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 798 ASN : amide:sc= -6.73! C(o=-7.5!,f=-5.9!) USER MOD Set 1.2: B 799 CYS SG : rot 179:sc= -0.733 USER MOD Set 2.1: B 793 GLN : amide:sc= -3.31! C(o=-4.5!,f=-16!) USER MOD Set 2.2: B 797 THR OG1 : rot -86:sc= -1.16 USER MOD Set 3.1: B 744 SER OG : rot -65:sc= 0.283 USER MOD Set 3.2: B 812 CYS SG : rot -115:sc= 0.0913 USER MOD Set 4.1: B 729 TYR OH : rot 180:sc= -0.0779 USER MOD Set 4.2: B 733 LYS NZ :NH3+ -122:sc= 0.301 (180deg=-0.381) USER MOD Single : B 727 GLN : amide:sc= -4.65! C(o=-4.7!,f=-4.5!) USER MOD Single : B 730 SER OG : rot 180:sc= 0 USER MOD Single : B 731 THR OG1 : rot 87:sc= 1.08 USER MOD Single : B 734 SER OG : rot 180:sc= 0 USER MOD Single : B 737 GLN : amide:sc= -0.0272 X(o=-0.027,f=-0.19) USER MOD Single : B 738 GLN : amide:sc= -4.57! C(o=-4.6!,f=-3.4!) USER MOD Single : B 740 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 741 SER OG : rot 180:sc= 0 USER MOD Single : B 742 HIS : no HD1:sc= -0.434 K(o=-0.43,f=-2.3) USER MOD Single : B 743 GLN : amide:sc= -0.257 K(o=-0.26,f=-1.6!) USER MOD Single : B 749 MET CE :methyl 134:sc= -3.45 (180deg=-7.69!) USER MOD Single : B 760 TYR OH : rot 0:sc= -0.805 USER MOD Single : B 761 TYR OH : rot 180:sc= 0 USER MOD Single : B 768 MET CE :methyl -138:sc= -1.93! (180deg=-3.41!) 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 143:sc= -1.93 (180deg=-5.97!) USER MOD Single : B 774 SER OG : rot 180:sc= -0.16 USER MOD Single : B 778 LYS NZ :NH3+ -157:sc= -0.0333 (180deg=-0.671) USER MOD Single : B 779 ASN : amide:sc= -0.822 K(o=-0.82,f=-7.5!) USER MOD Single : B 781 TYR OH : rot 180:sc= 0 USER MOD Single : B 782 TYR OH : rot 121:sc= 1.16 USER MOD Single : B 784 SER OG : rot 180:sc= -0.745 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 149:sc= -9.95! (180deg=-13.8!) USER MOD Single : B 800 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 802 TYR OH : rot 180:sc= 0 USER MOD Single : B 803 ASN : amide:sc= -3.12! C(o=-3.1!,f=-7.4!) 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 30:sc= 0 USER MOD Single : B 811 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 814 ASN : amide:sc= -0.27 K(o=-0.27,f=-2.7!) USER MOD Single : B 818 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 822 SER OG : rot -77:sc= 0.47 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 16.723 -0.487 -7.944 1.00 0.00 N ATOM 304 CA GLU B 721 16.828 -1.897 -7.472 1.00 0.00 C ATOM 305 C GLU B 721 17.416 -1.943 -6.055 1.00 0.00 C ATOM 306 O GLU B 721 18.312 -1.185 -5.737 1.00 0.00 O ATOM 307 CB GLU B 721 17.777 -2.575 -8.463 1.00 0.00 C ATOM 308 CG GLU B 721 17.126 -2.616 -9.848 1.00 0.00 C ATOM 309 CD GLU B 721 18.200 -2.874 -10.908 1.00 0.00 C ATOM 310 OE1 GLU B 721 18.929 -1.948 -11.222 1.00 0.00 O ATOM 311 OE2 GLU B 721 18.275 -3.994 -11.386 1.00 0.00 O ATOM 0 HA GLU B 721 15.857 -2.390 -7.429 1.00 0.00 H new ATOM 0 HB2 GLU B 721 18.721 -2.031 -8.509 1.00 0.00 H new ATOM 0 HB3 GLU B 721 18.008 -3.586 -8.128 1.00 0.00 H new ATOM 0 HG2 GLU B 721 16.369 -3.400 -9.883 1.00 0.00 H new ATOM 0 HG3 GLU B 721 16.618 -1.673 -10.051 1.00 0.00 H new ATOM 318 N PRO B 722 16.920 -2.858 -5.254 1.00 0.00 N ATOM 319 CA PRO B 722 17.391 -2.978 -3.858 1.00 0.00 C ATOM 320 C PRO B 722 18.583 -3.937 -3.755 1.00 0.00 C ATOM 321 O PRO B 722 18.766 -4.602 -2.755 1.00 0.00 O ATOM 322 CB PRO B 722 16.174 -3.553 -3.142 1.00 0.00 C ATOM 323 CG PRO B 722 15.430 -4.335 -4.183 1.00 0.00 C ATOM 324 CD PRO B 722 15.828 -3.800 -5.539 1.00 0.00 C ATOM 0 HA PRO B 722 17.739 -2.033 -3.440 1.00 0.00 H new ATOM 0 HB2 PRO B 722 16.473 -4.191 -2.311 1.00 0.00 H new ATOM 0 HB3 PRO B 722 15.552 -2.760 -2.727 1.00 0.00 H new ATOM 0 HG2 PRO B 