USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=32 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 814 ASN : amide:sc= -0.633 K(o=0.5,f=-15!) USER MOD Set 1.2: B 818 LYS NZ :NH3+ 175:sc= 1.13 (180deg=0) USER MOD Set 2.1: B 811 LYS NZ :NH3+ -173:sc= 0.0174 (180deg=0) USER MOD Set 2.2: B 812 CYS SG : rot 90:sc= 0.144 USER MOD Set 3.1: B 793 GLN : amide:sc= -3.39 X(o=-5.3,f=-5.2!) USER MOD Set 3.2: B 797 THR OG1 : rot 101:sc= -1.93! USER MOD Set 4.1: B 760 TYR OH : rot -56:sc= 1.4 USER MOD Set 4.2: B 798 ASN : amide:sc= -11.1! C(o=-8.6!,f=-12!) USER MOD Set 4.3: B 799 CYS SG : rot -166:sc= 0.179 USER MOD Set 4.4: B 802 TYR OH : rot 56:sc= 0.928 USER MOD Set 5.1: B 742 HIS : no HE2:sc= -2.96! C(o=-4.8!,f=-9.6!) USER MOD Set 5.2: B 744 SER OG : rot -103:sc= -1.84 USER MOD Set 6.1: B 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 6.2: B 737 GLN : amide:sc= -1.19 K(o=-1.2,f=-5.8!) USER MOD Single : B 727 GLN : amide:sc= 0 X(o=0,f=0.016) USER MOD Single : B 729 TYR OH : rot 108:sc= 0.0595 USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 74:sc= 0.0917 USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 738 GLN : amide:sc= -6.04! C(o=-6!,f=-11!) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot 180:sc= 0 USER MOD Single : B 743 GLN : amide:sc= -0.53 K(o=-0.53,f=-4.2!) USER MOD Single : B 749 MET CE :methyl 179:sc= -1.81 (180deg=-1.82) USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl 150:sc= -3.67! (180deg=-6.74!) USER MOD Single : B 771 LYS NZ :NH3+ 160:sc= -0.647 (180deg=-0.963) USER MOD Single : B 772 THR OG1 : rot 180:sc= -1.49! USER MOD Single : B 773 MET CE :methyl -108:sc= -1.53 (180deg=-2.56!) USER MOD Single : B 774 SER OG : rot -96:sc= -0.248 USER MOD Single : B 778 LYS NZ :NH3+ -164:sc= 0.594 (180deg=0.228) USER MOD Single : B 779 ASN : amide:sc= -0.837 X(o=-0.84,f=-0.51) 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 -170:sc= -1.33 USER MOD Single : B 785 LYS NZ :NH3+ -172:sc=-0.00871 (180deg=-0.0319) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl -116:sc= -11.7! (180deg=-15.6!) USER MOD Single : B 800 LYS NZ :NH3+ -160:sc= 0.848 (180deg=0.527) USER MOD Single : B 803 ASN : amide:sc= -11! C(o=-11!,f=-13!) USER MOD Single : B 807 SER OG : rot 180:sc= 0 USER MOD Single : B 809 TYR OH : rot -148:sc= 1.05 USER MOD Single : B 810 TYR OH : rot 180:sc= 0 USER MOD Single : B 822 SER OG : rot 180:sc= 0 USER MOD Single : B 823 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 303 N GLU B 721 17.818 0.094 -6.659 1.00 0.00 N ATOM 304 CA GLU B 721 18.217 -1.343 -6.664 1.00 0.00 C ATOM 305 C GLU B 721 18.427 -1.864 -5.232 1.00 0.00 C ATOM 306 O GLU B 721 19.259 -1.349 -4.510 1.00 0.00 O ATOM 307 CB GLU B 721 19.540 -1.370 -7.431 1.00 0.00 C ATOM 308 CG GLU B 721 19.419 -2.317 -8.626 1.00 0.00 C ATOM 309 CD GLU B 721 20.553 -2.040 -9.615 1.00 0.00 C ATOM 310 OE1 GLU B 721 21.695 -2.291 -9.263 1.00 0.00 O ATOM 311 OE2 GLU B 721 20.262 -1.583 -10.708 1.00 0.00 O ATOM 0 HA GLU B 721 17.452 -1.976 -7.115 1.00 0.00 H new ATOM 0 HB2 GLU B 721 19.795 -0.367 -7.773 1.00 0.00 H new ATOM 0 HB3 GLU B 721 20.346 -1.697 -6.775 1.00 0.00 H new ATOM 0 HG2 GLU B 721 19.462 -3.353 -8.288 1.00 0.00 H new ATOM 0 HG3 GLU B 721 18.454 -2.181 -9.115 1.00 0.00 H new ATOM 318 N PRO B 722 17.727 -2.926 -4.889 1.00 0.00 N ATOM 319 CA PRO B 722 17.864 -3.528 -3.534 1.00 0.00 C ATOM 320 C PRO B 722 19.271 -4.098 -3.309 1.00 0.00 C ATOM 321 O PRO B 722 19.603 -4.517 -2.218 1.00 0.00 O ATOM 322 CB PRO B 722 16.839 -4.671 -3.534 1.00 0.00 C ATOM 323 CG PRO B 722 16.544 -4.930 -4.974 1.00 0.00 C ATOM 324 CD PRO B 722 16.702 -3.617 -5.680 1.00 0.00 C ATOM 0 HA PRO B 722 17.702 -2.793 -2.746 1.00 0.00 H new ATOM 0 HB2 PRO B 722 17.240 -5.560 -3.048 1.00 0.00 H new ATOM 0 HB3 PRO B 722 15.936 -4.391 -2.991 1.00 0.00 H new ATOM 0 HG2 PRO B 722 17.226 -5.675 -5.382 1.00 0.00 H new ATOM 0 HG3 PRO B 722 15.534 -5.320 -5.100 1.00 0.00 H new ATOM 0 HD2 PRO B 722 17.017 -3.753 -6.715 1.00 0.00 H new ATOM 0 HD3 PRO B 722 15.767 -3.058 -5.702 1.00 0.00 H new ATOM 332 N ARG B 723 20.104 -4.117 -4.322 1.00 0.00 N ATOM 333 CA ARG B 723 21.477 -4.694 -4.165 1.00 0.00 C ATOM 334 C ARG B 723 21.378 -6.174 -3.796 1.00 0.00 C ATOM 335 O ARG B 723 21.473 -7.041 -4.641 1.00 0.00 O ATOM 336 CB ARG B 723 22.149 -3.898 -3.036 1.00 0.00 C ATOM 337 CG ARG B 723 23.169 -2.928 -3.634 1.00 0.00 C ATOM 338 CD ARG B 723 22.472 -1.613 -3.985 1.00 0.00 C ATOM 339 NE ARG B 723 22.822 -0.685 -2.869 1.00 0.00 N ATOM 340 CZ ARG B 723 22.377 0.551 -2.855 1.00 0.00 C ATOM 341 NH1 ARG B 723 21.616 1.006 -3.820 1.00 0.00 N ATOM 342 NH2 ARG B 723 22.699 1.338 -1.866 1.00 0.00 N ATOM 0 H ARG B 723 19.892 -3.757 -5.253 1.00 0.00 H new ATOM 0 HA ARG B 723 22.053 -4.625 -5.088 1.00 0.00 H new ATOM 0 HB2 ARG B 723 21.399 -3.349 -2.467 1.00 0.00 H new ATOM 0 HB3 ARG B 723 22.642 -4.578 -2.341 1.00 0.00 H new ATOM 0 HG2 ARG B 723 23.975 -2.747 -2.923 1.00 0.00 H new ATOM 0 HG3 ARG B 723 23.621 -3.362 -4.526 1.00 0.00 H new ATOM 0 HD2 ARG B 723 22.817 -1.226 -4.944 1.00 0.00 H new ATOM 0 HD3 ARG B 723 21.393 -1.746 -4.065 1.00 0.00 H new ATOM 0 HE ARG B 723 23.415 -1.015 -2.107 1.00 0.00 H new ATOM 0 HH11 ARG B 723 21.360 0.398 -4.598 1.00 0.00 H new ATOM 0 HH12 ARG B 723 21.279 1.968 -3.793 1.00 0.00 H new ATOM 0 HH21 ARG B 723 23.292 0.992 -1.111 1.00 0.00 H new ATOM 0 HH22 ARG B 723 22.358 2.299 -1.847 1.00 0.00 H new ATOM 356 N ASP B 724 21.169 -6.472 -2.544 1.00 0.00 N ATOM 357 CA ASP B 724 21.035 -7.897 -2.134 1.00 0.00 C ATOM 358 C ASP B 724 19.573 -8.203 -1.784 1.00 0.00 C ATOM 359 O ASP B 724 18.933 -7.427 -1.103 1.00 0.00 O ATOM 360 CB ASP B 724 21.922 -8.038 -0.896 1.00 0.00 C ATOM 361 CG ASP B 724 21.893 -9.488 -0.411 1.00 0.00 C ATOM 362 OD1 ASP B 724 20.812 -9.977 -0.128 1.00 0.00 O ATOM 363 OD2 ASP B 724 22.953 -10.087 -0.333 1.00 0.00 O ATOM 0 H ASP B 724 21.085 -5.792 -1.789 1.00 0.00 H new ATOM 0 HA ASP B 724 21.329 -8.587 -2.925 1.00 0.00 H new ATOM 0 HB2 ASP B 724 22.944 -7.743 -1.132 1.00 0.00 H new ATOM 0 HB3 ASP B 724 21.572 -7.372 -0.107 1.00 0.00 H new ATOM 368 N PRO B 725 19.077 -9.317 -2.265 1.00 0.00 N ATOM 369 CA PRO B 725 17.669 -9.691 -1.985 1.00 0.00 C ATOM 370 C PRO B 725 17.451 -9.866 -0.481 1.00 0.00 C ATOM 371 O PRO B 725 16.566 -9.271 0.100 1.00 0.00 O ATOM 372 CB PRO B 725 17.485 -11.026 -2.712 1.00 0.00 C ATOM 373 CG PRO B 725 18.625 -11.119 -3.678 1.00 0.00 C ATOM 374 CD PRO B 725 19.757 -10.314 -3.101 1.00 0.00 C ATOM 0 HA PRO B 725 16.960 -8.932 -2.315 1.00 0.00 H new ATOM 0 HB2 PRO B 725 17.497 -11.860 -2.010 1.00 0.00 H new ATOM 0 HB3 PRO B 725 16.527 -11.061 -3.231 1.00 0.00 H new ATOM 0 HG2 PRO B 725 18.924 -12.157 -3.822 1.00 0.00 H new ATOM 0 HG3 PRO B 725 18.335 -10.732 -4.655 1.00 0.00 H new ATOM 0 HD2 PRO B 725 20.433 -10.936 -2.514 1.00 0.00 H new ATOM 0 HD3 PRO B 725 20.354 -9.843 -3.882 1.00 0.00 H new ATOM 382 N ASP B 726 18.255 -10.674 0.155 1.00 0.00 N ATOM 383 CA ASP B 726 18.092 -10.883 1.621 1.00 0.00 C ATOM 384 C ASP B 726 18.144 -9.544 2.360 1.00 0.00 C ATOM 385 O ASP B 726 17.671 -9.420 3.472 1.00 0.00 O ATOM 386 CB ASP B 726 19.277 -11.763 2.027 1.00 0.00 C ATOM 387 CG ASP B 726 18.928 -12.531 3.303 1.00 0.00 C ATOM 388 OD1 ASP B 726 18.252 -13.542 3.197 1.00 0.00 O ATOM 389 OD2 ASP B 726 19.341 -12.096 4.365 1.00 0.00 O ATOM 0 H ASP B 726 19.016 -11.198 -0.277 1.00 0.00 H new ATOM 0 HA ASP B 726 17.135 -11.343 1.867 1.00 0.00 H new ATOM 0 HB2 ASP B 726 19.518 -12.460 1.224 1.00 0.00 H new ATOM 0 HB3 ASP B 726 20.162 -11.148 2.191 1.00 0.00 H new ATOM 394 N GLN B 727 18.712 -8.540 1.750 1.00 0.00 N ATOM 395 CA GLN B 727 18.789 -7.211 2.417 1.00 0.00 C ATOM 396 C GLN B 727 17.448 -6.482 2.311 1.00 0.00 C ATOM 397 O GLN B 727 16.905 -6.020 3.295 1.00 0.00 O ATOM 398 CB GLN B 727 19.873 -6.451 1.653 1.00 0.00 C ATOM 399 CG GLN B 727 20.139 -5.110 2.338 1.00 0.00 C ATOM 400 CD GLN B 727 21.342 -4.434 1.678 1.00 0.00 C ATOM 401 OE1 GLN B 727 21.332 -4.173 0.492 1.00 0.00 O ATOM 402 NE2 GLN B 727 22.387 -4.139 2.401 1.00 0.00 N ATOM 0 H GLN B 727 19.126 -8.583 0.819 1.00 0.00 H new ATOM 0 HA GLN B 727 19.018 -7.296 3.479 1.00 0.00 H new ATOM 0 HB2 GLN B 727 20.789 -7.041 1.618 1.00 0.00 H new ATOM 0 HB3 GLN B 727 19.559 -6.288 0.622 1.00 0.00 H new ATOM 0 HG2 GLN B 727 19.260 -4.469 2.262 1.00 0.00 H new ATOM 0 HG3 GLN B 727 20.331 -5.263 3.400 1.00 0.00 H new ATOM 0 HE21 GLN B 727 22.396 -4.358 3.397 1.00 0.00 H new ATOM 0 HE22 GLN B 727 23.195 -3.689 1.970 1.00 0.00 H new ATOM 411 N LEU B 728 16.904 -6.377 1.127 1.00 0.00 N ATOM 412 CA LEU B 728 15.597 -5.678 0.973 1.00 0.00 C ATOM 413 C LEU B 728 14.461 -6.518 1.556 1.00 0.00 C ATOM 414 O LEU B 728 13.481 -5.993 2.042 1.00 0.00 O ATOM 415 CB LEU B 728 15.412 -5.476 -0.522 1.00 0.00 C ATOM 416 CG LEU B 728 14.846 -4.073 -0.735 1.00 0.00 C ATOM 417 CD1 LEU B 728 15.981 -3.094 -1.034 1.00 0.00 C ATOM 418 CD2 LEU B 728 13.845 -4.093 -1.876 1.00 0.00 C ATOM 0 H LEU B 728 17.307 -6.744 0.265 1.00 0.00 H new ATOM 0 HA LEU B 728 15.584 -4.728 1.508 1.00 0.00 H new ATOM 0 HB2 LEU B 728 16.363 -5.588 -1.044 1.00 0.00 H new ATOM 0 HB3 LEU B 728 14.735 -6.227 -0.928 1.00 0.00 H new ATOM 0 HG LEU B 728 14.337 -3.746 0.172 1.00 0.00 H new ATOM 0 HD11 LEU B 728 15.570 -2.096 -1.185 1.00 0.00 H new ATOM 0 HD12 LEU B 728 16.677 -3.077 -0.195 1.00 0.00 H new ATOM 0 HD13 LEU B 728 16.506 -3.410 -1.935 1.00 0.00 H new ATOM 0 HD21 LEU B 728 13.443 -3.091 -2.025 1.00 0.00 H new ATOM 0 HD22 LEU B 728 14.340 -4.425 -2.789 1.00 0.00 H new ATOM 0 HD23 LEU B 728 13.032 -4.778 -1.635 1.00 0.00 H new ATOM 430 N TYR B 729 14.591 -7.818 1.550 1.00 0.00 N ATOM 431 CA TYR B 729 13.515 -8.670 2.138 1.00 0.00 C ATOM 432 C TYR B 729 13.178 -8.183 3.549 1.00 0.00 C ATOM 433 O TYR B 729 12.043 -7.869 3.859 1.00 0.00 O ATOM 434 CB TYR B 729 14.109 -10.080 2.186 1.00 0.00 C ATOM 435 CG TYR B 729 13.058 -11.051 2.670 1.00 0.00 C ATOM 436 CD1 TYR B 729 12.757 -11.135 4.035 1.00 0.00 C ATOM 437 CD2 TYR B 729 12.385 -11.868 1.753 1.00 0.00 C ATOM 438 CE1 TYR B 729 11.784 -12.036 4.483 1.00 0.00 C ATOM 439 CE2 TYR B 729 11.412 -12.769 2.201 1.00 0.00 C ATOM 440 CZ TYR B 729 11.111 -12.853 3.566 1.00 0.00 C ATOM 441 OH TYR B 729 10.151 -13.741 4.008 1.00 0.00 O ATOM 0 H TYR B 729 15.389 -8.324 1.167 1.00 0.00 H new ATOM 0 HA TYR B 729 12.593 -8.637 1.557 1.00 0.00 H new ATOM 0 HB2 TYR B 729 14.462 -10.372 1.197 1.00 0.00 H new ATOM 0 HB3 TYR B 729 14.972 -10.100 2.851 1.00 0.00 H new ATOM 0 HD1 TYR B 729 13.276 -10.505 4.742 1.00 0.00 H new ATOM 0 HD2 TYR B 729 12.617 -11.803 0.700 1.00 0.00 H new ATOM 0 HE1 TYR B 729 11.552 -12.101 5.536 1.00 0.00 H new ATOM 0 HE2 TYR B 729 10.893 -13.399 1.494 1.00 0.00 H new ATOM 0 HH TYR B 729 9.262 -13.416 3.752 1.00 0.00 H new ATOM 451 N SER B 730 14.165 -8.077 4.394 1.00 0.00 N ATOM 452 CA SER B 730 13.912 -7.570 5.769 1.00 0.00 C ATOM 453 C SER B 730 13.612 -6.073 5.716 1.00 0.00 C ATOM 454 O SER B 730 12.906 -5.542 6.550 1.00 0.00 O ATOM 455 CB SER B 730 15.209 -7.836 6.537 1.00 0.00 C ATOM 456 OG SER B 730 15.352 -6.878 7.576 1.00 0.00 O ATOM 0 H SER B 730 15.135 -8.320 4.191 1.00 0.00 H new ATOM 0 HA SER B 730 13.059 -8.053 6.244 1.00 0.00 H new ATOM 0 HB2 SER B 730 15.196 -8.842 6.956 1.00 0.00 H new ATOM 0 HB3 SER B 730 16.062 -7.783 5.860 1.00 0.00 H new ATOM 0 HG SER B 730 16.182 -7.050 8.068 1.00 0.00 H new ATOM 462 N THR B 731 14.132 -5.388 4.731 1.00 0.00 N ATOM 463 CA THR B 731 13.838 -3.935 4.613 1.00 0.00 C ATOM 464 C THR B 731 12.338 -3.739 4.432 1.00 0.00 C ATOM 465 O THR B 731 11.683 -3.109 5.236 1.00 0.00 O ATOM 466 CB THR B 731 14.581 -3.464 3.366 1.00 0.00 C ATOM 467 OG1 THR B 731 15.967 -3.739 3.504 1.00 0.00 O ATOM 468 CG2 THR B 731 14.369 -1.959 3.194 1.00 0.00 C ATOM 0 H THR B 731 14.743 -5.771 4.010 1.00 0.00 H new ATOM 0 HA THR B 731 14.148 -3.378 5.497 1.00 0.00 H new ATOM 0 HB THR B 731 14.198 -3.989 2.491 1.00 0.00 H new ATOM 0 HG1 THR B 731 16.123 -4.699 3.387 1.00 0.00 H new ATOM 0 HG21 THR B 731 14.898 -1.616 2.304 1.00 0.00 H new ATOM 0 HG22 THR B 731 13.304 -1.752 3.086 1.00 0.00 H new ATOM 0 HG23 THR B 731 14.754 -1.435 4.069 1.00 0.00 H new ATOM 476 N LEU B 732 11.773 -4.315 3.399 1.00 0.00 N ATOM 477 CA LEU B 732 10.299 -4.201 3.211 1.00 0.00 C ATOM 478 C LEU B 732 9.607 -4.631 4.499 1.00 0.00 C ATOM 479 O LEU B 732 8.694 -3.988 4.974 1.00 0.00 O ATOM 480 CB LEU B 732 9.947 -5.155 2.061 1.00 0.00 C ATOM 481 CG LEU B 732 10.781 -4.834 0.807 1.00 0.00 C ATOM 482 CD1 LEU B 732 10.173 -5.563 -0.390 1.00 0.00 C ATOM 483 CD2 LEU B 732 10.781 -3.326 0.525 1.00 0.00 C ATOM 0 H LEU B 732 12.265 -4.853 2.686 1.00 0.00 H new ATOM 0 HA LEU B 732 9.982 -3.184 2.981 1.00 0.00 H new ATOM 0 HB2 LEU B 732 10.128 -6.185 2.369 1.00 0.00 H new ATOM 0 HB3 LEU B 732 8.885 -5.074 1.827 1.00 0.00 H new ATOM 0 HG LEU