USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=31 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 800 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: B 810 TYR OH : rot 180:sc= -0.412 USER MOD Set 2.1: B 798 ASN : amide:sc= -7.3! C(o=-7.9!,f=-11!) USER MOD Set 2.2: B 799 CYS SG : rot -172:sc= -0.629 USER MOD Set 3.1: B 734 SER OG : rot 180:sc= 0.118 USER MOD Set 3.2: B 823 LYS NZ :NH3+ -137:sc= 0.121 (180deg=0) USER MOD Set 4.1: B 733 LYS NZ :NH3+ 145:sc= -0.218 (180deg=-0.425) USER MOD Set 4.2: B 737 GLN : amide:sc= -0.293 X(o=-0.51,f=-0.3) USER MOD Single : B 727 GLN : amide:sc= -0.587 K(o=-0.59,f=-1.4!) USER MOD Single : B 729 TYR OH : rot 180:sc= 0 USER MOD Single : B 730 SER OG : rot -91:sc= 0.109 USER MOD Single : B 731 THR OG1 : rot 75:sc= 0.916 USER MOD Single : B 738 GLN : amide:sc= -4.17! K(o=-4.2!,f=-2.8) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot -31:sc= 0.874 USER MOD Single : B 742 HIS : no HE2:sc= -2.6 K(o=-2.6,f=-3.6!) USER MOD Single : B 743 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD Single : B 744 SER OG : rot 110:sc= -0.561 USER MOD Single : B 749 MET CE :methyl 173:sc= -3.58! (180deg=-3.74!) USER MOD Single : B 760 TYR OH : rot 9:sc= -1.78 USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl -123:sc= -1.82 (180deg=-3.63!) USER MOD Single : B 771 LYS NZ :NH3+ -115:sc= 0.226 (180deg=0) USER MOD Single : B 772 THR OG1 : rot 180:sc= -0.298 USER MOD Single : B 773 MET CE :methyl -114:sc= -5.87! (180deg=-8.94!) USER MOD Single : B 774 SER OG : rot -92:sc= 0.816 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) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot 180:sc= 0 USER MOD Single : B 784 SER OG : rot -21:sc= 0.413 USER MOD Single : B 785 LYS NZ :NH3+ -155:sc= -2.2! (180deg=-3.32!) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl -178:sc= -6.29! (180deg=-6.46!) USER MOD Single : B 793 GLN : amide:sc= -2.82! C(o=-2.8!,f=-5.1!) USER MOD Single : B 797 THR OG1 : rot 180:sc= 0 USER MOD Single : B 802 TYR OH : rot 180:sc= 0 USER MOD Single : B 803 ASN : amide:sc= -4.11 K(o=-4.1,f=-6.2!) 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 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 812 CYS SG : rot 29:sc= -1.71 USER MOD Single : B 814 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 818 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 822 SER OG : rot 180:sc= 0 USER MOD Single : B 825 LYS NZ :NH3+ -177:sc= -0.875! (180deg=-0.912!) USER MOD ----------------------------------------------------------------- ATOM 303 N GLU B 721 16.988 -1.011 -7.555 1.00 0.00 N ATOM 304 CA GLU B 721 16.834 -2.449 -7.193 1.00 0.00 C ATOM 305 C GLU B 721 17.606 -2.763 -5.908 1.00 0.00 C ATOM 306 O GLU B 721 18.639 -2.183 -5.660 1.00 0.00 O ATOM 307 CB GLU B 721 17.430 -3.217 -8.375 1.00 0.00 C ATOM 308 CG GLU B 721 16.440 -3.209 -9.542 1.00 0.00 C ATOM 309 CD GLU B 721 17.157 -2.760 -10.817 1.00 0.00 C ATOM 310 OE1 GLU B 721 17.558 -1.609 -10.874 1.00 0.00 O ATOM 311 OE2 GLU B 721 17.293 -3.575 -11.714 1.00 0.00 O ATOM 0 HA GLU B 721 15.794 -2.718 -7.009 1.00 0.00 H new ATOM 0 HB2 GLU B 721 18.372 -2.761 -8.680 1.00 0.00 H new ATOM 0 HB3 GLU B 721 17.653 -4.243 -8.081 1.00 0.00 H new ATOM 0 HG2 GLU B 721 16.017 -4.204 -9.681 1.00 0.00 H new ATOM 0 HG3 GLU B 721 15.609 -2.538 -9.324 1.00 0.00 H new ATOM 318 N PRO B 722 17.061 -3.653 -5.114 1.00 0.00 N ATOM 319 CA PRO B 722 17.720 -4.047 -3.846 1.00 0.00 C ATOM 320 C PRO B 722 19.003 -4.816 -4.128 1.00 0.00 C ATOM 321 O PRO B 722 18.984 -5.956 -4.550 1.00 0.00 O ATOM 322 CB PRO B 722 16.703 -4.964 -3.182 1.00 0.00 C ATOM 323 CG PRO B 722 15.912 -5.505 -4.316 1.00 0.00 C ATOM 324 CD PRO B 722 15.820 -4.399 -5.328 1.00 0.00 C ATOM 0 HA PRO B 722 17.995 -3.190 -3.231 1.00 0.00 H new ATOM 0 HB2 PRO B 722 17.191 -5.760 -2.620 1.00 0.00 H new ATOM 0 HB3 PRO B 722 16.072 -4.419 -2.480 1.00 0.00 H new ATOM 0 HG2 PRO B 722 16.395 -6.384 -4.743 1.00 0.00 H new ATOM 0 HG3 PRO B 722 14.920 -5.814 -3.986 1.00 0.00 H new ATOM 0 HD2 PRO B 722 15.752 -4.787 -6.344 1.00 0.00 H new ATOM 0 HD3 PRO B 722 14.941 -3.775 -5.165 1.00 0.00 H new ATOM 332 N ARG B 723 20.110 -4.201 -3.885 1.00 0.00 N ATOM 333 CA ARG B 723 21.415 -4.883 -4.113 1.00 0.00 C ATOM 334 C ARG B 723 21.506 -6.132 -3.235 1.00 0.00 C ATOM 335 O ARG B 723 22.218 -7.069 -3.538 1.00 0.00 O ATOM 336 CB ARG B 723 22.475 -3.860 -3.700 1.00 0.00 C ATOM 337 CG ARG B 723 22.774 -2.934 -4.880 1.00 0.00 C ATOM 338 CD ARG B 723 21.650 -1.907 -5.018 1.00 0.00 C ATOM 339 NE ARG B 723 21.673 -1.142 -3.737 1.00 0.00 N ATOM 340 CZ ARG B 723 22.627 -0.276 -3.485 1.00 0.00 C ATOM 341 NH1 ARG B 723 23.586 -0.056 -4.351 1.00 0.00 N ATOM 342 NH2 ARG B 723 22.621 0.377 -2.355 1.00 0.00 N ATOM 0 H ARG B 723 20.178 -3.245 -3.535 1.00 0.00 H new ATOM 0 HA ARG B 723 21.543 -5.204 -5.147 1.00 0.00 H new ATOM 0 HB2 ARG B 723 22.123 -3.279 -2.848 1.00 0.00 H new ATOM 0 HB3 ARG B 723 23.385 -4.370 -3.384 1.00 0.00 H new ATOM 0 HG2 ARG B 723 23.727 -2.428 -4.727 1.00 0.00 H new ATOM 0 HG3 ARG B 723 22.866 -3.515 -5.798 1.00 0.00 H new ATOM 0 HD2 ARG B 723 21.816 -1.252 -5.873 1.00 0.00 H new ATOM 0 HD3 ARG B 723 20.687 -2.393 -5.171 1.00 0.00 H new ATOM 0 HE ARG B 723 20.937 -1.294 -3.047 1.00 0.00 H new ATOM 0 HH11 ARG B 723 23.599 -0.561 -5.237 1.00 0.00 H new ATOM 0 HH12 ARG B 723 24.319 0.620 -4.139 1.00 0.00 H new ATOM 0 HH21 ARG B 723 21.879 0.213 -1.675 1.00 0.00 H new ATOM 0 HH22 ARG B 723 23.359 1.051 -2.152 1.00 0.00 H new ATOM 356 N ASP B 724 20.777 -6.154 -2.154 1.00 0.00 N ATOM 357 CA ASP B 724 20.798 -7.342 -1.259 1.00 0.00 C ATOM 358 C ASP B 724 19.395 -7.581 -0.680 1.00 0.00 C ATOM 359 O ASP B 724 18.814 -6.687 -0.099 1.00 0.00 O ATOM 360 CB ASP B 724 21.781 -6.977 -0.146 1.00 0.00 C ATOM 361 CG ASP B 724 23.179 -7.475 -0.519 1.00 0.00 C ATOM 362 OD1 ASP B 724 23.864 -6.770 -1.243 1.00 0.00 O ATOM 363 OD2 ASP B 724 23.541 -8.552 -0.076 1.00 0.00 O ATOM 0 H ASP B 724 20.165 -5.396 -1.852 1.00 0.00 H new ATOM 0 HA ASP B 724 21.092 -8.254 -1.779 1.00 0.00 H new ATOM 0 HB2 ASP B 724 21.795 -5.897 0.002 1.00 0.00 H new ATOM 0 HB3 ASP B 724 21.463 -7.424 0.796 1.00 0.00 H new ATOM 368 N PRO B 725 18.877 -8.772 -0.873 1.00 0.00 N ATOM 369 CA PRO B 725 17.524 -9.094 -0.358 1.00 0.00 C ATOM 370 C PRO B 725 17.459 -8.863 1.153 1.00 0.00 C ATOM 371 O PRO B 725 16.442 -8.464 1.686 1.00 0.00 O ATOM 372 CB PRO B 725 17.337 -10.579 -0.684 1.00 0.00 C ATOM 373 CG PRO B 725 18.694 -11.089 -1.058 1.00 0.00 C ATOM 374 CD PRO B 725 19.488 -9.916 -1.558 1.00 0.00 C ATOM 0 HA PRO B 725 16.748 -8.470 -0.802 1.00 0.00 H new ATOM 0 HB2 PRO B 725 16.939 -11.120 0.174 1.00 0.00 H new ATOM 0 HB3 PRO B 725 16.630 -10.714 -1.502 1.00 0.00 H new ATOM 0 HG2 PRO B 725 19.183 -11.546 -0.198 1.00 0.00 H new ATOM 0 HG3 PRO B 725 18.617 -11.858 -1.827 1.00 0.00 H new ATOM 0 HD2 PRO B 725 20.545 -10.013 -1.312 1.00 0.00 H new ATOM 0 HD3 PRO B 725 19.420 -9.818 -2.641 1.00 0.00 H new ATOM 382 N ASP B 726 18.536 -9.107 1.847 1.00 0.00 N ATOM 383 CA ASP B 726 18.536 -8.894 3.321 1.00 0.00 C ATOM 384 C ASP B 726 18.527 -7.398 3.637 1.00 0.00 C ATOM 385 O ASP B 726 17.781 -6.935 4.477 1.00 0.00 O ATOM 386 CB ASP B 726 19.834 -9.538 3.811 1.00 0.00 C ATOM 387 CG ASP B 726 19.527 -10.915 4.403 1.00 0.00 C ATOM 388 OD1 ASP B 726 19.178 -10.972 5.570 1.00 0.00 O ATOM 389 OD2 ASP B 726 19.647 -11.889 3.678 1.00 0.00 O ATOM 0 H ASP B 726 19.416 -9.445 1.457 1.00 0.00 H new ATOM 0 HA ASP B 726 17.659 -9.325 3.803 1.00 0.00 H new ATOM 0 HB2 ASP B 726 20.539 -9.634 2.986 1.00 0.00 H new ATOM 0 HB3 ASP B 726 20.306 -8.904 4.562 1.00 0.00 H new ATOM 394 N GLN B 727 19.346 -6.634 2.967 1.00 0.00 N ATOM 395 CA GLN B 727 19.367 -5.168 3.225 1.00 0.00 C ATOM 396 C GLN B 727 17.961 -4.589 3.058 1.00 0.00 C ATOM 397 O GLN B 727 17.533 -3.740 3.815 1.00 0.00 O ATOM 398 CB GLN B 727 20.312 -4.596 2.168 1.00 0.00 C ATOM 399 CG GLN B 727 21.729 -5.118 2.414 1.00 0.00 C ATOM 400 CD GLN B 727 22.198 -4.688 3.805 1.00 0.00 C ATOM 401 OE1 GLN B 727 21.896 -5.335 4.788 1.00 0.00 O ATOM 402 NE2 GLN B 727 22.932 -3.616 3.930 1.00 0.00 N ATOM 0 H GLN B 727 19.999 -6.961 2.255 1.00 0.00 H new ATOM 0 HA GLN B 727 19.694 -4.927 4.236 1.00 0.00 H new ATOM 0 HB2 GLN B 727 19.976 -4.882 1.171 1.00 0.00 H new ATOM 0 HB3 GLN B 727 20.302 -3.507 2.207 1.00 0.00 H new ATOM 0 HG2 GLN B 727 21.747 -6.205 2.333 1.00 0.00 H new ATOM 0 HG3 GLN B 727 22.408 -4.730 1.654 1.00 0.00 H new ATOM 0 HE21 GLN B 727 23.186 -3.073 3.105 1.00 0.00 H new ATOM 0 HE22 GLN B 727 23.252 -3.322 4.853 1.00 0.00 H new ATOM 411 N LEU B 728 17.234 -5.052 2.077 1.00 0.00 N ATOM 412 CA LEU B 728 15.848 -4.546 1.871 1.00 0.00 C ATOM 413 C LEU B 728 14.885 -5.235 2.840 1.00 0.00 C ATOM 414 O LEU B 728 13.825 -4.729 3.140 1.00 0.00 O ATOM 415 CB LEU B 728 15.497 -4.922 0.425 1.00 0.00 C ATOM 416 CG LEU B 728 15.014 -3.690 -0.350 1.00 0.00 C ATOM 417 CD1 LEU B 728 13.878 -3.014 0.414 1.00 0.00 C ATOM 418 CD2 LEU B 728 16.175 -2.707 -0.530 1.00 0.00 C ATOM 0 H LEU B 728 17.541 -5.759 1.409 1.00 0.00 H new ATOM 0 HA LEU B 728 15.773 -3.473 2.048 1.00 0.00 H new ATOM 0 HB2 LEU B 728 16.370 -5.349 -0.068 1.00 0.00 H new ATOM 0 HB3 LEU B 728 14.722 -5.688 0.421 1.00 0.00 H new ATOM 0 HG LEU B 728 14.651 -4.000 -1.330 1.00 0.00 H new ATOM 0 HD11 LEU B 728 13.537 -2.139 -0.140 1.00 0.00 H new ATOM 0 HD12 LEU B 728 13.051 -3.714 0.531 1.00 0.00 H new ATOM 0 HD13 LEU B 728 14.234 -2.705 1.397 1.00 0.00 H new ATOM 0 HD21 LEU B 728 15.829 -1.832 -1.081 1.00 0.00 H new ATOM 0 HD22 LEU B 728 16.544 -2.397 0.448 1.00 0.00 H new ATOM 0 HD23 LEU B 728 16.979 -3.191 -1.085 1.00 0.00 H new ATOM 430 N TYR B 729 15.238 -6.395 3.327 1.00 0.00 N ATOM 431 CA TYR B 729 14.329 -7.117 4.264 1.00 0.00 C ATOM 432 C TYR B 729 13.904 -6.194 5.403 1.00 0.00 C ATOM 433 O TYR B 729 12.732 -5.945 5.614 1.00 0.00 O ATOM 434 CB TYR B 729 15.161 -8.280 4.807 1.00 0.00 C ATOM 435 CG TYR B 729 14.316 -9.098 5.753 1.00 0.00 C ATOM 436 CD1 TYR B 729 14.101 -8.653 7.063 1.00 0.00 C ATOM 437 CD2 TYR B 729 13.743 -10.299 5.319 1.00 0.00 C ATOM 438 CE1 TYR B 729 13.315 -9.411 7.940 1.00 0.00 C ATOM 439 CE2 TYR B 729 12.957 -11.057 6.195 1.00 0.00 C ATOM 440 CZ TYR B 729 12.743 -10.613 7.506 1.00 0.00 C ATOM 441 OH TYR B 729 11.968 -11.359 8.369 1.00 0.00 O ATOM 0 H TYR B 729 16.114 -6.873 3.117 1.00 0.00 H new ATOM 0 HA TYR B 729 13.419 -7.459 3.772 1.00 0.00 H new ATOM 0 HB2 TYR B 729 15.515 -8.903 3.986 1.00 0.00 H new ATOM 0 HB3 TYR B 729 16.043 -7.901 5.324 1.00 0.00 H new ATOM 0 HD1 TYR B 729 14.541 -7.725 7.397 1.00 0.00 H new ATOM 0 HD2 TYR B 729 13.907 -10.641 4.308 1.00 0.00 H new ATOM 0 HE1 TYR B 729 13.150 -9.068 8.951 1.00 0.00 H new ATOM 0 HE2 TYR B 729 12.516 -11.984 5.860 1.00 0.00 H new ATOM 0 HH TYR B 729 11.647 -12.163 7.909 1.00 0.00 H new ATOM 451 N SER B 730 14.849 -5.669 6.127 1.00 0.00 N ATOM 452 CA SER B 730 14.497 -4.752 7.244 1.00 0.00 C ATOM 453 C SER B 730 13.985 -3.422 6.692 1.00 0.00 C ATOM 454 O SER B 730 13.257 -2.709 7.354 1.00 0.00 O ATOM 455 CB SER B 730 15.784 -4.544 8.044 1.00 0.00 C ATOM 456 OG SER B 730 16.917 -4.896 7.261 1.00 0.00 O ATOM 0 H SER B 730 15.847 -5.834 5.995 1.00 0.00 H new ATOM 0 HA SER B 730 13.707 -5.166 7.870 1.00 0.00 H new ATOM 0 HB2 SER B 730 15.860 -3.503 8.358 1.00 0.00 H new ATOM 0 HB3 SER B 730 15.758 -5.149 8.950 1.00 0.00 H new ATOM 0 HG SER B 730 17.135 -5.840 7.407 1.00 0.00 H new ATOM 462 N THR B 731 14.344 -3.082 5.482 1.00 0.00 N ATOM 463 CA THR B 731 13.837 -1.808 4.903 1.00 0.00 C ATOM 464 C THR B 731 12.316 -1.863 4.823 1.00 0.00 C ATOM 465 O THR B 731 11.625 -1.041 5.392 1.00 0.00 O ATOM 466 CB THR B 731 14.437 -1.712 3.501 1.00 0.00 C ATOM 467 OG1 THR B 731 15.852 -1.629 3.593 1.00 0.00 O ATOM 468 CG2 THR B 731 13.891 -0.457 2.813 1.00 0.00 C ATOM 0 H THR B 731 14.959 -3.626 4.877 1.00 0.00 H new ATOM 0 HA THR B 731 14.113 -0.944 5.508 1.00 0.00 H new ATOM 0 HB THR B 731 14.169 -2.596 2.923 1.00 0.00 H new ATOM 0 HG1 THR B 731 16.218 -2.512 3.810 1.00 0.00 H new ATOM 0 HG21 THR B 731 14.313 -0.379 1.811 1.00 0.00 H new ATOM 0 HG22 THR B 731 12.805 -0.522 2.745 1.00 0.00 H new ATOM 0 HG23 THR B 731 14.166 0.424 3.392 1.00 0.00 H new ATOM 476 N LEU B 732 11.783 -2.837 4.133 1.00 0.00 N ATOM 477 CA LEU B 732 10.300 -2.962 4.069 1.00 0.00 C ATOM 478 C LEU B 732 9.762 -3.074 5.492 1.00 0.00 C ATOM 479 O LEU B 732 8.832 -2.400 5.872 1.00 0.00 O ATOM 480 CB LEU B 732 10.005 -4.256 3.290 1.00 0.00 C ATOM 481 CG LEU B 732 10.854 -4.360 2.010 1.00 0.00 C ATOM 482 CD1 LEU B 732 10.238 -5.423 1.104 1.00 0.00 C ATOM 483 CD2 LEU B 732 10.892 -3.023 1.261 1.00 0.00 C ATOM 0 H LEU B 732 12.306 -3.544 3.616 1.00 0.00 H new ATOM 0 HA LEU B 732 9.834 -2.104 3.584 1.00 0.00 H new ATOM 0 HB2 LEU B 732 10.203 -5.117 3.928 1.00 0.00 H new ATOM 0 HB3 LEU B 732 