722 15.669 -5.396 -4.106 1.00 0.00 H new ATOM 0 HG3 PRO B 722 14.354 -4.239 -4.036 1.00 0.00 H new ATOM 0 HD2 PRO B 722 16.157 -4.601 -6.201 1.00 0.00 H new ATOM 0 HD3 PRO B 722 14.992 -3.302 -6.031 1.00 0.00 H new ATOM 332 N ARG B 723 19.401 -4.001 -4.772 1.00 0.00 N ATOM 333 CA ARG B 723 20.587 -4.907 -4.731 1.00 0.00 C ATOM 334 C ARG B 723 20.162 -6.345 -4.401 1.00 0.00 C ATOM 335 O ARG B 723 19.899 -7.136 -5.285 1.00 0.00 O ATOM 336 CB ARG B 723 21.486 -4.334 -3.631 1.00 0.00 C ATOM 337 CG ARG B 723 22.000 -2.958 -4.057 1.00 0.00 C ATOM 338 CD ARG B 723 21.003 -1.886 -3.614 1.00 0.00 C ATOM 339 NE ARG B 723 21.793 -0.620 -3.574 1.00 0.00 N ATOM 340 CZ ARG B 723 22.098 0.019 -4.679 1.00 0.00 C ATOM 341 NH1 ARG B 723 21.723 -0.435 -5.849 1.00 0.00 N ATOM 342 NH2 ARG B 723 22.788 1.125 -4.611 1.00 0.00 N ATOM 0 H ARG B 723 19.299 -3.463 -5.633 1.00 0.00 H new ATOM 0 HA ARG B 723 21.101 -4.954 -5.691 1.00 0.00 H new ATOM 0 HB2 ARG B 723 20.929 -4.253 -2.697 1.00 0.00 H new ATOM 0 HB3 ARG B 723 22.324 -5.006 -3.445 1.00 0.00 H new ATOM 0 HG2 ARG B 723 22.977 -2.768 -3.612 1.00 0.00 H new ATOM 0 HG3 ARG B 723 22.130 -2.925 -5.139 1.00 0.00 H new ATOM 0 HD2 ARG B 723 20.169 -1.809 -4.312 1.00 0.00 H new ATOM 0 HD3 ARG B 723 20.580 -2.119 -2.637 1.00 0.00 H new ATOM 0 HE ARG B 723 22.100 -0.247 -2.676 1.00 0.00 H new ATOM 0 HH11 ARG B 723 21.185 -1.299 -5.912 1.00 0.00 H new ATOM 0 HH12 ARG B 723 21.969 0.075 -6.697 1.00 0.00 H new ATOM 0 HH21 ARG B 723 23.085 1.486 -3.704 1.00 0.00 H new ATOM 0 HH22 ARG B 723 23.030 1.629 -5.464 1.00 0.00 H new ATOM 356 N ASP B 724 20.103 -6.700 -3.143 1.00 0.00 N ATOM 357 CA ASP B 724 19.692 -8.085 -2.784 1.00 0.00 C ATOM 358 C ASP B 724 18.358 -8.063 -2.029 1.00 0.00 C ATOM 359 O ASP B 724 18.024 -7.077 -1.402 1.00 0.00 O ATOM 360 CB ASP B 724 20.807 -8.607 -1.878 1.00 0.00 C ATOM 361 CG ASP B 724 20.976 -10.112 -2.093 1.00 0.00 C ATOM 362 OD1 ASP B 724 21.297 -10.499 -3.205 1.00 0.00 O ATOM 363 OD2 ASP B 724 20.782 -10.852 -1.143 1.00 0.00 O ATOM 0 H ASP B 724 20.321 -6.092 -2.354 1.00 0.00 H new ATOM 0 HA ASP B 724 19.551 -8.713 -3.663 1.00 0.00 H new ATOM 0 HB2 ASP B 724 21.741 -8.090 -2.098 1.00 0.00 H new ATOM 0 HB3 ASP B 724 20.568 -8.402 -0.834 1.00 0.00 H new ATOM 368 N PRO B 725 17.636 -9.155 -2.106 1.00 0.00 N ATOM 369 CA PRO B 725 16.323 -9.239 -1.422 1.00 0.00 C ATOM 370 C PRO B 725 16.497 -9.158 0.096 1.00 0.00 C ATOM 371 O PRO B 725 15.632 -8.681 0.804 1.00 0.00 O ATOM 372 CB PRO B 725 15.777 -10.614 -1.822 1.00 0.00 C ATOM 373 CG PRO B 725 16.629 -11.080 -2.962 1.00 0.00 C ATOM 374 CD PRO B 725 17.955 -10.385 -2.841 1.00 0.00 C ATOM 0 HA PRO B 725 15.657 -8.423 -1.702 1.00 0.00 H new ATOM 0 HB2 PRO B 725 15.827 -11.312 -0.986 1.00 0.00 H new ATOM 0 HB3 PRO B 725 14.730 -10.547 -2.119 1.00 0.00 H new ATOM 0 HG2 PRO B 725 16.758 -12.162 -2.929 1.00 0.00 H new ATOM 0 HG3 PRO B 725 16.157 -10.844 -3.916 1.00 0.00 H new ATOM 0 HD2 PRO B 725 18.680 -10.996 -2.304 1.00 0.00 H new ATOM 0 HD3 PRO B 725 18.384 -10.167 -3.819 1.00 0.00 H new ATOM 382 N ASP B 726 17.603 -9.628 0.605 1.00 0.00 N ATOM 383 CA ASP B 726 17.819 -9.584 2.079 1.00 0.00 C ATOM 384 C ASP B 726 17.894 -8.136 2.567 1.00 0.00 C ATOM 385 O ASP B 726 17.223 -7.754 3.505 1.00 0.00 O ATOM 386 CB ASP B 726 19.156 -10.296 2.303 1.00 0.00 C ATOM 387 CG ASP B 726 18.907 -11.790 2.518 1.00 0.00 C ATOM 388 OD1 ASP B 726 18.082 -12.119 3.355 1.00 0.00 O ATOM 389 OD2 ASP B 726 19.545 -12.580 1.842 1.00 0.00 O ATOM 0 H ASP B 726 18.365 -10.040 0.066 1.00 0.00 H new ATOM 0 HA ASP B 726 17.005 -10.057 2.628 1.00 0.00 H new ATOM 0 HB2 ASP B 726 19.809 -10.145 1.444 1.00 0.00 H new ATOM 0 HB3 ASP B 726 19.665 -9.873 