USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=27 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= -2.46 K(o=-4.6,f=-6.8!) USER MOD Set 1.2: B 818 LYS NZ :NH3+ 179:sc= -2.12 (180deg=0) USER MOD Set 2.1: B 798 ASN : amide:sc= -9.72! C(o=-10!,f=-13!) USER MOD Set 2.2: B 799 CYS SG : rot 105:sc= -0.418 USER MOD Set 3.1: B 744 SER OG : rot -48:sc= 0.435 USER MOD Set 3.2: B 812 CYS SG : rot 74:sc= 0.963 USER MOD Single : B 727 GLN : amide:sc= -0.222 K(o=-0.22,f=-2.1!) USER MOD Single : B 729 TYR OH : rot 180:sc= 0 USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 64:sc= -0.174 USER MOD Single : B 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 737 GLN : amide:sc= -1.65 K(o=-1.6,f=-7.3!) USER MOD Single : B 738 GLN : amide:sc= -2.98! X(o=-3!,f=-2.9) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot -111:sc= 0.344 USER MOD Single : B 742 HIS : no HD1:sc= 0.67 K(o=0.67,f=-8.1!) USER MOD Single : B 743 GLN : amide:sc= -0.212 K(o=-0.21,f=-0.9) USER MOD Single : B 749 MET CE :methyl -161:sc= -2.83 (180deg=-4.93!) USER MOD Single : B 760 TYR OH : rot 180:sc= 0 USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl -169:sc= -1.96 (180deg=-2.44) USER MOD Single : B 771 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 772 THR OG1 : rot 180:sc= 0 USER MOD Single : B 773 MET CE :methyl 139:sc= -6.82! (180deg=-11.7!) USER MOD Single : B 774 SER OG : rot 100:sc= -1.47 USER MOD Single : B 778 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 779 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot 180:sc= 0 USER MOD Single : B 784 SER OG : rot -22:sc= 0.0664! USER MOD Single : B 785 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 786 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 789 MET CE :methyl -109:sc= -13.9! (180deg=-19.2!) USER MOD Single : B 793 GLN : amide:sc=-0.00989 X(o=-0.0099,f=-0.0042) USER MOD Single : B 797 THR OG1 : rot 180:sc= 0 USER MOD Single : B 800 LYS NZ :NH3+ -129:sc= 0.212 (180deg=0) USER MOD Single : B 802 TYR OH : rot 180:sc= 0 USER MOD Single : B 803 ASN : amide:sc= -4.28! C(o=-4.3!,f=-6.8!) USER MOD Single : B 807 SER OG : rot 180:sc= 0 USER MOD Single : B 809 TYR OH : rot 180:sc= 0 USER MOD Single : B 810 TYR OH : rot 180:sc= 0 USER MOD Single : B 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 822 SER OG : rot -56:sc= 1.06 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 -17.182 -0.151 -5.968 1.00 0.00 N ATOM 304 CA GLU B 721 -17.482 1.312 -5.932 1.00 0.00 C ATOM 305 C GLU B 721 -17.606 1.789 -4.479 1.00 0.00 C ATOM 306 O GLU B 721 -18.182 1.103 -3.657 1.00 0.00 O ATOM 307 CB GLU B 721 -18.823 1.466 -6.655 1.00 0.00 C ATOM 308 CG GLU B 721 -18.685 2.506 -7.769 1.00 0.00 C ATOM 309 CD GLU B 721 -20.068 3.055 -8.126 1.00 0.00 C ATOM 310 OE1 GLU B 721 -20.818 3.358 -7.213 1.00 0.00 O ATOM 311 OE2 GLU B 721 -20.354 3.163 -9.307 1.00 0.00 O ATOM 0 HA GLU B 721 -16.695 1.903 -6.401 1.00 0.00 H new ATOM 0 HB2 GLU B 721 -19.135 0.509 -7.073 1.00 0.00 H new ATOM 0 HB3 GLU B 721 -19.595 1.773 -5.950 1.00 0.00 H new ATOM 0 HG2 GLU B 721 -18.032 3.317 -7.446 1.00 0.00 H new ATOM 0 HG3 GLU B 721 -18.223 2.055 -8.647 1.00 0.00 H new ATOM 318 N PRO B 722 -17.083 2.962 -4.205 1.00 0.00 N ATOM 319 CA PRO B 722 -17.139 3.505 -2.828 1.00 0.00 C ATOM 320 C PRO B 722 -18.525 4.079 -2.509 1.00 0.00 C ATOM 321 O PRO B 722 -18.737 4.628 -1.448 1.00 0.00 O ATOM 322 CB PRO B 722 -16.100 4.625 -2.840 1.00 0.00 C ATOM 323 CG PRO B 722 -15.987 5.044 -4.272 1.00 0.00 C ATOM 324 CD PRO B 722 -16.360 3.856 -5.123 1.00 0.00 C ATOM 0 HA PRO B 722 -16.947 2.740 -2.075 1.00 0.00 H new ATOM 0 HB2 PRO B 722 -16.412 5.458 -2.210 1.00 0.00 H new ATOM 0 HB3 PRO B 722 -15.142 4.276 -2.455 1.00 0.00 H new ATOM 0 HG2 PRO B 722 -16.648 5.886 -4.478 1.00 0.00 H new ATOM 0 HG3 PRO B 722 -14.972 5.373 -4.496 1.00 0.00 H new ATOM 0 HD2 PRO B 722 -16.986 4.151 -5.965 1.00 0.00 H new ATOM 0 HD3 PRO B 722 -15.476 3.370 -5.537 1.00 0.00 H new ATOM 332 N ARG B 723 -19.464 3.970 -3.416 1.00 0.00 N ATOM 333 CA ARG B 723 -20.824 4.533 -3.163 1.00 0.00 C ATOM 334 C ARG B 723 -20.719 6.021 -2.799 1.00 0.00 C ATOM 335 O ARG B 723 -20.771 6.879 -3.658 1.00 0.00 O ATOM 336 CB ARG B 723 -21.390 3.717 -1.996 1.00 0.00 C ATOM 337 CG ARG B 723 -21.820 2.337 -2.495 1.00 0.00 C ATOM 338 CD ARG B 723 -20.717 1.321 -2.193 1.00 0.00 C ATOM 339 NE ARG B 723 -21.388 0.251 -1.397 1.00 0.00 N ATOM 340 CZ ARG B 723 -22.282 -0.539 -1.946 1.00 0.00 C ATOM 341 NH1 ARG B 723 -22.614 -0.409 -3.207 1.00 0.00 N ATOM 342 NH2 ARG B 723 -22.851 -1.467 -1.225 1.00 0.00 N ATOM 0 H ARG B 723 -19.346 3.515 -4.321 1.00 0.00 H new ATOM 0 HA ARG B 723 -21.469 4.470 -4.040 1.00 0.00 H new ATOM 0 HB2 ARG B 723 -20.639 3.614 -1.213 1.00 0.00 H new ATOM 0 HB3 ARG B 723 -22.241 4.236 -1.555 1.00 0.00 H new ATOM 0 HG2 ARG B 723 -22.749 2.036 -2.011 1.00 0.00 H new ATOM 0 HG3 ARG B 723 -22.015 2.370 -3.567 1.00 0.00 H new ATOM 0 HD2 ARG B 723 -20.287 0.920 -3.111 1.00 0.00 H new ATOM 0 HD3 ARG B 723 -19.902 1.778 -1.632 1.00 0.00 H new ATOM 0 HE ARG B 723 -21.149 0.132 -0.413 1.00 0.00 H new ATOM 0 HH11 ARG B 723 -22.176 0.314 -3.778 1.00 0.00 H new ATOM 0 HH12 ARG B 723 -23.310 -1.031 -3.618 1.00 0.00 H new ATOM 0 HH21 ARG B 723 -22.600 -1.575 -0.242 1.00 0.00 H new ATOM 0 HH22 ARG B 723 -23.546 -2.084 -1.645 1.00 0.00 H new ATOM 356 N ASP B 724 -20.565 6.338 -1.541 1.00 0.00 N ATOM 357 CA ASP B 724 -20.422 7.766 -1.146 1.00 0.00 C ATOM 358 C ASP B 724 -18.975 8.043 -0.720 1.00 0.00 C ATOM 359 O ASP B 724 -18.321 7.178 -0.170 1.00 0.00 O ATOM 360 CB ASP B 724 -21.375 7.947 0.038 1.00 0.00 C ATOM 361 CG ASP B 724 -22.817 7.989 -0.472 1.00 0.00 C ATOM 362 OD1 ASP B 724 -23.272 9.067 -0.816 1.00 0.00 O ATOM 363 OD2 ASP B 724 -23.442 6.942 -0.509 1.00 0.00 O ATOM 0 H ASP B 724 -20.532 5.669 -0.772 1.00 0.00 H new ATOM 0 HA ASP B 724 -20.655 8.451 -1.961 1.00 0.00 H new ATOM 0 HB2 ASP B 724 -21.252 7.128 0.747 1.00 0.00 H new ATOM 0 HB3 ASP B 724 -21.139 8.868 0.571 1.00 0.00 H new ATOM 368 N PRO B 725 -18.507 9.233 -1.005 1.00 0.00 N ATOM 369 CA PRO B 725 -17.114 9.596 -0.650 1.00 0.00 C ATOM 370 C PRO B 725 -16.896 9.483 0.861 1.00 0.00 C ATOM 371 O PRO B 725 -16.051 8.740 1.320 1.00 0.00 O ATOM 372 CB PRO B 725 -16.976 11.053 -1.106 1.00 0.00 C ATOM 373 CG PRO B 725 -18.371 11.538 -1.353 1.00 0.00 C ATOM 374 CD PRO B 725 -19.214 10.334 -1.668 1.00 0.00 C ATOM 0 HA PRO B 725 -16.380 8.940 -1.117 1.00 0.00 H new ATOM 0 HB2 PRO B 725 -16.482 11.656 -0.344 1.00 0.00 H new ATOM 0 HB3 PRO B 725 -16.372 11.124 -2.010 1.00 0.00 H new ATOM 0 HG2 PRO B 725 -18.757 12.059 -0.477 1.00 0.00 H new ATOM 0 HG3 PRO B 725 -18.390 12.248 -2.180 1.00 0.00 H new ATOM 0 HD2 PRO B 725 -20.229 10.445 -1.287 1.00 0.00 H new ATOM 0 HD3 PRO B 725 -19.293 10.170 -2.743 1.00 0.00 H new ATOM 382 N ASP B 726 -17.652 10.211 1.637 1.00 0.00 N ATOM 383 CA ASP B 726 -17.489 10.141 3.119 1.00 0.00 C ATOM 384 C ASP B 726 -17.541 8.688 3.592 1.00 0.00 C ATOM 385 O ASP B 726 -16.791 8.279 4.456 1.00 0.00 O ATOM 386 CB ASP B 726 -18.678 10.926 3.678 1.00 0.00 C ATOM 387 CG ASP B 726 -18.224 11.753 4.883 1.00 0.00 C ATOM 388 OD1 ASP B 726 -18.110 11.185 5.957 1.00 0.00 O ATOM 389 OD2 ASP B 726 -18.003 12.940 4.713 1.00 0.00 O ATOM 0 H ASP B 726 -18.375 10.851 1.310 1.00 0.00 H new ATOM 0 HA ASP B 726 -16.533 10.547 3.450 1.00 0.00 H new ATOM 0 HB2 ASP B 726 -19.089 11.580 2.909 1.00 0.00 H new ATOM 0 HB3 ASP B 726 -19.473 10.241 3.973 1.00 0.00 H new ATOM 394 N GLN B 727 -18.415 7.901 3.030 1.00 0.00 N ATOM 395 CA GLN B 727 -18.504 6.475 3.447 1.00 0.00 C ATOM 396 C GLN B 727 -17.148 5.789 3.269 1.00 0.00 C ATOM 397 O GLN B 727 -16.688 5.072 4.134 1.00 0.00 O ATOM 398 CB GLN B 727 -19.544 5.857 2.513 1.00 0.00 C ATOM 399 CG GLN B 727 -20.130 4.600 3.161 1.00 0.00 C ATOM 400 CD GLN B 727 -20.983 4.998 4.367 1.00 0.00 C ATOM 401 OE1 GLN B 727 -21.339 6.149 4.521 1.00 0.00 O ATOM 402 NE2 GLN B 727 -21.329 4.087 5.235 1.00 0.00 N ATOM 0 H GLN B 727 -19.070 8.183 2.301 1.00 0.00 H new ATOM 0 HA GLN B 727 -18.780 6.365 4.496 1.00 0.00 H new ATOM 0 HB2 GLN B 727 -20.337 6.576 2.308 1.00 0.00 H new ATOM 0 HB3 GLN B 727 -19.086 5.606 1.556 1.00 0.00 H new ATOM 0 HG2 GLN B 727 -20.736 4.054 2.438 1.00 0.00 H new ATOM 0 HG3 GLN B 727 -19.328 3.932 3.474 1.00 0.00 H new ATOM 0 HE21 GLN B 727 -21.030 3.120 5.106 1.00 0.00 H new ATOM 0 HE22 GLN B 727 -21.898 4.342 6.042 1.00 0.00 H new ATOM 411 N LEU B 728 -16.498 6.012 2.158 1.00 0.00 N ATOM 412 CA LEU B 728 -15.170 5.375 1.935 1.00 0.00 C ATOM 413 C LEU B 728 -14.079 6.106 2.719 1.00 0.00 C ATOM 414 O LEU B 728 -13.061 5.537 3.049 1.00 0.00 O ATOM 415 CB LEU B 728 -14.911 5.473 0.443 1.00 0.00 C ATOM 416 CG LEU B 728 -14.174 4.207 0.017 1.00 0.00 C ATOM 417 CD1 LEU B 728 -15.179 3.136 -0.408 1.00 0.00 C ATOM 418 CD2 LEU B 728 -13.223 4.535 -1.116 1.00 0.00 C ATOM 0 H LEU B 728 -16.829 6.606 1.398 1.00 0.00 H new ATOM 0 HA LEU B 728 -15.162 4.340 2.277 1.00 0.00 H new ATOM 0 HB2 LEU B 728 -15.849 5.571 -0.103 1.00 0.00 H new ATOM 0 HB3 LEU B 728 -14.316 6.357 0.215 1.00 0.00 H new ATOM 0 HG LEU B 728 -13.597 3.818 0.856 1.00 0.00 H new ATOM 0 HD11 LEU B 728 -14.645 2.235 -0.711 1.00 0.00 H new ATOM 0 HD12 LEU B 728 -15.838 2.903 0.428 1.00 0.00 H new ATOM 0 HD13 LEU B 728 -15.772 3.505 -1.245 1.00 0.00 H new ATOM 0 HD21 LEU B 728 -12.696 3.631 -1.421 1.00 0.00 H new ATOM 0 HD22 LEU B 728 -13.787 4.930 -1.961 1.00 0.00 H new ATOM 0 HD23 LEU B 728 -12.502 5.280 -0.781 1.00 0.00 H new ATOM 430 N TYR B 729 -14.286 7.358 3.036 1.00 0.00 N ATOM 431 CA TYR B 729 -13.251 8.118 3.802 1.00 0.00 C ATOM 432 C TYR B 729 -12.790 7.311 5.016 1.00 0.00 C ATOM 433 O TYR B 729 -11.623 6.999 5.165 1.00 0.00 O ATOM 434 CB TYR B 729 -13.957 9.398 4.254 1.00 0.00 C ATOM 435 CG TYR B 729 -13.010 10.225 5.090 1.00 0.00 C ATOM 436 CD1 TYR B 729 -12.836 9.930 6.448 1.00 0.00 C ATOM 437 CD2 TYR B 729 -12.305 11.285 4.509 1.00 0.00 C ATOM 438 CE1 TYR B 729 -11.958 10.695 7.224 1.00 0.00 C ATOM 439 CE2 TYR B 729 -11.427 12.051 5.285 1.00 0.00 C ATOM 440 CZ TYR B 729 -11.253 11.756 6.643 1.00 0.00 C ATOM 441 OH TYR B 729 -10.387 12.511 7.408 1.00 0.00 O ATOM 0 H TYR B 729 -15.125 7.887 2.798 1.00 0.00 H new ATOM 0 HA TYR B 729 -12.365 8.325 3.202 1.00 0.00 H new ATOM 0 HB2 TYR B 729 -14.288 9.970 3.387 1.00 0.00 H new ATOM 0 HB3 TYR B 729 -14.848 9.151 4.831 1.00 0.00 H new ATOM 0 HD1 TYR B 729 -13.380 9.112 6.897 1.00 0.00 H new ATOM 0 HD2 TYR B 729 -12.438 11.512 3.462 1.00 0.00 H new ATOM 0 HE1 TYR B 729 -11.824 10.467 8.271 1.00 0.00 H new ATOM 0 HE2 TYR B 729 -10.884 12.870 4.836 1.00 0.00 H new ATOM 0 HH TYR B 729 -9.979 13.206 6.850 1.00 0.00 H new ATOM 451 N SER B 730 -13.704 6.940 5.865 1.00 0.00 N ATOM 452 CA SER B 730 -13.325 6.126 7.050 1.00 0.00 C ATOM 453 C SER B 730 -13.043 4.685 6.621 1.00 0.00 C ATOM 454 O SER B 730 -12.364 3.948 7.307 1.00 0.00 O ATOM 455 CB SER B 730 -14.531 6.201 7.987 1.00 0.00 C ATOM 456 OG SER B 730 -14.693 4.966 8.673 1.00 0.00 O ATOM 0 H SER B 730 -14.696 7.165 5.790 1.00 0.00 H new ATOM 0 HA SER B 730 -12.421 6.489 7.539 1.00 0.00 H new ATOM 0 HB2 SER B 730 -14.394 7.010 8.705 1.00 0.00 H new ATOM 0 HB3 SER B 730 -15.431 6.430 7.417 1.00 0.00 H new ATOM 0 HG SER B 730 -15.467 5.024 9.272 1.00 0.00 H new ATOM 462 N THR B 731 -13.549 4.277 5.487 1.00 0.00 N ATOM 463 CA THR B 731 -13.269 2.895 5.011 1.00 0.00 C ATOM 464 C THR B 731 -11.779 2.753 4.721 1.00 0.00 C ATOM 465 O THR B 731 -11.093 1.948 5.319 1.00 0.00 O ATOM 466 CB THR B 731 -14.069 2.736 3.721 1.00 0.00 C ATOM 467 OG1 THR B 731 -15.441 2.997 3.975 1.00 0.00 O ATOM 468 CG2 THR B 731 -13.908 1.306 3.203 1.00 0.00 C ATOM 0 H THR B 731 -14.140 4.839 4.875 1.00 0.00 H new ATOM 0 HA THR B 731 -13.542 2.141 5.749 1.00 0.00 H new ATOM 0 HB THR B 731 -13.702 3.440 2.975 1.00 0.00 H new ATOM 0 HG1 THR B 731 -15.551 3.931 4.252 1.00 0.00 H new ATOM 0 HG21 THR B 731 -14.478 1.187 2.281 1.00 0.00 H new ATOM 0 HG22 THR B 731 -12.854 1.106 3.007 1.00 0.00 H new ATOM 0 HG23 THR B 731 -14.277 0.604 3.951 1.00 0.00 H new ATOM 476 N LEU B 732 -11.265 3.545 3.817 1.00 0.00 N ATOM 477 CA LEU B 732 -9.803 3.489 3.534 1.00 0.00 C ATOM 478 C LEU B 732 -9.055 3.752 4.839 1.00 0.00 C ATOM 479 O LEU B 732 -8.077 3.104 5.155 1.00 0.00 O ATOM 480 CB LEU B 732 -9.517 4.604 2.510 1.00 0.00 C ATOM 481 CG LEU B 732 -10.549 4.606 1.361 1.00 0.00 C ATOM 482 CD1 LEU B 732 -9.989 5.415 0.191 1.00 0.00 C ATOM 483 CD2 LEU B 732 -10.853 3.180 0.883 1.00 0.00 C ATOM 0 H LEU B 732 -11.791 4.223 3.266 1.00 0.00 H new ATOM 0 HA LEU B 732 -9.487 2.523 3.141 1.00 0.00 H new ATOM 0 HB2 LEU B 732 -9.531 5.571 3.012 1.00 0.00 H new ATOM 0 HB3 LEU B 732 -8.516 4.472 2.099 1.00 0.00 H new ATOM 0 HG LEU B 732 -11.474 5.050 1.729 1.00 0.00 H new ATOM 0 HD11 LEU B 732 -10.711 5.422 -0.625 1.00 0.00 H new