USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 887 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 799 CYS SG : rot 154:sc= -0.429 USER MOD Set 1.2: B 803 ASN : amide:sc= -2.93! C(o=-3.4!,f=-4.2!) USER MOD Set 2.1: B 760 TYR OH : rot -154:sc= 0.226 USER MOD Set 2.2: B 798 ASN : amide:sc= -3.2! C(o=-3!,f=-4.6!) USER MOD Single : B 727 GLN : amide:sc= -0.639 X(o=-0.64,f=-0.31) USER MOD Single : B 729 TYR OH : rot 180:sc= 0 USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 73:sc= -0.921! USER MOD Single : B 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 737 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : B 738 GLN : amide:sc= -3.73! C(o=-3.7!,f=-3!) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot 180:sc= 0 USER MOD Single : B 742 HIS : no HE2:sc= -2.72! C(o=-2.7!,f=-5!) USER MOD Single : B 743 GLN : amide:sc= -0.101 X(o=-0.1,f=0) USER MOD Single : B 744 SER OG : rot 110:sc= -1.32! USER MOD Single : B 749 MET CE :methyl -129:sc= -3.37! (180deg=-3.92!) USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl 142:sc= -0.25 (180deg=-1.92) USER MOD Single : B 771 LYS NZ :NH3+ 157:sc= 0.237 (180deg=0.0253) USER MOD Single : B 772 THR OG1 : rot 123:sc= 0.74 USER MOD Single : B 773 MET CE :methyl 167:sc= -7.44! (180deg=-8.36!) USER MOD Single : B 774 SER OG : rot 109:sc= 0.99 USER MOD Single : B 778 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 779 ASN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot -145:sc= 1.23 USER MOD Single : B 784 SER OG : rot 160:sc= -1.69 USER MOD Single : B 785 LYS NZ :NH3+ -121:sc= -0.393 (180deg=-1.16) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl 154:sc= -13.6! (180deg=-17.2!) USER MOD Single : B 793 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : B 797 THR OG1 : rot -82:sc= -2.43! USER MOD Single : B 800 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 802 TYR OH : rot 180:sc= 0 USER MOD Single : B 807 SER OG : rot 180:sc= 0 USER MOD Single : B 809 TYR OH : rot 180:sc= 0 USER MOD Single : B 810 TYR OH : rot 180:sc= 0 USER MOD Single : B 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 812 CYS SG : rot 74:sc= 1.19 USER MOD Single : B 814 ASN : amide:sc= -1.09 K(o=-1.1,f=-0.25!) USER MOD Single : B 818 LYS NZ :NH3+ 141:sc= -0.0555 (180deg=-1.62!) USER MOD Single : B 822 SER OG : rot -78:sc= 0.267 USER MOD Single : B 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 303 N GLU B 721 -18.029 -1.311 -5.642 1.00 0.00 N ATOM 304 CA GLU B 721 -18.712 -0.010 -5.393 1.00 0.00 C ATOM 305 C GLU B 721 -18.564 0.395 -3.919 1.00 0.00 C ATOM 306 O GLU B 721 -19.007 -0.320 -3.042 1.00 0.00 O ATOM 307 CB GLU B 721 -20.183 -0.273 -5.723 1.00 0.00 C ATOM 308 CG GLU B 721 -20.668 0.756 -6.747 1.00 0.00 C ATOM 309 CD GLU B 721 -22.181 0.618 -6.940 1.00 0.00 C ATOM 310 OE1 GLU B 721 -22.808 -0.042 -6.126 1.00 0.00 O ATOM 311 OE2 GLU B 721 -22.689 1.178 -7.897 1.00 0.00 O ATOM 0 HA GLU B 721 -18.291 0.799 -5.990 1.00 0.00 H new ATOM 0 HB2 GLU B 721 -20.303 -1.281 -6.120 1.00 0.00 H new ATOM 0 HB3 GLU B 721 -20.786 -0.213 -4.817 1.00 0.00 H new ATOM 0 HG2 GLU B 721 -20.425 1.763 -6.408 1.00 0.00 H new ATOM 0 HG3 GLU B 721 -20.155 0.607 -7.697 1.00 0.00 H new ATOM 318 N PRO B 722 -17.943 1.529 -3.681 1.00 0.00 N ATOM 319 CA PRO B 722 -17.764 2.010 -2.296 1.00 0.00 C ATOM 320 C PRO B 722 -19.079 2.557 -1.740 1.00 0.00 C ATOM 321 O PRO B 722 -19.157 2.951 -0.593 1.00 0.00 O ATOM 322 CB PRO B 722 -16.735 3.142 -2.410 1.00 0.00 C ATOM 323 CG PRO B 722 -16.360 3.231 -3.861 1.00 0.00 C ATOM 324 CD PRO B 722 -17.382 2.464 -4.652 1.00 0.00 C ATOM 0 HA PRO B 722 -17.443 1.213 -1.625 1.00 0.00 H new ATOM 0 HB2 PRO B 722 -17.155 4.085 -2.059 1.00 0.00 H new ATOM 0 HB3 PRO B 722 -15.860 2.934 -1.795 1.00 0.00 H new ATOM 0 HG2 PRO B 722 -16.331 4.272 -4.184 1.00 0.00 H new ATOM 0 HG3 PRO B 722 -15.364 2.819 -4.023 1.00 0.00 H new ATOM 0 HD2 PRO B 722 -18.148 3.123 -5.062 1.00 0.00 H new ATOM 0 HD3 PRO B 722 -16.927 1.942 -5.494 1.00 0.00 H new ATOM 332 N ARG B 723 -20.115 2.598 -2.538 1.00 0.00 N ATOM 333 CA ARG B 723 -21.407 3.145 -2.042 1.00 0.00 C ATOM 334 C ARG B 723 -21.192 4.544 -1.473 1.00 0.00 C ATOM 335 O ARG B 723 -21.257 4.760 -0.281 1.00 0.00 O ATOM 336 CB ARG B 723 -21.851 2.180 -0.947 1.00 0.00 C ATOM 337 CG ARG B 723 -23.016 1.338 -1.465 1.00 0.00 C ATOM 338 CD ARG B 723 -22.513 -0.064 -1.817 1.00 0.00 C ATOM 339 NE ARG B 723 -23.184 -0.395 -3.109 1.00 0.00 N ATOM 340 CZ ARG B 723 -24.460 -0.699 -3.147 1.00 0.00 C ATOM 341 NH1 ARG B 723 -25.183 -0.722 -2.054 1.00 0.00 N ATOM 342 NH2 ARG B 723 -25.018 -0.984 -4.293 1.00 0.00 N ATOM 0 H ARG B 723 -20.120 2.277 -3.506 1.00 0.00 H new ATOM 0 HA ARG B 723 -22.155 3.231 -2.831 1.00 0.00 H new ATOM 0 HB2 ARG B 723 -21.022 1.536 -0.655 1.00 0.00 H new ATOM 0 HB3 ARG B 723 -22.153 2.733 -0.058 1.00 0.00 H new ATOM 0 HG2 ARG B 723 -23.799 1.276 -0.709 1.00 0.00 H new ATOM 0 HG3 ARG B 723 -23.457 1.809 -2.343 1.00 0.00 H new ATOM 0 HD2 ARG B 723 -21.428 -0.081 -1.919 1.00 0.00 H new ATOM 0 HD3 ARG B 723 -22.772 -0.784 -1.041 1.00 0.00 H new ATOM 0 HE ARG B 723 -22.643 -0.385 -3.974 1.00 0.00 H new ATOM 0 HH11 ARG B 723 -24.755 -0.501 -1.155 1.00 0.00 H new ATOM 0 HH12 ARG B 723 -26.174 -0.961 -2.103 1.00 0.00 H new ATOM 0 HH21 ARG B 723 -24.463 -0.969 -5.148 1.00 0.00 H new ATOM 0 HH22 ARG B 723 -26.009 -1.222 -4.333 1.00 0.00 H new ATOM 356 N ASP B 724 -20.944 5.498 -2.330 1.00 0.00 N ATOM 357 CA ASP B 724 -20.681 6.903 -1.875 1.00 0.00 C ATOM 358 C ASP B 724 -19.337 6.969 -1.137 1.00 0.00 C ATOM 359 O ASP B 724 -18.970 6.040 -0.446 1.00 0.00 O ATOM 360 CB ASP B 724 -21.835 7.278 -0.932 1.00 0.00 C ATOM 361 CG ASP B 724 -22.300 8.704 -1.233 1.00 0.00 C ATOM 362 OD1 ASP B 724 -22.682 8.956 -2.364 1.00 0.00 O ATOM 363 OD2 ASP B 724 -22.268 9.519 -0.326 1.00 0.00 O ATOM 0 H ASP B 724 -20.911 5.366 -3.341 1.00 0.00 H new ATOM 0 HA ASP B 724 -20.627 7.594 -2.716 1.00 0.00 H new ATOM 0 HB2 ASP B 724 -22.663 6.580 -1.058 1.00 0.00 H new ATOM 0 HB3 ASP B 724 -21.510 7.202 0.106 1.00 0.00 H new ATOM 368 N PRO B 725 -18.631 8.060 -1.326 1.00 0.00 N ATOM 369 CA PRO B 725 -17.306 8.218 -0.678 1.00 0.00 C ATOM 370 C PRO B 725 -17.447 8.256 0.844 1.00 0.00 C ATOM 371 O PRO B 725 -16.724 7.589 1.556 1.00 0.00 O ATOM 372 CB PRO B 725 -16.791 9.561 -1.203 1.00 0.00 C ATOM 373 CG PRO B 725 -17.994 10.274 -1.734 1.00 0.00 C ATOM 374 CD PRO B 725 -18.988 9.224 -2.148 1.00 0.00 C ATOM 0 HA PRO B 725 -16.632 7.392 -0.902 1.00 0.00 H new ATOM 0 HB2 PRO B 725 -16.314 10.135 -0.409 1.00 0.00 H new ATOM 0 HB3 PRO B 725 -16.045 9.416 -1.984 1.00 0.00 H new ATOM 0 HG2 PRO B 725 -18.420 10.928 -0.973 1.00 0.00 H new ATOM 0 HG3 PRO B 725 -17.725 10.904 -2.582 1.00 0.00 H new ATOM 0 HD2 PRO B 725 -20.012 9.547 -1.961 1.00 0.00 H new ATOM 0 HD3 PRO B 725 -18.914 9.000 -3.212 1.00 0.00 H new ATOM 382 N ASP B 726 -18.374 9.026 1.352 1.00 0.00 N ATOM 383 CA ASP B 726 -18.559 9.101 2.833 1.00 0.00 C ATOM 384 C ASP B 726 -18.616 7.697 3.437 1.00 0.00 C ATOM 385 O ASP B 726 -18.209 7.477 4.561 1.00 0.00 O ATOM 386 CB ASP B 726 -19.898 9.818 3.025 1.00 0.00 C ATOM 387 CG ASP B 726 -19.769 11.273 2.567 1.00 0.00 C ATOM 388 OD1 ASP B 726 -18.651 11.755 2.498 1.00 0.00 O ATOM 389 OD2 ASP B 726 -20.792 11.880 2.296 1.00 0.00 O ATOM 0 H ASP B 726 -19.011 9.606 0.806 1.00 0.00 H new ATOM 0 HA ASP B 726 -17.737 9.622 3.324 1.00 0.00 H new ATOM 0 HB2 ASP B 726 -20.678 9.314 2.454 1.00 0.00 H new ATOM 0 HB3 ASP B 726 -20.196 9.781 4.073 1.00 0.00 H new ATOM 394 N GLN B 727 -19.098 6.741 2.692 1.00 0.00 N ATOM 395 CA GLN B 727 -19.148 5.351 3.218 1.00 0.00 C ATOM 396 C GLN B 727 -17.737 4.764 3.258 1.00 0.00 C ATOM 397 O GLN B 727 -17.221 4.445 4.309 1.00 0.00 O ATOM 398 CB GLN B 727 -20.020 4.580 2.226 1.00 0.00 C ATOM 399 CG GLN B 727 -21.481 5.009 2.386 1.00 0.00 C ATOM 400 CD GLN B 727 -21.942 4.744 3.821 1.00 0.00 C ATOM 401 OE1 GLN B 727 -22.619 5.560 4.414 1.00 0.00 O ATOM 402 NE2 GLN B 727 -21.605 3.627 4.406 1.00 0.00 N ATOM 0 H GLN B 727 -19.458 6.863 1.745 1.00 0.00 H new ATOM 0 HA GLN B 727 -19.549 5.303 4.230 1.00 0.00 H new ATOM 0 HB2 GLN B 727 -19.684 4.770 1.207 1.00 0.00 H new ATOM 0 HB3 GLN B 727 -19.924 3.508 2.399 1.00 0.00 H new ATOM 0 HG2 GLN B 727 -21.587 6.068 2.149 1.00 0.00 H new ATOM 0 HG3 GLN B 727 -22.110 4.461 1.685 1.00 0.00 H new ATOM 0 HE21 GLN B 727 -21.037 2.942 3.908 1.00 0.00 H new ATOM 0 HE22 GLN B 727 -21.910 3.439 5.361 1.00 0.00 H new ATOM 411 N LEU B 728 -17.099 4.646 2.124 1.00 0.00 N ATOM 412 CA LEU B 728 -15.715 4.092 2.106 1.00 0.00 C ATOM 413 C LEU B 728 -14.744 5.034 2.822 1.00 0.00 C ATOM 414 O LEU B 728 -13.674 4.642 3.226 1.00 0.00 O ATOM 415 CB LEU B 728 -15.340 3.969 0.637 1.00 0.00 C ATOM 416 CG LEU B 728 -14.718 2.592 0.421 1.00 0.00 C ATOM 417 CD1 LEU B 728 -15.813 1.563 0.132 1.00 0.00 C ATOM 418 CD2 LEU B 728 -13.730 2.653 -0.728 1.00 0.00 C ATOM 0 H LEU B 728 -17.475 4.908 1.213 1.00 0.00 H new ATOM 0 HA LEU B 728 -15.665 3.132 2.621 1.00 0.00 H new ATOM 0 HB2 LEU B 728 -16.221 4.092 0.007 1.00 0.00 H new ATOM 0 HB3 LEU B 728 -14.636 4.753 0.357 1.00 0.00 H new ATOM 0 HG LEU B 728 -14.189 2.289 1.324 1.00 0.00 H new ATOM 0 HD11 LEU B 728 -15.360 0.583 -0.021 1.00 0.00 H new ATOM 0 HD12 LEU B 728 -16.501 1.517 0.976 1.00 0.00 H new ATOM 0 HD13 LEU B 728 -16.359 1.855 -0.765 1.00 0.00 H new ATOM 0 HD21 LEU B 728 -13.287 1.669 -0.880 1.00 0.00 H new ATOM 0 HD22 LEU B 728 -14.247 2.963 -1.636 1.00 0.00 H new ATOM 0 HD23 LEU B 728 -12.945 3.372 -0.495 1.00 0.00 H new ATOM 430 N TYR B 729 -15.111 6.275 2.982 1.00 0.00 N ATOM 431 CA TYR B 729 -14.197 7.258 3.637 1.00 0.00 C ATOM 432 C TYR B 729 -13.611 6.689 4.921 1.00 0.00 C ATOM 433 O TYR B 729 -12.442 6.354 4.981 1.00 0.00 O ATOM 434 CB TYR B 729 -15.087 8.460 3.942 1.00 0.00 C ATOM 435 CG TYR B 729 -14.236 9.622 4.396 1.00 0.00 C ATOM 436 CD1 TYR B 729 -13.384 10.264 3.490 1.00 0.00 C ATOM 437 CD2 TYR B 729 -14.298 10.055 5.726 1.00 0.00 C ATOM 438 CE1 TYR B 729 -12.595 11.340 3.914 1.00 0.00 C ATOM 439 CE2 TYR B 729 -13.509 11.130 6.150 1.00 0.00 C ATOM 440 CZ TYR B 729 -12.658 11.773 5.244 1.00 0.00 C ATOM 441 OH TYR B 729 -11.880 12.834 5.661 1.00 0.00 O ATOM 0 H TYR B 729 -16.010 6.655 2.686 1.00 0.00 H new ATOM 0 HA TYR B 729 -13.348 7.514 3.003 1.00 0.00 H new ATOM 0 HB2 TYR B 729 -15.655 8.738 3.055 1.00 0.00 H new ATOM 0 HB3 TYR B 729 -15.810 8.202 4.716 1.00 0.00 H new ATOM 0 HD1 TYR B 729 -13.335 9.930 2.464 1.00 0.00 H new ATOM 0 HD2 TYR B 729 -14.955 9.559 6.425 1.00 0.00 H new ATOM 0 HE1 TYR B 729 -11.938 11.836 3.215 1.00 0.00 H new ATOM 0 HE2 TYR B 729 -13.557 11.463 7.176 1.00 0.00 H new ATOM 0 HH TYR B 729 -12.045 13.007 6.612 1.00 0.00 H new ATOM 451 N SER B 730 -14.402 6.566 5.947 1.00 0.00 N ATOM 452 CA SER B 730 -13.868 5.979 7.195 1.00 0.00 C ATOM 453 C SER B 730 -13.610 4.489 6.990 1.00 0.00 C ATOM 454 O SER B 730 -12.967 3.850 7.801 1.00 0.00 O ATOM 455 CB SER B 730 -14.925 6.245 8.262 1.00 0.00 C ATOM 456 OG SER B 730 -15.122 5.087 9.063 1.00 0.00 O ATOM 0 H SER B 730 -15.383 6.844 5.973 1.00 0.00 H new ATOM 0 HA SER B 730 -12.915 6.415 7.495 1.00 0.00 H new ATOM 0 HB2 SER B 730 -14.615 7.081 8.889 1.00 0.00 H new ATOM 0 HB3 SER B 730 -15.864 6.532 7.789 1.00 0.00 H new ATOM 0 HG SER B 730 -15.801 5.272 9.744 1.00 0.00 H new ATOM 462 N THR B 731 -14.061 3.930 5.893 1.00 0.00 N ATOM 463 CA THR B 731 -13.722 2.507 5.632 1.00 0.00 C ATOM 464 C THR B 731 -12.228 2.437 5.343 1.00 0.00 C ATOM 465 O THR B 731 -11.510 1.639 5.910 1.00 0.00 O ATOM 466 CB THR B 731 -14.538 2.082 4.415 1.00 0.00 C ATOM 467 OG1 THR B 731 -15.896 2.447 4.606 1.00 0.00 O ATOM 468 CG2 THR B 731 -14.440 0.565 4.245 1.00 0.00 C ATOM 0 H THR B 731 -14.635 4.389 5.186 1.00 0.00 H new ATOM 0 HA THR B 731 -13.948 1.851 6.473 1.00 0.00 H new ATOM 0 HB THR B 731 -14.150 2.576 3.525 1.00 0.00 H new ATOM 0 HG1 THR B 731 -15.990 3.418 4.514 1.00 0.00 H new ATOM 0 HG21 THR B 731 -15.022 0.258 3.376 1.00 0.00 H new ATOM 0 HG22 THR B 731 -13.397 0.282 4.102 1.00 0.00 H new ATOM 0 HG23 THR B 731 -14.831 0.073 5.136 1.00 0.00 H new ATOM 476 N LEU B 732 -11.740 3.337 4.527 1.00 0.00 N ATOM 477 CA LEU B 732 -10.276 3.398 4.288 1.00 0.00 C ATOM 478 C LEU B 732 -9.590 3.724 5.612 1.00 0.00 C ATOM 479 O LEU B 732 -8.574 3.155 5.960 1.00 0.00 O ATOM 480 CB LEU B 732 -10.069 4.547 3.282 1.00 0.00 C ATOM 481 CG LEU B 732 -10.886 4.335 1.987 1.00 0.00 C ATOM 482 CD1 LEU B 732 -10.248 5.142 0.857 1.00 0.00 C ATOM 483 CD2 LEU B 732 -10.933 2.856 1.576 1.00 0.00 C ATOM 0 H LEU B 732 -12.294 4.027 4.020 1.00 0.00 H new ATOM 0 HA LEU B 732 -9.866 2.463 3.906 1.00 0.00 H new ATOM 0 HB2 LEU B 732 -10.360 5.490 3.744 1.00 0.00 H new ATOM 0 HB3 LEU B 732 -9.010 4.626 3.034 1.00 0.00 H new ATOM 0 HG LEU B 732 -11.907 4.667 2.176 1.00 0.00 H new ATOM 0 HD11 LEU B 732 -10.819 