3.169 1.00 0.00 H new ATOM 394 N GLN B 727 18.699 -7.324 1.937 1.00 0.00 N ATOM 395 CA GLN B 727 18.807 -5.900 2.371 1.00 0.00 C ATOM 396 C GLN B 727 17.420 -5.260 2.447 1.00 0.00 C ATOM 397 O GLN B 727 17.101 -4.550 3.379 1.00 0.00 O ATOM 398 CB GLN B 727 19.640 -5.216 1.284 1.00 0.00 C ATOM 399 CG GLN B 727 21.128 -5.390 1.590 1.00 0.00 C ATOM 400 CD GLN B 727 21.516 -6.861 1.432 1.00 0.00 C ATOM 401 OE1 GLN B 727 21.282 -7.662 2.316 1.00 0.00 O ATOM 402 NE2 GLN B 727 22.107 -7.253 0.337 1.00 0.00 N ATOM 0 H GLN B 727 19.285 -7.583 1.143 1.00 0.00 H new ATOM 0 HA GLN B 727 19.259 -5.808 3.359 1.00 0.00 H new ATOM 0 HB2 GLN B 727 19.407 -5.645 0.309 1.00 0.00 H new ATOM 0 HB3 GLN B 727 19.391 -4.156 1.234 1.00 0.00 H new ATOM 0 HG2 GLN B 727 21.723 -4.772 0.917 1.00 0.00 H new ATOM 0 HG3 GLN B 727 21.343 -5.054 2.604 1.00 0.00 H new ATOM 0 HE21 GLN B 727 22.304 -6.581 -0.405 1.00 0.00 H new ATOM 0 HE22 GLN B 727 22.373 -8.231 0.223 1.00 0.00 H new ATOM 411 N LEU B 728 16.599 -5.499 1.463 1.00 0.00 N ATOM 412 CA LEU B 728 15.239 -4.891 1.456 1.00 0.00 C ATOM 413 C LEU B 728 14.278 -5.679 2.351 1.00 0.00 C ATOM 414 O LEU B 728 13.302 -5.151 2.841 1.00 0.00 O ATOM 415 CB LEU B 728 14.792 -4.977 -0.007 1.00 0.00 C ATOM 416 CG LEU B 728 14.512 -3.577 -0.551 1.00 0.00 C ATOM 417 CD1 LEU B 728 13.322 -2.988 0.193 1.00 0.00 C ATOM 418 CD2 LEU B 728 15.740 -2.682 -0.349 1.00 0.00 C ATOM 0 H LEU B 728 16.812 -6.091 0.660 1.00 0.00 H new ATOM 0 HA LEU B 728 15.246 -3.870 1.838 1.00 0.00 H new ATOM 0 HB2 LEU B 728 15.565 -5.460 -0.604 1.00 0.00 H new ATOM 0 HB3 LEU B 728 13.896 -5.593 -0.087 1.00 0.00 H new ATOM 0 HG LEU B 728 14.291 -3.636 -1.617 1.00 0.00 H new ATOM 0 HD11 LEU B 728 13.113 -1.988 -0.188 1.00 0.00 H new ATOM 0 HD12 LEU B 728 12.449 -3.623 0.043 1.00 0.00 H new ATOM 0 HD13 LEU B 728 13.550 -2.931 1.257 1.00 0.00 H new ATOM 0 HD21 LEU B 728 15.532 -1.686 -0.739 1.00 0.00 H new ATOM 0 HD22 LEU B 728 15.970 -2.614 0.714 1.00 0.00 H new ATOM 0 HD23 LEU B 728 16.592 -3.109 -0.878 1.00 0.00 H new ATOM 430 N TYR B 729 14.538 -6.943 2.555 1.00 0.00 N ATOM 431 CA TYR B 729 13.625 -7.778 3.393 1.00 0.00 C ATOM 432 C TYR B 729 13.269 -7.063 4.699 1.00 0.00 C ATOM 433 O TYR B 729 12.115 -6.801 4.986 1.00 0.00 O ATOM 434 CB TYR B 729 14.429 -9.047 3.684 1.00 0.00 C ATOM 435 CG TYR B 729 13.631 -9.967 4.577 1.00 0.00 C ATOM 436 CD1 TYR B 729 12.329 -10.338 4.219 1.00 0.00 C ATOM 437 CD2 TYR B 729 14.200 -10.459 5.758 1.00 0.00 C ATOM 438 CE1 TYR B 729 11.594 -11.195 5.047 1.00 0.00 C ATOM 439 CE2 TYR B 729 13.464 -11.316 6.585 1.00 0.00 C ATOM 440 CZ TYR B 729 12.161 -11.685 6.230 1.00 0.00 C ATOM 441 OH TYR B 729 11.436 -12.530 7.045 1.00 0.00 O ATOM 0 H TYR B 729 15.347 -7.436 2.176 1.00 0.00 H new ATOM 0 HA TYR B 729 12.681 -7.983 2.889 1.00 0.00 H new ATOM 0 HB2 TYR B 729 14.675 -9.554 2.751 1.00 0.00 H new ATOM 0 HB3 TYR B 729 15.373 -8.788 4.164 1.00 0.00 H new ATOM 0 HD1 TYR B 729 11.892 -9.963 3.305 1.00 0.00 H new ATOM 0 HD2 TYR B 729 15.206 -10.177 6.031 1.00 0.00 H new ATOM 0 HE1 TYR B 729 10.589 -11.479 4.773 1.00 0.00 H new ATOM 0 HE2 TYR B 729 13.902 -11.693 7.498 1.00 0.00 H new ATOM 0 HH TYR B 729 11.977 -12.777 7.824 1.00 0.00 H new ATOM 451 N SER B 730 14.250 -6.744 5.491 1.00 0.00 N ATOM 452 CA SER B 730 13.969 -6.043 6.772 1.00 0.00 C ATOM 453 C SER B 730 13.587 -4.593 6.495 1.00 0.00 C ATOM 454 O SER B 730 12.905 -3.959 7.276 1.00 0.00 O ATOM 455 CB SER B 730 15.273 -6.118 7.563 1.00 0.00 C ATOM 456 OG SER B 730 15.355 -5.015 8.453 1.00 0.00 O ATOM 0 H SER B 730 15.234 -6.938 5.308 1.00 0.00 H new ATOM 0 HA SER B 730 13.141 -6.493 7.320 1.00 0.00 H new ATOM 0 HB2 SER B 730 15.318 -7.053 8.122 