ATOM 0 HD12 LEU B 732 -9.797 6.438 0.515 1.00 0.00 H new ATOM 0 HD13 LEU B 732 -9.058 4.963 -0.152 1.00 0.00 H new ATOM 0 HD21 LEU B 732 -11.583 3.215 0.074 1.00 0.00 H new ATOM 0 HD22 LEU B 732 -9.936 2.713 0.524 1.00 0.00 H new ATOM 0 HD23 LEU B 732 -11.257 2.597 1.711 1.00 0.00 H new ATOM 495 N LYS B 733 -9.561 4.660 5.629 1.00 0.00 N ATOM 496 CA LYS B 733 -8.950 4.918 6.960 1.00 0.00 C ATOM 497 C LYS B 733 -9.028 3.649 7.794 1.00 0.00 C ATOM 498 O LYS B 733 -8.154 3.352 8.578 1.00 0.00 O ATOM 499 CB LYS B 733 -9.827 5.998 7.583 1.00 0.00 C ATOM 500 CG LYS B 733 -9.030 7.290 7.719 1.00 0.00 C ATOM 501 CD LYS B 733 -8.336 7.324 9.082 1.00 0.00 C ATOM 502 CE LYS B 733 -7.133 8.266 9.015 1.00 0.00 C ATOM 503 NZ LYS B 733 -6.006 7.489 9.603 1.00 0.00 N ATOM 0 H LYS B 733 -10.374 5.235 5.407 1.00 0.00 H new ATOM 0 HA LYS B 733 -7.905 5.220 6.897 1.00 0.00 H new ATOM 0 HB2 LYS B 733 -10.708 6.166 6.964 1.00 0.00 H new ATOM 0 HB3 LYS B 733 -10.181 5.673 8.561 1.00 0.00 H new ATOM 0 HG2 LYS B 733 -8.290 7.359 6.921 1.00 0.00 H new ATOM 0 HG3 LYS B 733 -9.692 8.150 7.615 1.00 0.00 H new ATOM 0 HD2 LYS B 733 -9.033 7.660 9.849 1.00 0.00 H new ATOM 0 HD3 LYS B 733 -8.012 6.322 9.363 1.00 0.00 H new ATOM 0 HE2 LYS B 733 -6.917 8.559 7.988 1.00 0.00 H new ATOM 0 HE3 LYS B 733 -7.317 9.182 9.576 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 -5.142 8.068 9.593 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 -6.237 7.229 10.583 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 -5.850 6.626 9.044 1.00 0.00 H new ATOM 517 N SER B 734 -10.090 2.907 7.629 1.00 0.00 N ATOM 518 CA SER B 734 -10.250 1.634 8.385 1.00 0.00 C ATOM 519 C SER B 734 -9.268 0.589 7.853 1.00 0.00 C ATOM 520 O SER B 734 -8.395 0.129 8.561 1.00 0.00 O ATOM 521 CB SER B 734 -11.692 1.196 8.123 1.00 0.00 C ATOM 522 OG SER B 734 -12.469 1.399 9.294 1.00 0.00 O ATOM 0 H SER B 734 -10.859 3.131 6.997 1.00 0.00 H new ATOM 0 HA SER B 734 -10.050 1.753 9.450 1.00 0.00 H new ATOM 0 HB2 SER B 734 -12.111 1.765 7.293 1.00 0.00 H new ATOM 0 HB3 SER B 734 -11.717 0.145 7.835 1.00 0.00 H new ATOM 0 HG SER B 734 -13.393 1.120 9.126 1.00 0.00 H new ATOM 528 N ILE B 735 -9.379 0.228 6.599 1.00 0.00 N ATOM 529 CA ILE B 735 -8.413 -0.754 6.028 1.00 0.00 C ATOM 530 C ILE B 735 -6.984 -0.273 6.297 1.00 0.00 C ATOM 531 O ILE B 735 -6.097 -1.045 6.604 1.00 0.00 O ATOM 532 CB ILE B 735 -8.691 -0.768 4.521 1.00 0.00 C ATOM 533 CG1 ILE B 735 -10.132 -1.217 4.261 1.00 0.00 C ATOM 534 CG2 ILE B 735 -7.725 -1.738 3.836 1.00 0.00 C ATOM 535 CD1 ILE B 735 -10.887 -0.104 3.538 1.00 0.00 C ATOM 0 H ILE B 735 -10.091 0.568 5.953 1.00 0.00 H new ATOM 0 HA ILE B 735 -8.520 -1.747 6.466 1.00 0.00 H new ATOM 0 HB ILE B 735 -8.551 0.236 4.120 1.00 0.00 H new ATOM 0 HG12 ILE B 735 -10.138 -2.126 3.660 1.00 0.00 H new ATOM 0 HG13 ILE B 735 -10.626 -1.454 5.203 1.00 0.00 H new ATOM 0 HG21 ILE B 735 -7.921 -1.750 2.764 1.00 0.00 H new ATOM 0 HG22 ILE B 735 -6.699 -1.416 4.014 1.00 0.00 H new ATOM 0 HG23 ILE B 735 -7.867 -2.740 4.242 1.00 0.00 H new ATOM 0 HD11 ILE B 735 -11.913 -0.422 3.352 1.00 0.00 H new ATOM 0 HD12 ILE B 735 -10.892 0.794 4.156 1.00 0.00 H new ATOM 0 HD13 ILE B 735 -10.396 0.112 2.589 1.00 0.00 H new ATOM 547 N LEU B 736 -6.771 1.012 6.209 1.00 0.00 N ATOM 548 CA LEU B 736 -5.422 1.571 6.492 1.00 0.00 C ATOM 549 C LEU B 736 -5.161 1.514 7.994 1.00 0.00 C ATOM 550 O LEU B 736 -4.079 1.190 8.442 1.00 0.00 O ATOM 551 CB LEU B 736 -5.492 3.023 6.017 1.00 0.00 C ATOM 552 CG LEU B 736 -4.160 3.721 6.306 1.00 0.00 C ATOM 553 CD1 LEU B 736 -3.277 3.668 5.058 1.00 0.00 C ATOM 554 CD2 LEU B 736 -4.421 5.180 6.684 1.00 0.00 C ATOM 0 H LEU B 736 -7.478 1.700 5.952 1.00 0.00 H new ATOM 0 HA LEU B 736 -4.621 1.022 5.997 1.00 0.00 H new ATOM 0 HB2 LEU B 736 -5.708 3.057 4.949 1.00 0.00 H new ATOM 0 HB3 LEU B 736 -6.305 3.544 6.524 1.00 0.00 H new ATOM 0 HG LEU B 736 -3.656 3.217 7.130 1.00 0.00 H new ATOM 0 HD11 LEU B 736 -2.328 4.165 5.262 1.00 0.00 H new ATOM 0 HD12 LEU B 736 -3.092 2.629 4.787 1.00 0.00 H new ATOM 0 HD13 LEU B 736 -3.781 4.173 4.234 1.00 0.00 H new ATOM 0 HD21 LEU B 736 -3.473 5.678 6.890 1.00 0.00 H new ATOM 0 HD22 LEU B 736 -4.924 5.685 5.860 1.00 0.00 H new ATOM 0 HD23 LEU B 736 -5.052 5.219 7.572 1.00 0.00 H new ATOM 566 N GLN B 737 -6.166 1.804 8.771 1.00 0.00 N ATOM 567 CA GLN B 737 -6.010 1.765 10.252 1.00 0.00 C ATOM 568 C GLN B 737 -5.399 0.432 10.698 1.00 0.00 C ATOM 569 O GLN B 737 -4.441 0.398 11.443 1.00 0.00 O ATOM 570 CB GLN B 737 -7.433 1.898 10.796 1.00 0.00 C ATOM 571 CG GLN B 737 -7.633 3.300 11.375 1.00 0.00 C ATOM 572 CD GLN B 737 -6.619 3.539 12.496 1.00 0.00 C ATOM 573 OE1 GLN B 737 -5.796 2.690 12.778 1.00 0.00 O ATOM 574 NE2 GLN B 737 -6.646 4.665 13.154 1.00 0.00 N ATOM 0 H GLN B 737 -7.095 2.068 8.442 1.00 0.00 H new ATOM 0 HA GLN B 737 -5.348 2.552 10.613 1.00 0.00 H new ATOM 0 HB2 GLN B 737 -8.156 1.716 10.001 1.00 0.00 H new ATOM 0 HB3 GLN B 737 -7.610 1.147 11.566 1.00 0.00 H new ATOM 0 HG2 GLN B 737 -7.510 4.049 10.593 1.00 0.00 H new ATOM 0 HG3 GLN B 737 -8.648 3.405 11.759 1.00 0.00 H new ATOM 0 HE21 GLN B 737 -7.337 5.377 12.917 1.00 0.00 H new ATOM 0 HE22 GLN B 737 -5.977 4.833 13.905 1.00 0.00 H new ATOM 583 N GLN B 738 -5.959 -0.668 10.266 1.00 0.00 N ATOM 584 CA GLN B 738 -5.404 -1.991 10.677 1.00 0.00 C ATOM 585 C GLN B 738 -4.133 -2.297 9.884 1.00 0.00 C ATOM 586 O GLN B 738 -3.275 -3.035 10.325 1.00 0.00 O ATOM 587 CB GLN B 738 -6.501 -3.012 10.354 1.00 0.00 C ATOM 588 CG GLN B 738 -6.928 -2.873 8.891 1.00 0.00 C ATOM 589 CD GLN B 738 -7.199 -4.254 8.303 1.00 0.00 C ATOM 590 OE1 GLN B 738 -7.554 -5.173 9.015 1.00 0.00 O ATOM 591 NE2 GLN B 738 -7.043 -4.443 7.023 1.00 0.00 N ATOM 0 H GLN B 738 -6.771 -0.708 9.650 1.00 0.00 H new ATOM 0 HA GLN B 738 -5.135 -2.012 11.733 1.00 0.00 H new ATOM 0 HB2 GLN B 738 -6.136 -4.022 10.541 1.00 0.00 H new ATOM 0 HB3 GLN B 738 -7.359 -2.857 11.009 1.00 0.00 H new ATOM 0 HG2 GLN B 738 -7.823 -2.255 8.820 1.00 0.00 H new ATOM 0 HG3 GLN B 738 -6.147 -2.370 8.320 1.00 0.00 H new ATOM 0 HE21 GLN B 738 -6.745 -3.671 6.426 1.00 0.00 H new ATOM 0 HE22 GLN B 738 -7.219 -5.363 6.618 1.00 0.00 H new ATOM 600 N VAL B 739 -3.998 -1.717 8.725 1.00 0.00 N ATOM 601 CA VAL B 739 -2.777 -1.953 7.908 1.00 0.00 C ATOM 602 C VAL B 739 -1.559 -1.324 8.600 1.00 0.00 C ATOM 603 O VAL B 739 -0.711 -2.012 9.129 1.00 0.00 O ATOM 604 CB VAL B 739 -3.101 -1.279 6.562 1.00 0.00 C ATOM 605 CG1 VAL B 739 -1.827 -0.879 5.811 1.00 0.00 C ATOM 606 CG2 VAL B 739 -3.901 -2.255 5.695 1.00 0.00 C ATOM 0 H VAL B 739 -4.683 -1.088 8.307 1.00 0.00 H new ATOM 0 HA VAL B 739 -2.528 -3.006 7.777 1.00 0.00 H new ATOM 0 HB VAL B 739 -3.677 -0.376 6.764 1.00 0.00 H new ATOM 0 HG11 VAL B 739 -2.095 -0.406 4.866 1.00 0.00 H new ATOM 0 HG12 VAL B 739 -1.252 -0.179 6.417 1.00 0.00 H new ATOM 0 HG13 VAL B 739 -1.226 -1.767 5.615 1.00 0.00 H new ATOM 0 HG21 VAL B 739 -4.135 -1.785 4.740 1.00 0.00 H new ATOM 0 HG22 VAL B 739 -3.312 -3.155 5.522 1.00 0.00 H new ATOM 0 HG23 VAL B 739 -4.827 -2.520 6.205 1.00 0.00 H new ATOM 616 N LYS B 740 -1.471 -0.025 8.604 1.00 0.00 N ATOM 617 CA LYS B 740 -0.303 0.643 9.246 1.00 0.00 C ATOM 618 C LYS B 740 -0.054 0.090 10.652 1.00 0.00 C ATOM 619 O LYS B 740 1.046 0.148 11.162 1.00 0.00 O ATOM 620 CB LYS B 740 -0.699 2.114 9.314 1.00 0.00 C ATOM 621 CG LYS B 740 0.560 2.979 9.395 1.00 0.00 C ATOM 622 CD LYS B 740 0.793 3.403 10.846 1.00 0.00 C ATOM 623 CE LYS B 740 -0.146 4.559 11.195 1.00 0.00 C ATOM 624 NZ LYS B 740 0.235 4.954 12.580 1.00 0.00 N ATOM 0 H LYS B 740 -2.158 0.606 8.190 1.00 0.00 H new ATOM 0 HA LYS B 740 0.619 0.480 8.689 1.00 0.00 H new ATOM 0 HB2 LYS B 740 -1.283 2.385 8.435 1.00 0.00 H new ATOM 0 HB3 LYS B 740 -1.331 2.291 10.184 1.00 0.00 H new ATOM 0 HG2 LYS B 740 1.421 2.423 9.024 1.00 0.00 H new ATOM 0 HG3 LYS B 740 0.452 3.859 8.761 1.00 0.00 H new ATOM 0 HD2 LYS B 740 0.616 2.561 11.515 1.00 0.00 H new ATOM 0 HD3 LYS B 740 1.830 3.708 10.985 1.00 0.00 H new ATOM 0 HE2 LYS B 740 -0.026 5.390 10.500 1.00 0.00 H new ATOM 0 HE3 LYS B 740 -1.190 4.250 11.145 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 -0.365 5.744 12.893 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 0.104 4.145 13.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 1.232 5.250 12.595 1.00 0.00 H new ATOM 638 N SER B 741 -1.061 -0.448 11.282 1.00 0.00 N ATOM 639 CA SER B 741 -0.865 -1.011 12.648 1.00 0.00 C ATOM 640 C SER B 741 -0.783 -2.539 12.589 1.00 0.00 C ATOM 641 O SER B 741 -0.933 -3.215 13.588 1.00 0.00 O ATOM 642 CB SER B 741 -2.101 -0.574 13.437 1.00 0.00 C ATOM 643 OG SER B 741 -3.192 -1.424 13.117 1.00 0.00 O ATOM 0 H SER B 741 -2.009 -0.522 10.912 1.00 0.00 H new ATOM 0 HA SER B 741 0.060 -0.662 13.107 1.00 0.00 H new ATOM 0 HB2 SER B 741 -1.896 -0.615 14.507 1.00 0.00 H new ATOM 0 HB3 SER B 741 -2.350 0.460 13.200 1.00 0.00 H new ATOM 0 HG SER B 741 -3.861 -0.920 12.608 1.00 0.00 H new ATOM 649 N HIS B 742 -0.551 -3.092 11.428 1.00 0.00 N ATOM 650 CA HIS B 742 -0.467 -4.575 11.311 1.00 0.00 C ATOM 651 C HIS B 742 0.910 -5.074 11.754 1.00 0.00 C ATOM 652 O HIS B 742 1.836 -4.307 11.926 1.00 0.00 O ATOM 653 CB HIS B 742 -0.682 -4.865 9.825 1.00 0.00 C ATOM 654 CG HIS B 742 -1.372 -6.193 9.666 1.00 0.00 C ATOM 655 ND1 HIS B 742 -0.691 -7.398 9.752 1.00 0.00 N ATOM 656 CD2 HIS B 742 -2.683 -6.521 9.426 1.00 0.00 C ATOM 657 CE1 HIS B 742 -1.587 -8.384 9.567 1.00 0.00 C ATOM 658 NE2 HIS B 742 -2.816 -7.905 9.364 1.00 0.00 N ATOM 0 H HIS B 742 -0.416 -2.580 10.556 1.00 0.00 H new ATOM 0 HA HIS B 742 -1.201 -5.076 11.942 1.00 0.00 H new ATOM 0 HB2 HIS B 742 -1.282 -4.075 9.373 1.00 0.00 H new ATOM 0 HB3 HIS B 742 0.275 -4.876 9.304 1.00 0.00 H new ATOM 0 HD2 HIS B 742 -3.489 -5.813 9.304 1.00 0.00 H new ATOM 0 HE1 HIS B 742 -1.342 -9.436 9.581 1.00 0.00 H new ATOM 0 HE2 HIS B 742 -3.669 -8.439 9.199 1.00 0.00 H new ATOM 666 N GLN B 743 1.052 -6.359 11.927 1.00 0.00 N ATOM 667 CA GLN B 743 2.365 -6.924 12.350 1.00 0.00 C ATOM 668 C GLN B 743 3.322 -7.044 11.161 1.00 0.00 C ATOM 669 O GLN B 743 4.477 -7.386 11.316 1.00 0.00 O ATOM 670 CB GLN B 743 2.018 -8.309 12.883 1.00 0.00 C ATOM 671 CG GLN B 743 3.167 -8.832 13.748 1.00 0.00 C ATOM 672 CD GLN B 743 2.696 -8.962 15.198 1.00 0.00 C ATOM 673 OE1 GLN B 743 1.575 -9.357 15.452 1.00 0.00 O ATOM 674 NE2 GLN B 743 3.511 -8.645 16.167 1.00 0.00 N ATOM 0 H GLN B 743 0.310 -7.046 11.793 1.00 0.00 H new ATOM 0 HA GLN B 743 2.865 -6.294 13.086 1.00 0.00 H new ATOM 0 HB2 GLN B 743 1.100 -8.264 13.469 1.00 0.00 H new ATOM 0 HB3 GLN B 743 1.834 -8.992 12.054 1.00 0.00 H new ATOM 0 HG2 GLN B 743 3.505 -9.799 13.376 1.00 0.00 H new ATOM 0 HG3 GLN B 743 4.018 -8.153 13.690 1.00 0.00 H new ATOM 0 HE21 GLN B 743 4.452 -8.313 15.954 1.00 0.00 H new ATOM 0 HE22 GLN B 743 3.207 -8.729 17.137 1.00 0.00 H new ATOM 683 N SER B 744 2.845 -6.804 9.971 1.00 0.00 N ATOM 684 CA SER B 744 3.734 -6.880 8.784 1.00 0.00 C ATOM 685 C SER B 744 3.640 -5.580 7.986 1.00 0.00 C ATOM 686 O SER B 744 4.086 -5.498 6.860 1.00 0.00 O ATOM 687 CB SER B 744 3.208 -8.057 7.959 1.00 0.00 C ATOM 688 OG SER B 744 4.088 -9.162 8.101 1.00 0.00 O ATOM 0 H SER B 744 1.875 -6.558 9.772 1.00 0.00 H new ATOM 0 HA SER B 744 4.780 -7.018 9.057 1.00 0.00 H new ATOM 0 HB2 SER B 744 2.207 -8.330 8.292 1.00 0.00 H new ATOM 0 HB3 SER B 744 3.129 -7.773 6.910 1.00 0.00 H new ATOM 0 HG SER B 744 5.011 -8.865 7.962 1.00 0.00 H new ATOM 694 N ALA B 745 3.052 -4.563 8.555 1.00 0.00 N ATOM 695 CA ALA B 745 2.959 -3.267 7.832 1.00 0.00 C ATOM 696 C ALA B 745 4.278 -2.500 7.939 1.00 0.00 C ATOM 697 O ALA B 745 4.427 -1.435 7.377 1.00 0.00 O ATOM 698 CB ALA B 745 1.844 -2.501 8.544 1.00 0.00 C ATOM 0 H ALA B 745 2.634 -4.575 9.485 1.00 0.00 H new ATOM 0 HA ALA B 745 2.756 -3.403 6.770 1.00 0.00 H new ATOM 0 HB1 ALA B 745 1.711 -1.529 8.070 1.00 0.00 H new ATOM 0 HB2 ALA B 745 0.915 -3.067 8.479 1.00 0.00 H new ATOM 0 HB3 ALA B 745 2.111 -2.360 9.592 1.00 0.00 H new ATOM 704 N TRP B 746 5.242 -3.028 8.648 1.00 0.00 N ATOM 705 CA TRP B 746 6.521 -2.289 8.810 1.00 0.00 C ATOM 706 C TRP B 746 7.178 -1.995 7.448 1.00 0.00 C ATOM 707 O TRP B 746 7.537 -0.864 7.187 1.00 0.00 O ATOM 708 CB TRP B 746 7.426 -3.189 9.654 1.00 0.00 C ATOM 709 CG TRP B 746 6.785 -3.543 10.965 1.00 0.00 C ATOM 710 CD1 TRP B 746 7.309 -4.429 11.843 1.00 0.00 C ATOM 711 CD2 TRP B 746 5.545 -3.052 11.577 1.00 0.00 C ATOM 712 NE1 TRP B 746 6.481 -4.520 12.944 1.00 0.00 N ATOM 713 CE2 TRP B 746 5.383 -3.695 12.831 1.00 0.00 C ATOM 714 CE3 TRP B 746 4.553 -2.130 11.182 1.00 0.00 C ATOM 715 CZ2 TRP B 746 4.288 -3.436 13.654 1.00 0.00 C ATOM 716 CZ3 TRP B 746 3.451 -1.870 12.011 1.00 0.00 C ATOM 717 CH2 TRP B 746 3.319 -2.519 13.244 1.00 0.00 C ATOM 0 H TRP B 746 5.196 -3.933 9.117 1.00 0.00 H new ATOM 0 HA TRP B 746 6.351 -1.323 9.287 1.00 