B 732 11.808 -5.159 0.974 1.00 0.00 H new ATOM 0 HD11 LEU B 732 10.756 -5.343 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU B 732 10.183 -6.637 -0.205 1.00 0.00 H new ATOM 0 HD13 LEU B 732 9.145 -5.230 -0.535 1.00 0.00 H new ATOM 0 HD21 LEU B 732 11.376 -3.122 -0.365 1.00 0.00 H new ATOM 0 HD22 LEU B 732 9.758 -2.986 0.363 1.00 0.00 H new ATOM 0 HD23 LEU B 732 11.209 -2.797 1.376 1.00 0.00 H new ATOM 495 N LYS B 733 10.107 -5.666 5.120 1.00 0.00 N ATOM 496 CA LYS B 733 9.546 -6.082 6.430 1.00 0.00 C ATOM 497 C LYS B 733 9.631 -4.903 7.398 1.00 0.00 C ATOM 498 O LYS B 733 8.716 -4.631 8.146 1.00 0.00 O ATOM 499 CB LYS B 733 10.447 -7.226 6.900 1.00 0.00 C ATOM 500 CG LYS B 733 9.648 -8.527 6.922 1.00 0.00 C ATOM 501 CD LYS B 733 9.359 -8.926 8.370 1.00 0.00 C ATOM 502 CE LYS B 733 7.900 -9.370 8.495 1.00 0.00 C ATOM 503 NZ LYS B 733 7.535 -9.090 9.912 1.00 0.00 N ATOM 0 H LYS B 733 10.878 -6.238 4.775 1.00 0.00 H new ATOM 0 HA LYS B 733 8.503 -6.392 6.371 1.00 0.00 H new ATOM 0 HB2 LYS B 733 11.305 -7.325 6.234 1.00 0.00 H new ATOM 0 HB3 LYS B 733 10.838 -7.010 7.894 1.00 0.00 H new ATOM 0 HG2 LYS B 733 8.713 -8.401 6.375 1.00 0.00 H new ATOM 0 HG3 LYS B 733 10.207 -9.317 6.421 1.00 0.00 H new ATOM 0 HD2 LYS B 733 10.024 -9.734 8.675 1.00 0.00 H new ATOM 0 HD3 LYS B 733 9.553 -8.085 9.036 1.00 0.00 H new ATOM 0 HE2 LYS B 733 7.259 -8.820 7.806 1.00 0.00 H new ATOM 0 HE3 LYS B 733 7.787 -10.428 8.260 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 6.547 -9.368 10.077 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 8.158 -9.632 10.544 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 7.646 -8.074 10.105 1.00 0.00 H new ATOM 517 N SER B 734 10.717 -4.176 7.349 1.00 0.00 N ATOM 518 CA SER B 734 10.865 -2.984 8.232 1.00 0.00 C ATOM 519 C SER B 734 9.770 -1.963 7.915 1.00 0.00 C ATOM 520 O SER B 734 8.927 -1.676 8.740 1.00 0.00 O ATOM 521 CB SER B 734 12.245 -2.413 7.908 1.00 0.00 C ATOM 522 OG SER B 734 13.047 -2.419 9.080 1.00 0.00 O ATOM 0 H SER B 734 11.509 -4.358 6.733 1.00 0.00 H new ATOM 0 HA SER B 734 10.773 -3.236 9.288 1.00 0.00 H new ATOM 0 HB2 SER B 734 12.721 -3.005 7.126 1.00 0.00 H new ATOM 0 HB3 SER B 734 12.149 -1.397 7.525 1.00 0.00 H new ATOM 0 HG SER B 734 13.933 -2.054 8.872 1.00 0.00 H new ATOM 528 N ILE B 735 9.741 -1.443 6.711 1.00 0.00 N ATOM 529 CA ILE B 735 8.680 -0.466 6.355 1.00 0.00 C ATOM 530 C ILE B 735 7.302 -1.016 6.739 1.00 0.00 C ATOM 531 O ILE B 735 6.652 -0.529 7.643 1.00 0.00 O ATOM 532 CB ILE B 735 8.772 -0.295 4.834 1.00 0.00 C ATOM 533 CG1 ILE B 735 10.157 0.239 4.445 1.00 0.00 C ATOM 534 CG2 ILE B 735 7.697 0.695 4.377 1.00 0.00 C ATOM 535 CD1 ILE B 735 10.800 -0.701 3.425 1.00 0.00 C ATOM 0 H ILE B 735 10.406 -1.656 5.967 1.00 0.00 H new ATOM 0 HA ILE B 735 8.811 0.480 6.880 1.00 0.00 H new ATOM 0 HB ILE B 735 8.618 -1.261 4.353 1.00 0.00 H new ATOM 0 HG12 ILE B 735 10.067 1.241 4.025 1.00 0.00 H new ATOM 0 HG13 ILE B 735 10.789 0.319 5.330 1.00 0.00 H new ATOM 0 HG21 ILE B 735 7.756 0.822 3.296 1.00 0.00 H new ATOM 0 HG22 ILE B 735 6.712 0.312 4.644 1.00 0.00 H new ATOM 0 HG23 ILE B 735 7.857 1.657 4.865 1.00 0.00 H new ATOM 0 HD11 ILE B 735 11.784 -0.321 3.149 1.00 0.00 H new ATOM 0 HD12 ILE B 735 10.904 -1.695 3.861 1.00 0.00 H new ATOM 0 HD13 ILE B 735 10.171 -0.759 2.536 1.00 0.00 H new ATOM 547 N LEU B 736 6.885 -2.063 6.086 1.00 0.00 N ATOM 548 CA LEU B 736 5.558 -2.673 6.392 1.00 0.00 C ATOM 549 C LEU B 736 5.376 -2.883 7.899 1.00 0.00 C ATOM 550 O LEU B 736 4.294 -2.722 8.427 1.00 0.00 O ATOM 551 CB LEU B 736 5.576 -4.023 5.675 1.00 0.00 C ATOM 552 CG LEU B 736 4.526 -4.024 4.562 1.00 0.00 C ATOM 553 CD1 LEU B 736 4.573 -5.361 3.819 1.00 0.00 C ATOM 554 CD2 LEU B 736 3.137 -3.828 5.173 1.00 0.00 C ATOM 0 H LEU B 736 7.410 -2.528 5.346 1.00 0.00 H new ATOM 0 HA LEU B 736 4.738 -2.032 6.068 1.00 0.00 H new ATOM 0 HB2 LEU B 736 6.565 -4.211 5.257 1.00 0.00 H new ATOM 0 HB3 LEU B 736 5.371 -4.826 6.383 1.00 0.00 H new ATOM 0 HG LEU B 736 4.734 -3.213 3.864 1.00 0.00 H new ATOM 0 HD11 LEU B 736 3.825 -5.363 3.026 1.00 0.00 H new ATOM 0 HD12 LEU B 736 5.563 -5.501 3.385 1.00 0.00 H new ATOM 0 HD13 LEU B 736 4.364 -6.172 4.516 1.00 0.00 H new ATOM 0 HD21 LEU B 736 2.388 -3.828 4.381 1.00 0.00 H new ATOM 0 HD22 LEU B 736 2.928 -4.639 5.870 1.00 0.00 H new ATOM 0 HD23 LEU B 736 3.104 -2.876 5.703 1.00 0.00 H new ATOM 566 N GLN B 737 6.409 -3.275 8.595 1.00 0.00 N ATOM 567 CA GLN B 737 6.261 -3.501 10.061 1.00 0.00 C ATOM 568 C GLN B 737 5.751 -2.229 10.735 1.00 0.00 C ATOM 569 O GLN B 737 4.827 -2.259 11.524 1.00 0.00 O ATOM 570 CB GLN B 737 7.664 -3.845 10.567 1.00 0.00 C ATOM 571 CG GLN B 737 7.837 -5.365 10.603 1.00 0.00 C ATOM 572 CD GLN B 737 7.051 -5.936 11.785 1.00 0.00 C ATOM 573 OE1 GLN B 737 6.008 -5.424 12.140 1.00 0.00 O ATOM 574 NE2 GLN B 737 7.513 -6.981 12.416 1.00 0.00 N ATOM 0 H GLN B 737 7.340 -3.447 8.216 1.00 0.00 H new ATOM 0 HA GLN B 737 5.548 -4.295 10.282 1.00 0.00 H new ATOM 0 HB2 GLN B 737 8.416 -3.398 9.917 1.00 0.00 H new ATOM 0 HB3 GLN B 737 7.815 -3.428 11.563 1.00 0.00 H new ATOM 0 HG2 GLN B 737 7.484 -5.805 9.670 1.00 0.00 H new ATOM 0 HG3 GLN B 737 8.893 -5.620 10.696 1.00 0.00 H new ATOM 0 HE21 GLN B 737 8.389 -7.411 12.118 1.00 0.00 H new ATOM 0 HE22 GLN B 737 6.998 -7.368 13.207 1.00 0.00 H new ATOM 583 N GLN B 738 6.345 -1.109 10.429 1.00 0.00 N ATOM 584 CA GLN B 738 5.878 0.162 11.064 1.00 0.00 C ATOM 585 C GLN B 738 4.629 0.709 10.357 1.00 0.00 C ATOM 586 O GLN B 738 3.879 1.470 10.937 1.00 0.00 O ATOM 587 CB GLN B 738 7.040 1.184 11.049 1.00 0.00 C ATOM 588 CG GLN B 738 7.813 1.214 9.724 1.00 0.00 C ATOM 589 CD GLN B 738 7.093 2.099 8.711 1.00 0.00 C ATOM 590 OE1 GLN B 738 5.971 2.509 8.926 1.00 0.00 O ATOM 591 NE2 GLN B 738 7.704 2.408 7.600 1.00 0.00 N ATOM 0 H GLN B 738 7.123 -1.015 9.776 1.00 0.00 H new ATOM 0 HA GLN B 738 5.589 -0.031 12.097 1.00 0.00 H new ATOM 0 HB2 GLN B 738 6.641 2.178 11.250 1.00 0.00 H new ATOM 0 HB3 GLN B 738 7.731 0.948 11.858 1.00 0.00 H new ATOM 0 HG2 GLN B 738 8.822 1.589 9.892 1.00 0.00 H new ATOM 0 HG3 GLN B 738 7.911 0.203 9.329 1.00 0.00 H new ATOM 0 HE21 GLN B 738 8.647 2.061 7.423 1.00 0.00 H new ATOM 0 HE22 GLN B 738 7.239 2.996 6.909 1.00 0.00 H new ATOM 600 N VAL B 739 4.358 0.309 9.134 1.00 0.00 N ATOM 601 CA VAL B 739 3.098 0.794 8.481 1.00 0.00 C ATOM 602 C VAL B 739 1.927 -0.056 8.995 1.00 0.00 C ATOM 603 O VAL B 739 0.829 0.423 9.192 1.00 0.00 O ATOM 604 CB VAL B 739 3.262 0.673 6.929 1.00 0.00 C ATOM 605 CG1 VAL B 739 4.713 0.907 6.495 1.00 0.00 C ATOM 606 CG2 VAL B 739 2.813 -0.703 6.415 1.00 0.00 C ATOM 0 H VAL B 739 4.938 -0.315 8.573 1.00 0.00 H new ATOM 0 HA VAL B 739 2.899 1.838 8.723 1.00 0.00 H new ATOM 0 HB VAL B 739 2.625 1.444 6.496 1.00 0.00 H new ATOM 0 HG11 VAL B 739 4.788 0.815 5.411 1.00 0.00 H new ATOM 0 HG12 VAL B 739 5.026 1.906 6.797 1.00 0.00 H new ATOM 0 HG13 VAL B 739 5.358 0.166 6.968 1.00 0.00 H new ATOM 0 HG21 VAL B 739 2.942 -0.747 5.334 1.00 0.00 H new ATOM 0 HG22 VAL B 739 3.415 -1.481 6.885 1.00 0.00 H new ATOM 0 HG23 VAL B 739 1.763 -0.858 6.661 1.00 0.00 H new ATOM 616 N LYS B 740 2.170 -1.322 9.206 1.00 0.00 N ATOM 617 CA LYS B 740 1.097 -2.227 9.698 1.00 0.00 C ATOM 618 C LYS B 740 0.504 -1.693 11.002 1.00 0.00 C ATOM 619 O LYS B 740 -0.693 -1.569 11.140 1.00 0.00 O ATOM 620 CB LYS B 740 1.808 -3.560 9.938 1.00 0.00 C ATOM 621 CG LYS B 740 0.840 -4.555 10.581 1.00 0.00 C ATOM 622 CD LYS B 740 1.263 -4.814 12.028 1.00 0.00 C ATOM 623 CE LYS B 740 1.861 -6.217 12.141 1.00 0.00 C ATOM 624 NZ LYS B 740 1.944 -6.479 13.606 1.00 0.00 N ATOM 0 H LYS B 740 3.074 -1.769 9.057 1.00 0.00 H new ATOM 0 HA LYS B 740 0.270 -2.316 8.994 1.00 0.00 H new ATOM 0 HB2 LYS B 740 2.181 -3.959 8.995 1.00 0.00 H new ATOM 0 HB3 LYS B 740 2.673 -3.410 10.584 1.00 0.00 H new ATOM 0 HG2 LYS B 740 -0.176 -4.161 10.553 1.00 0.00 H new ATOM 0 HG3 LYS B 740 0.835 -5.489 10.019 1.00 0.00 H new ATOM 0 HD2 LYS B 740 1.994 -4.069 12.343 1.00 0.00 H new ATOM 0 HD3 LYS B 740 0.404 -4.719 12.692 1.00 0.00 H new ATOM 0 HE2 LYS B 740 1.234 -6.956 11.642 1.00 0.00 H new ATOM 0 HE3 LYS B 740 2.845 -6.266 11.674 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 2.345 -7.425 13.767 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 2.553 -5.764 14.053 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 0.992 -6.432 14.022 1.00 0.00 H new ATOM 638 N SER B 741 1.334 -1.377 11.959 1.00 0.00 N ATOM 639 CA SER B 741 0.814 -0.849 13.253 1.00 0.00 C ATOM 640 C SER B 741 0.782 0.680 13.228 1.00 0.00 C ATOM 641 O SER B 741 0.862 1.331 14.251 1.00 0.00 O ATOM 642 CB SER B 741 1.810 -1.341 14.306 1.00 0.00 C ATOM 643 OG SER B 741 1.290 -2.497 14.946 1.00 0.00 O ATOM 0 H SER B 741 2.349 -1.462 11.901 1.00 0.00 H new ATOM 0 HA SER B 741 -0.202 -1.186 13.457 1.00 0.00 H new ATOM 0 HB2 SER B 741 2.767 -1.571 13.837 1.00 0.00 H new ATOM 0 HB3 SER B 741 1.995 -0.558 15.041 1.00 0.00 H new ATOM 0 HG SER B 741 1.928 -2.813 15.619 1.00 0.00 H new ATOM 649 N HIS B 742 0.667 1.258 12.064 1.00 0.00 N ATOM 650 CA HIS B 742 0.642 2.743 11.964 1.00 0.00 C ATOM 651 C HIS B 742 -0.747 3.283 12.303 1.00 0.00 C ATOM 652 O HIS B 742 -1.733 2.581 12.223 1.00 0.00 O ATOM 653 CB HIS B 742 0.969 3.032 10.500 1.00 0.00 C ATOM 654 CG HIS B 742 1.663 4.363 10.392 1.00 0.00 C ATOM 655 ND1 HIS B 742 0.999 5.564 10.591 1.00 0.00 N ATOM 656 CD2 HIS B 742 2.960 4.698 10.091 1.00 0.00 C ATOM 657 CE1 HIS B 742 1.893 6.555 10.417 1.00 0.00 C ATOM 658 NE2 HIS B 742 3.104 6.082 10.110 1.00 0.00 N ATOM 0 H HIS B 742 0.589 0.763 11.175 1.00 0.00 H new ATOM 0 HA HIS B 742 1.342 3.213 12.655 1.00 0.00 H new ATOM 0 HB2 HIS B 742 1.606 2.245 10.097 1.00 0.00 H new ATOM 0 HB3 HIS B 742 0.055 3.038 9.907 1.00 0.00 H new ATOM 0 HD1 HIS B 742 0.013 5.676 10.826 1.00 0.00 H new ATOM 0 HD2 HIS B 742 3.749 3.994 9.873 1.00 0.00 H new ATOM 0 HE1 HIS B 742 1.660 7.605 10.514 1.00 0.00 H new ATOM 666 N GLN B 743 -0.839 4.543 12.628 1.00 0.00 N ATOM 667 CA GLN B 743 -2.168 5.135 12.948 1.00 0.00 C ATOM 668 C GLN B 743 -2.955 5.449 11.668 1.00 0.00 C ATOM 669 O GLN B 743 -4.027 6.019 11.719 1.00 0.00 O ATOM 670 CB GLN B 743 -1.850 6.421 13.700 1.00 0.00 C ATOM 671 CG GLN B 743 -3.044 6.793 14.577 1.00 0.00 C ATOM 672 CD GLN B 743 -3.303 5.681 15.596 1.00 0.00 C ATOM 673 OE1 GLN B 743 -4.033 4.749 15.322 1.00 0.00 O ATOM 674 NE2 GLN B 743 -2.733 5.741 16.768 1.00 0.00 N ATOM 0 H GLN B 743 -0.051 5.188 12.686 1.00 0.00 H new ATOM 0 HA GLN B 743 -2.785 4.451 13.531 1.00 0.00 H new ATOM 0 HB2 GLN B 743 -0.959 6.288 14.314 1.00 0.00 H new ATOM 0 HB3 GLN B 743 -1.635 7.225 12.996 1.00 0.00 H new ATOM 0 HG2 GLN B 743 -2.850 7.734 15.092 1.00 0.00 H new ATOM 0 HG3 GLN B 743 -3.928 6.945 13.958 1.00 0.00 H new ATOM 0 HE21 GLN B 743 -2.120 6.523 16.998 1.00 0.00 H new ATOM 0 HE22 GLN B 743 -2.900 5.005 17.455 1.00 0.00 H new ATOM 683 N SER B 744 -2.442 5.084 10.521 1.00 0.00 N ATOM 684 CA SER B 744 -3.172 5.376 9.254 1.00 0.00 C ATOM 685 C SER B 744 -3.332 4.108 8.404 1.00 0.00 C ATOM 686 O SER B 744 -4.015 4.111 7.401 1.00 0.00 O ATOM 687 CB SER B 744 -2.307 6.406 8.515 1.00 0.00 C ATOM 688 OG SER B 744 -0.952 6.289 8.931 1.00 0.00 O ATOM 0 H SER B 744 -1.552 4.598 10.408 1.00 0.00 H new ATOM 0 HA SER B 744 -4.178 5.748 9.451 1.00 0.00 H new ATOM 0 HB2 SER B 744 -2.381 6.250 7.439 1.00 0.00 H new ATOM 0 HB3 SER B 744 -2.673 7.413 8.717 1.00 0.00 H new ATOM 0 HG SER B 744 -0.737 7.014 9.554 1.00 0.00 H new ATOM 694 N ALA B 745 -2.717 3.022 8.796 1.00 0.00 N ATOM 695 CA ALA B 745 -2.850 1.763 8.011 1.00 0.00 C ATOM 696 C ALA B 745 -4.197 1.086 8.285 1.00 0.00 C ATOM 697 O ALA B 745 -4.565 0.139 7.619 1.00 0.00 O ATOM 698 CB ALA B 745 -1.712 0.872 8.512 1.00 0.00 C ATOM 0 H ALA B 745 -2.129 2.955 9.626 1.00 0.00 H new ATOM 0 HA ALA B 745 -2.802 1.949 6.938 1.00 0.00 H new ATOM 0 HB1 ALA B 745 -1.736 -0.081 7.983 1.00 0.00 H new ATOM 0 HB2 ALA B 745 -0.757 1.364 8.329 1.00 0.00 H new ATOM 0 HB3 ALA B 745 -1.831 0.697 9.581 1.00 0.00 H new ATOM 704 N TRP B 746 -4.931 1.542 9.270 1.00 0.00 N ATOM 705 CA TRP B 746 -6.237 0.888 9.582 1.00 0.00 C ATOM 706 C TRP B 746 -7.087 0.686 8.310 1.00 0.00 C ATOM 707 O TRP B 746 -7.523 -0.418 8.050 1.00 0.00 O ATOM 708 CB TRP B 746 -6.964 1.816 10.562 1.00 0.00 C ATOM 709 CG TRP B 746 -6.135 2.111 11.778 1.00 0.00 C ATOM 710 CD1 TRP B 746 -6.425 3.092 12.664 1.00 0.00 C ATOM 711 CD2 TRP B 746 -4.934 1.447 12.289 1.00 0.00 C ATOM 712 NE1 TRP B 746 -5.484 3.084 13.673 1.00 0.00 N ATOM 713 CE2 TRP B 746 -4.545 2.092 13.491 1.00 0.00 C ATOM 714 CE3 TRP B 746 -4.146 0.371 11.840 1.00 0.00 C ATOM 715 CZ2 TRP B 746 -3.423 1.686 14.214 1.00 0.00 C ATOM 716 CZ3 TRP B 746 -3.017 -0.038 12.567 1.00 0.00 C ATOM 717 CH2 TRP B 746 -2.659 0.614 13.753 1.00 0.00 C ATOM 0 H TRP B 746 -4.684 2.332 9.866 1.00 0.00 H