1.00 0.00 H new ATOM 0 HB3 SER B 730 16.124 -6.113 6.882 1.00 0.00 H new ATOM 0 HG SER B 730 16.192 -5.066 8.961 1.00 0.00 H new ATOM 462 N THR B 731 14.009 -4.063 5.381 1.00 0.00 N ATOM 463 CA THR B 731 13.629 -2.667 5.044 1.00 0.00 C ATOM 464 C THR B 731 12.115 -2.585 4.886 1.00 0.00 C ATOM 465 O THR B 731 11.448 -1.851 5.587 1.00 0.00 O ATOM 466 CB THR B 731 14.320 -2.371 3.716 1.00 0.00 C ATOM 467 OG1 THR B 731 15.728 -2.469 3.881 1.00 0.00 O ATOM 468 CG2 THR B 731 13.956 -0.957 3.265 1.00 0.00 C ATOM 0 H THR B 731 14.597 -4.535 4.694 1.00 0.00 H new ATOM 0 HA THR B 731 13.922 -1.954 5.814 1.00 0.00 H new ATOM 0 HB THR B 731 13.994 -3.091 2.965 1.00 0.00 H new ATOM 0 HG1 THR B 731 16.009 -3.398 3.749 1.00 0.00 H new ATOM 0 HG21 THR B 731 14.447 -0.740 2.316 1.00 0.00 H new ATOM 0 HG22 THR B 731 12.876 -0.882 3.140 1.00 0.00 H new ATOM 0 HG23 THR B 731 14.285 -0.239 4.016 1.00 0.00 H new ATOM 476 N LEU B 732 11.557 -3.367 3.996 1.00 0.00 N ATOM 477 CA LEU B 732 10.074 -3.375 3.849 1.00 0.00 C ATOM 478 C LEU B 732 9.460 -3.693 5.207 1.00 0.00 C ATOM 479 O LEU B 732 8.470 -3.116 5.612 1.00 0.00 O ATOM 480 CB LEU B 732 9.759 -4.486 2.838 1.00 0.00 C ATOM 481 CG LEU B 732 10.547 -4.275 1.535 1.00 0.00 C ATOM 482 CD1 LEU B 732 10.012 -5.227 0.465 1.00 0.00 C ATOM 483 CD2 LEU B 732 10.388 -2.831 1.045 1.00 0.00 C ATOM 0 H LEU B 732 12.062 -3.995 3.370 1.00 0.00 H new ATOM 0 HA LEU B 732 9.675 -2.420 3.508 1.00 0.00 H new ATOM 0 HB2 LEU B 732 10.009 -5.456 3.267 1.00 0.00 H new ATOM 0 HB3 LEU B 732 8.690 -4.498 2.625 1.00 0.00 H new ATOM 0 HG LEU B 732 11.602 -4.474 1.723 1.00 0.00 H new ATOM 0 HD11 LEU B 732 10.567 -5.082 -0.462 1.00 0.00 H new ATOM 0 HD12 LEU B 732 10.131 -6.257 0.802 1.00 0.00 H new ATOM 0 HD13 LEU B 732 8.956 -5.022 0.291 1.00 0.00 H new ATOM 0 HD21 LEU B 732 10.951 -2.696 0.122 1.00 0.00 H new ATOM 0 HD22 LEU B 732 9.334 -2.623 0.861 1.00 0.00 H new ATOM 0 HD23 LEU B 732 10.766 -2.146 1.804 1.00 0.00 H new ATOM 495 N LYS B 733 10.099 -4.559 5.944 1.00 0.00 N ATOM 496 CA LYS B 733 9.627 -4.864 7.318 1.00 0.00 C ATOM 497 C LYS B 733 9.531 -3.560 8.115 1.00 0.00 C ATOM 498 O LYS B 733 8.646 -3.373 8.925 1.00 0.00 O ATOM 499 CB LYS B 733 10.720 -5.769 7.897 1.00 0.00 C ATOM 500 CG LYS B 733 10.094 -6.835 8.796 1.00 0.00 C ATOM 501 CD LYS B 733 10.397 -8.224 8.234 1.00 0.00 C ATOM 502 CE LYS B 733 9.283 -9.189 8.643 1.00 0.00 C ATOM 503 NZ LYS B 733 9.698 -10.510 8.092 1.00 0.00 N ATOM 0 H LYS B 733 10.932 -5.069 5.650 1.00 0.00 H new ATOM 0 HA LYS B 733 8.645 -5.337 7.346 1.00 0.00 H new ATOM 0 HB2 LYS B 733 11.276 -6.244 7.089 1.00 0.00 H new ATOM 0 HB3 LYS B 733 11.433 -5.173 8.467 1.00 0.00 H new ATOM 0 HG2 LYS B 733 10.488 -6.748 9.809 1.00 0.00 H new ATOM 0 HG3 LYS B 733 9.016 -6.685 8.859 1.00 0.00 H new ATOM 0 HD2 LYS B 733 10.475 -8.180 7.148 1.00 0.00 H new ATOM 0 HD3 LYS B 733 11.357 -8.579 8.609 1.00 0.00 H new ATOM 0 HE2 LYS B 733 9.174 -9.230 9.727 1.00 0.00 H new ATOM 0 HE3 LYS B 733 8.321 -8.876 8.237 1.00 0.00 H new ATOM 0 HZ1 LYS B 733 8.960 -10.867 7.452 1.00 0.00 H new ATOM 0 HZ2 LYS B 733 10.589 -10.403 7.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 733 9.835 -11.184 8.872 1.00 0.00 H new ATOM 517 N SER B 734 10.424 -2.640 7.852 1.00 0.00 N ATOM 518 CA SER B 734 10.401 -1.334 8.570 1.00 0.00 C ATOM 519 C SER B 734 9.294 -0.434 8.010 1.00 0.00 C ATOM 520 O SER B 734 8.370 -0.069 8.709 1.00 0.00 O ATOM 521 CB SER B 734 11.776 -0.721 8.305 1.00 0.00 C ATOM 522 OG SER B 734 12.490 -0.614 9.529 1.00 0.00 O ATOM 0 H SER B 734 11.172 -2.740 7.166 1.00 0.00 H new ATOM 0 HA SER B 734 10.200 -1.451 9.635 1.00 0.00 H new ATOM 0 HB2 SER B 734 12.332 -1.339 7.600 1.00 0.00 H new