0.00 H new ATOM 0 HB2 TRP B 746 7.652 -4.101 9.101 1.00 0.00 H new ATOM 0 HB3 TRP B 746 8.374 -2.684 9.837 1.00 0.00 H new ATOM 0 HD1 TRP B 746 8.229 -4.978 11.705 1.00 0.00 H new ATOM 0 HE1 TRP B 746 6.660 -5.125 13.745 1.00 0.00 H new ATOM 0 HE3 TRP B 746 4.642 -1.620 10.234 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 4.190 -3.942 14.603 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 2.698 -1.163 11.695 1.00 0.00 H new ATOM 0 HH2 TRP B 746 2.469 -2.311 13.877 1.00 0.00 H new ATOM 728 N PRO B 747 7.351 -3.010 6.621 1.00 0.00 N ATOM 729 CA PRO B 747 7.997 -2.786 5.300 1.00 0.00 C ATOM 730 C PRO B 747 7.167 -1.831 4.442 1.00 0.00 C ATOM 731 O PRO B 747 7.633 -1.314 3.447 1.00 0.00 O ATOM 732 CB PRO B 747 8.025 -4.174 4.657 1.00 0.00 C ATOM 733 CG PRO B 747 7.011 -4.974 5.408 1.00 0.00 C ATOM 734 CD PRO B 747 6.974 -4.422 6.805 1.00 0.00 C ATOM 0 HA PRO B 747 8.986 -2.339 5.396 1.00 0.00 H new ATOM 0 HB2 PRO B 747 7.779 -4.122 3.597 1.00 0.00 H new ATOM 0 HB3 PRO B 747 9.015 -4.623 4.732 1.00 0.00 H new ATOM 0 HG2 PRO B 747 6.031 -4.898 4.936 1.00 0.00 H new ATOM 0 HG3 PRO B 747 7.280 -6.030 5.416 1.00 0.00 H new ATOM 0 HD2 PRO B 747 5.984 -4.519 7.250 1.00 0.00 H new ATOM 0 HD3 PRO B 747 7.671 -4.942 7.462 1.00 0.00 H new ATOM 742 N PHE B 748 5.936 -1.608 4.804 1.00 0.00 N ATOM 743 CA PHE B 748 5.076 -0.714 3.985 1.00 0.00 C ATOM 744 C PHE B 748 4.879 0.640 4.669 1.00 0.00 C ATOM 745 O PHE B 748 4.391 1.576 4.069 1.00 0.00 O ATOM 746 CB PHE B 748 3.739 -1.447 3.890 1.00 0.00 C ATOM 747 CG PHE B 748 3.947 -2.821 3.301 1.00 0.00 C ATOM 748 CD1 PHE B 748 4.247 -2.964 1.944 1.00 0.00 C ATOM 749 CD2 PHE B 748 3.819 -3.954 4.110 1.00 0.00 C ATOM 750 CE1 PHE B 748 4.427 -4.238 1.398 1.00 0.00 C ATOM 751 CE2 PHE B 748 3.998 -5.230 3.564 1.00 0.00 C ATOM 752 CZ PHE B 748 4.302 -5.370 2.207 1.00 0.00 C ATOM 0 H PHE B 748 5.489 -2.006 5.630 1.00 0.00 H new ATOM 0 HA PHE B 748 5.519 -0.510 3.010 1.00 0.00 H new ATOM 0 HB2 PHE B 748 3.289 -1.530 4.879 1.00 0.00 H new ATOM 0 HB3 PHE B 748 3.045 -0.878 3.271 1.00 0.00 H new ATOM 0 HD1 PHE B 748 4.340 -2.090 1.317 1.00 0.00 H new ATOM 0 HD2 PHE B 748 3.582 -3.844 5.158 1.00 0.00 H new ATOM 0 HE1 PHE B 748 4.663 -4.347 0.350 1.00 0.00 H new ATOM 0 HE2 PHE B 748 3.901 -6.105 4.190 1.00 0.00 H new ATOM 0 HZ PHE B 748 4.440 -6.354 1.784 1.00 0.00 H new ATOM 762 N MET B 749 5.234 0.755 5.920 1.00 0.00 N ATOM 763 CA MET B 749 5.019 2.050 6.624 1.00 0.00 C ATOM 764 C MET B 749 6.299 2.904 6.597 1.00 0.00 C ATOM 765 O MET B 749 6.496 3.768 7.428 1.00 0.00 O ATOM 766 CB MET B 749 4.561 1.651 8.049 1.00 0.00 C ATOM 767 CG MET B 749 5.667 1.817 9.103 1.00 0.00 C ATOM 768 SD MET B 749 5.185 0.959 10.628 1.00 0.00 S ATOM 769 CE MET B 749 3.459 1.518 10.710 1.00 0.00 C ATOM 0 H MET B 749 5.659 0.016 6.480 1.00 0.00 H new ATOM 0 HA MET B 749 4.268 2.682 6.150 1.00 0.00 H new ATOM 0 HB2 MET B 749 3.702 2.259 8.332 1.00 0.00 H new ATOM 0 HB3 MET B 749 4.228 0.613 8.040 1.00 0.00 H new ATOM 0 HG2 MET B 749 6.606 1.412 8.727 1.00 0.00 H new ATOM 0 HG3 MET B 749 5.835 2.875 9.306 1.00 0.00 H new ATOM 0 HE1 MET B 749 3.082 1.388 11.725 1.00 0.00 H new ATOM 0 HE2 MET B 749 3.404 2.571 10.435 1.00 0.00 H new ATOM 0 HE3 MET B 749 2.853 0.931 10.020 1.00 0.00 H new ATOM 779 N GLU B 750 7.147 2.694 5.625 1.00 0.00 N ATOM 780 CA GLU B 750 8.371 3.537 5.515 1.00 0.00 C ATOM 781 C GLU B 750 8.475 4.108 4.087 1.00 0.00 C ATOM 782 O GLU B 750 7.928 3.542 3.161 1.00 0.00 O ATOM 783 CB GLU B 750 9.549 2.604 5.847 1.00 0.00 C ATOM 784 CG GLU B 750 9.827 1.657 4.676 1.00 0.00 C ATOM 785 CD GLU B 750 9.900 0.213 5.178 1.00 0.00 C ATOM 786 OE1 GLU B 750 10.076 0.026 6.371 1.00 0.00 O ATOM 787 OE2 GLU B 750 9.792 -0.682 4.357 1.00 0.00 O ATOM 0 H GLU B 750 7.045 1.978 4.906 1.00 0.00 H new ATOM 0 HA GLU B 750 8.359 4.390 6.193 1.00 0.00 H new ATOM 0 HB2 GLU B 750 10.439 3.195 6.064 1.00 0.00 H new ATOM 0 HB3 GLU B 750 9.323 2.027 6.744 1.00 0.00 H new ATOM 0 HG2 GLU B 750 9.041 1.751 3.927 1.00 0.00 H new ATOM 0 HG3 GLU B 750 10.764 1.930 4.191 1.00 0.00 H new ATOM 794 N PRO B 751 9.201 5.189 3.945 1.00 0.00 N ATOM 795 CA PRO B 751 9.305 5.864 2.640 1.00 0.00 C ATOM 796 C PRO B 751 10.625 5.540 1.936 1.00 0.00 C ATOM 797 O PRO B 751 11.668 5.463 2.555 1.00 0.00 O ATOM 798 CB PRO B 751 9.279 7.337 3.039 1.00 0.00 C ATOM 799 CG PRO B 751 9.827 7.386 4.442 1.00 0.00 C ATOM 800 CD PRO B 751 9.849 5.976 4.990 1.00 0.00 C ATOM 0 HA PRO B 751 8.521 5.565 1.944 1.00 0.00 H new ATOM 0 HB2 PRO B 751 9.885 7.938 2.360 1.00 0.00 H new ATOM 0 HB3 PRO B 751 8.265 7.736 3.000 1.00 0.00 H new ATOM 0 HG2 PRO B 751 10.831 7.810 4.443 1.00 0.00 H new ATOM 0 HG3 PRO B 751 9.209 8.028 5.069 1.00 0.00 H new ATOM 0 HD2 PRO B 751 10.867 5.634 5.175 1.00 0.00 H new ATOM 0 HD3 PRO B 751 9.312 5.905 5.936 1.00 0.00 H new ATOM 808 N VAL B 752 10.593 5.400 0.638 1.00 0.00 N ATOM 809 CA VAL B 752 11.855 5.163 -0.121 1.00 0.00 C ATOM 810 C VAL B 752 12.237 6.441 -0.867 1.00 0.00 C ATOM 811 O VAL B 752 11.464 7.375 -0.952 1.00 0.00 O ATOM 812 CB VAL B 752 11.546 4.027 -1.108 1.00 0.00 C ATOM 813 CG1 VAL B 752 10.294 4.370 -1.918 1.00 0.00 C ATOM 814 CG2 VAL B 752 12.730 3.836 -2.058 1.00 0.00 C ATOM 0 H VAL B 752 9.747 5.440 0.070 1.00 0.00 H new ATOM 0 HA VAL B 752 12.688 4.896 0.529 1.00 0.00 H new ATOM 0 HB VAL B 752 11.374 3.106 -0.551 1.00 0.00 H new ATOM 0 HG11 VAL B 752 10.080 3.561 -2.616 1.00 0.00 H new ATOM 0 HG12 VAL B 752 9.448 4.500 -1.243 1.00 0.00 H new ATOM 0 HG13 VAL B 752 10.461 5.293 -2.473 1.00 0.00 H new ATOM 0 HG21 VAL B 752 12.509 3.030 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL B 752 12.905 4.759 -2.611 1.00 0.00 H new ATOM 0 HG23 VAL B 752 13.621 3.583 -1.483 1.00 0.00 H new ATOM 899 N ALA B 757 18.073 4.940 -2.946 1.00 0.00 N ATOM 900 CA ALA B 757 17.182 3.758 -3.121 1.00 0.00 C ATOM 901 C ALA B 757 17.099 3.387 -4.607 1.00 0.00 C ATOM 902 O ALA B 757 16.076 3.578 -5.234 1.00 0.00 O ATOM 903 CB ALA B 757 15.816 4.209 -2.593 1.00 0.00 C ATOM 0 HA ALA B 757 17.545 2.876 -2.592 1.00 0.00 H new ATOM 0 HB1 ALA B 757 15.101 3.391 -2.688 1.00 0.00 H new ATOM 0 HB2 ALA B 757 15.907 4.492 -1.544 1.00 0.00 H new ATOM 0 HB3 ALA B 757 15.467 5.065 -3.171 1.00 0.00 H new ATOM 909 N PRO B 758 18.193 2.883 -5.131 1.00 0.00 N ATOM 910 CA PRO B 758 18.240 2.506 -6.565 1.00 0.00 C ATOM 911 C PRO B 758 17.337 1.303 -6.839 1.00 0.00 C ATOM 912 O PRO B 758 16.957 0.581 -5.939 1.00 0.00 O ATOM 913 CB PRO B 758 19.705 2.138 -6.802 1.00 0.00 C ATOM 914 CG PRO B 758 20.260 1.826 -5.448 1.00 0.00 C ATOM 915 CD PRO B 758 19.473 2.632 -4.451 1.00 0.00 C ATOM 0 HA PRO B 758 17.893 3.306 -7.219 1.00 0.00 H new ATOM 0 HB2 PRO B 758 19.792 1.281 -7.469 1.00 0.00 H new ATOM 0 HB3 PRO B 758 20.246 2.961 -7.268 1.00 0.00 H new ATOM 0 HG2 PRO B 758 20.177 0.761 -5.234 1.00 0.00 H new ATOM 0 HG3 PRO B 758 21.319 2.079 -5.398 1.00 0.00 H new ATOM 0 HD2 PRO B 758 19.330 2.085 -3.519 1.00 0.00 H new ATOM 0 HD3 PRO B 758 19.981 3.563 -4.200 1.00 0.00 H new ATOM 923 N GLY B 759 16.989 1.083 -8.078 1.00 0.00 N ATOM 924 CA GLY B 759 16.110 -0.071 -8.413 1.00 0.00 C ATOM 925 C GLY B 759 14.652 0.389 -8.440 1.00 0.00 C ATOM 926 O GLY B 759 13.867 -0.060 -9.250 1.00 0.00 O ATOM 0 H GLY B 759 17.276 1.654 -8.873 1.00 0.00 H new ATOM 0 HA2 GLY B 759 16.390 -0.486 -9.382 1.00 0.00 H new ATOM 0 HA3 GLY B 759 16.238 -0.865 -7.677 1.00 0.00 H new ATOM 930 N TYR B 760 14.284 1.278 -7.558 1.00 0.00 N ATOM 931 CA TYR B 760 12.877 1.766 -7.536 1.00 0.00 C ATOM 932 C TYR B 760 12.540 2.469 -8.851 1.00 0.00 C ATOM 933 O TYR B 760 12.632 3.674 -8.968 1.00 0.00 O ATOM 934 CB TYR B 760 12.822 2.751 -6.369 1.00 0.00 C ATOM 935 CG TYR B 760 11.971 2.166 -5.269 1.00 0.00 C ATOM 936 CD1 TYR B 760 12.528 1.263 -4.356 1.00 0.00 C ATOM 937 CD2 TYR B 760 10.620 2.512 -5.177 1.00 0.00 C ATOM 938 CE1 TYR B 760 11.734 0.720 -3.339 1.00 0.00 C ATOM 939 CE2 TYR B 760 9.826 1.968 -4.161 1.00 0.00 C ATOM 940 CZ TYR B 760 10.382 1.070 -3.243 1.00 0.00 C ATOM 941 OH TYR B 760 9.598 0.531 -2.244 1.00 0.00 O ATOM 0 H TYR B 760 14.897 1.687 -6.852 1.00 0.00 H new ATOM 0 HA TYR B 760 12.158 0.955 -7.420 1.00 0.00 H new ATOM 0 HB2 TYR B 760 13.827 2.953 -6.000 1.00 0.00 H new ATOM 0 HB3 TYR B 760 12.407 3.703 -6.700 1.00 0.00 H new ATOM 0 HD1 TYR B 760 13.569 0.986 -4.436 1.00 0.00 H new ATOM 0 HD2 TYR B 760 10.189 3.199 -5.890 1.00 0.00 H new ATOM 0 HE1 TYR B 760 12.165 0.031 -2.628 1.00 0.00 H new ATOM 0 HE2 TYR B 760 8.784 2.241 -4.085 1.00 0.00 H new ATOM 0 HH TYR B 760 8.685 0.880 -2.320 1.00 0.00 H new ATOM 951 N TYR B 761 12.175 1.712 -9.849 1.00 0.00 N ATOM 952 CA TYR B 761 11.831 2.305 -11.176 1.00 0.00 C ATOM 953 C TYR B 761 11.485 1.190 -12.164 1.00 0.00 C ATOM 954 O TYR B 761 10.639 1.345 -13.022 1.00 0.00 O ATOM 955 CB TYR B 761 13.093 3.046 -11.632 1.00 0.00 C ATOM 956 CG TYR B 761 12.803 4.527 -11.708 1.00 0.00 C ATOM 957 CD1 TYR B 761 11.701 4.988 -12.438 1.00 0.00 C ATOM 958 CD2 TYR B 761 13.634 5.438 -11.045 1.00 0.00 C ATOM 959 CE1 TYR B 761 11.431 6.360 -12.507 1.00 0.00 C ATOM 960 CE2 TYR B 761 13.365 6.810 -11.114 1.00 0.00 C ATOM 961 CZ TYR B 761 12.263 7.271 -11.845 1.00 0.00 C ATOM 962 OH TYR B 761 11.997 8.623 -11.914 1.00 0.00 O ATOM 0 H TYR B 761 12.099 0.696 -9.803 1.00 0.00 H new ATOM 0 HA TYR B 761 10.971 2.973 -11.119 1.00 0.00 H new ATOM 0 HB2 TYR B 761 13.910 2.859 -10.935 1.00 0.00 H new ATOM 0 HB3 TYR B 761 13.414 2.676 -12.606 1.00 0.00 H new ATOM 0 HD1 TYR B 761 11.059 4.285 -12.948 1.00 0.00 H new ATOM 0 HD2 TYR B 761 14.483 5.082 -10.480 1.00 0.00 H new ATOM 0 HE1 TYR B 761 10.581 6.716 -13.071 1.00 0.00 H new ATOM 0 HE2 TYR B 761 14.007 7.513 -10.604 1.00 0.00 H new ATOM 0 HH TYR B 761 12.670 9.115 -11.399 1.00 0.00 H new ATOM 972 N GLU B 762 12.138 0.063 -12.049 1.00 0.00 N ATOM 973 CA GLU B 762 11.833 -1.078 -12.955 1.00 0.00 C ATOM 974 C GLU B 762 11.012 -2.122 -12.199 1.00 0.00 C ATOM 975 O GLU B 762 10.269 -2.888 -12.778 1.00 0.00 O ATOM 976 CB GLU B 762 13.197 -1.651 -13.344 1.00 0.00 C ATOM 977 CG GLU B 762 13.882 -0.715 -14.342 1.00 0.00 C ATOM 978 CD GLU B 762 13.129 -0.748 -15.673 1.00 0.00 C ATOM 979 OE1 GLU B 762 13.246 -1.740 -16.374 1.00 0.00 O ATOM 980 OE2 GLU B 762 12.448 0.220 -15.970 1.00 0.00 O ATOM 0 H GLU B 762 12.872 -0.114 -11.363 1.00 0.00 H new ATOM 0 HA GLU B 762 11.257 -0.778 -13.830 1.00 0.00 H new ATOM 0 HB2 GLU B 762 13.819 -1.771 -12.457 1.00 0.00 H new ATOM 0 HB3 GLU B 762 13.075 -2.641 -13.784 1.00 0.00 H new ATOM 0 HG2 GLU B 762 13.902 0.301 -13.949 1.00 0.00 H new ATOM 0 HG3 GLU B 762 14.918 -1.020 -14.491 1.00 0.00 H new ATOM 987 N VAL B 763 11.146 -2.152 -10.901 1.00 0.00 N ATOM 988 CA VAL B 763 10.357 -3.122 -10.089 1.00 0.00 C ATOM 989 C VAL B 763 9.251 -2.389 -9.332 1.00 0.00 C ATOM 990 O VAL B 763 8.225 -2.955 -9.010 1.00 0.00 O ATOM 991 CB VAL B 763 11.348 -3.762 -9.101 1.00 0.00 C ATOM 992 CG1 VAL B 763 12.252 -4.738 -9.848 1.00 0.00 C ATOM 993 CG2 VAL B 763 12.209 -2.693 -8.421 1.00 0.00 C ATOM 0 H VAL B 763 11.769 -1.546 -10.367 1.00 0.00 H new ATOM 0 HA VAL B 763 9.882 -3.877 -10.716 1.00 0.00 H new ATOM 0 HB VAL B 763 10.780 -4.290 -8.335 1.00 0.00 H new ATOM 0 HG11 VAL B 763 12.954 -5.192 -9.149 1.00 0.00 H new ATOM 0 HG12 VAL B 763 11.644 -5.517 -10.309 1.00 0.00 H new ATOM 0 HG13 VAL B 763 12.804 -4.204 -10.621 1.00 0.00 H new ATOM 0 HG21 VAL B 763 12.901 -3.170 -7.727 1.00 0.00 H new ATOM 0 HG22 VAL B 763 12.772 -2.145 -9.176 1.00 0.00 H new ATOM 0 HG23 VAL B 763 11.567 -2.002 -7.875 1.00 0.00 H new ATOM 1003 N ILE B 764 9.450 -1.132 -9.044 1.00 0.00 N ATOM 1004 CA ILE B 764 8.401 -0.365 -8.312 1.00 0.00 C ATOM 1005 C ILE B 764 7.846 0.747 -9.205 1.00 0.00 C ATOM 1006 O ILE B 764 8.370 1.842 -9.249 1.00 0.00 O ATOM 1007 CB ILE B 764 9.099 0.238 -7.076 1.00 0.00 C ATOM 1008 CG1 ILE B 764 10.041 -0.781 -6.405 1.00 0.00 C ATOM 1009 CG2 ILE B 764 8.036 0.676 -6.067 1.00 0.00 C ATOM 1010 CD1 ILE B 764 9.359 -2.150 -6.279 1.00 0.00 C ATOM 0 H ILE B 764 10.290 -0.604 -9.282 1.00 0.00 H new ATOM 0 HA ILE B 764 7.564 -1.001 -8.024 1.00 0.00 H new ATOM 0 HB ILE B 764 9.696 1.090 -7.402 1.00 0.00 H new ATOM 0 HG12 ILE B 764 10.956 -0.878 -6.990 1.00 0.00 H new ATOM 0 HG13 ILE B 764 10.330 -0.421 -5.418 1.00 0.00 H new ATOM 0 HG21 ILE B 764 8.521 1.104 -5.190 1.00 0.00 H new ATOM 0 HG22 ILE B 764 7.387 1.424 -6.523 1.00 0.00 H new ATOM 0 HG23 ILE B 764 7.441 -0.187 -5.768 1.00 0.00 H new ATOM 0 HD11 ILE B 764 10.041 -2.854 -5.803 1.00 0.00 H new ATOM 0 HD12 ILE B 764 8.457 -2.053 -5.674 1.00 0.00 H new ATOM 0 HD13 ILE B 764 9.093 -2.517 -7.270 1.00 0.00 H new ATOM 1022 N ARG B 765 6.792 0.470 -9.923 1.00 0.00 N ATOM 1023 CA ARG B 765 6.208 1.503 -10.823 1.00 0.00 C ATOM 1024 C ARG B 765 5.939 2.799 -10.057 1.00 0.00 C ATOM 1025 O ARG B 765 6.501 3.834 -10.354 1.00 0.00 O ATOM 1026 CB ARG B 