8.947 -4.289 3.028 1.00 0.00 H new ATOM 0 HG LEU B 732 11.874 -4.627 2.285 1.00 0.00 H new ATOM 0 HD11 LEU B 732 10.828 -5.510 0.192 1.00 0.00 H new ATOM 0 HD12 LEU B 732 10.229 -6.382 1.622 1.00 0.00 H new ATOM 0 HD13 LEU B 732 9.217 -5.138 0.850 1.00 0.00 H new ATOM 0 HD21 LEU B 732 11.499 -3.127 0.362 1.00 0.00 H new ATOM 0 HD22 LEU B 732 9.879 -2.732 0.984 1.00 0.00 H new ATOM 0 HD23 LEU B 732 11.326 -2.258 1.905 1.00 0.00 H new ATOM 495 N LYS B 733 10.389 -3.887 6.296 1.00 0.00 N ATOM 496 CA LYS B 733 9.965 -4.017 7.718 1.00 0.00 C ATOM 497 C LYS B 733 9.906 -2.639 8.369 1.00 0.00 C ATOM 498 O LYS B 733 9.030 -2.353 9.152 1.00 0.00 O ATOM 499 CB LYS B 733 11.064 -4.856 8.363 1.00 0.00 C ATOM 500 CG LYS B 733 10.528 -6.254 8.676 1.00 0.00 C ATOM 501 CD LYS B 733 10.582 -6.500 10.186 1.00 0.00 C ATOM 502 CE LYS B 733 9.211 -6.970 10.678 1.00 0.00 C ATOM 503 NZ LYS B 733 8.804 -5.960 11.695 1.00 0.00 N ATOM 0 H LYS B 733 11.181 -4.470 6.027 1.00 0.00 H new ATOM 0 HA LYS B 733 8.978 -4.467 7.825 1.00 0.00 H new ATOM 0 HB2 LYS B 733 11.922 -4.926 7.694 1.00 0.00 H new ATOM 0 HB3 LYS B 733 11.412 -4.376 9.278 1.00 0.00 H new ATOM 0 HG2 LYS B 733 9.503 -6.350 8.318 1.00 0.00 H new ATOM 0 HG3 LYS B 733 11.119 -7.006 8.154 1.00 0.00 H new ATOM 0 HD2 LYS B 733 11.339 -7.250 10.416 1.00 0.00 H new ATOM 0 HD3 LYS B 733 10.872 -5.586 10.704 1.00 0.00 H new ATOM 0 HE2 LYS B 733 8.493 -7.019 9.860 1.00 0.00 H new ATOM 0 HE3 LYS B 733 9.268 -7.968 11.112 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 7.774 -5.819 11.652 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 9.068 -6.296 12.643 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 9.285 -5.059 11.501 1.00 0.00 H new ATOM 517 N SER B 734 10.836 -1.783 8.043 1.00 0.00 N ATOM 518 CA SER B 734 10.830 -0.413 8.629 1.00 0.00 C ATOM 519 C SER B 734 9.668 0.398 8.054 1.00 0.00 C ATOM 520 O SER B 734 8.771 0.806 8.765 1.00 0.00 O ATOM 521 CB SER B 734 12.168 0.199 8.212 1.00 0.00 C ATOM 522 OG SER B 734 12.534 1.212 9.136 1.00 0.00 O ATOM 0 H SER B 734 11.600 -1.974 7.395 1.00 0.00 H new ATOM 0 HA SER B 734 10.706 -0.425 9.712 1.00 0.00 H new ATOM 0 HB2 SER B 734 12.938 -0.572 8.178 1.00 0.00 H new ATOM 0 HB3 SER B 734 12.091 0.618 7.209 1.00 0.00 H new ATOM 0 HG SER B 734 13.392 1.603 8.870 1.00 0.00 H new ATOM 528 N ILE B 735 9.663 0.619 6.765 1.00 0.00 N ATOM 529 CA ILE B 735 8.547 1.387 6.139 1.00 0.00 C ATOM 530 C ILE B 735 7.199 0.808 6.581 1.00 0.00 C ATOM 531 O ILE B 735 6.267 1.525 6.887 1.00 0.00 O ATOM 532 CB ILE B 735 8.738 1.195 4.630 1.00 0.00 C ATOM 533 CG1 ILE B 735 10.046 1.856 4.187 1.00 0.00 C ATOM 534 CG2 ILE B 735 7.571 1.837 3.878 1.00 0.00 C ATOM 535 CD1 ILE B 735 10.972 0.805 3.570 1.00 0.00 C ATOM 0 H ILE B 735 10.385 0.300 6.119 1.00 0.00 H new ATOM 0 HA ILE B 735 8.555 2.439 6.425 1.00 0.00 H new ATOM 0 HB ILE B 735 8.774 0.128 4.408 1.00 0.00 H new ATOM 0 HG12 ILE B 735 9.839 2.643 3.462 1.00 0.00 H new ATOM 0 HG13 ILE B 735 10.533 2.328 5.040 1.00 0.00 H new ATOM 0 HG21 ILE B 735 7.709 1.699 2.806 1.00 0.00 H new ATOM 0 HG22 ILE B 735 6.637 1.368 4.187 1.00 0.00 H new ATOM 0 HG23 ILE B 735 7.534 2.902 4.105 1.00 0.00 H new ATOM 0 HD11 ILE B 735 11.902 1.279 3.256 1.00 0.00 H new ATOM 0 HD12 ILE B 735 11.189 0.033 4.308 1.00 0.00 H new ATOM 0 HD13 ILE B 735 10.485 0.353 2.706 1.00 0.00 H new ATOM 547 N LEU B 736 7.100 -0.492 6.622 1.00 0.00 N ATOM 548 CA LEU B 736 5.829 -1.139 7.050 1.00 0.00 C ATOM 549 C LEU B 736 5.636 -0.974 8.555 1.00 0.00 C ATOM 550 O LEU B 736 4.577 -0.604 9.017 1.00 0.00 O ATOM 551 CB LEU B 736 6.007 -2.614 6.703 1.00 0.00 C ATOM 552 CG LEU B 736 4.657 -3.217 6.310 1.00 0.00 C ATOM 553 CD1 LEU B 736 3.672 -3.067 7.472 1.00 0.00 C ATOM 554 CD2 LEU B 736 4.110 -2.490 5.080 1.00 0.00 C ATOM 0 H LEU B 736 7.850 -1.138 6.376 1.00 0.00 H new ATOM 0 HA LEU B 736 4.958 -0.701 6.563 1.00 0.00 H new ATOM 0 HB2 LEU B 736 6.717 -2.722 5.883 1.00 0.00 H new ATOM 0 HB3 LEU B 736 6.422 -3.151 7.556 1.00 0.00 H new ATOM 0 HG LEU B 736 4.787 -4.274 6.078 1.00 0.00 H new ATOM 0 HD11 LEU B 736 2.710 -3.497 7.192 1.00 0.00 H new ATOM 0 HD12 LEU B 736 4.060 -3.587 8.348 1.00 0.00 H new ATOM 0 HD13 LEU B 736 3.543 -2.010 7.705 1.00 0.00 H new ATOM 0 HD21 LEU B 736 3.148 -2.920 4.801 1.00 0.00 H new ATOM 0 HD22 LEU B 736 3.981 -1.432 5.310 1.00 0.00 H new ATOM 0 HD23 LEU B 736 4.810 -2.599 4.252 1.00 0.00 H new ATOM 566 N GLN B 737 6.659 -1.241 9.325 1.00 0.00 N ATOM 567 CA GLN B 737 6.532 -1.106 10.809 1.00 0.00 C ATOM 568 C GLN B 737 5.895 0.235 11.179 1.00 0.00 C ATOM 569 O GLN B 737 5.046 0.310 12.045 1.00 0.00 O ATOM 570 CB GLN B 737 7.963 -1.166 11.349 1.00 0.00 C ATOM 571 CG GLN B 737 8.315 -2.612 11.709 1.00 0.00 C ATOM 572 CD GLN B 737 8.406 -2.749 13.230 1.00 0.00 C ATOM 573 OE1 GLN B 737 9.281 -3.421 13.739 1.00 0.00 O ATOM 574 NE2 GLN B 737 7.534 -2.135 13.982 1.00 0.00 N ATOM 0 H GLN B 737 7.574 -1.546 8.993 1.00 0.00 H new ATOM 0 HA GLN B 737 5.899 -1.889 11.226 1.00 0.00 H new ATOM 0 HB2 GLN B 737 8.661 -0.786 10.602 1.00 0.00 H new ATOM 0 HB3 GLN B 737 8.058 -0.528 12.228 1.00 0.00 H new ATOM 0 HG2 GLN B 737 7.558 -3.291 11.316 1.00 0.00 H new ATOM 0 HG3 GLN B 737 9.263 -2.892 11.250 1.00 0.00 H new ATOM 0 HE21 GLN B 737 6.799 -1.571 13.555 1.00 0.00 H new ATOM 0 HE22 GLN B 737 7.587 -2.219 14.997 1.00 0.00 H new ATOM 583 N GLN B 738 6.334 1.303 10.569 1.00 0.00 N ATOM 584 CA GLN B 738 5.737 2.628 10.893 1.00 0.00 C ATOM 585 C GLN B 738 4.429 2.818 10.122 1.00 0.00 C ATOM 586 O GLN B 738 3.562 3.569 10.520 1.00 0.00 O ATOM 587 CB GLN B 738 6.786 3.656 10.465 1.00 0.00 C ATOM 588 CG GLN B 738 7.129 3.471 8.990 1.00 0.00 C ATOM 589 CD GLN B 738 7.391 4.839 8.374 1.00 0.00 C ATOM 590 OE1 GLN B 738 7.884 5.730 9.037 1.00 0.00 O ATOM 591 NE2 GLN B 738 7.064 5.058 7.136 1.00 0.00 N ATOM 0 H GLN B 738 7.074 1.315 9.867 1.00 0.00 H new ATOM 0 HA GLN B 738 5.492 2.727 11.951 1.00 0.00 H new ATOM 0 HB2 GLN B 738 6.409 4.664 10.635 1.00 0.00 H new ATOM 0 HB3 GLN B 738 7.684 3.545 11.072 1.00 0.00 H new ATOM 0 HG2 GLN B 738 8.007 2.834 8.883 1.00 0.00 H new ATOM 0 HG3 GLN B 738 6.310 2.974 8.471 1.00 0.00 H new ATOM 0 HE21 GLN B 738 6.650 4.311 6.578 1.00 0.00 H new ATOM 0 HE22 GLN B 738 7.221 5.977 6.722 1.00 0.00 H new ATOM 600 N VAL B 739 4.275 2.122 9.029 1.00 0.00 N ATOM 601 CA VAL B 739 3.025 2.242 8.229 1.00 0.00 C ATOM 602 C VAL B 739 1.911 1.410 8.880 1.00 0.00 C ATOM 603 O VAL B 739 0.763 1.806 8.914 1.00 0.00 O ATOM 604 CB VAL B 739 3.430 1.703 6.842 1.00 0.00 C ATOM 605 CG1 VAL B 739 2.228 1.123 6.085 1.00 0.00 C ATOM 606 CG2 VAL B 739 4.036 2.842 6.019 1.00 0.00 C ATOM 0 H VAL B 739 4.966 1.472 8.654 1.00 0.00 H new ATOM 0 HA VAL B 739 2.632 3.257 8.164 1.00 0.00 H new ATOM 0 HB VAL B 739 4.156 0.903 6.989 1.00 0.00 H new ATOM 0 HG11 VAL B 739 2.554 0.754 5.113 1.00 0.00 H new ATOM 0 HG12 VAL B 739 1.798 0.302 6.659 1.00 0.00 H new ATOM 0 HG13 VAL B 739 1.477 1.900 5.945 1.00 0.00 H new ATOM 0 HG21 VAL B 739 4.325 2.468 5.037 1.00 0.00 H new ATOM 0 HG22 VAL B 739 3.300 3.638 5.902 1.00 0.00 H new ATOM 0 HG23 VAL B 739 4.915 3.233 6.531 1.00 0.00 H new ATOM 616 N LYS B 740 2.245 0.263 9.392 1.00 0.00 N ATOM 617 CA LYS B 740 1.218 -0.589 10.047 1.00 0.00 C ATOM 618 C LYS B 740 0.532 0.185 11.177 1.00 0.00 C ATOM 619 O LYS B 740 -0.678 0.269 11.241 1.00 0.00 O ATOM 620 CB LYS B 740 2.011 -1.767 10.608 1.00 0.00 C ATOM 621 CG LYS B 740 1.088 -2.663 11.437 1.00 0.00 C ATOM 622 CD LYS B 740 1.564 -2.682 12.891 1.00 0.00 C ATOM 623 CE LYS B 740 1.217 -4.031 13.523 1.00 0.00 C ATOM 624 NZ LYS B 740 2.508 -4.774 13.565 1.00 0.00 N ATOM 0 H LYS B 740 3.189 -0.124 9.386 1.00 0.00 H new ATOM 0 HA LYS B 740 0.432 -0.906 9.362 1.00 0.00 H new ATOM 0 HB2 LYS B 740 2.454 -2.340 9.794 1.00 0.00 H new ATOM 0 HB3 LYS B 740 2.832 -1.404 11.226 1.00 0.00 H new ATOM 0 HG2 LYS B 740 0.063 -2.295 11.384 1.00 0.00 H new ATOM 0 HG3 LYS B 740 1.085 -3.675 11.031 1.00 0.00 H new ATOM 0 HD2 LYS B 740 2.640 -2.514 12.935 1.00 0.00 H new ATOM 0 HD3 LYS B 740 1.092 -1.874 13.450 1.00 0.00 H new ATOM 0 HE2 LYS B 740 0.801 -3.904 14.522 1.00 0.00 H new ATOM 0 HE3 LYS B 740 0.472 -4.565 12.933 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 2.355 -5.712 13.986 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 2.877 -4.884 12.599 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 3.195 -4.245 14.139 1.00 0.00 H new ATOM 638 N SER B 741 1.300 0.758 12.064 1.00 0.00 N ATOM 639 CA SER B 741 0.695 1.528 13.189 1.00 0.00 C ATOM 640 C SER B 741 0.514 2.997 12.798 1.00 0.00 C ATOM 641 O SER B 741 0.348 3.856 13.642 1.00 0.00 O ATOM 642 CB SER B 741 1.703 1.404 14.332 1.00 0.00 C ATOM 643 OG SER B 741 1.216 2.099 15.471 1.00 0.00 O ATOM 0 H SER B 741 2.319 0.726 12.058 1.00 0.00 H new ATOM 0 HA SER B 741 -0.291 1.151 13.462 1.00 0.00 H new ATOM 0 HB2 SER B 741 1.865 0.354 14.575 1.00 0.00 H new ATOM 0 HB3 SER B 741 2.666 1.813 14.027 1.00 0.00 H new ATOM 0 HG SER B 741 0.672 2.861 15.181 1.00 0.00 H new ATOM 649 N HIS B 742 0.542 3.294 11.527 1.00 0.00 N ATOM 650 CA HIS B 742 0.369 4.707 11.088 1.00 0.00 C ATOM 651 C HIS B 742 -1.049 5.191 11.397 1.00 0.00 C ATOM 652 O HIS B 742 -1.979 4.413 11.471 1.00 0.00 O ATOM 653 CB HIS B 742 0.601 4.671 9.577 1.00 0.00 C ATOM 654 CG HIS B 742 1.179 5.983 9.123 1.00 0.00 C ATOM 655 ND1 HIS B 742 2.535 6.150 8.893 1.00 0.00 N ATOM 656 CD2 HIS B 742 0.599 7.196 8.845 1.00 0.00 C ATOM 657 CE1 HIS B 742 2.726 7.421 8.499 1.00 0.00 C ATOM 658 NE2 HIS B 742 1.578 8.103 8.452 1.00 0.00 N ATOM 0 H HIS B 742 0.677 2.619 10.774 1.00 0.00 H new ATOM 0 HA HIS B 742 1.052 5.387 11.597 1.00 0.00 H new ATOM 0 HB2 HIS B 742 1.279 3.856 9.322 1.00 0.00 H new ATOM 0 HB3 HIS B 742 -0.339 4.478 9.059 1.00 0.00 H new ATOM 0 HD1 HIS B 742 3.257 5.438 9.003 1.00 0.00 H new ATOM 0 HD2 HIS B 742 -0.456 7.413 8.920 1.00 0.00 H new ATOM 0 HE1 HIS B 742 3.690 7.840 8.251 1.00 0.00 H new ATOM 666 N GLN B 743 -1.223 6.474 11.568 1.00 0.00 N ATOM 667 CA GLN B 743 -2.582 7.010 11.865 1.00 0.00 C ATOM 668 C GLN B 743 -3.415 7.141 10.583 1.00 0.00 C ATOM 669 O GLN B 743 -4.508 7.671 10.600 1.00 0.00 O ATOM 670 CB GLN B 743 -2.333 8.390 12.476 1.00 0.00 C ATOM 671 CG GLN B 743 -3.623 8.902 13.121 1.00 0.00 C ATOM 672 CD GLN B 743 -3.279 9.865 14.259 1.00 0.00 C ATOM 673 OE1 GLN B 743 -2.370 10.663 14.143 1.00 0.00 O ATOM 674 NE2 GLN B 743 -3.975 9.826 15.363 1.00 0.00 N ATOM 0 H GLN B 743 -0.483 7.174 11.515 1.00 0.00 H new ATOM 0 HA GLN B 743 -3.139 6.351 12.531 1.00 0.00 H new ATOM 0 HB2 GLN B 743 -1.539 8.332 13.221 1.00 0.00 H new ATOM 0 HB3 GLN B 743 -1.998 9.085 11.706 1.00 0.00 H new ATOM 0 HG2 GLN B 743 -4.238 9.407 12.377 1.00 0.00 H new ATOM 0 HG3 GLN B 743 -4.208 8.065 13.503 1.00 0.00 H new ATOM 0 HE21 GLN B 743 -4.738 9.157 15.461 1.00 0.00 H new ATOM 0 HE22 GLN B 743 -3.756 10.465 16.127 1.00 0.00 H new ATOM 683 N SER B 744 -2.914 6.670 9.470 1.00 0.00 N ATOM 684 CA SER B 744 -3.689 6.782 8.202 1.00 0.00 C ATOM 685 C SER B 744 -3.775 5.429 7.480 1.00 0.00 C ATOM 686 O SER B 744 -4.342 5.319 6.412 1.00 0.00 O ATOM 687 CB SER B 744 -2.901 7.783 7.354 1.00 0.00 C ATOM 688 OG SER B 744 -3.146 9.100 7.826 1.00 0.00 O ATOM 0 H SER B 744 -2.005 6.215 9.386 1.00 0.00 H new ATOM 0 HA SER B 744 -4.716 7.099 8.384 1.00 0.00 H new ATOM 0 HB2 SER B 744 -1.835 7.559 7.405 1.00 0.00 H new ATOM 0 HB3 SER B 744 -3.195 7.700 6.308 1.00 0.00 H new ATOM 0 HG SER B 744 -2.338 9.449 8.257 1.00 0.00 H new ATOM 694 N ALA B 745 -3.196 4.406 8.039 1.00 0.00 N ATOM 695 CA ALA B 745 -3.243 3.066 7.387 1.00 0.00 C ATOM 696 C ALA B 745 -4.573 2.362 7.671 1.00 0.00 C ATOM 697 O ALA B 745 -4.840 1.301 7.143 1.00 0.00 O ATOM 698 CB ALA B 745 -2.084 2.289 8.015 1.00 0.00 C ATOM 0 H ALA B 745 -2.689 4.438 8.924 1.00 0.00 H new ATOM 0 HA ALA B 745 -3.160 3.138 6.303 1.00 0.00 H new ATOM 0 HB1 ALA B 745 -2.045 1.286 7.590 1.00 0.00 H new ATOM 0 HB2 ALA B 745 -1.146 2.806 7.811 1.00 0.00 H new ATOM 0 HB3 ALA B 745 -2.233 2.221 9.093 1.00 0.00 H new ATOM 704 N TRP B 746 -5.412 2.934 8.496 1.00 0.00 N ATOM 705 CA TRP B 746 -6.718 2.279 8.797 1.00 0.00 C ATOM 706 C TRP B 746 -7.429 1.847 7.501 1.00 0.00 C ATOM 707 O TRP B 746 -7.790 0.694 7.370 1.00 0.00 O ATOM 708 CB TRP B 746 -7.540 3.322 9.558 1.00 0.00 C ATOM 709 CG TRP B 746 -6.825 3.765 10.802 1.00 0.00 C ATOM 710 CD1 TRP B 746 -7.236 4.790 11.585 1.00 0.00 C ATOM 711 CD2 TRP B 746 -5.606 3.240 11.426 1.00 0.00 C ATOM 712 NE1 TRP B 746 -6.358 4.931 12.642 1.00 0.00 N ATOM 713 CE2 TRP B 746 -5.339 4.004 12.591 1.00 0.00 C ATOM 714 CE3 TRP B 746 -4.712 2.195 11.109 1.00 0.00 C ATOM 715 CZ2 TRP B 746 -4.236 3.743 13.404 1.00 0.00 C ATOM 716 CZ3 TRP B 746 -3.602 1.932 11.928 1.00 0.00 C ATOM 717 CH2 TRP B 746 -3.365 2.704 13.072 1.00 0.00 C ATOM 0 H TRP B 746 -5.250 3.822 8.972 1.00 0.00 H new ATOM 0 HA TRP B 746 -6.585 1.372 9.387 1.00 0.00 H new ATOM 0 HB2 TRP B 746 -7.727 4.182 8.916 1.00 0.00 H new ATOM 0 HB3 TRP B 746 -8.511 2.904 9.822 1.00 0.00 H new ATOM 0 HD1 TRP B 746 -8.110 5.400 11.411 1.00 0.00 H new ATOM 0 HE1 TRP B 746 -6.452 5.636 13.373 1.00 0.00 H new ATOM 0 HE3 TRP B 746 -4.883 1.593 10.229 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 -4.057 4.341 14.285 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 -2.926 1.129 11.674 1.00 0.00 H new ATOM 0 HH2 TRP B 746 -2.509 2.496 13.697 1.00 0.00 H new ATOM 728 N PRO B 747 -7.588 2.757 6.560 1.00 0.00 N ATOM 729 CA PRO B 747 -8.242 2.384 5.281 1.00 0.00 C ATOM 730 C PRO B 747 -7.413 1.325 4.552 1.00 0.00 C ATOM 731 O PRO B 747 -7.897 0.647 3.667 1.00 0.00 O ATOM 732 CB PRO B 747 -8.272 3.686 4.479 1.00 0.00 C ATOM 733 CG PRO B 747 -7.260 4.574 5.126 1.00 0.00 C ATOM 734 CD PRO B 747 -7.193 4.175 6.573 1.00 0.00 C ATOM 0 HA PRO B 747 -9.236 1.960 5.425 1.00 0.00 H new ATOM 0 HB2 PRO B 747 -8.026 3.508 3.432 1.00 0.00 H new ATOM 0 HB3 PRO B 747 -9.263 4.139 4.502 1.00 0.00 H new ATOM 0 HG2 PRO B 747 -6.286 4.462 4.649 1.00 0.00 H new ATOM 0 HG3 PRO B 747 -7.545 5.621 5.027 1.00 0.00 H new ATOM 0 HD2 PRO B 747 -6.190 4.308 6.980 1.00 0.00 H new ATOM 0 HD3 PRO B 747 -7.867 4.773 7.186 1.00 0.00 H new ATOM 742 N PHE B 748 -6.163 1.179 4.908 1.00 0.00 N ATOM 743 CA PHE B 748 -5.314 0.158 4.232 1.00 0.00 C ATOM 744 C PHE B 748 -5.064 -1.023 5.169 1.00 0.00 C ATOM 745 O PHE B 748 -4.036 -1.667 5.107 1.00 0.00 O ATOM 746 CB PHE B 748 -3.987 0.863 3.909 1.00 0.00 C ATOM 747 CG PHE B 748 -4.222 2.210 3.247 1.00 0.00 C ATOM 748 CD1 PHE B 748 -5.412 2.477 2.551 1.00 0.00 C ATOM 749 CD2 PHE B 748 -3.227 3.190 3.321 1.00 0.00 C ATOM 750 CE1 PHE B 748 -5.606 3.725 1.948 1.00 0.00 C ATOM 751 CE2 PHE B 748 -3.420 4.436 2.715 1.00 0.00 C ATOM 752 CZ PHE B 748 -4.610 4.704 2.029 1.00 0.00 C ATOM 0 H PHE B 748 -5.696 1.721 5.635 1.00 0.00 H new ATOM 0 HA PHE B 748 -5.793 -0.231 3.334 1.00 0.00 H new ATOM 0 HB2 PHE B 748 -3.414 1.002 4.826 1.00 0.00 H new ATOM 0 HB3 PHE B 748 -3.389 0.232 3.252 1.00 0.00 H new ATOM 0 HD1 PHE B 748 -6.178 1.719 2.481 1.00 0.00 H new ATOM 0 HD2 PHE B 748 -2.307 2.984 3.848 1.00 0.00 H new ATOM 0 HE1 PHE B 748 -6.525 3.932 1.420 1.00 0.00 H new ATOM 0 HE2 PHE B 748 -2.650 5.191 2.777 1.00 0.00 H new ATOM 0 HZ PHE B 748 -4.759 5.666 1.562 1.00 0.00 H new ATOM 762 N MET B 749 -5.998 -1.323 6.030 1.00 0.00 N ATOM 763 CA MET B 749 -5.805 -2.470 6.959 1.00 0.00 C ATOM 764 C MET B 749 -6.882 -3.534 6.736 1.00 0.00 C ATOM 765 O MET B 749 -7.134 -4.361 7.589 1.00 0.00 O ATOM 766 CB MET B 749 -5.931 -1.876 8.360 1.00 0.00 C ATOM 767 CG MET B 749 -4.668 -1.074 8.691 1.00 0.00 C ATOM 768 SD MET B 749 -3.873 -1.766 10.163 1.00 0.00 S ATOM 769 CE MET B 749 -2.163 -1.479 9.647 1.00 0.00 C ATOM 0 H MET B 749 -6.883 -0.825 6.129 1.00 0.00 H new ATOM 0 HA MET B 749 -4.843 -2.958 6.804 1.00 0.00 H new ATOM 0 HB2 MET B 749 -6.809 -1.232 8.416 1.00 0.00 H new ATOM 0 HB3 MET B 749 -6.072 -2.671 9.092 1.00 0.00 H new ATOM 0 HG2 MET B 749 -3.978 -1.099 7.848 1.00 0.00 H new ATOM 0 HG3 MET B 749 -4.924 -0.028 8.862 1.00 0.00 H new ATOM 0 HE1 MET B 749 -1.489 -1.721 10.469 1.00 0.00 H new ATOM 0 HE2 MET B 749 -1.931 -2.111 8.789 1.00 0.00 H new ATOM 0 HE3 MET B 749 -2.037 -0.432 9.371 1.00 0.00 H new ATOM 779 N GLU B 750 -7.506 -3.539 5.589 1.00 0.00 N ATOM 780 CA GLU B 750 -8.544 -4.573 5.315 1.00 0.00 C ATOM 781 C GLU B 750 -8.544 -4.946 3.824 1.00 0.00 C ATOM 782 O GLU B 750 -8.037 -4.207 3.005 1.00 0.00 O ATOM 783 CB GLU B 750 -9.872 -3.925 5.714 1.00 0.00 C ATOM 784 CG GLU B 750 -10.145 -2.719 4.816 1.00 0.00 C ATOM 785 CD GLU B 750 -10.031 -1.433 5.637 1.00 0.00 C ATOM 786 OE1 GLU B 750 -10.744 -1.316 6.620 1.00 0.00 O ATOM 787 OE2 GLU B 750 -9.233 -0.588 5.270 1.00 0.00 O ATOM 0 H GLU B 750 -7.343 -2.874 4.833 1.00 0.00 H new ATOM 0 HA GLU B 750 -8.364 -5.494 5.869 1.00 0.00 H new ATOM 0 HB2 GLU B 750 -10.682 -4.648 5.625 1.00 0.00 H new ATOM 0 HB3 GLU B 750 -9.837 -3.613 6.758 1.00 0.00 H new ATOM 0 HG2 GLU B 750 -9.434 -2.699 3.990 1.00 0.00 H new ATOM 0 HG3 GLU B 750 -11.140 -2.796 4.378 1.00 0.00 H new ATOM 794 N PRO B 751 -9.132 -6.076 3.514 1.00 0.00 N ATOM 795 CA PRO B 751 -9.171 -6.555 2.121 1.00 0.00 C ATOM 796 C PRO B 751 -10.447 -6.081 1.420 1.00 0.00 C ATOM 797 O PRO B 751 -11.006 -6.776 0.595 1.00 0.00 O ATOM 798 CB PRO B 751 -9.187 -8.076 2.279 1.00 0.00 C ATOM 799 CG PRO B 751 -9.658 -8.352 3.684 1.00 0.00 C ATOM 800 CD PRO B 751 -9.751 -7.038 4.423 1.00 0.00 C ATOM 0 HA PRO B 751 -8.339 -6.189 1.520 1.00 0.00 H new ATOM 0 HB2 PRO B 751 -9.853 -8.535 1.549 1.00 0.00 H new ATOM 0 HB3 PRO B 751 -8.194 -8.494 2.113 1.00 0.00 H new ATOM 0 HG2 PRO B 751 -10.629 -8.848 3.668 1.00 0.00 H new ATOM 0 HG3 PRO B 751 -8.965 -9.024 4.191 1.00 0.00 H new ATOM 0 HD2 PRO B 751 -10.786 -6.774 4.639 1.00 0.00 H new ATOM 0 HD3 PRO B 751 -9.227 -7.079 5.378 1.00 0.00 H new ATOM 808 N VAL B 752 -10.924 -4.910 1.760 1.00 0.00 N ATOM 809 CA VAL B 752 -12.191 -4.385 1.142 1.00 0.00 C ATOM 810 C VAL B 752 -13.271 -5.484 1.171 1.00 0.00 C ATOM 811 O VAL B 752 -13.131 -6.483 1.848 1.00 0.00 O ATOM 812 CB VAL B 752 -11.851 -3.900 -0.316 1.00 0.00 C ATOM 813 CG1 VAL B 752 -10.347 -3.637 -0.485 1.00 0.00 C ATOM 814 CG2 VAL B 752 -12.283 -4.914 -1.386 1.00 0.00 C ATOM 0 H VAL B 752 -10.491 -4.288 2.443 1.00 0.00 H new ATOM 0 HA VAL B 752 -12.592 -3.539 1.700 1.00 0.00 H new ATOM 0 HB VAL B 752 -12.410 -2.975 -0.455 1.00 0.00 H new ATOM 0 HG11 VAL B 752 -10.148 -3.304 -1.504 1.00 0.00 H new ATOM 0 HG12 VAL B 752 -10.031 -2.866 0.217 1.00 0.00 H new ATOM 0 HG13 VAL B 752 -9.793 -4.555 -0.289 1.00 0.00 H new ATOM 0 HG21 VAL B 752 -12.026 -4.532 -2.374 1.00 0.00 H new ATOM 0 HG22 VAL B 752 -11.770 -5.861 -1.218 1.00 0.00 H new ATOM 0 HG23 VAL B 752 -13.360 -5.070 -1.326 1.00 0.00 H new ATOM 899 N ALA B 757 -17.652 -6.143 -3.711 1.00 0.00 N ATOM 900 CA ALA B 757 -17.116 -4.820 -4.158 1.00 0.00 C ATOM 901 C ALA B 757 -17.233 -4.675 -5.683 1.00 0.00 C ATOM 902 O ALA B 757 -16.459 -5.258 -6.416 1.00 0.00 O ATOM 903 CB ALA B 757 -15.642 -4.834 -3.737 1.00 0.00 C ATOM 0 HA ALA B 757 -17.666 -3.986 -3.721 1.00 0.00 H new ATOM 0 HB1 ALA B 757 -15.171 -3.895 -4.029 1.00 0.00 H new ATOM 0 HB2 ALA B 757 -15.574 -4.954 -2.656 1.00 0.00 H new ATOM 0 HB3 ALA B 757 -15.132 -5.663 -4.227 1.00 0.00 H new ATOM 909 N PRO B 758 -18.206 -3.907 -6.115 1.00 0.00 N ATOM 910 CA PRO B 758 -18.428 -3.716 -7.561 1.00 0.00 C ATOM 911 C PRO B 758 -17.590 -2.551 -8.089 1.00 0.00 C ATOM 912 O PRO B 758 -17.877 -1.400 -7.827 1.00 0.00 O ATOM 913 CB PRO B 758 -19.916 -3.382 -7.644 1.00 0.00 C ATOM 914 CG PRO B 758 -20.291 -2.827 -6.298 1.00 0.00 C ATOM 915 CD PRO B 758 -19.196 -3.175 -5.316 1.00 0.00 C ATOM 0 HA PRO B 758 -18.146 -4.586 -8.154 1.00 0.00 H new ATOM 0 HB2 PRO B 758 -20.110 -2.656 -8.433 1.00 0.00 H new ATOM 0 HB3 PRO B 758 -20.503 -4.270 -7.877 1.00 0.00 H new ATOM 0 HG2 PRO B 758 -20.419 -1.746 -6.356 1.00 0.00 H new ATOM 0 HG3 PRO B 758 -21.243 -3.243 -5.968 1.00 0.00 H new ATOM 0 HD2 PRO B 758 -18.763 -2.279 -4.870 1.00 0.00 H new ATOM 0 HD3 PRO B 758 -19.576 -3.786 -4.498 1.00 0.00 H new ATOM 923 N GLY B 759 -16.561 -2.837 -8.839 1.00 0.00 N ATOM 924 CA GLY B 759 -15.722 -1.738 -9.393 1.00 0.00 C ATOM 925 C GLY B 759 -14.240 -2.091 -9.256 1.00 0.00 C ATOM 926 O GLY B 759 -13.411 -1.603 -9.997 1.00 0.00 O ATOM 0 H GLY B 759 -16.266 -3.780 -9.091 1.00 0.00 H new ATOM 0 HA2 GLY B 759 -15.970 -1.574 -10.442 1.00 0.00 H new ATOM 0 HA3 GLY B 759 -15.933 -0.807 -8.866 1.00 0.00 H new ATOM 930 N TYR B 760 -13.895 -2.925 -8.311 1.00 0.00 N ATOM 931 CA TYR B 760 -12.461 -3.299 -8.139 1.00 0.00 C ATOM 932 C TYR B 760 -11.919 -3.919 -9.429 1.00 0.00 C ATOM 933 O TYR B 760 -11.978 -5.116 -9.629 1.00 0.00 O ATOM 934 CB TYR B 760 -12.455 -4.325 -7.005 1.00 0.00 C ATOM 935 CG TYR B 760 -12.257 -3.609 -5.691 1.00 0.00 C ATOM 936 CD1 TYR B 760 -13.328 -2.930 -5.098 1.00 0.00 C ATOM 937 CD2 TYR B 760 -11.001 -3.610 -5.076 1.00 0.00 C ATOM 938 CE1 TYR B 760 -13.144 -2.261 -3.882 1.00 0.00 C ATOM 939 CE2 TYR B 760 -10.817 -2.940 -3.860 1.00 0.00 C ATOM 940 CZ TYR B 760 -11.889 -2.266 -3.264 1.00 0.00 C ATOM 941 OH TYR B 760 -11.709 -1.605 -2.067 1.00 0.00 O ATOM 0 H TYR B 760 -14.541 -3.362 -7.654 1.00 0.00 H new ATOM 0 HA TYR B 760 -11.832 -2.438 -7.913 1.00 0.00 H new ATOM 0 HB2 TYR B 760 -13.394 -4.878 -6.994 1.00 0.00 H new ATOM 0 HB3 TYR B 760 -11.658 -5.052 -7.160 1.00 0.00 H new ATOM 0 HD1 TYR B 760 -14.295 -2.922 -5.578 1.00 0.00 H new ATOM 0 HD2 TYR B 760 -10.173 -4.127 -5.539 1.00 0.00 H new ATOM 0 HE1 TYR B 760 -13.971 -1.741 -3.421 1.00 0.00 H new ATOM 0 HE2 TYR B 760 -9.848 -2.943 -3.382 1.00 0.00 H new ATOM 0 HH TYR B 760 -12.578 -1.312 -1.721 1.00 0.00 H new ATOM 951 N TYR B 761 -11.419 -3.105 -10.321 1.00 0.00 N ATOM 952 CA TYR B 761 -10.882 -3.629 -11.612 1.00 0.00 C ATOM 953 C TYR B 761 -10.348 -2.474 -12.462 1.00 0.00 C ATOM 954 O TYR B 761 -9.369 -2.610 -13.168 1.00 0.00 O ATOM 955 CB TYR B 761 -12.076 -4.287 -12.310 1.00 0.00 C ATOM 956 CG TYR B 761 -11.645 -5.604 -12.907 1.00 0.00 C ATOM 957 CD1 TYR B 761 -10.984 -6.550 -12.114 1.00 0.00 C ATOM 958 CD2 TYR B 761 -11.905 -5.881 -14.254 1.00 0.00 C ATOM 959 CE1 TYR B 761 -10.584 -7.772 -12.668 1.00 0.00 C ATOM 960 CE2 TYR B 761 -11.506 -7.102 -14.809 1.00 0.00 C ATOM 961 CZ TYR B 761 -10.845 -8.048 -14.015 1.00 0.00 C ATOM 962 OH TYR B 761 -10.451 -9.252 -14.562 1.00 0.00 O ATOM 0 H TYR B 761 -11.359 -2.093 -10.210 1.00 0.00 H new ATOM 0 HA TYR B 761 -10.062 -4.331 -11.460 1.00 0.00 H new ATOM 0 HB2 TYR B 761 -12.885 -4.446 -11.597 1.00 0.00 H new ATOM 0 HB3 TYR B 761 -12.462 -3.631 -13.090 1.00 0.00 H new ATOM 0 HD1 TYR B 761 -10.783 -6.337 -11.075 1.00 0.00 H new ATOM 0 HD2 TYR B 761 -12.414 -5.151 -14.866 1.00 0.00 H new ATOM 0 HE1 TYR B 761 -10.074 -8.501 -12.056 1.00 0.00 H new ATOM 0 HE2 TYR B 761 -11.707 -7.315 -15.848 1.00 0.00 H new ATOM 0 HH TYR B 761 -10.710 -9.282 -15.507 1.00 0.00 H new ATOM 972 N GLU B 762 -10.995 -1.341 -12.408 1.00 0.00 N ATOM 973 CA GLU B 762 -10.518 -0.168 -13.192 1.00 0.00 C ATOM 974 C GLU B 762 -9.855 0.834 -12.250 1.00 0.00 C ATOM 975 O GLU B 762 -8.977 1.582 -12.633 1.00 0.00 O ATOM 976 CB GLU B 762 -11.782 0.432 -13.812 1.00 0.00 C ATOM 977 CG GLU B 762 -11.391 1.470 -14.866 1.00 0.00 C ATOM 978 CD GLU B 762 -12.549 1.661 -15.848 1.00 0.00 C ATOM 979 OE1 GLU B 762 -13.151 0.668 -16.223 1.00 0.00 O ATOM 980 OE2 GLU B 762 -12.813 2.796 -16.208 1.00 0.00 O ATOM 0 H GLU B 762 -11.835 -1.178 -11.853 1.00 0.00 H new ATOM 0 HA GLU B 762 -9.785 -0.437 -13.952 1.00 0.00 H new ATOM 0 HB2 GLU B 762 -12.385 -0.354 -14.267 1.00 0.00 H new ATOM 0 HB3 GLU B 762 -12.394 0.896 -13.039 1.00 0.00 H new ATOM 0 HG2 GLU B 762 -11.147 2.418 -14.386 1.00 0.00 H new ATOM 0 HG3 GLU B 762 -10.498 1.144 -15.399 1.00 0.00 H new ATOM 987 N VAL B 763 -10.268 0.842 -11.014 1.00 0.00 N ATOM 988 CA VAL B 763 -9.643 1.760 -10.018 1.00 0.00 C ATOM 989 C VAL B 763 -8.746 0.964 -9.078 1.00 0.00 C ATOM 990 O VAL B 763 -7.794 1.477 -8.525 1.00 0.00 O ATOM 991 CB VAL B 763 -10.798 2.397 -9.230 1.00 0.00 C ATOM 992 CG1 VAL B 763 -11.490 3.441 -10.103 1.00 0.00 C ATOM 993 CG2 VAL B 763 -11.816 1.337 -8.795 1.00 0.00 C ATOM 0 H VAL B 763 -11.014 0.251 -10.648 1.00 0.00 H new ATOM 0 HA VAL B 763 -9.031 2.520 -10.504 1.00 0.00 H new ATOM 0 HB VAL B 763 -10.390 2.868 -8.336 1.00 0.00 H new ATOM 0 HG11 VAL B 763 -12.310 3.895 -9.547 1.00 0.00 H new ATOM 0 HG12 VAL B 763 -10.773 4.212 -10.386 1.00 0.00 H new ATOM 0 HG13 VAL B 763 -11.882 2.963 -11.001 1.00 0.00 H new ATOM 0 HG21 VAL B 763 -12.623 1.814 -8.239 1.00 0.00 H new ATOM 0 HG22 VAL B 763 -12.225 0.842 -9.676 1.00 0.00 H new ATOM 0 HG23 VAL B 763 -11.325 0.600 -8.160 1.00 0.00 H new ATOM 1003 N ILE B 764 -9.048 -0.289 -8.889 1.00 0.00 N ATOM 1004 CA ILE B 764 -8.211 -1.125 -7.987 1.00 0.00 C ATOM 1005 C ILE B 764 -7.777 -2.397 -8.718 1.00 0.00 C ATOM 1006 O ILE B 764 -8.337 -3.457 -8.524 1.00 0.00 O ATOM 1007 CB ILE B 764 -9.105 -1.486 -6.783 1.00 0.00 C ATOM 1008 CG1 ILE B 764 -9.954 -0.283 -6.330 1.00 0.00 C ATOM 1009 CG2 ILE B 764 -8.218 -1.939 -5.621 1.00 0.00 C ATOM 1010 CD1 ILE B 764 -9.077 0.964 -6.175 1.00 0.00 C ATOM 0 H ILE B 764 -9.838 -0.770 -9.320 1.00 0.00 H new ATOM 0 HA ILE B 764 -7.312 -0.598 -7.669 1.00 0.00 H new ATOM 0 HB ILE B 764 -9.781 -2.285 -7.086 1.00 0.00 H new ATOM 0 HG12 ILE B 764 -10.743 -0.092 -7.058 1.00 0.00 H new ATOM 0 HG13 ILE B 764 -10.443 -0.511 -5.383 1.00 0.00 H new ATOM 0 HG21 ILE B 764 -8.842 -2.196 -4.765 1.00 0.00 H new ATOM 0 HG22 ILE B 764 -7.640 -2.812 -5.924 1.00 0.00 H new ATOM 0 HG23 ILE B 764 -7.539 -1.132 -5.345 1.00 0.00 H new ATOM 0 HD11 ILE B 764 -9.693 1.804 -5.855 1.00 0.00 H new ATOM 0 HD12 ILE B 764 -8.304 0.775 -5.430 1.00 0.00 