ATOM 0 HB3 SER B 734 11.666 0.263 7.849 1.00 0.00 H new ATOM 0 HG SER B 734 13.372 -0.223 9.360 1.00 0.00 H new ATOM 528 N ILE B 735 9.369 -0.080 6.751 1.00 0.00 N ATOM 529 CA ILE B 735 8.307 0.787 6.154 1.00 0.00 C ATOM 530 C ILE B 735 6.919 0.227 6.485 1.00 0.00 C ATOM 531 O ILE B 735 6.072 0.914 7.020 1.00 0.00 O ATOM 532 CB ILE B 735 8.554 0.734 4.641 1.00 0.00 C ATOM 533 CG1 ILE B 735 9.903 1.379 4.316 1.00 0.00 C ATOM 534 CG2 ILE B 735 7.446 1.495 3.910 1.00 0.00 C ATOM 535 CD1 ILE B 735 10.743 0.407 3.485 1.00 0.00 C ATOM 0 H ILE B 735 10.117 -0.353 6.113 1.00 0.00 H new ATOM 0 HA ILE B 735 8.343 1.806 6.540 1.00 0.00 H new ATOM 0 HB ILE B 735 8.558 -0.307 4.318 1.00 0.00 H new ATOM 0 HG12 ILE B 735 9.752 2.308 3.766 1.00 0.00 H new ATOM 0 HG13 ILE B 735 10.427 1.635 5.237 1.00 0.00 H new ATOM 0 HG21 ILE B 735 7.625 1.455 2.836 1.00 0.00 H new ATOM 0 HG22 ILE B 735 6.482 1.039 4.134 1.00 0.00 H new ATOM 0 HG23 ILE B 735 7.441 2.534 4.239 1.00 0.00 H new ATOM 0 HD11 ILE B 735 11.705 0.864 3.252 1.00 0.00 H new ATOM 0 HD12 ILE B 735 10.905 -0.510 4.051 1.00 0.00 H new ATOM 0 HD13 ILE B 735 10.219 0.173 2.558 1.00 0.00 H new ATOM 547 N LEU B 736 6.691 -1.024 6.193 1.00 0.00 N ATOM 548 CA LEU B 736 5.365 -1.635 6.496 1.00 0.00 C ATOM 549 C LEU B 736 5.089 -1.587 8.005 1.00 0.00 C ATOM 550 O LEU B 736 3.971 -1.383 8.434 1.00 0.00 O ATOM 551 CB LEU B 736 5.487 -3.084 6.007 1.00 0.00 C ATOM 552 CG LEU B 736 4.270 -3.895 6.464 1.00 0.00 C ATOM 553 CD1 LEU B 736 3.004 -3.319 5.830 1.00 0.00 C ATOM 554 CD2 LEU B 736 4.438 -5.352 6.032 1.00 0.00 C ATOM 0 H LEU B 736 7.367 -1.651 5.757 1.00 0.00 H new ATOM 0 HA LEU B 736 4.541 -1.109 6.014 1.00 0.00 H new ATOM 0 HB2 LEU B 736 5.561 -3.105 4.920 1.00 0.00 H new ATOM 0 HB3 LEU B 736 6.401 -3.533 6.397 1.00 0.00 H new ATOM 0 HG LEU B 736 4.187 -3.844 7.550 1.00 0.00 H new ATOM 0 HD11 LEU B 736 2.139 -3.897 6.156 1.00 0.00 H new ATOM 0 HD12 LEU B 736 2.883 -2.280 6.137 1.00 0.00 H new ATOM 0 HD13 LEU B 736 3.086 -3.369 4.744 1.00 0.00 H new ATOM 0 HD21 LEU B 736 3.573 -5.930 6.357 1.00 0.00 H new ATOM 0 HD22 LEU B 736 4.521 -5.402 4.946 1.00 0.00 H new ATOM 0 HD23 LEU B 736 5.340 -5.764 6.485 1.00 0.00 H new ATOM 566 N GLN B 737 6.098 -1.778 8.810 1.00 0.00 N ATOM 567 CA GLN B 737 5.889 -1.754 10.288 1.00 0.00 C ATOM 568 C GLN B 737 5.289 -0.416 10.725 1.00 0.00 C ATOM 569 O GLN B 737 4.285 -0.370 11.409 1.00 0.00 O ATOM 570 CB GLN B 737 7.285 -1.929 10.890 1.00 0.00 C ATOM 571 CG GLN B 737 7.474 -3.384 11.325 1.00 0.00 C ATOM 572 CD GLN B 737 6.769 -3.613 12.664 1.00 0.00 C ATOM 573 OE1 GLN B 737 7.035 -2.925 13.629 1.00 0.00 O ATOM 574 NE2 GLN B 737 5.876 -4.559 12.764 1.00 0.00 N ATOM 0 H GLN B 737 7.058 -1.950 8.510 1.00 0.00 H new ATOM 0 HA GLN B 737 5.199 -2.532 10.613 1.00 0.00 H new ATOM 0 HB2 GLN B 737 8.045 -1.655 10.158 1.00 0.00 H new ATOM 0 HB3 GLN B 737 7.410 -1.264 11.744 1.00 0.00 H new ATOM 0 HG2 GLN B 737 7.068 -4.056 10.569 1.00 0.00 H new ATOM 0 HG3 GLN B 737 8.536 -3.612 11.417 1.00 0.00 H new ATOM 0 HE21 GLN B 737 5.652 -5.137 11.954 1.00 0.00 H new ATOM 0 HE22 GLN B 737 5.402 -4.721 13.652 1.00 0.00 H new ATOM 583 N GLN B 738 5.903 0.673 10.352 1.00 0.00 N ATOM 584 CA GLN B 738 5.358 2.005 10.743 1.00 0.00 C ATOM 585 C GLN B 738 4.151 2.352 9.872 1.00 0.00 C ATOM 586 O GLN B 738 3.299 3.130 10.250 1.00 0.00 O ATOM 587 CB GLN B 738 6.504 2.990 10.495 1.00 0.00 C ATOM 588 CG GLN B 738 6.956 2.894 9.038 1.00 0.00 C ATOM 589 CD GLN B 738 7.668 4.184 8.640 1.00 0.00 C ATOM 590 OE1 GLN B 738 7.938 5.027 9.472 1.00 0.00 O ATOM 591 NE2 GLN B 738 7.988 4.372 7.392 1.00 0.00 N ATOM 0 H GLN B 738 6.757 0.699 9.795 1.00 0.00 H new ATOM 0 HA GLN B 738 