765 4.891 0.899 -11.309 1.00 0.00 C ATOM 1027 CG ARG B 765 4.747 1.133 -12.814 1.00 0.00 C ATOM 1028 CD ARG B 765 3.723 2.244 -13.062 1.00 0.00 C ATOM 1029 NE ARG B 765 4.534 3.420 -13.495 1.00 0.00 N ATOM 1030 CZ ARG B 765 3.974 4.431 -14.119 1.00 0.00 C ATOM 1031 NH1 ARG B 765 2.690 4.437 -14.380 1.00 0.00 N ATOM 1032 NH2 ARG B 765 4.708 5.446 -14.485 1.00 0.00 N ATOM 0 H ARG B 765 6.310 -0.429 -9.925 1.00 0.00 H new ATOM 0 HA ARG B 765 6.881 1.754 -11.643 1.00 0.00 H new ATOM 0 HB2 ARG B 765 4.867 -0.169 -11.092 1.00 0.00 H new ATOM 0 HB3 ARG B 765 4.053 1.351 -10.778 1.00 0.00 H new ATOM 0 HG2 ARG B 765 5.710 1.409 -13.244 1.00 0.00 H new ATOM 0 HG3 ARG B 765 4.429 0.214 -13.307 1.00 0.00 H new ATOM 0 HD2 ARG B 765 3.004 1.955 -13.829 1.00 0.00 H new ATOM 0 HD3 ARG B 765 3.154 2.466 -12.159 1.00 0.00 H new ATOM 0 HE ARG B 765 5.536 3.439 -13.304 1.00 0.00 H new ATOM 0 HH11 ARG B 765 2.108 3.648 -14.098 1.00 0.00 H new ATOM 0 HH12 ARG B 765 2.272 5.231 -14.866 1.00 0.00 H new ATOM 0 HH21 ARG B 765 5.708 5.450 -14.286 1.00 0.00 H new ATOM 0 HH22 ARG B 765 4.281 6.235 -14.970 1.00 0.00 H new ATOM 1046 N PHE B 766 5.067 2.757 -9.087 1.00 0.00 N ATOM 1047 CA PHE B 766 4.750 3.994 -8.320 1.00 0.00 C ATOM 1048 C PHE B 766 5.187 3.854 -6.857 1.00 0.00 C ATOM 1049 O PHE B 766 4.412 3.423 -6.025 1.00 0.00 O ATOM 1050 CB PHE B 766 3.230 4.130 -8.401 1.00 0.00 C ATOM 1051 CG PHE B 766 2.876 5.308 -9.277 1.00 0.00 C ATOM 1052 CD1 PHE B 766 3.508 5.477 -10.514 1.00 0.00 C ATOM 1053 CD2 PHE B 766 1.917 6.235 -8.849 1.00 0.00 C ATOM 1054 CE1 PHE B 766 3.181 6.570 -11.325 1.00 0.00 C ATOM 1055 CE2 PHE B 766 1.590 7.328 -9.659 1.00 0.00 C ATOM 1056 CZ PHE B 766 2.222 7.496 -10.897 1.00 0.00 C ATOM 0 H PHE B 766 4.561 1.921 -8.793 1.00 0.00 H new ATOM 0 HA PHE B 766 5.269 4.864 -8.723 1.00 0.00 H new ATOM 0 HB2 PHE B 766 2.794 3.217 -8.807 1.00 0.00 H new ATOM 0 HB3 PHE B 766 2.813 4.267 -7.403 1.00 0.00 H new ATOM 0 HD1 PHE B 766 4.249 4.763 -10.843 1.00 0.00 H new ATOM 0 HD2 PHE B 766 1.430 6.106 -7.894 1.00 0.00 H new ATOM 0 HE1 PHE B 766 3.668 6.699 -12.280 1.00 0.00 H new ATOM 0 HE2 PHE B 766 0.850 8.042 -9.329 1.00 0.00 H new ATOM 0 HZ PHE B 766 1.970 8.340 -11.522 1.00 0.00 H new ATOM 1066 N PRO B 767 6.409 4.244 -6.575 1.00 0.00 N ATOM 1067 CA PRO B 767 6.932 4.175 -5.188 1.00 0.00 C ATOM 1068 C PRO B 767 5.910 4.720 -4.185 1.00 0.00 C ATOM 1069 O PRO B 767 5.813 5.911 -3.968 1.00 0.00 O ATOM 1070 CB PRO B 767 8.178 5.073 -5.216 1.00 0.00 C ATOM 1071 CG PRO B 767 8.250 5.652 -6.600 1.00 0.00 C ATOM 1072 CD PRO B 767 7.413 4.784 -7.494 1.00 0.00 C ATOM 0 HA PRO B 767 7.148 3.152 -4.879 1.00 0.00 H new ATOM 0 HB2 PRO B 767 8.105 5.862 -4.468 1.00 0.00 H new ATOM 0 HB3 PRO B 767 9.076 4.499 -4.988 1.00 0.00 H new ATOM 0 HG2 PRO B 767 7.881 6.678 -6.607 1.00 0.00 H new ATOM 0 HG3 PRO B 767 9.282 5.682 -6.950 1.00 0.00 H new ATOM 0 HD2 PRO B 767 6.956 5.357 -8.301 1.00 0.00 H new ATOM 0 HD3 PRO B 767 8.003 3.994 -7.958 1.00 0.00 H new ATOM 1080 N MET B 768 5.150 3.856 -3.569 1.00 0.00 N ATOM 1081 CA MET B 768 4.141 4.324 -2.578 1.00 0.00 C ATOM 1082 C MET B 768 4.268 3.528 -1.277 1.00 0.00 C ATOM 1083 O MET B 768 4.659 2.378 -1.279 1.00 0.00 O ATOM 1084 CB MET B 768 2.788 4.053 -3.238 1.00 0.00 C ATOM 1085 CG MET B 768 1.666 4.549 -2.323 1.00 0.00 C ATOM 1086 SD MET B 768 0.930 6.048 -3.022 1.00 0.00 S ATOM 1087 CE MET B 768 2.463 6.996 -3.189 1.00 0.00 C ATOM 0 H MET B 768 5.185 2.846 -3.709 1.00 0.00 H new ATOM 0 HA MET B 768 4.270 5.376 -2.322 1.00 0.00 H new ATOM 0 HB2 MET B 768 2.735 4.557 -4.203 1.00 0.00 H new ATOM 0 HB3 MET B 768 2.671 2.986 -3.429 1.00 0.00 H new ATOM 0 HG2 MET B 768 0.905 3.776 -2.212 1.00 0.00 H new ATOM 0 HG3 MET B 768 2.059 4.755 -1.327 1.00 0.00 H new ATOM 0 HE1 MET B 768 2.225 8.034 -3.423 1.00 0.00 H new ATOM 0 HE2 MET B 768 3.021 6.953 -2.254 1.00 0.00 H new ATOM 0 HE3 MET B 768 3.067 6.573 -3.991 1.00 0.00 H new ATOM 1097 N ASP B 769 3.945 4.131 -0.166 1.00 0.00 N ATOM 1098 CA ASP B 769 4.053 3.405 1.131 1.00 0.00 C ATOM 1099 C ASP B 769 3.023 3.936 2.130 1.00 0.00 C ATOM 1100 O ASP B 769 2.555 5.052 2.021 1.00 0.00 O ATOM 1101 CB ASP B 769 5.471 3.698 1.626 1.00 0.00 C ATOM 1102 CG ASP B 769 6.461 2.774 0.916 1.00 0.00 C ATOM 1103 OD1 ASP B 769 6.160 1.599 0.791 1.00 0.00 O ATOM 1104 OD2 ASP B 769 7.505 3.258 0.509 1.00 0.00 O ATOM 0 H ASP B 769 3.612 5.093 -0.100 1.00 0.00 H new ATOM 0 HA ASP B 769 3.865 2.337 1.021 1.00 0.00 H new ATOM 0 HB2 ASP B 769 5.727 4.740 1.433 1.00 0.00 H new ATOM 0 HB3 ASP B 769 5.529 3.550 2.704 1.00 0.00 H new ATOM 1109 N LEU B 770 2.669 3.145 3.104 1.00 0.00 N ATOM 1110 CA LEU B 770 1.674 3.602 4.115 1.00 0.00 C ATOM 1111 C LEU B 770 2.215 4.810 4.885 1.00 0.00 C ATOM 1112 O LEU B 770 1.468 5.586 5.446 1.00 0.00 O ATOM 1113 CB LEU B 770 1.495 2.409 5.059 1.00 0.00 C ATOM 1114 CG LEU B 770 0.954 1.210 4.276 1.00 0.00 C ATOM 1115 CD1 LEU B 770 0.890 -0.010 5.196 1.00 0.00 C ATOM 1116 CD2 LEU B 770 -0.449 1.533 3.756 1.00 0.00 C ATOM 0 H LEU B 770 3.026 2.200 3.244 1.00 0.00 H new ATOM 0 HA LEU B 770 0.734 3.910 3.657 1.00 0.00 H new ATOM 0 HB2 LEU B 770 2.448 2.153 5.523 1.00 0.00 H new ATOM 0 HB3 LEU B 770 0.808 2.670 5.864 1.00 0.00 H new ATOM 0 HG LEU B 770 1.613 0.996 3.434 1.00 0.00 H new ATOM 0 HD11 LEU B 770 0.505 -0.865 4.640 1.00 0.00 H new ATOM 0 HD12 LEU B 770 1.889 -0.239 5.567 1.00 0.00 H new ATOM 0 HD13 LEU B 770 0.230 0.203 6.037 1.00 0.00 H new ATOM 0 HD21 LEU B 770 -0.836 0.680 3.198 1.00 0.00 H new ATOM 0 HD22 LEU B 770 -1.109 1.746 4.597 1.00 0.00 H new ATOM 0 HD23 LEU B 770 -0.403 2.404 3.102 1.00 0.00 H new ATOM 1128 N LYS B 771 3.511 4.972 4.920 1.00 0.00 N ATOM 1129 CA LYS B 771 4.097 6.129 5.655 1.00 0.00 C ATOM 1130 C LYS B 771 3.704 7.441 4.952 1.00 0.00 C ATOM 1131 O LYS B 771 3.566 8.474 5.576 1.00 0.00 O ATOM 1132 CB LYS B 771 5.628 5.855 5.648 1.00 0.00 C ATOM 1133 CG LYS B 771 6.430 6.969 4.950 1.00 0.00 C ATOM 1134 CD LYS B 771 6.462 8.211 5.844 1.00 0.00 C ATOM 1135 CE LYS B 771 6.192 9.457 4.997 1.00 0.00 C ATOM 1136 NZ LYS B 771 6.025 10.561 5.984 1.00 0.00 N ATOM 0 H LYS B 771 4.188 4.354 4.472 1.00 0.00 H new ATOM 0 HA LYS B 771 3.737 6.236 6.678 1.00 0.00 H new ATOM 0 HB2 LYS B 771 5.978 5.750 6.675 1.00 0.00 H new ATOM 0 HB3 LYS B 771 5.821 4.906 5.147 1.00 0.00 H new ATOM 0 HG2 LYS B 771 7.445 6.628 4.746 1.00 0.00 H new ATOM 0 HG3 LYS B 771 5.976 7.211 3.989 1.00 0.00 H new ATOM 0 HD2 LYS B 771 5.713 8.125 6.632 1.00 0.00 H new ATOM 0 HD3 LYS B 771 7.432 8.295 6.334 1.00 0.00 H new ATOM 0 HE2 LYS B 771 7.018 9.658 4.315 1.00 0.00 H new ATOM 0 HE3 LYS B 771 5.297 9.334 4.386 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 5.836 11.451 5.480 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 5.227 10.345 6.615 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 6.895 10.659 6.546 1.00 0.00 H new ATOM 1150 N THR B 772 3.529 7.400 3.660 1.00 0.00 N ATOM 1151 CA THR B 772 3.151 8.636 2.920 1.00 0.00 C ATOM 1152 C THR B 772 1.747 8.495 2.329 1.00 0.00 C ATOM 1153 O THR B 772 1.050 9.469 2.123 1.00 0.00 O ATOM 1154 CB THR B 772 4.189 8.760 1.802 1.00 0.00 C ATOM 1155 OG1 THR B 772 3.874 9.879 0.986 1.00 0.00 O ATOM 1156 CG2 THR B 772 4.180 7.490 0.948 1.00 0.00 C ATOM 0 H THR B 772 3.631 6.564 3.085 1.00 0.00 H new ATOM 0 HA THR B 772 3.136 9.513 3.567 1.00 0.00 H new ATOM 0 HB THR B 772 5.178 8.894 2.241 1.00 0.00 H new ATOM 0 HG1 THR B 772 4.539 9.960 0.271 1.00 0.00 H new ATOM 0 HG21 THR B 772 4.920 7.581 0.153 1.00 0.00 H new ATOM 0 HG22 THR B 772 4.422 6.630 1.572 1.00 0.00 H new ATOM 0 HG23 THR B 772 3.191 7.353 0.510 1.00 0.00 H new ATOM 1164 N MET B 773 1.325 7.291 2.057 1.00 0.00 N ATOM 1165 CA MET B 773 -0.035 7.092 1.481 1.00 0.00 C ATOM 1166 C MET B 773 -1.107 7.515 2.487 1.00 0.00 C ATOM 1167 O MET B 773 -2.152 8.014 2.121 1.00 0.00 O ATOM 1168 CB MET B 773 -0.129 5.591 1.201 1.00 0.00 C ATOM 1169 CG MET B 773 -1.295 5.322 0.247 1.00 0.00 C ATOM 1170 SD MET B 773 -2.845 5.304 1.180 1.00 0.00 S ATOM 1171 CE MET B 773 -3.099 3.512 1.158 1.00 0.00 C ATOM 0 H MET B 773 1.862 6.437 2.208 1.00 0.00 H new ATOM 0 HA MET B 773 -0.192 7.688 0.582 1.00 0.00 H new ATOM 0 HB2 MET B 773 0.803 5.233 0.763 1.00 0.00 H new ATOM 0 HB3 MET B 773 -0.274 5.045 2.133 1.00 0.00 H new ATOM 0 HG2 MET B 773 -1.332 6.090 -0.525 1.00 0.00 H new ATOM 0 HG3 MET B 773 -1.152 4.368 -0.260 1.00 0.00 H new ATOM 0 HE1 MET B 773 -3.459 3.184 2.133 1.00 0.00 H new ATOM 0 HE2 MET B 773 -3.835 3.258 0.395 1.00 0.00 H new ATOM 0 HE3 MET B 773 -2.156 3.014 0.933 1.00 0.00 H new ATOM 1181 N SER B 774 -0.856 7.320 3.754 1.00 0.00 N ATOM 1182 CA SER B 774 -1.861 7.718 4.779 1.00 0.00 C ATOM 1183 C SER B 774 -2.049 9.236 4.772 1.00 0.00 C ATOM 1184 O SER B 774 -3.105 9.742 5.093 1.00 0.00 O ATOM 1185 CB SER B 774 -1.266 7.260 6.112 1.00 0.00 C ATOM 1186 OG SER B 774 -1.307 5.842 6.186 1.00 0.00 O ATOM 0 H SER B 774 -0.001 6.903 4.122 1.00 0.00 H new ATOM 0 HA SER B 774 -2.839 7.275 4.593 1.00 0.00 H new ATOM 0 HB2 SER B 774 -0.238 7.610 6.203 1.00 0.00 H new ATOM 0 HB3 SER B 774 -1.825 7.694 6.941 1.00 0.00 H new ATOM 0 HG SER B 774 -0.426 5.477 5.962 1.00 0.00 H new ATOM 1192 N GLU B 775 -1.032 9.965 4.402 1.00 0.00 N ATOM 1193 CA GLU B 775 -1.156 11.449 4.366 1.00 0.00 C ATOM 1194 C GLU B 775 -2.225 11.865 3.355 1.00 0.00 C ATOM 1195 O GLU B 775 -2.947 12.820 3.559 1.00 0.00 O ATOM 1196 CB GLU B 775 0.220 11.945 3.923 1.00 0.00 C ATOM 1197 CG GLU B 775 1.252 11.612 5.001 1.00 0.00 C ATOM 1198 CD GLU B 775 0.900 12.354 6.291 1.00 0.00 C ATOM 1199 OE1 GLU B 775 0.651 13.546 6.216 1.00 0.00 O ATOM 1200 OE2 GLU B 775 0.885 11.719 7.332 1.00 0.00 O ATOM 0 H GLU B 775 -0.122 9.598 4.124 1.00 0.00 H new ATOM 0 HA GLU B 775 -1.452 11.864 5.329 1.00 0.00 H new ATOM 0 HB2 GLU B 775 0.500 11.478 2.979 1.00 0.00 H new ATOM 0 HB3 GLU B 775 0.193 13.021 3.750 1.00 0.00 H new ATOM 0 HG2 GLU B 775 1.272 10.537 5.181 1.00 0.00 H new ATOM 0 HG3 GLU B 775 2.249 11.897 4.665 1.00 0.00 H new ATOM 1207 N ARG B 776 -2.334 11.152 2.268 1.00 0.00 N ATOM 1208 CA ARG B 776 -3.364 11.503 1.250 1.00 0.00 C ATOM 1209 C ARG B 776 -4.765 11.335 1.840 1.00 0.00 C ATOM 1210 O ARG B 776 -5.641 12.148 1.623 1.00 0.00 O ATOM 1211 CB ARG B 776 -3.143 10.514 0.104 1.00 0.00 C ATOM 1212 CG ARG B 776 -2.695 11.275 -1.145 1.00 0.00 C ATOM 1213 CD ARG B 776 -1.167 11.259 -1.231 1.00 0.00 C ATOM 1214 NE ARG B 776 -0.859 11.697 -2.624 1.00 0.00 N ATOM 1215 CZ ARG B 776 -0.933 12.963 -2.966 1.00 0.00 C ATOM 1216 NH1 ARG B 776 -1.279 13.879 -2.094 1.00 0.00 N ATOM 1217 NH2 ARG B 776 -0.658 13.314 -4.192 1.00 0.00 N ATOM 0 H ARG B 776 -1.756 10.343 2.041 1.00 0.00 H new ATOM 0 HA ARG B 776 -3.280 12.537 0.916 1.00 0.00 H new ATOM 0 HB2 ARG B 776 -2.390 9.778 0.385 1.00 0.00 H new ATOM 0 HB3 ARG B 776 -4.063 9.966 -0.101 1.00 0.00 H new ATOM 0 HG2 ARG B 776 -3.125 10.818 -2.036 1.00 0.00 H new ATOM 0 HG3 ARG B 776 -3.057 12.302 -1.107 1.00 0.00 H new ATOM 0 HD2 ARG B 776 -0.722 11.932 -0.497 1.00 0.00 H new ATOM 0 HD3 ARG B 776 -0.770 10.263 -1.032 1.00 0.00 H new ATOM 0 HE ARG B 776 -0.587 11.003 -3.321 1.00 0.00 H new ATOM 0 HH11 ARG B 776 -1.496 13.613 -1.133 1.00 0.00 H new ATOM 0 HH12 ARG B 776 -1.332 14.858 -2.376 1.00 0.00 H new ATOM 0 HH21 ARG B 776 -0.388 12.608 -4.876 1.00 0.00 H new ATOM 0 HH22 ARG B 776 -0.713 14.295 -4.466 1.00 0.00 H new ATOM 1231 N LEU B 777 -4.981 10.290 2.592 1.00 0.00 N ATOM 1232 CA LEU B 777 -6.320 10.083 3.211 1.00 0.00 C ATOM 1233 C LEU B 777 -6.726 11.324 4.003 1.00 0.00 C ATOM 1234 O LEU B 777 -7.886 11.679 4.077 1.00 0.00 O ATOM 1235 CB LEU B 777 -6.134 8.895 4.156 1.00 0.00 C ATOM 1236 CG LEU B 777 -7.431 8.085 4.229 1.00 0.00 C ATOM 1237 CD1 LEU B 777 -8.572 8.986 4.707 1.00 0.00 C ATOM 1238 CD2 LEU B 777 -7.767 7.528 2.845 1.00 0.00 C ATOM 0 H LEU B 777 -4.289 9.572 2.804 1.00 0.00 H new ATOM 0 HA LEU B 777 -7.097 9.903 2.468 1.00 0.00 H new ATOM 0 HB2 LEU B 777 -5.319 8.263 3.805 1.00 0.00 H new ATOM 0 HB3 LEU B 777 -5.858 9.248 5.150 1.00 0.00 H new ATOM 0 HG LEU B 777 -7.302 7.260 4.930 1.00 0.00 H new ATOM 0 HD11 LEU B 777 -9.495 8.408 4.759 1.00 0.00 H new ATOM 0 HD12 LEU B 777 -8.335 9.380 5.695 1.00 0.00 H new ATOM 0 HD13 LEU B 777 -8.700 9.813 4.008 1.00 0.00 H new ATOM 0 HD21 LEU B 777 -8.691 6.952 2.899 1.00 0.00 H new ATOM 0 HD22 LEU B 777 -7.894 8.352 2.142 1.00 0.00 H new ATOM 0 HD23 LEU B 777 -6.956 6.883 2.506 1.00 0.00 H new ATOM 1250 N LYS B 778 -5.773 11.984 4.599 1.00 0.00 N ATOM 1251 CA LYS B 778 -6.086 13.205 5.389 1.00 0.00 C ATOM 1252 C LYS B 778 -6.496 14.350 4.461 1.00 0.00 C ATOM 1253 O LYS B 778 -7.128 15.301 4.875 1.00 0.00 O ATOM 1254 CB LYS B 778 -4.778 13.546 6.105 1.00 0.00 C ATOM 1255 CG LYS B 778 -4.900 13.197 7.589 1.00 0.00 C ATOM 1256 CD LYS B 778 -3.647 12.459 8.041 1.00 0.00 C ATOM 1257 CE LYS B 778 -2.420 