new ATOM 0 HA TRP B 746 -6.074 -0.101 10.009 1.00 0.00 H new ATOM 0 HB2 TRP B 746 -7.214 2.750 10.059 1.00 0.00 H new ATOM 0 HB3 TRP B 746 -7.904 1.356 10.867 1.00 0.00 H new ATOM 0 HD1 TRP B 746 -7.260 3.773 12.593 1.00 0.00 H new ATOM 0 HE1 TRP B 746 -5.483 3.734 14.459 1.00 0.00 H new ATOM 0 HE3 TRP B 746 -4.412 -0.144 10.929 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 -3.148 2.198 15.124 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 -2.419 -0.863 12.208 1.00 0.00 H new ATOM 0 HH2 TRP B 746 -1.793 0.288 14.310 1.00 0.00 H new ATOM 728 N PRO B 747 -7.322 1.744 7.556 1.00 0.00 N ATOM 729 CA PRO B 747 -8.153 1.616 6.329 1.00 0.00 C ATOM 730 C PRO B 747 -7.495 0.683 5.315 1.00 0.00 C ATOM 731 O PRO B 747 -8.154 0.110 4.470 1.00 0.00 O ATOM 732 CB PRO B 747 -8.207 3.040 5.770 1.00 0.00 C ATOM 733 CG PRO B 747 -7.052 3.746 6.396 1.00 0.00 C ATOM 734 CD PRO B 747 -6.869 3.131 7.752 1.00 0.00 C ATOM 0 HA PRO B 747 -9.137 1.198 6.540 1.00 0.00 H new ATOM 0 HB2 PRO B 747 -8.127 3.040 4.683 1.00 0.00 H new ATOM 0 HB3 PRO B 747 -9.150 3.527 6.021 1.00 0.00 H new ATOM 0 HG2 PRO B 747 -6.152 3.631 5.792 1.00 0.00 H new ATOM 0 HG3 PRO B 747 -7.247 4.815 6.477 1.00 0.00 H new ATOM 0 HD2 PRO B 747 -5.829 3.173 8.076 1.00 0.00 H new ATOM 0 HD3 PRO B 747 -7.460 3.644 8.510 1.00 0.00 H new ATOM 742 N PHE B 748 -6.200 0.539 5.370 1.00 0.00 N ATOM 743 CA PHE B 748 -5.515 -0.329 4.371 1.00 0.00 C ATOM 744 C PHE B 748 -5.345 -1.739 4.930 1.00 0.00 C ATOM 745 O PHE B 748 -4.486 -2.483 4.506 1.00 0.00 O ATOM 746 CB PHE B 748 -4.134 0.306 4.126 1.00 0.00 C ATOM 747 CG PHE B 748 -4.225 1.815 3.955 1.00 0.00 C ATOM 748 CD1 PHE B 748 -5.425 2.435 3.569 1.00 0.00 C ATOM 749 CD2 PHE B 748 -3.081 2.591 4.161 1.00 0.00 C ATOM 750 CE1 PHE B 748 -5.483 3.826 3.437 1.00 0.00 C ATOM 751 CE2 PHE B 748 -3.136 3.981 4.009 1.00 0.00 C ATOM 752 CZ PHE B 748 -4.336 4.597 3.643 1.00 0.00 C ATOM 0 H PHE B 748 -5.590 0.981 6.058 1.00 0.00 H new ATOM 0 HA PHE B 748 -6.092 -0.404 3.449 1.00 0.00 H new ATOM 0 HB2 PHE B 748 -3.475 0.075 4.963 1.00 0.00 H new ATOM 0 HB3 PHE B 748 -3.685 -0.134 3.235 1.00 0.00 H new ATOM 0 HD1 PHE B 748 -6.303 1.837 3.374 1.00 0.00 H new ATOM 0 HD2 PHE B 748 -2.151 2.116 4.438 1.00 0.00 H new ATOM 0 HE1 PHE B 748 -6.415 4.305 3.176 1.00 0.00 H new ATOM 0 HE2 PHE B 748 -2.251 4.578 4.175 1.00 0.00 H new ATOM 0 HZ PHE B 748 -4.377 5.669 3.519 1.00 0.00 H new ATOM 762 N MET B 749 -6.155 -2.115 5.880 1.00 0.00 N ATOM 763 CA MET B 749 -6.026 -3.481 6.454 1.00 0.00 C ATOM 764 C MET B 749 -7.327 -4.265 6.279 1.00 0.00 C ATOM 765 O MET B 749 -7.593 -5.210 6.995 1.00 0.00 O ATOM 766 CB MET B 749 -5.730 -3.259 7.937 1.00 0.00 C ATOM 767 CG MET B 749 -4.264 -2.857 8.111 1.00 0.00 C ATOM 768 SD MET B 749 -3.949 -2.469 9.851 1.00 0.00 S ATOM 769 CE MET B 749 -2.546 -3.587 10.085 1.00 0.00 C ATOM 0 H MET B 749 -6.896 -1.539 6.281 1.00 0.00 H new ATOM 0 HA MET B 749 -5.245 -4.059 5.961 1.00 0.00 H new ATOM 0 HB2 MET B 749 -6.381 -2.481 8.336 1.00 0.00 H new ATOM 0 HB3 MET B 749 -5.938 -4.169 8.500 1.00 0.00 H new ATOM 0 HG2 MET B 749 -3.612 -3.667 7.784 1.00 0.00 H new ATOM 0 HG3 MET B 749 -4.036 -1.993 7.487 1.00 0.00 H new ATOM 0 HE1 MET B 749 -2.174 -3.496 11.106 1.00 0.00 H new ATOM 0 HE2 MET B 749 -2.865 -4.614 9.906 1.00 0.00 H new ATOM 0 HE3 MET B 749 -1.752 -3.326 9.385 1.00 0.00 H new ATOM 779 N GLU B 750 -8.139 -3.888 5.328 1.00 0.00 N ATOM 780 CA GLU B 750 -9.409 -4.635 5.101 1.00 0.00 C ATOM 781 C GLU B 750 -9.541 -5.008 3.615 1.00 0.00 C ATOM 782 O GLU B 750 -9.280 -4.191 2.755 1.00 0.00 O ATOM 783 CB GLU B 750 -10.524 -3.671 5.519 1.00 0.00 C ATOM 784 CG GLU B 750 -10.539 -2.459 4.588 1.00 0.00 C ATOM 785 CD GLU B 750 -11.486 -1.399 5.150 1.00 0.00 C ATOM 786 OE1 GLU B 750 -12.519 -1.775 5.680 1.00 0.00 O ATOM 787 OE2 GLU B 750 -11.162 -0.229 5.042 1.00 0.00 O ATOM 0 H GLU B 750 -7.979 -3.099 4.702 1.00 0.00 H new ATOM 0 HA GLU B 750 -9.449 -5.565 5.668 1.00 0.00 H new ATOM 0 HB2 GLU B 750 -11.488 -4.179 5.485 1.00 0.00 H new ATOM 0 HB3 GLU B 750 -10.370 -3.348 6.549 1.00 0.00 H new ATOM 0 HG2 GLU B 750 -9.534 -2.049 4.490 1.00 0.00 H new ATOM 0 HG3 GLU B 750 -10.860 -2.757 3.590 1.00 0.00 H new ATOM 794 N PRO B 751 -9.944 -6.230 3.353 1.00 0.00 N ATOM 795 CA PRO B 751 -10.082 -6.686 1.953 1.00 0.00 C ATOM 796 C PRO B 751 -11.365 -6.141 1.313 1.00 0.00 C ATOM 797 O PRO B 751 -12.456 -6.550 1.657 1.00 0.00 O ATOM 798 CB PRO B 751 -10.170 -8.212 2.051 1.00 0.00 C ATOM 799 CG PRO B 751 -10.193 -8.561 3.512 1.00 0.00 C ATOM 800 CD PRO B 751 -10.269 -7.288 4.312 1.00 0.00 C ATOM 0 HA PRO B 751 -9.251 -6.341 1.337 1.00 0.00 H new ATOM 0 HB2 PRO B 751 -11.068 -8.579 1.553 1.00 0.00 H new ATOM 0 HB3 PRO B 751 -9.318 -8.679 1.557 1.00 0.00 H new ATOM 0 HG2 PRO B 751 -11.049 -9.199 3.735 1.00 0.00 H new ATOM 0 HG3 PRO B 751 -9.298 -9.123 3.780 1.00 0.00 H new ATOM 0 HD2 PRO B 751 -11.262 -7.146 4.738 1.00 0.00 H new ATOM 0 HD3 PRO B 751 -9.564 -7.300 5.144 1.00 0.00 H new ATOM 808 N VAL B 752 -11.251 -5.260 0.352 1.00 0.00 N ATOM 809 CA VAL B 752 -12.481 -4.758 -0.334 1.00 0.00 C ATOM 810 C VAL B 752 -13.148 -5.910 -1.082 1.00 0.00 C ATOM 811 O VAL B 752 -12.508 -6.860 -1.484 1.00 0.00 O ATOM 812 CB VAL B 752 -12.010 -3.673 -1.319 1.00 0.00 C ATOM 813 CG1 VAL B 752 -10.874 -4.220 -2.187 1.00 0.00 C ATOM 814 CG2 VAL B 752 -13.175 -3.250 -2.219 1.00 0.00 C ATOM 0 H VAL B 752 -10.371 -4.870 0.015 1.00 0.00 H new ATOM 0 HA VAL B 752 -13.208 -4.353 0.371 1.00 0.00 H new ATOM 0 HB VAL B 752 -11.654 -2.811 -0.755 1.00 0.00 H new ATOM 0 HG11 VAL B 752 -10.544 -3.449 -2.883 1.00 0.00 H new ATOM 0 HG12 VAL B 752 -10.040 -4.516 -1.551 1.00 0.00 H new ATOM 0 HG13 VAL B 752 -11.228 -5.086 -2.747 1.00 0.00 H new ATOM 0 HG21 VAL B 752 -12.837 -2.482 -2.915 1.00 0.00 H new ATOM 0 HG22 VAL B 752 -13.535 -4.114 -2.779 1.00 0.00 H new ATOM 0 HG23 VAL B 752 -13.984 -2.853 -1.605 1.00 0.00 H new ATOM 899 N ALA B 757 -18.264 -3.790 -3.774 1.00 0.00 N ATOM 900 CA ALA B 757 -17.359 -2.607 -3.726 1.00 0.00 C ATOM 901 C ALA B 757 -17.213 -2.001 -5.128 1.00 0.00 C ATOM 902 O ALA B 757 -16.246 -2.264 -5.815 1.00 0.00 O ATOM 903 CB ALA B 757 -16.017 -3.158 -3.234 1.00 0.00 C ATOM 0 HA ALA B 757 -17.738 -1.818 -3.076 1.00 0.00 H new ATOM 0 HB1 ALA B 757 -15.292 -2.347 -3.171 1.00 0.00 H new ATOM 0 HB2 ALA B 757 -16.147 -3.606 -2.249 1.00 0.00 H new ATOM 0 HB3 ALA B 757 -15.656 -3.914 -3.932 1.00 0.00 H new ATOM 909 N PRO B 758 -18.188 -1.211 -5.514 1.00 0.00 N ATOM 910 CA PRO B 758 -18.169 -0.590 -6.864 1.00 0.00 C ATOM 911 C PRO B 758 -17.019 0.411 -6.995 1.00 0.00 C ATOM 912 O PRO B 758 -16.509 0.920 -6.018 1.00 0.00 O ATOM 913 CB PRO B 758 -19.515 0.133 -6.957 1.00 0.00 C ATOM 914 CG PRO B 758 -19.982 0.289 -5.544 1.00 0.00 C ATOM 915 CD PRO B 758 -19.397 -0.852 -4.759 1.00 0.00 C ATOM 0 HA PRO B 758 -18.023 -1.326 -7.655 1.00 0.00 H new ATOM 0 HB2 PRO B 758 -19.407 1.102 -7.444 1.00 0.00 H new ATOM 0 HB3 PRO B 758 -20.230 -0.442 -7.546 1.00 0.00 H new ATOM 0 HG2 PRO B 758 -19.658 1.245 -5.134 1.00 0.00 H new ATOM 0 HG3 PRO B 758 -21.071 0.273 -5.494 1.00 0.00 H new ATOM 0 HD2 PRO B 758 -19.158 -0.555 -3.738 1.00 0.00 H new ATOM 0 HD3 PRO B 758 -20.091 -1.690 -4.693 1.00 0.00 H new ATOM 923 N GLY B 759 -16.618 0.705 -8.204 1.00 0.00 N ATOM 924 CA GLY B 759 -15.512 1.683 -8.408 1.00 0.00 C ATOM 925 C GLY B 759 -14.180 0.939 -8.528 1.00 0.00 C ATOM 926 O GLY B 759 -13.239 1.423 -9.121 1.00 0.00 O ATOM 0 H GLY B 759 -17.010 0.309 -9.059 1.00 0.00 H new ATOM 0 HA2 GLY B 759 -15.694 2.270 -9.308 1.00 0.00 H new ATOM 0 HA3 GLY B 759 -15.474 2.383 -7.573 1.00 0.00 H new ATOM 930 N TYR B 760 -14.086 -0.224 -7.947 1.00 0.00 N ATOM 931 CA TYR B 760 -12.813 -0.991 -8.019 1.00 0.00 C ATOM 932 C TYR B 760 -12.704 -1.730 -9.354 1.00 0.00 C ATOM 933 O TYR B 760 -13.251 -2.800 -9.528 1.00 0.00 O ATOM 934 CB TYR B 760 -12.892 -1.987 -6.861 1.00 0.00 C ATOM 935 CG TYR B 760 -12.176 -1.415 -5.664 1.00 0.00 C ATOM 936 CD1 TYR B 760 -12.826 -0.497 -4.830 1.00 0.00 C ATOM 937 CD2 TYR B 760 -10.858 -1.794 -5.393 1.00 0.00 C ATOM 938 CE1 TYR B 760 -12.158 0.036 -3.722 1.00 0.00 C ATOM 939 CE2 TYR B 760 -10.190 -1.264 -4.284 1.00 0.00 C ATOM 940 CZ TYR B 760 -10.839 -0.347 -3.449 1.00 0.00 C ATOM 941 OH TYR B 760 -10.180 0.178 -2.356 1.00 0.00 O ATOM 0 H TYR B 760 -14.837 -0.676 -7.425 1.00 0.00 H new ATOM 0 HA TYR B 760 -11.939 -0.344 -7.949 1.00 0.00 H new ATOM 0 HB2 TYR B 760 -13.933 -2.192 -6.613 1.00 0.00 H new ATOM 0 HB3 TYR B 760 -12.440 -2.936 -7.151 1.00 0.00 H new ATOM 0 HD1 TYR B 760 -13.843 -0.200 -5.042 1.00 0.00 H new ATOM 0 HD2 TYR B 760 -10.355 -2.497 -6.041 1.00 0.00 H new ATOM 0 HE1 TYR B 760 -12.660 0.743 -3.077 1.00 0.00 H new ATOM 0 HE2 TYR B 760 -9.174 -1.562 -4.072 1.00 0.00 H new ATOM 0 HH TYR B 760 -10.184 1.156 -2.410 1.00 0.00 H new ATOM 951 N TYR B 761 -11.996 -1.162 -10.292 1.00 0.00 N ATOM 952 CA TYR B 761 -11.833 -1.815 -11.624 1.00 0.00 C ATOM 953 C TYR B 761 -10.951 -0.945 -12.518 1.00 0.00 C ATOM 954 O TYR B 761 -10.018 -1.414 -13.138 1.00 0.00 O ATOM 955 CB TYR B 761 -13.245 -1.904 -12.214 1.00 0.00 C ATOM 956 CG TYR B 761 -13.180 -2.552 -13.576 1.00 0.00 C ATOM 957 CD1 TYR B 761 -12.745 -3.878 -13.700 1.00 0.00 C ATOM 958 CD2 TYR B 761 -13.555 -1.830 -14.715 1.00 0.00 C ATOM 959 CE1 TYR B 761 -12.684 -4.480 -14.962 1.00 0.00 C ATOM 960 CE2 TYR B 761 -13.494 -2.432 -15.977 1.00 0.00 C ATOM 961 CZ TYR B 761 -13.059 -3.757 -16.101 1.00 0.00 C ATOM 962 OH TYR B 761 -12.999 -4.351 -17.345 1.00 0.00 O ATOM 0 H TYR B 761 -11.519 -0.266 -10.192 1.00 0.00 H new ATOM 0 HA TYR B 761 -11.365 -2.796 -11.544 1.00 0.00 H new ATOM 0 HB2 TYR B 761 -13.891 -2.483 -11.554 1.00 0.00 H new ATOM 0 HB3 TYR B 761 -13.681 -0.908 -12.293 1.00 0.00 H new ATOM 0 HD1 TYR B 761 -12.457 -4.436 -12.821 1.00 0.00 H new ATOM 0 HD2 TYR B 761 -13.891 -0.808 -14.620 1.00 0.00 H new ATOM 0 HE1 TYR B 761 -12.348 -5.502 -15.057 1.00 0.00 H new ATOM 0 HE2 TYR B 761 -13.783 -1.874 -16.856 1.00 0.00 H new ATOM 0 HH TYR B 761 -13.295 -3.712 -18.027 1.00 0.00 H new ATOM 972 N GLU B 762 -11.240 0.327 -12.582 1.00 0.00 N ATOM 973 CA GLU B 762 -10.427 1.235 -13.441 1.00 0.00 C ATOM 974 C GLU B 762 -9.896 2.428 -12.637 1.00 0.00 C ATOM 975 O GLU B 762 -9.051 3.168 -13.100 1.00 0.00 O ATOM 976 CB GLU B 762 -11.394 1.718 -14.524 1.00 0.00 C ATOM 977 CG GLU B 762 -12.573 2.441 -13.869 1.00 0.00 C ATOM 978 CD GLU B 762 -12.799 3.783 -14.567 1.00 0.00 C ATOM 979 OE1 GLU B 762 -13.325 3.775 -15.668 1.00 0.00 O ATOM 980 OE2 GLU B 762 -12.443 4.797 -13.989 1.00 0.00 O ATOM 0 H GLU B 762 -12.004 0.776 -12.077 1.00 0.00 H new ATOM 0 HA GLU B 762 -9.555 0.727 -13.853 1.00 0.00 H new ATOM 0 HB2 GLU B 762 -10.880 2.388 -15.213 1.00 0.00 H new ATOM 0 HB3 GLU B 762 -11.753 0.872 -15.110 1.00 0.00 H new ATOM 0 HG2 GLU B 762 -13.472 1.828 -13.936 1.00 0.00 H new ATOM 0 HG3 GLU B 762 -12.373 2.599 -12.809 1.00 0.00 H new ATOM 987 N VAL B 763 -10.385 2.631 -11.442 1.00 0.00 N ATOM 988 CA VAL B 763 -9.897 3.785 -10.626 1.00 0.00 C ATOM 989 C VAL B 763 -8.847 3.299 -9.635 1.00 0.00 C ATOM 990 O VAL B 763 -7.859 3.958 -9.379 1.00 0.00 O ATOM 991 CB VAL B 763 -11.109 4.332 -9.839 1.00 0.00 C ATOM 992 CG1 VAL B 763 -10.905 5.827 -9.585 1.00 0.00 C ATOM 993 CG2 VAL B 763 -12.422 4.129 -10.608 1.00 0.00 C ATOM 0 H VAL B 763 -11.097 2.052 -10.997 1.00 0.00 H new ATOM 0 HA VAL B 763 -9.458 4.552 -11.265 1.00 0.00 H new ATOM 0 HB VAL B 763 -11.178 3.785 -8.899 1.00 0.00 H new ATOM 0 HG11 VAL B 763 -11.756 6.221 -9.030 1.00 0.00 H new ATOM 0 HG12 VAL B 763 -9.994 5.977 -9.006 1.00 0.00 H new ATOM 0 HG13 VAL B 763 -10.820 6.350 -10.538 1.00 0.00 H new ATOM 0 HG21 VAL B 763 -13.251 4.526 -10.023 1.00 0.00 H new ATOM 0 HG22 VAL B 763 -12.369 4.651 -11.563 1.00 0.00 H new ATOM 0 HG23 VAL B 763 -12.579 3.065 -10.785 1.00 0.00 H new ATOM 1003 N ILE B 764 -9.073 2.156 -9.052 1.00 0.00 N ATOM 1004 CA ILE B 764 -8.120 1.635 -8.037 1.00 0.00 C ATOM 1005 C ILE B 764 -6.976 0.860 -8.691 1.00 0.00 C ATOM 1006 O ILE B 764 -6.079 0.403 -8.017 1.00 0.00 O ATOM 1007 CB ILE B 764 -8.955 0.696 -7.149 1.00 0.00 C ATOM 1008 CG1 ILE B 764 -10.255 1.386 -6.707 1.00 0.00 C ATOM 1009 CG2 ILE B 764 -8.143 0.313 -5.911 1.00 0.00 C ATOM 1010 CD1 ILE B 764 -9.936 2.745 -6.079 1.00 0.00 C ATOM 0 H ILE B 764 -9.879 1.559 -9.236 1.00 0.00 H new ATOM 0 HA ILE B 764 -7.659 2.446 -7.473 1.00 0.00 H new ATOM 0 HB ILE B 764 -9.206 -0.196 -7.723 1.00 0.00 H new ATOM 0 HG12 ILE B 764 -10.916 1.518 -7.563 1.00 0.00 H new ATOM 0 HG13 ILE B 764 -10.784 0.759 -5.989 1.00 0.00 H new ATOM 0 HG21 ILE B 764 -8.733 -0.352 -5.280 1.00 0.00 H new ATOM 0 HG22 ILE B 764 -7.229 -0.194 -6.218 1.00 0.00 H new ATOM 0 HG23 ILE B 764 -7.888 1.212 -5.351 1.00 0.00 H new ATOM 0 HD11 ILE B 764 -10.862 3.228 -5.768 1.00 0.00 H new ATOM 0 HD12 ILE B 764 -9.292 