4.998 -0.060 1.00 0.00 H new ATOM 0 HD12 LEU B 732 -10.247 6.200 1.121 1.00 0.00 H new ATOM 0 HD13 LEU B 732 -9.223 4.805 0.703 1.00 0.00 H new ATOM 0 HD21 LEU B 732 -11.517 2.751 0.661 1.00 0.00 H new ATOM 0 HD22 LEU B 732 -9.919 2.494 1.403 1.00 0.00 H new ATOM 0 HD23 LEU B 732 -11.396 2.272 2.371 1.00 0.00 H new ATOM 495 N LYS B 733 -10.171 4.616 6.371 1.00 0.00 N ATOM 496 CA LYS B 733 -9.597 4.954 7.701 1.00 0.00 C ATOM 497 C LYS B 733 -9.486 3.685 8.545 1.00 0.00 C ATOM 498 O LYS B 733 -8.500 3.459 9.215 1.00 0.00 O ATOM 499 CB LYS B 733 -10.612 5.910 8.338 1.00 0.00 C ATOM 500 CG LYS B 733 -10.671 7.218 7.545 1.00 0.00 C ATOM 501 CD LYS B 733 -11.526 8.237 8.303 1.00 0.00 C ATOM 502 CE LYS B 733 -10.676 9.461 8.649 1.00 0.00 C ATOM 503 NZ LYS B 733 -11.388 10.109 9.786 1.00 0.00 N ATOM 0 H LYS B 733 -11.020 5.124 6.124 1.00 0.00 H new ATOM 0 HA LYS B 733 -8.604 5.396 7.626 1.00 0.00 H new ATOM 0 HB2 LYS B 733 -11.597 5.444 8.361 1.00 0.00 H new ATOM 0 HB3 LYS B 733 -10.332 6.114 9.371 1.00 0.00 H new ATOM 0 HG2 LYS B 733 -9.665 7.611 7.396 1.00 0.00 H new ATOM 0 HG3 LYS B 733 -11.093 7.037 6.556 1.00 0.00 H new ATOM 0 HD2 LYS B 733 -12.380 8.535 7.695 1.00 0.00 H new ATOM 0 HD3 LYS B 733 -11.924 7.788 9.213 1.00 0.00 H new ATOM 0 HE2 LYS B 733 -9.663 9.173 8.929 1.00 0.00 H new ATOM 0 HE3 LYS B 733 -10.591 10.137 7.798 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 -10.867 10.959 10.083 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 -12.347 10.378 9.487 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 -11.448 9.443 10.583 1.00 0.00 H new ATOM 517 N SER B 734 -10.500 2.859 8.511 1.00 0.00 N ATOM 518 CA SER B 734 -10.486 1.606 9.320 1.00 0.00 C ATOM 519 C SER B 734 -9.459 0.612 8.773 1.00 0.00 C ATOM 520 O SER B 734 -8.576 0.169 9.480 1.00 0.00 O ATOM 521 CB SER B 734 -11.900 1.037 9.183 1.00 0.00 C ATOM 522 OG SER B 734 -12.350 0.579 10.450 1.00 0.00 O ATOM 0 H SER B 734 -11.342 3.001 7.953 1.00 0.00 H new ATOM 0 HA SER B 734 -10.211 1.796 10.357 1.00 0.00 H new ATOM 0 HB2 SER B 734 -12.576 1.801 8.800 1.00 0.00 H new ATOM 0 HB3 SER B 734 -11.906 0.217 8.465 1.00 0.00 H new ATOM 0 HG SER B 734 -13.256 0.216 10.364 1.00 0.00 H new ATOM 528 N ILE B 735 -9.566 0.245 7.522 1.00 0.00 N ATOM 529 CA ILE B 735 -8.589 -0.729 6.950 1.00 0.00 C ATOM 530 C ILE B 735 -7.154 -0.280 7.250 1.00 0.00 C ATOM 531 O ILE B 735 -6.316 -1.061 7.654 1.00 0.00 O ATOM 532 CB ILE B 735 -8.849 -0.723 5.440 1.00 0.00 C ATOM 533 CG1 ILE B 735 -10.254 -1.262 5.160 1.00 0.00 C ATOM 534 CG2 ILE B 735 -7.821 -1.617 4.742 1.00 0.00 C ATOM 535 CD1 ILE B 735 -10.978 -0.327 4.190 1.00 0.00 C ATOM 0 H ILE B 735 -10.283 0.575 6.876 1.00 0.00 H new ATOM 0 HA ILE B 735 -8.707 -1.725 7.377 1.00 0.00 H new ATOM 0 HB ILE B 735 -8.766 0.297 5.064 1.00 0.00 H new ATOM 0 HG12 ILE B 735 -10.192 -2.265 4.737 1.00 0.00 H new ATOM 0 HG13 ILE B 735 -10.816 -1.343 6.091 1.00 0.00 H new ATOM 0 HG21 ILE B 735 -8.005 -1.613 3.668 1.00 0.00 H new ATOM 0 HG22 ILE B 735 -6.817 -1.240 4.939 1.00 0.00 H new ATOM 0 HG23 ILE B 735 -7.907 -2.635 5.121 1.00 0.00 H new ATOM 0 HD11 ILE B 735 -11.978 -0.712 3.992 1.00 0.00 H new ATOM 0 HD12 ILE B 735 -11.053 0.667 4.630 1.00 0.00 H new ATOM 0 HD13 ILE B 735 -10.420 -0.269 3.256 1.00 0.00 H new ATOM 547 N LEU B 736 -6.870 0.977 7.070 1.00 0.00 N ATOM 548 CA LEU B 736 -5.500 1.473 7.369 1.00 0.00 C ATOM 549 C LEU B 736 -5.317 1.571 8.878 1.00 0.00 C ATOM 550 O LEU B 736 -4.254 1.312 9.406 1.00 0.00 O ATOM 551 CB LEU B 736 -5.436 2.860 6.731 1.00 0.00 C ATOM 552 CG LEU B 736 -4.038 3.094 6.155 1.00 0.00 C ATOM 553 CD1 LEU B 736 -3.903 2.349 4.825 1.00 0.00 C ATOM 554 CD2 LEU B 736 -3.826 4.591 5.925 1.00 0.00 C ATOM 0 H LEU B 736 -7.525 1.681 6.730 1.00 0.00 H new ATOM 0 HA LEU B 736 -4.719 0.816 6.986 1.00 0.00 H new ATOM 0 HB2 LEU B 736 -6.184 2.944 5.943 1.00 0.00 H new ATOM 0 HB3 LEU B 736 -5.668 3.624 7.473 1.00 0.00 H new ATOM 0 HG LEU B 736 -3.289 2.724 6.856 1.00 0.00 H new ATOM 0 HD11 LEU B 736 -2.907 2.515 4.414 1.00 0.00 H new ATOM 0 HD12 LEU B 736 -4.054 1.282 4.989 1.00 0.00 H new ATOM 0 HD13 LEU B 736 -4.651 2.718 4.124 1.00 0.00 H new ATOM 0 HD21 LEU B 736 -2.830 4.759 5.515 1.00 0.00 H new ATOM 0 HD22 LEU B 736 -4.574 4.961 5.224 1.00 0.00 H new ATOM 0 HD23 LEU B 736 -3.922 5.122 6.872 1.00 0.00 H new ATOM 566 N GLN B 737 -6.360 1.913 9.583 1.00 0.00 N ATOM 567 CA GLN B 737 -6.262 1.990 11.065 1.00 0.00 C ATOM 568 C GLN B 737 -5.688 0.685 11.616 1.00 0.00 C ATOM 569 O GLN B 737 -4.893 0.682 12.534 1.00 0.00 O ATOM 570 CB GLN B 737 -7.704 2.163 11.540 1.00 0.00 C ATOM 571 CG GLN B 737 -7.926 3.601 12.011 1.00 0.00 C ATOM 572 CD GLN B 737 -9.325 3.725 12.619 1.00 0.00 C ATOM 573 OE1 GLN B 737 -9.687 2.967 13.497 1.00 0.00 O ATOM 574 NE2 GLN B 737 -10.135 4.651 12.184 1.00 0.00 N ATOM 0 H GLN B 737 -7.275 2.142 9.196 1.00 0.00 H new ATOM 0 HA GLN B 737 -5.613 2.800 11.398 1.00 0.00 H new ATOM 0 HB2 GLN B 737 -8.394 1.925 10.730 1.00 0.00 H new ATOM 0 HB3 GLN B 737 -7.915 1.468 12.353 1.00 0.00 H new ATOM 0 HG2 GLN B 737 -7.171 3.875 12.748 1.00 0.00 H new ATOM 0 HG3 GLN B 737 -7.819 4.291 11.174 1.00 0.00 H new ATOM 0 HE21 GLN B 737 -9.833 5.288 11.447 1.00 0.00 H new ATOM 0 HE22 GLN B 737 -11.071 4.738 12.581 1.00 0.00 H new ATOM 583 N GLN B 738 -6.108 -0.428 11.075 1.00 0.00 N ATOM 584 CA GLN B 738 -5.594 -1.732 11.576 1.00 0.00 C ATOM 585 C GLN B 738 -4.224 -2.058 10.966 1.00 0.00 C ATOM 586 O GLN B 738 -3.392 -2.662 11.615 1.00 0.00 O ATOM 587 CB GLN B 738 -6.646 -2.774 11.176 1.00 0.00 C ATOM 588 CG GLN B 738 -6.891 -2.720 9.672 1.00 0.00 C ATOM 589 CD GLN B 738 -7.510 -4.034 9.208 1.00 0.00 C ATOM 590 OE1 GLN B 738 -7.993 -4.810 10.008 1.00 0.00 O ATOM 591 NE2 GLN B 738 -7.514 -4.319 7.937 1.00 0.00 N ATOM 0 H GLN B 738 -6.782 -0.489 10.311 1.00 0.00 H new ATOM 0 HA GLN B 738 -5.444 -1.715 12.655 1.00 0.00 H new ATOM 0 HB2 GLN B 738 -6.309 -3.770 11.462 1.00 0.00 H new ATOM 0 HB3 GLN B 738 -7.577 -2.586 11.711 1.00 0.00 H new ATOM 0 HG2 GLN B 738 -7.554 -1.889 9.431 1.00 0.00 H new ATOM 0 HG3 GLN B 738 -5.953 -2.543 9.146 1.00 0.00 H new ATOM 0 HE21 GLN B 738 -7.108 -3.666 7.267 1.00 0.00 H new ATOM 0 HE22 GLN B 738 -7.923 -5.195 7.612 1.00 0.00 H new ATOM 600 N VAL B 739 -3.956 -1.657 9.741 1.00 0.00 N ATOM 601 CA VAL B 739 -2.612 -1.974 9.165 1.00 0.00 C ATOM 602 C VAL B 739 -1.564 -0.984 9.688 1.00 0.00 C ATOM 603 O VAL B 739 -0.387 -1.279 9.740 1.00 0.00 O ATOM 604 CB VAL B 739 -2.731 -1.896 7.628 1.00 0.00 C ATOM 605 CG1 VAL B 739 -3.990 -2.621 7.149 1.00 0.00 C ATOM 606 CG2 VAL B 739 -2.748 -0.454 7.135 1.00 0.00 C ATOM 0 H VAL B 739 -4.591 -1.139 9.133 1.00 0.00 H new ATOM 0 HA VAL B 739 -2.291 -2.972 9.462 1.00 0.00 H new ATOM 0 HB VAL B 739 -1.851 -2.386 7.211 1.00 0.00 H new ATOM 0 HG11 VAL B 739 -4.057 -2.555 6.063 1.00 0.00 H new ATOM 0 HG12 VAL B 739 -3.942 -3.668 7.447 1.00 0.00 H new ATOM 0 HG13 VAL B 739 -4.869 -2.157 7.595 1.00 0.00 H new ATOM 0 HG21 VAL B 739 -2.833 -0.442 6.048 1.00 0.00 H new ATOM 0 HG22 VAL B 739 -3.599 0.070 7.571 1.00 0.00 H new ATOM 0 HG23 VAL B 739 -1.825 0.043 7.432 1.00 0.00 H new ATOM 616 N LYS B 740 -1.983 0.190 10.066 1.00 0.00 N ATOM 617 CA LYS B 740 -1.014 1.197 10.579 1.00 0.00 C ATOM 618 C LYS B 740 -0.190 0.610 11.727 1.00 0.00 C ATOM 619 O LYS B 740 1.017 0.721 11.755 1.00 0.00 O ATOM 620 CB LYS B 740 -1.883 2.348 11.084 1.00 0.00 C ATOM 621 CG LYS B 740 -0.988 3.470 11.614 1.00 0.00 C ATOM 622 CD LYS B 740 -0.864 3.350 13.135 1.00 0.00 C ATOM 623 CE LYS B 740 -2.200 3.714 13.786 1.00 0.00 C ATOM 624 NZ LYS B 740 -1.833 4.522 14.984 1.00 0.00 N ATOM 0 H LYS B 740 -2.956 0.496 10.042 1.00 0.00 H new ATOM 0 HA LYS B 740 -0.306 1.516 9.814 1.00 0.00 H new ATOM 0 HB2 LYS B 740 -2.514 2.722 10.278 1.00 0.00 H new ATOM 0 HB3 LYS B 740 -2.548 1.996 11.872 1.00 0.00 H new ATOM 0 HG2 LYS B 740 -0.002 3.412 11.153 1.00 0.00 H new ATOM 0 HG3 LYS B 740 -1.408 4.440 11.348 1.00 0.00 H new ATOM 0 HD2 LYS B 740 -0.579 2.334 13.408 1.00 0.00 H new ATOM 0 HD3 LYS B 740 -0.078 4.011 13.500 1.00 0.00 H new ATOM 0 HE2 LYS B 740 -2.831 4.283 13.103 1.00 0.00 H new ATOM 0 HE3 LYS B 740 -2.759 2.822 14.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 -2.697 4.811 15.486 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 -1.238 3.952 15.618 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 -1.308 5.368 14.684 1.00 0.00 H new ATOM 638 N SER B 741 -0.833 -0.009 12.678 1.00 0.00 N ATOM 639 CA SER B 741 -0.082 -0.599 13.823 1.00 0.00 C ATOM 640 C SER B 741 0.167 -2.089 13.583 1.00 0.00 C ATOM 641 O SER B 741 0.287 -2.866 14.509 1.00 0.00 O ATOM 642 CB SER B 741 -0.997 -0.400 15.033 1.00 0.00 C ATOM 643 OG SER B 741 -0.211 -0.304 16.211 1.00 0.00 O ATOM 0 H SER B 741 -1.845 -0.132 12.712 1.00 0.00 H new ATOM 0 HA SER B 741 0.894 -0.133 13.962 1.00 0.00 H new ATOM 0 HB2 SER B 741 -1.593 0.504 14.906 1.00 0.00 H new ATOM 0 HB3 SER B 741 -1.695 -1.233 15.116 1.00 0.00 H new ATOM 0 HG SER B 741 -0.797 -0.175 16.986 1.00 0.00 H new ATOM 649 N HIS B 742 0.238 -2.495 12.345 1.00 0.00 N ATOM 650 CA HIS B 742 0.469 -3.935 12.041 1.00 0.00 C ATOM 651 C HIS B 742 1.951 -4.286 12.171 1.00 0.00 C ATOM 652 O HIS B 742 2.813 -3.437 12.066 1.00 0.00 O ATOM 653 CB HIS B 742 0.010 -4.103 10.592 1.00 0.00 C ATOM 654 CG HIS B 742 -0.608 -5.463 10.417 1.00 0.00 C ATOM 655 ND1 HIS B 742 -1.480 -6.004 11.350 1.00 0.00 N ATOM 656 CD2 HIS B 742 -0.492 -6.404 9.424 1.00 0.00 C ATOM 657 CE1 HIS B 742 -1.851 -7.217 10.903 1.00 0.00 C ATOM 658 NE2 HIS B 742 -1.277 -7.510 9.732 1.00 0.00 N ATOM 0 H HIS B 742 0.146 -1.890 11.529 1.00 0.00 H new ATOM 0 HA HIS B 742 -0.068 -4.589 12.728 1.00 0.00 H new ATOM 0 HB2 HIS B 742 -0.712 -3.328 10.336 1.00 0.00 H new ATOM 0 HB3 HIS B 742 0.856 -3.986 9.915 1.00 0.00 H new ATOM 0 HD1 HIS B 742 -1.785 -5.562 12.217 1.00 0.00 H new ATOM 0 HD2 HIS B 742 0.117 -6.301 8.538 1.00 0.00 H new ATOM 0 HE1 HIS B 742 -2.530 -7.874 11.426 1.00 0.00 H new ATOM 666 N GLN B 743 2.254 -5.540 12.373 1.00 0.00 N ATOM 667 CA GLN B 743 3.681 -5.957 12.490 1.00 0.00 C ATOM 668 C GLN B 743 4.326 -6.097 11.104 1.00 0.00 C ATOM 669 O GLN B 743 5.452 -6.537 10.980 1.00 0.00 O ATOM 670 CB GLN B 743 3.631 -7.315 13.191 1.00 0.00 C ATOM 671 CG GLN B 743 5.038 -7.708 13.647 1.00 0.00 C ATOM 672 CD GLN B 743 4.943 -8.615 14.876 1.00 0.00 C ATOM 673 OE1 GLN B 743 5.704 -8.471 15.812 1.00 0.00 O ATOM 674 NE2 GLN B 743 4.034 -9.551 14.912 1.00 0.00 N ATOM 0 H GLN B 743 1.574 -6.295 12.462 1.00 0.00 H new ATOM 0 HA GLN B 743 4.276 -5.226 13.037 1.00 0.00 H new ATOM 0 HB2 GLN B 743 2.959 -7.269 14.048 1.00 0.00 H new ATOM 0 HB3 GLN B 743 3.232 -8.071 12.514 1.00 0.00 H new ATOM 0 HG2 GLN B 743 5.562 -8.223 12.842 1.00 0.00 H new ATOM 0 HG3 GLN B 743 5.617 -6.816 13.885 1.00 0.00 H new ATOM 0 HE21 GLN B 743 3.395 -9.672 14.126 1.00 0.00 H new ATOM 0 HE22 GLN B 743 3.963 -10.162 15.726 1.00 0.00 H new ATOM 683 N SER B 744 3.628 -5.733 10.059 1.00 0.00 N ATOM 684 CA SER B 744 4.212 -5.851 8.693 1.00 0.00 C ATOM 685 C SER B 744 4.027 -4.548 7.905 1.00 0.00 C ATOM 686 O SER B 744 4.411 -4.449 6.757 1.00 0.00 O ATOM 687 CB SER B 744 3.429 -6.985 8.032 1.00 0.00 C ATOM 688 OG SER B 744 3.826 -8.226 8.597 1.00 0.00 O ATOM 0 H SER B 744 2.679 -5.360 10.094 1.00 0.00 H new ATOM 0 HA SER B 744 5.284 -6.046 8.724 1.00 0.00 H new ATOM 0 HB2 SER B 744 2.359 -6.834 8.175 1.00 0.00 H new ATOM 0 HB3 SER B 744 3.610 -6.988 6.957 1.00 0.00 H new ATOM 0 HG SER B 744 3.096 -8.586 9.142 1.00 0.00 H new ATOM 694 N ALA B 745 3.409 -3.559 8.491 1.00 0.00 N ATOM 695 CA ALA B 745 3.228 -2.269 7.774 1.00 0.00 C ATOM 696 C ALA B 745 4.502 -1.426 7.858 1.00 0.00 C ATOM 697 O ALA B 745 4.667 -0.471 7.127 1.00 0.00 O ATOM 698 CB ALA B 745 2.082 -1.585 8.503 1.00 0.00 C ATOM 0 H ALA B 745 3.023 -3.590 9.434 1.00 0.00 H new ATOM 0 HA ALA B 745 3.018 -2.408 6.713 1.00 0.00 H new ATOM 0 HB1 ALA B 745 1.879 -0.620 8.038 1.00 0.00 H new ATOM 0 HB2 ALA B 745 1.190 -2.210 8.447 1.00 0.00 H new ATOM 0 HB3 ALA B 745 2.354 -1.434 9.548 1.00 0.00 H new ATOM 704 N TRP B 746 5.402 -1.770 8.750 1.00 0.00 N ATOM 705 CA TRP B 746 6.699 -1.032 8.848 1.00 0.00 C ATOM 706 C TRP B 746 7.280 -0.759 7.447 1.00 0.00 C ATOM 707 O TRP B 746 7.620 0.366 7.140 1.00 0.00 O ATOM 708 CB TRP B 746 7.640 -1.954 9.634 1.00 0.00 C ATOM 709 CG TRP B 746 7.033 -2.360 10.947 1.00 0.00 C ATOM 710 CD1 TRP B 746 7.545 -3.320 11.752 1.00 0.00 C ATOM 711 CD2 TRP B 746 5.843 -1.848 11.631 1.00 0.00 C ATOM 712 NE1 TRP B 746 6.753 -3.436 12.877 1.00 0.00 N ATOM 713 CE2 TRP B 746 5.693 -2.554 12.851 1.00 0.00 C ATOM 714 CE3 TRP B 746 4.887 -0.860 11.323 1.00 0.00 C ATOM 715 CZ2 TRP B 746 4.641 -2.289 13.728 1.00 0.00 C ATOM 716 CZ3 TRP B 746 3.828 -0.593 12.205 1.00 0.00 C ATOM 717 CH2 TRP B 746 3.706 -1.305 13.405 1.00 0.00 C ATOM 0 H TRP B 746 5.291 -2.534 