13.345 7.817 1.00 0.00 C ATOM 1258 NZ LYS B 778 -1.621 13.212 9.067 1.00 0.00 N ATOM 0 H LYS B 778 -4.786 11.728 4.572 1.00 0.00 H new ATOM 0 HA LYS B 778 -6.912 13.049 6.083 1.00 0.00 H new ATOM 0 HB2 LYS B 778 -3.952 12.993 5.658 1.00 0.00 H new ATOM 0 HB3 LYS B 778 -4.553 14.606 5.988 1.00 0.00 H new ATOM 0 HG2 LYS B 778 -5.033 14.105 8.177 1.00 0.00 H new ATOM 0 HG3 LYS B 778 -5.781 12.577 7.757 1.00 0.00 H new ATOM 0 HD2 LYS B 778 -3.729 12.194 9.095 1.00 0.00 H new ATOM 0 HD3 LYS B 778 -3.541 11.527 7.486 1.00 0.00 H new ATOM 0 HE2 LYS B 778 -1.850 13.019 6.947 1.00 0.00 H new ATOM 0 HE3 LYS B 778 -2.708 14.381 7.640 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 -0.761 13.791 8.992 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 -2.187 13.536 9.877 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 -1.357 12.216 9.206 1.00 0.00 H new ATOM 1272 N ASN B 779 -6.139 14.268 3.208 1.00 0.00 N ATOM 1273 CA ASN B 779 -6.500 15.359 2.262 1.00 0.00 C ATOM 1274 C ASN B 779 -7.563 14.893 1.261 1.00 0.00 C ATOM 1275 O ASN B 779 -7.843 15.571 0.298 1.00 0.00 O ATOM 1276 CB ASN B 779 -5.195 15.691 1.535 1.00 0.00 C ATOM 1277 CG ASN B 779 -4.415 16.733 2.340 1.00 0.00 C ATOM 1278 OD1 ASN B 779 -3.796 16.410 3.334 1.00 0.00 O ATOM 1279 ND2 ASN B 779 -4.421 17.979 1.952 1.00 0.00 N ATOM 0 H ASN B 779 -5.614 13.494 2.800 1.00 0.00 H new ATOM 0 HA ASN B 779 -6.922 16.220 2.780 1.00 0.00 H new ATOM 0 HB2 ASN B 779 -4.596 14.789 1.410 1.00 0.00 H new ATOM 0 HB3 ASN B 779 -5.409 16.072 0.537 1.00 0.00 H new ATOM 0 HD21 ASN B 779 -3.906 18.681 2.483 1.00 0.00 H new ATOM 0 HD22 ASN B 779 -4.941 18.251 1.117 1.00 0.00 H new ATOM 1286 N ARG B 780 -8.158 13.742 1.483 1.00 0.00 N ATOM 1287 CA ARG B 780 -9.226 13.231 0.557 1.00 0.00 C ATOM 1288 C ARG B 780 -8.660 12.935 -0.844 1.00 0.00 C ATOM 1289 O ARG B 780 -9.394 12.664 -1.772 1.00 0.00 O ATOM 1290 CB ARG B 780 -10.322 14.327 0.563 1.00 0.00 C ATOM 1291 CG ARG B 780 -10.327 15.175 -0.719 1.00 0.00 C ATOM 1292 CD ARG B 780 -11.282 14.553 -1.734 1.00 0.00 C ATOM 1293 NE ARG B 780 -12.598 15.207 -1.476 1.00 0.00 N ATOM 1294 CZ ARG B 780 -12.830 16.438 -1.872 1.00 0.00 C ATOM 1295 NH1 ARG B 780 -11.914 17.126 -2.507 1.00 0.00 N ATOM 1296 NH2 ARG B 780 -13.991 16.981 -1.629 1.00 0.00 N ATOM 0 H ARG B 780 -7.949 13.130 2.271 1.00 0.00 H new ATOM 0 HA ARG B 780 -9.640 12.276 0.881 1.00 0.00 H new ATOM 0 HB2 ARG B 780 -11.298 13.857 0.686 1.00 0.00 H new ATOM 0 HB3 ARG B 780 -10.172 14.979 1.423 1.00 0.00 H new ATOM 0 HG2 ARG B 780 -10.634 16.196 -0.492 1.00 0.00 H new ATOM 0 HG3 ARG B 780 -9.321 15.230 -1.136 1.00 0.00 H new ATOM 0 HD2 ARG B 780 -10.945 14.733 -2.755 1.00 0.00 H new ATOM 0 HD3 ARG B 780 -11.346 13.473 -1.605 1.00 0.00 H new ATOM 0 HE ARG B 780 -13.328 14.691 -0.985 1.00 0.00 H new ATOM 0 HH11 ARG B 780 -11.004 16.707 -2.701 1.00 0.00 H new ATOM 0 HH12 ARG B 780 -12.110 18.081 -2.808 1.00 0.00 H new ATOM 0 HH21 ARG B 780 -14.709 16.450 -1.136 1.00 0.00 H new ATOM 0 HH22 ARG B 780 -14.181 17.936 -1.932 1.00 0.00 H new ATOM 1310 N TYR B 781 -7.370 12.964 -1.006 1.00 0.00 N ATOM 1311 CA TYR B 781 -6.798 12.689 -2.352 1.00 0.00 C ATOM 1312 C TYR B 781 -7.159 11.272 -2.796 1.00 0.00 C ATOM 1313 O TYR B 781 -7.709 11.064 -3.859 1.00 0.00 O ATOM 1314 CB TYR B 781 -5.284 12.830 -2.178 1.00 0.00 C ATOM 1315 CG TYR B 781 -4.801 14.057 -2.916 1.00 0.00 C ATOM 1316 CD1 TYR B 781 -5.328 15.315 -2.602 1.00 0.00 C ATOM 1317 CD2 TYR B 781 -3.823 13.935 -3.910 1.00 0.00 C ATOM 1318 CE1 TYR B 781 -4.878 16.452 -3.285 1.00 0.00 C ATOM 1319 CE2 TYR B 781 -3.373 15.071 -4.592 1.00 0.00 C ATOM 1320 CZ TYR B 781 -3.900 16.330 -4.280 1.00 0.00 C ATOM 1321 OH TYR B 781 -3.455 17.450 -4.953 1.00 0.00 O ATOM 0 H TYR B 781 -6.690 13.164 -0.272 1.00 0.00 H new ATOM 0 HA TYR B 781 -7.183 13.368 -3.112 1.00 0.00 H new ATOM 0 HB2 TYR B 781 -5.035 12.908 -1.120 1.00 0.00 H new ATOM 0 HB3 TYR B 781 -4.780 11.942 -2.559 1.00 0.00 H new ATOM 0 HD1 TYR B 781 -6.081 15.409 -1.834 1.00 0.00 H new ATOM 0 HD2 TYR B 781 -3.416 12.964 -4.151 1.00 0.00 H new ATOM 0 HE1 TYR B 781 -5.285 17.423 -3.044 1.00 0.00 H new ATOM 0 HE2 TYR B 781 -2.619 14.977 -5.359 1.00 0.00 H new ATOM 0 HH TYR B 781 -2.776 17.189 -5.609 1.00 0.00 H new ATOM 1331 N TYR B 782 -6.860 10.296 -1.985 1.00 0.00 N ATOM 1332 CA TYR B 782 -7.221 8.895 -2.341 1.00 0.00 C ATOM 1333 C TYR B 782 -8.503 8.501 -1.607 1.00 0.00 C ATOM 1334 O TYR B 782 -8.476 7.760 -0.645 1.00 0.00 O ATOM 1335 CB TYR B 782 -6.047 8.041 -1.853 1.00 0.00 C ATOM 1336 CG TYR B 782 -4.854 8.229 -2.763 1.00 0.00 C ATOM 1337 CD1 TYR B 782 -5.017 8.221 -4.154 1.00 0.00 C ATOM 1338 CD2 TYR B 782 -3.577 8.390 -2.211 1.00 0.00 C ATOM 1339 CE1 TYR B 782 -3.907 8.387 -4.991 1.00 0.00 C ATOM 1340 CE2 TYR B 782 -2.467 8.555 -3.048 1.00 0.00 C ATOM 1341 CZ TYR B 782 -2.631 8.554 -4.438 1.00 0.00 C ATOM 1342 OH TYR B 782 -1.534 8.716 -5.262 1.00 0.00 O ATOM 0 H TYR B 782 -6.381 10.408 -1.091 1.00 0.00 H new ATOM 0 HA TYR B 782 -7.396 8.766 -3.409 1.00 0.00 H new ATOM 0 HB2 TYR B 782 -5.784 8.320 -0.833 1.00 0.00 H new ATOM 0 HB3 TYR B 782 -6.336 6.990 -1.832 1.00 0.00 H new ATOM 0 HD1 TYR B 782 -6.000 8.087 -4.581 1.00 0.00 H new ATOM 0 HD2 TYR B 782 -3.448 8.387 -1.139 1.00 0.00 H new ATOM 0 HE1 TYR B 782 -4.035 8.386 -6.063 1.00 0.00 H new ATOM 0 HE2 TYR B 782 -1.483 8.683 -2.621 1.00 0.00 H new ATOM 0 HH TYR B 782 -0.727 8.820 -4.716 1.00 0.00 H new ATOM 1352 N VAL B 783 -9.623 9.018 -2.033 1.00 0.00 N ATOM 1353 CA VAL B 783 -10.897 8.711 -1.328 1.00 0.00 C ATOM 1354 C VAL B 783 -11.838 7.892 -2.227 1.00 0.00 C ATOM 1355 O VAL B 783 -13.008 8.194 -2.355 1.00 0.00 O ATOM 1356 CB VAL B 783 -11.480 10.098 -0.990 1.00 0.00 C ATOM 1357 CG1 VAL B 783 -12.167 10.720 -2.214 1.00 0.00 C ATOM 1358 CG2 VAL B 783 -12.489 9.963 0.148 1.00 0.00 C ATOM 0 H VAL B 783 -9.710 9.639 -2.838 1.00 0.00 H new ATOM 0 HA VAL B 783 -10.755 8.102 -0.436 1.00 0.00 H new ATOM 0 HB VAL B 783 -10.662 10.751 -0.686 1.00 0.00 H new ATOM 0 HG11 VAL B 783 -12.569 11.697 -1.948 1.00 0.00 H new ATOM 0 HG12 VAL B 783 -11.442 10.833 -3.020 1.00 0.00 H new ATOM 0 HG13 VAL B 783 -12.978 10.072 -2.544 1.00 0.00 H new ATOM 0 HG21 VAL B 783 -12.901 10.943 0.387 1.00 0.00 H new ATOM 0 HG22 VAL B 783 -13.295 9.295 -0.157 1.00 0.00 H new ATOM 0 HG23 VAL B 783 -11.992 9.554 1.028 1.00 0.00 H new ATOM 1368 N SER B 784 -11.338 6.857 -2.848 1.00 0.00 N ATOM 1369 CA SER B 784 -12.207 6.034 -3.735 1.00 0.00 C ATOM 1370 C SER B 784 -11.686 4.597 -3.816 1.00 0.00 C ATOM 1371 O SER B 784 -11.019 4.117 -2.921 1.00 0.00 O ATOM 1372 CB SER B 784 -12.118 6.709 -5.105 1.00 0.00 C ATOM 1373 OG SER B 784 -12.438 8.086 -4.976 1.00 0.00 O ATOM 0 H SER B 784 -10.369 6.548 -2.779 1.00 0.00 H new ATOM 0 HA SER B 784 -13.231 5.977 -3.367 1.00 0.00 H new ATOM 0 HB2 SER B 784 -11.114 6.595 -5.514 1.00 0.00 H new ATOM 0 HB3 SER B 784 -12.803 6.229 -5.804 1.00 0.00 H new ATOM 0 HG SER B 784 -12.968 8.224 -4.163 1.00 0.00 H new ATOM 1379 N LYS B 785 -11.987 3.908 -4.882 1.00 0.00 N ATOM 1380 CA LYS B 785 -11.515 2.501 -5.019 1.00 0.00 C ATOM 1381 C LYS B 785 -10.237 2.444 -5.859 1.00 0.00 C ATOM 1382 O LYS B 785 -9.160 2.213 -5.349 1.00 0.00 O ATOM 1383 CB LYS B 785 -12.657 1.772 -5.732 1.00 0.00 C ATOM 1384 CG LYS B 785 -12.267 0.310 -5.958 1.00 0.00 C ATOM 1385 CD LYS B 785 -11.769 0.127 -7.394 1.00 0.00 C ATOM 1386 CE LYS B 785 -10.298 -0.301 -7.375 1.00 0.00 C ATOM 1387 NZ LYS B 785 -10.327 -1.785 -7.232 1.00 0.00 N ATOM 0 H LYS B 785 -12.540 4.258 -5.664 1.00 0.00 H new ATOM 0 HA LYS B 785 -11.277 2.051 -4.055 1.00 0.00 H new ATOM 0 HB2 LYS B 785 -13.567 1.828 -5.135 1.00 0.00 H new ATOM 0 HB3 LYS B 785 -12.871 2.254 -6.686 1.00 0.00 H new ATOM 0 HG2 LYS B 785 -11.489 0.017 -5.253 1.00 0.00 H new ATOM 0 HG3 LYS B 785 -13.124 -0.338 -5.774 1.00 0.00 H new ATOM 0 HD2 LYS B 785 -12.371 -0.624 -7.906 1.00 0.00 H new ATOM 0 HD3 LYS B 785 -11.881 1.058 -7.950 1.00 0.00 H new ATOM 0 HE2 LYS B 785 -9.789 -0.003 -8.292 1.00 0.00 H new ATOM 0 HE3 LYS B 785 -9.763 0.164 -6.547 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 -9.354 -2.151 -7.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 -10.811 -2.039 -6.347 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 -10.836 -2.201 -8.037 1.00 0.00 H new ATOM 1401 N LYS B 786 -10.345 2.662 -7.143 1.00 0.00 N ATOM 1402 CA LYS B 786 -9.134 2.619 -8.012 1.00 0.00 C ATOM 1403 C LYS B 786 -8.042 3.533 -7.452 1.00 0.00 C ATOM 1404 O LYS B 786 -6.872 3.362 -7.730 1.00 0.00 O ATOM 1405 CB LYS B 786 -9.612 3.130 -9.373 1.00 0.00 C ATOM 1406 CG LYS B 786 -8.482 2.996 -10.395 1.00 0.00 C ATOM 1407 CD LYS B 786 -8.212 1.514 -10.665 1.00 0.00 C ATOM 1408 CE LYS B 786 -8.584 1.182 -12.112 1.00 0.00 C ATOM 1409 NZ LYS B 786 -7.729 0.015 -12.467 1.00 0.00 N ATOM 0 H LYS B 786 -11.219 2.868 -7.627 1.00 0.00 H new ATOM 0 HA LYS B 786 -8.706 1.619 -8.074 1.00 0.00 H new ATOM 0 HB2 LYS B 786 -10.482 2.562 -9.701 1.00 0.00 H new ATOM 0 HB3 LYS B 786 -9.923 4.172 -9.293 1.00 0.00 H new ATOM 0 HG2 LYS B 786 -8.753 3.502 -11.322 1.00 0.00 H new ATOM 0 HG3 LYS B 786 -7.579 3.479 -10.021 1.00 0.00 H new ATOM 0 HD2 LYS B 786 -7.161 1.287 -10.487 1.00 0.00 H new ATOM 0 HD3 LYS B 786 -8.792 0.897 -9.979 1.00 0.00 H new ATOM 0 HE2 LYS B 786 -9.643 0.939 -12.202 1.00 0.00 H new ATOM 0 HE3 LYS B 786 -8.394 2.027 -12.773 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 -7.925 -0.274 -13.447 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 -6.727 0.279 -12.378 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 -7.937 -0.776 -11.825 1.00 0.00 H new ATOM 1423 N LEU B 787 -8.416 4.500 -6.661 1.00 0.00 N ATOM 1424 CA LEU B 787 -7.406 5.431 -6.089 1.00 0.00 C ATOM 1425 C LEU B 787 -6.696 4.794 -4.894 1.00 0.00 C ATOM 1426 O LEU B 787 -5.538 4.433 -4.966 1.00 0.00 O ATOM 1427 CB LEU B 787 -8.220 6.641 -5.630 1.00 0.00 C ATOM 1428 CG LEU B 787 -8.471 7.563 -6.821 1.00 0.00 C ATOM 1429 CD1 LEU B 787 -9.537 6.945 -7.727 1.00 0.00 C ATOM 1430 CD2 LEU B 787 -8.950 8.923 -6.317 1.00 0.00 C ATOM 0 H LEU B 787 -9.381 4.685 -6.386 1.00 0.00 H new ATOM 0 HA LEU B 787 -6.632 5.691 -6.811 1.00 0.00 H new ATOM 0 HB2 LEU B 787 -9.168 6.315 -5.202 1.00 0.00 H new ATOM 0 HB3 LEU B 787 -7.685 7.178 -4.847 1.00 0.00 H new ATOM 0 HG LEU B 787 -7.548 7.691 -7.386 1.00 0.00 H new ATOM 0 HD11 LEU B 787 -9.717 7.602 -8.578 1.00 0.00 H new ATOM 0 HD12 LEU B 787 -9.192 5.975 -8.085 1.00 0.00 H new ATOM 0 HD13 LEU B 787 -10.462 6.817 -7.165 1.00 0.00 H new ATOM 0 HD21 LEU B 787 -9.130 9.583 -7.166 1.00 0.00 H new ATOM 0 HD22 LEU B 787 -9.874 8.797 -5.753 1.00 0.00 H new ATOM 0 HD23 LEU B 787 -8.188 9.361 -5.672 1.00 0.00 H new ATOM 1442 N PHE B 788 -7.376 4.672 -3.790 1.00 0.00 N ATOM 1443 CA PHE B 788 -6.740 4.081 -2.581 1.00 0.00 C ATOM 1444 C PHE B 788 -6.313 2.639 -2.840 1.00 0.00 C ATOM 1445 O PHE B 788 -5.207 2.245 -2.528 1.00 0.00 O ATOM 1446 CB PHE B 788 -7.830 4.119 -1.515 1.00 0.00 C ATOM 1447 CG PHE B 788 -7.281 3.583 -0.215 1.00 0.00 C ATOM 1448 CD1 PHE B 788 -6.583 4.434 0.651 1.00 0.00 C ATOM 1449 CD2 PHE B 788 -7.462 2.235 0.123 1.00 0.00 C ATOM 1450 CE1 PHE B 788 -6.073 3.940 1.857 1.00 0.00 C ATOM 1451 CE2 PHE B 788 -6.949 1.741 1.329 1.00 0.00 C ATOM 1452 CZ PHE B 788 -6.255 2.594 2.196 1.00 0.00 C ATOM 0 H PHE B 788 -8.348 4.957 -3.672 1.00 0.00 H new ATOM 0 HA PHE B 788 -5.843 4.625 -2.286 1.00 0.00 H new ATOM 0 HB2 PHE B 788 -8.185 5.141 -1.379 1.00 0.00 H new ATOM 0 HB3 PHE B 788 -8.686 3.524 -1.833 1.00 0.00 H new ATOM 0 HD1 PHE B 788 -6.438 5.471 0.388 1.00 0.00 H new ATOM 0 HD2 PHE B 788 -7.997 1.577 -0.546 1.00 0.00 H new ATOM 0 HE1 PHE B 788 -5.539 4.598 2.527 1.00 0.00 H new ATOM 0 HE2 PHE B 788 -7.089 0.702 1.590 1.00 0.00 H new ATOM 0 HZ PHE B 788 -5.860 2.213 3.126 1.00 0.00 H new ATOM 1462 N MET B 789 -7.187 1.838 -3.383 1.00 0.00 N ATOM 1463 CA MET B 789 -6.821 0.419 -3.640 1.00 0.00 C ATOM 1464 C MET B 789 -5.558 0.354 -4.495 1.00 0.00 C ATOM 1465 O MET B 789 -4.735 -0.520 -4.332 1.00 0.00 O ATOM 1466 CB MET B 789 -8.013 -0.192 -4.390 1.00 0.00 C ATOM 1467 CG MET B 789 -9.309 -0.029 -3.577 1.00 0.00 C ATOM 1468 SD MET B 789 -9.084 -0.652 -1.887 1.00 0.00 S ATOM 1469 CE MET B 789 -8.966 -2.409 -2.301 1.00 0.00 C ATOM 0 H MET B 789 -8.133 2.103 -3.658 1.00 0.00 H new ATOM 0 HA MET B 789 -6.615 -0.122 -2.716 1.00 0.00 H new ATOM 0 HB2 MET B 789 -8.124 0.291 -5.361 1.00 0.00 H new ATOM 0 HB3 MET B 789 -7.827 -1.249 -4.579 1.00 0.00 H new ATOM 0 HG2 MET B 789 -9.597 1.022 -3.548 1.00 0.00 H new ATOM 0 HG3 MET B 789 -10.121 -0.569 -4.064 1.00 0.00 H new ATOM 0 HE1 MET B 789 -9.866 -2.923 -1.964 1.00 0.00 H new ATOM 0 HE2 MET B 789 -8.865 -2.523 -3.380 1.00 0.00 H new ATOM 0 HE3 MET B 789 -8.095 -2.841 -1.808 1.00 0.00 H new ATOM 1479 N ALA B 790 -5.385 1.287 -5.390 1.00 0.00 N ATOM 1480 CA ALA B 790 -4.161 