H new ATOM 0 HD13 ILE B 764 -8.609 1.201 -7.131 1.00 0.00 H new ATOM 1022 N ARG B 765 -6.800 -2.295 -9.577 1.00 0.00 N ATOM 1023 CA ARG B 765 -6.333 -3.500 -10.319 1.00 0.00 C ATOM 1024 C ARG B 765 -5.968 -4.610 -9.335 1.00 0.00 C ATOM 1025 O ARG B 765 -6.568 -5.666 -9.320 1.00 0.00 O ATOM 1026 CB ARG B 765 -5.086 -3.042 -11.077 1.00 0.00 C ATOM 1027 CG ARG B 765 -5.418 -1.816 -11.926 1.00 0.00 C ATOM 1028 CD ARG B 765 -4.641 -0.608 -11.402 1.00 0.00 C ATOM 1029 NE ARG B 765 -3.239 -0.824 -11.868 1.00 0.00 N ATOM 1030 CZ ARG B 765 -2.355 0.146 -11.820 1.00 0.00 C ATOM 1031 NH1 ARG B 765 -2.677 1.331 -11.362 1.00 0.00 N ATOM 1032 NH2 ARG B 765 -1.137 -0.074 -12.235 1.00 0.00 N ATOM 0 H ARG B 765 -6.306 -1.430 -9.797 1.00 0.00 H new ATOM 0 HA ARG B 765 -7.099 -3.894 -10.987 1.00 0.00 H new ATOM 0 HB2 ARG B 765 -4.289 -2.803 -10.373 1.00 0.00 H new ATOM 0 HB3 ARG B 765 -4.719 -3.848 -11.713 1.00 0.00 H new ATOM 0 HG2 ARG B 765 -5.162 -2.002 -12.969 1.00 0.00 H new ATOM 0 HG3 ARG B 765 -6.489 -1.616 -11.892 1.00 0.00 H new ATOM 0 HD2 ARG B 765 -5.049 0.324 -11.793 1.00 0.00 H new ATOM 0 HD3 ARG B 765 -4.691 -0.547 -10.315 1.00 0.00 H new ATOM 0 HE ARG B 765 -2.964 -1.738 -12.229 1.00 0.00 H new ATOM 0 HH11 ARG B 765 -3.627 1.511 -11.036 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -1.978 2.073 -11.332 1.00 0.00 H new ATOM 0 HH21 ARG B 765 -0.878 -0.993 -12.593 1.00 0.00 H new ATOM 0 HH22 ARG B 765 -0.444 0.674 -12.201 1.00 0.00 H new ATOM 1046 N PHE B 766 -4.984 -4.374 -8.513 1.00 0.00 N ATOM 1047 CA PHE B 766 -4.581 -5.402 -7.517 1.00 0.00 C ATOM 1048 C PHE B 766 -4.842 -4.886 -6.099 1.00 0.00 C ATOM 1049 O PHE B 766 -3.940 -4.398 -5.447 1.00 0.00 O ATOM 1050 CB PHE B 766 -3.082 -5.603 -7.739 1.00 0.00 C ATOM 1051 CG PHE B 766 -2.865 -6.677 -8.778 1.00 0.00 C ATOM 1052 CD1 PHE B 766 -3.186 -6.429 -10.118 1.00 0.00 C ATOM 1053 CD2 PHE B 766 -2.342 -7.919 -8.402 1.00 0.00 C ATOM 1054 CE1 PHE B 766 -2.985 -7.425 -11.082 1.00 0.00 C ATOM 1055 CE2 PHE B 766 -2.140 -8.915 -9.365 1.00 0.00 C ATOM 1056 CZ PHE B 766 -2.462 -8.668 -10.705 1.00 0.00 C ATOM 0 H PHE B 766 -4.441 -3.511 -8.489 1.00 0.00 H new ATOM 0 HA PHE B 766 -5.140 -6.331 -7.632 1.00 0.00 H new ATOM 0 HB2 PHE B 766 -2.624 -4.669 -8.065 1.00 0.00 H new ATOM 0 HB3 PHE B 766 -2.600 -5.885 -6.803 1.00 0.00 H new ATOM 0 HD1 PHE B 766 -3.589 -5.470 -10.408 1.00 0.00 H new ATOM 0 HD2 PHE B 766 -2.094 -8.110 -7.368 1.00 0.00 H new ATOM 0 HE1 PHE B 766 -3.233 -7.234 -12.116 1.00 0.00 H new ATOM 0 HE2 PHE B 766 -1.736 -9.873 -9.074 1.00 0.00 H new ATOM 0 HZ PHE B 766 -2.307 -9.436 -11.448 1.00 0.00 H new ATOM 1066 N PRO B 767 -6.076 -4.998 -5.664 1.00 0.00 N ATOM 1067 CA PRO B 767 -6.455 -4.539 -4.306 1.00 0.00 C ATOM 1068 C PRO B 767 -5.418 -4.968 -3.264 1.00 0.00 C ATOM 1069 O PRO B 767 -5.477 -6.055 -2.723 1.00 0.00 O ATOM 1070 CB PRO B 767 -7.800 -5.231 -4.042 1.00 0.00 C ATOM 1071 CG PRO B 767 -8.073 -6.090 -5.243 1.00 0.00 C ATOM 1072 CD PRO B 767 -7.223 -5.569 -6.367 1.00 0.00 C ATOM 0 HA PRO B 767 -6.514 -3.453 -4.240 1.00 0.00 H new ATOM 0 HB2 PRO B 767 -7.756 -5.833 -3.135 1.00 0.00 H new ATOM 0 HB3 PRO B 767 -8.594 -4.498 -3.900 1.00 0.00 H new ATOM 0 HG2 PRO B 767 -7.834 -7.132 -5.032 1.00 0.00 H new ATOM 0 HG3 PRO B 767 -9.129 -6.052 -5.510 1.00 0.00 H new ATOM 0 HD2 PRO B 767 -6.924 -6.364 -7.051 1.00 0.00 H new ATOM 0 HD3 PRO B 767 -7.749 -4.820 -6.959 1.00 0.00 H new ATOM 1080 N MET B 768 -4.466 -4.122 -2.990 1.00 0.00 N ATOM 1081 CA MET B 768 -3.441 -4.457 -1.967 1.00 0.00 C ATOM 1082 C MET B 768 -3.763 -3.717 -0.673 1.00 0.00 C ATOM 1083 O MET B 768 -4.494 -2.747 -0.670 1.00 0.00 O ATOM 1084 CB MET B 768 -2.115 -3.965 -2.555 1.00 0.00 C ATOM 1085 CG MET B 768 -1.184 -5.153 -2.821 1.00 0.00 C ATOM 1086 SD MET B 768 -1.988 -6.334 -3.933 1.00 0.00 S ATOM 1087 CE MET B 768 -2.406 -7.563 -2.674 1.00 0.00 C ATOM 0 H MET B 768 -4.354 -3.210 -3.433 1.00 0.00 H new ATOM 0 HA MET B 768 -3.405 -5.522 -1.736 1.00 0.00 H new ATOM 0 HB2 MET B 768 -2.299 -3.422 -3.482 1.00 0.00 H new ATOM 0 HB3 MET B 768 -1.639 -3.267 -1.866 1.00 0.00 H new ATOM 0 HG2 MET B 768 -0.251 -4.803 -3.263 1.00 0.00 H new ATOM 0 HG3 MET B 768 -0.928 -5.642 -1.881 1.00 0.00 H new ATOM 0 HE1 MET B 768 -1.969 -8.524 -2.944 1.00 0.00 H new ATOM 0 HE2 MET B 768 -2.012 -7.244 -1.709 1.00 0.00 H new ATOM 0 HE3 MET B 768 -3.489 -7.663 -2.609 1.00 0.00 H new ATOM 1097 N ASP B 769 -3.250 -4.175 0.431 1.00 0.00 N ATOM 1098 CA ASP B 769 -3.562 -3.507 1.722 1.00 0.00 C ATOM 1099 C ASP B 769 -2.724 -4.125 2.840 1.00 0.00 C ATOM 1100 O ASP B 769 -2.386 -5.288 2.798 1.00 0.00 O ATOM 1101 CB ASP B 769 -5.054 -3.781 1.935 1.00 0.00 C ATOM 1102 CG ASP B 769 -5.487 -3.299 3.320 1.00 0.00 C ATOM 1103 OD1 ASP B 769 -4.928 -3.772 4.295 1.00 0.00 O ATOM 1104 OD2 ASP B 769 -6.386 -2.476 3.380 1.00 0.00 O ATOM 0 H ASP B 769 -2.629 -4.982 0.496 1.00 0.00 H new ATOM 0 HA ASP B 769 -3.339 -2.440 1.719 1.00 0.00 H new ATOM 0 HB2 ASP B 769 -5.638 -3.274 1.167 1.00 0.00 H new ATOM 0 HB3 ASP B 769 -5.253 -4.848 1.835 1.00 0.00 H new ATOM 1109 N LEU B 770 -2.373 -3.355 3.834 1.00 0.00 N ATOM 1110 CA LEU B 770 -1.528 -3.902 4.939 1.00 0.00 C ATOM 1111 C LEU B 770 -2.104 -5.226 5.457 1.00 0.00 C ATOM 1112 O LEU B 770 -1.387 -6.186 5.657 1.00 0.00 O ATOM 1113 CB LEU B 770 -1.556 -2.830 6.038 1.00 0.00 C ATOM 1114 CG LEU B 770 -0.996 -1.498 5.506 1.00 0.00 C ATOM 1115 CD1 LEU B 770 -0.802 -0.532 6.677 1.00 0.00 C ATOM 1116 CD2 LEU B 770 0.353 -1.723 4.810 1.00 0.00 C ATOM 0 H LEU B 770 -2.633 -2.373 3.931 1.00 0.00 H new ATOM 0 HA LEU B 770 -0.512 -4.115 4.606 1.00 0.00 H new ATOM 0 HB2 LEU B 770 -2.578 -2.687 6.389 1.00 0.00 H new ATOM 0 HB3 LEU B 770 -0.968 -3.163 6.894 1.00 0.00 H new ATOM 0 HG LEU B 770 -1.700 -1.081 4.786 1.00 0.00 H new ATOM 0 HD11 LEU B 770 -0.406 0.413 6.307 1.00 0.00 H new ATOM 0 HD12 LEU B 770 -1.760 -0.357 7.167 1.00 0.00 H new ATOM 0 HD13 LEU B 770 -0.102 -0.964 7.393 1.00 0.00 H new ATOM 0 HD21 LEU B 770 0.735 -0.771 4.440 1.00 0.00 H new ATOM 0 HD22 LEU B 770 1.063 -2.147 5.520 1.00 0.00 H new ATOM 0 HD23 LEU B 770 0.221 -2.411 3.975 1.00 0.00 H new ATOM 1128 N LYS B 771 -3.396 -5.299 5.640 1.00 0.00 N ATOM 1129 CA LYS B 771 -4.013 -6.570 6.125 1.00 0.00 C ATOM 1130 C LYS B 771 -3.544 -7.751 5.251 1.00 0.00 C ATOM 1131 O LYS B 771 -3.482 -8.879 5.697 1.00 0.00 O ATOM 1132 CB LYS B 771 -5.543 -6.306 6.037 1.00 0.00 C ATOM 1133 CG LYS B 771 -6.282 -7.333 5.161 1.00 0.00 C ATOM 1134 CD LYS B 771 -6.310 -8.685 5.875 1.00 0.00 C ATOM 1135 CE LYS B 771 -6.036 -9.800 4.865 1.00 0.00 C ATOM 1136 NZ LYS B 771 -6.059 -11.056 5.666 1.00 0.00 N ATOM 0 H LYS B 771 -4.051 -4.535 5.475 1.00 0.00 H new ATOM 0 HA LYS B 771 -3.727 -6.843 7.141 1.00 0.00 H new ATOM 0 HB2 LYS B 771 -5.967 -6.322 7.041 1.00 0.00 H new ATOM 0 HB3 LYS B 771 -5.711 -5.307 5.635 1.00 0.00 H new ATOM 0 HG2 LYS B 771 -7.299 -6.993 4.963 1.00 0.00 H new ATOM 0 HG3 LYS B 771 -5.784 -7.429 4.196 1.00 0.00 H new ATOM 0 HD2 LYS B 771 -5.562 -8.705 6.667 1.00 0.00 H new ATOM 0 HD3 LYS B 771 -7.280 -8.838 6.348 1.00 0.00 H new ATOM 0 HE2 LYS B 771 -6.793 -9.818 4.081 1.00 0.00 H new ATOM 0 HE3 LYS B 771 -5.072 -9.661 4.375 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 -5.114 -11.489 5.660 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 -6.333 -10.838 6.645 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 -6.746 -11.719 5.253 1.00 0.00 H new ATOM 1150 N THR B 772 -3.216 -7.493 4.015 1.00 0.00 N ATOM 1151 CA THR B 772 -2.773 -8.594 3.113 1.00 0.00 C ATOM 1152 C THR B 772 -1.288 -8.444 2.768 1.00 0.00 C ATOM 1153 O THR B 772 -0.578 -9.416 2.598 1.00 0.00 O ATOM 1154 CB THR B 772 -3.636 -8.423 1.858 1.00 0.00 C ATOM 1155 OG1 THR B 772 -4.992 -8.693 2.179 1.00 0.00 O ATOM 1156 CG2 THR B 772 -3.170 -9.391 0.767 1.00 0.00 C ATOM 0 H THR B 772 -3.236 -6.566 3.590 1.00 0.00 H new ATOM 0 HA THR B 772 -2.886 -9.578 3.568 1.00 0.00 H new ATOM 0 HB THR B 772 -3.540 -7.400 1.494 1.00 0.00 H new ATOM 0 HG1 THR B 772 -5.546 -8.583 1.378 1.00 0.00 H new ATOM 0 HG21 THR B 772 -3.788 -9.263 -0.121 1.00 0.00 H new ATOM 0 HG22 THR B 772 -2.129 -9.184 0.517 1.00 0.00 H new ATOM 0 HG23 THR B 772 -3.260 -10.416 1.127 1.00 0.00 H new ATOM 1164 N MET B 773 -0.818 -7.235 2.649 1.00 0.00 N ATOM 1165 CA MET B 773 0.611 -7.017 2.295 1.00 0.00 C ATOM 1166 C MET B 773 1.516 -7.316 3.489 1.00 0.00 C ATOM 1167 O MET B 773 2.556 -7.929 3.353 1.00 0.00 O ATOM 1168 CB MET B 773 0.694 -5.537 1.927 1.00 0.00 C ATOM 1169 CG MET B 773 1.800 -5.331 0.893 1.00 0.00 C ATOM 1170 SD MET B 773 2.023 -3.560 0.602 1.00 0.00 S ATOM 1171 CE MET B 773 3.351 -3.293 1.802 1.00 0.00 C ATOM 0 H MET B 773 -1.365 -6.384 2.782 1.00 0.00 H new ATOM 0 HA MET B 773 0.937 -7.669 1.485 1.00 0.00 H new ATOM 0 HB2 MET B 773 -0.261 -5.197 1.527 1.00 0.00 H new ATOM 0 HB3 MET B 773 0.897 -4.941 2.817 1.00 0.00 H new ATOM 0 HG2 MET B 773 2.731 -5.773 1.247 1.00 0.00 H new ATOM 0 HG3 MET B 773 1.541 -5.835 -0.038 1.00 0.00 H new ATOM 0 HE1 MET B 773 2.993 -2.646 2.603 1.00 0.00 H new ATOM 0 HE2 MET B 773 3.661 -4.250 2.221 1.00 0.00 H new ATOM 0 HE3 MET B 773 4.200 -2.822 1.306 1.00 0.00 H new ATOM 1181 N SER B 774 1.145 -6.870 4.657 1.00 0.00 N ATOM 1182 CA SER B 774 1.989 -7.140 5.852 1.00 0.00 C ATOM 1183 C SER B 774 2.174 -8.645 6.026 1.00 0.00 C ATOM 1184 O SER B 774 3.130 -9.101 6.622 1.00 0.00 O ATOM 1185 CB SER B 774 1.208 -6.559 7.029 1.00 0.00 C ATOM 1186 OG SER B 774 0.221 -7.490 7.448 1.00 0.00 O ATOM 0 H SER B 774 0.297 -6.332 4.834 1.00 0.00 H new ATOM 0 HA SER B 774 2.983 -6.700 5.768 1.00 0.00 H new ATOM 0 HB2 SER B 774 1.885 -6.335 7.853 1.00 0.00 H new ATOM 0 HB3 SER B 774 0.737 -5.620 6.739 1.00 0.00 H new ATOM 0 HG SER B 774 -0.619 -7.310 6.977 1.00 0.00 H new ATOM 1192 N GLU B 775 1.264 -9.420 5.505 1.00 0.00 N ATOM 1193 CA GLU B 775 1.384 -10.896 5.633 1.00 0.00 C ATOM 1194 C GLU B 775 2.544 -11.405 4.778 1.00 0.00 C ATOM 1195 O GLU B 775 3.107 -12.449 5.035 1.00 0.00 O ATOM 1196 CB GLU B 775 0.056 -11.438 5.122 1.00 0.00 C ATOM 1197 CG GLU B 775 -0.991 -11.241 6.197 1.00 0.00 C ATOM 1198 CD GLU B 775 -2.076 -12.313 6.071 1.00 0.00 C ATOM 1199 OE1 GLU B 775 -1.901 -13.374 6.646 1.00 0.00 O ATOM 1200 OE2 GLU B 775 -3.062 -12.054 5.401 1.00 0.00 O ATOM 0 H GLU B 775 0.443 -9.093 4.996 1.00 0.00 H new ATOM 0 HA GLU B 775 1.586 -11.213 6.656 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.238 -10.921 4.209 1.00 0.00 H new ATOM 0 HB3 GLU B 775 0.149 -12.495 4.874 1.00 0.00 H new ATOM 0 HG2 GLU B 775 -0.528 -11.294 7.182 1.00 0.00 H new ATOM 0 HG3 GLU B 775 -1.435 -10.250 6.107 1.00 0.00 H new ATOM 1207 N ARG B 776 2.908 -10.667 3.764 1.00 0.00 N ATOM 1208 CA ARG B 776 4.041 -11.097 2.897 1.00 0.00 C ATOM 1209 C ARG B 776 5.366 -10.857 3.614 1.00 0.00 C ATOM 1210 O ARG B 776 6.203 -11.732 3.700 1.00 0.00 O ATOM 1211 CB ARG B 776 3.946 -10.215 1.655 1.00 0.00 C ATOM 1212 CG ARG B 776 2.993 -10.855 0.644 1.00 0.00 C ATOM 1213 CD ARG B 776 1.587 -10.282 0.834 1.00 0.00 C ATOM 1214 NE ARG B 776 0.688 -11.236 0.120 1.00 0.00 N ATOM 1215 CZ ARG B 776 0.473 -12.442 0.593 1.00 0.00 C ATOM 1216 NH1 ARG B 776 1.038 -12.842 1.706 1.00 0.00 N ATOM 1217 NH2 ARG B 776 -0.316 -13.254 -0.056 1.00 0.00 N ATOM 0 H ARG B 776 2.469 -9.785 3.499 1.00 0.00 H new ATOM 0 HA ARG B 776 3.993 -12.158 2.650 1.00 0.00 H new ATOM 0 HB2 ARG B 776 3.589 -9.222 1.928 1.00 0.00 H new ATOM 0 HB3 ARG B 776 4.933 -10.088 1.210 1.00 0.00 H new ATOM 0 HG2 ARG B 776 3.341 -10.664 -0.371 1.00 0.00 H new ATOM 0 HG3 ARG B 776 2.977 -11.937 0.777 1.00 0.00 H new ATOM 0 HD2 ARG B 776 1.328 -10.210 1.890 1.00 0.00 H new ATOM 0 HD3 ARG B 776 1.509 -9.278 0.417 1.00 0.00 H new ATOM 0 HE ARG B 776 0.235 -10.947 -0.747 1.00 0.00 H new ATOM 0 HH11 ARG B 776 1.656 -12.213 2.219 1.00 0.00 H new ATOM 0 HH12 ARG B 776 0.860 -13.782 2.059 1.00 0.00 H new ATOM 0 HH21 ARG B 776 -0.760 -12.950 -0.923 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -0.489 -14.193 0.303 1.00 0.00 H new ATOM 1231 N LEU B 777 5.560 -9.681 4.150 1.00 0.00 N ATOM 1232 CA LEU B 777 6.826 -9.399 4.887 1.00 0.00 C ATOM 1233 C LEU B 777 7.073 -10.494 5.925 1.00 0.00 C ATOM 1234 O LEU B 777 8.197 -10.841 6.227 1.00 0.00 O ATOM 1235 CB LEU B 777 6.588 -8.052 5.571 1.00 0.00 C ATOM 1236 CG LEU B 777 7.901 -7.265 5.629 1.00 0.00 C ATOM 1237 CD1 LEU B 777 8.962 -8.086 6.368 1.00 0.00 C ATOM 1238 CD2 LEU B 777 8.382 -6.971 4.207 1.00 0.00 C ATOM 0 H LEU B 777 4.898 -8.906 4.109 1.00 0.00 H new ATOM 0 HA LEU B 777 7.698 -9.374 4.233 1.00 0.00 H new ATOM 0 HB2 LEU B 777 5.836 -7.483 5.025 1.00 0.00 H new ATOM 0 HB3 LEU B 777 6.201 -8.208 6.578 1.00 0.00 H new ATOM 0 HG LEU B 777 7.737 -6.327 6.159 1.00 0.00 H new ATOM 0 HD11 LEU B 777 9.895 -7.524 6.408 1.00 0.00 H new ATOM 0 HD12 LEU B 777 8.620 -8.294 7.382 1.00 0.00 H new ATOM 0 HD13 LEU B 777 9.127 -9.026 5.841 1.00 0.00 H new ATOM 0 HD21 LEU B 777 9.316 -6.411 4.247 1.00 0.00 H new ATOM 0 HD22 LEU B 777 8.544 -7.909 3.676 1.00 0.00 H new ATOM 0 HD23 LEU B 777 7.629 -6.383 3.682 1.00 0.00 H new ATOM 1250 N LYS B 778 6.021 -11.063 6.445 1.00 0.00 N ATOM 1251 CA LYS B 778 6.174 -12.172 7.423 1.00 0.00 C ATOM 1252 C LYS B 778 6.344 -13.492 6.670 1.00 0.00 C ATOM 1253 O LYS B 778 6.938 -14.431 7.162 1.00 0.00 O ATOM 1254 CB LYS B 778 4.869 -12.171 8.222 1.00 0.00 C ATOM 1255 CG LYS B 778 4.895 -13.304 9.251 1.00 0.00 C ATOM 1256 CD LYS B 778 3.938 -14.411 8.813 1.00 0.00 C ATOM 1257 CE LYS B 778 2.763 -14.487 9.791 1.00 0.00 C ATOM 1258 NZ LYS B 778 2.283 -15.895 9.703 1.00 0.00 N ATOM 0 H LYS B 778 5.057 -10.805 6.232 1.00 0.00 H new ATOM 0 HA LYS B 778 7.043 -12.052 8.070 1.00 0.00 H new ATOM 0 HB2 LYS B 778 4.740 -11.213 8.725 1.00 0.00 H new ATOM 0 HB3 LYS B 778 4.020 -12.296 7.550 1.00 0.00 H new ATOM 0 HG2 LYS B 778 5.906 -13.700 9.347 1.00 0.00 H new ATOM 0 HG3 LYS B 778 4.606 -12.926 10.232 1.00 0.00 H new ATOM 0 HD2 LYS B 778 3.574 -14.213 7.805 1.00 0.00 H new ATOM 0 HD3 LYS B 778 4.461 -15.367 8.781 1.00 0.00 H new ATOM 0 HE2 LYS B 778 3.076 -14.239 10.805 1.00 0.00 H new ATOM 0 HE3 LYS B 778 1.976 -13.783 9.519 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 1.476 -16.028 10.346 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 1.986 -16.100 8.728 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 3.051 -16.541 9.974 1.00 0.00 H new ATOM 1272 N ASN B 779 5.839 -13.560 5.466 1.00 0.00 N ATOM 1273 CA ASN B 779 5.978 -14.807 4.664 1.00 0.00 C ATOM 1274 C ASN B 779 7.083 -14.656 3.614 1.00 0.00 C ATOM 1275 O ASN B 779 7.209 -15.464 2.715 1.00 0.00 O ATOM 1276 CB ASN B 779 4.623 -14.970 3.974 1.00 0.00 C ATOM 1277 CG ASN B 779 4.247 -16.451 3.932 1.00 0.00 C ATOM 1278 OD1 ASN B 779 4.607 -17.156 3.010 1.00 0.00 O ATOM 1279 ND2 ASN B 779 3.533 -16.956 4.900 1.00 0.00 N ATOM 0 H ASN B 779 5.335 -12.803 5.004 1.00 0.00 H new ATOM 0 HA ASN B 779 6.245 -15.664 5.282 1.00 0.00 H new ATOM 0 HB2 ASN B 779 3.860 -14.405 4.510 1.00 0.00 H new ATOM 0 HB3 ASN B 779 4.667 -14.566 2.962 1.00 0.00 H new ATOM 0 HD21 ASN B 779 3.277 -17.943 4.883 1.00 0.00 H new ATOM 0 HD22 ASN B 779 3.231 -16.364 5.674 1.00 0.00 H new ATOM 1286 N ARG B 780 7.875 -13.618 3.703 1.00 0.00 N ATOM 1287 CA ARG B 780 8.951 -13.410 2.692 1.00 0.00 C ATOM 1288 C ARG B 780 8.377 -13.505 1.276 1.00 0.00 C ATOM 1289 O ARG B 780 8.698 -14.403 0.523 1.00 0.00 O ATOM 1290 CB ARG B 780 9.953 -14.536 2.938 1.00 0.00 C ATOM 1291 CG ARG B 780 11.169 -14.334 2.032 1.00 0.00 C ATOM 1292 CD ARG B 780 11.351 -15.564 1.143 1.00 0.00 C ATOM 1293 NE ARG B 780 12.783 -15.523 0.719 1.00 0.00 N ATOM 1294 CZ ARG B 780 13.193 -14.662 -0.183 1.00 0.00 C ATOM 1295 NH1 ARG B 780 12.362 -13.815 -0.738 1.00 0.00 N ATOM 1296 NH2 ARG B 780 14.451 -14.650 -0.534 1.00 0.00 N ATOM 0 H ARG B 780 7.822 -12.907 4.432 1.00 0.00 H new ATOM 0 HA ARG B 780 9.412 -12.427 2.782 1.00 0.00 H new ATOM 0 HB2 ARG B 780 10.261 -14.543 3.984 1.00 0.00 H new ATOM 0 HB3 ARG B 780 9.490 -15.502 2.735 1.00 0.00 H new ATOM 0 HG2 ARG B 780 11.034 -13.444 1.417 1.00 0.00 H new ATOM 0 HG3 ARG B 780 12.063 -14.172 2.635 1.00 0.00 H new ATOM 0 HD2 ARG B 780 11.126 -16.481 1.687 1.00 0.00 H new ATOM 0 HD3 ARG B 780 10.683 -15.532 0.282 1.00 0.00 H new ATOM 0 HE ARG B 780 13.450 -16.172 1.136 1.00 0.00 H new ATOM 0 HH11 ARG B 780 11.378 -13.817 -0.471 1.00 0.00 H new ATOM 0 HH12 ARG B 780 12.699 -13.153 -1.437 1.00 0.00 H new ATOM 0 HH21 ARG B 780 15.106 -15.306 -0.108 1.00 0.00 H new ATOM 0 HH22 ARG B 780 14.779 -13.985 -1.234 1.00 0.00 H new ATOM 1310 N TYR B 781 7.520 -12.591 0.917 1.00 0.00 N ATOM 1311 CA TYR B 781 6.922 -12.619 -0.448 1.00 0.00 C ATOM 1312 C TYR B 781 7.326 -11.363 -1.218 1.00 0.00 C ATOM 1313 O TYR B 781 7.834 -11.432 -2.320 1.00 0.00 O ATOM 1314 CB TYR B 781 5.411 -12.636 -0.214 1.00 0.00 C ATOM 1315 CG TYR B 781 4.804 -13.830 -0.912 1.00 0.00 C ATOM 1316 CD1 TYR B 781 5.165 -14.130 -2.231 1.00 0.00 C ATOM 1317 CD2 TYR B 781 3.879 -14.637 -0.240 1.00 0.00 C ATOM 1318 CE1 TYR B 781 4.601 -15.237 -2.877 1.00 0.00 C ATOM 1319 CE2 TYR B 781 3.315 -15.744 -0.885 1.00 0.00 C ATOM 1320 CZ TYR B 781 3.676 -16.044 -2.204 1.00 0.00 C ATOM 1321 OH TYR B 781 3.120 -17.136 -2.841 1.00 0.00 O ATOM 0 H TYR B 781 7.207 -11.823 1.511 1.00 0.00 H new ATOM 0 HA TYR B 781 7.255 -13.477 -1.032 1.00 0.00 H new ATOM 0 HB2 TYR B 781 5.199 -12.680 0.854 1.00 0.00 H new ATOM 0 HB3 TYR B 781 4.964 -11.716 -0.590 1.00 0.00 H new ATOM 0 HD1 TYR B 781 5.879 -13.508 -2.750 1.00 0.00 H new ATOM 0 HD2 TYR B 781 3.600 -14.405 0.777 1.00 0.00 H new ATOM 0 HE1 TYR B 781 4.880 -15.468 -3.894 1.00 0.00 H new ATOM 0 HE2 TYR B 781 2.602 -16.366 -0.365 1.00 0.00 H new ATOM 0 HH TYR B 781 2.499 -17.588 -2.233 1.00 0.00 H new ATOM 1331 N TYR B 782 7.106 -10.214 -0.643 1.00 0.00 N ATOM 1332 CA TYR B 782 7.501 -8.951 -1.329 1.00 0.00 C ATOM 1333 C TYR B 782 8.760 -8.383 -0.673 1.00 0.00 C ATOM 1334 O TYR B 782 8.688 -7.567 0.225 1.00 0.00 O ATOM 1335 CB TYR B 782 6.320 -7.995 -1.128 1.00 0.00 C ATOM 1336 CG TYR B 782 5.224 -8.302 -2.126 1.00 0.00 C ATOM 1337 CD1 TYR B 782 5.536 -8.529 -3.473 1.00 0.00 C ATOM 1338 CD2 TYR B 782 3.890 -8.336 -1.703 1.00 0.00 C ATOM 1339 CE1 TYR B 782 4.516 -8.803 -4.391 1.00 0.00 C ATOM 1340 CE2 TYR B 782 2.870 -8.610 -2.622 1.00 0.00 C ATOM 1341 CZ TYR B 782 3.183 -8.844 -3.966 1.00 0.00 C ATOM 1342 OH TYR B 782 2.178 -9.115 -4.872 1.00 0.00 O ATOM 0 H TYR B 782 6.670 -10.094 0.271 1.00 0.00 H new ATOM 0 HA TYR B 782 7.721 -9.104 -2.386 1.00 0.00 H new ATOM 0 HB2 TYR B 782 5.935 -8.090 -0.113 1.00 0.00 H new ATOM 0 HB3 TYR B 782 6.653 -6.964 -1.248 1.00 0.00 H new ATOM 0 HD1 TYR B 782 6.564 -8.492 -3.803 1.00 0.00 H new ATOM 0 HD2 TYR B 782 3.648 -8.151 -0.667 1.00 0.00 H new ATOM 0 HE1 TYR B 782 4.757 -8.983 -5.428 1.00 0.00 H new ATOM 0 HE2 TYR B 782 1.842 -8.641 -2.294 1.00 0.00 H new ATOM 0 HH TYR B 782 1.312 -9.107 -4.413 1.00 0.00 H new ATOM 1352 N VAL B 783 9.913 -8.823 -1.096 1.00 0.00 N ATOM 1353 CA VAL B 783 11.168 -8.334 -0.463 1.00 0.00 C ATOM 1354 C VAL B 783 12.071 -7.647 -1.492 1.00 0.00 C ATOM 1355 O VAL B 783 13.205 -8.035 -1.689 1.00 0.00 O ATOM 1356 CB VAL B 783 11.833 -9.601 0.085 1.00 0.00 C ATOM 1357 CG1 VAL B 783 12.238 -10.519 -1.072 1.00 0.00 C ATOM 1358 CG2 VAL B 783 13.072 -9.217 0.893 1.00 0.00 C ATOM 0 H VAL B 783 10.039 -9.498 -1.850 1.00 0.00 H new ATOM 0 HA VAL B 783 10.979 -7.592 0.313 1.00 0.00 H new ATOM 0 HB VAL B 783 11.128 -10.128 0.728 1.00 0.00 H new ATOM 0 HG11 VAL B 783 12.710 -11.418 -0.675 1.00 0.00 H new ATOM 0 HG12 VAL B 783 11.352 -10.796 -1.643 1.00 0.00 H new ATOM 0 HG13 VAL B 783 12.940 -9.997 -1.722 1.00 0.00 H new ATOM 0 HG21 VAL B 783 13.546 -10.118 1.283 1.00 0.00 H new ATOM 0 HG22 VAL B 783 13.775 -8.686 0.251 1.00 0.00 H new ATOM 0 HG23 VAL B 783 12.780 -8.572 1.722 1.00 0.00 H new ATOM 1368 N SER B 784 11.586 -6.617 -2.136 1.00 0.00 N ATOM 1369 CA SER B 784 12.431 -5.905 -3.137 1.00 0.00 C ATOM 1370 C SER B 784 11.855 -4.520 -3.446 1.00 0.00 C ATOM 1371 O SER B 784 11.012 -4.013 -2.733 1.00 0.00 O ATOM 1372 CB SER B 784 12.393 -6.786 -4.387 1.00 0.00 C ATOM 1373 OG SER B 784 12.962 -8.053 -4.096 1.00 0.00 O ATOM 0 H SER B 784 10.646 -6.241 -2.012 1.00 0.00 H new ATOM 0 HA SER B 784 13.446 -5.749 -2.772 1.00 0.00 H new ATOM 0 HB2 SER B 784 11.365 -6.908 -4.727 1.00 0.00 H new ATOM 0 HB3 SER B 784 12.942 -6.307 -5.198 1.00 0.00 H new ATOM 0 HG SER B 784 13.534 -7.980 -3.304 1.00 0.00 H new ATOM 1379 N LYS B 785 12.310 -3.902 -4.504 1.00 0.00 N ATOM 1380 CA LYS B 785 11.802 -2.544 -4.855 1.00 0.00 C ATOM 1381 C LYS B 785 10.469 -2.643 -5.602 1.00 0.00 C ATOM 1382 O LYS B 785 9.414 -2.449 -5.033 1.00 0.00 O ATOM 1383 CB LYS B 785 12.876 -1.945 -5.767 1.00 0.00 C ATOM 1384 CG LYS B 785 13.562 -0.780 -5.050 1.00 0.00 C ATOM 1385 CD LYS B 785 14.953 -1.212 -4.575 1.00 0.00 C ATOM 1386 CE LYS B 785 15.820 0.033 -4.344 1.00 0.00 C ATOM 1387 NZ LYS B 785 17.228 -0.459 -4.281 1.00 0.00 N ATOM 0 H LYS B 785 13.012 -4.280 -5.140 1.00 0.00 H new ATOM 0 HA LYS B 785 11.623 -1.934 -3.969 1.00 0.00 H new ATOM 0 HB2 LYS B 785 13.610 -2.706 -6.031 1.00 0.00 H new ATOM 0 HB3 LYS B 785 12.426 -1.599 -6.698 1.00 0.00 H new ATOM 0 HG2 LYS B 785 13.646 0.074 -5.722 1.00 0.00 H new ATOM 0 HG3 LYS B 785 12.960 -0.459 -4.200 1.00 0.00 H new ATOM 0 HD2 LYS B 785 14.872 -1.789 -3.654 1.00 0.00 H new ATOM 0 HD3 LYS B 785 15.418 -1.860 -5.317 1.00 0.00 H new ATOM 0 HE2 LYS B 785 15.693 0.753 -5.152 1.00 0.00 H new ATOM 0 HE3 LYS B 785 15.540 0.538 -3.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 17.804 0.207 -3.728 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 17.249 -1.394 -3.827 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 17.613 -0.533 -5.244 1.00 0.00 H new ATOM 1401 N LYS B 786 10.508 -2.950 -6.872 1.00 0.00 N ATOM 1402 CA LYS B 786 9.244 -3.046 -7.663 1.00 0.00 C ATOM 1403 C LYS B 786 8.201 -3.895 -6.931 1.00 0.00 C ATOM 1404 O LYS B 786 7.015 -3.755 -7.147 1.00 0.00 O ATOM 1405 CB LYS B 786 9.652 -3.724 -8.973 1.00 0.00 C ATOM 1406 CG LYS B 786 8.571 -3.482 -10.030 1.00 0.00 C ATOM 1407 CD LYS B 786 7.922 -4.814 -10.411 1.00 0.00 C ATOM 1408 CE LYS B 786 7.446 -4.752 -11.864 1.00 0.00 C ATOM 1409 NZ LYS B 786 6.046 -4.246 -11.785 1.00 0.00 N ATOM 0 H LYS B 786 11.362 -3.139 -7.397 1.00 0.00 H new ATOM 0 HA LYS B 786 8.792 -2.067 -7.822 1.00 0.00 H new ATOM 0 HB2 LYS B 786 10.608 -3.329 -9.317 1.00 0.00 H new ATOM 0 HB3 LYS B 786 9.788 -4.794 -8.814 1.00 0.00 H new ATOM 0 HG2 LYS B 786 7.817 -2.795 -9.644 1.00 0.00 H new ATOM 0 HG3 LYS B 786 9.008 -3.013 -10.912 1.00 0.00 H new ATOM 0 HD2 LYS B 786 8.636 -5.628 -10.285 1.00 0.00 H new ATOM 0 HD3 LYS B 786 7.081 -5.023 -9.750 1.00 0.00 H new ATOM 0 HE2 LYS B 786 8.074 -4.088 -12.458 1.00 0.00 H new ATOM 0 HE3 LYS B 786 7.486 -5.734 -12.335 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 5.648 -4.175 -12.743 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 5.471 -4.902 -11.219 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 6.041 -3.307 -11.338 1.00 0.00 H new ATOM 1423 N LEU B 787 8.630 -4.772 -6.067 1.00 0.00 N ATOM 1424 CA LEU B 787 7.659 -5.625 -5.326 1.00 0.00 C ATOM 1425 C LEU B 787 7.007 -4.835 -4.192 1.00 0.00 C ATOM 1426 O LEU B 787 5.823 -4.561 -4.209 1.00 0.00 O ATOM 1427 CB LEU B 787 8.505 -6.761 -4.752 1.00 0.00 C ATOM 1428 CG LEU B 787 8.721 -7.825 -5.826 1.00 0.00 C ATOM 1429 CD1 LEU B 787 9.761 -7.324 -6.829 1.00 0.00 C ATOM 1430 CD2 LEU B 787 9.218 -9.115 -5.172 1.00 0.00 C ATOM 0 H LEU B 787 9.611 -4.935 -5.842 1.00 0.00 H new ATOM 0 HA LEU B 787 6.854 -5.983 -5.967 1.00 0.00 H new ATOM 0 HB2 LEU B 787 9.465 -6.376 -4.407 1.00 0.00 H new ATOM 0 HB3 LEU B 787 8.008 -7.198 -3.886 1.00 0.00 H new ATOM 0 HG LEU B 787 7.782 -8.022 -6.343 1.00 0.00 H new ATOM 0 HD11 LEU B 787 9.919 -8.080 -7.598 1.00 0.00 H new ATOM 0 HD12 LEU B 787 9.406 -6.404 -7.293 1.00 0.00 H new ATOM 0 HD13 LEU B 787 10.701 -7.130 -6.312 1.00 0.00 H new ATOM 0 HD21 LEU B 787 9.372 -9.875 -5.938 1.00 0.00 H new ATOM 0 HD22 LEU B 787 10.159 -8.923 -4.657 1.00 0.00 H new ATOM 0 HD23 LEU B 787 8.477 -9.468 -4.455 1.00 0.00 H new ATOM 1442 N PHE B 788 7.772 -4.483 -3.197 1.00 0.00 N ATOM 1443 CA PHE B 788 7.209 -3.726 -2.046 1.00 0.00 C ATOM 1444 C PHE B 788 6.659 -2.375 -2.499 1.00 0.00 C ATOM 1445 O PHE B 788 5.493 -2.080 -2.328 1.00 0.00 O ATOM 1446 CB PHE B 788 8.397 -3.520 -1.111 1.00 0.00 C ATOM 1447 CG PHE B 788 7.925 -2.867 0.167 1.00 0.00 C ATOM 1448 CD1 PHE B 788 7.335 -3.643 1.172 1.00 0.00 C ATOM 1449 CD2 PHE B 788 8.069 -1.486 0.343 1.00 0.00 C ATOM 1450 CE1 PHE B 788 6.896 -3.038 2.356 1.00 0.00 C ATOM 1451 CE2 PHE B 788 7.631 -0.881 1.527 1.00 0.00 C ATOM 1452 CZ PHE B 788 7.043 -1.658 2.533 1.00 0.00 C ATOM 0 H PHE B 788 8.769 -4.689 -3.132 1.00 0.00 H new ATOM 0 HA PHE B 788 6.383 -4.256 -1.572 1.00 0.00 H new ATOM 0 HB2 PHE B 788 8.870 -4.477 -0.890 1.00 0.00 H new ATOM 0 HB3 PHE B 788 9.150 -2.897 -1.594 1.00 0.00 H new ATOM 0 HD1 PHE B 788 7.219 -4.708 1.034 1.00 0.00 H new ATOM 0 HD2 PHE B 788 8.518 -0.887 -0.435 1.00 0.00 H new ATOM 0 HE1 PHE B 788 6.444 -3.637 3.133 1.00 0.00 H new ATOM 0 HE2 PHE B 788 7.746 0.184 1.665 1.00 0.00 H new ATOM 0 HZ PHE B 788 6.703 -1.192 3.446 1.00 0.00 H new ATOM 1462 N MET B 789 7.494 -1.545 -3.063 1.00 0.00 N ATOM 1463 CA MET B 789 7.028 -0.202 -3.516 1.00 0.00 C ATOM 1464 C MET B 789 5.735 -0.322 -4.328 1.00 0.00 C ATOM 1465 O MET B 789 4.902 0.556 -4.312 1.00 0.00 O ATOM 1466 CB MET B 789 8.158 0.325 -4.401 1.00 0.00 C ATOM 1467 CG MET B 789 9.304 0.830 -3.526 1.00 0.00 C ATOM 1468 SD MET B 789 9.333 2.637 -3.581 1.00 0.00 S ATOM 1469 CE MET B 789 7.805 2.921 -2.661 1.00 0.00 C ATOM 0 H MET B 789 8.481 -1.739 -3.230 