9.417 1.00 0.00 H new ATOM 0 HA TRP B 746 6.569 -0.066 9.335 1.00 0.00 H new ATOM 0 HB2 TRP B 746 7.860 -2.842 9.042 1.00 0.00 H new ATOM 0 HB3 TRP B 746 8.588 -1.445 9.811 1.00 0.00 H new ATOM 0 HD1 TRP B 746 8.431 -3.902 11.547 1.00 0.00 H new ATOM 0 HE1 TRP B 746 6.930 -4.094 13.636 1.00 0.00 H new ATOM 0 HE3 TRP B 746 4.970 -0.304 10.401 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 4.551 -2.842 14.651 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 3.102 0.167 11.956 1.00 0.00 H new ATOM 0 HH2 TRP B 746 2.889 -1.093 14.079 1.00 0.00 H new ATOM 728 N PRO B 747 7.320 -1.780 6.611 1.00 0.00 N ATOM 729 CA PRO B 747 7.838 -1.605 5.228 1.00 0.00 C ATOM 730 C PRO B 747 7.059 -0.525 4.480 1.00 0.00 C ATOM 731 O PRO B 747 7.480 -0.062 3.439 1.00 0.00 O ATOM 732 CB PRO B 747 7.573 -2.961 4.559 1.00 0.00 C ATOM 733 CG PRO B 747 6.629 -3.671 5.475 1.00 0.00 C ATOM 734 CD PRO B 747 6.938 -3.180 6.851 1.00 0.00 C ATOM 0 HA PRO B 747 8.886 -1.306 5.224 1.00 0.00 H new ATOM 0 HB2 PRO B 747 7.138 -2.833 3.568 1.00 0.00 H new ATOM 0 HB3 PRO B 747 8.497 -3.525 4.432 1.00 0.00 H new ATOM 0 HG2 PRO B 747 5.594 -3.458 5.209 1.00 0.00 H new ATOM 0 HG3 PRO B 747 6.760 -4.751 5.408 1.00 0.00 H new ATOM 0 HD2 PRO B 747 6.075 -3.258 7.513 1.00 0.00 H new ATOM 0 HD3 PRO B 747 7.746 -3.748 7.313 1.00 0.00 H new ATOM 742 N PHE B 748 5.887 -0.186 4.943 1.00 0.00 N ATOM 743 CA PHE B 748 5.072 0.824 4.214 1.00 0.00 C ATOM 744 C PHE B 748 4.897 2.077 5.063 1.00 0.00 C ATOM 745 O PHE B 748 4.218 3.008 4.691 1.00 0.00 O ATOM 746 CB PHE B 748 3.709 0.152 3.986 1.00 0.00 C ATOM 747 CG PHE B 748 3.873 -1.273 3.482 1.00 0.00 C ATOM 748 CD1 PHE B 748 4.987 -1.645 2.714 1.00 0.00 C ATOM 749 CD2 PHE B 748 2.891 -2.218 3.782 1.00 0.00 C ATOM 750 CE1 PHE B 748 5.113 -2.961 2.252 1.00 0.00 C ATOM 751 CE2 PHE B 748 3.018 -3.536 3.326 1.00 0.00 C ATOM 752 CZ PHE B 748 4.131 -3.909 2.563 1.00 0.00 C ATOM 0 H PHE B 748 5.461 -0.563 5.790 1.00 0.00 H new ATOM 0 HA PHE B 748 5.544 1.129 3.280 1.00 0.00 H new ATOM 0 HB2 PHE B 748 3.143 0.148 4.917 1.00 0.00 H new ATOM 0 HB3 PHE B 748 3.132 0.731 3.265 1.00 0.00 H new ATOM 0 HD1 PHE B 748 5.748 -0.916 2.479 1.00 0.00 H new ATOM 0 HD2 PHE B 748 2.030 -1.932 4.368 1.00 0.00 H new ATOM 0 HE1 PHE B 748 5.968 -3.245 1.656 1.00 0.00 H new ATOM 0 HE2 PHE B 748 2.257 -4.265 3.563 1.00 0.00 H new ATOM 0 HZ PHE B 748 4.232 -4.926 2.215 1.00 0.00 H new ATOM 762 N MET B 749 5.510 2.107 6.199 1.00 0.00 N ATOM 763 CA MET B 749 5.336 3.246 7.113 1.00 0.00 C ATOM 764 C MET B 749 6.454 4.273 6.944 1.00 0.00 C ATOM 765 O MET B 749 6.663 5.120 7.786 1.00 0.00 O ATOM 766 CB MET B 749 5.445 2.543 8.442 1.00 0.00 C ATOM 767 CG MET B 749 4.852 3.368 9.550 1.00 0.00 C ATOM 768 SD MET B 749 3.095 3.681 9.235 1.00 0.00 S ATOM 769 CE MET B 749 2.469 2.066 9.763 1.00 0.00 C ATOM 0 H MET B 749 6.136 1.376 6.537 1.00 0.00 H new ATOM 0 HA MET B 749 4.417 3.812 6.964 1.00 0.00 H new ATOM 0 HB2 MET B 749 4.935 1.581 8.389 1.00 0.00 H new ATOM 0 HB3 MET B 749 6.493 2.336 8.661 1.00 0.00 H new ATOM 0 HG2 MET B 749 4.971 2.849 10.501 1.00 0.00 H new ATOM 0 HG3 MET B 749 5.387 4.314 9.634 1.00 0.00 H new ATOM 0 HE1 MET B 749 1.825 1.654 8.986 1.00 0.00 H new ATOM 0 HE2 MET B 749 3.306 1.390 9.936 1.00 0.00 H new ATOM 0 HE3 MET B 749 1.899 2.181 10.685 1.00 0.00 H new ATOM 779 N GLU B 750 7.140 4.224 5.836 1.00 0.00 N ATOM 780 CA GLU B 750 8.244 5.192 5.576 1.00 0.00 C ATOM 781 C GLU B 750 8.548 5.261 4.075 1.00 0.00 C ATOM 782 O GLU B 750 8.388 4.284 3.372 1.00 0.00 O ATOM 783 CB GLU B 750 9.450 4.617 6.323 1.00 0.00 C ATOM 784 CG GLU B 750 9.549 5.270 7.698 1.00 0.00 C ATOM 785 CD GLU B 750 10.787 6.167 7.752 1.00 0.00 C ATOM 786 OE1 GLU B 750 11.793 5.791 7.172 1.00 0.00 O ATOM 787 OE2 GLU B 750 10.709 7.214 8.374 1.00 0.00 O ATOM 0 H GLU B 750 6.981 3.546 5.090 1.00 0.00 H new ATOM 0 HA GLU B 750 7.991 6.201 5.902 1.00 0.00 H new ATOM 0 HB2 GLU B 750 9.347 3.537 6.427 1.00 0.00 H new ATOM 0 HB3 GLU B 750 10.363 4.797 5.756 1.00 0.00 H new ATOM 0 HG2 GLU B 750 8.653 5.857 7.898 1.00 0.00 H new ATOM 0 HG3 GLU B 750 9.608 4.505 8.472 1.00 0.00 H new ATOM 794 N PRO B 751 8.990 6.412 3.626 1.00 0.00 N ATOM 795 CA PRO B 751 9.346 6.573 2.195 1.00 0.00 C ATOM 796 C PRO B 751 10.362 5.503 1.781 1.00 0.00 C ATOM 797 O PRO B 751 10.864 4.764 2.605 1.00 0.00 O ATOM 798 CB PRO B 751 9.987 7.966 2.127 1.00 0.00 C ATOM 799 CG PRO B 751 10.247 8.363 3.543 1.00 0.00 C ATOM 800 CD PRO B 751 9.238 7.642 4.387 1.00 0.00 C ATOM 0 HA PRO B 751 8.488 6.470 1.531 1.00 0.00 H new ATOM 0 HB2 PRO B 751 10.912 7.943 1.551 1.00 0.00 H new ATOM 0 HB3 PRO B 751 9.324 8.678 1.637 1.00 0.00 H new ATOM 0 HG2 PRO B 751 11.261 8.095 3.840 1.00 0.00 H new ATOM 0 HG3 PRO B 751 10.153 9.442 3.665 1.00 0.00 H new ATOM 0 HD2 PRO B 751 9.624 7.429 5.384 1.00 0.00 H new ATOM 0 HD3 PRO B 751 8.328 8.227 4.516 1.00 0.00 H new ATOM 808 N VAL B 752 10.686 5.422 0.517 1.00 0.00 N ATOM 809 CA VAL B 752 11.697 4.415 0.077 1.00 0.00 C ATOM 810 C VAL B 752 13.029 5.104 -0.207 1.00 0.00 C ATOM 811 O VAL B 752 13.851 4.603 -0.949 1.00 0.00 O ATOM 812 CB VAL B 752 11.137 3.792 -1.214 1.00 0.00 C ATOM 813 CG1 VAL B 752 9.706 3.315 -0.978 1.00 0.00 C ATOM 814 CG2 VAL B 752 11.147 4.824 -2.350 1.00 0.00 C ATOM 0 H VAL B 752 10.298 6.005 -0.225 1.00 0.00 H new ATOM 0 HA VAL B 752 11.873 3.659 0.842 1.00 0.00 H new ATOM 0 HB VAL B 752 11.764 2.946 -1.494 1.00 0.00 H new ATOM 0 HG11 VAL B 752 9.313 2.875 -1.895 1.00 0.00 H new ATOM 0 HG12 VAL B 752 9.698 2.568 -0.184 1.00 0.00 H new ATOM 0 HG13 VAL B 752 9.084 4.161 -0.687 1.00 0.00 H new ATOM 0 HG21 VAL B 752 10.748 4.370 -3.257 1.00 0.00 H new ATOM 0 HG22 VAL B 752 10.531 5.679 -2.071 1.00 0.00 H new ATOM 0 HG23 VAL B 752 12.169 5.157 -2.530 1.00 0.00 H new ATOM 899 N ALA B 757 17.349 5.796 -3.130 1.00 0.00 N ATOM 900 CA ALA B 757 16.890 4.471 -3.649 1.00 0.00 C ATOM 901 C ALA B 757 16.852 4.474 -5.184 1.00 0.00 C ATOM 902 O ALA B 757 15.924 4.990 -5.775 1.00 0.00 O ATOM 903 CB ALA B 757 15.475 4.303 -3.082 1.00 0.00 C ATOM 0 HA ALA B 757 17.557 3.661 -3.355 1.00 0.00 H new ATOM 0 HB1 ALA B 757 15.060 3.352 -3.415 1.00 0.00 H new ATOM 0 HB2 ALA B 757 15.515 4.320 -1.993 1.00 0.00 H new ATOM 0 HB3 ALA B 757 14.843 5.118 -3.435 1.00 0.00 H new ATOM 909 N PRO B 758 17.867 3.896 -5.783 1.00 0.00 N ATOM 910 CA PRO B 758 17.966 3.865 -7.254 1.00 0.00 C ATOM 911 C PRO B 758 17.317 2.600 -7.817 1.00 0.00 C ATOM 912 O PRO B 758 17.287 1.568 -7.176 1.00 0.00 O ATOM 913 CB PRO B 758 19.477 3.839 -7.504 1.00 0.00 C ATOM 914 CG PRO B 758 20.123 3.466 -6.194 1.00 0.00 C ATOM 915 CD PRO B 758 19.035 3.272 -5.167 1.00 0.00 C ATOM 0 HA PRO B 758 17.461 4.705 -7.730 1.00 0.00 H new ATOM 0 HB2 PRO B 758 19.729 3.116 -8.280 1.00 0.00 H new ATOM 0 HB3 PRO B 758 19.830 4.812 -7.847 1.00 0.00 H new ATOM 0 HG2 PRO B 758 20.707 2.553 -6.305 1.00 0.00 H new ATOM 0 HG3 PRO B 758 20.812 4.248 -5.874 1.00 0.00 H new ATOM 0 HD2 PRO B 758 18.863 2.216 -4.960 1.00 0.00 H new ATOM 0 HD3 PRO B 758 19.289 3.746 -4.219 1.00 0.00 H new ATOM 923 N GLY B 759 16.815 2.664 -9.020 1.00 0.00 N ATOM 924 CA GLY B 759 16.195 1.456 -9.633 1.00 0.00 C ATOM 925 C GLY B 759 14.676 1.501 -9.455 1.00 0.00 C ATOM 926 O GLY B 759 13.933 1.013 -10.284 1.00 0.00 O ATOM 0 H GLY B 759 16.808 3.500 -9.604 1.00 0.00 H new ATOM 0 HA2 GLY B 759 16.444 1.407 -10.693 1.00 0.00 H new ATOM 0 HA3 GLY B 759 16.597 0.555 -9.169 1.00 0.00 H new ATOM 930 N TYR B 760 14.204 2.067 -8.379 1.00 0.00 N ATOM 931 CA TYR B 760 12.733 2.121 -8.159 1.00 0.00 C ATOM 932 C TYR B 760 12.047 2.842 -9.319 1.00 0.00 C ATOM 933 O TYR B 760 11.890 4.047 -9.311 1.00 0.00 O ATOM 934 CB TYR B 760 12.556 2.908 -6.860 1.00 0.00 C ATOM 935 CG TYR B 760 12.031 1.984 -5.788 1.00 0.00 C ATOM 936 CD1 TYR B 760 12.904 1.108 -5.133 1.00 0.00 C ATOM 937 CD2 TYR B 760 10.671 1.995 -5.459 1.00 0.00 C ATOM 938 CE1 TYR B 760 12.417 0.247 -4.143 1.00 0.00 C ATOM 939 CE2 TYR B 760 10.184 1.134 -4.469 1.00 0.00 C ATOM 940 CZ TYR B 760 11.057 0.260 -3.811 1.00 0.00 C ATOM 941 OH TYR B 760 10.578 -0.590 -2.836 1.00 0.00 O ATOM 0 H TYR B 760 14.771 2.493 -7.646 1.00 0.00 H new ATOM 0 HA TYR B 760 12.290 1.127 -8.099 1.00 0.00 H new ATOM 0 HB2 TYR B 760 13.507 3.341 -6.550 1.00 0.00 H new ATOM 0 HB3 TYR B 760 11.864 3.736 -7.014 1.00 0.00 H new ATOM 0 HD1 TYR B 760 13.953 1.096 -5.391 1.00 0.00 H new ATOM 0 HD2 TYR B 760 9.997 2.668 -5.969 1.00 0.00 H new ATOM 0 HE1 TYR B 760 13.090 -0.428 -3.635 1.00 0.00 H new ATOM 0 HE2 TYR B 760 9.135 1.144 -4.213 1.00 0.00 H new ATOM 0 HH TYR B 760 9.628 -0.770 -2.997 1.00 0.00 H new ATOM 951 N TYR B 761 11.647 2.111 -10.323 1.00 0.00 N ATOM 952 CA TYR B 761 10.966 2.738 -11.492 1.00 0.00 C ATOM 953 C TYR B 761 10.572 1.660 -12.504 1.00 0.00 C ATOM 954 O TYR B 761 9.491 1.681 -13.059 1.00 0.00 O ATOM 955 CB TYR B 761 12.001 3.690 -12.099 1.00 0.00 C ATOM 956 CG TYR B 761 11.432 5.088 -12.143 1.00 0.00 C ATOM 957 CD1 TYR B 761 10.404 5.397 -13.042 1.00 0.00 C ATOM 958 CD2 TYR B 761 11.930 6.075 -11.284 1.00 0.00 C ATOM 959 CE1 TYR B 761 9.876 6.693 -13.084 1.00 0.00 C ATOM 960 CE2 TYR B 761 11.401 7.371 -11.325 1.00 0.00 C ATOM 961 CZ TYR B 761 10.374 7.680 -12.225 1.00 0.00 C ATOM 962 OH TYR B 761 9.853 8.957 -12.267 1.00 0.00 O ATOM 0 H TYR B 761 11.763 1.100 -10.384 1.00 0.00 H new ATOM 0 HA TYR B 761 10.054 3.263 -11.207 1.00 0.00 H new ATOM 0 HB2 TYR B 761 12.916 3.676 -11.506 1.00 0.00 H new ATOM 0 HB3 TYR B 761 12.268 3.362 -13.104 1.00 0.00 H new ATOM 0 HD1 TYR B 761 10.018 4.635 -13.703 1.00 0.00 H new ATOM 0 HD2 TYR B 761 12.722 5.837 -10.590 1.00 0.00 H new ATOM 0 HE1 TYR B 761 9.085 6.931 -13.779 1.00 0.00 H new ATOM 0 HE2 TYR B 761 11.785 8.132 -10.662 1.00 0.00 H new ATOM 0 HH TYR B 761 10.309 9.518 -11.606 1.00 0.00 H new ATOM 972 N GLU B 762 11.436 0.710 -12.739 1.00 0.00 N ATOM 973 CA GLU B 762 11.105 -0.378 -13.702 1.00 0.00 C ATOM 974 C GLU B 762 10.294 -1.469 -12.999 1.00 0.00 C ATOM 975 O GLU B 762 9.346 -1.999 -13.542 1.00 0.00 O ATOM 976 CB GLU B 762 12.459 -0.926 -14.157 1.00 0.00 C ATOM 977 CG GLU B 762 12.374 -1.330 -15.631 1.00 0.00 C ATOM 978 CD GLU B 762 13.169 -0.335 -16.478 1.00 0.00 C ATOM 979 OE1 GLU B 762 13.092 0.849 -16.194 1.00 0.00 O ATOM 980 OE2 GLU B 762 13.839 -0.773 -17.399 1.00 0.00 O ATOM 0 H GLU B 762 12.357 0.641 -12.306 1.00 0.00 H new ATOM 0 HA GLU B 762 10.506 -0.024 -14.541 1.00 0.00 H new ATOM 0 HB2 GLU B 762 13.234 -0.172 -14.019 1.00 0.00 H new ATOM 0 HB3 GLU B 762 12.739 -1.786 -13.548 1.00 0.00 H new ATOM 0 HG2 GLU B 762 12.769 -2.337 -15.767 1.00 0.00 H new ATOM 0 HG3 GLU B 762 11.333 -1.350 -15.955 1.00 0.00 H new ATOM 987 N VAL B 763 10.659 -1.802 -11.791 1.00 0.00 N ATOM 988 CA VAL B 763 9.892 -2.839 -11.035 1.00 0.00 C ATOM 989 C VAL B 763 8.789 -2.153 -10.242 1.00 0.00 C ATOM 990 O VAL B 763 7.750 -2.720 -9.965 1.00 0.00 O ATOM 991 CB VAL B 763 10.874 -3.501 -10.043 1.00 0.00 C ATOM 992 CG1 VAL B 763 10.436 -4.947 -9.797 1.00 0.00 C ATOM 993 CG2 VAL B 763 12.313 -3.500 -10.582 1.00 0.00 C ATOM 0 H VAL B 763 11.454 -1.402 -11.293 1.00 0.00 H new ATOM 0 HA VAL B 763 9.456 -3.575 -11.711 1.00 0.00 H new ATOM 0 HB VAL B 763 10.858 -2.927 -9.116 1.00 0.00 H new ATOM 0 HG11 VAL B 763 11.124 -5.422 -9.098 1.00 0.00 H new ATOM 0 HG12 VAL B 763 9.430 -4.956 -9.378 1.00 0.00 H new ATOM 0 HG13 VAL B 763 10.442 -5.494 -10.740 1.00 0.00 H new ATOM 0 HG21 VAL B 763 12.974 -3.974 -9.856 1.00 0.00 H new ATOM 0 HG22 VAL B 763 12.350 -4.052 -11.521 1.00 0.00 H new ATOM 0 HG23 VAL B 763 12.637 -2.473 -10.752 1.00 0.00 H new ATOM 1003 N ILE B 764 9.034 -0.938 -9.847 1.00 0.00 N ATOM 1004 CA ILE B 764 8.048 -0.202 -9.016 1.00 0.00 C ATOM 1005 C ILE B 764 7.463 0.971 -9.805 1.00 0.00 C ATOM 1006 O ILE B 764 7.929 2.089 -9.716 1.00 0.00 O ATOM 1007 CB ILE B 764 8.869 0.302 -7.815 1.00 0.00 C ATOM 1008 CG1 ILE B 764 9.700 -0.842 -7.202 1.00 0.00 C ATOM 1009 CG2 ILE B 764 7.936 0.873 -6.750 1.00 0.00 C ATOM 1010 CD1 ILE B 764 8.813 -2.060 -6.911 1.00 0.00 C ATOM 0 H ILE B 764 9.884 -0.419 -10.067 1.00 0.00 H new ATOM 0 HA ILE B 764 7.205 -0.821 -8.710 1.00 0.00 H new ATOM 0 HB ILE B 764 9.546 1.080 -8.168 1.00 0.00 H new ATOM 0 HG12 ILE B 764 10.501 -1.124 -7.886 1.00 0.00 H new ATOM 0 HG13 ILE B 764 10.173 -0.502 -6.281 1.00 0.00 H new ATOM 0 HG21 ILE B 764 8.524 1.228 -5.903 1.00 0.00 H new ATOM 0 HG22 ILE B 764 7.368 1.703 -7.171 1.00 0.00 H new ATOM 0 HG23 ILE B 764 7.248 0.097 -6.414 1.00 0.00 H new ATOM 0 HD11 ILE B 764 9.419 -2.856 -6.479 1.00 0.00 H new ATOM 0 HD12 ILE B 764 8.028 -1.779 -6.209 1.00 0.00 H new ATOM 0 HD13 ILE B 764 8.361 -2.411 -7.839 1.00 0.00 H new ATOM 1022 N ARG B 765 6.443 0.720 -10.582 1.00 0.00 N ATOM 1023 CA ARG B 765 5.817 1.813 -11.380 1.00 0.00 C ATOM 1024 C ARG B 765 5.493 3.011 -10.484 1.00 0.00 C ATOM 1025 O ARG B 765 6.083 4.065 -10.605 