1.283 -6.239 1.00 0.00 C ATOM 1481 C ALA B 790 -2.916 1.462 -5.371 1.00 0.00 C ATOM 1482 O ALA B 790 -2.005 0.659 -5.399 1.00 0.00 O ATOM 1483 CB ALA B 790 -4.325 2.482 -7.173 1.00 0.00 C ATOM 0 H ALA B 790 -6.037 2.051 -5.570 1.00 0.00 H new ATOM 0 HA ALA B 790 -4.043 0.347 -6.785 1.00 0.00 H new ATOM 0 HB1 ALA B 790 -3.461 2.549 -7.834 1.00 0.00 H new ATOM 0 HB2 ALA B 790 -5.229 2.358 -7.769 1.00 0.00 H new ATOM 0 HB3 ALA B 790 -4.402 3.395 -6.583 1.00 0.00 H new ATOM 1489 N ASP B 791 -2.870 2.515 -4.601 1.00 0.00 N ATOM 1490 CA ASP B 791 -1.686 2.751 -3.728 1.00 0.00 C ATOM 1491 C ASP B 791 -1.405 1.513 -2.875 1.00 0.00 C ATOM 1492 O ASP B 791 -0.271 1.135 -2.668 1.00 0.00 O ATOM 1493 CB ASP B 791 -2.080 3.933 -2.841 1.00 0.00 C ATOM 1494 CG ASP B 791 -2.400 5.146 -3.718 1.00 0.00 C ATOM 1495 OD1 ASP B 791 -1.723 5.326 -4.717 1.00 0.00 O ATOM 1496 OD2 ASP B 791 -3.317 5.875 -3.375 1.00 0.00 O ATOM 0 H ASP B 791 -3.602 3.222 -4.539 1.00 0.00 H new ATOM 0 HA ASP B 791 -0.782 2.954 -4.302 1.00 0.00 H new ATOM 0 HB2 ASP B 791 -2.946 3.672 -2.233 1.00 0.00 H new ATOM 0 HB3 ASP B 791 -1.268 4.172 -2.154 1.00 0.00 H new ATOM 1501 N LEU B 792 -2.432 0.873 -2.388 1.00 0.00 N ATOM 1502 CA LEU B 792 -2.223 -0.342 -1.552 1.00 0.00 C ATOM 1503 C LEU B 792 -1.763 -1.514 -2.421 1.00 0.00 C ATOM 1504 O LEU B 792 -0.772 -2.156 -2.136 1.00 0.00 O ATOM 1505 CB LEU B 792 -3.593 -0.631 -0.938 1.00 0.00 C ATOM 1506 CG LEU B 792 -3.460 -0.745 0.583 1.00 0.00 C ATOM 1507 CD1 LEU B 792 -2.855 0.543 1.147 1.00 0.00 C ATOM 1508 CD2 LEU B 792 -4.844 -0.967 1.195 1.00 0.00 C ATOM 0 H LEU B 792 -3.406 1.139 -2.533 1.00 0.00 H new ATOM 0 HA LEU B 792 -1.455 -0.196 -0.792 1.00 0.00 H new ATOM 0 HB2 LEU B 792 -4.292 0.165 -1.193 1.00 0.00 H new ATOM 0 HB3 LEU B 792 -3.999 -1.556 -1.348 1.00 0.00 H new ATOM 0 HG LEU B 792 -2.810 -1.585 0.828 1.00 0.00 H new ATOM 0 HD11 LEU B 792 -2.762 0.458 2.230 1.00 0.00 H new ATOM 0 HD12 LEU B 792 -1.870 0.704 0.710 1.00 0.00 H new ATOM 0 HD13 LEU B 792 -3.502 1.386 0.904 1.00 0.00 H new ATOM 0 HD21 LEU B 792 -4.754 -1.049 2.278 1.00 0.00 H new ATOM 0 HD22 LEU B 792 -5.491 -0.125 0.947 1.00 0.00 H new ATOM 0 HD23 LEU B 792 -5.275 -1.885 0.796 1.00 0.00 H new ATOM 1520 N GLN B 793 -2.468 -1.796 -3.485 1.00 0.00 N ATOM 1521 CA GLN B 793 -2.048 -2.914 -4.378 1.00 0.00 C ATOM 1522 C GLN B 793 -0.601 -2.703 -4.816 1.00 0.00 C ATOM 1523 O GLN B 793 0.229 -3.583 -4.707 1.00 0.00 O ATOM 1524 CB GLN B 793 -2.984 -2.836 -5.587 1.00 0.00 C ATOM 1525 CG GLN B 793 -3.523 -4.230 -5.905 1.00 0.00 C ATOM 1526 CD GLN B 793 -2.373 -5.129 -6.362 1.00 0.00 C ATOM 1527 OE1 GLN B 793 -1.921 -5.033 -7.486 1.00 0.00 O ATOM 1528 NE2 GLN B 793 -1.877 -6.006 -5.533 1.00 0.00 N ATOM 0 H GLN B 793 -3.313 -1.302 -3.773 1.00 0.00 H new ATOM 0 HA GLN B 793 -2.105 -3.884 -3.884 1.00 0.00 H new ATOM 0 HB2 GLN B 793 -3.809 -2.154 -5.378 1.00 0.00 H new ATOM 0 HB3 GLN B 793 -2.450 -2.436 -6.449 1.00 0.00 H new ATOM 0 HG2 GLN B 793 -4.003 -4.656 -5.024 1.00 0.00 H new ATOM 0 HG3 GLN B 793 -4.283 -4.169 -6.684 1.00 0.00 H new ATOM 0 HE21 GLN B 793 -2.256 -6.087 -4.589 1.00 0.00 H new ATOM 0 HE22 GLN B 793 -1.110 -6.610 -5.828 1.00 0.00 H new ATOM 1537 N ARG B 794 -0.293 -1.530 -5.292 1.00 0.00 N ATOM 1538 CA ARG B 794 1.101 -1.236 -5.715 1.00 0.00 C ATOM 1539 C ARG B 794 2.063 -1.500 -4.553 1.00 0.00 C ATOM 1540 O ARG B 794 3.068 -2.166 -4.704 1.00 0.00 O ATOM 1541 CB ARG B 794 1.079 0.252 -6.080 1.00 0.00 C ATOM 1542 CG ARG B 794 0.648 0.412 -7.539 1.00 0.00 C ATOM 1543 CD ARG B 794 1.697 -0.225 -8.454 1.00 0.00 C ATOM 1544 NE ARG B 794 1.097 -1.525 -8.874 1.00 0.00 N ATOM 1545 CZ ARG B 794 1.728 -2.322 -9.706 1.00 0.00 C ATOM 1546 NH1 ARG B 794 2.902 -2.000 -10.191 1.00 0.00 N ATOM 1547 NH2 ARG B 794 1.178 -3.453 -10.054 1.00 0.00 N ATOM 0 H ARG B 794 -0.951 -0.759 -5.406 1.00 0.00 H new ATOM 0 HA ARG B 794 1.436 -1.856 -6.546 1.00 0.00 H new ATOM 0 HB2 ARG B 794 0.392 0.788 -5.426 1.00 0.00 H new ATOM 0 HB3 ARG B 794 2.067 0.689 -5.931 1.00 0.00 H new ATOM 0 HG2 ARG B 794 -0.322 -0.060 -7.697 1.00 0.00 H new ATOM 0 HG3 ARG B 794 0.532 1.468 -7.781 1.00 0.00 H new ATOM 0 HD2 ARG B 794 1.909 0.409 -9.315 1.00 0.00 H new ATOM 0 HD3 ARG B 794 2.640 -0.376 -7.929 1.00 0.00 H new ATOM 0 HE ARG B 794 0.184 -1.799 -8.510 1.00 0.00 H new ATOM 0 HH11 ARG B 794 3.340 -1.119 -9.924 1.00 0.00 H new ATOM 0 HH12 ARG B 794 3.378 -2.631 -10.836 1.00 0.00 H new ATOM 0 HH21 ARG B 794 0.265 -3.712 -9.680 1.00 0.00 H new ATOM 0 HH22 ARG B 794 1.661 -4.078 -10.700 1.00 0.00 H new ATOM 1561 N VAL B 795 1.754 -0.989 -3.392 1.00 0.00 N ATOM 1562 CA VAL B 795 2.628 -1.219 -2.209 1.00 0.00 C ATOM 1563 C VAL B 795 2.827 -2.720 -1.994 1.00 0.00 C ATOM 1564 O VAL B 795 3.884 -3.164 -1.600 1.00 0.00 O ATOM 1565 CB VAL B 795 1.855 -0.593 -1.036 1.00 0.00 C ATOM 1566 CG1 VAL B 795 2.469 -1.019 0.303 1.00 0.00 C ATOM 1567 CG2 VAL B 795 1.912 0.932 -1.149 1.00 0.00 C ATOM 0 H VAL B 795 0.928 -0.418 -3.212 1.00 0.00 H new ATOM 0 HA VAL B 795 3.621 -0.784 -2.321 1.00 0.00 H new ATOM 0 HB VAL B 795 0.821 -0.936 -1.076 1.00 0.00 H new ATOM 0 HG11 VAL B 795 1.908 -0.566 1.121 1.00 0.00 H new ATOM 0 HG12 VAL B 795 2.429 -2.105 0.393 1.00 0.00 H new ATOM 0 HG13 VAL B 795 3.507 -0.690 0.348 1.00 0.00 H new ATOM 0 HG21 VAL B 795 1.365 1.379 -0.319 1.00 0.00 H new ATOM 0 HG22 VAL B 795 2.951 1.261 -1.118 1.00 0.00 H new ATOM 0 HG23 VAL B 795 1.461 1.244 -2.091 1.00 0.00 H new ATOM 1577 N PHE B 796 1.814 -3.502 -2.236 1.00 0.00 N ATOM 1578 CA PHE B 796 1.948 -4.968 -2.032 1.00 0.00 C ATOM 1579 C PHE B 796 2.676 -5.611 -3.212 1.00 0.00 C ATOM 1580 O PHE B 796 3.662 -6.296 -3.042 1.00 0.00 O ATOM 1581 CB PHE B 796 0.511 -5.491 -1.954 1.00 0.00 C ATOM 1582 CG PHE B 796 -0.200 -4.867 -0.775 1.00 0.00 C ATOM 1583 CD1 PHE B 796 0.452 -4.753 0.460 1.00 0.00 C ATOM 1584 CD2 PHE B 796 -1.518 -4.416 -0.914 1.00 0.00 C ATOM 1585 CE1 PHE B 796 -0.210 -4.178 1.551 1.00 0.00 C ATOM 1586 CE2 PHE B 796 -2.180 -3.841 0.177 1.00 0.00 C ATOM 1587 CZ PHE B 796 -1.527 -3.723 1.410 1.00 0.00 C ATOM 0 H PHE B 796 0.901 -3.189 -2.566 1.00 0.00 H new ATOM 0 HA PHE B 796 2.524 -5.202 -1.137 1.00 0.00 H new ATOM 0 HB2 PHE B 796 -0.021 -5.257 -2.876 1.00 0.00 H new ATOM 0 HB3 PHE B 796 0.515 -6.576 -1.855 1.00 0.00 H new ATOM 0 HD1 PHE B 796 1.466 -5.109 0.570 1.00 0.00 H new ATOM 0 HD2 PHE B 796 -2.024 -4.512 -1.863 1.00 0.00 H new ATOM 0 HE1 PHE B 796 0.295 -4.085 2.501 1.00 0.00 H new ATOM 0 HE2 PHE B 796 -3.195 -3.488 0.068 1.00 0.00 H new ATOM 0 HZ PHE B 796 -2.039 -3.281 2.252 1.00 0.00 H new ATOM 1597 N THR B 797 2.196 -5.395 -4.407 1.00 0.00 N ATOM 1598 CA THR B 797 2.828 -6.039 -5.594 1.00 0.00 C ATOM 1599 C THR B 797 4.225 -5.471 -5.879 1.00 0.00 C ATOM 1600 O THR B 797 5.091 -6.177 -6.357 1.00 0.00 O ATOM 1601 CB THR B 797 1.881 -5.742 -6.756 1.00 0.00 C ATOM 1602 OG1 THR B 797 2.406 -6.301 -7.951 1.00 0.00 O ATOM 1603 CG2 THR B 797 1.741 -4.234 -6.918 1.00 0.00 C ATOM 0 H THR B 797 1.393 -4.800 -4.612 1.00 0.00 H new ATOM 0 HA THR B 797 2.971 -7.108 -5.433 1.00 0.00 H new ATOM 0 HB THR B 797 0.904 -6.180 -6.552 1.00 0.00 H new ATOM 0 HG1 THR B 797 1.798 -6.112 -8.696 1.00 0.00 H new ATOM 0 HG21 THR B 797 1.066 -4.018 -7.746 1.00 0.00 H new ATOM 0 HG22 THR B 797 1.338 -3.805 -6.000 1.00 0.00 H new ATOM 0 HG23 THR B 797 2.719 -3.798 -7.124 1.00 0.00 H new ATOM 1611 N ASN B 798 4.463 -4.210 -5.612 1.00 0.00 N ATOM 1612 CA ASN B 798 5.817 -3.650 -5.905 1.00 0.00 C ATOM 1613 C ASN B 798 6.812 -4.065 -4.813 1.00 0.00 C ATOM 1614 O ASN B 798 7.945 -4.402 -5.090 1.00 0.00 O ATOM 1615 CB ASN B 798 5.630 -2.112 -6.001 1.00 0.00 C ATOM 1616 CG ASN B 798 5.810 -1.398 -4.645 1.00 0.00 C ATOM 1617 OD1 ASN B 798 6.793 -1.590 -3.958 1.00 0.00 O ATOM 1618 ND2 ASN B 798 4.929 -0.513 -4.272 1.00 0.00 N ATOM 0 H ASN B 798 3.791 -3.555 -5.211 1.00 0.00 H new ATOM 0 HA ASN B 798 6.234 -4.031 -6.837 1.00 0.00 H new ATOM 0 HB2 ASN B 798 6.347 -1.708 -6.716 1.00 0.00 H new ATOM 0 HB3 ASN B 798 4.635 -1.896 -6.390 1.00 0.00 H new ATOM 0 HD21 ASN B 798 5.068 0.012 -3.409 1.00 0.00 H new ATOM 0 HD22 ASN B 798 4.101 -0.346 -4.843 1.00 0.00 H new ATOM 1625 N CYS B 799 6.395 -4.048 -3.577 1.00 0.00 N ATOM 1626 CA CYS B 799 7.325 -4.436 -2.477 1.00 0.00 C ATOM 1627 C CYS B 799 7.729 -5.905 -2.608 1.00 0.00 C ATOM 1628 O CYS B 799 8.867 -6.267 -2.382 1.00 0.00 O ATOM 1629 CB CYS B 799 6.528 -4.223 -1.195 1.00 0.00 C ATOM 1630 SG CYS B 799 6.516 -2.461 -0.776 1.00 0.00 S ATOM 0 H CYS B 799 5.455 -3.784 -3.281 1.00 0.00 H new ATOM 0 HA CYS B 799 8.245 -3.851 -2.496 1.00 0.00 H new ATOM 0 HB2 CYS B 799 5.508 -4.584 -1.325 1.00 0.00 H new ATOM 0 HB3 CYS B 799 6.968 -4.798 -0.381 1.00 0.00 H new ATOM 0 HG CYS B 799 5.353 -1.955 -1.060 1.00 0.00 H new ATOM 1636 N LYS B 800 6.804 -6.758 -2.950 1.00 0.00 N ATOM 1637 CA LYS B 800 7.146 -8.200 -3.097 1.00 0.00 C ATOM 1638 C LYS B 800 7.850 -8.449 -4.440 1.00 0.00 C ATOM 1639 O LYS B 800 8.345 -9.528 -4.701 1.00 0.00 O ATOM 1640 CB LYS B 800 5.801 -8.937 -3.025 1.00 0.00 C ATOM 1641 CG LYS B 800 4.975 -8.664 -4.285 1.00 0.00 C ATOM 1642 CD LYS B 800 3.657 -9.440 -4.211 1.00 0.00 C ATOM 1643 CE LYS B 800 2.738 -8.795 -3.171 1.00 0.00 C ATOM 1644 NZ LYS B 800 1.913 -9.918 -2.644 1.00 0.00 N ATOM 0 H LYS B 800 5.829 -6.520 -3.134 1.00 0.00 H new ATOM 0 HA LYS B 800 7.833 -8.546 -2.324 1.00 0.00 H new ATOM 0 HB2 LYS B 800 5.971 -10.008 -2.919 1.00 0.00 H new ATOM 0 HB3 LYS B 800 5.248 -8.613 -2.143 1.00 0.00 H new ATOM 0 HG2 LYS B 800 4.776 -7.596 -4.378 1.00 0.00 H new ATOM 0 HG3 LYS B 800 5.535 -8.962 -5.171 1.00 0.00 H new ATOM 0 HD2 LYS B 800 3.171 -9.445 -5.187 1.00 0.00 H new ATOM 0 HD3 LYS B 800 3.850 -10.479 -3.946 1.00 0.00 H new ATOM 0 HE2 LYS B 800 3.313 -8.319 -2.376 1.00 0.00 H new ATOM 0 HE3 LYS B 800 2.114 -8.022 -3.620 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 0.907 -9.659 -2.686 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 2.076 -10.768 -3.220 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 2.180 -10.112 -1.658 1.00 0.00 H new ATOM 1658 N GLU B 801 7.908 -7.455 -5.288 1.00 0.00 N ATOM 1659 CA GLU B 801 8.589 -7.629 -6.599 1.00 0.00 C ATOM 1660 C GLU B 801 10.103 -7.738 -6.397 1.00 0.00 C ATOM 1661 O GLU B 801 10.780 -8.484 -7.077 1.00 0.00 O ATOM 1662 CB GLU B 801 8.243 -6.365 -7.386 1.00 0.00 C ATOM 1663 CG GLU B 801 7.569 -6.756 -8.701 1.00 0.00 C ATOM 1664 CD GLU B 801 8.487 -7.683 -9.503 1.00 0.00 C ATOM 1665 OE1 GLU B 801 9.668 -7.725 -9.197 1.00 0.00 O ATOM 1666 OE2 GLU B 801 7.994 -8.335 -10.408 1.00 0.00 O ATOM 0 H GLU B 801 7.511 -6.529 -5.126 1.00 0.00 H new ATOM 0 HA GLU B 801 8.273 -8.535 -7.116 1.00 0.00 H new ATOM 0 HB2 GLU B 801 7.580 -5.728 -6.800 1.00 0.00 H new ATOM 0 HB3 GLU B 801 9.146 -5.788 -7.585 1.00 0.00 H new ATOM 0 HG2 GLU B 801 6.621 -7.255 -8.499 1.00 0.00 H new ATOM 0 HG3 GLU B 801 7.342 -5.863 -9.283 1.00 0.00 H new ATOM 1673 N TYR B 802 10.635 -7.005 -5.458 1.00 0.00 N ATOM 1674 CA TYR B 802 12.102 -7.064 -5.198 1.00 0.00 C ATOM 1675 C TYR B 802 12.371 -7.853 -3.907 1.00 0.00 C ATOM 1676 O TYR B 802 13.328 -8.596 -3.814 1.00 0.00 O ATOM 1677 CB TYR B 802 12.525 -5.583 -5.064 1.00 0.00 C ATOM 1678 CG TYR B 802 13.794 -5.454 -4.245 1.00 0.00 C ATOM 1679 CD1 TYR B 802 14.929 -6.196 -4.591 1.00 0.00 C ATOM 1680 CD2 TYR B 802 13.812 -4.634 -3.111 1.00 0.00 C ATOM 1681 CE1 TYR B 802 16.093 -6.094 -3.820 1.00 0.00 C ATOM 1682 CE2 TYR B 802 14.974 -4.531 -2.340 1.00 0.00 C ATOM 1683 CZ TYR B 802 16.114 -5.265 -2.691 1.00 0.00 C ATOM 1684 OH TYR B 802 17.263 -5.160 -1.933 1.00 0.00 O ATOM 0 H TYR B 802 10.115 -6.365 -4.857 1.00 0.00 H new ATOM 0 HA TYR B 802 12.662 -7.570 -5.985 1.00 0.00 H new ATOM 0 HB2 TYR B 802 12.681 -5.154 -6.054 1.00 0.00 H new ATOM 0 HB3 TYR B 802 11.724 -5.013 -4.593 1.00 0.00 H new ATOM 0 HD1 TYR B 802 14.907 -6.847 -5.452 1.00 0.00 H new ATOM 0 HD2 TYR B 802 12.928 -4.080 -2.831 1.00 0.00 H new ATOM 0 HE1 TYR B 802 16.974 -6.654 -4.095 1.00 0.00 H new ATOM 0 HE2 TYR B 802 14.992 -3.886 -1.474 1.00 0.00 H new ATOM 0 HH TYR B 802 17.108 -4.544 -1.187 1.00 0.00 H new ATOM 1694 N ASN B 803 11.546 -7.665 -2.908 1.00 0.00 N ATOM 1695 CA ASN B 803 11.751 -8.360 -1.597 1.00 0.00 C ATOM 1696 C ASN B 803 12.171 -9.827 -1.786 1.00 0.00 C ATOM 1697 O ASN B 803 11.923 -10.413 -2.822 1.00 0.00 O ATOM 1698 CB ASN B 803 10.387 -8.291 -0.909 1.00 0.00 C ATOM 1699 CG ASN B 803 10.250 -6.953 -0.182 1.00 0.00 C ATOM 1700 OD1 ASN B 803 11.193 -6.192 -0.102 1.00 0.00 O ATOM 1701 ND2 ASN B 803 9.105 -6.632 0.355 1.00 0.00 N ATOM 0 H ASN B 803 10.730 -7.054 -2.944 1.00 0.00 H new ATOM 0 HA ASN B 803 12.547 -7.891 -1.019 1.00 0.00 H new ATOM 0 HB2 ASN B 803 9.591 -8.400 -1.645 1.00 0.00 H new ATOM 0 HB3 ASN B 803 10.282 -9.114 -0.202 1.00 0.00 H new ATOM 0 HD21 ASN B 803 9.002 -5.742 0.842 1.00 0.00 H new ATOM 0 HD22 ASN