5.020 2.029 11.779 1.00 0.00 H new ATOM 0 HB2 GLN B 738 6.179 4.006 10.719 1.00 0.00 H new ATOM 0 HB3 GLN B 738 7.338 2.768 11.161 1.00 0.00 H new ATOM 0 HG2 GLN B 738 7.624 2.043 8.909 1.00 0.00 H new ATOM 0 HG3 GLN B 738 6.096 2.726 8.390 1.00 0.00 H new ATOM 0 HE21 GLN B 738 7.761 3.663 6.695 1.00 0.00 H new ATOM 0 HE22 GLN B 738 8.466 5.228 7.112 1.00 0.00 H new ATOM 600 N VAL B 739 4.068 1.766 8.710 1.00 0.00 N ATOM 601 CA VAL B 739 2.916 2.038 7.810 1.00 0.00 C ATOM 602 C VAL B 739 1.674 1.305 8.329 1.00 0.00 C ATOM 603 O VAL B 739 0.584 1.840 8.343 1.00 0.00 O ATOM 604 CB VAL B 739 3.379 1.491 6.449 1.00 0.00 C ATOM 605 CG1 VAL B 739 2.186 1.243 5.523 1.00 0.00 C ATOM 606 CG2 VAL B 739 4.319 2.506 5.793 1.00 0.00 C ATOM 0 H VAL B 739 4.754 1.106 8.344 1.00 0.00 H new ATOM 0 HA VAL B 739 2.641 3.091 7.749 1.00 0.00 H new ATOM 0 HB VAL B 739 3.894 0.545 6.613 1.00 0.00 H new ATOM 0 HG11 VAL B 739 2.541 0.857 4.568 1.00 0.00 H new ATOM 0 HG12 VAL B 739 1.515 0.517 5.981 1.00 0.00 H new ATOM 0 HG13 VAL B 739 1.651 2.179 5.360 1.00 0.00 H new ATOM 0 HG21 VAL B 739 4.651 2.124 4.828 1.00 0.00 H new ATOM 0 HG22 VAL B 739 3.792 3.449 5.648 1.00 0.00 H new ATOM 0 HG23 VAL B 739 5.184 2.669 6.436 1.00 0.00 H new ATOM 616 N LYS B 740 1.836 0.087 8.759 1.00 0.00 N ATOM 617 CA LYS B 740 0.673 -0.679 9.279 1.00 0.00 C ATOM 618 C LYS B 740 0.246 -0.134 10.642 1.00 0.00 C ATOM 619 O LYS B 740 -0.927 -0.017 10.934 1.00 0.00 O ATOM 620 CB LYS B 740 1.189 -2.109 9.408 1.00 0.00 C ATOM 621 CG LYS B 740 0.006 -3.075 9.477 1.00 0.00 C ATOM 622 CD LYS B 740 -0.323 -3.371 10.941 1.00 0.00 C ATOM 623 CE LYS B 740 -0.908 -4.779 11.059 1.00 0.00 C ATOM 624 NZ LYS B 740 -0.786 -5.123 12.503 1.00 0.00 N ATOM 0 H LYS B 740 2.726 -0.412 8.773 1.00 0.00 H new ATOM 0 HA LYS B 740 -0.200 -0.611 8.629 1.00 0.00 H new ATOM 0 HB2 LYS B 740 1.824 -2.356 8.557 1.00 0.00 H new ATOM 0 HB3 LYS B 740 1.803 -2.206 10.303 1.00 0.00 H new ATOM 0 HG2 LYS B 740 -0.861 -2.642 8.978 1.00 0.00 H new ATOM 0 HG3 LYS B 740 0.246 -4.000 8.953 1.00 0.00 H new ATOM 0 HD2 LYS B 740 0.577 -3.287 11.551 1.00 0.00 H new ATOM 0 HD3 LYS B 740 -1.034 -2.637 11.320 1.00 0.00 H new ATOM 0 HE2 LYS B 740 -1.948 -4.804 10.733 1.00 0.00 H new ATOM 0 HE3 LYS B 740 -0.362 -5.488 10.436 1.00 0.00 H new ATOM 0 HZ1 LYS B 740 -1.167 -6.077 12.666 1.00 0.00 H new ATOM 0 HZ2 LYS B 740 0.215 -5.098 12.783 1.00 0.00 H new ATOM 0 HZ3 LYS B 740 -1.321 -4.435 13.070 1.00 0.00 H new ATOM 638 N SER B 741 1.188 0.207 11.477 1.00 0.00 N ATOM 639 CA SER B 741 0.831 0.761 12.813 1.00 0.00 C ATOM 640 C SER B 741 0.626 2.277 12.728 1.00 0.00 C ATOM 641 O SER B 741 0.517 2.952 13.732 1.00 0.00 O ATOM 642 CB SER B 741 2.029 0.435 13.706 1.00 0.00 C ATOM 643 OG SER B 741 1.709 -0.667 14.543 1.00 0.00 O ATOM 0 H SER B 741 2.188 0.126 11.293 1.00 0.00 H new ATOM 0 HA SER B 741 -0.097 0.339 13.198 1.00 0.00 H new ATOM 0 HB2 SER B 741 2.899 0.200 13.094 1.00 0.00 H new ATOM 0 HB3 SER B 741 2.291 1.302 14.312 1.00 0.00 H new ATOM 0 HG SER B 741 2.477 -0.878 15.114 1.00 0.00 H new ATOM 649 N HIS B 742 0.570 2.820 11.539 1.00 0.00 N ATOM 650 CA HIS B 742 0.368 4.289 11.403 1.00 0.00 C ATOM 651 C HIS B 742 -1.068 4.664 11.776 1.00 0.00 C ATOM 652 O HIS B 742 -1.972 3.859 11.685 1.00 0.00 O ATOM 653 CB HIS B 742 0.629 4.581 9.925 1.00 0.00 C ATOM 654 CG HIS B 742 1.471 5.822 9.800 1.00 0.00 C ATOM 655 ND1 HIS B 742 1.060 6.924 9.067 1.00 0.00 N ATOM 656 CD2 HIS B 742 2.705 6.146 10.306 1.00 0.00 C ATOM 657 CE1 HIS B 742 2.030 7.852 9.153 1.00 0.00 C ATOM 658 NE2 HIS B 742 3.056 7.429 9.897 1.00 0.00 N ATOM 0 H HIS B 742 0.655 2.309 10.660 1.00 0.00 H new ATOM 0 HA HIS B 742 1.024 4.861 12.059 1.00 0.00 