1.00 0.00 O ATOM 1026 CB ARG B 765 4.532 1.196 -11.935 1.00 0.00 C ATOM 1027 CG ARG B 765 3.865 2.175 -12.900 1.00 0.00 C ATOM 1028 CD ARG B 765 2.526 2.632 -12.318 1.00 0.00 C ATOM 1029 NE ARG B 765 2.383 4.052 -12.755 1.00 0.00 N ATOM 1030 CZ ARG B 765 1.280 4.723 -12.514 1.00 0.00 C ATOM 1031 NH1 ARG B 765 0.274 4.167 -11.884 1.00 0.00 N ATOM 1032 NH2 ARG B 765 1.185 5.964 -12.908 1.00 0.00 N ATOM 0 H ARG B 765 6.015 -0.199 -10.698 1.00 0.00 H new ATOM 0 HA ARG B 765 6.474 2.181 -12.168 1.00 0.00 H new ATOM 0 HB2 ARG B 765 4.758 0.262 -12.449 1.00 0.00 H new ATOM 0 HB3 ARG B 765 3.851 0.954 -11.119 1.00 0.00 H new ATOM 0 HG2 ARG B 765 4.513 3.035 -13.068 1.00 0.00 H new ATOM 0 HG3 ARG B 765 3.709 1.699 -13.868 1.00 0.00 H new ATOM 0 HD2 ARG B 765 1.704 2.020 -12.689 1.00 0.00 H new ATOM 0 HD3 ARG B 765 2.519 2.550 -11.231 1.00 0.00 H new ATOM 0 HE ARG B 765 3.152 4.507 -13.247 1.00 0.00 H new ATOM 0 HH11 ARG B 765 0.340 3.198 -11.572 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -0.575 4.703 -11.705 1.00 0.00 H new ATOM 0 HH21 ARG B 765 1.963 6.404 -13.398 1.00 0.00 H new ATOM 0 HH22 ARG B 765 0.332 6.493 -12.725 1.00 0.00 H new ATOM 1046 N PHE B 766 4.563 2.855 -9.581 1.00 0.00 N ATOM 1047 CA PHE B 766 4.213 3.983 -8.673 1.00 0.00 C ATOM 1048 C PHE B 766 4.293 3.533 -7.211 1.00 0.00 C ATOM 1049 O PHE B 766 3.285 3.242 -6.598 1.00 0.00 O ATOM 1050 CB PHE B 766 2.779 4.359 -9.039 1.00 0.00 C ATOM 1051 CG PHE B 766 2.549 5.819 -8.731 1.00 0.00 C ATOM 1052 CD1 PHE B 766 2.480 6.252 -7.402 1.00 0.00 C ATOM 1053 CD2 PHE B 766 2.409 6.741 -9.776 1.00 0.00 C ATOM 1054 CE1 PHE B 766 2.269 7.606 -7.116 1.00 0.00 C ATOM 1055 CE2 PHE B 766 2.197 8.095 -9.490 1.00 0.00 C ATOM 1056 CZ PHE B 766 2.127 8.528 -8.161 1.00 0.00 C ATOM 0 H PHE B 766 4.032 1.997 -9.433 1.00 0.00 H new ATOM 0 HA PHE B 766 4.896 4.826 -8.783 1.00 0.00 H new ATOM 0 HB2 PHE B 766 2.600 4.167 -10.097 1.00 0.00 H new ATOM 0 HB3 PHE B 766 2.076 3.743 -8.479 1.00 0.00 H new ATOM 0 HD1 PHE B 766 2.590 5.541 -6.596 1.00 0.00 H new ATOM 0 HD2 PHE B 766 2.465 6.408 -10.802 1.00 0.00 H new ATOM 0 HE1 PHE B 766 2.216 7.940 -6.090 1.00 0.00 H new ATOM 0 HE2 PHE B 766 2.087 8.806 -10.296 1.00 0.00 H new ATOM 0 HZ PHE B 766 1.964 9.573 -7.941 1.00 0.00 H new ATOM 1066 N PRO B 767 5.500 3.480 -6.698 1.00 0.00 N ATOM 1067 CA PRO B 767 5.715 3.077 -5.286 1.00 0.00 C ATOM 1068 C PRO B 767 4.753 3.817 -4.356 1.00 0.00 C ATOM 1069 O PRO B 767 4.116 4.778 -4.741 1.00 0.00 O ATOM 1070 CB PRO B 767 7.164 3.489 -4.997 1.00 0.00 C ATOM 1071 CG PRO B 767 7.628 4.243 -6.209 1.00 0.00 C ATOM 1072 CD PRO B 767 6.760 3.824 -7.356 1.00 0.00 C ATOM 0 HA PRO B 767 5.538 2.014 -5.125 1.00 0.00 H new ATOM 0 HB2 PRO B 767 7.222 4.111 -4.104 1.00 0.00 H new ATOM 0 HB3 PRO B 767 7.790 2.615 -4.818 1.00 0.00 H new ATOM 0 HG2 PRO B 767 7.554 5.318 -6.044 1.00 0.00 H new ATOM 0 HG3 PRO B 767 8.675 4.024 -6.420 1.00 0.00 H new ATOM 0 HD2 PRO B 767 6.632 4.628 -8.081 1.00 0.00 H new ATOM 0 HD3 PRO B 767 7.181 2.974 -7.893 1.00 0.00 H new ATOM 1080 N MET B 768 4.635 3.369 -3.137 1.00 0.00 N ATOM 1081 CA MET B 768 3.716 4.033 -2.178 1.00 0.00 C ATOM 1082 C MET B 768 3.864 3.372 -0.810 1.00 0.00 C ATOM 1083 O MET B 768 4.486 2.336 -0.679 1.00 0.00 O ATOM 1084 CB MET B 768 2.310 3.799 -2.747 1.00 0.00 C ATOM 1085 CG MET B 768 1.277 4.596 -1.943 1.00 0.00 C ATOM 1086 SD MET B 768 1.671 6.362 -2.017 1.00 0.00 S ATOM 1087 CE MET B 768 1.408 6.581 -3.794 1.00 0.00 C ATOM 0 H MET B 768 5.141 2.565 -2.764 1.00 0.00 H new ATOM 0 HA MET B 768 3.922 5.096 -2.054 1.00 0.00 H new ATOM 0 HB2 MET B 768 2.278 4.100 -3.794 1.00 0.00 H new ATOM 0 HB3 MET B 768 2.068 2.737 -2.713 1.00 0.00 H new ATOM 0 HG2 MET B 768 0.278 4.420 -2.342 1.00 0.00 H new ATOM 0 HG3 MET B 768 1.270 4.259 -0.907 1.00 0.00 H new ATOM 0 HE1 MET B 768 0.940 7.549 -3.976 1.00 0.00 H new ATOM 0 HE2 MET B 768 2.366 6.538 -4.312 1.00 0.00 H new ATOM 0 HE3 MET B 768 0.759 5.788 -4.166 1.00 0.00 H new ATOM 1097 N ASP B 769 3.313 3.958 0.209 1.00 0.00 N ATOM 1098 CA ASP B 769 3.462 3.368 1.564 1.00 0.00 C ATOM 1099 C ASP B 769 2.537 4.091 2.549 1.00 0.00 C ATOM 1100 O ASP B 769 2.258 5.261 2.391 1.00 0.00 O ATOM 1101 CB ASP B 769 4.946 3.582 1.898 1.00 0.00 C ATOM 1102 CG ASP B 769 5.224 5.061 2.188 1.00 0.00 C ATOM 1103 OD1 ASP B 769 4.672 5.569 3.148 1.00 0.00 O ATOM 1104 OD2 ASP B 769 5.984 5.658 1.443 1.00 0.00 O ATOM 0 H ASP B 769 2.767 4.818 0.164 1.00 0.00 H new ATOM 0 HA ASP B 769 3.188 2.314 1.618 1.00 0.00 H new ATOM 0 HB2 ASP B 769 5.221 2.978 2.763 1.00 0.00 H new ATOM 0 HB3 ASP B 769 5.564 3.246 1.065 1.00 0.00 H new ATOM 1109 N LEU B 770 2.045 3.398 3.549 1.00 0.00 N ATOM 1110 CA LEU B 770 1.140 4.044 4.557 1.00 0.00 C ATOM 1111 C LEU B 770 1.677 5.421 4.957 1.00 0.00 C ATOM 1112 O LEU B 770 0.971 6.410 4.925 1.00 0.00 O ATOM 1113 CB LEU B 770 1.157 3.103 5.768 1.00 0.00 C ATOM 1114 CG LEU B 770 0.593 1.728 5.387 1.00 0.00 C ATOM 1115 CD1 LEU B 770 0.446 0.883 6.653 1.00 0.00 C ATOM 1116 CD2 LEU B 770 -0.777 1.887 4.720 1.00 0.00 C ATOM 0 H LEU B 770 2.231 2.409 3.712 1.00 0.00 H new ATOM 0 HA LEU B 770 0.135 4.195 4.162 1.00 0.00 H new ATOM 0 HB2 LEU B 770 2.177 2.995 6.138 1.00 0.00 H new ATOM 0 HB3 LEU B 770 0.568 3.533 6.578 1.00 0.00 H new ATOM 0 HG LEU B 770 1.272 1.240 4.688 1.00 0.00 H new ATOM 0 HD11 LEU B 770 0.046 -0.097 6.392 1.00 0.00 H new ATOM 0 HD12 LEU B 770 1.421 0.762 7.125 1.00 0.00 H new ATOM 0 HD13 LEU B 770 -0.233 1.380 7.345 1.00 0.00 H new ATOM 0 HD21 LEU B 770 -1.168 0.905 4.454 1.00 0.00 H new ATOM 0 HD22 LEU B 770 -1.464 2.376 5.411 1.00 0.00 H new ATOM 0 HD23 LEU B 770 -0.675 2.493 3.820 1.00 0.00 H new ATOM 1128 N LYS B 771 2.944 5.494 5.267 1.00 0.00 N ATOM 1129 CA LYS B 771 3.570 6.806 5.618 1.00 0.00 C ATOM 1130 C LYS B 771 3.174 7.873 4.580 1.00 0.00 C ATOM 1131 O LYS B 771 3.009 9.034 4.899 1.00 0.00 O ATOM 1132 CB LYS B 771 5.090 6.488 5.619 1.00 0.00 C ATOM 1133 CG LYS B 771 5.910 7.425 4.715 1.00 0.00 C ATOM 1134 CD LYS B 771 6.011 8.807 5.358 1.00 0.00 C ATOM 1135 CE LYS B 771 5.560 9.869 4.351 1.00 0.00 C ATOM 1136 NZ LYS B 771 5.036 10.988 5.183 1.00 0.00 N ATOM 0 H LYS B 771 3.578 4.696 5.293 1.00 0.00 H new ATOM 0 HA LYS B 771 3.250 7.217 6.576 1.00 0.00 H new ATOM 0 HB2 LYS B 771 5.468 6.557 6.639 1.00 0.00 H new ATOM 0 HB3 LYS B 771 5.239 5.459 5.293 1.00 0.00 H new ATOM 0 HG2 LYS B 771 6.907 7.013 4.558 1.00 0.00 H new ATOM 0 HG3 LYS B 771 5.439 7.503 3.735 1.00 0.00 H new ATOM 0 HD2 LYS B 771 5.390 8.851 6.252 1.00 0.00 H new ATOM 0 HD3 LYS B 771 7.037 9.000 5.673 1.00 0.00 H new ATOM 0 HE2 LYS B 771 6.390 10.197 3.725 1.00 0.00 H new ATOM 0 HE3 LYS B 771 4.791 9.479 3.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 5.073 11.873 4.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 4.052 10.788 5.453 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 5.617 11.085 6.040 1.00 0.00 H new ATOM 1150 N THR B 772 3.019 7.478 3.347 1.00 0.00 N ATOM 1151 CA THR B 772 2.660 8.458 2.285 1.00 0.00 C ATOM 1152 C THR B 772 1.184 8.323 1.894 1.00 0.00 C ATOM 1153 O THR B 772 0.541 9.285 1.525 1.00 0.00 O ATOM 1154 CB THR B 772 3.563 8.085 1.107 1.00 0.00 C ATOM 1155 OG1 THR B 772 4.921 8.272 1.476 1.00 0.00 O ATOM 1156 CG2 THR B 772 3.235 8.971 -0.093 1.00 0.00 C ATOM 0 H THR B 772 3.126 6.515 3.028 1.00 0.00 H new ATOM 0 HA THR B 772 2.797 9.489 2.610 1.00 0.00 H new ATOM 0 HB THR B 772 3.397 7.041 0.841 1.00 0.00 H new ATOM 0 HG1 THR B 772 5.411 7.432 1.355 1.00 0.00 H new ATOM 0 HG21 THR B 772 3.880 8.703 -0.930 1.00 0.00 H new ATOM 0 HG22 THR B 772 2.193 8.827 -0.377 1.00 0.00 H new ATOM 0 HG23 THR B 772 3.398 10.016 0.171 1.00 0.00 H new ATOM 1164 N MET B 773 0.643 7.137 1.969 1.00 0.00 N ATOM 1165 CA MET B 773 -0.787 6.944 1.593 1.00 0.00 C ATOM 1166 C MET B 773 -1.708 7.543 2.657 1.00 0.00 C ATOM 1167 O MET B 773 -2.830 7.918 2.380 1.00 0.00 O ATOM 1168 CB MET B 773 -0.973 5.426 1.521 1.00 0.00 C ATOM 1169 CG MET B 773 -2.077 5.095 0.513 1.00 0.00 C ATOM 1170 SD MET B 773 -3.694 5.301 1.300 1.00 0.00 S ATOM 1171 CE MET B 773 -3.961 3.562 1.727 1.00 0.00 C ATOM 0 H MET B 773 1.129 6.294 2.274 1.00 0.00 H new ATOM 0 HA MET B 773 -1.033 7.436 0.652 1.00 0.00 H new ATOM 0 HB2 MET B 773 -0.039 4.948 1.224 1.00 0.00 H new ATOM 0 HB3 MET B 773 -1.234 5.034 2.504 1.00 0.00 H new ATOM 0 HG2 MET B 773 -1.998 5.748 -0.356 1.00 0.00 H new ATOM 0 HG3 MET B 773 -1.963 4.072 0.155 1.00 0.00 H new ATOM 0 HE1 MET B 773 -4.794 3.483 2.426 1.00 0.00 H new ATOM 0 HE2 MET B 773 -4.190 2.997 0.824 1.00 0.00 H new ATOM 0 HE3 MET B 773 -3.060 3.158 2.189 1.00 0.00 H new ATOM 1181 N SER B 774 -1.246 7.634 3.874 1.00 0.00 N ATOM 1182 CA SER B 774 -2.100 8.211 4.951 1.00 0.00 C ATOM 1183 C SER B 774 -2.361 9.694 4.680 1.00 0.00 C ATOM 1184 O SER B 774 -3.392 10.228 5.039 1.00 0.00 O ATOM 1185 CB SER B 774 -1.287 8.043 6.235 1.00 0.00 C ATOM 1186 OG SER B 774 -0.955 6.674 6.411 1.00 0.00 O ATOM 0 H SER B 774 -0.317 7.335 4.169 1.00 0.00 H new ATOM 0 HA SER B 774 -3.071 7.720 5.013 1.00 0.00 H new ATOM 0 HB2 SER B 774 -0.379 8.644 6.184 1.00 0.00 H new ATOM 0 HB3 SER B 774 -1.860 8.402 7.090 1.00 0.00 H new ATOM 0 HG SER B 774 0.003 6.546 6.247 1.00 0.00 H new ATOM 1192 N GLU B 775 -1.434 10.364 4.052 1.00 0.00 N ATOM 1193 CA GLU B 775 -1.633 11.811 3.758 1.00 0.00 C ATOM 1194 C GLU B 775 -2.866 12.005 2.874 1.00 0.00 C ATOM 1195 O GLU B 775 -3.555 13.002 2.963 1.00 0.00 O ATOM 1196 CB GLU B 775 -0.367 12.238 3.013 1.00 0.00 C ATOM 1197 CG GLU B 775 0.842 12.082 3.936 1.00 0.00 C ATOM 1198 CD GLU B 775 2.107 12.538 3.205 1.00 0.00 C ATOM 1199 OE1 GLU B 775 2.396 11.980 2.159 1.00 0.00 O ATOM 1200 OE2 GLU B 775 2.765 13.436 3.704 1.00 0.00 O ATOM 0 H GLU B 775 -0.549 9.973 3.730 1.00 0.00 H new ATOM 0 HA GLU B 775 -1.794 12.399 4.661 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.236 11.630 2.118 1.00 0.00 H new ATOM 0 HB3 GLU B 775 -0.457 13.274 2.685 1.00 0.00 H new ATOM 0 HG2 GLU B 775 0.700 12.672 4.841 1.00 0.00 H new ATOM 0 HG3 GLU B 775 0.944 11.042 4.246 1.00 0.00 H new ATOM 1207 N ARG B 776 -3.156 11.054 2.028 1.00 0.00 N ATOM 1208 CA ARG B 776 -4.347 11.182 1.144 1.00 0.00 C ATOM 1209 C ARG B 776 -5.632 11.104 1.968 1.00 0.00 C ATOM 1210 O ARG B 776 -6.480 11.969 1.889 1.00 0.00 O ATOM 1211 CB ARG B 776 -4.254 9.995 0.189 1.00 0.00 C ATOM 1212 CG ARG B 776 -2.929 10.062 -0.573 1.00 0.00 C ATOM 1213 CD ARG B 776 -3.194 10.478 -2.023 1.00 0.00 C ATOM 1214 NE ARG B 776 -2.890 11.939 -2.066 1.00 0.00 N ATOM 1215 CZ ARG B 776 -2.709 12.556 -3.211 1.00 0.00 C ATOM 1216 NH1 ARG B 776 -2.790 11.909 -4.348 1.00 0.00 N ATOM 1217 NH2 ARG B 776 -2.444 13.835 -3.218 1.00 0.00 N ATOM 0 H ARG B 776 -2.619 10.195 1.912 1.00 0.00 H new ATOM 0 HA ARG B 776 -4.368 12.135 0.616 1.00 0.00 H new ATOM 0 HB2 ARG B 776 -4.320 9.060 0.745 1.00 0.00 H new ATOM 0 HB3 ARG B 776 -5.090 10.010 -0.510 1.00 0.00 H new ATOM 0 HG2 ARG B 776 -2.258 10.776 -0.095 1.00 0.00 H new ATOM 0 HG3 ARG B 776 -2.433 9.092 -0.547 1.00 0.00 H new ATOM 0 HD2 ARG B 776 -2.561 9.922 -2.715 1.00 0.00 H new ATOM 0 HD3 ARG B 776 -4.228 10.281 -2.308 1.00 0.00 H new ATOM 0 HE ARG B 776 -2.822 12.465 -1.195 1.00 0.00 H new ATOM 0 HH11 ARG B 776 -2.997 10.910 -4.353 1.00 0.00 H new ATOM 0 HH12 ARG B 776 -2.647 12.404 -5.228 1.00 0.00 H new ATOM 0 HH21 ARG B 776 -2.379 14.347 -2.338 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -2.302 14.322 -4.103 1.00 0.00 H new ATOM 1231 N LEU B 777 -5.784 10.083 2.774 1.00 0.00 N ATOM 1232 CA LEU B 777 -7.015 9.983 3.613 1.00 0.00 C ATOM 1233 C LEU B 777 -7.202 11.278 4.400 1.00 0.00 C ATOM 1234 O LEU B 777 -8.296 11.790 4.525 1.00 0.00 O ATOM 1235 CB LEU B 777 -6.773 8.805 4.562 1.00 0.00 C ATOM 1236 CG LEU B 777 -8.055 7.970 4.679 1.00 0.00 C ATOM 1237 CD1 LEU B 777 -9.209 8.860 5.157 1.00 0.00 C ATOM 1238 CD2 LEU B 777 -8.406 7.373 3.316 1.00 0.00 C ATOM 0 H LEU B 777 -5.115 9.321 2.886 1.00 0.00 H new ATOM 0 HA LEU B 777 -7.913 9.830 3.015 1.00 0.00 H new ATOM 0 HB2 LEU B 777 -5.956 8.186 4.190 1.00 0.00 H new ATOM 0 HB3 LEU B 777 -6.474 9.171 5.544 1.00 0.00 H new ATOM 0 HG LEU B 777 -7.895 7.166 5.398 1.00 0.00 H new ATOM 0 HD11 LEU B 777 -10.118 8.264 5.239 1.00 0.00 H new ATOM 0 HD12 LEU B 777 -8.963 9.283 6.131 1.00 0.00 H new ATOM 0 HD13 LEU B 777 -9.367 9.666 4.441 1.00 0.00 H new ATOM 0 HD21 LEU B 777 -9.317 6.780 3.402 1.00 0.00 H new ATOM 0 HD22 LEU B 777 -8.562 8.176 2.596 1.00 0.00 H new ATOM 0 HD23 LEU B 777 -7.589 6.736 2.977 1.00 0.00 H new ATOM 1250 N LYS B 778 -6.131 11.833 4.898 1.00 0.00 N ATOM 1251 CA LYS B 778 -6.238 13.129 5.615 1.00 0.00 C ATOM 1252 C LYS B 778 -6.803 14.177 4.657 1.00 0.00 C ATOM 1253 O LYS B 778 -7.460 15.116 5.059 1.00 0.00 O ATOM 1254 CB LYS B 778 -4.802 13.473 6.015 1.00 0.00 C ATOM 1255 CG LYS B 778 -4.756 14.883 6.607 1.00 0.00 C ATOM 1256 CD