B 803 8.313 -7.271 0.288 1.00 0.00 H new ATOM 1708 N PRO B 804 12.809 -10.370 -0.774 1.00 0.00 N ATOM 1709 CA PRO B 804 13.272 -11.778 -0.833 1.00 0.00 C ATOM 1710 C PRO B 804 12.145 -12.709 -1.295 1.00 0.00 C ATOM 1711 O PRO B 804 10.984 -12.400 -1.123 1.00 0.00 O ATOM 1712 CB PRO B 804 13.661 -12.088 0.611 1.00 0.00 C ATOM 1713 CG PRO B 804 13.979 -10.762 1.224 1.00 0.00 C ATOM 1714 CD PRO B 804 13.147 -9.732 0.508 1.00 0.00 C ATOM 0 HA PRO B 804 14.090 -11.921 -1.539 1.00 0.00 H new ATOM 0 HB2 PRO B 804 12.846 -12.582 1.141 1.00 0.00 H new ATOM 0 HB3 PRO B 804 14.520 -12.757 0.652 1.00 0.00 H new ATOM 0 HG2 PRO B 804 13.753 -10.766 2.290 1.00 0.00 H new ATOM 0 HG3 PRO B 804 15.041 -10.536 1.124 1.00 0.00 H new ATOM 0 HD2 PRO B 804 12.251 -9.479 1.075 1.00 0.00 H new ATOM 0 HD3 PRO B 804 13.702 -8.806 0.358 1.00 0.00 H new ATOM 1722 N PRO B 805 12.523 -13.828 -1.864 1.00 0.00 N ATOM 1723 CA PRO B 805 11.516 -14.809 -2.336 1.00 0.00 C ATOM 1724 C PRO B 805 10.762 -15.404 -1.146 1.00 0.00 C ATOM 1725 O PRO B 805 11.071 -16.483 -0.680 1.00 0.00 O ATOM 1726 CB PRO B 805 12.348 -15.884 -3.038 1.00 0.00 C ATOM 1727 CG PRO B 805 13.736 -15.729 -2.499 1.00 0.00 C ATOM 1728 CD PRO B 805 13.899 -14.287 -2.105 1.00 0.00 C ATOM 0 HA PRO B 805 10.766 -14.367 -2.991 1.00 0.00 H new ATOM 0 HB2 PRO B 805 11.956 -16.880 -2.833 1.00 0.00 H new ATOM 0 HB3 PRO B 805 12.330 -15.751 -4.120 1.00 0.00 H new ATOM 0 HG2 PRO B 805 13.891 -16.383 -1.641 1.00 0.00 H new ATOM 0 HG3 PRO B 805 14.474 -16.009 -3.250 1.00 0.00 H new ATOM 0 HD2 PRO B 805 14.516 -14.184 -1.213 1.00 0.00 H new ATOM 0 HD3 PRO B 805 14.380 -13.709 -2.894 1.00 0.00 H new ATOM 1736 N GLU B 806 9.781 -14.705 -0.643 1.00 0.00 N ATOM 1737 CA GLU B 806 9.017 -15.226 0.526 1.00 0.00 C ATOM 1738 C GLU B 806 9.975 -15.582 1.665 1.00 0.00 C ATOM 1739 O GLU B 806 9.832 -16.598 2.315 1.00 0.00 O ATOM 1740 CB GLU B 806 8.310 -16.482 0.010 1.00 0.00 C ATOM 1741 CG GLU B 806 6.805 -16.356 0.254 1.00 0.00 C ATOM 1742 CD GLU B 806 6.228 -17.731 0.600 1.00 0.00 C ATOM 1743 OE1 GLU B 806 6.866 -18.446 1.354 1.00 0.00 O ATOM 1744 OE2 GLU B 806 5.159 -18.044 0.103 1.00 0.00 O ATOM 0 H GLU B 806 9.476 -13.796 -0.991 1.00 0.00 H new ATOM 0 HA GLU B 806 8.312 -14.493 0.919 1.00 0.00 H new ATOM 0 HB2 GLU B 806 8.507 -16.612 -1.054 1.00 0.00 H new ATOM 0 HB3 GLU B 806 8.699 -17.365 0.517 1.00 0.00 H new ATOM 0 HG2 GLU B 806 6.615 -15.655 1.067 1.00 0.00 H new ATOM 0 HG3 GLU B 806 6.314 -15.956 -0.633 1.00 0.00 H new ATOM 1751 N SER B 807 10.956 -14.755 1.907 1.00 0.00 N ATOM 1752 CA SER B 807 11.922 -15.049 3.003 1.00 0.00 C ATOM 1753 C SER B 807 11.499 -14.342 4.290 1.00 0.00 C ATOM 1754 O SER B 807 11.191 -14.971 5.282 1.00 0.00 O ATOM 1755 CB SER B 807 13.262 -14.501 2.510 1.00 0.00 C ATOM 1756 OG SER B 807 14.320 -15.269 3.066 1.00 0.00 O ATOM 0 H SER B 807 11.130 -13.891 1.394 1.00 0.00 H new ATOM 0 HA SER B 807 11.973 -16.114 3.229 1.00 0.00 H new ATOM 0 HB2 SER B 807 13.304 -14.538 1.421 1.00 0.00 H new ATOM 0 HB3 SER B 807 13.367 -13.455 2.797 1.00 0.00 H new ATOM 0 HG SER B 807 15.179 -14.920 2.749 1.00 0.00 H new ATOM 1762 N GLU B 808 11.481 -13.038 4.285 1.00 0.00 N ATOM 1763 CA GLU B 808 11.078 -12.301 5.514 1.00 0.00 C ATOM 1764 C GLU B 808 10.253 -11.066 5.151 1.00 0.00 C ATOM 1765 O GLU B 808 9.258 -10.764 5.779 1.00 0.00 O ATOM 1766 CB GLU B 808 12.394 -11.888 6.172 1.00 0.00 C ATOM 1767 CG GLU B 808 12.447 -12.438 7.599 1.00 0.00 C ATOM 1768 CD GLU B 808 11.952 -11.369 8.576 1.00 0.00 C ATOM 1769 OE1 GLU B 808 12.283 -10.212 8.374 1.00 0.00 O ATOM 1770 OE2 GLU B 808 11.252 -11.726 9.509 1.00 0.00 O ATOM 0 H GLU B 808 11.727 -12.453 3.486 1.00 0.00 H new ATOM 0 HA GLU B 808 10.460 -12.909 6.174 1.00 0.00 H new ATOM 0 HB2 GLU B 808 13.237 -12.267 5.594 1.00 0.00 H new ATOM 0 HB3 GLU B 808 12.480 -10.802 6.186 1.00 0.00 H new ATOM 0 HG2 GLU B 808 11.829 -13.333 7.679 1.00 0.00 H new ATOM 0 HG3 GLU B 808 13.467 -12.731 7.850 1.00 0.00 H new ATOM 1777 N TYR B 809 10.671 -10.338 4.153 1.00 0.00 N ATOM 1778 CA TYR B 809 9.912 -9.118 3.752 1.00 0.00 C ATOM 1779 C TYR B 809 8.708 -9.497 2.885 1.00 0.00 C ATOM 1780 O TYR B 809 7.607 -9.030 3.098 1.00 0.00 O ATOM 1781 CB TYR B 809 10.908 -8.279 2.949 1.00 0.00 C ATOM 1782 CG TYR B 809 11.187 -6.989 3.684 1.00 0.00 C ATOM 1783 CD1 TYR B 809 11.679 -7.025 4.995 1.00 0.00 C ATOM 1784 CD2 TYR B 809 10.958 -5.757 3.057 1.00 0.00 C ATOM 1785 CE1 TYR B 809 11.939 -5.832 5.679 1.00 0.00 C ATOM 1786 CE2 TYR B 809 11.219 -4.563 3.742 1.00 0.00 C ATOM 1787 CZ TYR B 809 11.709 -4.601 5.053 1.00 0.00 C ATOM 1788 OH TYR B 809 11.967 -3.425 5.727 1.00 0.00 O ATOM 0 H TYR B 809 11.504 -10.534 3.598 1.00 0.00 H new ATOM 0 HA TYR B 809 9.521 -8.577 4.613 1.00 0.00 H new ATOM 0 HB2 TYR B 809 11.834 -8.835 2.804 1.00 0.00 H new ATOM 0 HB3 TYR B 809 10.505 -8.066 1.959 1.00 0.00 H new ATOM 0 HD1 TYR B 809 11.858 -7.974 5.478 1.00 0.00 H new ATOM 0 HD2 TYR B 809 10.580 -5.728 2.046 1.00 0.00 H new ATOM 0 HE1 TYR B 809 12.317 -5.861 6.690 1.00 0.00 H new ATOM 0 HE2 TYR B 809 11.042 -3.613 3.259 1.00 0.00 H new ATOM 0 HH TYR B 809 11.754 -2.663 5.149 1.00 0.00 H new ATOM 1798 N TYR B 810 8.912 -10.336 1.908 1.00 0.00 N ATOM 1799 CA TYR B 810 7.783 -10.740 1.022 1.00 0.00 C ATOM 1800 C TYR B 810 6.637 -11.330 1.847 1.00 0.00 C ATOM 1801 O TYR B 810 5.484 -11.244 1.474 1.00 0.00 O ATOM 1802 CB TYR B 810 8.380 -11.801 0.097 1.00 0.00 C ATOM 1803 CG TYR B 810 7.317 -12.317 -0.843 1.00 0.00 C ATOM 1804 CD1 TYR B 810 6.336 -13.201 -0.377 1.00 0.00 C ATOM 1805 CD2 TYR B 810 7.320 -11.920 -2.186 1.00 0.00 C ATOM 1806 CE1 TYR B 810 5.354 -13.681 -1.252 1.00 0.00 C ATOM 1807 CE2 TYR B 810 6.338 -12.401 -3.060 1.00 0.00 C ATOM 1808 CZ TYR B 810 5.354 -13.280 -2.593 1.00 0.00 C ATOM 1809 OH TYR B 810 4.387 -13.755 -3.456 1.00 0.00 O ATOM 0 H TYR B 810 9.812 -10.760 1.684 1.00 0.00 H new ATOM 0 HA TYR B 810 7.367 -9.897 0.471 1.00 0.00 H new ATOM 0 HB2 TYR B 810 9.207 -11.376 -0.472 1.00 0.00 H new ATOM 0 HB3 TYR B 810 8.787 -12.623 0.686 1.00 0.00 H new ATOM 0 HD1 TYR B 810 6.337 -13.512 0.657 1.00 0.00 H new ATOM 0 HD2 TYR B 810 8.080 -11.243 -2.547 1.00 0.00 H new ATOM 0 HE1 TYR B 810 4.596 -14.361 -0.892 1.00 0.00 H new ATOM 0 HE2 TYR B 810 6.340 -12.094 -4.095 1.00 0.00 H new ATOM 0 HH TYR B 810 4.531 -13.377 -4.349 1.00 0.00 H new ATOM 1819 N LYS B 811 6.942 -11.931 2.964 1.00 0.00 N ATOM 1820 CA LYS B 811 5.865 -12.524 3.807 1.00 0.00 C ATOM 1821 C LYS B 811 4.867 -11.444 4.231 1.00 0.00 C ATOM 1822 O LYS B 811 3.669 -11.643 4.197 1.00 0.00 O ATOM 1823 CB LYS B 811 6.589 -13.091 5.030 1.00 0.00 C ATOM 1824 CG LYS B 811 6.846 -14.586 4.826 1.00 0.00 C ATOM 1825 CD LYS B 811 5.580 -15.374 5.169 1.00 0.00 C ATOM 1826 CE LYS B 811 5.474 -15.534 6.687 1.00 0.00 C ATOM 1827 NZ LYS B 811 4.308 -16.438 6.895 1.00 0.00 N ATOM 0 H LYS B 811 7.888 -12.037 3.329 1.00 0.00 H new ATOM 0 HA LYS B 811 5.298 -13.288 3.275 1.00 0.00 H new ATOM 0 HB2 LYS B 811 7.532 -12.567 5.182 1.00 0.00 H new ATOM 0 HB3 LYS B 811 5.989 -12.934 5.926 1.00 0.00 H new ATOM 0 HG2 LYS B 811 7.138 -14.778 3.793 1.00 0.00 H new ATOM 0 HG3 LYS B 811 7.673 -14.913 5.457 1.00 0.00 H new ATOM 0 HD2 LYS B 811 4.701 -14.856 4.785 1.00 0.00 H new ATOM 0 HD3 LYS B 811 5.607 -16.353 4.690 1.00 0.00 H new ATOM 0 HE2 LYS B 811 6.386 -15.962 7.104 1.00 0.00 H new ATOM 0 HE3 LYS B 811 5.321 -14.572 7.176 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 4.169 -16.597 7.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 3.454 -16.001 6.493 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 4.486 -17.348 6.424 1.00 0.00 H new ATOM 1841 N CYS B 812 5.354 -10.300 4.626 1.00 0.00 N ATOM 1842 CA CYS B 812 4.439 -9.207 5.057 1.00 0.00 C ATOM 1843 C CYS B 812 3.447 -8.863 3.946 1.00 0.00 C ATOM 1844 O CYS B 812 2.262 -8.731 4.182 1.00 0.00 O ATOM 1845 CB CYS B 812 5.357 -8.016 5.330 1.00 0.00 C ATOM 1846 SG CYS B 812 6.557 -8.457 6.612 1.00 0.00 S ATOM 0 H CYS B 812 6.348 -10.075 4.669 1.00 0.00 H new ATOM 0 HA CYS B 812 3.849 -9.489 5.929 1.00 0.00 H new ATOM 0 HB2 CYS B 812 5.876 -7.727 4.416 1.00 0.00 H new ATOM 0 HB3 CYS B 812 4.769 -7.156 5.649 1.00 0.00 H new ATOM 0 HG CYS B 812 7.456 -9.251 6.110 1.00 0.00 H new ATOM 1852 N ALA B 813 3.915 -8.708 2.736 1.00 0.00 N ATOM 1853 CA ALA B 813 2.984 -8.372 1.620 1.00 0.00 C ATOM 1854 C ALA B 813 1.825 -9.365 1.590 1.00 0.00 C ATOM 1855 O ALA B 813 0.674 -8.986 1.548 1.00 0.00 O ATOM 1856 CB ALA B 813 3.821 -8.493 0.345 1.00 0.00 C ATOM 0 H ALA B 813 4.896 -8.799 2.473 1.00 0.00 H new ATOM 0 HA ALA B 813 2.554 -7.376 1.729 1.00 0.00 H new ATOM 0 HB1 ALA B 813 3.201 -8.260 -0.521 1.00 0.00 H new ATOM 0 HB2 ALA B 813 4.657 -7.795 0.391 1.00 0.00 H new ATOM 0 HB3 ALA B 813 4.202 -9.510 0.255 1.00 0.00 H new ATOM 1862 N ASN B 814 2.119 -10.635 1.644 1.00 0.00 N ATOM 1863 CA ASN B 814 1.032 -11.652 1.632 1.00 0.00 C ATOM 1864 C ASN B 814 0.029 -11.370 2.754 1.00 0.00 C ATOM 1865 O ASN B 814 -1.133 -11.118 2.510 1.00 0.00 O ATOM 1866 CB ASN B 814 1.740 -12.986 1.875 1.00 0.00 C ATOM 1867 CG ASN B 814 1.338 -13.983 0.787 1.00 0.00 C ATOM 1868 OD1 ASN B 814 1.006 -13.596 -0.316 1.00 0.00 O ATOM 1869 ND2 ASN B 814 1.356 -15.261 1.051 1.00 0.00 N ATOM 0 H ASN B 814 3.065 -11.012 1.696 1.00 0.00 H new ATOM 0 HA ASN B 814 0.473 -11.647 0.697 1.00 0.00 H new ATOM 0 HB2 ASN B 814 2.820 -12.842 1.870 1.00 0.00 H new ATOM 0 HB3 ASN B 814 1.475 -13.377 2.857 1.00 0.00 H new ATOM 0 HD21 ASN B 814 1.092 -15.934 0.332 1.00 0.00 H new ATOM 0 HD22 ASN B 814 1.635 -15.587 1.977 1.00 0.00 H new ATOM 1876 N ILE B 815 0.473 -11.408 3.982 1.00 0.00 N ATOM 1877 CA ILE B 815 -0.452 -11.150 5.123 1.00 0.00 C ATOM 1878 C ILE B 815 -1.214 -9.839 4.912 1.00 0.00 C ATOM 1879 O ILE B 815 -2.425 -9.827 4.815 1.00 0.00 O ATOM 1880 CB ILE B 815 0.463 -11.054 6.349 1.00 0.00 C ATOM 1881 CG1 ILE B 815 1.090 -12.423 6.621 1.00 0.00 C ATOM 1882 CG2 ILE B 815 -0.348 -10.615 7.573 1.00 0.00 C ATOM 1883 CD1 ILE B 815 2.463 -12.236 7.268 1.00 0.00 C ATOM 0 H ILE B 815 1.438 -11.607 4.244 1.00 0.00 H new ATOM 0 HA ILE B 815 -1.205 -11.931 5.231 1.00 0.00 H new ATOM 0 HB ILE B 815 1.246 -10.321 6.156 1.00 0.00 H new ATOM 0 HG12 ILE B 815 0.444 -13.007 7.276 1.00 0.00 H new ATOM 0 HG13 ILE B 815 1.188 -12.981 5.690 1.00 0.00 H new ATOM 0 HG21 ILE B 815 0.309 -10.549 8.440 1.00 0.00 H new ATOM 0 HG22 ILE B 815 -0.796 -9.640 7.382 1.00 0.00 H new ATOM 0 HG23 ILE B 815 -1.135 -11.344 7.769 1.00 0.00 H new ATOM 0 HD11 ILE B 815 2.910 -13.211 7.462 1.00 0.00 H new ATOM 0 HD12 ILE B 815 3.107 -11.669 6.596 1.00 0.00 H new ATOM 0 HD13 ILE B 815 2.352 -11.695 8.208 1.00 0.00 H new ATOM 1895 N LEU B 816 -0.522 -8.731 4.846 1.00 0.00 N ATOM 1896 CA LEU B 816 -1.226 -7.429 4.647 1.00 0.00 C ATOM 1897 C LEU B 816 -2.177 -7.519 3.454 1.00 0.00 C ATOM 1898 O LEU B 816 -3.353 -7.239 3.565 1.00 0.00 O ATOM 1899 CB LEU B 816 -0.119 -6.414 4.373 1.00 0.00 C ATOM 1900 CG LEU B 816 -0.029 -5.438 5.546 1.00 0.00 C ATOM 1901 CD1 LEU B 816 1.094 -4.435 5.287 1.00 0.00 C ATOM 1902 CD2 LEU B 816 -1.356 -4.692 5.698 1.00 0.00 C ATOM 0 H LEU B 816 0.493 -8.671 4.921 1.00 0.00 H new ATOM 0 HA LEU B 816 -1.827 -7.151 5.513 1.00 0.00 H new ATOM 0 HB2 LEU B 816 0.834 -6.925 4.236 1.00 0.00 H new ATOM 0 HB3 LEU B 816 -0.326 -5.873 3.450 1.00 0.00 H new ATOM 0 HG LEU B 816 0.180 -5.991 6.462 1.00 0.00 H new ATOM 0 HD11 LEU B 816 1.159 -3.738 6.123 1.00 0.00 H new ATOM 0 HD12 LEU B 816 2.040 -4.967 5.183 1.00 0.00 H new ATOM 0 HD13 LEU B 816 0.885 -3.884 4.370 1.00 0.00 H new ATOM 0 HD21 LEU B 816 -1.289 -3.997 6.535 1.00 0.00 H new ATOM 0 HD22 LEU B 816 -1.569 -4.139 4.783 1.00 0.00 H new ATOM 0 HD23 LEU B 816 -2.157 -5.408 5.884 1.00 0.00 H new ATOM 1914 N GLU B 817 -1.684 -7.935 2.319 1.00 0.00 N ATOM 1915 CA GLU B 817 -2.576 -8.078 1.136 1.00 0.00 C ATOM 1916 C GLU B 817 -3.751 -8.994 1.496 1.00 0.00 C ATOM 1917 O GLU B 817 -4.811 -8.925 0.908 1.00 0.00 O ATOM 1918 CB GLU B 817 -1.690 -8.708 0.045 1.00 0.00 C ATOM 1919 CG GLU B 817 -2.560 -9.247 -1.100 1.00 0.00 C ATOM 1920 CD GLU B 817 -1.677 -9.994 -2.102 1.00 0.00 C ATOM 1921 OE1 GLU B 817 -1.169 -9.354 -3.007 1.00 0.00 O ATOM 1922 OE2 GLU B 817 -1.525 -11.195 -1.946 1.00 0.00 O ATOM 0 H GLU B 817 -0.707 -8.181 2.161 1.00 0.00 H new ATOM 0 HA GLU B 817 -3.000 -7.131 0.802 1.00 0.00 H new ATOM 0 HB2 GLU B 817 -0.990 -7.966 -0.339 1.00 0.00 H new ATOM 0 HB3 GLU B 817 -1.095 -9.516 0.471 1.00 0.00 H new ATOM 0 HG2 GLU B 817 -3.326 -9.914 -0.706 1.00 0.00 H new ATOM 0 HG3 GLU B 817 -3.077 -8.426 -1.596 1.00 0.00 H new ATOM 1929 N LYS B 818 -3.566 -9.852 2.458 1.00 0.00 N ATOM 1930 CA LYS B 818 -4.667 -10.765 2.860 1.00 0.00 C ATOM 1931 C LYS B 818 -5.652 -10.045 3.784 1.00 0.00 C ATOM 1932 O LYS B 818 -6.841 -10.009 3.537 1.00 0.00 O ATOM 1933 CB LYS B 818 -3.974 -11.900 3.609 1.00 0.00 