2.603 -5.211 1.00 0.00 H new ATOM 0 HD13 ILE B 764 -9.427 3.373 -6.810 1.00 0.00 H new ATOM 1022 N ARG B 765 -6.996 0.729 -9.995 1.00 0.00 N ATOM 1023 CA ARG B 765 -5.918 -0.027 -10.712 1.00 0.00 C ATOM 1024 C ARG B 765 -5.876 -1.485 -10.236 1.00 0.00 C ATOM 1025 O ARG B 765 -6.282 -2.388 -10.941 1.00 0.00 O ATOM 1026 CB ARG B 765 -4.608 0.698 -10.377 1.00 0.00 C ATOM 1027 CG ARG B 765 -4.747 2.185 -10.711 1.00 0.00 C ATOM 1028 CD ARG B 765 -3.361 2.786 -10.950 1.00 0.00 C ATOM 1029 NE ARG B 765 -3.626 4.120 -11.567 1.00 0.00 N ATOM 1030 CZ ARG B 765 -4.015 4.219 -12.817 1.00 0.00 C ATOM 1031 NH1 ARG B 765 -4.183 3.152 -13.560 1.00 0.00 N ATOM 1032 NH2 ARG B 765 -4.240 5.398 -13.329 1.00 0.00 N ATOM 0 H ARG B 765 -7.720 1.117 -10.600 1.00 0.00 H new ATOM 0 HA ARG B 765 -6.091 -0.055 -11.788 1.00 0.00 H new ATOM 0 HB2 ARG B 765 -4.370 0.572 -9.321 1.00 0.00 H new ATOM 0 HB3 ARG B 765 -3.784 0.263 -10.943 1.00 0.00 H new ATOM 0 HG2 ARG B 765 -5.368 2.313 -11.597 1.00 0.00 H new ATOM 0 HG3 ARG B 765 -5.246 2.707 -9.894 1.00 0.00 H new ATOM 0 HD2 ARG B 765 -2.806 2.885 -10.017 1.00 0.00 H new ATOM 0 HD3 ARG B 765 -2.765 2.156 -11.610 1.00 0.00 H new ATOM 0 HE ARG B 765 -3.503 4.965 -11.010 1.00 0.00 H new ATOM 0 HH11 ARG B 765 -4.011 2.226 -13.169 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -4.486 3.248 -14.529 1.00 0.00 H new ATOM 0 HH21 ARG B 765 -4.113 6.234 -12.759 1.00 0.00 H new ATOM 0 HH22 ARG B 765 -4.542 5.483 -14.299 1.00 0.00 H new ATOM 1046 N PHE B 766 -5.381 -1.723 -9.054 1.00 0.00 N ATOM 1047 CA PHE B 766 -5.347 -3.108 -8.517 1.00 0.00 C ATOM 1048 C PHE B 766 -5.615 -3.074 -7.009 1.00 0.00 C ATOM 1049 O PHE B 766 -4.707 -2.853 -6.239 1.00 0.00 O ATOM 1050 CB PHE B 766 -3.932 -3.621 -8.812 1.00 0.00 C ATOM 1051 CG PHE B 766 -3.659 -4.907 -8.058 1.00 0.00 C ATOM 1052 CD1 PHE B 766 -4.658 -5.883 -7.944 1.00 0.00 C ATOM 1053 CD2 PHE B 766 -2.399 -5.128 -7.488 1.00 0.00 C ATOM 1054 CE1 PHE B 766 -4.400 -7.072 -7.252 1.00 0.00 C ATOM 1055 CE2 PHE B 766 -2.141 -6.318 -6.798 1.00 0.00 C ATOM 1056 CZ PHE B 766 -3.142 -7.290 -6.678 1.00 0.00 C ATOM 0 H PHE B 766 -4.996 -1.011 -8.434 1.00 0.00 H new ATOM 0 HA PHE B 766 -6.102 -3.754 -8.966 1.00 0.00 H new ATOM 0 HB2 PHE B 766 -3.817 -3.790 -9.883 1.00 0.00 H new ATOM 0 HB3 PHE B 766 -3.200 -2.865 -8.529 1.00 0.00 H new ATOM 0 HD1 PHE B 766 -5.627 -5.718 -8.390 1.00 0.00 H new ATOM 0 HD2 PHE B 766 -1.626 -4.380 -7.581 1.00 0.00 H new ATOM 0 HE1 PHE B 766 -5.172 -7.822 -7.161 1.00 0.00 H new ATOM 0 HE2 PHE B 766 -1.169 -6.487 -6.358 1.00 0.00 H new ATOM 0 HZ PHE B 766 -2.944 -8.207 -6.143 1.00 0.00 H new ATOM 1066 N PRO B 767 -6.859 -3.270 -6.633 1.00 0.00 N ATOM 1067 CA PRO B 767 -7.253 -3.282 -5.199 1.00 0.00 C ATOM 1068 C PRO B 767 -6.174 -3.907 -4.305 1.00 0.00 C ATOM 1069 O PRO B 767 -6.066 -5.112 -4.193 1.00 0.00 O ATOM 1070 CB PRO B 767 -8.521 -4.153 -5.194 1.00 0.00 C ATOM 1071 CG PRO B 767 -8.789 -4.506 -6.634 1.00 0.00 C ATOM 1072 CD PRO B 767 -8.022 -3.535 -7.474 1.00 0.00 C ATOM 0 HA PRO B 767 -7.403 -2.277 -4.805 1.00 0.00 H new ATOM 0 HB2 PRO B 767 -8.375 -5.051 -4.593 1.00 0.00 H new ATOM 0 HB3 PRO B 767 -9.363 -3.613 -4.761 1.00 0.00 H new ATOM 0 HG2 PRO B 767 -8.476 -5.529 -6.845 1.00 0.00 H new ATOM 0 HG3 PRO B 767 -9.855 -4.447 -6.853 1.00 0.00 H new ATOM 0 HD2 PRO B 767 -7.742 -3.960 -8.438 1.00 0.00 H new ATOM 0 HD3 PRO B 767 -8.594 -2.630 -7.679 1.00 0.00 H new ATOM 1080 N MET B 768 -5.373 -3.090 -3.673 1.00 0.00 N ATOM 1081 CA MET B 768 -4.324 -3.626 -2.762 1.00 0.00 C ATOM 1082 C MET B 768 -4.632 -3.212 -1.325 1.00 0.00 C ATOM 1083 O MET B 768 -5.429 -2.328 -1.081 1.00 0.00 O ATOM 1084 CB MET B 768 -3.010 -2.989 -3.221 1.00 0.00 C ATOM 1085 CG MET B 768 -2.683 -3.442 -4.646 1.00 0.00 C ATOM 1086 SD MET B 768 -1.054 -4.226 -4.681 1.00 0.00 S ATOM 1087 CE MET B 768 -1.565 -5.811 -3.979 1.00 0.00 C ATOM 0 H MET B 768 -5.402 -2.073 -3.750 1.00 0.00 H new ATOM 0 HA MET B 768 -4.274 -4.714 -2.793 1.00 0.00 H new ATOM 0 HB2 MET B 768 -3.090 -1.903 -3.185 1.00 0.00 H new ATOM 0 HB3 MET B 768 -2.203 -3.272 -2.546 1.00 0.00 H new ATOM 0 HG2 MET B 768 -3.441 -4.142 -4.998 1.00 0.00 H new ATOM 0 HG3 MET B 768 -2.700 -2.587 -5.322 1.00 0.00 H new ATOM 0 HE1 MET B 768 -0.927 -6.604 -4.368 1.00 0.00 H new ATOM 0 HE2 MET B 768 -1.476 -5.774 -2.893 1.00 0.00 H new ATOM 0 HE3 MET B 768 -2.601 -6.013 -4.251 1.00 0.00 H new ATOM 1097 N ASP B 769 -4.004 -3.839 -0.371 1.00 0.00 N ATOM 1098 CA ASP B 769 -4.267 -3.494 1.055 1.00 0.00 C ATOM 1099 C ASP B 769 -3.350 -4.321 1.958 1.00 0.00 C ATOM 1100 O ASP B 769 -3.061 -5.466 1.669 1.00 0.00 O ATOM 1101 CB ASP B 769 -5.736 -3.873 1.279 1.00 0.00 C ATOM 1102 CG ASP B 769 -6.114 -3.661 2.745 1.00 0.00 C ATOM 1103 OD1 ASP B 769 -5.633 -4.410 3.577 1.00 0.00 O ATOM 1104 OD2 ASP B 769 -6.894 -2.760 3.009 1.00 0.00 O ATOM 0 H ASP B 769 -3.317 -4.579 -0.517 1.00 0.00 H new ATOM 0 HA ASP B 769 -4.080 -2.444 1.282 1.00 0.00 H new ATOM 0 HB2 ASP B 769 -6.378 -3.268 0.638 1.00 0.00 H new ATOM 0 HB3 ASP B 769 -5.898 -4.914 1.000 1.00 0.00 H new ATOM 1109 N LEU B 770 -2.874 -3.752 3.040 1.00 0.00 N ATOM 1110 CA LEU B 770 -1.966 -4.515 3.956 1.00 0.00 C ATOM 1111 C LEU B 770 -2.537 -5.907 4.231 1.00 0.00 C ATOM 1112 O LEU B 770 -1.818 -6.885 4.276 1.00 0.00 O ATOM 1113 CB LEU B 770 -1.915 -3.695 5.244 1.00 0.00 C ATOM 1114 CG LEU B 770 -1.243 -2.342 4.973 1.00 0.00 C ATOM 1115 CD1 LEU B 770 -1.111 -1.568 6.286 1.00 0.00 C ATOM 1116 CD2 LEU B 770 0.149 -2.562 4.370 1.00 0.00 C ATOM 0 H LEU B 770 -3.074 -2.794 3.328 1.00 0.00 H new ATOM 0 HA LEU B 770 -0.975 -4.657 3.525 1.00 0.00 H new ATOM 0 HB2 LEU B 770 -2.924 -3.540 5.627 1.00 0.00 H new ATOM 0 HB3 LEU B 770 -1.363 -4.239 6.010 1.00 0.00 H new ATOM 0 HG LEU B 770 -1.852 -1.773 4.271 1.00 0.00 H new ATOM 0 HD11 LEU B 770 -0.634 -0.607 6.095 1.00 0.00 H new ATOM 0 HD12 LEU B 770 -2.101 -1.404 6.713 1.00 0.00 H new ATOM 0 HD13 LEU B 770 -0.504 -2.141 6.987 1.00 0.00 H new ATOM 0 HD21 LEU B 770 0.620 -1.597 4.180 1.00 0.00 H new ATOM 0 HD22 LEU B 770 0.761 -3.134 5.067 1.00 0.00 H new ATOM 0 HD23 LEU B 770 0.057 -3.111 3.433 1.00 0.00 H new ATOM 1128 N LYS B 771 -3.838 -6.000 4.352 1.00 0.00 N ATOM 1129 CA LYS B 771 -4.505 -7.324 4.538 1.00 0.00 C ATOM 1130 C LYS B 771 -3.899 -8.370 3.597 1.00 0.00 C ATOM 1131 O LYS B 771 -3.520 -9.446 4.012 1.00 0.00 O ATOM 1132 CB LYS B 771 -5.959 -7.047 4.179 1.00 0.00 C ATOM 1133 CG LYS B 771 -6.774 -8.319 4.335 1.00 0.00 C ATOM 1134 CD LYS B 771 -6.754 -9.078 3.021 1.00 0.00 C ATOM 1135 CE LYS B 771 -6.303 -10.512 3.263 1.00 0.00 C ATOM 1136 NZ LYS B 771 -7.304 -11.080 4.209 1.00 0.00 N ATOM 0 H LYS B 771 -4.474 -5.203 4.329 1.00 0.00 H new ATOM 0 HA LYS B 771 -4.388 -7.722 5.546 1.00 0.00 H new ATOM 0 HB2 LYS B 771 -6.360 -6.265 4.823 1.00 0.00 H new ATOM 0 HB3 LYS B 771 -6.028 -6.682 3.154 1.00 0.00 H new ATOM 0 HG2 LYS B 771 -6.361 -8.936 5.133 1.00 0.00 H new ATOM 0 HG3 LYS B 771 -7.799 -8.078 4.616 1.00 0.00 H new ATOM 0 HD2 LYS B 771 -7.746 -9.070 2.570 1.00 0.00 H new ATOM 0 HD3 LYS B 771 -6.080 -8.589 2.318 1.00 0.00 H new ATOM 0 HE2 LYS B 771 -6.275 -11.079 2.332 1.00 0.00 H new ATOM 0 HE3 LYS B 771 -5.299 -10.543 3.686 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 -7.274 -12.119 4.164 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 -7.083 -10.769 5.176 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 -8.255 -10.750 3.948 1.00 0.00 H new ATOM 1150 N THR B 772 -3.724 -8.025 2.354 1.00 0.00 N ATOM 1151 CA THR B 772 -3.126 -8.991 1.391 1.00 0.00 C ATOM 1152 C THR B 772 -1.682 -8.603 1.057 1.00 0.00 C ATOM 1153 O THR B 772 -0.830 -9.448 0.872 1.00 0.00 O ATOM 1154 CB THR B 772 -4.004 -8.889 0.141 1.00 0.00 C ATOM 1155 OG1 THR B 772 -5.318 -9.331 0.445 1.00 0.00 O ATOM 1156 CG2 THR B 772 -3.421 -9.768 -0.962 1.00 0.00 C ATOM 0 H THR B 772 -3.969 -7.116 1.962 1.00 0.00 H new ATOM 0 HA THR B 772 -3.092 -10.002 1.796 1.00 0.00 H new ATOM 0 HB THR B 772 -4.036 -7.852 -0.194 1.00 0.00 H new ATOM 0 HG1 THR B 772 -5.879 -9.264 -0.356 1.00 0.00 H new ATOM 0 HG21 THR B 772 -4.045 -9.696 -1.853 1.00 0.00 H new ATOM 0 HG22 THR B 772 -2.411 -9.433 -1.199 1.00 0.00 H new ATOM 0 HG23 THR B 772 -3.390 -10.804 -0.623 1.00 0.00 H new ATOM 1164 N MET B 773 -1.407 -7.332 0.953 1.00 0.00 N ATOM 1165 CA MET B 773 -0.026 -6.897 0.602 1.00 0.00 C ATOM 1166 C MET B 773 0.999 -7.514 1.555 1.00 0.00 C ATOM 1167 O MET B 773 2.121 -7.789 1.178 1.00 0.00 O ATOM 1168 CB MET B 773 -0.044 -5.376 0.753 1.00 0.00 C ATOM 1169 CG MET B 773 0.511 -4.733 -0.519 1.00 0.00 C ATOM 1170 SD MET B 773 1.142 -3.084 -0.130 1.00 0.00 S ATOM 1171 CE MET B 773 2.837 -3.578 0.269 1.00 0.00 C ATOM 0 H MET B 773 -2.078 -6.577 1.096 1.00 0.00 H new ATOM 0 HA MET B 773 0.256 -7.212 -0.403 1.00 0.00 H new ATOM 0 HB2 MET B 773 -1.061 -5.030 0.935 1.00 0.00 H new ATOM 0 HB3 MET B 773 0.553 -5.078 1.615 1.00 0.00 H new ATOM 0 HG2 MET B 773 1.307 -5.351 -0.935 1.00 0.00 H new ATOM 0 HG3 MET B 773 -0.270 -4.667 -1.277 1.00 0.00 H new ATOM 0 HE1 MET B 773 2.996 -3.497 1.344 1.00 0.00 H new ATOM 0 HE2 MET B 773 2.999 -4.609 -0.045 1.00 0.00 H new ATOM 0 HE3 MET B 773 3.538 -2.926 -0.251 1.00 0.00 H new ATOM 1181 N SER B 774 0.631 -7.728 2.788 1.00 0.00 N ATOM 1182 CA SER B 774 1.597 -8.323 3.755 1.00 0.00 C ATOM 1183 C SER B 774 1.800 -9.808 3.457 1.00 0.00 C ATOM 1184 O SER B 774 2.900 -10.319 3.521 1.00 0.00 O ATOM 1185 CB SER B 774 0.948 -8.138 5.126 1.00 0.00 C ATOM 1186 OG SER B 774 -0.004 -9.170 5.343 1.00 0.00 O ATOM 0 H SER B 774 -0.292 -7.518 3.167 1.00 0.00 H new ATOM 0 HA SER B 774 2.578 -7.852 3.699 1.00 0.00 H new ATOM 0 HB2 SER B 774 1.709 -8.161 5.906 1.00 0.00 H new ATOM 0 HB3 SER B 774 0.463 -7.164 5.182 1.00 0.00 H new ATOM 0 HG SER B 774 -0.897 -8.848 5.099 1.00 0.00 H new ATOM 1192 N GLU B 775 0.748 -10.507 3.128 1.00 0.00 N ATOM 1193 CA GLU B 775 0.883 -11.959 2.823 1.00 0.00 C ATOM 1194 C GLU B 775 1.973 -12.179 1.771 1.00 0.00 C ATOM 1195 O GLU B 775 2.670 -13.175 1.786 1.00 0.00 O ATOM 1196 CB GLU B 775 -0.484 -12.372 2.277 1.00 0.00 C ATOM 1197 CG GLU B 775 -1.501 -12.388 3.419 1.00 0.00 C ATOM 1198 CD GLU B 775 -1.154 -13.515 4.394 1.00 0.00 C ATOM 1199 OE1 GLU B 775 -0.942 -14.625 3.934 1.00 0.00 O ATOM 1200 OE2 GLU B 775 -1.104 -13.248 5.584 1.00 0.00 O ATOM 0 H GLU B 775 -0.199 -10.135 3.057 1.00 0.00 H new ATOM 0 HA GLU B 775 1.167 -12.543 3.698 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.803 -11.677 1.500 1.00 0.00 H new ATOM 0 HB3 GLU B 775 -0.422 -13.358 1.816 1.00 0.00 H new ATOM 0 HG2 GLU B 775 -1.497 -11.429 3.938 1.00 0.00 H new ATOM 0 HG3 GLU B 775 -2.506 -12.532 3.023 1.00 0.00 H new ATOM 1207 N ARG B 776 2.136 -11.251 0.868 1.00 0.00 N ATOM 1208 CA ARG B 776 3.200 -11.399 -0.165 1.00 0.00 C ATOM 1209 C ARG B 776 4.569 -11.475 0.511 1.00 0.00 C ATOM 1210 O ARG B 776 5.299 -12.434 0.355 1.00 0.00 O ATOM 1211 CB ARG B 776 3.097 -10.135 -1.021 1.00 0.00 C ATOM 1212 CG ARG B 776 2.183 -10.400 -2.218 1.00 0.00 C ATOM 1213 CD ARG B 776 2.409 -9.322 -3.279 1.00 0.00 C ATOM 1214 NE ARG B 776 1.048 -9.022 -3.814 1.00 0.00 N ATOM 1215 CZ ARG B 776 0.457 -9.843 -4.652 1.00 0.00 C ATOM 1216 NH1 ARG B 776 1.044 -10.947 -5.044 1.00 0.00 N ATOM 1217 NH2 ARG B 776 -0.734 -9.554 -5.101 1.00 0.00 N ATOM 0 H ARG B 776 1.580 -10.399 0.801 1.00 0.00 H new ATOM 0 HA ARG B 776 3.082 -12.304 -0.760 1.00 0.00 H new ATOM 0 HB2 ARG B 776 2.704 -9.311 -0.425 1.00 0.00 H new ATOM 0 HB3 ARG B 776 4.087 -9.835 -1.365 1.00 0.00 H new ATOM 0 HG2 ARG B 776 2.389 -11.386 -2.636 1.00 0.00 H new ATOM 0 HG3 ARG B 776 1.140 -10.400 -1.900 1.00 0.00 H new ATOM 0 HD2 ARG B 776 2.869 -8.433 -2.848 1.00 0.00 H new ATOM 0 HD3 ARG B 776 3.075 -9.675 -4.067 1.00 0.00 H new ATOM 0 HE ARG B 776 0.571 -8.168 -3.525 1.00 0.00 H new ATOM 0 HH11 ARG B 776 1.975 -11.180 -4.698 1.00 0.00 H new ATOM 0 HH12 ARG B 776 0.570 -11.573 -5.695 1.00 0.00 H new ATOM 0 HH21 ARG B 776 -1.198 -8.697 -4.801 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -1.201 -10.185 -5.752 1.00 0.00 H new ATOM 1231 N LEU B 777 4.917 -10.476 1.275 1.00 0.00 N ATOM 1232 CA LEU B 777 6.227 -10.498 1.982 1.00 0.00 C ATOM 1233 C LEU B 777 6.347 -11.776 2.813 1.00 0.00 C ATOM 1234 O LEU B 777 7.429 -12.266 3.069 1.00 0.00 O ATOM 1235 CB LEU B 777 6.194 -9.268 2.893 1.00 0.00 C ATOM 1236 CG LEU B 777 7.561 -8.577 2.884 1.00 0.00 C ATOM 1237 CD1 LEU B 777 8.623 -9.535 3.429 1.00 0.00 C ATOM 1238 CD2 LEU B 777 7.924 -8.173 1.453 1.00 0.00 C ATOM 0 H LEU B 777 4.349 -9.645 1.440 1.00 0.00 H new ATOM 0 HA LEU B 777 7.075 -10.480 1.298 1.00 0.00 H new ATOM 0 HB2 LEU B 777 5.424 -8.575 2.555 1.00 0.00 H new ATOM 0 HB3 LEU B 777 5.933 -9.564 3.909 1.00 0.00 H new ATOM 0 HG LEU B 777 7.519 -7.687 3.511 1.00 0.00 H new ATOM 0 HD11 LEU B 777 9.595 -9.042 3.422 1.00 0.00 H new ATOM 0 HD12 LEU B 777 8.367 -9.819 4.450 1.00 0.00 H new ATOM 0 HD13 LEU B 777 8.664 -10.427 2.804 1.00 0.00 H new ATOM 0 HD21 LEU B 777 8.897 -7.682 1.449 1.00 0.00 H new ATOM 0 HD22 LEU B 777 7.964 -9.062 0.823 1.00 0.00 H new ATOM 0 HD23 LEU B 777 7.170 -7.488 1.066 1.00 0.00 H new ATOM 1250 N LYS B 778 5.237 -12.323 3.231 1.00 0.00 N ATOM 1251 CA LYS B 778 5.275 -13.578 4.032 1.00 0.00 C ATOM 1252 C LYS B 778 5.650 -14.762 3.139 1.00 0.00 C ATOM 1253 O LYS B 778 6.167 -15.761 3.597 1.00 0.00 O ATOM 1254 CB LYS B 778 3.846 -13.748 4.554 1.00 0.00 C ATOM 1255 CG LYS B 778 3.783 -13.340 6.027 1.00 0.00 C ATOM 1256 CD LYS B 778 2.906 -14.327 6.787 1.00 0.00 C ATOM 1257 CE LYS B 778 1.459 -13.831 6.787 1.00 0.00 C ATOM 1258 NZ LYS B 778 0.634 -15.066 6.666 1.00 0.00 N ATOM 0 H LYS B 778 4.304 -11.953 3.051 1.00 0.00 H new ATOM 0 HA LYS B 778 6.010 -13.534 4.836 1.00 0.00 H new ATOM 0 HB2 LYS B 778 3.159 -13.137 3.968 1.00 0.00 H new ATOM 0 HB3 LYS B 778 3.528 -14.784 4.440 1.00 0.00 H new ATOM 0 HG2 LYS B 778 4.786 -13.323 6.454 1.00 0.00 H new ATOM 0 HG3 LYS B 778 3.380 -12.332 6.120 1.00 0.00 H new ATOM 0 HD2 LYS B 778 2.964 -15.312 6.324 1.00 0.00 H new ATOM 0 HD3 LYS B 778 3.264 -14.435 7.811 1.00 0.00 H new ATOM 0 HE2 LYS B 778 1.227 -13.288 7.703 1.00 0.00 H new ATOM 0 HE3 LYS B 778 1.274 -13.149 5.957 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 -0.335 -14.810 6.389 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 1.047 -15.690 5.944 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 0.613 -15.561 7.581 1.00 0.00 H new ATOM 1272 N ASN B 779 5.382 -14.658 1.866 1.00 0.00 N ATOM 1273 CA ASN B 779 5.707 -15.777 0.938 1.00 0.00 C ATOM 1274 C ASN B 779 6.972 -15.467 0.133 1.00 0.00 C ATOM 1275 O ASN B 779 7.270 -16.126 -0.843 1.00 0.00 O ATOM 1276 CB ASN B 779 4.501 -15.863 0.000 1.00 0.00 C ATOM 1277 CG ASN B 779 3.223 -16.052 0.822 1.00 0.00 C ATOM 1278 OD1 ASN B 779 3.214 -16.779 1.795 1.00 0.00 O ATOM 1279 ND2 ASN B 779 2.134 -15.425 0.467 1.00 0.00 N ATOM 0 H ASN B 779 4.951 -13.844 1.428 1.00 0.00 H new ATOM 0 HA ASN B 779 5.894 -16.708 1.473 1.00 0.00 H new ATOM 0 HB2 ASN B 779 4.429 -14.956 -0.600 1.00 0.00 H new ATOM 0 HB3 ASN B 779 4.626 -16.695 -0.694 1.00 0.00 H new ATOM 0 HD21 ASN B 779 1.277 -15.546 1.007 1.00 0.00 H new ATOM 0 HD22 ASN B 779 2.140 -14.814 -0.350 1.00 0.00 H new ATOM 1286 N ARG B 780 7.709 -14.458 0.515 1.00 0.00 N ATOM 1287 CA ARG B 780 8.939 -14.104 -0.250 1.00 0.00 C ATOM 1288 C ARG B 780 8.615 -13.963 -1.738 1.00 0.00 C ATOM 1289 O ARG B 780 8.856 -14.859 -2.524 1.00 0.00 O ATOM 1290 CB ARG B 780 9.900 -15.271 -0.025 1.00 0.00 C ATOM 1291 CG ARG B 780 11.282 -14.899 -0.566 1.00 0.00 C ATOM 1292 CD ARG B 780 11.683 -15.886 -1.664 1.00 0.00 C ATOM 1293 NE ARG B 780 13.162 -15.730 -1.796 1.00 0.00 N ATOM 1294 CZ ARG B 780 13.678 -14.686 -2.402 1.00 0.00 C ATOM 1295 NH1 ARG B 780 12.912 -13.750 -2.907 1.00 0.00 N ATOM 1296 NH2 ARG B 780 14.975 -14.578 -2.503 1.00 0.00 N ATOM 0 H ARG B 780 7.513 -13.865 1.322 1.00 0.00 H new ATOM 0 HA ARG B 780 9.365 -13.155 0.076 1.00 0.00 H new ATOM 0 HB2 ARG B 780 9.964 -15.505 1.038 1.00 0.00 H new ATOM 0 HB3 ARG B 780 9.529 -16.165 -0.527 1.00 0.00 H new ATOM 0 HG2 ARG B 780 11.268 -13.884 -0.962 1.00 0.00 H new ATOM 0 HG3 ARG B 780 12.016 -14.917 0.239 1.00 0.00 H new ATOM 0 HD2 ARG B 780 11.416 -16.908 -1.394 1.00 0.00 H new ATOM 0 HD3 ARG B 780 11.176 -15.661 -2.602 1.00 0.00 H new ATOM 0 HE ARG B 780 13.780 -16.444 -1.410 1.00 0.00 H new ATOM 0 HH11 ARG B 780 11.898 -13.826 -2.832 1.00 0.00 H new ATOM 0 HH12 ARG B 780 13.330 -12.946 -3.374 1.00 0.00 H new ATOM 0 HH21 ARG B 780 15.579 -15.301 -2.113 1.00 0.00 H new ATOM 0 HH22 ARG B 780 15.384 -13.770 -2.972 1.00 0.00 H new ATOM 1310 N TYR B 781 8.051 -12.855 -2.127 1.00 0.00 N ATOM 1311 CA TYR B 781 7.706 -12.656 -3.561 1.00 0.00 C ATOM 1312 C TYR B 781 8.039 -11.227 -3.985 1.00 0.00 C ATOM 1313 O TYR B 781 8.655 -10.998 -5.007 1.00 0.00 O ATOM 1314 CB TYR B 781 6.198 -12.899 -3.641 1.00 0.00 C ATOM 1315 CG TYR B 781 5.849 -13.456 -5.001 1.00 0.00 C ATOM 1316 CD1 TYR B 781 6.469 -14.625 -5.459 1.00 0.00 C ATOM 1317 CD2 TYR B 781 4.906 -12.803 -5.803 1.00 0.00 C ATOM 1318 CE1 TYR B 781 6.145 -15.141 -6.720 1.00 0.00 C ATOM 1319 CE2 TYR B 781 4.583 -13.319 -7.064 1.00 0.00 C ATOM 1320 CZ TYR B 781 5.202 -14.487 -7.522 1.00 0.00 C ATOM 1321 OH TYR B 781 4.882 -14.995 -8.765 1.00 0.00 O ATOM 0 H TYR B 781 7.813 -12.077 -1.512 1.00 0.00 H new ATOM 0 HA TYR B 781 8.263 -13.324 -4.219 1.00 0.00 H new ATOM 0 HB2 TYR B 781 5.889 -13.595 -2.861 1.00 0.00 H new ATOM 0 HB3 TYR B 781 5.659 -11.967 -3.469 1.00 0.00 H new ATOM 0 HD1 TYR B 781 7.197 -15.129 -4.840 1.00 0.00 H new ATOM 0 HD2 TYR B 781 4.428 -11.902 -5.449 1.00 0.00 H new ATOM 0 HE1 TYR B 781 6.622 -16.043 -7.074 1.00 0.00 H new ATOM 0 HE2 TYR B 781 3.856 -12.815 -7.683 1.00 0.00 H new ATOM 0 HH TYR B 781 4.210 -14.421 -9.190 1.00 0.00 H new ATOM 1331 N TYR B 782 7.642 -10.262 -3.202 1.00 0.00 N ATOM 1332 CA TYR B 782 7.954 -8.848 -3.552 1.00 0.00 C ATOM 1333 C TYR B 782 9.193 -8.385 -2.785 1.00 0.00 C ATOM 1334 O TYR B 782 9.096 -7.762 -1.746 1.00 0.00 O ATOM 1335 CB TYR B 782 6.721 -8.053 -3.119 1.00 0.00 C ATOM 1336 CG TYR B 782 5.739 -7.995 -4.264 1.00 0.00 C ATOM 1337 CD1 TYR B 782 5.354 -9.174 -4.916 1.00 0.00 C ATOM 1338 CD2 TYR B 782 5.220 -6.764 -4.681 1.00 0.00 C ATOM 1339 CE1 TYR B 782 4.446 -9.121 -5.981 1.00 0.00 C ATOM 1340 CE2 TYR B 782 4.312 -6.711 -5.746 1.00 0.00 C ATOM 1341 CZ TYR B 782 3.925 -7.889 -6.396 1.00 0.00 C ATOM 1342 OH TYR B 782 3.030 -7.836 -7.445 1.00 0.00 O ATOM 0 H TYR B 782 7.117 -10.391 -2.337 1.00 0.00 H new ATOM 0 HA TYR B 782 8.167 -8.716 -4.613 1.00 0.00 H new ATOM 0 HB2 TYR B 782 6.258 -8.522 -2.251 1.00 0.00 H new ATOM 0 HB3 TYR B 782 7.010 -7.045 -2.821 1.00 0.00 H new ATOM 0 HD1 TYR B 782 5.757 -10.124 -4.597 1.00 0.00 H new ATOM 0 HD2 TYR B 782 5.520 -5.855 -4.181 1.00 0.00 H new ATOM 0 HE1 TYR B 782 4.148 -10.030 -6.482 1.00 0.00 H new ATOM 0 HE2 TYR B 782 3.910 -5.761 -6.066 1.00 0.00 H new ATOM 0 HH TYR B 782 2.766 -6.906 -7.603 1.00 0.00 H new ATOM 1352 N VAL B 783 10.358 -8.702 -3.280 1.00 0.00 N ATOM 1353 CA VAL B 783 11.604 -8.311 -2.564 1.00 0.00 C ATOM 1354 C VAL B 783 12.426 -7.320 -3.396 1.00 0.00 C ATOM 1355 O VAL B 783 13.581 -7.554 -3.690 1.00 0.00 O ATOM 1356 CB VAL B 783 12.367 -9.627 -2.378 1.00 0.00 C ATOM 1357 CG1 VAL B 783 12.778 -10.186 -3.744 1.00 0.00 C ATOM 1358 CG2 VAL B 783 13.616 -9.377 -1.532 1.00 0.00 C ATOM 0 H VAL B 783 10.500 -9.215 -4.150 1.00 0.00 H new ATOM 0 HA VAL B 783 11.397 -7.813 -1.617 1.00 0.00 H new ATOM 0 HB VAL B 783 11.723 -10.348 -1.874 1.00 0.00 H new ATOM 0 HG11 VAL B 783 13.320 -11.122 -3.606 1.00 0.00 H new ATOM 0 HG12 VAL B 783 11.887 -10.368 -4.346 1.00 0.00 H new ATOM 0 HG13 VAL B 783 13.419 -9.467 -4.253 1.00 0.00 H new ATOM 0 HG21 VAL B 783 14.159 -10.313 -1.399 1.00 0.00 H new ATOM 0 HG22 VAL B 783 14.257 -8.653 -2.035 1.00 0.00 H new ATOM 0 HG23 VAL B 783 13.323 -8.986 -0.557 1.00 0.00 H new ATOM 1368 N SER B 784 11.845 -6.212 -3.771 1.00 0.00 N ATOM 1369 CA SER B 784 12.602 -5.208 -4.574 1.00 0.00 C ATOM 1370 C SER B 784 11.980 -3.818 -4.412 1.00 0.00 C ATOM 1371 O SER B 784 11.426 -3.495 -3.380 1.00 0.00 O ATOM 1372 CB SER B 784 12.477 -5.682 -6.023 1.00 0.00 C ATOM 1373 OG SER B 784 12.442 -7.101 -6.060 1.00 0.00 O ATOM 0 H SER B 784 10.880 -5.959 -3.557 1.00 0.00 H new ATOM 0 HA SER B 784 13.642 -5.129 -4.257 1.00 0.00 H new ATOM 0 HB2 SER B 784 11.572 -5.274 -6.473 1.00 0.00 H new ATOM 0 HB3 SER B 784 13.318 -5.314 -6.610 1.00 0.00 H new ATOM 0 HG SER B 784 12.522 -7.406 -6.988 1.00 0.00 H new ATOM 1379 N LYS B 785 12.068 -2.991 -5.420 1.00 0.00 N ATOM 1380 CA LYS B 785 11.483 -1.624 -5.310 1.00 0.00 C ATOM 1381 C LYS B 785 10.186 -1.542 -6.117 1.00 0.00 C ATOM 1382 O LYS B 785 9.111 -1.390 -5.571 1.00 0.00 O ATOM 1383 CB LYS B 785 12.532 -0.677 -5.908 1.00 0.00 C ATOM 1384 CG LYS B 785 13.898 -0.911 -5.249 1.00 0.00 C ATOM 1385 CD LYS B 785 15.007 -0.760 -6.296 1.00 0.00 C ATOM 1386 CE LYS B 785 14.786 -1.756 -7.438 1.00 0.00 C ATOM 1387 NZ LYS B 785 14.686 -0.915 -8.663 1.00 0.00 N ATOM 0 H LYS B 785 12.518 -3.202 -6.311 1.00 0.00 H new ATOM 0 HA LYS B 785 11.245 -1.368 -4.278 1.00 0.00 H new ATOM 0 HB2 LYS B 785 12.607 -0.839 -6.983 1.00 0.00 H new ATOM 0 HB3 LYS B 785 12.223 0.358 -5.762 1.00 0.00 H new ATOM 0 HG2 LYS B 785 14.049 -0.197 -4.439 1.00 0.00 H new ATOM 0 HG3 LYS B 785 13.934 -1.907 -4.807 1.00 0.00 H new ATOM 0 HD2 LYS B 785 15.014 0.258 -6.686 1.00 0.00 H new ATOM 0 HD3 LYS B 785 15.980 -0.932 -5.835 1.00 0.00 H new ATOM 0 HE2 LYS B 785 15.612 -2.464 -7.511 1.00 0.00 H new ATOM 0 HE3 LYS B 785 13.878 -2.340 -7.284 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 14.400 -1.507 -9.468 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 13.978 -0.168 -8.514 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 15.610 -0.482 -8.863 1.00 0.00 H new ATOM 1401 N LYS B 786 10.278 -1.648 -7.415 1.00 0.00 N ATOM 1402 CA LYS B 786 9.055 -1.575 -8.260 1.00 0.00 C ATOM 1403 C LYS B 786 7.997 -2.559 -7.757 1.00 0.00 C ATOM 1404 O LYS B 786 6.821 -2.398 -8.007 1.00 0.00 O ATOM 1405 CB LYS B 786 9.524 -1.970 -9.661 1.00 0.00 C ATOM 1406 CG LYS B 786 8.364 -1.820 -10.647 1.00 0.00 C ATOM 1407 CD LYS B 786 8.402 -0.423 -11.269 1.00 0.00 C ATOM 1408 CE LYS B 786 8.384 -0.544 -12.794 1.00 0.00 C ATOM 1409 NZ LYS B 786 8.381 0.861 -13.288 1.00 0.00 N ATOM 0 H LYS B 786 11.150 -1.782 -7.926 1.00 0.00 H new ATOM 0 HA LYS B 786 8.600 -0.585 -8.240 1.00 0.00 H new ATOM 0 HB2 LYS B 786 10.360 -1.341 -9.967 1.00 0.00 H new ATOM 0 HB3 LYS B 786 9.883 -2.999 -9.659 1.00 0.00 H new ATOM 0 HG2 LYS B 786 8.434 -2.579 -11.426 1.00 0.00 H new ATOM 0 HG3 LYS B 786 7.415 -1.976 -10.135 1.00 0.00 H new ATOM 0 HD2 LYS B 786 7.547 0.161 -10.930 1.00 0.00 H new ATOM 0 HD3 LYS B 786 9.298 0.107 -10.946 1.00 0.00 H new ATOM 0 HE2 LYS B 786 9.255 -1.089 -13.158 1.00 0.00 H new ATOM 0 HE3 LYS B 786 7.503 -1.086 -13.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 8.369 0.863 -14.328 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 7.537 1.353 -12.931 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 9.235 1.349 -12.951 1.00 0.00 H new ATOM 1423 N LEU B 787 8.406 -3.588 -7.068 1.00 0.00 N ATOM 1424 CA LEU B 787 7.417 -4.577 -6.552 1.00 0.00 C ATOM 1425 C LEU B 787 6.764 -4.067 -5.266 1.00 0.00 C ATOM 1426 O LEU B 787 5.594 -3.738 -5.239 1.00 0.00 O ATOM 1427 CB LEU B 787 8.237 -5.836 -6.264 1.00 0.00 C ATOM 1428 CG LEU B 787 8.397 -6.641 -7.553 1.00 0.00 C ATOM 1429 CD1 LEU B 787 9.763 -7.326 -7.557 1.00 0.00 C ATOM 1430 CD2 LEU B 787 7.293 -7.697 -7.635 1.00 0.00 C ATOM 0 H LEU B 787 9.380 -3.787 -6.840 1.00 0.00 H new ATOM 0 HA LEU B 787 6.612 -4.758 -7.264 1.00 0.00 H new ATOM 0 HB2 LEU B 787 9.215 -5.564 -5.868 1.00 0.00 H new ATOM 0 HB3 LEU B 787 7.742 -6.440 -5.504 1.00 0.00 H new ATOM 0 HG LEU B 787 8.323 -5.974 -8.412 1.00 0.00 H new ATOM 0 HD11 LEU B 787 9.879 -7.901 -8.476 1.00 0.00 H new ATOM 0 HD12 LEU B 787 10.548 -6.572 -7.499 1.00 0.00 H new ATOM 0 HD13 LEU B 787 9.837 -7.994 -6.699 1.00 0.00 H new ATOM 0 HD21 LEU B 787 7.407 -8.272 -8.554 1.00 0.00 H new ATOM 0 HD22 LEU B 787 7.365 -8.366 -6.778 1.00 0.00 H new ATOM 0 HD23 LEU B 787 6.320 -7.207 -7.632 1.00 0.00 H new ATOM 1442 N PHE B 788 7.509 -4.018 -4.197 1.00 0.00 N ATOM 1443 CA PHE B 788 6.935 -3.554 -2.902 1.00 0.00 C ATOM 1444 C PHE B 788 6.443 -2.110 -3.009 1.00 0.00 C ATOM 1445 O PHE B 788 5.323 -1.797 -2.657 1.00 0.00 O ATOM 1446 CB PHE B 788 8.099 -3.643 -1.913 1.00 0.00 C ATOM 1447 CG PHE B 788 7.650 -3.151 -0.558 1.00 0.00 C ATOM 1448 CD1 PHE B 788 6.974 -4.014 0.311 1.00 0.00 C ATOM 1449 CD2 PHE B 788 7.912 -1.831 -0.172 1.00 0.00 C ATOM 1450 CE1 PHE B 788 6.558 -3.557 1.567 1.00 0.00 C ATOM 1451 CE2 PHE B 788 7.496 -1.374 1.085 1.00 0.00 C ATOM 1452 CZ PHE B 788 6.819 -2.238 1.954 1.00 0.00 C ATOM 0 H PHE B 788 8.494 -4.280 -4.164 1.00 0.00 H new ATOM 0 HA PHE B 788 6.077 -4.153 -2.597 1.00 0.00 H new ATOM 0 HB2 PHE B 788 8.449 -4.673 -1.840 1.00 0.00 H new ATOM 0 HB3 PHE B 788 8.938 -3.045 -2.269 1.00 0.00 H new ATOM 0 HD1 PHE B 788 6.773 -5.032 0.013 1.00 0.00 H new ATOM 0 HD2 PHE B 788 8.435 -1.165 -0.843 1.00 0.00 H new ATOM 0 HE1 PHE B 788 6.035 -4.223 2.238 1.00 0.00 H new ATOM 0 HE2 PHE B 788 7.697 -0.356 1.384 1.00 0.00 H new ATOM 0 HZ PHE B 788 6.498 -1.886 2.923 1.00 0.00 H new ATOM 1462 N MET B 789 7.278 -1.223 -3.471 1.00 0.00 N ATOM 1463 CA MET B 789 6.865 0.206 -3.577 1.00 0.00 C ATOM 1464 C MET B 789 5.585 0.337 -4.404 1.00 0.00 C ATOM 1465 O MET B 789 4.746 1.165 -4.128 1.00 0.00 O ATOM 1466 CB MET B 789 8.023 0.906 -4.292 1.00 0.00 C ATOM 1467 CG MET B 789 9.335 0.625 -3.552 1.00 0.00 C ATOM 1468 SD MET B 789 10.134 2.188 -3.119 1.00 0.00 S