LYS B 778 -3.580 14.989 7.577 1.00 0.00 C ATOM 1257 CE LYS B 778 -2.599 16.050 7.076 1.00 0.00 C ATOM 1258 NZ LYS B 778 -1.645 16.250 8.202 1.00 0.00 N ATOM 0 H LYS B 778 -5.190 11.444 4.838 1.00 0.00 H new ATOM 0 HA LYS B 778 -6.895 13.090 6.484 1.00 0.00 H new ATOM 0 HB2 LYS B 778 -4.434 12.750 6.743 1.00 0.00 H new ATOM 0 HB3 LYS B 778 -4.147 13.411 5.146 1.00 0.00 H new ATOM 0 HG2 LYS B 778 -4.652 15.620 5.811 1.00 0.00 H new ATOM 0 HG3 LYS B 778 -5.690 15.102 7.125 1.00 0.00 H new ATOM 0 HD2 LYS B 778 -3.938 15.251 8.572 1.00 0.00 H new ATOM 0 HD3 LYS B 778 -3.078 14.026 7.663 1.00 0.00 H new ATOM 0 HE2 LYS B 778 -2.083 15.718 6.175 1.00 0.00 H new ATOM 0 HE3 LYS B 778 -3.114 16.977 6.825 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 -0.939 16.965 7.936 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 -2.164 16.572 9.044 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 -1.165 15.352 8.414 1.00 0.00 H new ATOM 1272 N ASN B 779 -6.564 14.005 3.384 1.00 0.00 N ATOM 1273 CA ASN B 779 -7.114 14.959 2.384 1.00 0.00 C ATOM 1274 C ASN B 779 -8.344 14.355 1.694 1.00 0.00 C ATOM 1275 O ASN B 779 -8.822 14.869 0.703 1.00 0.00 O ATOM 1276 CB ASN B 779 -5.982 15.162 1.374 1.00 0.00 C ATOM 1277 CG ASN B 779 -5.929 16.633 0.955 1.00 0.00 C ATOM 1278 OD1 ASN B 779 -6.440 16.999 -0.084 1.00 0.00 O ATOM 1279 ND2 ASN B 779 -5.327 17.496 1.726 1.00 0.00 N ATOM 0 H ASN B 779 -6.010 13.242 2.995 1.00 0.00 H new ATOM 0 HA ASN B 779 -7.434 15.897 2.838 1.00 0.00 H new ATOM 0 HB2 ASN B 779 -5.030 14.864 1.814 1.00 0.00 H new ATOM 0 HB3 ASN B 779 -6.142 14.530 0.501 1.00 0.00 H new ATOM 0 HD21 ASN B 779 -5.285 18.479 1.456 1.00 0.00 H new ATOM 0 HD22 ASN B 779 -4.898 17.188 2.599 1.00 0.00 H new ATOM 1286 N ARG B 780 -8.853 13.260 2.204 1.00 0.00 N ATOM 1287 CA ARG B 780 -10.051 12.627 1.582 1.00 0.00 C ATOM 1288 C ARG B 780 -9.810 12.367 0.089 1.00 0.00 C ATOM 1289 O ARG B 780 -10.734 12.202 -0.681 1.00 0.00 O ATOM 1290 CB ARG B 780 -11.177 13.645 1.786 1.00 0.00 C ATOM 1291 CG ARG B 780 -12.454 13.150 1.101 1.00 0.00 C ATOM 1292 CD ARG B 780 -12.713 13.986 -0.155 1.00 0.00 C ATOM 1293 NE ARG B 780 -14.072 14.573 0.047 1.00 0.00 N ATOM 1294 CZ ARG B 780 -15.155 13.858 -0.160 1.00 0.00 C ATOM 1295 NH1 ARG B 780 -15.078 12.608 -0.547 1.00 0.00 N ATOM 1296 NH2 ARG B 780 -16.327 14.402 0.024 1.00 0.00 N ATOM 0 H ARG B 780 -8.488 12.779 3.026 1.00 0.00 H new ATOM 0 HA ARG B 780 -10.288 11.660 2.026 1.00 0.00 H new ATOM 0 HB2 ARG B 780 -11.358 13.792 2.851 1.00 0.00 H new ATOM 0 HB3 ARG B 780 -10.885 14.612 1.376 1.00 0.00 H new ATOM 0 HG2 ARG B 780 -12.354 12.097 0.836 1.00 0.00 H new ATOM 0 HG3 ARG B 780 -13.300 13.228 1.784 1.00 0.00 H new ATOM 0 HD2 ARG B 780 -11.960 14.765 -0.273 1.00 0.00 H new ATOM 0 HD3 ARG B 780 -12.678 13.370 -1.054 1.00 0.00 H new ATOM 0 HE ARG B 780 -14.160 15.543 0.350 1.00 0.00 H new ATOM 0 HH11 ARG B 780 -14.166 12.174 -0.692 1.00 0.00 H new ATOM 0 HH12 ARG B 780 -15.930 12.069 -0.703 1.00 0.00 H new ATOM 0 HH21 ARG B 780 -16.396 15.374 0.326 1.00 0.00 H new ATOM 0 HH22 ARG B 780 -17.173 13.855 -0.134 1.00 0.00 H new ATOM 1310 N TYR B 781 -8.573 12.304 -0.324 1.00 0.00 N ATOM 1311 CA TYR B 781 -8.289 12.036 -1.762 1.00 0.00 C ATOM 1312 C TYR B 781 -8.815 10.657 -2.156 1.00 0.00 C ATOM 1313 O TYR B 781 -9.659 10.526 -3.020 1.00 0.00 O ATOM 1314 CB TYR B 781 -6.765 12.070 -1.882 1.00 0.00 C ATOM 1315 CG TYR B 781 -6.358 13.209 -2.784 1.00 0.00 C ATOM 1316 CD1 TYR B 781 -6.580 14.532 -2.385 1.00 0.00 C ATOM 1317 CD2 TYR B 781 -5.762 12.941 -4.022 1.00 0.00 C ATOM 1318 CE1 TYR B 781 -6.203 15.588 -3.224 1.00 0.00 C ATOM 1319 CE2 TYR B 781 -5.385 13.997 -4.860 1.00 0.00 C ATOM 1320 CZ TYR B 781 -5.605 15.320 -4.461 1.00 0.00 C ATOM 1321 OH TYR B 781 -5.233 16.361 -5.287 1.00 0.00 O ATOM 0 H TYR B 781 -7.752 12.426 0.268 1.00 0.00 H new ATOM 0 HA TYR B 781 -8.769 12.764 -2.416 1.00 0.00 H new ATOM 0 HB2 TYR B 781 -6.314 12.193 -0.897 1.00 0.00 H new ATOM 0 HB3 TYR B 781 -6.400 11.125 -2.284 1.00 0.00 H new ATOM 0 HD1 TYR B 781 -7.042 14.738 -1.431 1.00 0.00 H new ATOM 0 HD2 TYR B 781 -5.593 11.920 -4.330 1.00 0.00 H new ATOM 0 HE1 TYR B 781 -6.374 16.609 -2.917 1.00 0.00 H new ATOM 0 HE2 TYR B 781 -4.924 13.791 -5.815 1.00 0.00 H new ATOM 0 HH TYR B 781 -4.832 16.002 -6.106 1.00 0.00 H new ATOM 1331 N TYR B 782 -8.321 9.626 -1.528 1.00 0.00 N ATOM 1332 CA TYR B 782 -8.794 8.255 -1.864 1.00 0.00 C ATOM 1333 C TYR B 782 -10.120 7.964 -1.157 1.00 0.00 C ATOM 1334 O TYR B 782 -10.215 8.015 0.053 1.00 0.00 O ATOM 1335 CB TYR B 782 -7.698 7.319 -1.345 1.00 0.00 C ATOM 1336 CG TYR B 782 -6.438 7.491 -2.166 1.00 0.00 C ATOM 1337 CD1 TYR B 782 -6.513 7.584 -3.561 1.00 0.00 C ATOM 1338 CD2 TYR B 782 -5.192 7.537 -1.529 1.00 0.00 C ATOM 1339 CE1 TYR B 782 -5.344 7.734 -4.318 1.00 0.00 C ATOM 1340 CE2 TYR B 782 -4.024 7.687 -2.286 1.00 0.00 C ATOM 1341 CZ TYR B 782 -4.100 7.786 -3.680 1.00 0.00 C ATOM 1342 OH TYR B 782 -2.948 7.934 -4.426 1.00 0.00 O ATOM 0 H TYR B 782 -7.611 9.674 -0.797 1.00 0.00 H new ATOM 0 HA TYR B 782 -8.968 8.130 -2.933 1.00 0.00 H new ATOM 0 HB2 TYR B 782 -7.491 7.534 -0.297 1.00 0.00 H new ATOM 0 HB3 TYR B 782 -8.037 6.284 -1.397 1.00 0.00 H new ATOM 0 HD1 TYR B 782 -7.473 7.540 -4.054 1.00 0.00 H new ATOM 0 HD2 TYR B 782 -5.132 7.457 -0.454 1.00 0.00 H new ATOM 0 HE1 TYR B 782 -5.403 7.809 -5.394 1.00 0.00 H new ATOM 0 HE2 TYR B 782 -3.063 7.726 -1.794 1.00 0.00 H new ATOM 0 HH TYR B 782 -2.220 7.428 -4.008 1.00 0.00 H new ATOM 1352 N VAL B 783 -11.145 7.664 -1.905 1.00 0.00 N ATOM 1353 CA VAL B 783 -12.463 7.360 -1.281 1.00 0.00 C ATOM 1354 C VAL B 783 -13.241 6.378 -2.158 1.00 0.00 C ATOM 1355 O VAL B 783 -14.435 6.503 -2.342 1.00 0.00 O ATOM 1356 CB VAL B 783 -13.189 8.706 -1.215 1.00 0.00 C ATOM 1357 CG1 VAL B 783 -12.363 9.694 -0.387 1.00 0.00 C ATOM 1358 CG2 VAL B 783 -13.372 9.257 -2.630 1.00 0.00 C ATOM 0 H VAL B 783 -11.127 7.616 -2.924 1.00 0.00 H new ATOM 0 HA VAL B 783 -12.361 6.903 -0.297 1.00 0.00 H new ATOM 0 HB VAL B 783 -14.165 8.568 -0.749 1.00 0.00 H new ATOM 0 HG11 VAL B 783 -12.881 10.652 -0.341 1.00 0.00 H new ATOM 0 HG12 VAL B 783 -12.232 9.303 0.622 1.00 0.00 H new ATOM 0 HG13 VAL B 783 -11.387 9.831 -0.852 1.00 0.00 H new ATOM 0 HG21 VAL B 783 -13.889 10.215 -2.583 1.00 0.00 H new ATOM 0 HG22 VAL B 783 -12.396 9.393 -3.096 1.00 0.00 H new ATOM 0 HG23 VAL B 783 -13.961 8.555 -3.220 1.00 0.00 H new ATOM 1368 N SER B 784 -12.566 5.412 -2.718 1.00 0.00 N ATOM 1369 CA SER B 784 -13.260 4.424 -3.589 1.00 0.00 C ATOM 1370 C SER B 784 -12.454 3.125 -3.659 1.00 0.00 C ATOM 1371 O SER B 784 -11.780 2.754 -2.719 1.00 0.00 O ATOM 1372 CB SER B 784 -13.326 5.091 -4.966 1.00 0.00 C ATOM 1373 OG SER B 784 -12.087 4.918 -5.637 1.00 0.00 O ATOM 0 H SER B 784 -11.563 5.265 -2.609 1.00 0.00 H new ATOM 0 HA SER B 784 -14.250 4.163 -3.214 1.00 0.00 H new ATOM 0 HB2 SER B 784 -14.134 4.656 -5.554 1.00 0.00 H new ATOM 0 HB3 SER B 784 -13.547 6.153 -4.857 1.00 0.00 H new ATOM 0 HG SER B 784 -12.216 5.045 -6.600 1.00 0.00 H new ATOM 1379 N LYS B 785 -12.515 2.428 -4.762 1.00 0.00 N ATOM 1380 CA LYS B 785 -11.748 1.155 -4.870 1.00 0.00 C ATOM 1381 C LYS B 785 -10.402 1.405 -5.562 1.00 0.00 C ATOM 1382 O LYS B 785 -9.370 1.445 -4.925 1.00 0.00 O ATOM 1383 CB LYS B 785 -12.628 0.213 -5.707 1.00 0.00 C ATOM 1384 CG LYS B 785 -14.038 0.143 -5.113 1.00 0.00 C ATOM 1385 CD LYS B 785 -15.069 0.327 -6.231 1.00 0.00 C ATOM 1386 CE LYS B 785 -14.933 1.728 -6.835 1.00 0.00 C ATOM 1387 NZ LYS B 785 -16.071 1.841 -7.789 1.00 0.00 N ATOM 0 H LYS B 785 -13.059 2.683 -5.587 1.00 0.00 H new ATOM 0 HA LYS B 785 -11.526 0.727 -3.893 1.00 0.00 H new ATOM 0 HB2 LYS B 785 -12.676 0.567 -6.737 1.00 0.00 H new ATOM 0 HB3 LYS B 785 -12.186 -0.783 -5.733 1.00 0.00 H new ATOM 0 HG2 LYS B 785 -14.189 -0.816 -4.618 1.00 0.00 H new ATOM 0 HG3 LYS B 785 -14.164 0.916 -4.355 1.00 0.00 H new ATOM 0 HD2 LYS B 785 -14.921 -0.428 -7.003 1.00 0.00 H new ATOM 0 HD3 LYS B 785 -16.076 0.187 -5.837 1.00 0.00 H new ATOM 0 HE2 LYS B 785 -14.984 2.498 -6.065 1.00 0.00 H new ATOM 0 HE3 LYS B 785 -13.977 1.849 -7.344 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 -15.705 2.023 -8.745 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 -16.613 0.954 -7.789 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 -16.690 2.625 -7.500 1.00 0.00 H new ATOM 1401 N LYS B 786 -10.406 1.619 -6.852 1.00 0.00 N ATOM 1402 CA LYS B 786 -9.126 1.856 -7.579 1.00 0.00 C ATOM 1403 C LYS B 786 -8.271 2.910 -6.870 1.00 0.00 C ATOM 1404 O LYS B 786 -7.074 2.961 -7.051 1.00 0.00 O ATOM 1405 CB LYS B 786 -9.545 2.353 -8.965 1.00 0.00 C ATOM 1406 CG LYS B 786 -10.347 3.649 -8.827 1.00 0.00 C ATOM 1407 CD LYS B 786 -9.648 4.769 -9.604 1.00 0.00 C ATOM 1408 CE LYS B 786 -9.515 4.365 -11.075 1.00 0.00 C ATOM 1409 NZ LYS B 786 -9.423 5.653 -11.820 1.00 0.00 N ATOM 0 H LYS B 786 -11.244 1.640 -7.434 1.00 0.00 H new ATOM 0 HA LYS B 786 -8.519 0.952 -7.627 1.00 0.00 H new ATOM 0 HB2 LYS B 786 -8.663 2.524 -9.583 1.00 0.00 H new ATOM 0 HB3 LYS B 786 -10.145 1.595 -9.468 1.00 0.00 H new ATOM 0 HG2 LYS B 786 -11.358 3.505 -9.207 1.00 0.00 H new ATOM 0 HG3 LYS B 786 -10.437 3.923 -7.776 1.00 0.00 H new ATOM 0 HD2 LYS B 786 -10.218 5.694 -9.520 1.00 0.00 H new ATOM 0 HD3 LYS B 786 -8.663 4.961 -9.178 1.00 0.00 H new ATOM 0 HE2 LYS B 786 -8.629 3.751 -11.237 1.00 0.00 H new ATOM 0 HE3 LYS B 786 -10.374 3.779 -11.403 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 -9.330 5.460 -12.838 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 -10.283 6.214 -11.652 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 -8.592 6.186 -11.491 1.00 0.00 H new ATOM 1423 N LEU B 787 -8.866 3.763 -6.082 1.00 0.00 N ATOM 1424 CA LEU B 787 -8.059 4.795 -5.371 1.00 0.00 C ATOM 1425 C LEU B 787 -7.403 4.199 -4.124 1.00 0.00 C ATOM 1426 O LEU B 787 -6.205 4.280 -3.942 1.00 0.00 O ATOM 1427 CB LEU B 787 -9.060 5.880 -4.981 1.00 0.00 C ATOM 1428 CG LEU B 787 -8.908 7.064 -5.936 1.00 0.00 C ATOM 1429 CD1 LEU B 787 -9.633 6.755 -7.244 1.00 0.00 C ATOM 1430 CD2 LEU B 787 -9.508 8.316 -5.301 1.00 0.00 C ATOM 0 H LEU B 787 -9.869 3.791 -5.900 1.00 0.00 H new ATOM 0 HA LEU B 787 -7.253 5.184 -5.993 1.00 0.00 H new ATOM 0 HB2 LEU B 787 -10.076 5.488 -5.026 1.00 0.00 H new ATOM 0 HB3 LEU B 787 -8.887 6.200 -3.954 1.00 0.00 H new ATOM 0 HG LEU B 787 -7.851 7.235 -6.137 1.00 0.00 H new ATOM 0 HD11 LEU B 787 -9.526 7.598 -7.927 1.00 0.00 H new ATOM 0 HD12 LEU B 787 -9.201 5.863 -7.698 1.00 0.00 H new ATOM 0 HD13 LEU B 787 -10.690 6.583 -7.042 1.00 0.00 H new ATOM 0 HD21 LEU B 787 -9.398 9.159 -5.984 1.00 0.00 H new ATOM 0 HD22 LEU B 787 -10.566 8.149 -5.097 1.00 0.00 H new ATOM 0 HD23 LEU B 787 -8.989 8.535 -4.368 1.00 0.00 H new ATOM 1442 N PHE B 788 -8.180 3.606 -3.261 1.00 0.00 N ATOM 1443 CA PHE B 788 -7.603 3.007 -2.025 1.00 0.00 C ATOM 1444 C PHE B 788 -6.857 1.718 -2.358 1.00 0.00 C ATOM 1445 O PHE B 788 -5.677 1.578 -2.092 1.00 0.00 O ATOM 1446 CB PHE B 788 -8.815 2.693 -1.148 1.00 0.00 C ATOM 1447 CG PHE B 788 -8.349 2.179 0.193 1.00 0.00 C ATOM 1448 CD1 PHE B 788 -7.617 3.013 1.047 1.00 0.00 C ATOM 1449 CD2 PHE B 788 -8.646 0.868 0.581 1.00 0.00 C ATOM 1450 CE1 PHE B 788 -7.188 2.537 2.291 1.00 0.00 C ATOM 1451 CE2 PHE B 788 -8.215 0.391 1.825 1.00 0.00 C ATOM 1452 CZ PHE B 788 -7.486 1.226 2.680 1.00 0.00 C ATOM 0 H PHE B 788 -9.191 3.510 -3.358 1.00 0.00 H new ATOM 0 HA PHE B 788 -6.892 3.674 -1.537 1.00 0.00 H new ATOM 0 HB2 PHE B 788 -9.422 3.588 -1.015 1.00 0.00 H new ATOM 0 HB3 PHE B 788 -9.446 1.949 -1.635 1.00 0.00 H new ATOM 0 HD1 PHE B 788 -7.384 4.023 0.746 1.00 0.00 H new ATOM 0 HD2 PHE B 788 -9.208 0.224 -0.079 1.00 0.00 H new ATOM 0 HE1 PHE B 788 -6.627 3.182 2.951 1.00 0.00 H new ATOM 0 HE2 PHE B 788 -8.445 -0.621 2.125 1.00 0.00 H new ATOM 0 HZ PHE B 788 -7.154 0.859 3.640 1.00 0.00 H new ATOM 1462 N MET B 789 -7.542 0.770 -2.935 1.00 0.00 N ATOM 1463 CA MET B 789 -6.893 -0.526 -3.272 1.00 0.00 C ATOM 1464 C MET B 789 -5.578 -0.297 -4.017 1.00 0.00 C ATOM 1465 O MET B 789 -4.591 -0.941 -3.753 1.00 0.00 O ATOM 1466 CB MET B 789 -7.901 -1.239 -4.185 1.00 0.00 C ATOM 1467 CG MET B 789 -8.622 -2.340 -3.417 1.00 0.00 C ATOM 1468 SD MET B 789 -7.431 -3.534 -2.771 1.00 0.00 S ATOM 1469 CE MET B 789 -8.130 -3.607 -1.107 1.00 0.00 C ATOM 0 H MET B 789 -8.528 0.838 -3.188 1.00 0.00 H new ATOM 0 HA MET B 789 -6.651 -1.105 -2.381 1.00 0.00 H new ATOM 0 HB2 MET B 789 -8.625 -0.521 -4.570 1.00 0.00 H new ATOM 0 HB3 MET B 789 -7.385 -1.664 -5.046 1.00 0.00 H new ATOM 0 HG2 MET B 789 -9.194 -1.906 -2.597 1.00 0.00 H new ATOM 0 HG3 MET B 789 -9.334 -2.843 -4.071 1.00 0.00 H new ATOM 0 HE1 MET B 789 -7.892 -4.569 -0.654 1.00 0.00 H new ATOM 0 HE2 MET B 789 -7.709 -2.806 -0.500 1.00 0.00 H new ATOM 0 HE3 MET B 789 -9.212 -3.490 -1.162 1.00 0.00 H new ATOM 1479 N ALA B 790 -5.559 0.621 -4.939 1.00 0.00 N ATOM 1480 CA ALA B 790 -4.313 0.877 -5.722 1.00 0.00 C ATOM 1481 C ALA B 790 -3.126 1.149 -4.799 1.00 0.00 C ATOM 1482 O ALA B 790 -2.220 0.348 -4.682 1.00 0.00 O ATOM 1483 CB ALA B 790 -4.613 2.125 -6.552 1.00 0.00 C ATOM 0 H ALA B 790 -6.354 1.209 -5.188 1.00 0.00 H new ATOM 0 HA ALA B 790 -4.048 0.015 -6.335 1.00 0.00 H new ATOM 0 HB1 ALA B 790 -3.742 2.378 -7.157 1.00 0.00 H new ATOM 0 HB2 ALA B 790 -5.464 1.932 -7.205 1.00 0.00 H new ATOM 0 HB3 ALA B 790 -4.847 2.957 -5.887 1.00 0.00 H new ATOM 1489 N ASP B 791 -3.106 2.296 -4.175 1.00 0.00 N ATOM 1490 CA ASP B 791 -1.961 2.656 -3.288 1.00 0.00 C ATOM 1491 C ASP B 791 -1.601 1.500 -2.354 1.00 0.00 C ATOM 1492 O ASP B 791 -0.441 1.253 -2.078 1.00 0.00 O ATOM 1493 CB ASP B 791 -2.461 3.852 -2.475 1.00 0.00 C ATOM 1494 CG ASP B 791 -2.736 5.029 -3.413 1.00 0.00 C ATOM 1495 OD1 ASP B 791 -3.763 5.008 -4.072 1.00 0.00 O ATOM 1496 OD2 ASP B 791 -1.917 5.932 -3.455 1.00 0.00 O ATOM 0 H ASP B 791 -3.838 3.003 -4.242 1.00 0.00 H new ATOM 0 HA ASP B 791 -1.062 2.882 -3.862 1.00 0.00 H new ATOM 0 HB2 ASP B 791 -3.369 3.584 -1.935 1.00 0.00 H new ATOM 0 HB3 ASP B 791 -1.718 4.134 -1.729 1.00 0.00 H new ATOM 1501 N LEU B 792 -2.577 0.787 -1.864 1.00 0.00 N ATOM 1502 CA LEU B 792 -2.263 -0.335 -0.936 1.00 0.00 C ATOM 1503 C LEU B 792 -1.698 -1.529 -1.707 1.00 0.00 C ATOM 1504 O LEU B 792 -0.728 -2.134 -1.297 1.00 0.00 O ATOM 1505 CB LEU B 792 -3.590 -0.690 -0.269 1.00 0.00 C ATOM 1506 CG LEU B 792 -3.391 -0.737 1.249 1.00 0.00 C ATOM 1507 CD1 LEU B 792 -2.884 0.619 1.747 1.00 0.00 C ATOM 1508 CD2 LEU B 792 -4.721 -1.059 1.925 1.00 0.00 C ATOM 0 H LEU B 792 -3.567 0.930 -2.063 1.00 0.00 H new ATOM 0 HA LEU B 792 -1.507 -0.058 -0.201 1.00 0.00 H new ATOM 0 HB2 LEU B 792 -4.349 0.048 -0.526 1.00 0.00 H new ATOM 0 HB3 LEU B 792 -3.947 -1.654 -0.631 1.00 0.00 H new ATOM 0 HG LEU B 792 -2.659 -1.507 1.492 1.00 0.00 H new ATOM 0 HD11 LEU B 792 -2.744 0.581 2.827 1.00 0.00 H new ATOM 0 HD12 LEU B 792 -1.934 0.851 1.266 1.00 0.00 H new ATOM 0 HD13 LEU B 792 -3.613 1.392 1.503 1.00 0.00 H new ATOM 0 HD21 LEU B 792 -4.581 -1.093 3.005 1.00 0.00 H new ATOM 0 HD22 LEU B 792 -5.451 -0.288 1.678 1.00 0.00 H new ATOM 0 HD23 LEU B 792 -5.082 -2.026 1.575 1.00 0.00 H new ATOM 1520 N GLN B 793 -2.283 -1.871 -2.823 1.00 0.00 N ATOM 1521 CA GLN B 793 -1.728 -2.998 -3.621 1.00 0.00 C ATOM 1522 C GLN B 793 -0.340 -2.611 -4.117 1.00 0.00 C ATOM 1523 O GLN B 793 0.614 -3.341 -3.942 1.00 0.00 O ATOM 1524 CB GLN B 793 -2.685 -3.192 -4.799 1.00 0.00 C ATOM 1525 CG GLN B 793 -3.082 -4.667 -4.893 1.00 0.00 C ATOM 1526 CD GLN B 793 -2.871 -5.163 -6.325 1.00 0.00 C ATOM 1527 OE1 GLN B 793 -3.366 -4.572 -7.264 1.00 0.00 O ATOM 1528 NE2 GLN B 793 -2.152 -6.232 -6.534 1.00 0.00 N ATOM 0 H GLN B 793 -3.113 -1.423 -3.212 1.00 0.00 H new ATOM 0 HA GLN B 793 -1.637 -3.916 -3.041 1.00 0.00 H new ATOM 0 HB2 GLN B 793 -3.572 -2.573 -4.667 1.00 0.00 H new ATOM 0 HB3 GLN B 793 -2.208 -2.872 -5.726 1.00 0.00 H new ATOM 0 HG2 GLN B 793 -2.485 -5.260 -4.200 1.00 0.00 H new ATOM 0 HG3 GLN B 793 -4.125 -4.793 -4.603 1.00 0.00 H new ATOM 0 HE21 GLN B 793 -1.736 -6.729 -5.746 1.00 0.00 H new ATOM 0 HE22 GLN B 793 -2.006 -6.571 -7.485 1.00 0.00 H new ATOM 1537 N ARG B 794 -0.211 -1.430 -4.673 1.00 0.00 N ATOM 1538 CA ARG B 794 1.123 -0.952 -5.140 1.00 0.00 C ATOM 1539 C ARG B 794 2.165 -1.178 -4.045 1.00 0.00 C ATOM 1540 O ARG B 794 3.221 -1.728 -4.283 1.00 0.00 O ATOM 1541 CB ARG B 794 0.936 0.546 -5.399 1.00 0.00 C ATOM 1542 CG ARG B 794 0.195 0.761 -6.727 1.00 0.00 C ATOM 1543 CD ARG B 794 0.934 0.066 -7.881 1.00 0.00 C ATOM 1544 NE ARG B 794 2.368 0.469 -7.743 1.00 0.00 N ATOM 1545 CZ ARG B 794 3.327 -0.242 -8.293 1.00 0.00 C ATOM 1546 NH1 ARG B 794 3.057 -1.328 -8.976 1.00 0.00 N ATOM 1547 NH2 ARG B 794 4.568 0.138 -8.156 1.00 0.00 N ATOM 0 H ARG B 794 -0.979 -0.775 -4.823 1.00 0.00 H new ATOM 0 HA ARG B 794 1.469 -1.479 -6.029 1.00 0.00 H new ATOM 0 HB2 ARG B 794 0.373 0.997 -4.582 1.00 0.00 H new ATOM 0 HB3 ARG B 794 1.906 1.042 -5.430 1.00 0.00 H new ATOM 0 HG2 ARG B 794 -0.819 0.370 -6.650 1.00 0.00 H new ATOM 0 HG3 ARG B 794 0.110 1.828 -6.933 1.00 0.00 H new ATOM 0 HD2 ARG B 794 0.824 -1.017 -7.821 1.00 0.00 H new ATOM 0 HD3 ARG B 794 0.532 0.374 -8.846 1.00 0.00 H new ATOM 0 HE ARG B 794 2.605 1.308 -7.214 1.00 0.00 H new ATOM 0 HH11 ARG B 794 2.090 -1.633 -9.087 1.00 0.00 H new ATOM 0 HH12 ARG B 794 3.814 -1.868 -9.396 1.00 0.00 H new ATOM 0 HH21 ARG B 794 4.788 0.981 -7.625 1.00 0.00 H new ATOM 0 HH22 ARG B 794 5.318 -0.408 -8.580 1.00 0.00 H new ATOM 1561 N VAL B 795 1.851 -0.811 -2.833 1.00 0.00 N ATOM 1562 CA VAL B 795 2.802 -1.059 -1.721 1.00 0.00 C ATOM 1563 C VAL B 795 3.111 -2.550 -1.640 1.00 0.00 C ATOM 1564 O VAL B 795 4.248 -2.954 -1.529 1.00 0.00 O ATOM 1565 CB VAL B 795 2.077 -0.605 -0.453 1.00 0.00 C ATOM 1566 CG1 VAL B 795 2.970 -0.886 0.758 1.00 0.00 C ATOM 1567 CG2 VAL B 795 1.786 0.894 -0.534 1.00 0.00 C ATOM 0 H VAL B 795 0.979 -0.352 -2.568 1.00 0.00 H new ATOM 0 HA VAL B 795 3.744 -0.528 -1.858 1.00 0.00 H new ATOM 0 HB VAL B 795 1.137 -1.147 -0.355 1.00 0.00 H new ATOM 0 HG11 VAL B 795 2.461 -0.566 1.667 1.00 0.00 H new ATOM 0 HG12 VAL B 795 3.179 -1.954 0.816 1.00 0.00 H new ATOM 0 HG13 VAL B 795 3.907 -0.339 0.654 1.00 0.00 H new ATOM 0 HG21 VAL B 795 1.269 1.214 0.371 1.00 0.00 H new ATOM 0 HG22 VAL B 795 2.723 1.442 -0.630 1.00 0.00 H new ATOM 0 HG23 VAL B 795 1.157 1.096 -1.401 1.00 0.00 H new ATOM 1577 N PHE B 796 2.100 -3.372 -1.707 1.00 0.00 N ATOM 1578 CA PHE B 796 2.328 -4.842 -1.632 1.00 0.00 C ATOM 1579 C PHE B 796 3.039 -5.331 -2.897 1.00 0.00 C ATOM 1580 O PHE B 796 4.026 -6.036 -2.828 1.00 0.00 O ATOM 1581 CB PHE B 796 0.928 -5.467 -1.520 1.00 0.00 C ATOM 1582 CG PHE B 796 0.128 -4.793 -0.416 1.00 0.00 C ATOM 1583 CD1 PHE B 796 0.764 -4.321 0.743 1.00 0.00 C ATOM 1584 CD2 PHE B 796 -1.259 -4.649 -0.554 1.00 0.00 C ATOM 1585 CE1 PHE B 796 0.015 -3.700 1.752 1.00 0.00 C ATOM 1586 CE2 PHE B 796 -2.005 -4.030 0.457 1.00 0.00 C ATOM 1587 CZ PHE B 796 -1.368 -3.556 1.608 1.00 0.00 C ATOM 0 H PHE B 796 1.126 -3.089 -1.810 1.00 0.00 H new ATOM 0 HA PHE B 796 2.959 -5.117 -0.787 1.00 0.00 H new ATOM 0 HB2 PHE B 796 0.402 -5.368 -2.470 1.00 0.00 H new ATOM 0 HB3 PHE B 796 1.015 -6.534 -1.314 1.00 0.00 H new ATOM 0 HD1 PHE B 796 1.832 -4.436 0.857 1.00 0.00 H new ATOM 0 HD2 PHE B 796 -1.754 -5.016 -1.441 1.00 0.00 H new ATOM 0 HE1 PHE B 796 0.506 -3.333 2.641 1.00 0.00 H new ATOM 0 HE2 PHE B 796 -3.074 -3.919 0.347 1.00 0.00 H new ATOM 0 HZ PHE B 796 -1.945 -3.078 2.386 1.00 0.00 H new ATOM 1597 N THR B 797 2.563 -4.949 -4.055 1.00 0.00 N ATOM 1598 CA THR B 797 3.243 -5.386 -5.310 1.00 0.00 C ATOM 1599 C THR B 797 4.684 -4.886 -5.320 1.00 0.00 C ATOM 1600 O THR B 797 5.618 -5.662 -5.343 1.00 0.00 O ATOM 1601 CB THR B 797 2.461 -4.750 -6.464 1.00 0.00 C ATOM 1602 OG1 THR B 797 1.797 -3.582 -6.014 1.00 0.00 O ATOM 1603 CG2 THR B 797 1.435 -5.748 -6.996 1.00 0.00 C ATOM 0 H THR B 797 1.741 -4.359 -4.185 1.00 0.00 H new ATOM 0 HA THR B 797 3.265 -6.472 -5.395 1.00 0.00 H new ATOM 0 HB THR B 797 3.155 -4.481 -7.260 1.00 0.00 H new ATOM 0 HG1 THR B 797 0.961 -3.832 -5.568 1.00 0.00 H new ATOM 0 HG21 THR B 797 0.879 -5.295 -7.817 1.00 0.00 H new ATOM 0 HG22 THR B 797 1.948 -6.641 -7.354 1.00 0.00 H new ATOM 0 HG23 THR B 797 0.745 -6.021 -6.198 1.00 0.00 H new ATOM 1611 N ASN B 798 4.879 -3.592 -5.291 1.00 0.00 N ATOM 1612 CA ASN B 798 6.271 -3.052 -5.291 1.00 0.00 C ATOM 1613 C ASN B 798 7.077 -3.720 -4.163 1.00 0.00 C ATOM 1614 O ASN B 798 8.224 -4.081 -4.336 1.00 0.00 O ATOM 1615 CB ASN B 798 6.103 -1.516 -5.121 1.00 0.00 C ATOM 1616 CG ASN B 798 6.477 -1.025 -3.710 1.00 0.00 C ATOM 1617 OD1 ASN B 798 7.561 -1.286 -3.226 1.00 0.00 O ATOM 1618 ND2 ASN B 798 5.632 -0.286 -3.049 1.00 0.00 N ATOM 0 H ASN B 798 4.139 -2.890 -5.267 1.00 0.00 H new ATOM 0 HA ASN B 798 6.830 -3.260 -6.203 1.00 0.00 H new ATOM 0 HB2 ASN B 798 6.725 -1.004 -5.855 1.00 0.00 H new ATOM 0 HB3 ASN B 798 5.069 -1.243 -5.333 1.00 0.00 H new ATOM 0 HD21 ASN B 798 5.881 0.073 -2.127 1.00 0.00 H new ATOM 0 HD22 ASN B 798 4.722 -0.066 -3.453 1.00 0.00 H new ATOM 1625 N CYS B 799 6.465 -3.925 -3.027 1.00 0.00 N ATOM 1626 CA CYS B 799 7.181 -4.604 -1.909 1.00 0.00 C ATOM 1627 C CYS B 799 7.590 -6.020 -2.335 1.00 0.00 C ATOM 1628 O CYS B 799 8.715 -6.434 -2.146 1.00 0.00 O ATOM 1629 CB CYS B 799 6.156 -4.650 -0.766 1.00 0.00 C ATOM 1630 SG CYS B 799 6.776 -5.661 0.604 1.00 0.00 S ATOM 0 H CYS B 799 5.503 -3.652 -2.826 1.00 0.00 H new ATOM 0 HA CYS B 799 8.095 -4.088 -1.615 1.00 0.00 H new ATOM 0 HB2 CYS B 799 5.949 -3.639 -0.415 1.00 0.00 H new ATOM 0 HB3 CYS B 799 5.214 -5.060 -1.131 1.00 0.00 H new ATOM 0 HG CYS B 799 6.232 -5.265 1.716 1.00 0.00 H new ATOM 1636 N LYS B 800 6.675 -6.772 -2.883 1.00 0.00 N ATOM 1637 CA LYS B 800 7.005 -8.161 -3.315 1.00 0.00 C ATOM 1638 C LYS B 800 7.702 -8.166 -4.680 1.00 0.00 C ATOM 1639 O LYS B 800 7.949 -9.209 -5.253 1.00 0.00 O ATOM 1640 CB LYS B 800 5.652 -8.867 -3.419 1.00 0.00 C ATOM 1641 CG LYS B 800 4.976 -8.885 -2.047 1.00 0.00 C ATOM 1642 CD LYS B 800 4.116 -10.143 -1.921 1.00 0.00 C ATOM 1643 CE LYS B 800 2.646 -9.781 -2.149 1.00 0.00 C ATOM 1644 NZ LYS B 800 1.880 -10.951 -1.634 1.00 0.00 N ATOM 0 H LYS B 800 5.711 -6.484 -3.051 1.00 0.00 H new ATOM 0 HA LYS B 800 7.685 -8.648 -2.616 1.00 0.00 H new ATOM 0 HB2 LYS B 800 5.017 -8.354 -4.142 1.00 0.00 H new ATOM 0 HB3 LYS B 800 5.789 -9.886 -3.782 1.00 0.00 H new ATOM 0 HG2 LYS B 800 5.728 -8.865 -1.258 1.00 0.00 H new ATOM 0 HG3 LYS B 800 4.359 -7.995 -1.922 1.00 0.00 H new ATOM 0 HD2 LYS B 800 4.435 -10.889 -2.649 1.00 0.00 H new ATOM 0 HD3 LYS B 800 4.244 -10.586 -0.933 1.00 0.00 H new ATOM 0 HE2 LYS B 800 2.377 -8.868 -1.618 1.00 0.00 H new ATOM 0 HE3 LYS B 800 2.441 -9.608 -3.205 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 0.861 -10.780 -1.755 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 2.153 -11.804 -2.162 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 2.091 -11.087 -0.625 1.00 0.00 H new ATOM 1658 N GLU B 801 8.006 -7.016 -5.219 1.00 0.00 N ATOM 1659 CA GLU B 801 8.653 -6.974 -6.559 1.00 0.00 C ATOM 1660 C GLU B 801 10.176 -6.893 -6.429 1.00 0.00 C ATOM 1661 O GLU B 801 10.903 -7.242 -7.338 1.00 0.00 O ATOM 1662 CB GLU B 801 8.105 -5.700 -7.207 1.00 0.00 C ATOM 1663 CG GLU B 801 7.432 -6.045 -8.537 1.00 0.00 C ATOM 1664 CD GLU B 801 6.324 -7.076 -8.303 1.00 0.00 C ATOM 1665 OE1 GLU B 801 5.221 -6.668 -7.981 1.00 0.00 O ATOM 1666 OE2 GLU B 801 6.600 -8.255 -8.448 1.00 0.00 O ATOM 0 H GLU B 801 7.834 -6.107 -4.790 1.00 0.00 H new ATOM 0 HA GLU B 801 8.442 -7.868 -7.145 1.00 0.00 H new ATOM 0 HB2 GLU B 801 7.389 -5.221 -6.540 1.00 0.00 H new ATOM 0 HB3 GLU B 801 8.913 -4.988 -7.372 1.00 0.00 H new ATOM 0 HG2 GLU B 801 7.015 -5.145 -8.989 1.00 0.00 H new ATOM 0 HG3 GLU B 801 8.168 -6.441 -9.236 1.00 0.00 H new ATOM 1673 N TYR B 802 10.667 -6.435 -5.311 1.00 0.00 N ATOM 1674 CA TYR B 802 12.144 -6.327 -5.141 1.00 0.00 C ATOM 1675 C TYR B 802 12.586 -7.017 -3.844 1.00 0.00 C ATOM 1676 O TYR B 802 13.507 -7.809 -3.835 1.00 0.00 O ATOM 1677 CB TYR B 802 12.415 -4.815 -5.079 1.00 0.00 C ATOM 1678 CG TYR B 802 13.844 -4.564 -4.651 1.00 0.00 C ATOM 1679 CD1 TYR B 802 14.902 -4.981 -5.466 1.00 0.00 C ATOM 1680 CD2 TYR B 802 14.105 -3.945 -3.424 1.00 0.00 C ATOM 1681 CE1 TYR B 802 16.224 -4.763 -5.061 1.00 0.00 C ATOM 1682 CE2 TYR B 802 15.426 -3.726 -3.019 1.00 0.00 C ATOM 1683 CZ TYR B 802 16.486 -4.135 -3.838 1.00 0.00 C ATOM 1684 OH TYR B 802 17.790 -3.921 -3.439 1.00 0.00 O ATOM 0 H TYR B 802 10.112 -6.132 -4.510 1.00 0.00 H new ATOM 0 HA TYR B 802 12.695 -6.810 -5.948 1.00 0.00 H new ATOM 0 HB2 TYR B 802 12.234 -4.364 -6.055 1.00 0.00 H new ATOM 0 HB3 TYR B 802 11.728 -4.342 -4.377 1.00 0.00 H new ATOM 0 HD1 TYR B 802 14.699 -5.471 -6.407 1.00 0.00 H new ATOM 0 HD2 TYR B 802 13.287 -3.636 -2.790 1.00 0.00 H new ATOM 0 HE1 TYR B 802 17.041 -5.079 -5.692 1.00 0.00 H new ATOM 0 HE2 TYR B 802 15.628 -3.242 -2.075 1.00 0.00 H new ATOM 0 HH TYR B 802 17.796 -3.473 -2.567 1.00 0.00 H new ATOM 1694 N ASN B 803 11.950 -6.701 -2.750 1.00 0.00 N ATOM 1695 CA ASN B 803 12.335 -7.315 -1.443 1.00 0.00 C ATOM 1696 C ASN B 803 12.522 -8.834 -1.579 1.00 0.00 C ATOM 1697 O ASN B 803 12.114 -9.417 -2.564 1.00 0.00 O ATOM 1698 CB ASN B 803 11.157 -6.995 -0.523 1.00 0.00 C ATOM 1699 CG ASN B 803 11.018 -5.476 -0.402 1.00 0.00 C ATOM 1700 OD1 ASN B 803 11.827 -4.737 -0.928 1.00 0.00 O ATOM 1701 ND2 ASN B 803 10.018 -4.975 0.267 1.00 0.00 N ATOM 0 H ASN B 803 11.175 -6.040 -2.703 1.00 0.00 H new ATOM 0 HA ASN B 803 13.282 -6.930 -1.066 1.00 0.00 H new ATOM 0 HB2 ASN B 803 10.239 -7.426 -0.923 1.00 0.00 H new ATOM 0 HB3 ASN B 803 11.316 -7.438 0.460 1.00 0.00 H new ATOM 0 HD21 ASN B 803 9.915 -3.964 