1.00 0.00 H new ATOM 0 HA MET B 789 6.812 0.459 -2.676 1.00 0.00 H new ATOM 0 HB2 MET B 789 8.514 -0.465 -5.062 1.00 0.00 H new ATOM 0 HB3 MET B 789 7.790 1.131 -5.036 1.00 0.00 H new ATOM 0 HG2 MET B 789 9.174 0.486 -2.500 1.00 0.00 H new ATOM 0 HG3 MET B 789 10.253 0.427 -3.879 1.00 0.00 H new ATOM 0 HE1 MET B 789 7.607 3.991 -2.605 1.00 0.00 H new ATOM 0 HE2 MET B 789 6.977 2.425 -3.168 1.00 0.00 H new ATOM 0 HE3 MET B 789 7.907 2.518 -1.653 1.00 0.00 H new ATOM 1479 N ALA B 790 5.557 -1.409 -5.025 1.00 0.00 N ATOM 1480 CA ALA B 790 4.324 -1.577 -5.844 1.00 0.00 C ATOM 1481 C ALA B 790 3.089 -1.706 -4.951 1.00 0.00 C ATOM 1482 O ALA B 790 2.226 -0.851 -4.943 1.00 0.00 O ATOM 1483 CB ALA B 790 4.550 -2.874 -6.621 1.00 0.00 C ATOM 0 H ALA B 790 6.213 -2.189 -5.063 1.00 0.00 H new ATOM 0 HA ALA B 790 4.149 -0.722 -6.496 1.00 0.00 H new ATOM 0 HB1 ALA B 790 3.685 -3.075 -7.253 1.00 0.00 H new ATOM 0 HB2 ALA B 790 5.439 -2.775 -7.243 1.00 0.00 H new ATOM 0 HB3 ALA B 790 4.687 -3.698 -5.921 1.00 0.00 H new ATOM 1489 N ASP B 791 2.988 -2.777 -4.208 1.00 0.00 N ATOM 1490 CA ASP B 791 1.796 -2.967 -3.330 1.00 0.00 C ATOM 1491 C ASP B 791 1.536 -1.709 -2.493 1.00 0.00 C ATOM 1492 O ASP B 791 0.413 -1.261 -2.365 1.00 0.00 O ATOM 1493 CB ASP B 791 2.155 -4.151 -2.429 1.00 0.00 C ATOM 1494 CG ASP B 791 2.505 -5.363 -3.295 1.00 0.00 C ATOM 1495 OD1 ASP B 791 1.689 -5.729 -4.125 1.00 0.00 O ATOM 1496 OD2 ASP B 791 3.583 -5.905 -3.113 1.00 0.00 O ATOM 0 H ASP B 791 3.678 -3.527 -4.171 1.00 0.00 H new ATOM 0 HA ASP B 791 0.888 -3.150 -3.904 1.00 0.00 H new ATOM 0 HB2 ASP B 791 2.998 -3.892 -1.789 1.00 0.00 H new ATOM 0 HB3 ASP B 791 1.318 -4.389 -1.773 1.00 0.00 H new ATOM 1501 N LEU B 792 2.564 -1.123 -1.940 1.00 0.00 N ATOM 1502 CA LEU B 792 2.370 0.121 -1.140 1.00 0.00 C ATOM 1503 C LEU B 792 1.953 1.270 -2.061 1.00 0.00 C ATOM 1504 O LEU B 792 0.961 1.933 -1.830 1.00 0.00 O ATOM 1505 CB LEU B 792 3.738 0.398 -0.506 1.00 0.00 C ATOM 1506 CG LEU B 792 3.562 0.809 0.962 1.00 0.00 C ATOM 1507 CD1 LEU B 792 2.805 -0.283 1.722 1.00 0.00 C ATOM 1508 CD2 LEU B 792 4.937 1.004 1.604 1.00 0.00 C ATOM 0 H LEU B 792 3.528 -1.451 -2.007 1.00 0.00 H new ATOM 0 HA LEU B 792 1.589 0.020 -0.386 1.00 0.00 H new ATOM 0 HB2 LEU B 792 4.365 -0.491 -0.571 1.00 0.00 H new ATOM 0 HB3 LEU B 792 4.249 1.189 -1.055 1.00 0.00 H new ATOM 0 HG LEU B 792 2.996 1.740 1.006 1.00 0.00 H new ATOM 0 HD11 LEU B 792 2.684 0.016 2.763 1.00 0.00 H new ATOM 0 HD12 LEU B 792 1.824 -0.428 1.270 1.00 0.00 H new ATOM 0 HD13 LEU B 792 3.367 -1.216 1.675 1.00 0.00 H new ATOM 0 HD21 LEU B 792 4.814 1.296 2.647 1.00 0.00 H new ATOM 0 HD22 LEU B 792 5.498 0.071 1.552 1.00 0.00 H new ATOM 0 HD23 LEU B 792 5.480 1.784 1.071 1.00 0.00 H new ATOM 1520 N GLN B 793 2.682 1.493 -3.123 1.00 0.00 N ATOM 1521 CA GLN B 793 2.297 2.578 -4.072 1.00 0.00 C ATOM 1522 C GLN B 793 0.898 2.306 -4.624 1.00 0.00 C ATOM 1523 O GLN B 793 0.145 3.213 -4.917 1.00 0.00 O ATOM 1524 CB GLN B 793 3.337 2.512 -5.193 1.00 0.00 C ATOM 1525 CG GLN B 793 3.100 3.652 -6.183 1.00 0.00 C ATOM 1526 CD GLN B 793 2.018 3.246 -7.185 1.00 0.00 C ATOM 1527 OE1 GLN B 793 1.085 3.987 -7.420 1.00 0.00 O ATOM 1528 NE2 GLN B 793 2.108 2.097 -7.797 1.00 0.00 N ATOM 0 H GLN B 793 3.523 0.973 -3.373 1.00 0.00 H new ATOM 0 HA GLN B 793 2.274 3.559 -3.598 1.00 0.00 H new ATOM 0 HB2 GLN B 793 4.341 2.583 -4.775 1.00 0.00 H new ATOM 0 HB3 GLN B 793 3.272 1.552 -5.706 1.00 0.00 H new ATOM 0 HG2 GLN B 793 2.796 4.553 -5.650 1.00 0.00 H new ATOM 0 HG3 GLN B 793 4.025 3.889 -6.708 1.00 0.00 H new ATOM 0 HE21 GLN B 793 2.891 1.474 -7.600 1.00 0.00 H new ATOM 0 HE22 GLN B 793 1.395 1.822 -8.472 1.00 0.00 H new ATOM 1537 N ARG B 794 0.541 1.057 -4.756 1.00 0.00 N ATOM 1538 CA ARG B 794 -0.815 0.716 -5.260 1.00 0.00 C ATOM 1539 C ARG B 794 -1.858 1.027 -4.186 1.00 0.00 C ATOM 1540 O ARG B 794 -2.886 1.615 -4.454 1.00 0.00 O ATOM 1541 CB ARG B 794 -0.763 -0.788 -5.537 1.00 0.00 C ATOM 1542 CG ARG B 794 -0.342 -1.024 -6.989 1.00 0.00 C ATOM 1543 CD ARG B 794 -1.507 -0.683 -7.919 1.00 0.00 C ATOM 1544 NE ARG B 794 -1.544 -1.797 -8.913 1.00 0.00 N ATOM 1545 CZ ARG B 794 -0.675 -1.852 -9.896 1.00 0.00 C ATOM 1546 NH1 ARG B 794 0.249 -0.933 -10.034 1.00 0.00 N ATOM 1547 NH2 ARG B 794 -0.732 -2.837 -10.750 1.00 0.00 N ATOM 0 H ARG B 794 1.134 0.257 -4.535 1.00 0.00 H new ATOM 0 HA ARG B 794 -1.088 1.284 -6.149 1.00 0.00 H new ATOM 0 HB2 ARG B 794 -0.058 -1.269 -4.860 1.00 0.00 H new ATOM 0 HB3 ARG B 794 -1.739 -1.237 -5.352 1.00 0.00 H new ATOM 0 HG2 ARG B 794 0.524 -0.408 -7.232 1.00 0.00 H new ATOM 0 HG3 ARG B 794 -0.044 -2.063 -7.128 1.00 0.00 H new ATOM 0 HD2 ARG B 794 -2.445 -0.614 -7.368 1.00 0.00 H new ATOM 0 HD3 ARG B 794 -1.353 0.279 -8.409 1.00 0.00 H new ATOM 0 HE ARG B 794 -2.254 -2.525 -8.827 1.00 0.00 H new ATOM 0 HH11 ARG B 794 0.301 -0.159 -9.372 1.00 0.00 H new ATOM 0 HH12 ARG B 794 0.916 -0.992 -10.804 1.00 0.00 H new ATOM 0 HH21 ARG B 794 -1.448 -3.557 -10.651 1.00 0.00 H new ATOM 0 HH22 ARG B 794 -0.061 -2.887 -11.516 1.00 0.00 H new ATOM 1561 N VAL B 795 -1.593 0.642 -2.966 1.00 0.00 N ATOM 1562 CA VAL B 795 -2.553 0.925 -1.866 1.00 0.00 C ATOM 1563 C VAL B 795 -2.834 2.424 -1.794 1.00 0.00 C ATOM 1564 O VAL B 795 -3.928 2.844 -1.486 1.00 0.00 O ATOM 1565 CB VAL B 795 -1.845 0.451 -0.594 1.00 0.00 C ATOM 1566 CG1 VAL B 795 -2.698 0.798 0.629 1.00 0.00 C ATOM 1567 CG2 VAL B 795 -1.645 -1.064 -0.660 1.00 0.00 C ATOM 0 H VAL B 795 -0.749 0.142 -2.686 1.00 0.00 H new ATOM 0 HA VAL B 795 -3.511 0.425 -2.009 1.00 0.00 H new ATOM 0 HB VAL B 795 -0.877 0.946 -0.512 1.00 0.00 H new ATOM 0 HG11 VAL B 795 -2.192 0.460 1.533 1.00 0.00 H new ATOM 0 HG12 VAL B 795 -2.844 1.877 0.677 1.00 0.00 H new ATOM 0 HG13 VAL B 795 -3.667 0.305 0.549 1.00 0.00 H new ATOM 0 HG21 VAL B 795 -1.141 -1.404 0.245 1.00 0.00 H new ATOM 0 HG22 VAL B 795 -2.614 -1.556 -0.742 1.00 0.00 H new ATOM 0 HG23 VAL B 795 -1.037 -1.313 -1.530 1.00 0.00 H new ATOM 1577 N PHE B 796 -1.855 3.234 -2.082 1.00 0.00 N ATOM 1578 CA PHE B 796 -2.073 4.705 -2.029 1.00 0.00 C ATOM 1579 C PHE B 796 -2.776 5.190 -3.298 1.00 0.00 C ATOM 1580 O PHE B 796 -3.815 5.815 -3.243 1.00 0.00 O ATOM 1581 CB PHE B 796 -0.669 5.308 -1.936 1.00 0.00 C ATOM 1582 CG PHE B 796 0.045 4.757 -0.724 1.00 0.00 C ATOM 1583 CD1 PHE B 796 -0.630 4.642 0.499 1.00 0.00 C ATOM 1584 CD2 PHE B 796 1.387 4.370 -0.820 1.00 0.00 C ATOM 1585 CE1 PHE B 796 0.034 4.133 1.621 1.00 0.00 C ATOM 1586 CE2 PHE B 796 2.051 3.861 0.303 1.00 0.00 C ATOM 1587 CZ PHE B 796 1.375 3.743 1.523 1.00 0.00 C ATOM 0 H PHE B 796 -0.916 2.942 -2.351 1.00 0.00 H new ATOM 0 HA PHE B 796 -2.704 4.995 -1.189 1.00 0.00 H new ATOM 0 HB2 PHE B 796 -0.104 5.077 -2.839 1.00 0.00 H new ATOM 0 HB3 PHE B 796 -0.733 6.394 -1.869 1.00 0.00 H new ATOM 0 HD1 PHE B 796 -1.663 4.946 0.576 1.00 0.00 H new ATOM 0 HD2 PHE B 796 1.910 4.464 -1.760 1.00 0.00 H new ATOM 0 HE1 PHE B 796 -0.488 4.041 2.562 1.00 0.00 H new ATOM 0 HE2 PHE B 796 3.085 3.559 0.228 1.00 0.00 H new ATOM 0 HZ PHE B 796 1.888 3.351 2.389 1.00 0.00 H new ATOM 1597 N THR B 797 -2.220 4.908 -4.443 1.00 0.00 N ATOM 1598 CA THR B 797 -2.843 5.389 -5.708 1.00 0.00 C ATOM 1599 C THR B 797 -4.226 4.763 -5.923 1.00 0.00 C ATOM 1600 O THR B 797 -5.130 5.407 -6.418 1.00 0.00 O ATOM 1601 CB THR B 797 -1.879 4.958 -6.814 1.00 0.00 C ATOM 1602 OG1 THR B 797 -2.333 5.461 -8.062 1.00 0.00 O ATOM 1603 CG2 THR B 797 -1.825 3.437 -6.868 1.00 0.00 C ATOM 0 H THR B 797 -1.363 4.367 -4.558 1.00 0.00 H new ATOM 0 HA THR B 797 -2.999 6.468 -5.693 1.00 0.00 H new ATOM 0 HB THR B 797 -0.884 5.352 -6.606 1.00 0.00 H new ATOM 0 HG1 THR B 797 -1.714 5.186 -8.770 1.00 0.00 H new ATOM 0 HG21 THR B 797 -1.139 3.125 -7.655 1.00 0.00 H new ATOM 0 HG22 THR B 797 -1.477 3.051 -5.910 1.00 0.00 H new ATOM 0 HG23 THR B 797 -2.820 3.045 -7.078 1.00 0.00 H new ATOM 1611 N ASN B 798 -4.404 3.514 -5.574 1.00 0.00 N ATOM 1612 CA ASN B 798 -5.733 2.875 -5.806 1.00 0.00 C ATOM 1613 C ASN B 798 -6.756 3.352 -4.761 1.00 0.00 C ATOM 1614 O ASN B 798 -7.877 3.683 -5.091 1.00 0.00 O ATOM 1615 CB ASN B 798 -5.473 1.347 -5.759 1.00 0.00 C ATOM 1616 CG ASN B 798 -5.734 0.739 -4.366 1.00 0.00 C ATOM 1617 OD1 ASN B 798 -6.798 0.901 -3.802 1.00 0.00 O ATOM 1618 ND2 ASN B 798 -4.819 -0.011 -3.817 1.00 0.00 N ATOM 0 H ASN B 798 -3.697 2.917 -5.145 1.00 0.00 H new ATOM 0 HA ASN B 798 -6.169 3.149 -6.766 1.00 0.00 H new ATOM 0 HB2 ASN B 798 -6.110 0.852 -6.492 1.00 0.00 H new ATOM 0 HB3 ASN B 798 -4.441 1.150 -6.049 1.00 0.00 H new ATOM 0 HD21 ASN B 798 -4.998 -0.459 -2.918 1.00 0.00 H new ATOM 0 HD22 ASN B 798 -3.924 -0.150 -4.287 1.00 0.00 H new ATOM 1625 N CYS B 799 -6.390 3.380 -3.505 1.00 0.00 N ATOM 1626 CA CYS B 799 -7.361 3.846 -2.472 1.00 0.00 C ATOM 1627 C CYS B 799 -7.741 5.301 -2.741 1.00 0.00 C ATOM 1628 O CYS B 799 -8.856 5.719 -2.500 1.00 0.00 O ATOM 1629 CB CYS B 799 -6.629 3.725 -1.136 1.00 0.00 C ATOM 1630 SG CYS B 799 -6.513 1.981 -0.668 1.00 0.00 S ATOM 0 H CYS B 799 -5.473 3.104 -3.154 1.00 0.00 H new ATOM 0 HA CYS B 799 -8.280 3.261 -2.478 1.00 0.00 H new ATOM 0 HB2 CYS B 799 -5.632 4.159 -1.215 1.00 0.00 H new ATOM 0 HB3 CYS B 799 -7.160 4.285 -0.366 1.00 0.00 H new ATOM 0 HG CYS B 799 -6.044 1.886 0.541 1.00 0.00 H new ATOM 1636 N LYS B 800 -6.820 6.073 -3.246 1.00 0.00 N ATOM 1637 CA LYS B 800 -7.132 7.490 -3.573 1.00 0.00 C ATOM 1638 C LYS B 800 -7.989 7.550 -4.840 1.00 0.00 C ATOM 1639 O LYS B 800 -8.653 8.531 -5.109 1.00 0.00 O ATOM 1640 CB LYS B 800 -5.769 8.144 -3.816 1.00 0.00 C ATOM 1641 CG LYS B 800 -5.094 8.434 -2.474 1.00 0.00 C ATOM 1642 CD LYS B 800 -4.421 9.808 -2.530 1.00 0.00 C ATOM 1643 CE LYS B 800 -2.900 9.630 -2.534 1.00 0.00 C ATOM 1644 NZ LYS B 800 -2.416 10.505 -3.639 1.00 0.00 N ATOM 0 H LYS B 800 -5.863 5.782 -3.446 1.00 0.00 H new ATOM 0 HA LYS B 800 -7.689 7.992 -2.782 1.00 0.00 H new ATOM 0 HB2 LYS B 800 -5.140 7.486 -4.416 1.00 0.00 H new ATOM 0 HB3 LYS B 800 -5.893 9.069 -4.380 1.00 0.00 H new ATOM 0 HG2 LYS B 800 -5.831 8.410 -1.671 1.00 0.00 H new ATOM 0 HG3 LYS B 800 -4.355 7.664 -2.252 1.00 0.00 H new ATOM 0 HD2 LYS B 800 -4.738 10.344 -3.425 1.00 0.00 H new ATOM 0 HD3 LYS B 800 -4.726 10.409 -1.673 1.00 0.00 H new ATOM 0 HE2 LYS B 800 -2.465 9.923 -1.578 1.00 0.00 H new ATOM 0 HE3 LYS B 800 -2.624 8.589 -2.704 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 -1.380 10.438 -3.706 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 -2.842 10.198 -4.537 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 -2.688 11.490 -3.446 1.00 0.00 H new ATOM 1658 N GLU B 801 -7.983 6.498 -5.615 1.00 0.00 N ATOM 1659 CA GLU B 801 -8.795 6.477 -6.862 1.00 0.00 C ATOM 1660 C GLU B 801 -10.290 6.361 -6.542 1.00 0.00 C ATOM 1661 O GLU B 801 -11.127 6.474 -7.416 1.00 0.00 O ATOM 1662 CB GLU B 801 -8.316 5.235 -7.612 1.00 0.00 C ATOM 1663 CG GLU B 801 -7.670 5.657 -8.929 1.00 0.00 C ATOM 1664 CD GLU B 801 -8.681 6.436 -9.774 1.00 0.00 C ATOM 1665 OE1 GLU B 801 -9.868 6.221 -9.590 1.00 0.00 O ATOM 1666 OE2 GLU B 801 -8.251 7.234 -10.590 1.00 0.00 O ATOM 0 H GLU B 801 -7.447 5.649 -5.435 1.00 0.00 H new ATOM 0 HA GLU B 801 -8.674 7.391 -7.443 1.00 0.00 H new ATOM 0 HB2 GLU B 801 -7.600 4.683 -7.003 1.00 0.00 H new ATOM 0 HB3 GLU B 801 -9.155 4.566 -7.803 1.00 0.00 H new ATOM 0 HG2 GLU B 801 -6.793 6.274 -8.734 1.00 0.00 H new ATOM 0 HG3 GLU B 801 -7.326 4.778 -9.474 1.00 0.00 H new ATOM 1673 N TYR B 802 -10.639 6.128 -5.303 1.00 0.00 N ATOM 1674 CA TYR B 802 -12.082 5.987 -4.957 1.00 0.00 C ATOM 1675 C TYR B 802 -12.409 6.716 -3.648 1.00 0.00 C ATOM 1676 O TYR B 802 -13.447 7.333 -3.521 1.00 0.00 O ATOM 1677 CB TYR B 802 -12.293 4.478 -4.796 1.00 0.00 C ATOM 1678 CG TYR B 802 -13.699 4.210 -4.313 1.00 0.00 C ATOM 1679 CD1 TYR B 802 -14.793 4.703 -5.033 1.00 0.00 C ATOM 1680 CD2 TYR B 802 -13.906 3.488 -3.132 1.00 0.00 C ATOM 1681 CE1 TYR B 802 -16.095 4.462 -4.581 1.00 0.00 C ATOM 1682 CE2 TYR B 802 -15.208 3.249 -2.679 1.00 0.00 C ATOM 1683 CZ TYR B 802 -16.303 3.734 -3.404 1.00 0.00 C ATOM 1684 OH TYR B 802 -17.587 3.497 -2.957 1.00 0.00 O ATOM 0 H TYR B 802 -9.991 6.030 -4.522 1.00 0.00 H new ATOM 0 HA TYR B 802 -12.729 6.422 -5.719 1.00 0.00 H new ATOM 0 HB2 TYR B 802 -12.122 3.974 -5.747 1.00 0.00 H new ATOM 0 HB3 TYR B 802 -11.571 4.074 -4.087 1.00 0.00 H new ATOM 0 HD1 TYR B 802 -14.632 5.270 -5.938 1.00 0.00 H new ATOM 0 HD2 TYR B 802 -13.062 3.116 -2.571 1.00 0.00 H new ATOM 0 HE1 TYR B 802 -16.939 4.838 -5.140 1.00 0.00 H new ATOM 0 HE2 TYR B 802 -15.368 2.690 -1.769 1.00 0.00 H new ATOM 0 HH TYR B 802 -17.554 2.977 -2.127 1.00 0.00 H new ATOM 1694 N ASN B 803 -11.543 6.627 -2.670 1.00 0.00 N ATOM 1695 CA ASN B 803 -11.810 7.285 -1.354 1.00 0.00 C ATOM 1696 C ASN B 803 -12.363 8.707 -1.535 1.00 0.00 C ATOM 1697 O ASN B 803 -12.191 9.310 -2.575 1.00 0.00 O ATOM 1698 CB ASN B 803 -10.447 