ATOM 1469 CE MET B 789 8.832 2.812 -2.029 1.00 0.00 C ATOM 0 H MET B 789 8.229 -1.424 -3.780 1.00 0.00 H new ATOM 0 HA MET B 789 6.659 0.640 -2.598 1.00 0.00 H new ATOM 0 HB2 MET B 789 8.093 0.554 -5.321 1.00 0.00 H new ATOM 0 HB3 MET B 789 7.841 1.980 -4.334 1.00 0.00 H new ATOM 0 HG2 MET B 789 9.139 0.043 -2.651 1.00 0.00 H new ATOM 0 HG3 MET B 789 9.997 0.028 -4.179 1.00 0.00 H new ATOM 0 HE1 MET B 789 8.403 3.719 -2.456 1.00 0.00 H new ATOM 0 HE2 MET B 789 8.053 2.057 -1.924 1.00 0.00 H new ATOM 0 HE3 MET B 789 9.254 3.037 -1.050 1.00 0.00 H new ATOM 1479 N ALA B 790 5.437 -0.462 -5.426 1.00 0.00 N ATOM 1480 CA ALA B 790 4.225 -0.359 -6.290 1.00 0.00 C ATOM 1481 C ALA B 790 2.960 -0.687 -5.500 1.00 0.00 C ATOM 1482 O ALA B 790 2.125 0.163 -5.263 1.00 0.00 O ATOM 1483 CB ALA B 790 4.438 -1.399 -7.390 1.00 0.00 C ATOM 0 H ALA B 790 6.104 -1.183 -5.701 1.00 0.00 H new ATOM 0 HA ALA B 790 4.096 0.649 -6.684 1.00 0.00 H new ATOM 0 HB1 ALA B 790 3.587 -1.388 -8.071 1.00 0.00 H new ATOM 0 HB2 ALA B 790 5.348 -1.164 -7.942 1.00 0.00 H new ATOM 0 HB3 ALA B 790 4.531 -2.388 -6.942 1.00 0.00 H new ATOM 1489 N ASP B 791 2.800 -1.921 -5.112 1.00 0.00 N ATOM 1490 CA ASP B 791 1.580 -2.318 -4.354 1.00 0.00 C ATOM 1491 C ASP B 791 1.337 -1.363 -3.184 1.00 0.00 C ATOM 1492 O ASP B 791 0.228 -0.921 -2.948 1.00 0.00 O ATOM 1493 CB ASP B 791 1.887 -3.724 -3.837 1.00 0.00 C ATOM 1494 CG ASP B 791 1.993 -4.689 -5.019 1.00 0.00 C ATOM 1495 OD1 ASP B 791 2.270 -4.226 -6.113 1.00 0.00 O ATOM 1496 OD2 ASP B 791 1.795 -5.874 -4.809 1.00 0.00 O ATOM 0 H ASP B 791 3.464 -2.675 -5.288 1.00 0.00 H new ATOM 0 HA ASP B 791 0.683 -2.288 -4.973 1.00 0.00 H new ATOM 0 HB2 ASP B 791 2.819 -3.720 -3.272 1.00 0.00 H new ATOM 0 HB3 ASP B 791 1.102 -4.052 -3.155 1.00 0.00 H new ATOM 1501 N LEU B 792 2.365 -1.034 -2.453 1.00 0.00 N ATOM 1502 CA LEU B 792 2.175 -0.112 -1.302 1.00 0.00 C ATOM 1503 C LEU B 792 1.637 1.231 -1.798 1.00 0.00 C ATOM 1504 O LEU B 792 0.637 1.723 -1.309 1.00 0.00 O ATOM 1505 CB LEU B 792 3.566 0.039 -0.674 1.00 0.00 C ATOM 1506 CG LEU B 792 3.444 0.548 0.770 1.00 0.00 C ATOM 1507 CD1 LEU B 792 2.494 -0.345 1.574 1.00 0.00 C ATOM 1508 CD2 LEU B 792 4.822 0.524 1.431 1.00 0.00 C ATOM 0 H LEU B 792 3.320 -1.361 -2.601 1.00 0.00 H new ATOM 0 HA LEU B 792 1.455 -0.488 -0.575 1.00 0.00 H new ATOM 0 HB2 LEU B 792 4.085 -0.920 -0.687 1.00 0.00 H new ATOM 0 HB3 LEU B 792 4.165 0.734 -1.263 1.00 0.00 H new ATOM 0 HG LEU B 792 3.050 1.564 0.751 1.00 0.00 H new ATOM 0 HD11 LEU B 792 2.419 0.030 2.595 1.00 0.00 H new ATOM 0 HD12 LEU B 792 1.507 -0.336 1.111 1.00 0.00 H new ATOM 0 HD13 LEU B 792 2.879 -1.365 1.589 1.00 0.00 H new ATOM 0 HD21 LEU B 792 4.740 0.885 2.456 1.00 0.00 H new ATOM 0 HD22 LEU B 792 5.206 -0.496 1.435 1.00 0.00 H new ATOM 0 HD23 LEU B 792 5.504 1.166 0.874 1.00 0.00 H new ATOM 1520 N GLN B 793 2.255 1.813 -2.793 1.00 0.00 N ATOM 1521 CA GLN B 793 1.703 3.084 -3.339 1.00 0.00 C ATOM 1522 C GLN B 793 0.299 2.815 -3.870 1.00 0.00 C ATOM 1523 O GLN B 793 -0.622 3.566 -3.634 1.00 0.00 O ATOM 1524 CB GLN B 793 2.634 3.495 -4.479 1.00 0.00 C ATOM 1525 CG GLN B 793 3.299 4.830 -4.135 1.00 0.00 C ATOM 1526 CD GLN B 793 2.223 5.900 -3.942 1.00 0.00 C ATOM 1527 OE1 GLN B 793 1.658 6.024 -2.873 1.00 0.00 O ATOM 1528 NE2 GLN B 793 1.913 6.683 -4.938 1.00 0.00 N ATOM 0 H GLN B 793 3.103 1.469 -3.243 1.00 0.00 H new ATOM 0 HA GLN B 793 1.642 3.871 -2.587 1.00 0.00 H new ATOM 0 HB2 GLN B 793 3.392 2.729 -4.638 1.00 0.00 H new ATOM 0 HB3 GLN B 793 2.072 3.585 -5.408 1.00 0.00 H new ATOM 0 HG2 GLN B 793 3.894 4.729 -3.227 1.00 0.00 H new ATOM 0 HG3 GLN B 793 3.981 5.125 -4.932 1.00 0.00 H new ATOM 0 HE21 GLN B 793 2.387 6.579 -5.835 1.00 0.00 H new ATOM 0 HE22 GLN B 793 1.197 7.399 -4.820 1.00 0.00 H new ATOM 1537 N ARG B 794 0.119 1.706 -4.539 1.00 0.00 N ATOM 1538 CA ARG B 794 -1.234 1.351 -5.054 1.00 0.00 C ATOM 1539 C ARG B 794 -2.266 1.467 -3.932 1.00 0.00 C ATOM 1540 O ARG B 794 -3.413 1.780 -4.162 1.00 0.00 O ATOM 1541 CB ARG B 794 -1.105 -0.102 -5.513 1.00 0.00 C ATOM 1542 CG ARG B 794 -1.854 -0.292 -6.834 1.00 0.00 C ATOM 1543 CD ARG B 794 -1.222 0.590 -7.912 1.00 0.00 C ATOM 1544 NE ARG B 794 -1.041 -0.315 -9.086 1.00 0.00 N ATOM 1545 CZ ARG B 794 -0.296 0.043 -10.105 1.00 0.00 C ATOM 1546 NH1 ARG B 794 0.312 1.204 -10.124 1.00 0.00 N ATOM 1547 NH2 ARG B 794 -0.159 -0.770 -11.117 1.00 0.00 N ATOM 0 H ARG B 794 0.853 1.030 -4.751 1.00 0.00 H new ATOM 0 HA ARG B 794 -1.562 2.008 -5.859 1.00 0.00 H new ATOM 0 HB2 ARG B 794 -0.054 -0.362 -5.639 1.00 0.00 H new ATOM 0 HB3 ARG B 794 -1.510 -0.771 -4.754 1.00 0.00 H new ATOM 0 HG2 ARG B 794 -1.817 -1.338 -7.138 1.00 0.00 H new ATOM 0 HG3 ARG B 794 -2.905 -0.034 -6.708 1.00 0.00 H new ATOM 0 HD2 ARG B 794 -1.865 1.435 -8.159 1.00 0.00 H new ATOM 0 HD3 ARG B 794 -0.269 1.001 -7.579 1.00 0.00 H new ATOM 0 HE ARG B 794 -1.503 -1.224 -9.096 1.00 0.00 H new ATOM 0 HH11 ARG B 794 0.210 1.846 -9.338 1.00 0.00 H new ATOM 0 HH12 ARG B 794 0.887 1.465 -10.925 1.00 0.00 H new ATOM 0 HH21 ARG B 794 -0.629 -1.675 -11.111 1.00 0.00 H new ATOM 0 HH22 ARG B 794 0.418 -0.500 -11.914 1.00 0.00 H new ATOM 1561 N VAL B 795 -1.856 1.231 -2.716 1.00 0.00 N ATOM 1562 CA VAL B 795 -2.796 1.359 -1.570 1.00 0.00 C ATOM 1563 C VAL B 795 -2.940 2.831 -1.185 1.00 0.00 C ATOM 1564 O VAL B 795 -4.006 3.287 -0.826 1.00 0.00 O ATOM 1565 CB VAL B 795 -2.147 0.560 -0.437 1.00 0.00 C ATOM 1566 CG1 VAL B 795 -2.930 0.770 0.862 1.00 0.00 C ATOM 1567 CG2 VAL B 795 -2.163 -0.923 -0.800 1.00 0.00 C ATOM 0 H VAL B 795 -0.906 0.954 -2.467 1.00 0.00 H new ATOM 0 HA VAL B 795 -3.795 0.990 -1.800 1.00 0.00 H new ATOM 0 HB VAL B 795 -1.121 0.899 -0.296 1.00 0.00 H new ATOM 0 HG11 VAL B 795 -2.463 0.199 1.665 1.00 0.00 H new ATOM 0 HG12 VAL B 795 -2.928 1.829 1.121 1.00 0.00 H new ATOM 0 HG13 VAL B 795 -3.957 0.432 0.726 1.00 0.00 H new ATOM 0 HG21 VAL B 795 -1.702 -1.499 0.002 1.00 0.00 H new ATOM 0 HG22 VAL B 795 -3.193 -1.253 -0.938 1.00 0.00 H new ATOM 0 HG23 VAL B 795 -1.606 -1.077 -1.724 1.00 0.00 H new ATOM 1577 N PHE B 796 -1.879 3.582 -1.272 1.00 0.00 N ATOM 1578 CA PHE B 796 -1.971 5.029 -0.935 1.00 0.00 C ATOM 1579 C PHE B 796 -2.559 5.806 -2.115 1.00 0.00 C ATOM 1580 O PHE B 796 -3.516 6.539 -1.975 1.00 0.00 O ATOM 1581 CB PHE B 796 -0.527 5.474 -0.675 1.00 0.00 C ATOM 1582 CG PHE B 796 0.059 4.709 0.495 1.00 0.00 C ATOM 1583 CD1 PHE B 796 -0.730 4.402 1.613 1.00 0.00 C ATOM 1584 CD2 PHE B 796 1.407 4.331 0.468 1.00 0.00 C ATOM 1585 CE1 PHE B 796 -0.174 3.701 2.691 1.00 0.00 C ATOM 1586 CE2 PHE B 796 1.962 3.632 1.546 1.00 0.00 C ATOM 1587 CZ PHE B 796 1.172 3.317 2.657 1.00 0.00 C ATOM 0 H PHE B 796 -0.956 3.258 -1.561 1.00 0.00 H new ATOM 0 HA PHE B 796 -2.615 5.210 -0.074 1.00 0.00 H new ATOM 0 HB2 PHE B 796 0.078 5.307 -1.566 1.00 0.00 H new ATOM 0 HB3 PHE B 796 -0.501 6.544 -0.468 1.00 0.00 H new ATOM 0 HD1 PHE B 796 -1.766 4.706 1.643 1.00 0.00 H new ATOM 0 HD2 PHE B 796 2.019 4.579 -0.386 1.00 0.00 H new ATOM 0 HE1 PHE B 796 -0.784 3.457 3.548 1.00 0.00 H new ATOM 0 HE2 PHE B 796 3.000 3.336 1.520 1.00 0.00 H new ATOM 0 HZ PHE B 796 1.601 2.777 3.489 1.00 0.00 H new ATOM 1597 N THR B 797 -1.996 5.641 -3.281 1.00 0.00 N ATOM 1598 CA THR B 797 -2.505 6.378 -4.473 1.00 0.00 C ATOM 1599 C THR B 797 -3.993 6.089 -4.698 1.00 0.00 C ATOM 1600 O THR B 797 -4.791 6.996 -4.829 1.00 0.00 O ATOM 1601 CB THR B 797 -1.677 5.856 -5.656 1.00 0.00 C ATOM 1602 OG1 THR B 797 -0.413 5.396 -5.199 1.00 0.00 O ATOM 1603 CG2 THR B 797 -1.463 6.987 -6.663 1.00 0.00 C ATOM 0 H THR B 797 -1.203 5.025 -3.460 1.00 0.00 H new ATOM 0 HA THR B 797 -2.410 7.457 -4.349 1.00 0.00 H new ATOM 0 HB THR B 797 -2.212 5.032 -6.129 1.00 0.00 H new ATOM 0 HG1 THR B 797 -0.423 4.418 -5.140 1.00 0.00 H new ATOM 0 HG21 THR B 797 -0.875 6.619 -7.504 1.00 0.00 H new ATOM 0 HG22 THR B 797 -2.429 7.341 -7.023 1.00 0.00 H new ATOM 0 HG23 THR B 797 -0.932 7.808 -6.181 1.00 0.00 H new ATOM 1611 N ASN B 798 -4.378 4.841 -4.760 1.00 0.00 N ATOM 1612 CA ASN B 798 -5.819 4.530 -4.995 1.00 0.00 C ATOM 1613 C ASN B 798 -6.666 5.051 -3.825 1.00 0.00 C ATOM 1614 O ASN B 798 -7.744 5.578 -4.016 1.00 0.00 O ATOM 1615 CB ASN B 798 -5.889 2.990 -5.159 1.00 0.00 C ATOM 1616 CG ASN B 798 -6.303 2.278 -3.858 1.00 0.00 C ATOM 1617 OD1 ASN B 798 -7.381 1.725 -3.773 1.00 0.00 O ATOM 1618 ND2 ASN B 798 -5.489 2.270 -2.843 1.00 0.00 N ATOM 0 H ASN B 798 -3.765 4.032 -4.659 1.00 0.00 H new ATOM 0 HA ASN B 798 -6.221 5.017 -5.883 1.00 0.00 H new ATOM 0 HB2 ASN B 798 -6.601 2.743 -5.947 1.00 0.00 H new ATOM 0 HB3 ASN B 798 -4.916 2.617 -5.480 1.00 0.00 H new ATOM 0 HD21 ASN B 798 -5.757 1.800 -1.978 1.00 0.00 H new ATOM 0 HD22 ASN B 798 -4.583 2.734 -2.912 1.00 0.00 H new ATOM 1625 N CYS B 799 -6.185 4.916 -2.617 1.00 0.00 N ATOM 1626 CA CYS B 799 -6.972 5.423 -1.456 1.00 0.00 C ATOM 1627 C CYS B 799 -7.301 6.903 -1.658 1.00 0.00 C ATOM 1628 O CYS B 799 -8.355 7.375 -1.295 1.00 0.00 O ATOM 1629 CB CYS B 799 -6.068 5.218 -0.243 1.00 0.00 C ATOM 1630 SG CYS B 799 -6.481 3.635 0.530 1.00 0.00 S ATOM 0 H CYS B 799 -5.291 4.482 -2.386 1.00 0.00 H new ATOM 0 HA CYS B 799 -7.923 4.904 -1.334 1.00 0.00 H new ATOM 0 HB2 CYS B 799 -5.021 5.228 -0.546 1.00 0.00 H new ATOM 0 HB3 CYS B 799 -6.202 6.032 0.469 1.00 0.00 H new ATOM 0 HG CYS B 799 -5.940 3.574 1.710 1.00 0.00 H new ATOM 1636 N LYS B 800 -6.427 7.630 -2.286 1.00 0.00 N ATOM 1637 CA LYS B 800 -6.714 9.064 -2.564 1.00 0.00 C ATOM 1638 C LYS B 800 -7.591 9.210 -3.815 1.00 0.00 C ATOM 1639 O LYS B 800 -7.739 10.291 -4.350 1.00 0.00 O ATOM 1640 CB LYS B 800 -5.343 9.698 -2.801 1.00 0.00 C ATOM 1641 CG LYS B 800 -4.499 9.572 -1.532 1.00 0.00 C ATOM 1642 CD LYS B 800 -3.407 10.643 -1.537 1.00 0.00 C ATOM 1643 CE LYS B 800 -2.327 10.273 -0.519 1.00 0.00 C ATOM 1644 NZ LYS B 800 -1.088 10.929 -1.023 1.00 0.00 N ATOM 0 H LYS B 800 -5.524 7.295 -2.621 1.00 0.00 H new ATOM 0 HA LYS B 800 -7.255 9.538 -1.745 1.00 0.00 H new ATOM 0 HB2 LYS B 800 -4.842 9.206 -3.635 1.00 0.00 H new ATOM 0 HB3 LYS B 800 -5.457 10.748 -3.072 1.00 0.00 H new ATOM 0 HG2 LYS B 800 -5.130 9.685 -0.650 1.00 0.00 H new ATOM 0 HG3 LYS B 800 -4.050 8.580 -1.478 1.00 0.00 H new ATOM 0 HD2 LYS B 800 -2.970 10.728 -2.532 1.00 0.00 H new ATOM 0 HD3 LYS B 800 -3.835 11.615 -1.293 1.00 0.00 H new ATOM 0 HE2 LYS B 800 -2.585 10.629 0.478 1.00 0.00 H new ATOM 0 HE3 LYS B 800 -2.202 9.192 -0.450 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 -0.256 10.469 -0.602 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 -1.045 10.841 -2.058 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 -1.097 11.936 -0.761 1.00 0.00 H new ATOM 1658 N GLU B 801 -8.166 8.138 -4.298 1.00 0.00 N ATOM 1659 CA GLU B 801 -8.975 8.231 -5.541 1.00 0.00 C ATOM 1660 C GLU B 801 -10.461 7.958 -5.284 1.00 0.00 C ATOM 1661 O GLU B 801 -11.301 8.354 -6.069 1.00 0.00 O ATOM 1662 CB GLU B 801 -8.396 7.146 -6.452 1.00 0.00 C ATOM 1663 CG GLU B 801 -7.989 7.762 -7.792 1.00 0.00 C ATOM 1664 CD GLU B 801 -7.159 6.752 -8.585 1.00 0.00 C ATOM 1665 OE1 GLU B 801 -6.549 5.898 -7.963 1.00 0.00 O ATOM 1666 OE2 GLU B 801 -7.148 6.848 -9.801 1.00 0.00 O ATOM 0 H GLU B 801 -8.108 7.208 -3.884 1.00 0.00 H new ATOM 0 HA GLU B 801 -8.926 9.231 -5.972 1.00 0.00 H new ATOM 0 HB2 GLU B 801 -7.532 6.681 -5.977 1.00 0.00 H new ATOM 0 HB3 GLU B 801 -9.134 6.359 -6.611 1.00 0.00 H new ATOM 0 HG2 GLU B 801 -8.876 8.045 -8.359 1.00 0.00 H new ATOM 0 HG3 GLU B 801 -7.413 8.672 -7.626 1.00 0.00 H new ATOM 1673 N TYR B 802 -10.812 7.268 -4.221 1.00 0.00 N ATOM 1674 CA TYR B 802 -12.263 6.967 -4.017 1.00 0.00 C ATOM 1675 C TYR B 802 -12.776 7.348 -2.621 1.00 0.00 C ATOM 1676 O TYR B 802 -13.898 7.801 -2.495 1.00 0.00 O ATOM 1677 CB TYR B 802 -12.415 5.463 -4.265 1.00 0.00 C ATOM 1678 CG TYR B 802 -11.552 4.669 -3.316 1.00 0.00 C ATOM 1679 CD1 TYR B 802 -10.206 4.441 -3.621 1.00 0.00 C ATOM 1680 CD2 TYR B 802 -12.115 4.098 -2.168 1.00 0.00 C ATOM 1681 CE1 TYR B 802 -9.417 3.670 -2.761 1.00 0.00 C ATOM 1682 CE2 TYR B 802 -11.328 3.336 -1.312 1.00 0.00 C ATOM 1683 CZ TYR B 802 -9.977 3.122 -1.602 1.00 0.00 C ATOM 1684 OH TYR B 802 -9.198 2.367 -0.748 1.00 0.00 O ATOM 0 H TYR B 802 -10.177 6.911 -3.507 1.00 0.00 H new ATOM 0 HA TYR B 802 -12.865 7.564 -4.702 1.00 0.00 H new ATOM 0 HB2 TYR B 802 -13.459 5.174 -4.141 1.00 0.00 H new ATOM 0 HB3 TYR B 802 -12.140 5.231 -5.294 1.00 0.00 H new ATOM 0 HD1 TYR B 802 -9.777 4.860 -4.519 1.00 0.00 H new ATOM 0 HD2 TYR B 802 -13.161 4.250 -1.947 1.00 0.00 H new ATOM 0 HE1 TYR B 802 -8.376 3.498 -2.992 1.00 0.00 H new ATOM 0 HE2 TYR B 802 -11.761 2.908 -0.420 1.00 0.00 H new ATOM 0 HH TYR B 802 -8.416 2.889 -0.471 1.00 0.00 H new ATOM 1694 N ASN B 803 -12.021 7.152 -1.563 1.00 0.00 N ATOM 1695 CA ASN B 803 -12.580 7.526 -0.221 1.00 0.00 C ATOM 1696 C ASN B 803 -12.647 9.053 0.001 1.00 0.00 