C ATOM 1934 CG LYS B 818 -4.268 -13.224 2.918 1.00 0.00 C ATOM 1935 CD LYS B 818 -3.498 -13.250 1.614 1.00 0.00 C ATOM 1936 CE LYS B 818 -2.776 -14.586 1.480 1.00 0.00 C ATOM 1937 NZ LYS B 818 -1.538 -14.278 0.711 1.00 0.00 N ATOM 0 H LYS B 818 -2.698 -9.960 2.983 1.00 0.00 H new ATOM 0 HA LYS B 818 -5.240 -11.120 2.004 1.00 0.00 H new ATOM 0 HB2 LYS B 818 -2.899 -11.725 3.639 1.00 0.00 H new ATOM 0 HB3 LYS B 818 -4.321 -11.933 4.642 1.00 0.00 H new ATOM 0 HG2 LYS B 818 -3.972 -14.059 3.552 1.00 0.00 H new ATOM 0 HG3 LYS B 818 -5.337 -13.328 2.732 1.00 0.00 H new ATOM 0 HD2 LYS B 818 -4.178 -13.105 0.774 1.00 0.00 H new ATOM 0 HD3 LYS B 818 -2.779 -12.431 1.587 1.00 0.00 H new ATOM 0 HE2 LYS B 818 -2.539 -15.007 2.457 1.00 0.00 H new ATOM 0 HE3 LYS B 818 -3.393 -15.318 0.959 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 -0.978 -15.146 0.592 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 -1.795 -13.901 -0.224 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 -0.976 -13.571 1.227 1.00 0.00 H new ATOM 1951 N PHE B 819 -5.164 -9.484 4.857 1.00 0.00 N ATOM 1952 CA PHE B 819 -6.067 -8.791 5.820 1.00 0.00 C ATOM 1953 C PHE B 819 -6.830 -7.654 5.137 1.00 0.00 C ATOM 1954 O PHE B 819 -8.045 -7.643 5.108 1.00 0.00 O ATOM 1955 CB PHE B 819 -5.139 -8.231 6.900 1.00 0.00 C ATOM 1956 CG PHE B 819 -5.544 -8.786 8.244 1.00 0.00 C ATOM 1957 CD1 PHE B 819 -5.592 -10.171 8.443 1.00 0.00 C ATOM 1958 CD2 PHE B 819 -5.873 -7.916 9.290 1.00 0.00 C ATOM 1959 CE1 PHE B 819 -5.968 -10.686 9.689 1.00 0.00 C ATOM 1960 CE2 PHE B 819 -6.248 -8.431 10.536 1.00 0.00 C ATOM 1961 CZ PHE B 819 -6.296 -9.816 10.736 1.00 0.00 C ATOM 0 H PHE B 819 -4.176 -9.476 5.109 1.00 0.00 H new ATOM 0 HA PHE B 819 -6.818 -9.469 6.227 1.00 0.00 H new ATOM 0 HB2 PHE B 819 -4.105 -8.497 6.681 1.00 0.00 H new ATOM 0 HB3 PHE B 819 -5.192 -7.142 6.912 1.00 0.00 H new ATOM 0 HD1 PHE B 819 -5.339 -10.842 7.635 1.00 0.00 H new ATOM 0 HD2 PHE B 819 -5.837 -6.848 9.136 1.00 0.00 H new ATOM 0 HE1 PHE B 819 -6.005 -11.754 9.843 1.00 0.00 H new ATOM 0 HE2 PHE B 819 -6.500 -7.760 11.344 1.00 0.00 H new ATOM 0 HZ PHE B 819 -6.586 -10.213 11.698 1.00 0.00 H new ATOM 1971 N PHE B 820 -6.135 -6.687 4.599 1.00 0.00 N ATOM 1972 CA PHE B 820 -6.840 -5.545 3.944 1.00 0.00 C ATOM 1973 C PHE B 820 -7.857 -6.073 2.916 1.00 0.00 C ATOM 1974 O PHE B 820 -8.818 -5.410 2.583 1.00 0.00 O ATOM 1975 CB PHE B 820 -5.711 -4.688 3.310 1.00 0.00 C ATOM 1976 CG PHE B 820 -5.597 -4.893 1.809 1.00 0.00 C ATOM 1977 CD1 PHE B 820 -5.149 -6.115 1.300 1.00 0.00 C ATOM 1978 CD2 PHE B 820 -5.946 -3.857 0.935 1.00 0.00 C ATOM 1979 CE1 PHE B 820 -5.047 -6.303 -0.084 1.00 0.00 C ATOM 1980 CE2 PHE B 820 -5.843 -4.043 -0.448 1.00 0.00 C ATOM 1981 CZ PHE B 820 -5.393 -5.266 -0.958 1.00 0.00 C ATOM 0 H PHE B 820 -5.116 -6.638 4.584 1.00 0.00 H new ATOM 0 HA PHE B 820 -7.425 -4.941 4.637 1.00 0.00 H new ATOM 0 HB2 PHE B 820 -5.900 -3.634 3.516 1.00 0.00 H new ATOM 0 HB3 PHE B 820 -4.761 -4.939 3.781 1.00 0.00 H new ATOM 0 HD1 PHE B 820 -4.881 -6.915 1.974 1.00 0.00 H new ATOM 0 HD2 PHE B 820 -6.295 -2.914 1.328 1.00 0.00 H new ATOM 0 HE1 PHE B 820 -4.701 -7.248 -0.477 1.00 0.00 H new ATOM 0 HE2 PHE B 820 -6.111 -3.243 -1.122 1.00 0.00 H new ATOM 0 HZ PHE B 820 -5.313 -5.410 -2.025 1.00 0.00 H new ATOM 1991 N PHE B 821 -7.647 -7.264 2.421 1.00 0.00 N ATOM 1992 CA PHE B 821 -8.595 -7.841 1.424 1.00 0.00 C ATOM 1993 C PHE B 821 -9.958 -8.092 2.072 1.00 0.00 C ATOM 1994 O PHE B 821 -10.970 -7.588 1.628 1.00 0.00 O ATOM 1995 CB PHE B 821 -7.959 -9.165 0.995 1.00 0.00 C ATOM 1996 CG PHE B 821 -7.995 -9.275 -0.511 1.00 0.00 C ATOM 1997 CD1 PHE B 821 -9.167 -8.959 -1.210 1.00 0.00 C ATOM 1998 CD2 PHE B 821 -6.856 -9.695 -1.209 1.00 0.00 C ATOM 1999 CE1 PHE B 821 -9.198 -9.061 -2.606 1.00 0.00 C ATOM 2000 CE2 PHE B 821 -6.888 -9.797 -2.605 1.00 0.00 C ATOM 2001 CZ PHE B 821 -8.059 -9.480 -3.303 1.00 0.00 C ATOM 0 H PHE B 821 -6.858 -7.863 2.665 1.00 0.00 H new ATOM 0 HA PHE B 821 -8.762 -7.172 0.580 1.00 0.00 H new ATOM 0 HB2 PHE B 821 -6.930 -9.218 1.350 1.00 0.00 H new ATOM 0 HB3 PHE B 821 -8.495 -10.001 1.444 1.00 0.00 H new ATOM 0 HD1 PHE B 821 -10.046 -8.637 -0.672 1.00 0.00 H new ATOM 0 HD2 PHE B 821 -5.953 -9.940 -0.670 1.00 0.00 H new ATOM 0 HE1 PHE B 821 -10.101 -8.816 -3.145 1.00 0.00 H new ATOM 0 HE2 PHE B 821 -6.009 -10.120 -3.143 1.00 0.00 H new ATOM 0 HZ PHE B 821 -8.084 -9.559 -4.380 1.00 0.00 H new ATOM 2011 N SER B 822 -9.998 -8.869 3.122 1.00 0.00 N ATOM 2012 CA SER B 822 -11.298 -9.119 3.807 1.00 0.00 C ATOM 2013 C SER B 822 -11.951 -7.785 4.172 1.00 0.00 C ATOM 2014 O SER B 822 -13.152 -7.686 4.316 1.00 0.00 O ATOM 2015 CB SER B 822 -10.939 -9.904 5.069 1.00 0.00 C ATOM 2016 OG SER B 822 -10.283 -9.046 5.990 1.00 0.00 O ATOM 0 H SER B 822 -9.191 -9.339 3.532 1.00 0.00 H new ATOM 0 HA SER B 822 -12.003 -9.665 3.180 1.00 0.00 H new ATOM 0 HB2 SER B 822 -11.840 -10.319 5.521 1.00 0.00 H new ATOM 0 HB3 SER B 822 -10.293 -10.745 4.816 1.00 0.00 H new ATOM 0 HG SER B 822 -9.499 -8.644 5.561 1.00 0.00 H new ATOM 2022 N LYS B 823 -11.162 -6.753 4.301 1.00 0.00 N ATOM 2023 CA LYS B 823 -11.727 -5.417 4.624 1.00 0.00 C ATOM 2024 C LYS B 823 -12.284 -4.772 3.361 1.00 0.00 C ATOM 2025 O LYS B 823 -13.440 -4.416 3.298 1.00 0.00 O ATOM 2026 CB LYS B 823 -10.544 -4.603 5.148 1.00 0.00 C ATOM 2027 CG LYS B 823 -10.108 -5.136 6.520 1.00 0.00 C ATOM 2028 CD LYS B 823 -11.292 -5.134 7.498 1.00 0.00 C ATOM 2029 CE LYS B 823 -11.942 -3.747 7.534 1.00 0.00 C ATOM 2030 NZ LYS B 823 -12.619 -3.676 8.859 1.00 0.00 N ATOM 0 H LYS B 823 -10.148 -6.780 4.196 1.00 0.00 H new ATOM 0 HA LYS B 823 -12.539 -5.476 5.349 1.00 0.00 H new ATOM 0 HB2 LYS B 823 -9.713 -4.660 4.445 1.00 0.00 H new ATOM 0 HB3 LYS B 823 -10.822 -3.552 5.228 1.00 0.00 H new ATOM 0 HG2 LYS B 823 -9.716 -6.148 6.416 1.00 0.00 H new ATOM 0 HG3 LYS B 823 -9.300 -4.520 6.916 1.00 0.00 H new ATOM 0 HD2 LYS B 823 -12.026 -5.880 7.194 1.00 0.00 H new ATOM 0 HD3 LYS B 823 -10.950 -5.410 8.496 1.00 0.00 H new ATOM 0 HE2 LYS B 823 -11.197 -2.959 7.428 1.00 0.00 H new ATOM 0 HE3 LYS B 823 -12.655 -3.623 6.719 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 -13.089 -2.754 8.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 -13.327 -4.435 8.928 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 -11.914 -3.790 9.615 1.00 0.00 H new ATOM 2044 N ILE B 824 -11.475 -4.621 2.349 1.00 0.00 N ATOM 2045 CA ILE B 824 -11.975 -3.988 1.099 1.00 0.00 C ATOM 2046 C ILE B 824 -13.125 -4.811 0.511 1.00 0.00 C ATOM 2047 O ILE B 824 -14.152 -4.276 0.140 1.00 0.00 O ATOM 2048 CB ILE B 824 -10.775 -3.942 0.145 1.00 0.00 C ATOM 2049 CG1 ILE B 824 -10.248 -5.351 -0.126 1.00 0.00 C ATOM 2050 CG2 ILE B 824 -9.670 -3.090 0.775 1.00 0.00 C ATOM 2051 CD1 ILE B 824 -8.994 -5.265 -1.003 1.00 0.00 C ATOM 0 H ILE B 824 -10.496 -4.907 2.334 1.00 0.00 H new ATOM 0 HA ILE B 824 -12.369 -2.987 1.277 1.00 0.00 H new ATOM 0 HB ILE B 824 -11.089 -3.505 -0.803 1.00 0.00 H new ATOM 0 HG12 ILE B 824 -10.014 -5.851 0.814 1.00 0.00 H new ATOM 0 HG13 ILE B 824 -11.013 -5.948 -0.623 1.00 0.00 H new ATOM 0 HG21 ILE B 824 -8.812 -3.052 0.103 1.00 0.00 H new ATOM 0 HG22 ILE B 824 -10.042 -2.080 0.946 1.00 0.00 H new ATOM 0 HG23 ILE B 824 -9.367 -3.531 1.725 1.00 0.00 H new ATOM 0 HD11 ILE B 824 -8.616 -6.269 -1.197 1.00 0.00 H new ATOM 0 HD12 ILE B 824 -9.243 -4.782 -1.948 1.00 0.00 H new ATOM 0 HD13 ILE B 824 -8.229 -4.683 -0.488 1.00 0.00 H new ATOM 2063 N LYS B 825 -12.988 -6.106 0.455 1.00 0.00 N ATOM 2064 CA LYS B 825 -14.099 -6.931 -0.090 1.00 0.00 C ATOM 2065 C LYS B 825 -15.371 -6.668 0.710 1.00 0.00 C ATOM 2066 O LYS B 825 -16.435 -6.464 0.161 1.00 0.00 O ATOM 2067 CB LYS B 825 -13.649 -8.379 0.080 1.00 0.00 C ATOM 2068 CG LYS B 825 -14.262 -9.221 -1.036 1.00 0.00 C ATOM 2069 CD LYS B 825 -15.111 -10.338 -0.426 1.00 0.00 C ATOM 2070 CE LYS B 825 -16.164 -10.789 -1.439 1.00 0.00 C ATOM 2071 NZ LYS B 825 -17.021 -11.755 -0.695 1.00 0.00 N ATOM 0 H LYS B 825 -12.164 -6.624 0.760 1.00 0.00 H new ATOM 0 HA LYS B 825 -14.316 -6.700 -1.133 1.00 0.00 H new ATOM 0 HB2 LYS B 825 -12.561 -8.442 0.046 1.00 0.00 H new ATOM 0 HB3 LYS B 825 -13.960 -8.759 1.053 1.00 0.00 H new ATOM 0 HG2 LYS B 825 -14.877 -8.595 -1.683 1.00 0.00 H new ATOM 0 HG3 LYS B 825 -13.475 -9.647 -1.659 1.00 0.00 H new ATOM 0 HD2 LYS B 825 -14.477 -11.179 -0.145 1.00 0.00 H new ATOM 0 HD3 LYS B 825 -15.595 -9.986 0.485 1.00 0.00 H new ATOM 0 HE2 LYS B 825 -16.747 -9.944 -1.806 1.00 0.00 H new ATOM 0 HE3 LYS B 825 -15.702 -11.258 -2.307 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 -17.769 -12.111 -1.323 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 -16.440 -12.551 -0.364 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 -17.453 -11.278 0.122 1.00 0.00 H new ATOM 2085 N GLU B 826 -15.260 -6.649 2.006 1.00 0.00 N ATOM 2086 CA GLU B 826 -16.451 -6.355 2.849 1.00 0.00 C ATOM 2087 C GLU B 826 -16.777 -4.863 2.763 1.00 0.00 C ATOM 2088 O GLU B 826 -17.912 -4.452 2.901 1.00 0.00 O ATOM 2089 CB GLU B 826 -16.033 -6.734 4.271 1.00 0.00 C ATOM 2090 CG GLU B 826 -15.845 -8.251 4.360 1.00 0.00 C ATOM 2091 CD GLU B 826 -17.143 -8.897 4.847 1.00 0.00 C ATOM 2092 OE1 GLU B 826 -18.193 -8.324 4.607 1.00 0.00 O ATOM 2093 OE2 GLU B 826 -17.066 -9.955 5.450 1.00 0.00 O ATOM 0 H GLU B 826 -14.396 -6.824 2.520 1.00 0.00 H new ATOM 0 HA GLU B 826 -17.339 -6.902 2.532 1.00 0.00 H new ATOM 0 HB2 GLU B 826 -15.106 -6.226 4.537 1.00 0.00 H new ATOM 0 HB3 GLU B 826 -16.791 -6.408 4.983 1.00 0.00 H new ATOM 0 HG2 GLU B 826 -15.570 -8.652 3.384 1.00 0.00 H new ATOM 0 HG3 GLU B 826 -15.029 -8.488 5.043 1.00 0.00 H new ATOM 2100 N ALA B 827 -15.784 -4.055 2.507 1.00 0.00 N ATOM 2101 CA ALA B 827 -16.016 -2.588 2.386 1.00 0.00 C ATOM 2102 C ALA B 827 -16.656 -2.248 1.039 1.00 0.00 C ATOM 2103 O ALA B 827 -16.919 -1.098 0.745 1.00 0.00 O ATOM 2104 CB ALA B 827 -14.617 -1.970 2.457 1.00 0.00 C ATOM 0 H ALA B 827 -14.817 -4.350 2.376 1.00 0.00 H new ATOM 0 HA ALA B 827 -16.687 -2.219 3.162 1.00 0.00 H new ATOM 0 HB1 ALA B 827 -14.694 -0.886 2.375 1.00 0.00 H new ATOM 0 HB2 ALA B 827 -14.152 -2.230 3.408 1.00 0.00 H new ATOM 0 HB3 ALA B 827 -14.008 -2.353 1.638 1.00 0.00 H new ATOM 2110 N GLY B 828 -16.875 -3.222 0.198 1.00 0.00 N ATOM 2111 CA GLY B 828 -17.427 -2.921 -1.148 1.00 0.00 C ATOM 2112 C GLY B 828 -16.332 -2.253 -1.984 1.00 0.00 C ATOM 2113 O GLY B 828 -16.601 -1.537 -2.928 1.00 0.00 O ATOM 0 H GLY B 828 -16.696 -4.208 0.386 1.00 0.00 H new ATOM 0 HA2 GLY B 828 -17.767 -3.837 -1.631 1.00 0.00 H new ATOM 0 HA3 GLY B 828 -18.293 -2.264 -1.064 1.00 0.00 H new ATOM 2117 N LEU B 829 -15.093 -2.471 -1.628 1.00 0.00 N ATOM 2118 CA LEU B 829 -13.971 -1.861 -2.384 1.00 0.00 C ATOM 2119 C LEU B 829 -13.640 -2.722 -3.597 1.00 0.00 C ATOM 2120 O LEU B 829 -13.311 -2.232 -4.658 1.00 0.00 O ATOM 2121 CB LEU B 829 -12.806 -1.907 -1.395 1.00 0.00 C ATOM 2122 CG LEU B 829 -12.738 -0.644 -0.531 1.00 0.00 C ATOM 2123 CD1 LEU B 829 -12.129 0.497 -1.345 1.00 0.00 C ATOM 2124 CD2 LEU B 829 -14.124 -0.233 -0.026 1.00 0.00 C ATOM 0 H LEU B 829 -14.813 -3.052 -0.838 1.00 0.00 H new ATOM 0 HA LEU B 829 -14.194 -0.856 -2.744 1.00 0.00 H new ATOM 0 HB2 LEU B 829 -12.910 -2.781 -0.752 1.00 0.00 H new ATOM 0 HB3 LEU B 829 -11.870 -2.023 -1.942 1.00 0.00 H new ATOM 0 HG LEU B 829 -12.115 -0.860 0.337 1.00 0.00 H new ATOM 0 HD11 LEU B 829 -12.080 1.396 -0.731 1.00 0.00 H new ATOM 0 HD12 LEU B 829 -11.124 0.220 -1.664 1.00 0.00 H new ATOM 0 HD13 LEU B 829 -12.748 0.689 -2.221 1.00 0.00 H new ATOM 0 HD21 LEU B 829 -14.037 0.667 0.583 1.00 0.00 H new ATOM 0 HD22 LEU B 829 -14.777 -0.034 -0.876 1.00 0.00 H new ATOM 0 HD23 LEU B 829 -14.546 -1.039 0.575 1.00 0.00 H new ATOM 2136 N ILE B 830 -13.707 -4.011 -3.429 1.00 0.00 N ATOM 2137 CA ILE B 830 -13.356 -4.937 -4.546 1.00 0.00 C ATOM 2138 C ILE B 830 -14.609 -5.595 -5.124 1.00 0.00 C ATOM 2139 O ILE B 830 -14.574 -6.200 -6.177 1.00 0.00 O ATOM 2140 CB ILE B 830 -12.431 -5.980 -3.911 1.00 0.00 C ATOM 2141 CG1 ILE B 830 -11.322 -5.264 -3.139 1.00 0.00 C ATOM 2142 CG2 ILE B 830 -11.812 -6.850 -5.004 1.00 0.00 C ATOM 2143 CD1 ILE B 830 -10.580 -4.314 -4.083 1.00 0.00 C ATOM 0 H ILE B 830 -13.991 -4.468 -2.563 1.00 0.00 H new ATOM 0 HA ILE B 830 -12.879 -4.417 -5.377 1.00 0.00 H new ATOM 0 HB ILE B 830 -13.004 -6.611 -3.231 1.00 0.00 H new ATOM 0 HG12 ILE B 830 -11.746 -4.707 -2.304 1.00 0.00 H new ATOM 0 HG13 ILE B 830 -10.628 -5.992 -2.718 1.00 0.00 H new ATOM 0 HG21 ILE B 830 -11.154 -7.591 -4.550 1.00 0.00 H new ATOM 0 HG22 ILE B 830 -12.603 -7.357 -5.557 1.00 0.00 H new ATOM 0 HG23 ILE B 830 -11.237 -6.223 -5.686 1.00 0.00 H new ATOM 0 HD11 ILE B 830 -9.789 -3.802 -3.536 1.00 0.00 H new ATOM 0 HD12 ILE B 830 -10.144 -4.884 -4.903 1.00 0.00 H new ATOM 0 HD13 ILE B 830 -11.279 -3.579 -4.483 1.00 0.00 H new