7.323 -0.662 1.00 0.00 C ATOM 1699 CG ASN B 803 -10.235 6.014 0.100 1.00 0.00 C ATOM 1700 OD1 ASN B 803 -11.177 5.435 0.601 1.00 0.00 O ATOM 1701 ND2 ASN B 803 -9.033 5.517 0.205 1.00 0.00 N ATOM 0 H ASN B 803 -10.657 6.124 -2.727 1.00 0.00 H new ATOM 0 HA ASN B 803 -12.561 6.745 -0.777 1.00 0.00 H new ATOM 0 HB2 ASN B 803 -9.655 7.462 -1.398 1.00 0.00 H new ATOM 0 HB3 ASN B 803 -10.397 8.169 0.023 1.00 0.00 H new ATOM 0 HD21 ASN B 803 -8.885 4.642 0.708 1.00 0.00 H new ATOM 0 HD22 ASN B 803 -8.241 6.003 -0.216 1.00 0.00 H new ATOM 1708 N PRO B 804 -13.044 9.184 -0.517 1.00 0.00 N ATOM 1709 CA PRO B 804 -13.650 10.537 -0.573 1.00 0.00 C ATOM 1710 C PRO B 804 -12.638 11.575 -1.069 1.00 0.00 C ATOM 1711 O PRO B 804 -11.448 11.394 -0.918 1.00 0.00 O ATOM 1712 CB PRO B 804 -14.037 10.816 0.877 1.00 0.00 C ATOM 1713 CG PRO B 804 -14.204 9.471 1.507 1.00 0.00 C ATOM 1714 CD PRO B 804 -13.304 8.516 0.769 1.00 0.00 C ATOM 0 HA PRO B 804 -14.494 10.591 -1.260 1.00 0.00 H new ATOM 0 HB2 PRO B 804 -13.266 11.395 1.385 1.00 0.00 H new ATOM 0 HB3 PRO B 804 -14.959 11.394 0.934 1.00 0.00 H new ATOM 0 HG2 PRO B 804 -13.942 9.507 2.564 1.00 0.00 H new ATOM 0 HG3 PRO B 804 -15.242 9.145 1.447 1.00 0.00 H new ATOM 0 HD2 PRO B 804 -12.380 8.335 1.318 1.00 0.00 H new ATOM 0 HD3 PRO B 804 -13.784 7.548 0.625 1.00 0.00 H new ATOM 1722 N PRO B 805 -13.143 12.637 -1.651 1.00 0.00 N ATOM 1723 CA PRO B 805 -12.253 13.710 -2.156 1.00 0.00 C ATOM 1724 C PRO B 805 -11.539 14.394 -0.989 1.00 0.00 C ATOM 1725 O PRO B 805 -11.934 15.453 -0.542 1.00 0.00 O ATOM 1726 CB PRO B 805 -13.205 14.685 -2.850 1.00 0.00 C ATOM 1727 CG PRO B 805 -14.558 14.394 -2.280 1.00 0.00 C ATOM 1728 CD PRO B 805 -14.563 12.946 -1.871 1.00 0.00 C ATOM 0 HA PRO B 805 -11.476 13.339 -2.824 1.00 0.00 H new ATOM 0 HB2 PRO B 805 -12.914 15.719 -2.663 1.00 0.00 H new ATOM 0 HB3 PRO B 805 -13.195 14.542 -3.931 1.00 0.00 H new ATOM 0 HG2 PRO B 805 -14.762 15.037 -1.424 1.00 0.00 H new ATOM 0 HG3 PRO B 805 -15.337 14.589 -3.017 1.00 0.00 H new ATOM 0 HD2 PRO B 805 -15.151 12.788 -0.967 1.00 0.00 H new ATOM 0 HD3 PRO B 805 -14.994 12.313 -2.647 1.00 0.00 H new ATOM 1736 N GLU B 806 -10.497 13.792 -0.485 1.00 0.00 N ATOM 1737 CA GLU B 806 -9.770 14.398 0.666 1.00 0.00 C ATOM 1738 C GLU B 806 -10.743 14.679 1.812 1.00 0.00 C ATOM 1739 O GLU B 806 -10.720 15.733 2.416 1.00 0.00 O ATOM 1740 CB GLU B 806 -9.186 15.706 0.125 1.00 0.00 C ATOM 1741 CG GLU B 806 -8.149 16.247 1.110 1.00 0.00 C ATOM 1742 CD GLU B 806 -7.866 17.717 0.795 1.00 0.00 C ATOM 1743 OE1 GLU B 806 -7.098 17.970 -0.119 1.00 0.00 O ATOM 1744 OE2 GLU B 806 -8.424 18.565 1.471 1.00 0.00 O ATOM 0 H GLU B 806 -10.118 12.907 -0.820 1.00 0.00 H new ATOM 0 HA GLU B 806 -8.995 13.739 1.059 1.00 0.00 H new ATOM 0 HB2 GLU B 806 -8.725 15.536 -0.848 1.00 0.00 H new ATOM 0 HB3 GLU B 806 -9.980 16.438 -0.022 1.00 0.00 H new ATOM 0 HG2 GLU B 806 -8.515 16.147 2.132 1.00 0.00 H new ATOM 0 HG3 GLU B 806 -7.229 15.666 1.042 1.00 0.00 H new ATOM 1751 N SER B 807 -11.606 13.745 2.112 1.00 0.00 N ATOM 1752 CA SER B 807 -12.582 13.959 3.217 1.00 0.00 C ATOM 1753 C SER B 807 -12.074 13.315 4.507 1.00 0.00 C ATOM 1754 O SER B 807 -11.761 13.992 5.466 1.00 0.00 O ATOM 1755 CB SER B 807 -13.868 13.274 2.748 1.00 0.00 C ATOM 1756 OG SER B 807 -14.991 14.015 3.203 1.00 0.00 O ATOM 0 H SER B 807 -11.676 12.844 1.639 1.00 0.00 H new ATOM 0 HA SER B 807 -12.736 15.017 3.430 1.00 0.00 H new ATOM 0 HB2 SER B 807 -13.880 13.205 1.660 1.00 0.00 H new ATOM 0 HB3 SER B 807 -13.911 12.255 3.132 1.00 0.00 H new ATOM 0 HG SER B 807 -15.815 13.578 2.902 1.00 0.00 H new ATOM 1762 N GLU B 808 -11.989 12.015 4.541 1.00 0.00 N ATOM 1763 CA GLU B 808 -11.494 11.339 5.774 1.00 0.00 C ATOM 1764 C GLU B 808 -10.656 10.115 5.410 1.00 0.00 C ATOM 1765 O GLU B 808 -9.618 9.868 5.989 1.00 0.00 O ATOM 1766 CB GLU B 808 -12.756 10.917 6.527 1.00 0.00 C ATOM 1767 CG GLU B 808 -12.701 11.463 7.956 1.00 0.00 C ATOM 1768 CD GLU B 808 -11.744 10.609 8.791 1.00 0.00 C ATOM 1769 OE1 GLU B 808 -12.149 9.536 9.208 1.00 0.00 O ATOM 1770 OE2 GLU B 808 -10.624 11.043 9.001 1.00 0.00 O ATOM 0 H GLU B 808 -12.239 11.393 3.773 1.00 0.00 H new ATOM 0 HA GLU B 808 -10.858 11.991 6.373 1.00 0.00 H new ATOM 0 HB2 GLU B 808 -13.641 11.294 6.015 1.00 0.00 H new ATOM 0 HB3 GLU B 808 -12.837 9.830 6.544 1.00 0.00 H new ATOM 0 HG2 GLU B 808 -12.367 12.501 7.948 1.00 0.00 H new ATOM 0 HG3 GLU B 808 -13.697 11.452 8.400 1.00 0.00 H new ATOM 1777 N TYR B 809 -11.104 9.340 4.463 1.00 0.00 N ATOM 1778 CA TYR B 809 -10.328 8.132 4.060 1.00 0.00 C ATOM 1779 C TYR B 809 -9.188 8.527 3.120 1.00 0.00 C ATOM 1780 O TYR B 809 -8.053 8.135 3.307 1.00 0.00 O ATOM 1781 CB TYR B 809 -11.337 7.240 3.334 1.00 0.00 C ATOM 1782 CG TYR B 809 -11.643 6.031 4.186 1.00 0.00 C ATOM 1783 CD1 TYR B 809 -12.000 6.195 5.530 1.00 0.00 C ATOM 1784 CD2 TYR B 809 -11.571 4.746 3.633 1.00 0.00 C ATOM 1785 CE1 TYR B 809 -12.284 5.076 6.321 1.00 0.00 C ATOM 1786 CE2 TYR B 809 -11.856 3.627 4.424 1.00 0.00 C ATOM 1787 CZ TYR B 809 -12.212 3.792 5.768 1.00 0.00 C ATOM 1788 OH TYR B 809 -12.493 2.688 6.548 1.00 0.00 O ATOM 0 H TYR B 809 -11.973 9.489 3.950 1.00 0.00 H new ATOM 0 HA TYR B 809 -9.875 7.626 4.913 1.00 0.00 H new ATOM 0 HB2 TYR B 809 -12.252 7.797 3.132 1.00 0.00 H new ATOM 0 HB3 TYR B 809 -10.935 6.927 2.370 1.00 0.00 H new ATOM 0 HD1 TYR B 809 -12.056 7.186 5.956 1.00 0.00 H new ATOM 0 HD2 TYR B 809 -11.296 4.619 2.596 1.00 0.00 H new ATOM 0 HE1 TYR B 809 -12.559 5.203 7.358 1.00 0.00 H new ATOM 0 HE2 TYR B 809 -11.801 2.636 3.998 1.00 0.00 H new ATOM 0 HH TYR B 809 -12.397 1.874 6.010 1.00 0.00 H new ATOM 1798 N TYR B 810 -9.480 9.304 2.115 1.00 0.00 N ATOM 1799 CA TYR B 810 -8.411 9.732 1.170 1.00 0.00 C ATOM 1800 C TYR B 810 -7.366 10.573 1.904 1.00 0.00 C ATOM 1801 O TYR B 810 -6.209 10.603 1.535 1.00 0.00 O ATOM 1802 CB TYR B 810 -9.135 10.576 0.121 1.00 0.00 C ATOM 1803 CG TYR B 810 -8.142 11.088 -0.895 1.00 0.00 C ATOM 1804 CD1 TYR B 810 -7.278 12.138 -0.562 1.00 0.00 C ATOM 1805 CD2 TYR B 810 -8.092 10.518 -2.172 1.00 0.00 C ATOM 1806 CE1 TYR B 810 -6.361 12.615 -1.506 1.00 0.00 C ATOM 1807 CE2 TYR B 810 -7.176 10.995 -3.116 1.00 0.00 C ATOM 1808 CZ TYR B 810 -6.311 12.044 -2.784 1.00 0.00 C ATOM 1809 OH TYR B 810 -5.404 12.512 -3.714 1.00 0.00 O ATOM 0 H TYR B 810 -10.412 9.661 1.907 1.00 0.00 H new ATOM 0 HA TYR B 810 -7.884 8.887 0.726 1.00 0.00 H new ATOM 0 HB2 TYR B 810 -9.901 9.979 -0.374 1.00 0.00 H new ATOM 0 HB3 TYR B 810 -9.643 11.413 0.601 1.00 0.00 H new ATOM 0 HD1 TYR B 810 -7.319 12.580 0.423 1.00 0.00 H new ATOM 0 HD2 TYR B 810 -8.761 9.710 -2.429 1.00 0.00 H new ATOM 0 HE1 TYR B 810 -5.692 13.423 -1.249 1.00 0.00 H new ATOM 0 HE2 TYR B 810 -7.136 10.554 -4.101 1.00 0.00 H new ATOM 0 HH TYR B 810 -5.500 12.007 -4.548 1.00 0.00 H new ATOM 1819 N LYS B 811 -7.766 11.254 2.943 1.00 0.00 N ATOM 1820 CA LYS B 811 -6.794 12.089 3.703 1.00 0.00 C ATOM 1821 C LYS B 811 -5.736 11.208 4.370 1.00 0.00 C ATOM 1822 O LYS B 811 -4.704 11.685 4.797 1.00 0.00 O ATOM 1823 CB LYS B 811 -7.633 12.802 4.766 1.00 0.00 C ATOM 1824 CG LYS B 811 -8.180 14.110 4.192 1.00 0.00 C ATOM 1825 CD LYS B 811 -7.747 15.280 5.078 1.00 0.00 C ATOM 1826 CE LYS B 811 -6.288 15.632 4.780 1.00 0.00 C ATOM 1827 NZ LYS B 811 -6.243 17.121 4.794 1.00 0.00 N ATOM 0 H LYS B 811 -8.722 11.268 3.298 1.00 0.00 H new ATOM 0 HA LYS B 811 -6.263 12.788 3.056 1.00 0.00 H new ATOM 0 HB2 LYS B 811 -8.455 12.161 5.086 1.00 0.00 H new ATOM 0 HB3 LYS B 811 -7.025 13.005 5.648 1.00 0.00 H new ATOM 0 HG2 LYS B 811 -7.813 14.255 3.176 1.00 0.00 H new ATOM 0 HG3 LYS B 811 -9.268 14.067 4.135 1.00 0.00 H new ATOM 0 HD2 LYS B 811 -8.386 16.144 4.895 1.00 0.00 H new ATOM 0 HD3 LYS B 811 -7.861 15.016 6.129 1.00 0.00 H new ATOM 0 HE2 LYS B 811 -5.619 15.209 5.529 1.00 0.00 H new ATOM 0 HE3 LYS B 811 -5.975 15.236 3.814 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 -5.273 17.441 4.597 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 -6.885 17.495 4.066 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 -6.539 17.468 5.728 1.00 0.00 H new ATOM 1841 N CYS B 812 -5.990 9.931 4.492 1.00 0.00 N ATOM 1842 CA CYS B 812 -4.979 9.039 5.138 1.00 0.00 C ATOM 1843 C CYS B 812 -3.894 8.683 4.121 1.00 0.00 C ATOM 1844 O CYS B 812 -2.717 8.710 4.420 1.00 0.00 O ATOM 1845 CB CYS B 812 -5.709 7.758 5.609 1.00 0.00 C ATOM 1846 SG CYS B 812 -7.389 8.109 6.208 1.00 0.00 S ATOM 0 H CYS B 812 -6.844 9.470 4.177 1.00 0.00 H new ATOM 0 HA CYS B 812 -4.510 9.536 5.987 1.00 0.00 H new ATOM 0 HB2 CYS B 812 -5.760 7.046 4.785 1.00 0.00 H new ATOM 0 HB3 CYS B 812 -5.133 7.284 6.404 1.00 0.00 H new ATOM 0 HG CYS B 812 -7.855 9.160 5.601 1.00 0.00 H new ATOM 1852 N ALA B 813 -4.280 8.365 2.913 1.00 0.00 N ATOM 1853 CA ALA B 813 -3.265 8.018 1.877 1.00 0.00 C ATOM 1854 C ALA B 813 -2.272 9.168 1.700 1.00 0.00 C ATOM 1855 O ALA B 813 -1.092 8.956 1.526 1.00 0.00 O ATOM 1856 CB ALA B 813 -4.063 7.809 0.589 1.00 0.00 C ATOM 0 H ALA B 813 -5.250 8.331 2.601 1.00 0.00 H new ATOM 0 HA ALA B 813 -2.689 7.134 2.151 1.00 0.00 H new ATOM 0 HB1 ALA B 813 -3.383 7.550 -0.222 1.00 0.00 H new ATOM 0 HB2 ALA B 813 -4.781 7.002 0.733 1.00 0.00 H new ATOM 0 HB3 ALA B 813 -4.595 8.727 0.337 1.00 0.00 H new ATOM 1862 N ASN B 814 -2.742 10.385 1.734 1.00 0.00 N ATOM 1863 CA ASN B 814 -1.817 11.542 1.567 1.00 0.00 C ATOM 1864 C ASN B 814 -0.711 11.491 2.624 1.00 0.00 C ATOM 1865 O ASN B 814 0.464 11.554 2.315 1.00 0.00 O ATOM 1866 CB ASN B 814 -2.695 12.778 1.772 1.00 0.00 C ATOM 1867 CG ASN B 814 -2.128 13.946 0.963 1.00 0.00 C ATOM 1868 OD1 ASN B 814 -2.254 13.982 -0.245 1.00 0.00 O ATOM 1869 ND2 ASN B 814 -1.502 14.910 1.582 1.00 0.00 N ATOM 0 H ASN B 814 -3.723 10.628 1.870 1.00 0.00 H new ATOM 0 HA ASN B 814 -1.327 11.544 0.594 1.00 0.00 H new ATOM 0 HB2 ASN B 814 -3.717 12.567 1.459 1.00 0.00 H new ATOM 0 HB3 ASN B 814 -2.733 13.039 2.830 1.00 0.00 H new ATOM 0 HD21 ASN B 814 -1.119 15.693 1.052 1.00 0.00 H new ATOM 0 HD22 ASN B 814 -1.396 14.881 2.596 1.00 0.00 H new ATOM 1876 N ILE B 815 -1.079 11.379 3.871 1.00 0.00 N ATOM 1877 CA ILE B 815 -0.055 11.300 4.948 1.00 0.00 C ATOM 1878 C ILE B 815 0.814 10.065 4.732 1.00 0.00 C ATOM 1879 O ILE B 815 2.013 10.149 4.561 1.00 0.00 O ATOM 1880 CB ILE B 815 -0.871 11.164 6.243 1.00 0.00 C ATOM 1881 CG1 ILE B 815 -1.557 12.497 6.550 1.00 0.00 C ATOM 1882 CG2 ILE B 815 0.049 10.779 7.409 1.00 0.00 C ATOM 1883 CD1 ILE B 815 -3.047 12.260 6.814 1.00 0.00 C ATOM 0 H ILE B 815 -2.047 11.339 4.190 1.00 0.00 H new ATOM 0 HA ILE B 815 0.609 12.164 4.971 1.00 0.00 H new ATOM 0 HB ILE B 815 -1.622 10.384 6.113 1.00 0.00 H new ATOM 0 HG12 ILE B 815 -1.093 12.964 7.419 1.00 0.00 H new ATOM 0 HG13 ILE B 815 -1.430 13.184 5.713 1.00 0.00 H new ATOM 0 HG21 ILE B 815 -0.540 10.685 8.321 1.00 0.00 H new ATOM 0 HG22 ILE B 815 0.534 9.828 7.191 1.00 0.00 H new ATOM 0 HG23 ILE B 815 0.807 11.550 7.544 1.00 0.00 H new ATOM 0 HD11 ILE B 815 -3.534 13.211 7.032 1.00 0.00 H new ATOM 0 HD12 ILE B 815 -3.506 11.812 5.933 1.00 0.00 H new ATOM 0 HD13 ILE B 815 -3.163 11.589 7.665 1.00 0.00 H new ATOM 1895 N LEU B 816 0.203 8.920 4.744 1.00 0.00 N ATOM 1896 CA LEU B 816 0.964 7.660 4.555 1.00 0.00 C ATOM 1897 C LEU B 816 1.846 7.737 3.308 1.00 0.00 C ATOM 1898 O LEU B 816 3.051 7.607 3.381 1.00 0.00 O ATOM 1899 CB LEU B 816 -0.115 6.593 4.375 1.00 0.00 C ATOM 1900 CG LEU B 816 0.047 5.528 5.457 1.00 0.00 C ATOM 1901 CD1 LEU B 816 -1.027 4.457 5.280 1.00 0.00 C ATOM 1902 CD2 LEU B 816 1.431 4.893 5.343 1.00 0.00 C ATOM 0 H LEU B 816 -0.801 8.801 4.878 1.00 0.00 H new ATOM 0 HA LEU B 816 1.631 7.451 5.392 1.00 0.00 H new ATOM 0 HB2 LEU B 816 -1.105 7.045 4.438 1.00 0.00 H new ATOM 0 HB3 LEU B 816 -0.034 6.140 3.387 1.00 0.00 H new ATOM 0 HG LEU B 816 -0.059 5.987 6.440 1.00 0.00 H new ATOM 0 HD11 LEU B 816 -0.913 3.696 6.052 1.00 0.00 H new ATOM 0 HD12 LEU B 816 -2.013 4.913 5.364 1.00 0.00 H new ATOM 0 HD13 LEU B 816 -0.923 3.996 4.298 1.00 0.00 H new ATOM 0 HD21 LEU B 816 1.547 4.133 6.115 1.00 0.00 H new ATOM 0 HD22 LEU B 816 1.540 4.433 4.361 1.00 0.00 H new ATOM 0 HD23 LEU B 816 2.195 5.660 5.471 1.00 0.00 H new ATOM 1914 N GLU B 817 1.252 7.945 2.163 1.00 0.00 N ATOM 1915 CA GLU B 817 2.043 8.021 0.900 1.00 0.00 C ATOM 1916 C GLU B 817 3.258 8.940 1.074 1.00 0.00 C ATOM 1917 O GLU B 817 4.317 8.689 0.536 1.00 0.00 O ATOM 1918 CB GLU B 817 1.065 8.598 -0.135 1.00 0.00 C ATOM 1919 CG GLU B 817 1.812 8.952 -1.426 1.00 0.00 C ATOM 1920 CD GLU B 817 2.356 7.674 -2.069 1.00 0.00 C ATOM 1921 OE1 GLU B 817 1.622 6.701 -2.119 1.00 0.00 O ATOM 1922 OE2 GLU B 817 3.496 7.691 -2.502 1.00 0.00 O ATOM 0 H GLU B 817 0.246 8.066 2.048 1.00 0.00 H new ATOM 0 HA GLU B 817 2.436 7.050 0.599 1.00 0.00 H new ATOM 0 HB2 GLU B 817 0.279 7.873 -0.348 1.00 0.00 H new ATOM 0 HB3 GLU B 817 