C ATOM 1697 O ASN B 803 -13.531 9.504 0.693 1.00 0.00 O ATOM 1698 CB ASN B 803 -11.750 6.812 0.862 1.00 0.00 C ATOM 1699 CG ASN B 803 -10.249 7.025 0.682 1.00 0.00 C ATOM 1700 OD1 ASN B 803 -9.741 8.100 0.931 1.00 0.00 O ATOM 1701 ND2 ASN B 803 -9.496 5.995 0.405 1.00 0.00 N ATOM 0 H ASN B 803 -11.078 6.764 -1.565 1.00 0.00 H new ATOM 0 HA ASN B 803 -13.617 7.196 -0.165 1.00 0.00 H new ATOM 0 HB2 ASN B 803 -12.050 7.176 1.845 1.00 0.00 H new ATOM 0 HB3 ASN B 803 -11.968 5.744 0.837 1.00 0.00 H new ATOM 0 HD21 ASN B 803 -8.481 6.093 0.398 1.00 0.00 H new ATOM 0 HD22 ASN B 803 -9.923 5.093 0.196 1.00 0.00 H new ATOM 1708 N PRO B 804 -11.803 9.822 -0.650 1.00 0.00 N ATOM 1709 CA PRO B 804 -11.857 11.295 -0.486 1.00 0.00 C ATOM 1710 C PRO B 804 -12.769 11.889 -1.584 1.00 0.00 C ATOM 1711 O PRO B 804 -13.500 11.132 -2.192 1.00 0.00 O ATOM 1712 CB PRO B 804 -10.389 11.635 -0.644 1.00 0.00 C ATOM 1713 CG PRO B 804 -9.907 10.706 -1.704 1.00 0.00 C ATOM 1714 CD PRO B 804 -10.689 9.433 -1.531 1.00 0.00 C ATOM 0 HA PRO B 804 -12.275 11.682 0.444 1.00 0.00 H new ATOM 0 HB2 PRO B 804 -10.251 12.676 -0.935 1.00 0.00 H new ATOM 0 HB3 PRO B 804 -9.845 11.490 0.289 1.00 0.00 H new ATOM 0 HG2 PRO B 804 -10.067 11.130 -2.695 1.00 0.00 H new ATOM 0 HG3 PRO B 804 -8.837 10.523 -1.604 1.00 0.00 H new ATOM 0 HD2 PRO B 804 -11.049 9.052 -2.487 1.00 0.00 H new ATOM 0 HD3 PRO B 804 -10.080 8.647 -1.083 1.00 0.00 H new ATOM 1722 N PRO B 805 -12.824 13.207 -1.772 1.00 0.00 N ATOM 1723 CA PRO B 805 -11.949 14.215 -1.091 1.00 0.00 C ATOM 1724 C PRO B 805 -11.847 14.024 0.424 1.00 0.00 C ATOM 1725 O PRO B 805 -12.847 14.006 1.113 1.00 0.00 O ATOM 1726 CB PRO B 805 -12.650 15.535 -1.391 1.00 0.00 C ATOM 1727 CG PRO B 805 -13.331 15.319 -2.700 1.00 0.00 C ATOM 1728 CD PRO B 805 -13.670 13.854 -2.790 1.00 0.00 C ATOM 0 HA PRO B 805 -10.921 14.143 -1.447 1.00 0.00 H new ATOM 0 HB2 PRO B 805 -13.367 15.788 -0.610 1.00 0.00 H new ATOM 0 HB3 PRO B 805 -11.937 16.357 -1.448 1.00 0.00 H new ATOM 0 HG2 PRO B 805 -14.233 15.927 -2.769 1.00 0.00 H new ATOM 0 HG3 PRO B 805 -12.682 15.615 -3.524 1.00 0.00 H new ATOM 0 HD2 PRO B 805 -14.728 13.680 -2.593 1.00 0.00 H new ATOM 0 HD3 PRO B 805 -13.462 13.461 -3.785 1.00 0.00 H new ATOM 1736 N GLU B 806 -10.620 13.957 0.927 1.00 0.00 N ATOM 1737 CA GLU B 806 -10.330 13.821 2.402 1.00 0.00 C ATOM 1738 C GLU B 806 -11.555 13.434 3.227 1.00 0.00 C ATOM 1739 O GLU B 806 -12.056 14.214 4.014 1.00 0.00 O ATOM 1740 CB GLU B 806 -9.841 15.210 2.821 1.00 0.00 C ATOM 1741 CG GLU B 806 -8.890 15.078 4.013 1.00 0.00 C ATOM 1742 CD GLU B 806 -8.972 16.339 4.875 1.00 0.00 C ATOM 1743 OE1 GLU B 806 -9.989 17.011 4.813 1.00 0.00 O ATOM 1744 OE2 GLU B 806 -8.018 16.611 5.586 1.00 0.00 O ATOM 0 H GLU B 806 -9.780 13.993 0.349 1.00 0.00 H new ATOM 0 HA GLU B 806 -9.607 13.024 2.577 1.00 0.00 H new ATOM 0 HB2 GLU B 806 -9.332 15.695 1.988 1.00 0.00 H new ATOM 0 HB3 GLU B 806 -10.689 15.841 3.087 1.00 0.00 H new ATOM 0 HG2 GLU B 806 -9.153 14.202 4.606 1.00 0.00 H new ATOM 0 HG3 GLU B 806 -7.869 14.931 3.662 1.00 0.00 H new ATOM 1751 N SER B 807 -12.070 12.258 3.022 1.00 0.00 N ATOM 1752 CA SER B 807 -13.259 11.840 3.808 1.00 0.00 C ATOM 1753 C SER B 807 -12.802 11.188 5.102 1.00 0.00 C ATOM 1754 O SER B 807 -13.382 11.387 6.152 1.00 0.00 O ATOM 1755 CB SER B 807 -13.993 10.830 2.929 1.00 0.00 C ATOM 1756 OG SER B 807 -15.256 10.529 3.503 1.00 0.00 O ATOM 0 H SER B 807 -11.723 11.573 2.350 1.00 0.00 H new ATOM 0 HA SER B 807 -13.903 12.679 4.071 1.00 0.00 H new ATOM 0 HB2 SER B 807 -14.125 11.234 1.925 1.00 0.00 H new ATOM 0 HB3 SER B 807 -13.401 9.920 2.830 1.00 0.00 H new ATOM 0 HG SER B 807 -15.727 9.882 2.937 1.00 0.00 H new ATOM 1762 N GLU B 808 -11.759 10.403 5.038 1.00 0.00 N ATOM 1763 CA GLU B 808 -11.242 9.745 6.284 1.00 0.00 C ATOM 1764 C GLU B 808 -10.097 8.796 5.951 1.00 0.00 C ATOM 1765 O GLU B 808 -9.132 8.687 6.681 1.00 0.00 O ATOM 1766 CB GLU B 808 -12.422 8.952 6.859 1.00 0.00 C ATOM 1767 CG GLU B 808 -12.875 9.598 8.170 1.00 0.00 C ATOM 1768 CD GLU B 808 -14.402 9.694 8.193 1.00 0.00 C ATOM 1769 OE1 GLU B 808 -14.983 9.844 7.131 1.00 0.00 O ATOM 1770 OE2 GLU B 808 -14.964 9.616 9.273 1.00 0.00 O ATOM 0 H GLU B 808 -11.243 10.187 4.185 1.00 0.00 H new ATOM 0 HA GLU B 808 -10.861 10.482 6.992 1.00 0.00 H new ATOM 0 HB2 GLU B 808 -13.246 8.935 6.145 1.00 0.00 H new ATOM 0 HB3 GLU B 808 -12.129 7.917 7.033 1.00 0.00 H new ATOM 0 HG2 GLU B 808 -12.525 9.009 9.018 1.00 0.00 H new ATOM 0 HG3 GLU B 808 -12.436 10.591 8.269 1.00 0.00 H new ATOM 1777 N TYR B 809 -10.210 8.084 4.871 1.00 0.00 N ATOM 1778 CA TYR B 809 -9.130 7.140 4.490 1.00 0.00 C ATOM 1779 C TYR B 809 -7.987 7.903 3.815 1.00 0.00 C ATOM 1780 O TYR B 809 -6.826 7.662 4.084 1.00 0.00 O ATOM 1781 CB TYR B 809 -9.800 6.174 3.514 1.00 0.00 C ATOM 1782 CG TYR B 809 -10.352 4.982 4.264 1.00 0.00 C ATOM 1783 CD1 TYR B 809 -11.020 5.164 5.483 1.00 0.00 C ATOM 1784 CD2 TYR B 809 -10.229 3.699 3.720 1.00 0.00 C ATOM 1785 CE1 TYR B 809 -11.541 4.061 6.167 1.00 0.00 C ATOM 1786 CE2 TYR B 809 -10.753 2.595 4.403 1.00 0.00 C ATOM 1787 CZ TYR B 809 -11.410 2.776 5.628 1.00 0.00 C ATOM 1788 OH TYR B 809 -11.926 1.690 6.304 1.00 0.00 O ATOM 0 H TYR B 809 -11.006 8.115 4.233 1.00 0.00 H new ATOM 0 HA TYR B 809 -8.695 6.619 5.343 1.00 0.00 H new ATOM 0 HB2 TYR B 809 -10.603 6.682 2.980 1.00 0.00 H new ATOM 0 HB3 TYR B 809 -9.080 5.842 2.766 1.00 0.00 H new ATOM 0 HD1 TYR B 809 -11.132 6.156 5.894 1.00 0.00 H new ATOM 0 HD2 TYR B 809 -9.730 3.560 2.773 1.00 0.00 H new ATOM 0 HE1 TYR B 809 -12.045 4.201 7.112 1.00 0.00 H new ATOM 0 HE2 TYR B 809 -10.651 1.604 3.986 1.00 0.00 H new ATOM 0 HH TYR B 809 -11.369 0.902 6.131 1.00 0.00 H new ATOM 1798 N TYR B 810 -8.303 8.857 2.976 1.00 0.00 N ATOM 1799 CA TYR B 810 -7.228 9.643 2.307 1.00 0.00 C ATOM 1800 C TYR B 810 -6.255 10.219 3.348 1.00 0.00 C ATOM 1801 O TYR B 810 -5.060 10.016 3.267 1.00 0.00 O ATOM 1802 CB TYR B 810 -7.979 10.753 1.560 1.00 0.00 C ATOM 1803 CG TYR B 810 -7.049 11.890 1.185 1.00 0.00 C ATOM 1804 CD1 TYR B 810 -6.759 12.891 2.120 1.00 0.00 C ATOM 1805 CD2 TYR B 810 -6.493 11.950 -0.098 1.00 0.00 C ATOM 1806 CE1 TYR B 810 -5.906 13.946 1.776 1.00 0.00 C ATOM 1807 CE2 TYR B 810 -5.640 13.006 -0.443 1.00 0.00 C ATOM 1808 CZ TYR B 810 -5.346 14.003 0.495 1.00 0.00 C ATOM 1809 OH TYR B 810 -4.505 15.043 0.157 1.00 0.00 O ATOM 0 H TYR B 810 -9.256 9.123 2.727 1.00 0.00 H new ATOM 0 HA TYR B 810 -6.619 9.041 1.633 1.00 0.00 H new ATOM 0 HB2 TYR B 810 -8.437 10.343 0.660 1.00 0.00 H new ATOM 0 HB3 TYR B 810 -8.787 11.132 2.185 1.00 0.00 H new ATOM 0 HD1 TYR B 810 -7.194 12.849 3.108 1.00 0.00 H new ATOM 0 HD2 TYR B 810 -6.722 11.182 -0.822 1.00 0.00 H new ATOM 0 HE1 TYR B 810 -5.680 14.716 2.499 1.00 0.00 H new ATOM 0 HE2 TYR B 810 -5.209 13.051 -1.432 1.00 0.00 H new ATOM 0 HH TYR B 810 -4.202 14.931 -0.768 1.00 0.00 H new ATOM 1819 N LYS B 811 -6.754 10.955 4.307 1.00 0.00 N ATOM 1820 CA LYS B 811 -5.852 11.570 5.330 1.00 0.00 C ATOM 1821 C LYS B 811 -4.861 10.538 5.876 1.00 0.00 C ATOM 1822 O LYS B 811 -3.759 10.870 6.265 1.00 0.00 O ATOM 1823 CB LYS B 811 -6.782 12.063 6.444 1.00 0.00 C ATOM 1824 CG LYS B 811 -7.682 10.919 6.913 1.00 0.00 C ATOM 1825 CD LYS B 811 -8.481 11.367 8.138 1.00 0.00 C ATOM 1826 CE LYS B 811 -7.558 11.424 9.357 1.00 0.00 C ATOM 1827 NZ LYS B 811 -7.890 10.203 10.144 1.00 0.00 N ATOM 0 H LYS B 811 -7.746 11.158 4.427 1.00 0.00 H new ATOM 0 HA LYS B 811 -5.256 12.379 4.907 1.00 0.00 H new ATOM 0 HB2 LYS B 811 -6.194 12.441 7.280 1.00 0.00 H new ATOM 0 HB3 LYS B 811 -7.391 12.892 6.082 1.00 0.00 H new ATOM 0 HG2 LYS B 811 -8.360 10.624 6.112 1.00 0.00 H new ATOM 0 HG3 LYS B 811 -7.079 10.045 7.159 1.00 0.00 H new ATOM 0 HD2 LYS B 811 -8.924 12.347 7.958 1.00 0.00 H new ATOM 0 HD3 LYS B 811 -9.302 10.675 8.323 1.00 0.00 H new ATOM 0 HE2 LYS B 811 -6.509 11.430 9.059 1.00 0.00 H new ATOM 0 HE3 LYS B 811 -7.729 12.329 9.940 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 -7.386 10.228 11.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 -8.915 10.170 10.317 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 -7.601 9.358 9.612 1.00 0.00 H new ATOM 1841 N CYS B 812 -5.235 9.289 5.897 1.00 0.00 N ATOM 1842 CA CYS B 812 -4.297 8.245 6.395 1.00 0.00 C ATOM 1843 C CYS B 812 -3.294 7.875 5.300 1.00 0.00 C ATOM 1844 O CYS B 812 -2.123 7.682 5.558 1.00 0.00 O ATOM 1845 CB CYS B 812 -5.179 7.043 6.739 1.00 0.00 C ATOM 1846 SG CYS B 812 -6.379 7.520 8.007 1.00 0.00 S ATOM 0 H CYS B 812 -6.146 8.947 5.592 1.00 0.00 H new ATOM 0 HA CYS B 812 -3.722 8.586 7.256 1.00 0.00 H new ATOM 0 HB2 CYS B 812 -5.697 6.691 5.847 1.00 0.00 H new ATOM 0 HB3 CYS B 812 -4.564 6.217 7.097 1.00 0.00 H new ATOM 0 HG CYS B 812 -7.462 7.959 7.437 1.00 0.00 H new ATOM 1852 N ALA B 813 -3.740 7.787 4.075 1.00 0.00 N ATOM 1853 CA ALA B 813 -2.808 7.430 2.968 1.00 0.00 C ATOM 1854 C ALA B 813 -1.597 8.365 2.967 1.00 0.00 C ATOM 1855 O ALA B 813 -0.476 7.941 2.776 1.00 0.00 O ATOM 1856 CB ALA B 813 -3.627 7.619 1.690 1.00 0.00 C ATOM 0 H ALA B 813 -4.708 7.947 3.794 1.00 0.00 H new ATOM 0 HA ALA B 813 -2.423 6.415 3.065 1.00 0.00 H new ATOM 0 HB1 ALA B 813 -3.011 7.376 0.824 1.00 0.00 H new ATOM 0 HB2 ALA B 813 -4.496 6.961 1.714 1.00 0.00 H new ATOM 0 HB3 ALA B 813 -3.958 8.655 1.620 1.00 0.00 H new ATOM 1862 N ASN B 814 -1.815 9.634 3.177 1.00 0.00 N ATOM 1863 CA ASN B 814 -0.676 10.596 3.181 1.00 0.00 C ATOM 1864 C ASN B 814 0.259 10.319 4.361 1.00 0.00 C ATOM 1865 O ASN B 814 1.447 10.132 4.192 1.00 0.00 O ATOM 1866 CB ASN B 814 -1.329 11.971 3.334 1.00 0.00 C ATOM 1867 CG ASN B 814 -0.417 13.038 2.725 1.00 0.00 C ATOM 1868 OD1 ASN B 814 0.786 12.992 2.891 1.00 0.00 O ATOM 1869 ND2 ASN B 814 -0.941 14.003 2.021 1.00 0.00 N ATOM 0 H ASN B 814 -2.732 10.047 3.346 1.00 0.00 H new ATOM 0 HA ASN B 814 -0.072 10.520 2.277 1.00 0.00 H new ATOM 0 HB2 ASN B 814 -2.300 11.982 2.839 1.00 0.00 H new ATOM 0 HB3 ASN B 814 -1.506 12.186 4.388 1.00 0.00 H new ATOM 0 HD21 ASN B 814 -0.341 14.718 1.610 1.00 0.00 H new ATOM 0 HD22 ASN B 814 -1.951 14.042 1.881 1.00 0.00 H new ATOM 1876 N ILE B 815 -0.267 10.300 5.554 1.00 0.00 N ATOM 1877 CA ILE B 815 0.592 10.046 6.746 1.00 0.00 C ATOM 1878 C ILE B 815 1.322 8.706 6.609 1.00 0.00 C ATOM 1879 O ILE B 815 2.534 8.654 6.541 1.00 0.00 O ATOM 1880 CB ILE B 815 -0.387 10.008 7.923 1.00 0.00 C ATOM 1881 CG1 ILE B 815 -1.012 11.392 8.104 1.00 0.00 C ATOM 1882 CG2 ILE B 815 0.356 9.612 9.202 1.00 0.00 C ATOM 1883 CD1 ILE B 815 -2.242 11.283 9.008 1.00 0.00 C ATOM 0 H ILE B 815 -1.256 10.449 5.756 1.00 0.00 H new ATOM 0 HA ILE B 815 1.363 10.806 6.871 1.00 0.00 H new ATOM 0 HB ILE B 815 -1.168 9.275 7.721 1.00 0.00 H new ATOM 0 HG12 ILE B 815 -0.285 12.076 8.542 1.00 0.00 H new ATOM 0 HG13 ILE B 815 -1.295 11.804 7.135 1.00 0.00 H new ATOM 0 HG21 ILE B 815 -0.345 9.586 10.037 1.00 0.00 H new ATOM 0 HG22 ILE B 815 0.803 8.626 9.073 1.00 0.00 H new ATOM 0 HG23 ILE B 815 1.139 10.341 9.408 1.00 0.00 H new ATOM 0 HD11 ILE B 815 -2.687 12.269 9.137 1.00 0.00 H new ATOM 0 HD12 ILE B 815 -2.971 10.613 8.552 1.00 0.00 H new ATOM 0 HD13 ILE B 815 -1.945 10.889 9.980 1.00 0.00 H new ATOM 1895 N LEU B 816 0.594 7.621 6.573 1.00 0.00 N ATOM 1896 CA LEU B 816 1.248 6.285 6.444 1.00 0.00 C ATOM 1897 C LEU B 816 2.238 6.289 5.276 1.00 0.00 C ATOM 1898 O LEU B 816 3.288 5.680 5.336 1.00 0.00 O ATOM 1899 CB LEU B 816 0.093 5.309 6.180 1.00 0.00 C ATOM 1900 CG LEU B 816 0.615 3.871 6.033 1.00 0.00 C ATOM 1901 CD1 LEU B 816 1.588 3.525 7.165 1.00 0.00 C ATOM 1902 CD2 LEU B 816 -0.567 2.906 6.084 1.00 0.00 C ATOM 0 H LEU B 816 -0.424 7.602 6.627 1.00 0.00 H new ATOM 0 HA LEU B 816 1.817 6.011 7.332 1.00 0.00 H new ATOM 0 HB2 LEU B 816 -0.625 5.358 6.999 1.00 0.00 H new ATOM 0 HB3 LEU B 816 -0.437 5.603 5.274 1.00 0.00 H new ATOM 0 HG LEU B 816 1.140 3.786 5.082 1.00 0.00 H new ATOM 0 HD11 LEU B 816 1.944 2.502 7.039 1.00 0.00 H new ATOM 0 HD12 LEU B 816 2.436 4.210 7.138 1.00 0.00 H new ATOM 0 HD13 LEU B 816 1.078 3.616 8.124 1.00 0.00 H new ATOM 0 HD21 LEU B 816 -0.206 1.883 5.980 1.00 0.00 H new ATOM 0 HD22 LEU B 816 -1.084 3.014 7.038 1.00 0.00 H new ATOM 0 HD23 LEU B 816 -1.256 3.132 5.270 1.00 0.00 H new ATOM 1914 N GLU B 817 1.925 6.997 4.226 1.00 0.00 N ATOM 1915 CA GLU B 817 2.866 7.076 3.074 1.00 0.00 C ATOM 1916 C GLU B 817 4.079 7.924 3.463 1.00 0.00 C ATOM 1917 O GLU B 817 5.201 7.632 3.100 1.00 0.00 O ATOM 1918 CB GLU B 817 2.063 7.762 1.962 1.00 0.00 C ATOM 1919 CG GLU B 817 2.987 8.126 0.796 1.00 0.00 C ATOM 1920 CD GLU B 817 2.168 8.782 -0.317 1.00 0.00 C ATOM 1921 OE1 GLU B 817 1.181 9.425 0.002 1.00 0.00 O ATOM 1922 OE2 GLU B 817 2.539 8.628 -1.469 1.00 0.00 O ATOM 0 H GLU B 817 1.059 7.524 4.116 1.00 0.00 H new ATOM 0 HA GLU B 817 3.239 6.100 2.763 1.00 0.00 H new ATOM 0 HB2 GLU B 817 