0.349 1.00 0.00 H new ATOM 0 HD22 ASN B 803 9.339 -5.594 0.709 1.00 0.00 H new ATOM 1708 N PRO B 804 13.150 -9.428 -0.588 1.00 0.00 N ATOM 1709 CA PRO B 804 13.404 -10.887 -0.597 1.00 0.00 C ATOM 1710 C PRO B 804 12.168 -11.662 -1.049 1.00 0.00 C ATOM 1711 O PRO B 804 11.062 -11.298 -0.718 1.00 0.00 O ATOM 1712 CB PRO B 804 13.720 -11.215 0.871 1.00 0.00 C ATOM 1713 CG PRO B 804 13.523 -9.934 1.626 1.00 0.00 C ATOM 1714 CD PRO B 804 13.678 -8.828 0.630 1.00 0.00 C ATOM 0 HA PRO B 804 14.205 -11.160 -1.284 1.00 0.00 H new ATOM 0 HB2 PRO B 804 13.061 -11.997 1.248 1.00 0.00 H new ATOM 0 HB3 PRO B 804 14.741 -11.580 0.979 1.00 0.00 H new ATOM 0 HG2 PRO B 804 12.537 -9.904 2.089 1.00 0.00 H new ATOM 0 HG3 PRO B 804 14.255 -9.840 2.428 1.00 0.00 H new ATOM 0 HD2 PRO B 804 13.119 -7.939 0.920 1.00 0.00 H new ATOM 0 HD3 PRO B 804 14.719 -8.527 0.516 1.00 0.00 H new ATOM 1722 N PRO B 805 12.393 -12.732 -1.767 1.00 0.00 N ATOM 1723 CA PRO B 805 11.263 -13.585 -2.186 1.00 0.00 C ATOM 1724 C PRO B 805 10.555 -14.145 -0.947 1.00 0.00 C ATOM 1725 O PRO B 805 9.451 -14.645 -1.027 1.00 0.00 O ATOM 1726 CB PRO B 805 11.918 -14.710 -2.991 1.00 0.00 C ATOM 1727 CG PRO B 805 13.369 -14.681 -2.622 1.00 0.00 C ATOM 1728 CD PRO B 805 13.691 -13.280 -2.183 1.00 0.00 C ATOM 0 HA PRO B 805 10.513 -13.049 -2.767 1.00 0.00 H new ATOM 0 HB2 PRO B 805 11.472 -15.675 -2.750 1.00 0.00 H new ATOM 0 HB3 PRO B 805 11.783 -14.555 -4.061 1.00 0.00 H new ATOM 0 HG2 PRO B 805 13.576 -15.392 -1.822 1.00 0.00 H new ATOM 0 HG3 PRO B 805 13.987 -14.969 -3.472 1.00 0.00 H new ATOM 0 HD2 PRO B 805 14.409 -13.274 -1.363 1.00 0.00 H new ATOM 0 HD3 PRO B 805 14.129 -12.698 -2.994 1.00 0.00 H new ATOM 1736 N GLU B 806 11.193 -14.080 0.203 1.00 0.00 N ATOM 1737 CA GLU B 806 10.561 -14.600 1.456 1.00 0.00 C ATOM 1738 C GLU B 806 11.569 -14.529 2.604 1.00 0.00 C ATOM 1739 O GLU B 806 12.004 -15.537 3.126 1.00 0.00 O ATOM 1740 CB GLU B 806 10.187 -16.061 1.164 1.00 0.00 C ATOM 1741 CG GLU B 806 8.673 -16.236 1.305 1.00 0.00 C ATOM 1742 CD GLU B 806 8.368 -17.643 1.823 1.00 0.00 C ATOM 1743 OE1 GLU B 806 9.181 -18.170 2.564 1.00 0.00 O ATOM 1744 OE2 GLU B 806 7.325 -18.169 1.469 1.00 0.00 O ATOM 0 H GLU B 806 12.127 -13.687 0.324 1.00 0.00 H new ATOM 0 HA GLU B 806 9.686 -14.018 1.745 1.00 0.00 H new ATOM 0 HB2 GLU B 806 10.504 -16.335 0.158 1.00 0.00 H new ATOM 0 HB3 GLU B 806 10.707 -16.726 1.854 1.00 0.00 H new ATOM 0 HG2 GLU B 806 8.272 -15.490 1.991 1.00 0.00 H new ATOM 0 HG3 GLU B 806 8.187 -16.078 0.342 1.00 0.00 H new ATOM 1751 N SER B 807 11.971 -13.348 2.985 1.00 0.00 N ATOM 1752 CA SER B 807 12.972 -13.232 4.082 1.00 0.00 C ATOM 1753 C SER B 807 12.444 -12.352 5.214 1.00 0.00 C ATOM 1754 O SER B 807 12.240 -12.811 6.320 1.00 0.00 O ATOM 1755 CB SER B 807 14.199 -12.586 3.433 1.00 0.00 C ATOM 1756 OG SER B 807 15.352 -12.874 4.211 1.00 0.00 O ATOM 0 H SER B 807 11.652 -12.464 2.588 1.00 0.00 H new ATOM 0 HA SER B 807 13.200 -14.202 4.524 1.00 0.00 H new ATOM 0 HB2 SER B 807 14.328 -12.963 2.418 1.00 0.00 H new ATOM 0 HB3 SER B 807 14.058 -11.508 3.357 1.00 0.00 H new ATOM 0 HG SER B 807 16.138 -12.462 3.795 1.00 0.00 H new ATOM 1762 N GLU B 808 12.236 -11.090 4.960 1.00 0.00 N ATOM 1763 CA GLU B 808 11.748 -10.196 6.050 1.00 0.00 C ATOM 1764 C GLU B 808 10.815 -9.116 5.503 1.00 0.00 C ATOM 1765 O GLU B 808 9.824 -8.771 6.116 1.00 0.00 O ATOM 1766 CB GLU B 808 13.015 -9.560 6.620 1.00 0.00 C ATOM 1767 CG GLU B 808 13.074 -9.802 8.130 1.00 0.00 C ATOM 1768 CD GLU B 808 14.440 -9.367 8.663 1.00 0.00 C ATOM 1769 OE1 GLU B 808 15.352 -10.176 8.631 1.00 0.00 O ATOM 1770 OE2 GLU B 808 14.551 -8.231 9.094 1.00 0.00 O ATOM 0 H GLU B 808 12.381 -10.641 4.055 1.00 0.00 H new ATOM 0 HA GLU B 808 11.177 -10.744 6.799 1.00 0.00 H new ATOM 0 HB2 GLU B 808 13.896 -9.985 6.138 1.00 0.00 H new ATOM 0 HB3 GLU B 808 13.023 -8.490 6.412 1.00 0.00 H new ATOM 0 HG2 GLU B 808 12.282 -9.244 8.630 1.00 0.00 H new ATOM 0 HG3 GLU B 808 12.906 -10.857 8.347 1.00 0.00 H new ATOM 1777 N TYR B 809 11.135 -8.561 4.370 1.00 0.00 N ATOM 1778 CA TYR B 809 10.272 -7.489 3.798 1.00 0.00 C ATOM 1779 C TYR B 809 9.052 -8.097 3.103 1.00 0.00 C ATOM 1780 O TYR B 809 7.948 -7.604 3.225 1.00 0.00 O ATOM 1781 CB TYR B 809 11.166 -6.775 2.784 1.00 0.00 C ATOM 1782 CG TYR B 809 11.917 -5.658 3.468 1.00 0.00 C ATOM 1783 CD1 TYR B 809 12.665 -5.921 4.622 1.00 0.00 C ATOM 1784 CD2 TYR B 809 11.867 -4.359 2.947 1.00 0.00 C ATOM 1785 CE1 TYR B 809 13.362 -4.884 5.255 1.00 0.00 C ATOM 1786 CE2 TYR B 809 12.564 -3.324 3.580 1.00 0.00 C ATOM 1787 CZ TYR B 809 13.311 -3.585 4.734 1.00 0.00 C ATOM 1788 OH TYR B 809 13.997 -2.564 5.357 1.00 0.00 O ATOM 0 H TYR B 809 11.956 -8.802 3.814 1.00 0.00 H new ATOM 0 HA TYR B 809 9.890 -6.812 4.562 1.00 0.00 H new ATOM 0 HB2 TYR B 809 11.868 -7.482 2.342 1.00 0.00 H new ATOM 0 HB3 TYR B 809 10.562 -6.375 1.970 1.00 0.00 H new ATOM 0 HD1 TYR B 809 12.705 -6.923 5.024 1.00 0.00 H new ATOM 0 HD2 TYR B 809 11.290 -4.156 2.057 1.00 0.00 H new ATOM 0 HE1 TYR B 809 13.939 -5.086 6.145 1.00 0.00 H new ATOM 0 HE2 TYR B 809 12.525 -2.323 3.177 1.00 0.00 H new ATOM 0 HH TYR B 809 13.856 -1.728 4.866 1.00 0.00 H new ATOM 1798 N TYR B 810 9.239 -9.165 2.377 1.00 0.00 N ATOM 1799 CA TYR B 810 8.086 -9.803 1.682 1.00 0.00 C ATOM 1800 C TYR B 810 7.168 -10.485 2.699 1.00 0.00 C ATOM 1801 O TYR B 810 5.966 -10.528 2.532 1.00 0.00 O ATOM 1802 CB TYR B 810 8.719 -10.831 0.740 1.00 0.00 C ATOM 1803 CG TYR B 810 7.644 -11.667 0.081 1.00 0.00 C ATOM 1804 CD1 TYR B 810 7.010 -12.689 0.799 1.00 0.00 C ATOM 1805 CD2 TYR B 810 7.297 -11.433 -1.255 1.00 0.00 C ATOM 1806 CE1 TYR B 810 6.018 -13.465 0.186 1.00 0.00 C ATOM 1807 CE2 TYR B 810 6.307 -12.211 -1.869 1.00 0.00 C ATOM 1808 CZ TYR B 810 5.668 -13.226 -1.148 1.00 0.00 C ATOM 1809 OH TYR B 810 4.692 -13.992 -1.753 1.00 0.00 O ATOM 0 H TYR B 810 10.139 -9.623 2.235 1.00 0.00 H new ATOM 0 HA TYR B 810 7.471 -9.082 1.142 1.00 0.00 H new ATOM 0 HB2 TYR B 810 9.311 -10.322 -0.020 1.00 0.00 H new ATOM 0 HB3 TYR B 810 9.400 -11.474 1.297 1.00 0.00 H new ATOM 0 HD1 TYR B 810 7.286 -12.879 1.826 1.00 0.00 H new ATOM 0 HD2 TYR B 810 7.793 -10.652 -1.813 1.00 0.00 H new ATOM 0 HE1 TYR B 810 5.523 -14.247 0.742 1.00 0.00 H new ATOM 0 HE2 TYR B 810 6.037 -12.028 -2.898 1.00 0.00 H new ATOM 0 HH TYR B 810 4.570 -13.695 -2.679 1.00 0.00 H new ATOM 1819 N LYS B 811 7.725 -11.014 3.752 1.00 0.00 N ATOM 1820 CA LYS B 811 6.882 -11.686 4.779 1.00 0.00 C ATOM 1821 C LYS B 811 5.871 -10.700 5.368 1.00 0.00 C ATOM 1822 O LYS B 811 4.901 -11.090 5.988 1.00 0.00 O ATOM 1823 CB LYS B 811 7.867 -12.147 5.855 1.00 0.00 C ATOM 1824 CG LYS B 811 8.534 -13.451 5.412 1.00 0.00 C ATOM 1825 CD LYS B 811 8.072 -14.594 6.318 1.00 0.00 C ATOM 1826 CE LYS B 811 8.680 -14.419 7.711 1.00 0.00 C ATOM 1827 NZ LYS B 811 8.000 -15.441 8.555 1.00 0.00 N ATOM 0 H LYS B 811 8.726 -11.010 3.946 1.00 0.00 H new ATOM 0 HA LYS B 811 6.309 -12.515 4.363 1.00 0.00 H new ATOM 0 HB2 LYS B 811 8.622 -11.379 6.025 1.00 0.00 H new ATOM 0 HB3 LYS B 811 7.346 -12.296 6.801 1.00 0.00 H new ATOM 0 HG2 LYS B 811 8.278 -13.669 4.375 1.00 0.00 H new ATOM 0 HG3 LYS B 811 9.618 -13.351 5.459 1.00 0.00 H new ATOM 0 HD2 LYS B 811 6.984 -14.603 6.383 1.00 0.00 H new ATOM 0 HD3 LYS B 811 8.374 -15.552 5.895 1.00 0.00 H new ATOM 0 HE2 LYS B 811 9.759 -14.574 7.694 1.00 0.00 H new ATOM 0 HE3 LYS B 811 8.509 -13.413 8.094 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 8.363 -15.385 9.528 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 6.975 -15.263 8.557 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 8.186 -16.389 8.170 1.00 0.00 H new ATOM 1841 N CYS B 812 6.100 -9.423 5.206 1.00 0.00 N ATOM 1842 CA CYS B 812 5.148 -8.422 5.749 1.00 0.00 C ATOM 1843 C CYS B 812 3.961 -8.263 4.803 1.00 0.00 C ATOM 1844 O CYS B 812 2.819 -8.389 5.198 1.00 0.00 O ATOM 1845 CB CYS B 812 5.943 -7.118 5.828 1.00 0.00 C ATOM 1846 SG CYS B 812 7.411 -7.360 6.861 1.00 0.00 S ATOM 0 H CYS B 812 6.908 -9.034 4.720 1.00 0.00 H new ATOM 0 HA CYS B 812 4.749 -8.716 6.720 1.00 0.00 H new ATOM 0 HB2 CYS B 812 6.238 -6.800 4.828 1.00 0.00 H new ATOM 0 HB3 CYS B 812 5.320 -6.326 6.244 1.00 0.00 H new ATOM 0 HG CYS B 812 8.290 -8.060 6.208 1.00 0.00 H new ATOM 1852 N ALA B 813 4.221 -7.994 3.551 1.00 0.00 N ATOM 1853 CA ALA B 813 3.103 -7.842 2.580 1.00 0.00 C ATOM 1854 C ALA B 813 2.203 -9.073 2.632 1.00 0.00 C ATOM 1855 O ALA B 813 1.003 -8.977 2.509 1.00 0.00 O ATOM 1856 CB ALA B 813 3.771 -7.732 1.209 1.00 0.00 C ATOM 0 H ALA B 813 5.156 -7.874 3.162 1.00 0.00 H new ATOM 0 HA ALA B 813 2.482 -6.973 2.798 1.00 0.00 H new ATOM 0 HB1 ALA B 813 3.007 -7.617 0.440 1.00 0.00 H new ATOM 0 HB2 ALA B 813 4.433 -6.866 1.195 1.00 0.00 H new ATOM 0 HB3 ALA B 813 4.350 -8.634 1.013 1.00 0.00 H new ATOM 1862 N ASN B 814 2.772 -10.229 2.835 1.00 0.00 N ATOM 1863 CA ASN B 814 1.934 -11.455 2.923 1.00 0.00 C ATOM 1864 C ASN B 814 0.878 -11.276 4.014 1.00 0.00 C ATOM 1865 O ASN B 814 -0.304 -11.459 3.791 1.00 0.00 O ATOM 1866 CB ASN B 814 2.908 -12.574 3.296 1.00 0.00 C ATOM 1867 CG ASN B 814 2.720 -13.754 2.339 1.00 0.00 C ATOM 1868 OD1 ASN B 814 3.453 -13.896 1.381 1.00 0.00 O ATOM 1869 ND2 ASN B 814 1.762 -14.612 2.560 1.00 0.00 N ATOM 0 H ASN B 814 3.775 -10.376 2.943 1.00 0.00 H new ATOM 0 HA ASN B 814 1.407 -11.672 1.994 1.00 0.00 H new ATOM 0 HB2 ASN B 814 3.934 -12.210 3.244 1.00 0.00 H new ATOM 0 HB3 ASN B 814 2.735 -12.894 4.323 1.00 0.00 H new ATOM 0 HD21 ASN B 814 1.629 -15.402 1.928 1.00 0.00 H new ATOM 0 HD22 ASN B 814 1.146 -14.493 3.364 1.00 0.00 H new ATOM 1876 N ILE B 815 1.298 -10.888 5.187 1.00 0.00 N ATOM 1877 CA ILE B 815 0.329 -10.669 6.294 1.00 0.00 C ATOM 1878 C ILE B 815 -0.558 -9.462 5.981 1.00 0.00 C ATOM 1879 O ILE B 815 -1.765 -9.571 5.891 1.00 0.00 O ATOM 1880 CB ILE B 815 1.208 -10.395 7.527 1.00 0.00 C ATOM 1881 CG1 ILE B 815 1.832 -11.709 8.003 1.00 0.00 C ATOM 1882 CG2 ILE B 815 0.367 -9.791 8.662 1.00 0.00 C ATOM 1883 CD1 ILE B 815 3.305 -11.479 8.346 1.00 0.00 C ATOM 0 H ILE B 815 2.274 -10.713 5.426 1.00 0.00 H new ATOM 0 HA ILE B 815 -0.337 -11.518 6.447 1.00 0.00 H new ATOM 0 HB ILE B 815 1.990 -9.687 7.254 1.00 0.00 H new ATOM 0 HG12 ILE B 815 1.298 -12.082 8.877 1.00 0.00 H new ATOM 0 HG13 ILE B 815 1.743 -12.469 7.227 1.00 0.00 H new ATOM 0 HG21 ILE B 815 1.004 -9.603 9.526 1.00 0.00 H new ATOM 0 HG22 ILE B 815 -0.076 -8.853 8.327 1.00 0.00 H new ATOM 0 HG23 ILE B 815 -0.424 -10.488 8.939 1.00 0.00 H new ATOM 0 HD11 ILE B 815 3.750 -12.414 8.685 1.00 0.00 H new ATOM 0 HD12 ILE B 815 3.834 -11.126 7.461 1.00 0.00 H new ATOM 0 HD13 ILE B 815 3.382 -10.733 9.137 1.00 0.00 H new ATOM 1895 N LEU B 816 0.030 -8.307 5.847 1.00 0.00 N ATOM 1896 CA LEU B 816 -0.780 -7.089 5.587 1.00 0.00 C ATOM 1897 C LEU B 816 -1.739 -7.304 4.413 1.00 0.00 C ATOM 1898 O LEU B 816 -2.890 -6.923 4.469 1.00 0.00 O ATOM 1899 CB LEU B 816 0.241 -5.996 5.248 1.00 0.00 C ATOM 1900 CG LEU B 816 -0.046 -4.734 6.077 1.00 0.00 C ATOM 1901 CD1 LEU B 816 0.817 -3.581 5.568 1.00 0.00 C ATOM 1902 CD2 LEU B 816 -1.520 -4.352 5.957 1.00 0.00 C ATOM 0 H LEU B 816 1.037 -8.155 5.907 1.00 0.00 H new ATOM 0 HA LEU B 816 -1.398 -6.827 6.446 1.00 0.00 H new ATOM 0 HB2 LEU B 816 1.250 -6.354 5.452 1.00 0.00 H new ATOM 0 HB3 LEU B 816 0.195 -5.761 4.185 1.00 0.00 H new ATOM 0 HG LEU B 816 0.188 -4.936 7.122 1.00 0.00 H new ATOM 0 HD11 LEU B 816 0.613 -2.686 6.156 1.00 0.00 H new ATOM 0 HD12 LEU B 816 1.870 -3.845 5.663 1.00 0.00 H new ATOM 0 HD13 LEU B 816 0.585 -3.387 4.521 1.00 0.00 H new ATOM 0 HD21 LEU B 816 -1.713 -3.457 6.548 1.00 0.00 H new ATOM 0 HD22 LEU B 816 -1.761 -4.156 4.912 1.00 0.00 H new ATOM 0 HD23 LEU B 816 -2.139 -5.170 6.325 1.00 0.00 H new ATOM 1914 N GLU B 817 -1.275 -7.900 3.351 1.00 0.00 N ATOM 1915 CA GLU B 817 -2.165 -8.124 2.175 1.00 0.00 C ATOM 1916 C GLU B 817 -3.346 -9.019 2.561 1.00 0.00 C ATOM 1917 O GLU B 817 -4.471 -8.773 2.177 1.00 0.00 O ATOM 1918 CB GLU B 817 -1.277 -8.822 1.136 1.00 0.00 C ATOM 1919 CG GLU B 817 -2.120 -9.248 -0.070 1.00 0.00 C ATOM 1920 CD GLU B 817 -2.479 -8.016 -0.903 1.00 0.00 C ATOM 1921 OE1 GLU B 817 -1.589 -7.227 -1.170 1.00 0.00 O ATOM 1922 OE2 GLU B 817 -3.638 -7.886 -1.261 1.00 0.00 O ATOM 0 H GLU B 817 -0.320 -8.242 3.245 1.00 0.00 H new ATOM 0 HA GLU B 817 -2.588 -7.194 1.795 1.00 0.00 H new ATOM 0 HB2 GLU B 817 -0.481 -8.150 0.815 1.00 0.00 H new ATOM 0 HB3 GLU B 817 -0.798 -9.694 1.582 1.00 0.00 H new ATOM 0 HG2 GLU B 817 -1.567 -9.963 -0.679 1.00 0.00 H new ATOM 0 HG3 GLU B 817 -3.027 -9.750 0.266 1.00 0.00 H new ATOM 1929 N LYS B 818 -3.104 -10.064 3.300 1.00 0.00 N ATOM 1930 CA LYS B 818 -4.223 -10.974 3.673 1.00 0.00 C ATOM 1931 C LYS B 818 -5.094 -10.346 4.762 1.00 0.00 C ATOM 1932 O LYS B 818 -6.259 -10.663 4.898 1.00 0.00 O ATOM 1933 CB LYS B 818 -3.546 -12.234 4.211 