H new ATOM 0 HB2 HIS B 742 1.137 3.736 9.460 1.00 0.00 H new ATOM 0 HB3 HIS B 742 -0.315 4.715 9.397 1.00 0.00 H new ATOM 0 HD2 HIS B 742 3.311 5.503 10.927 1.00 0.00 H new ATOM 0 HE1 HIS B 742 1.985 8.821 8.678 1.00 0.00 H new ATOM 0 HE2 HIS B 742 3.912 7.937 10.118 1.00 0.00 H new ATOM 666 N GLN B 743 -1.283 5.880 12.198 1.00 0.00 N ATOM 667 CA GLN B 743 -2.660 6.304 12.580 1.00 0.00 C ATOM 668 C GLN B 743 -3.491 6.658 11.339 1.00 0.00 C ATOM 669 O GLN B 743 -4.655 6.991 11.442 1.00 0.00 O ATOM 670 CB GLN B 743 -2.456 7.542 13.455 1.00 0.00 C ATOM 671 CG GLN B 743 -3.815 8.136 13.833 1.00 0.00 C ATOM 672 CD GLN B 743 -3.704 8.849 15.182 1.00 0.00 C ATOM 673 OE1 GLN B 743 -2.980 8.413 16.055 1.00 0.00 O ATOM 674 NE2 GLN B 743 -4.396 9.935 15.391 1.00 0.00 N ATOM 0 H GLN B 743 -0.565 6.598 12.295 1.00 0.00 H new ATOM 0 HA GLN B 743 -3.201 5.511 13.097 1.00 0.00 H new ATOM 0 HB2 GLN B 743 -1.902 7.276 14.355 1.00 0.00 H new ATOM 0 HB3 GLN B 743 -1.860 8.282 12.921 1.00 0.00 H new ATOM 0 HG2 GLN B 743 -4.143 8.837 13.065 1.00 0.00 H new ATOM 0 HG3 GLN B 743 -4.566 7.348 13.887 1.00 0.00 H new ATOM 0 HE21 GLN B 743 -5.004 10.301 14.658 1.00 0.00 H new ATOM 0 HE22 GLN B 743 -4.329 10.418 16.287 1.00 0.00 H new ATOM 683 N SER B 744 -2.914 6.589 10.168 1.00 0.00 N ATOM 684 CA SER B 744 -3.688 6.940 8.944 1.00 0.00 C ATOM 685 C SER B 744 -3.718 5.772 7.950 1.00 0.00 C ATOM 686 O SER B 744 -4.290 5.875 6.890 1.00 0.00 O ATOM 687 CB SER B 744 -2.935 8.128 8.340 1.00 0.00 C ATOM 688 OG SER B 744 -3.703 9.310 8.509 1.00 0.00 O ATOM 0 H SER B 744 -1.947 6.307 10.008 1.00 0.00 H new ATOM 0 HA SER B 744 -4.728 7.172 9.176 1.00 0.00 H new ATOM 0 HB2 SER B 744 -1.964 8.240 8.822 1.00 0.00 H new ATOM 0 HB3 SER B 744 -2.746 7.952 7.281 1.00 0.00 H new ATOM 0 HG SER B 744 -4.532 9.239 7.991 1.00 0.00 H new ATOM 694 N ALA B 745 -3.099 4.668 8.271 1.00 0.00 N ATOM 695 CA ALA B 745 -3.100 3.511 7.326 1.00 0.00 C ATOM 696 C ALA B 745 -4.400 2.705 7.424 1.00 0.00 C ATOM 697 O ALA B 745 -4.536 1.663 6.814 1.00 0.00 O ATOM 698 CB ALA B 745 -1.912 2.663 7.766 1.00 0.00 C ATOM 0 H ALA B 745 -2.594 4.516 9.144 1.00 0.00 H new ATOM 0 HA ALA B 745 -3.028 3.835 6.288 1.00 0.00 H new ATOM 0 HB1 ALA B 745 -1.834 1.785 7.124 1.00 0.00 H new ATOM 0 HB2 ALA B 745 -0.997 3.251 7.690 1.00 0.00 H new ATOM 0 HB3 ALA B 745 -2.054 2.346 8.799 1.00 0.00 H new ATOM 704 N TRP B 746 -5.360 3.177 8.169 1.00 0.00 N ATOM 705 CA TRP B 746 -6.650 2.438 8.277 1.00 0.00 C ATOM 706 C TRP B 746 -7.195 2.072 6.882 1.00 0.00 C ATOM 707 O TRP B 746 -7.506 0.923 6.641 1.00 0.00 O ATOM 708 CB TRP B 746 -7.595 3.396 9.001 1.00 0.00 C ATOM 709 CG TRP B 746 -7.171 3.587 10.429 1.00 0.00 C ATOM 710 CD1 TRP B 746 -7.821 4.383 11.308 1.00 0.00 C ATOM 711 CD2 TRP B 746 -6.030 3.021 11.161 1.00 0.00 C ATOM 712 NE1 TRP B 746 -7.170 4.343 12.525 1.00 0.00 N ATOM 713 CE2 TRP B 746 -6.063 3.521 12.488 1.00 0.00 C ATOM 714 CE3 TRP B 746 -4.983 2.134 10.822 1.00 0.00 C ATOM 715 CZ2 TRP B 746 -5.104 3.160 13.435 1.00 0.00 C ATOM 716 CZ3 TRP B 746 -4.018 1.772 11.777 1.00 0.00 C ATOM 717 CH2 TRP B 746 -4.079 2.283 13.079 1.00 0.00 C ATOM 0 H TRP B 746 -5.308 4.042 8.708 1.00 0.00 H new ATOM 0 HA TRP B 746 -6.537 1.496 8.813 1.00 0.00 H new ATOM 0 HB2 TRP B 746 -7.607 4.358 8.489 1.00 0.00 H new ATOM 0 HB3 TRP B 746 -8.612 3.005 8.968 1.00 0.00 H new ATOM 0 HD1 TRP B 746 -8.709 4.959 11.092 1.00 0.00 H new ATOM 0 HE1 TRP B 746 -7.471 4.859 13.352 1.00 0.00 H new ATOM 0 HE3 TRP B 746 -4.924 1.732 9.822 1.00 0.00 H new ATOM 0 HZ2 TRP B 746 -5.155 3.557 14.438 1.00 0.00 H new ATOM 0 HZ3 TRP B 746 -3.223 1.094 11.504 1.00 0.00 H new ATOM 0 HH2 TRP B 746 -3.334 1.999 13.807 1.00 0.00 H new