1.269 7.101 1.615 1.00 0.00 H new ATOM 0 HB3 GLU B 817 1.583 8.660 2.350 1.00 0.00 H new ATOM 0 HG2 GLU B 817 3.769 8.805 1.136 1.00 0.00 H new ATOM 0 HG3 GLU B 817 3.483 7.232 0.418 1.00 0.00 H new ATOM 1929 N LYS B 818 3.856 8.979 4.196 1.00 0.00 N ATOM 1930 CA LYS B 818 4.985 9.857 4.607 1.00 0.00 C ATOM 1931 C LYS B 818 6.050 9.043 5.343 1.00 0.00 C ATOM 1932 O LYS B 818 7.209 9.043 4.978 1.00 0.00 O ATOM 1933 CB LYS B 818 4.359 10.888 5.546 1.00 0.00 C ATOM 1934 CG LYS B 818 4.453 12.278 4.917 1.00 0.00 C ATOM 1935 CD LYS B 818 3.360 12.433 3.859 1.00 0.00 C ATOM 1936 CE LYS B 818 3.877 13.312 2.722 1.00 0.00 C ATOM 1937 NZ LYS B 818 3.044 12.943 1.542 1.00 0.00 N ATOM 0 H LYS B 818 2.937 9.271 4.529 1.00 0.00 H new ATOM 0 HA LYS B 818 5.477 10.324 3.753 1.00 0.00 H new ATOM 0 HB2 LYS B 818 3.316 10.634 5.738 1.00 0.00 H new ATOM 0 HB3 LYS B 818 4.872 10.878 6.508 1.00 0.00 H new ATOM 0 HG2 LYS B 818 4.343 13.044 5.684 1.00 0.00 H new ATOM 0 HG3 LYS B 818 5.435 12.419 4.465 1.00 0.00 H new ATOM 0 HD2 LYS B 818 3.069 11.455 3.474 1.00 0.00 H new ATOM 0 HD3 LYS B 818 2.470 12.879 4.302 1.00 0.00 H new ATOM 0 HE2 LYS B 818 3.774 14.370 2.963 1.00 0.00 H new ATOM 0 HE3 LYS B 818 4.935 13.130 2.531 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 3.281 13.564 0.742 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 3.231 11.954 1.280 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 2.037 13.053 1.779 1.00 0.00 H new ATOM 1951 N PHE B 819 5.665 8.350 6.380 1.00 0.00 N ATOM 1952 CA PHE B 819 6.654 7.536 7.141 1.00 0.00 C ATOM 1953 C PHE B 819 7.355 6.545 6.211 1.00 0.00 C ATOM 1954 O PHE B 819 8.567 6.492 6.145 1.00 0.00 O ATOM 1955 CB PHE B 819 5.824 6.791 8.188 1.00 0.00 C ATOM 1956 CG PHE B 819 6.630 6.644 9.456 1.00 0.00 C ATOM 1957 CD1 PHE B 819 7.508 5.563 9.607 1.00 0.00 C ATOM 1958 CD2 PHE B 819 6.500 7.588 10.481 1.00 0.00 C ATOM 1959 CE1 PHE B 819 8.254 5.427 10.783 1.00 0.00 C ATOM 1960 CE2 PHE B 819 7.247 7.452 11.658 1.00 0.00 C ATOM 1961 CZ PHE B 819 8.124 6.371 11.808 1.00 0.00 C ATOM 0 H PHE B 819 4.709 8.313 6.733 1.00 0.00 H new ATOM 0 HA PHE B 819 7.433 8.149 7.594 1.00 0.00 H new ATOM 0 HB2 PHE B 819 4.902 7.335 8.391 1.00 0.00 H new ATOM 0 HB3 PHE B 819 5.538 5.809 7.810 1.00 0.00 H new ATOM 0 HD1 PHE B 819 7.609 4.835 8.816 1.00 0.00 H new ATOM 0 HD2 PHE B 819 5.823 8.422 10.364 1.00 0.00 H new ATOM 0 HE1 PHE B 819 8.930 4.593 10.900 1.00 0.00 H new ATOM 0 HE2 PHE B 819 7.147 8.180 12.449 1.00 0.00 H new ATOM 0 HZ PHE B 819 8.700 6.266 12.715 1.00 0.00 H new ATOM 1971 N PHE B 820 6.603 5.757 5.491 1.00 0.00 N ATOM 1972 CA PHE B 820 7.231 4.777 4.561 1.00 0.00 C ATOM 1973 C PHE B 820 8.146 5.522 3.575 1.00 0.00 C ATOM 1974 O PHE B 820 9.117 4.980 3.089 1.00 0.00 O ATOM 1975 CB PHE B 820 6.026 4.073 3.879 1.00 0.00 C ATOM 1976 CG PHE B 820 6.188 3.962 2.372 1.00 0.00 C ATOM 1977 CD1 PHE B 820 6.892 2.886 1.818 1.00 0.00 C ATOM 1978 CD2 PHE B 820 5.628 4.935 1.536 1.00 0.00 C ATOM 1979 CE1 PHE B 820 7.036 2.784 0.429 1.00 0.00 C ATOM 1980 CE2 PHE B 820 5.773 4.834 0.147 1.00 0.00 C ATOM 1981 CZ PHE B 820 6.478 3.759 -0.406 1.00 0.00 C ATOM 0 H PHE B 820 5.583 5.750 5.507 1.00 0.00 H new ATOM 0 HA PHE B 820 7.873 4.042 5.047 1.00 0.00 H new ATOM 0 HB2 PHE B 820 5.906 3.076 4.302 1.00 0.00 H new ATOM 0 HB3 PHE B 820 5.113 4.626 4.103 1.00 0.00 H new ATOM 0 HD1 PHE B 820 7.324 2.135 2.462 1.00 0.00 H new ATOM 0 HD2 PHE B 820 5.084 5.764 1.963 1.00 0.00 H new ATOM 0 HE1 PHE B 820 7.578 1.953 0.002 1.00 0.00 H new ATOM 0 HE2 PHE B 820 5.341 5.585 -0.497 1.00 0.00 H new ATOM 0 HZ PHE B 820 6.592 3.682 -1.477 1.00 0.00 H new ATOM 1991 N PHE B 821 7.844 6.758 3.283 1.00 0.00 N ATOM 1992 CA PHE B 821 8.705 7.529 2.342 1.00 0.00 C ATOM 1993 C PHE B 821 10.068 7.788 2.981 1.00 0.00 C ATOM 1994 O PHE B 821 11.089 7.766 2.323 1.00 0.00 O ATOM 1995 CB PHE B 821 7.960 8.845 2.107 1.00 0.00 C ATOM 1996 CG PHE B 821 7.814 9.081 0.622 1.00 0.00 C ATOM 1997 CD1 PHE B 821 8.884 9.609 -0.111 1.00 0.00 C ATOM 1998 CD2 PHE B 821 6.610 8.773 -0.023 1.00 0.00 C ATOM 1999 CE1 PHE B 821 8.750 9.829 -1.487 1.00 0.00 C ATOM 2000 CE2 PHE B 821 6.476 8.992 -1.400 1.00 0.00 C ATOM 2001 CZ PHE B 821 7.546 9.520 -2.131 1.00 0.00 C ATOM 0 H PHE B 821 7.041 7.266 3.654 1.00 0.00 H new ATOM 0 HA PHE B 821 8.884 6.996 1.409 1.00 0.00 H new ATOM 0 HB2 PHE B 821 6.978 8.809 2.579 1.00 0.00 H new ATOM 0 HB3 PHE B 821 8.504 9.671 2.566 1.00 0.00 H new ATOM 0 HD1 PHE B 821 9.813 9.847 0.386 1.00 0.00 H new ATOM 0 HD2 PHE B 821 5.784 8.366 0.542 1.00 0.00 H new ATOM 0 HE1 PHE B 821 9.575 10.237 -2.052 1.00 0.00 H new ATOM 0 HE2 PHE B 821 5.547 8.753 -1.897 1.00 0.00 H new ATOM 0 HZ PHE B 821 7.443 9.689 -3.193 1.00 0.00 H new ATOM 2011 N SER B 822 10.093 8.021 4.264 1.00 0.00 N ATOM 2012 CA SER B 822 11.393 8.244 4.952 1.00 0.00 C ATOM 2013 C SER B 822 12.154 6.925 5.049 1.00 0.00 C ATOM 2014 O SER B 822 13.351 6.876 4.861 1.00 0.00 O ATOM 2015 CB SER B 822 11.020 8.748 6.347 1.00 0.00 C ATOM 2016 OG SER B 822 11.869 9.830 6.702 1.00 0.00 O ATOM 0 H SER B 822 9.270 8.066 4.864 1.00 0.00 H new ATOM 0 HA SER B 822 12.032 8.951 4.422 1.00 0.00 H new ATOM 0 HB2 SER B 822 9.978 9.069 6.363 1.00 0.00 H new ATOM 0 HB3 SER B 822 11.117 7.942 7.074 1.00 0.00 H new ATOM 0 HG SER B 822 11.629 10.154 7.595 1.00 0.00 H new ATOM 2022 N LYS B 823 11.462 5.851 5.314 1.00 0.00 N ATOM 2023 CA LYS B 823 12.145 4.535 5.436 1.00 0.00 C ATOM 2024 C LYS B 823 12.624 4.039 4.075 1.00 0.00 C ATOM 2025 O LYS B 823 13.658 3.420 3.977 1.00 0.00 O ATOM 2026 CB LYS B 823 11.086 3.592 6.008 1.00 0.00 C ATOM 2027 CG LYS B 823 10.766 4.013 7.445 1.00 0.00 C ATOM 2028 CD LYS B 823 11.996 3.802 8.329 1.00 0.00 C ATOM 2029 CE LYS B 823 11.726 2.661 9.311 1.00 0.00 C ATOM 2030 NZ LYS B 823 12.811 2.766 10.327 1.00 0.00 N ATOM 0 H LYS B 823 10.452 5.829 5.451 1.00 0.00 H new ATOM 0 HA LYS B 823 13.030 4.595 6.070 1.00 0.00 H new ATOM 0 HB2 LYS B 823 10.184 3.624 5.397 1.00 0.00 H new ATOM 0 HB3 LYS B 823 11.448 2.564 5.989 1.00 0.00 H new ATOM 0 HG2 LYS B 823 10.464 5.060 7.469 1.00 0.00 H new ATOM 0 HG3 LYS B 823 9.927 3.431 7.827 1.00 0.00 H new ATOM 0 HD2 LYS B 823 12.864 3.569 7.713 1.00 0.00 H new ATOM 0 HD3 LYS B 823 12.228 4.718 8.873 1.00 0.00 H new ATOM 0 HE2 LYS B 823 10.743 2.760 9.771 1.00 0.00 H new ATOM 0 HE3 LYS B 823 11.747 1.694 8.809 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 12.695 2.015 11.037 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 13.735 2.662 9.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 12.761 3.694 10.793 1.00 0.00 H new ATOM 2044 N ILE B 824 11.890 4.291 3.023 1.00 0.00 N ATOM 2045 CA ILE B 824 12.356 3.824 1.684 1.00 0.00 C ATOM 2046 C ILE B 824 13.538 4.677 1.223 1.00 0.00 C ATOM 2047 O ILE B 824 14.507 4.178 0.684 1.00 0.00 O ATOM 2048 CB ILE B 824 11.157 3.972 0.742 1.00 0.00 C ATOM 2049 CG1 ILE B 824 10.740 5.436 0.616 1.00 0.00 C ATOM 2050 CG2 ILE B 824 9.988 3.158 1.290 1.00 0.00 C ATOM 2051 CD1 ILE B 824 9.557 5.528 -0.352 1.00 0.00 C ATOM 0 H ILE B 824 11.002 4.792 3.031 1.00 0.00 H new ATOM 0 HA ILE B 824 12.700 2.790 1.705 1.00 0.00 H new ATOM 0 HB ILE B 824 11.441 3.608 -0.245 1.00 0.00 H new ATOM 0 HG12 ILE B 824 10.462 5.835 1.591 1.00 0.00 H new ATOM 0 HG13 ILE B 824 11.574 6.036 0.252 1.00 0.00 H new ATOM 0 HG21 ILE B 824 9.131 3.259 0.624 1.00 0.00 H new ATOM 0 HG22 ILE B 824 10.275 2.108 1.356 1.00 0.00 H new ATOM 0 HG23 ILE B 824 9.722 3.525 2.282 1.00 0.00 H new ATOM 0 HD11 ILE B 824 9.248 6.569 -0.452 1.00 0.00 H new ATOM 0 HD12 ILE B 824 9.854 5.143 -1.327 1.00 0.00 H new ATOM 0 HD13 ILE B 824 8.725 4.938 0.033 1.00 0.00 H new ATOM 2063 N LYS B 825 13.493 5.957 1.459 1.00 0.00 N ATOM 2064 CA LYS B 825 14.664 6.797 1.105 1.00 0.00 C ATOM 2065 C LYS B 825 15.815 6.380 2.003 1.00 0.00 C ATOM 2066 O LYS B 825 16.960 6.314 1.603 1.00 0.00 O ATOM 2067 CB LYS B 825 14.242 8.232 1.401 1.00 0.00 C ATOM 2068 CG LYS B 825 15.246 9.181 0.756 1.00 0.00 C ATOM 2069 CD LYS B 825 16.162 9.764 1.834 1.00 0.00 C ATOM 2070 CE LYS B 825 17.556 9.988 1.247 1.00 0.00 C ATOM 2071 NZ LYS B 825 18.386 10.442 2.397 1.00 0.00 N ATOM 0 H LYS B 825 12.705 6.452 1.877 1.00 0.00 H new ATOM 0 HA LYS B 825 14.976 6.695 0.066 1.00 0.00 H new ATOM 0 HB2 LYS B 825 13.241 8.419 1.012 1.00 0.00 H new ATOM 0 HB3 LYS B 825 14.202 8.399 2.477 1.00 0.00 H new ATOM 0 HG2 LYS B 825 15.837 8.650 0.010 1.00 0.00 H new ATOM 0 HG3 LYS B 825 14.722 9.983 0.236 1.00 0.00 H new ATOM 0 HD2 LYS B 825 15.755 10.705 2.203 1.00 0.00 H new ATOM 0 HD3 LYS B 825 16.218 9.086 2.685 1.00 0.00 H new ATOM 0 HE2 LYS B 825 17.953 9.072 0.810 1.00 0.00 H new ATOM 0 HE3 LYS B 825 17.536 10.736 0.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 19.359 10.617 2.075 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 17.987 11.319 2.788 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 18.392 9.707 3.133 1.00 0.00 H new ATOM 2085 N GLU B 826 15.482 6.044 3.212 1.00 0.00 N ATOM 2086 CA GLU B 826 16.494 5.545 4.173 1.00 0.00 C ATOM 2087 C GLU B 826 16.898 4.122 3.784 1.00 0.00 C ATOM 2088 O GLU B 826 18.000 3.679 4.041 1.00 0.00 O ATOM 2089 CB GLU B 826 15.753 5.543 5.511 1.00 0.00 C ATOM 2090 CG GLU B 826 15.823 6.938 6.138 1.00 0.00 C ATOM 2091 CD GLU B 826 16.698 6.890 7.393 1.00 0.00 C ATOM 2092 OE1 GLU B 826 16.275 6.283 8.363 1.00 0.00 O ATOM 2093 OE2 GLU B 826 17.777 7.459 7.361 1.00 0.00 O ATOM 0 H GLU B 826 14.533 6.095 3.581 1.00 0.00 H new ATOM 0 HA GLU B 826 17.404 6.144 4.201 1.00 0.00 H new ATOM 0 HB2 GLU B 826 14.713 5.252 5.362 1.00 0.00 H new ATOM 0 HB3 GLU B 826 16.197 4.808 6.183 1.00 0.00 H new ATOM 0 HG2 GLU B 826 16.234 7.650 5.422 1.00 0.00 H new ATOM 0 HG3 GLU B 826 14.821 7.284 6.393 1.00 0.00 H new ATOM 2100 N ALA B 827 16.003 3.414 3.152 1.00 0.00 N ATOM 2101 CA ALA B 827 16.298 2.022 2.719 1.00 0.00 C ATOM 2102 C ALA B 827 16.930 2.014 1.327 1.00 0.00 C ATOM 2103 O ALA B 827 17.132 0.970 0.738 1.00 0.00 O ATOM 2104 CB ALA B 827 14.930 1.334 2.673 1.00 0.00 C ATOM 0 H ALA B 827 15.068 3.747 2.915 1.00 0.00 H new ATOM 0 HA ALA B 827 16.998 1.525 3.390 1.00 0.00 H new ATOM 0 HB1 ALA B 827 15.055 0.297 2.361 1.00 0.00 H new ATOM 0 HB2 ALA B 827 14.475 1.363 3.663 1.00 0.00 H new ATOM 0 HB3 ALA B 827 14.286 1.852 1.962 1.00 0.00 H new ATOM 2110 N GLY B 828 17.219 3.163 0.776 1.00 0.00 N ATOM 2111 CA GLY B 828 17.775 3.195 -0.600 1.00 0.00 C ATOM 2112 C GLY B 828 16.722 2.638 -1.559 1.00 0.00 C ATOM 2113 O GLY B 828 17.036 2.147 -2.626 1.00 0.00 O ATOM 0 H GLY B 828 17.094 4.073 1.219 1.00 0.00 H new ATOM 0 HA2 GLY B 828 18.040 4.215 -0.878 1.00 0.00 H new ATOM 0 HA3 GLY B 828 18.688 2.603 -0.654 1.00 0.00 H new ATOM 2117 N LEU B 829 15.471 2.690 -1.175 1.00 0.00 N ATOM 2118 CA LEU B 829 14.397 2.168 -2.053 1.00 0.00 C ATOM 2119 C LEU B 829 14.124 3.164 -3.169 1.00 0.00 C ATOM 2120 O LEU B 829 13.988 2.812 -4.324 1.00 0.00 O ATOM 2121 CB LEU B 829 13.181 2.079 -1.126 1.00 0.00 C ATOM 2122 CG LEU B 829 13.043 0.680 -0.519 1.00 0.00 C ATOM 2123 CD1 LEU B 829 12.521 -0.294 -1.575 1.00 0.00 C ATOM 2124 CD2 LEU B 829 14.377 0.174 0.018 1.00 0.00 C ATOM 0 H LEU B 829 15.153 3.075 -0.286 1.00 0.00 H new ATOM 0 HA LEU B 829 14.647 1.215 -2.519 1.00 0.00 H new ATOM 0 HB2 LEU B 829 13.275 2.816 -0.328 1.00 0.00 H new ATOM 0 HB3 LEU B 829 12.278 2.326 -1.684 1.00 0.00 H new ATOM 0 HG LEU B 829 12.339 0.743 0.311 1.00 0.00 H new ATOM 0 HD11 LEU B 829 12.425 -1.288 -1.138 1.00 0.00 H new ATOM 0 HD12 LEU B 829 11.547 0.042 -1.930 1.00 0.00 H new ATOM 0 HD13 LEU B 829 13.219 -0.332 -2.412 1.00 0.00 H new ATOM 0 HD21 LEU B 829 14.245 -0.821 0.442 1.00 0.00 H new ATOM 0 HD22 LEU B 829 15.103 0.129 -0.794 1.00 0.00 H new ATOM 0 HD23 LEU B 829 14.739 0.852 0.791 1.00 0.00 H new ATOM 2136 N ILE B 830 14.046 4.413 -2.819 1.00 0.00 N ATOM 2137 CA ILE B 830 13.765 5.461 -3.834 1.00 0.00 C ATOM 2138 C ILE B 830 15.071 6.104 -4.310 1.00 0.00 C ATOM 2139 O ILE B 830 15.132 6.698 -5.368 1.00 0.00 O ATOM 2140 CB ILE B 830 12.900 6.483 -3.091 1.00 0.00 C ATOM 2141 CG1 ILE B 830 11.691 5.780 -2.467 1.00 0.00 C ATOM 2142 CG2 ILE B 830 12.418 7.552 -4.068 1.00 0.00 C ATOM 2143 CD1 ILE B 830 10.821 5.166 -3.569 1.00 0.00 C ATOM 0 H ILE B 830 14.166 4.756 -1.866 1.00 0.00 H new ATOM 0 HA ILE B 830 13.271 5.066 -4.722 1.00 0.00 H new ATOM 0 HB ILE B 830 13.492 6.950 -2.304 1.00 0.00 H new ATOM 0 HG12 ILE B 830 12.026 5.003 -1.780 1.00 0.00 H new ATOM 0 HG13 ILE B 830 11.106 6.491 -1.884 1.00 0.00 H new ATOM 0 HG21 ILE B 830 11.802 8.279 -3.538 1.00 0.00 H new ATOM 0 HG22 ILE B 830 13.278 8.057 -4.508 1.00 0.00 H new ATOM 0 HG23 ILE B 830 11.829 7.085 -4.857 1.00 0.00 H new ATOM 0 HD11 ILE B 830 9.962 4.667 -3.119 1.00 0.00 H new ATOM 0 HD12 ILE B 830 10.474 5.952 -4.239 1.00 0.00 H new ATOM 0 HD13 ILE B 830 11.407 4.441 -4.134 1.00 0.00 H new