0.579 9.486 0.268 1.00 0.00 H new ATOM 0 HG2 GLU B 817 1.142 9.463 -2.118 1.00 0.00 H new ATOM 0 HG3 GLU B 817 2.630 9.639 -1.209 1.00 0.00 H new ATOM 1929 N LYS B 818 3.114 10.004 1.812 1.00 0.00 N ATOM 1930 CA LYS B 818 4.261 10.935 1.996 1.00 0.00 C ATOM 1931 C LYS B 818 5.231 10.410 3.058 1.00 0.00 C ATOM 1932 O LYS B 818 6.416 10.282 2.822 1.00 0.00 O ATOM 1933 CB LYS B 818 3.626 12.245 2.452 1.00 0.00 C ATOM 1934 CG LYS B 818 3.636 13.251 1.297 1.00 0.00 C ATOM 1935 CD LYS B 818 2.899 12.657 0.096 1.00 0.00 C ATOM 1936 CE LYS B 818 2.037 13.736 -0.555 1.00 0.00 C ATOM 1937 NZ LYS B 818 2.950 14.430 -1.506 1.00 0.00 N ATOM 0 H LYS B 818 2.255 10.269 2.294 1.00 0.00 H new ATOM 0 HA LYS B 818 4.843 11.050 1.082 1.00 0.00 H new ATOM 0 HB2 LYS B 818 2.603 12.068 2.785 1.00 0.00 H new ATOM 0 HB3 LYS B 818 4.173 12.649 3.304 1.00 0.00 H new ATOM 0 HG2 LYS B 818 3.159 14.181 1.607 1.00 0.00 H new ATOM 0 HG3 LYS B 818 4.662 13.496 1.023 1.00 0.00 H new ATOM 0 HD2 LYS B 818 3.615 12.264 -0.626 1.00 0.00 H new ATOM 0 HD3 LYS B 818 2.276 11.821 0.415 1.00 0.00 H new ATOM 0 HE2 LYS B 818 1.183 13.301 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS B 818 1.640 14.427 0.188 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 2.432 15.188 -1.995 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 3.750 14.840 -0.983 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 3.307 13.748 -2.205 1.00 0.00 H new ATOM 1951 N PHE B 819 4.740 10.120 4.232 1.00 0.00 N ATOM 1952 CA PHE B 819 5.636 9.629 5.318 1.00 0.00 C ATOM 1953 C PHE B 819 6.451 8.419 4.851 1.00 0.00 C ATOM 1954 O PHE B 819 7.665 8.459 4.812 1.00 0.00 O ATOM 1955 CB PHE B 819 4.691 9.230 6.453 1.00 0.00 C ATOM 1956 CG PHE B 819 5.332 9.562 7.779 1.00 0.00 C ATOM 1957 CD1 PHE B 819 6.507 8.910 8.171 1.00 0.00 C ATOM 1958 CD2 PHE B 819 4.749 10.519 8.618 1.00 0.00 C ATOM 1959 CE1 PHE B 819 7.100 9.216 9.402 1.00 0.00 C ATOM 1960 CE2 PHE B 819 5.342 10.825 9.849 1.00 0.00 C ATOM 1961 CZ PHE B 819 6.518 10.174 10.240 1.00 0.00 C ATOM 0 H PHE B 819 3.756 10.202 4.487 1.00 0.00 H new ATOM 0 HA PHE B 819 6.357 10.387 5.624 1.00 0.00 H new ATOM 0 HB2 PHE B 819 3.742 9.757 6.353 1.00 0.00 H new ATOM 0 HB3 PHE B 819 4.471 8.164 6.400 1.00 0.00 H new ATOM 0 HD1 PHE B 819 6.956 8.171 7.524 1.00 0.00 H new ATOM 0 HD2 PHE B 819 3.842 11.021 8.316 1.00 0.00 H new ATOM 0 HE1 PHE B 819 8.006 8.713 9.705 1.00 0.00 H new ATOM 0 HE2 PHE B 819 4.892 11.563 10.497 1.00 0.00 H new ATOM 0 HZ PHE B 819 6.976 10.411 11.189 1.00 0.00 H new ATOM 1971 N PHE B 820 5.800 7.340 4.504 1.00 0.00 N ATOM 1972 CA PHE B 820 6.552 6.132 4.050 1.00 0.00 C ATOM 1973 C PHE B 820 7.524 6.508 2.921 1.00 0.00 C ATOM 1974 O PHE B 820 8.504 5.833 2.686 1.00 0.00 O ATOM 1975 CB PHE B 820 5.455 5.125 3.607 1.00 0.00 C ATOM 1976 CG PHE B 820 5.342 5.013 2.095 1.00 0.00 C ATOM 1977 CD1 PHE B 820 4.794 6.063 1.351 1.00 0.00 C ATOM 1978 CD2 PHE B 820 5.797 3.858 1.446 1.00 0.00 C ATOM 1979 CE1 PHE B 820 4.695 5.958 -0.042 1.00 0.00 C ATOM 1980 CE2 PHE B 820 5.698 3.752 0.054 1.00 0.00 C ATOM 1981 CZ PHE B 820 5.147 4.802 -0.690 1.00 0.00 C ATOM 0 H PHE B 820 4.785 7.242 4.515 1.00 0.00 H new ATOM 0 HA PHE B 820 7.178 5.692 4.827 1.00 0.00 H new ATOM 0 HB2 PHE B 820 5.678 4.143 4.025 1.00 0.00 H new ATOM 0 HB3 PHE B 820 4.494 5.436 4.018 1.00 0.00 H new ATOM 0 HD1 PHE B 820 4.447 6.955 1.851 1.00 0.00 H new ATOM 0 HD2 PHE B 820 6.224 3.049 2.020 1.00 0.00 H new ATOM 0 HE1 PHE B 820 4.270 6.768 -0.616 1.00 0.00 H new ATOM 0 HE2 PHE B 820 6.047 2.860 -0.446 1.00 0.00 H new ATOM 0 HZ PHE B 820 5.071 4.720 -1.764 1.00 0.00 H new ATOM 1991 N PHE B 821 7.251 7.582 2.232 1.00 0.00 N ATOM 1992 CA PHE B 821 8.133 8.005 1.103 1.00 0.00 C ATOM 1993 C PHE B 821 9.543 8.337 1.601 1.00 0.00 C ATOM 1994 O PHE B 821 10.524 7.825 1.102 1.00 0.00 O ATOM 1995 CB PHE B 821 7.464 9.258 0.536 1.00 0.00 C ATOM 1996 CG PHE B 821 7.636 9.283 -0.963 1.00 0.00 C ATOM 1997 CD1 PHE B 821 6.742 8.584 -1.782 1.00 0.00 C ATOM 1998 CD2 PHE B 821 8.694 10.001 -1.534 1.00 0.00 C ATOM 1999 CE1 PHE B 821 6.904 8.604 -3.172 1.00 0.00 C ATOM 2000 CE2 PHE B 821 8.855 10.022 -2.924 1.00 0.00 C ATOM 2001 CZ PHE B 821 7.961 9.324 -3.744 1.00 0.00 C ATOM 0 H PHE B 821 6.450 8.190 2.403 1.00 0.00 H new ATOM 0 HA PHE B 821 8.245 7.216 0.359 1.00 0.00 H new ATOM 0 HB2 PHE B 821 6.404 9.265 0.792 1.00 0.00 H new ATOM 0 HB3 PHE B 821 7.905 10.151 0.979 1.00 0.00 H new ATOM 0 HD1 PHE B 821 5.927 8.029 -1.341 1.00 0.00 H new ATOM 0 HD2 PHE B 821 9.385 10.538 -0.902 1.00 0.00 H new ATOM 0 HE1 PHE B 821 6.214 8.064 -3.804 1.00 0.00 H new ATOM 0 HE2 PHE B 821 9.670 10.577 -3.364 1.00 0.00 H new ATOM 0 HZ PHE B 821 8.086 9.340 -4.817 1.00 0.00 H new ATOM 2011 N SER B 822 9.660 9.209 2.565 1.00 0.00 N ATOM 2012 CA SER B 822 11.014 9.554 3.087 1.00 0.00 C ATOM 2013 C SER B 822 11.755 8.278 3.486 1.00 0.00 C ATOM 2014 O SER B 822 12.904 8.081 3.148 1.00 0.00 O ATOM 2015 CB SER B 822 10.752 10.429 4.314 1.00 0.00 C ATOM 2016 OG SER B 822 11.547 11.602 4.238 1.00 0.00 O ATOM 0 H SER B 822 8.882 9.695 3.012 1.00 0.00 H new ATOM 0 HA SER B 822 11.630 10.066 2.348 1.00 0.00 H new ATOM 0 HB2 SER B 822 9.696 10.695 4.365 1.00 0.00 H new ATOM 0 HB3 SER B 822 10.986 9.877 5.224 1.00 0.00 H new ATOM 0 HG SER B 822 11.378 12.163 5.023 1.00 0.00 H new ATOM 2022 N LYS B 823 11.086 7.392 4.169 1.00 0.00 N ATOM 2023 CA LYS B 823 11.735 6.116 4.573 1.00 0.00 C ATOM 2024 C LYS B 823 12.255 5.375 3.342 1.00 0.00 C ATOM 2025 O LYS B 823 13.415 5.031 3.261 1.00 0.00 O ATOM 2026 CB LYS B 823 10.625 5.319 5.249 1.00 0.00 C ATOM 2027 CG LYS B 823 10.195 6.048 6.521 1.00 0.00 C ATOM 2028 CD LYS B 823 11.047 5.563 7.695 1.00 0.00 C ATOM 2029 CE LYS B 823 10.719 4.098 7.991 1.00 0.00 C ATOM 2030 NZ LYS B 823 10.929 3.949 9.458 1.00 0.00 N ATOM 0 H LYS B 823 10.116 7.498 4.465 1.00 0.00 H new ATOM 0 HA LYS B 823 12.590 6.272 5.231 1.00 0.00 H new ATOM 0 HB2 LYS B 823 9.777 5.207 4.574 1.00 0.00 H new ATOM 0 HB3 LYS B 823 10.975 4.315 5.490 1.00 0.00 H new ATOM 0 HG2 LYS B 823 10.310 7.124 6.393 1.00 0.00 H new ATOM 0 HG3 LYS B 823 9.140 5.862 6.721 1.00 0.00 H new ATOM 0 HD2 LYS B 823 12.106 5.669 7.458 1.00 0.00 H new ATOM 0 HD3 LYS B 823 10.854 6.175 8.576 1.00 0.00 H new ATOM 0 HE2 LYS B 823 9.693 3.858 7.712 1.00 0.00 H new ATOM 0 HE3 LYS B 823 11.367 3.426 7.428 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 11.431 3.058 9.648 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 11.495 4.747 9.811 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 10.008 3.937 9.941 1.00 0.00 H new ATOM 2044 N ILE B 824 11.408 5.130 2.379 1.00 0.00 N ATOM 2045 CA ILE B 824 11.869 4.426 1.149 1.00 0.00 C ATOM 2046 C ILE B 824 12.842 5.313 0.374 1.00 0.00 C ATOM 2047 O ILE B 824 13.759 4.835 -0.263 1.00 0.00 O ATOM 2048 CB ILE B 824 10.600 4.169 0.333 1.00 0.00 C ATOM 2049 CG1 ILE B 824 9.947 5.484 -0.060 1.00 0.00 C ATOM 2050 CG2 ILE B 824 9.615 3.345 1.155 1.00 0.00 C ATOM 2051 CD1 ILE B 824 8.865 5.194 -1.089 1.00 0.00 C ATOM 0 H ILE B 824 10.421 5.386 2.391 1.00 0.00 H new ATOM 0 HA ILE B 824 12.395 3.498 1.375 1.00 0.00 H new ATOM 0 HB ILE B 824 10.873 3.622 -0.570 1.00 0.00 H new ATOM 0 HG12 ILE B 824 9.517 5.971 0.816 1.00 0.00 H new ATOM 0 HG13 ILE B 824 10.689 6.168 -0.472 1.00 0.00 H new ATOM 0 HG21 ILE B 824 8.714 3.165 0.569 1.00 0.00 H new ATOM 0 HG22 ILE B 824 10.071 2.392 1.421 1.00 0.00 H new ATOM 0 HG23 ILE B 824 9.355 3.889 2.063 1.00 0.00 H new ATOM 0 HD11 ILE B 824 8.384 6.127 -1.384 1.00 0.00 H new ATOM 0 HD12 ILE B 824 9.312 4.724 -1.965 1.00 0.00 H new ATOM 0 HD13 ILE B 824 8.122 4.524 -0.657 1.00 0.00 H new ATOM 2063 N LYS B 825 12.666 6.605 0.439 1.00 0.00 N ATOM 2064 CA LYS B 825 13.608 7.515 -0.264 1.00 0.00 C ATOM 2065 C LYS B 825 14.958 7.464 0.439 1.00 0.00 C ATOM 2066 O LYS B 825 16.003 7.469 -0.181 1.00 0.00 O ATOM 2067 CB LYS B 825 12.994 8.908 -0.135 1.00 0.00 C ATOM 2068 CG LYS B 825 13.830 9.897 -0.944 1.00 0.00 C ATOM 2069 CD LYS B 825 14.096 11.145 -0.115 1.00 0.00 C ATOM 2070 CE LYS B 825 15.291 10.906 0.808 1.00 0.00 C ATOM 2071 NZ LYS B 825 14.945 11.618 2.070 1.00 0.00 N ATOM 0 H LYS B 825 11.912 7.067 0.948 1.00 0.00 H new ATOM 0 HA LYS B 825 13.761 7.242 -1.308 1.00 0.00 H new ATOM 0 HB2 LYS B 825 11.966 8.901 -0.496 1.00 0.00 H new ATOM 0 HB3 LYS B 825 12.962 9.210 0.912 1.00 0.00 H new ATOM 0 HG2 LYS B 825 14.773 9.436 -1.237 1.00 0.00 H new ATOM 0 HG3 LYS B 825 13.307 10.164 -1.862 1.00 0.00 H new ATOM 0 HD2 LYS B 825 14.294 11.993 -0.770 1.00 0.00 H new ATOM 0 HD3 LYS B 825 13.214 11.397 0.474 1.00 0.00 H new ATOM 0 HE2 LYS B 825 15.448 9.842 0.984 1.00 0.00 H new ATOM 0 HE3 LYS B 825 16.211 11.296 0.373 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 15.738 11.545 2.739 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 14.758 12.620 1.863 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 14.097 11.187 2.490 1.00 0.00 H new ATOM 2085 N GLU B 826 14.931 7.398 1.738 1.00 0.00 N ATOM 2086 CA GLU B 826 16.195 7.284 2.507 1.00 0.00 C ATOM 2087 C GLU B 826 16.664 5.830 2.467 1.00 0.00 C ATOM 2088 O GLU B 826 17.843 5.540 2.515 1.00 0.00 O ATOM 2089 CB GLU B 826 15.826 7.712 3.928 1.00 0.00 C ATOM 2090 CG GLU B 826 15.344 9.165 3.908 1.00 0.00 C ATOM 2091 CD GLU B 826 16.285 10.029 4.751 1.00 0.00 C ATOM 2092 OE1 GLU B 826 16.433 9.735 5.926 1.00 0.00 O ATOM 2093 OE2 GLU B 826 16.841 10.968 4.207 1.00 0.00 O ATOM 0 H GLU B 826 14.082 7.418 2.303 1.00 0.00 H new ATOM 0 HA GLU B 826 17.005 7.897 2.111 1.00 0.00 H new ATOM 0 HB2 GLU B 826 15.045 7.063 4.325 1.00 0.00 H new ATOM 0 HB3 GLU B 826 16.689 7.612 4.586 1.00 0.00 H new ATOM 0 HG2 GLU B 826 15.314 9.535 2.883 1.00 0.00 H new ATOM 0 HG3 GLU B 826 14.328 9.227 4.299 1.00 0.00 H new ATOM 2100 N ALA B 827 15.740 4.916 2.318 1.00 0.00 N ATOM 2101 CA ALA B 827 16.114 3.482 2.202 1.00 0.00 C ATOM 2102 C ALA B 827 16.793 3.248 0.855 1.00 0.00 C ATOM 2103 O ALA B 827 17.720 2.472 0.737 1.00 0.00 O ATOM 2104 CB ALA B 827 14.786 2.722 2.260 1.00 0.00 C ATOM 0 H ALA B 827 14.739 5.106 2.272 1.00 0.00 H new ATOM 0 HA ALA B 827 16.802 3.161 2.984 1.00 0.00 H new ATOM 0 HB1 ALA B 827 14.976 1.652 2.180 1.00 0.00 H new ATOM 0 HB2 ALA B 827 14.287 2.933 3.206 1.00 0.00 H new ATOM 0 HB3 ALA B 827 14.149 3.040 1.435 1.00 0.00 H new ATOM 2110 N GLY B 828 16.334 3.924 -0.163 1.00 0.00 N ATOM 2111 CA GLY B 828 16.954 3.767 -1.505 1.00 0.00 C ATOM 2112 C GLY B 828 15.941 3.167 -2.482 1.00 0.00 C ATOM 2113 O GLY B 828 16.312 2.533 -3.449 1.00 0.00 O ATOM 0 H GLY B 828 15.554 4.580 -0.121 1.00 0.00 H new ATOM 0 HA2 GLY B 828 17.297 4.735 -1.872 1.00 0.00 H new ATOM 0 HA3 GLY B 828 17.831 3.123 -1.437 1.00 0.00 H new ATOM 2117 N LEU B 829 14.665 3.353 -2.250 1.00 0.00 N ATOM 2118 CA LEU B 829 13.662 2.799 -3.205 1.00 0.00 C ATOM 2119 C LEU B 829 13.294 3.852 -4.246 1.00 0.00 C ATOM 2120 O LEU B 829 13.263 3.593 -5.432 1.00 0.00 O ATOM 2121 CB LEU B 829 12.433 2.453 -2.388 1.00 0.00 C ATOM 2122 CG LEU B 829 12.803 1.503 -1.260 1.00 0.00 C ATOM 2123 CD1 LEU B 829 11.608 1.343 -0.337 1.00 0.00 C ATOM 2124 CD2 LEU B 829 13.135 0.144 -1.848 1.00 0.00 C ATOM 0 H LEU B 829 14.280 3.858 -1.451 1.00 0.00 H new ATOM 0 HA LEU B 829 14.059 1.927 -3.725 1.00 0.00 H new ATOM 0 HB2 LEU B 829 11.992 3.362 -1.978 1.00 0.00 H new ATOM 0 HB3 LEU B 829 11.679 1.994 -3.028 1.00 0.00 H new ATOM 0 HG LEU B 829 13.657 1.899 -0.711 1.00 0.00 H new ATOM 0 HD11 LEU B 829 11.864 0.663 0.475 1.00 0.00 H new ATOM 0 HD12 LEU B 829 11.334 2.314 0.075 1.00 0.00 H new ATOM 0 HD13 LEU B 829 10.767 0.937 -0.898 1.00 0.00 H new ATOM 0 HD21 LEU B 829 13.402 -0.544 -1.046 1.00 0.00 H new ATOM 0 HD22 LEU B 829 12.268 -0.242 -2.384 1.00 0.00 H new ATOM 0 HD23 LEU B 829 13.974 0.241 -2.537 1.00 0.00 H new ATOM 2136 N ILE B 830 12.984 5.035 -3.797 1.00 0.00 N ATOM 2137 CA ILE B 830 12.585 6.117 -4.737 1.00 0.00 C ATOM 2138 C ILE B 830 13.799 6.972 -5.108 1.00 0.00 C ATOM 2139 O ILE B 830 13.810 7.649 -6.117 1.00 0.00 O ATOM 2140 CB ILE B 830 11.556 6.931 -3.949 1.00 0.00 C ATOM 2141 CG1 ILE B 830 10.413 6.009 -3.521 1.00 0.00 C ATOM 2142 CG2 ILE B 830 11.002 8.061 -4.816 1.00 0.00 C ATOM 2143 CD1 ILE B 830 9.689 5.464 -4.757 1.00 0.00 C ATOM 0 H ILE B 830 12.990 5.300 -2.812 1.00 0.00 H new ATOM 0 HA ILE B 830 12.181 5.740 -5.676 1.00 0.00 H new ATOM 0 HB ILE B 830 12.035 7.364 -3.071 1.00 0.00 H new ATOM 0 HG12 ILE B 830 10.804 5.184 -2.925 1.00 0.00 H new ATOM 0 HG13 ILE B 830 9.712 6.554 -2.889 1.00 0.00 H new ATOM 0 HG21 ILE B 830 10.271 8.633 -4.245 1.00 0.00 H new ATOM 0 HG22 ILE B 830 11.817 8.717 -5.123 1.00 0.00 H new ATOM 0 HG23 ILE B 830 10.523 7.640 -5.700 1.00 0.00 H new ATOM 0 HD11 ILE B 830 8.877 4.808 -4.443 1.00 0.00 H new ATOM 0 HD12 ILE B 830 9.283 6.293 -5.336 1.00 0.00 H new ATOM 0 HD13 ILE B 830 10.392 4.902 -5.372 1.00 0.00 H new