1.00 0.00 C ATOM 1934 CG LYS B 818 -3.656 -13.360 3.190 1.00 0.00 C ATOM 1935 CD LYS B 818 -2.880 -12.951 1.957 1.00 0.00 C ATOM 1936 CE LYS B 818 -3.679 -13.320 0.709 1.00 0.00 C ATOM 1937 NZ LYS B 818 -3.267 -12.328 -0.324 1.00 0.00 N ATOM 0 H LYS B 818 -2.187 -10.327 3.660 1.00 0.00 H new ATOM 0 HA LYS B 818 -4.875 -11.180 2.824 1.00 0.00 H new ATOM 0 HB2 LYS B 818 -2.498 -12.029 4.428 1.00 0.00 H new ATOM 0 HB3 LYS B 818 -4.012 -12.535 5.149 1.00 0.00 H new ATOM 0 HG2 LYS B 818 -3.257 -14.287 3.601 1.00 0.00 H new ATOM 0 HG3 LYS B 818 -4.700 -13.546 2.939 1.00 0.00 H new ATOM 0 HD2 LYS B 818 -2.687 -11.878 1.975 1.00 0.00 H new ATOM 0 HD3 LYS B 818 -1.911 -13.449 1.942 1.00 0.00 H new ATOM 0 HE2 LYS B 818 -3.460 -14.338 0.387 1.00 0.00 H new ATOM 0 HE3 LYS B 818 -4.751 -13.270 0.898 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 -3.186 -12.801 -1.247 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 -3.979 -11.572 -0.383 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 -2.348 -11.917 -0.064 1.00 0.00 H new ATOM 1951 N PHE B 819 -4.535 -9.472 5.555 1.00 0.00 N ATOM 1952 CA PHE B 819 -5.326 -8.853 6.656 1.00 0.00 C ATOM 1953 C PHE B 819 -6.263 -7.769 6.117 1.00 0.00 C ATOM 1954 O PHE B 819 -7.468 -7.870 6.231 1.00 0.00 O ATOM 1955 CB PHE B 819 -4.282 -8.240 7.591 1.00 0.00 C ATOM 1956 CG PHE B 819 -4.051 -9.167 8.760 1.00 0.00 C ATOM 1957 CD1 PHE B 819 -3.250 -10.304 8.605 1.00 0.00 C ATOM 1958 CD2 PHE B 819 -4.643 -8.892 9.999 1.00 0.00 C ATOM 1959 CE1 PHE B 819 -3.038 -11.165 9.689 1.00 0.00 C ATOM 1960 CE2 PHE B 819 -4.431 -9.752 11.083 1.00 0.00 C ATOM 1961 CZ PHE B 819 -3.629 -10.889 10.928 1.00 0.00 C ATOM 0 H PHE B 819 -3.566 -9.161 5.488 1.00 0.00 H new ATOM 0 HA PHE B 819 -5.959 -9.583 7.161 1.00 0.00 H new ATOM 0 HB2 PHE B 819 -3.348 -8.075 7.053 1.00 0.00 H new ATOM 0 HB3 PHE B 819 -4.622 -7.267 7.946 1.00 0.00 H new ATOM 0 HD1 PHE B 819 -2.795 -10.518 7.649 1.00 0.00 H new ATOM 0 HD2 PHE B 819 -5.263 -8.016 10.118 1.00 0.00 H new ATOM 0 HE1 PHE B 819 -2.419 -12.042 9.569 1.00 0.00 H new ATOM 0 HE2 PHE B 819 -4.886 -9.538 12.039 1.00 0.00 H new ATOM 0 HZ PHE B 819 -3.466 -11.553 11.764 1.00 0.00 H new ATOM 1971 N PHE B 820 -5.725 -6.728 5.541 1.00 0.00 N ATOM 1972 CA PHE B 820 -6.599 -5.637 5.025 1.00 0.00 C ATOM 1973 C PHE B 820 -7.625 -6.200 4.027 1.00 0.00 C ATOM 1974 O PHE B 820 -8.647 -5.596 3.766 1.00 0.00 O ATOM 1975 CB PHE B 820 -5.628 -4.614 4.385 1.00 0.00 C ATOM 1976 CG PHE B 820 -5.435 -4.853 2.898 1.00 0.00 C ATOM 1977 CD1 PHE B 820 -4.888 -6.057 2.440 1.00 0.00 C ATOM 1978 CD2 PHE B 820 -5.795 -3.857 1.983 1.00 0.00 C ATOM 1979 CE1 PHE B 820 -4.708 -6.266 1.066 1.00 0.00 C ATOM 1980 CE2 PHE B 820 -5.614 -4.067 0.612 1.00 0.00 C ATOM 1981 CZ PHE B 820 -5.074 -5.272 0.153 1.00 0.00 C ATOM 0 H PHE B 820 -4.724 -6.587 5.406 1.00 0.00 H new ATOM 0 HA PHE B 820 -7.194 -5.160 5.804 1.00 0.00 H new ATOM 0 HB2 PHE B 820 -6.011 -3.606 4.542 1.00 0.00 H new ATOM 0 HB3 PHE B 820 -4.662 -4.670 4.888 1.00 0.00 H new ATOM 0 HD1 PHE B 820 -4.605 -6.825 3.145 1.00 0.00 H new ATOM 0 HD2 PHE B 820 -6.213 -2.926 2.336 1.00 0.00 H new ATOM 0 HE1 PHE B 820 -4.286 -7.195 0.712 1.00 0.00 H new ATOM 0 HE2 PHE B 820 -5.892 -3.297 -0.093 1.00 0.00 H new ATOM 0 HZ PHE B 820 -4.940 -5.435 -0.906 1.00 0.00 H new ATOM 1991 N PHE B 821 -7.364 -7.357 3.481 1.00 0.00 N ATOM 1992 CA PHE B 821 -8.323 -7.956 2.511 1.00 0.00 C ATOM 1993 C PHE B 821 -9.676 -8.206 3.185 1.00 0.00 C ATOM 1994 O PHE B 821 -10.707 -7.800 2.693 1.00 0.00 O ATOM 1995 CB PHE B 821 -7.677 -9.280 2.093 1.00 0.00 C ATOM 1996 CG PHE B 821 -8.054 -9.596 0.665 1.00 0.00 C ATOM 1997 CD1 PHE B 821 -9.397 -9.787 0.319 1.00 0.00 C ATOM 1998 CD2 PHE B 821 -7.058 -9.691 -0.316 1.00 0.00 C ATOM 1999 CE1 PHE B 821 -9.744 -10.077 -1.006 1.00 0.00 C ATOM 2000 CE2 PHE B 821 -7.406 -9.980 -1.641 1.00 0.00 C ATOM 2001 CZ PHE B 821 -8.749 -10.173 -1.986 1.00 0.00 C ATOM 0 H PHE B 821 -6.529 -7.912 3.665 1.00 0.00 H new ATOM 0 HA PHE B 821 -8.513 -7.304 1.658 1.00 0.00 H new ATOM 0 HB2 PHE B 821 -6.593 -9.214 2.188 1.00 0.00 H new ATOM 0 HB3 PHE B 821 -8.007 -10.082 2.753 1.00 0.00 H new ATOM 0 HD1 PHE B 821 -10.165 -9.711 1.074 1.00 0.00 H new ATOM 0 HD2 PHE B 821 -6.022 -9.541 -0.050 1.00 0.00 H new ATOM 0 HE1 PHE B 821 -10.780 -10.227 -1.272 1.00 0.00 H new ATOM 0 HE2 PHE B 821 -6.638 -10.054 -2.397 1.00 0.00 H new ATOM 0 HZ PHE B 821 -9.017 -10.396 -3.008 1.00 0.00 H new ATOM 2011 N SER B 822 -9.681 -8.855 4.317 1.00 0.00 N ATOM 2012 CA SER B 822 -10.973 -9.122 5.017 1.00 0.00 C ATOM 2013 C SER B 822 -11.793 -7.836 5.147 1.00 0.00 C ATOM 2014 O SER B 822 -13.004 -7.862 5.169 1.00 0.00 O ATOM 2015 CB SER B 822 -10.567 -9.632 6.402 1.00 0.00 C ATOM 2016 OG SER B 822 -10.275 -8.527 7.246 1.00 0.00 O ATOM 0 H SER B 822 -8.849 -9.212 4.788 1.00 0.00 H new ATOM 0 HA SER B 822 -11.592 -9.836 4.474 1.00 0.00 H new ATOM 0 HB2 SER B 822 -11.371 -10.229 6.832 1.00 0.00 H new ATOM 0 HB3 SER B 822 -9.696 -10.282 6.321 1.00 0.00 H new ATOM 0 HG SER B 822 -9.385 -8.178 7.032 1.00 0.00 H new ATOM 2022 N LYS B 823 -11.141 -6.715 5.273 1.00 0.00 N ATOM 2023 CA LYS B 823 -11.885 -5.431 5.402 1.00 0.00 C ATOM 2024 C LYS B 823 -12.323 -4.921 4.032 1.00 0.00 C ATOM 2025 O LYS B 823 -13.496 -4.848 3.737 1.00 0.00 O ATOM 2026 CB LYS B 823 -10.891 -4.456 6.028 1.00 0.00 C ATOM 2027 CG LYS B 823 -10.472 -4.967 7.409 1.00 0.00 C ATOM 2028 CD LYS B 823 -11.710 -5.117 8.297 1.00 0.00 C ATOM 2029 CE LYS B 823 -11.297 -5.017 9.766 1.00 0.00 C ATOM 2030 NZ LYS B 823 -12.561 -5.200 10.534 1.00 0.00 N ATOM 0 H LYS B 823 -10.125 -6.632 5.292 1.00 0.00 H new ATOM 0 HA LYS B 823 -12.787 -5.547 6.002 1.00 0.00 H new ATOM 0 HB2 LYS B 823 -10.016 -4.351 5.387 1.00 0.00 H new ATOM 0 HB3 LYS B 823 -11.342 -3.468 6.116 1.00 0.00 H new ATOM 0 HG2 LYS B 823 -9.962 -5.925 7.314 1.00 0.00 H new ATOM 0 HG3 LYS B 823 -9.766 -4.274 7.866 1.00 0.00 H new ATOM 0 HD2 LYS B 823 -12.438 -4.341 8.059 1.00 0.00 H new ATOM 0 HD3 LYS B 823 -12.193 -6.076 8.108 1.00 0.00 H new ATOM 0 HE2 LYS B 823 -10.564 -5.782 10.023 1.00 0.00 H new ATOM 0 HE3 LYS B 823 -10.839 -4.052 9.983 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 -12.359 -5.144 11.553 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 -13.237 -4.454 10.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 -12.970 -6.130 10.313 1.00 0.00 H new ATOM 2044 N ILE B 824 -11.388 -4.544 3.198 1.00 0.00 N ATOM 2045 CA ILE B 824 -11.761 -4.009 1.855 1.00 0.00 C ATOM 2046 C ILE B 824 -12.776 -4.928 1.161 1.00 0.00 C ATOM 2047 O ILE B 824 -13.731 -4.466 0.568 1.00 0.00 O ATOM 2048 CB ILE B 824 -10.461 -3.946 1.043 1.00 0.00 C ATOM 2049 CG1 ILE B 824 -9.705 -5.267 1.118 1.00 0.00 C ATOM 2050 CG2 ILE B 824 -9.565 -2.832 1.548 1.00 0.00 C ATOM 2051 CD1 ILE B 824 -9.891 -5.982 -0.209 1.00 0.00 C ATOM 0 H ILE B 824 -10.387 -4.583 3.388 1.00 0.00 H new ATOM 0 HA ILE B 824 -12.228 -3.028 1.943 1.00 0.00 H new ATOM 0 HB ILE B 824 -10.734 -3.749 0.006 1.00 0.00 H new ATOM 0 HG12 ILE B 824 -8.647 -5.092 1.313 1.00 0.00 H new ATOM 0 HG13 ILE B 824 -10.083 -5.878 1.938 1.00 0.00 H new ATOM 0 HG21 ILE B 824 -8.649 -2.806 0.958 1.00 0.00 H new ATOM 0 HG22 ILE B 824 -10.084 -1.878 1.456 1.00 0.00 H new ATOM 0 HG23 ILE B 824 -9.317 -3.010 2.594 1.00 0.00 H new ATOM 0 HD11 ILE B 824 -9.360 -6.934 -0.187 1.00 0.00 H new ATOM 0 HD12 ILE B 824 -10.952 -6.162 -0.380 1.00 0.00 H new ATOM 0 HD13 ILE B 824 -9.494 -5.364 -1.014 1.00 0.00 H new ATOM 2063 N LYS B 825 -12.583 -6.221 1.221 1.00 0.00 N ATOM 2064 CA LYS B 825 -13.565 -7.141 0.583 1.00 0.00 C ATOM 2065 C LYS B 825 -14.935 -6.921 1.202 1.00 0.00 C ATOM 2066 O LYS B 825 -15.923 -6.733 0.518 1.00 0.00 O ATOM 2067 CB LYS B 825 -13.078 -8.550 0.912 1.00 0.00 C ATOM 2068 CG LYS B 825 -13.290 -9.444 -0.302 1.00 0.00 C ATOM 2069 CD LYS B 825 -13.337 -10.899 0.139 1.00 0.00 C ATOM 2070 CE LYS B 825 -13.215 -11.792 -1.091 1.00 0.00 C ATOM 2071 NZ LYS B 825 -12.280 -12.879 -0.685 1.00 0.00 N ATOM 0 H LYS B 825 -11.794 -6.674 1.681 1.00 0.00 H new ATOM 0 HA LYS B 825 -13.643 -6.977 -0.492 1.00 0.00 H new ATOM 0 HB2 LYS B 825 -12.023 -8.529 1.185 1.00 0.00 H new ATOM 0 HB3 LYS B 825 -13.621 -8.945 1.770 1.00 0.00 H new ATOM 0 HG2 LYS B 825 -14.218 -9.176 -0.806 1.00 0.00 H new ATOM 0 HG3 LYS B 825 -12.483 -9.297 -1.020 1.00 0.00 H new ATOM 0 HD2 LYS B 825 -12.527 -11.107 0.838 1.00 0.00 H new ATOM 0 HD3 LYS B 825 -14.271 -11.104 0.663 1.00 0.00 H new ATOM 0 HE2 LYS B 825 -14.185 -12.194 -1.385 1.00 0.00 H new ATOM 0 HE3 LYS B 825 -12.828 -11.237 -1.945 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 -12.145 -13.536 -1.480 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 -11.364 -12.467 -0.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 -12.678 -13.394 0.126 1.00 0.00 H new ATOM 2085 N GLU B 826 -14.999 -6.953 2.500 1.00 0.00 N ATOM 2086 CA GLU B 826 -16.297 -6.732 3.186 1.00 0.00 C ATOM 2087 C GLU B 826 -16.694 -5.257 3.080 1.00 0.00 C ATOM 2088 O GLU B 826 -17.841 -4.898 3.257 1.00 0.00 O ATOM 2089 CB GLU B 826 -16.043 -7.132 4.639 1.00 0.00 C ATOM 2090 CG GLU B 826 -15.513 -8.571 4.691 1.00 0.00 C ATOM 2091 CD GLU B 826 -16.682 -9.550 4.562 1.00 0.00 C ATOM 2092 OE1 GLU B 826 -17.553 -9.517 5.416 1.00 0.00 O ATOM 2093 OE2 GLU B 826 -16.686 -10.316 3.613 1.00 0.00 O ATOM 0 H GLU B 826 -14.205 -7.123 3.118 1.00 0.00 H new ATOM 0 HA GLU B 826 -17.112 -7.309 2.748 1.00 0.00 H new ATOM 0 HB2 GLU B 826 -15.323 -6.452 5.094 1.00 0.00 H new ATOM 0 HB3 GLU B 826 -16.965 -7.052 5.215 1.00 0.00 H new ATOM 0 HG2 GLU B 826 -14.797 -8.735 3.886 1.00 0.00 H new ATOM 0 HG3 GLU B 826 -14.984 -8.741 5.629 1.00 0.00 H new ATOM 2100 N ALA B 827 -15.757 -4.403 2.754 1.00 0.00 N ATOM 2101 CA ALA B 827 -16.082 -2.958 2.604 1.00 0.00 C ATOM 2102 C ALA B 827 -16.700 -2.703 1.229 1.00 0.00 C ATOM 2103 O ALA B 827 -17.440 -1.759 1.033 1.00 0.00 O ATOM 2104 CB ALA B 827 -14.734 -2.244 2.717 1.00 0.00 C ATOM 0 H ALA B 827 -14.781 -4.647 2.586 1.00 0.00 H new ATOM 0 HA ALA B 827 -16.797 -2.611 3.350 1.00 0.00 H new ATOM 0 HB1 ALA B 827 -14.882 -1.169 2.617 1.00 0.00 H new ATOM 0 HB2 ALA B 827 -14.288 -2.460 3.688 1.00 0.00 H new ATOM 0 HB3 ALA B 827 -14.070 -2.594 1.927 1.00 0.00 H new ATOM 2110 N GLY B 828 -16.393 -3.537 0.273 1.00 0.00 N ATOM 2111 CA GLY B 828 -16.953 -3.348 -1.094 1.00 0.00 C ATOM 2112 C GLY B 828 -15.833 -2.936 -2.050 1.00 0.00 C ATOM 2113 O GLY B 828 -16.070 -2.320 -3.070 1.00 0.00 O ATOM 0 H GLY B 828 -15.777 -4.343 0.381 1.00 0.00 H new ATOM 0 HA2 GLY B 828 -17.419 -4.271 -1.439 1.00 0.00 H new ATOM 0 HA3 GLY B 828 -17.731 -2.585 -1.078 1.00 0.00 H new ATOM 2117 N LEU B 829 -14.610 -3.272 -1.732 1.00 0.00 N ATOM 2118 CA LEU B 829 -13.479 -2.887 -2.624 1.00 0.00 C ATOM 2119 C LEU B 829 -13.136 -4.019 -3.576 1.00 0.00 C ATOM 2120 O LEU B 829 -12.899 -3.809 -4.748 1.00 0.00 O ATOM 2121 CB LEU B 829 -12.295 -2.637 -1.694 1.00 0.00 C ATOM 2122 CG LEU B 829 -12.677 -1.712 -0.525 1.00 0.00 C ATOM 2123 CD1 LEU B 829 -11.411 -1.052 0.002 1.00 0.00 C ATOM 2124 CD2 LEU B 829 -13.642 -0.617 -0.984 1.00 0.00 C ATOM 0 H LEU B 829 -14.347 -3.794 -0.896 1.00 0.00 H new ATOM 0 HA LEU B 829 -13.731 -2.015 -3.227 1.00 0.00 H new ATOM 0 HB2 LEU B 829 -11.932 -3.587 -1.303 1.00 0.00 H new ATOM 0 HB3 LEU B 829 -11.476 -2.191 -2.259 1.00 0.00 H new ATOM 0 HG LEU B 829 -13.164 -2.306 0.248 1.00 0.00 H new ATOM 0 HD11 LEU B 829 -11.663 -0.392 0.832 1.00 0.00 H new ATOM 0 HD12 LEU B 829 -10.717 -1.819 0.346 1.00 0.00 H new ATOM 0 HD13 LEU B 829 -10.945 -0.472 -0.794 1.00 0.00 H new ATOM 0 HD21 LEU B 829 -13.896 0.022 -0.138 1.00 0.00 H new ATOM 0 HD22 LEU B 829 -13.169 -0.018 -1.763 1.00 0.00 H new ATOM 0 HD23 LEU B 829 -14.550 -1.074 -1.378 1.00 0.00 H new ATOM 2136 N ILE B 830 -13.032 -5.210 -3.066 1.00 0.00 N ATOM 2137 CA ILE B 830 -12.704 -6.354 -3.932 1.00 0.00 C ATOM 2138 C ILE B 830 -13.742 -7.429 -3.739 1.00 0.00 C ATOM 2139 O ILE B 830 -13.438 -8.557 -3.404 1.00 0.00 O ATOM 2140 CB ILE B 830 -11.339 -6.854 -3.479 1.00 0.00 C ATOM 2141 CG1 ILE B 830 -10.354 -5.685 -3.451 1.00 0.00 C ATOM 2142 CG2 ILE B 830 -10.856 -7.930 -4.455 1.00 0.00 C ATOM 2143 CD1 ILE B 830 -8.949 -6.209 -3.149 1.00 0.00 C ATOM 0 H ILE B 830 -13.162 -5.435 -2.080 1.00 0.00 H new ATOM 0 HA ILE B 830 -12.688 -6.079 -4.987 1.00 0.00 H new ATOM 0 HB ILE B 830 -11.408 -7.280 -2.478 1.00 0.00 H new ATOM 0 HG12 ILE B 830 -10.362 -5.166 -4.409 1.00 0.00 H new ATOM 0 HG13 ILE B 830 -10.654 -4.961 -2.694 1.00 0.00 H new ATOM 0 HG21 ILE B 830 -9.879 -8.295 -4.140 1.00 0.00 H new ATOM 0 HG22 ILE B 830 -11.566 -8.757 -4.466 1.00 0.00 H new ATOM 0 HG23 ILE B 830 -10.779 -7.505 -5.456 1.00 0.00 H new ATOM 0 HD11 ILE B 830 -8.246 -5.376 -3.129 1.00 0.00 H new ATOM 0 HD12 ILE B 830 -8.947 -6.708 -2.180 1.00 0.00 H new ATOM 0 HD13 ILE B 830 -8.651 -6.917 -3.922 1.00 0.00 H new