ATOM 728 N PRO B 747 -7.282 3.042 5.991 1.00 0.00 N ATOM 729 CA PRO B 747 -7.793 2.750 4.631 1.00 0.00 C ATOM 730 C PRO B 747 -6.937 1.689 3.948 1.00 0.00 C ATOM 731 O PRO B 747 -7.331 1.107 2.957 1.00 0.00 O ATOM 732 CB PRO B 747 -7.661 4.067 3.866 1.00 0.00 C ATOM 733 CG PRO B 747 -6.920 5.013 4.759 1.00 0.00 C ATOM 734 CD PRO B 747 -6.942 4.460 6.158 1.00 0.00 C ATOM 0 HA PRO B 747 -8.816 2.376 4.663 1.00 0.00 H new ATOM 0 HB2 PRO B 747 -7.123 3.918 2.930 1.00 0.00 H new ATOM 0 HB3 PRO B 747 -8.643 4.466 3.610 1.00 0.00 H new ATOM 0 HG2 PRO B 747 -5.893 5.134 4.415 1.00 0.00 H new ATOM 0 HG3 PRO B 747 -7.383 6.000 4.734 1.00 0.00 H new ATOM 0 HD2 PRO B 747 -5.975 4.581 6.647 1.00 0.00 H new ATOM 0 HD3 PRO B 747 -7.678 4.974 6.776 1.00 0.00 H new ATOM 742 N PHE B 748 -5.738 1.490 4.413 1.00 0.00 N ATOM 743 CA PHE B 748 -4.850 0.494 3.754 1.00 0.00 C ATOM 744 C PHE B 748 -4.635 -0.681 4.690 1.00 0.00 C ATOM 745 O PHE B 748 -3.595 -1.299 4.700 1.00 0.00 O ATOM 746 CB PHE B 748 -3.514 1.206 3.510 1.00 0.00 C ATOM 747 CG PHE B 748 -3.716 2.624 3.011 1.00 0.00 C ATOM 748 CD1 PHE B 748 -4.841 2.978 2.252 1.00 0.00 C ATOM 749 CD2 PHE B 748 -2.750 3.578 3.305 1.00 0.00 C ATOM 750 CE1 PHE B 748 -4.994 4.299 1.808 1.00 0.00 C ATOM 751 CE2 PHE B 748 -2.897 4.896 2.862 1.00 0.00 C ATOM 752 CZ PHE B 748 -4.020 5.257 2.113 1.00 0.00 C ATOM 0 H PHE B 748 -5.335 1.971 5.217 1.00 0.00 H new ATOM 0 HA PHE B 748 -5.280 0.123 2.824 1.00 0.00 H new ATOM 0 HB2 PHE B 748 -2.937 1.225 4.435 1.00 0.00 H new ATOM 0 HB3 PHE B 748 -2.930 0.644 2.781 1.00 0.00 H new ATOM 0 HD1 PHE B 748 -5.587 2.235 2.010 1.00 0.00 H new ATOM 0 HD2 PHE B 748 -1.879 3.300 3.880 1.00 0.00 H new ATOM 0 HE1 PHE B 748 -5.863 4.577 1.231 1.00 0.00 H new ATOM 0 HE2 PHE B 748 -2.144 5.633 3.098 1.00 0.00 H new ATOM 0 HZ PHE B 748 -4.136 6.274 1.770 1.00 0.00 H new ATOM 762 N MET B 749 -5.600 -0.973 5.499 1.00 0.00 N ATOM 763 CA MET B 749 -5.430 -2.040 6.496 1.00 0.00 C ATOM 764 C MET B 749 -6.642 -2.988 6.468 1.00 0.00 C ATOM 765 O MET B 749 -6.683 -3.981 7.165 1.00 0.00 O ATOM 766 CB MET B 749 -5.311 -1.206 7.772 1.00 0.00 C ATOM 767 CG MET B 749 -5.668 -1.981 9.031 1.00 0.00 C ATOM 768 SD MET B 749 -4.191 -2.807 9.681 1.00 0.00 S ATOM 769 CE MET B 749 -3.165 -1.330 9.924 1.00 0.00 C ATOM 0 H MET B 749 -6.509 -0.511 5.510 1.00 0.00 H new ATOM 0 HA MET B 749 -4.584 -2.712 6.354 1.00 0.00 H new ATOM 0 HB2 MET B 749 -4.291 -0.833 7.860 1.00 0.00 H new ATOM 0 HB3 MET B 749 -5.963 -0.336 7.692 1.00 0.00 H new ATOM 0 HG2 MET B 749 -6.078 -1.305 9.781 1.00 0.00 H new ATOM 0 HG3 MET B 749 -6.440 -2.718 8.809 1.00 0.00 H new ATOM 0 HE1 MET B 749 -2.692 -1.373 10.905 1.00 0.00 H new ATOM 0 HE2 MET B 749 -2.397 -1.290 9.152 1.00 0.00 H new ATOM 0 HE3 MET B 749 -3.790 -0.439 9.862 1.00 0.00 H new ATOM 779 N GLU B 750 -7.587 -2.741 5.595 1.00 0.00 N ATOM 780 CA GLU B 750 -8.746 -3.667 5.471 1.00 0.00 C ATOM 781 C GLU B 750 -8.915 -4.079 4.000 1.00 0.00 C ATOM 782 O GLU B 750 -8.792 -3.256 3.116 1.00 0.00 O ATOM 783 CB GLU B 750 -9.959 -2.867 5.946 1.00 0.00 C ATOM 784 CG GLU B 750 -10.112 -3.023 7.461 1.00 0.00 C ATOM 785 CD GLU B 750 -10.858 -4.323 7.768 1.00 0.00 C ATOM 786 OE1 GLU B 750 -11.953 -4.489 7.257 1.00 0.00 O ATOM 787 OE2 GLU B 750 -10.321 -5.130 8.509 1.00 0.00 O ATOM 0 H GLU B 750 -7.603 -1.939 4.965 1.00 0.00 H new ATOM 0 HA GLU B 750 -8.616 -4.578 6.056 1.00 0.00 H new ATOM 0 HB2 GLU B 750 -9.838 -1.815 5.688 1.00 0.00 H new ATOM 0 HB3 GLU B 750 -10.859 -3.217 5.441 1.00 0.00 H new ATOM 0 HG2 GLU B 750 -9.131 -3.033 7.937 1.00 0.00 H new ATOM 0 HG3 GLU B 750 -10.657 -2.173 7.872 1.00 0.00 H new ATOM 794 N PRO B 751 -9.181 -5.343 3.781 1.00 0.00 N ATOM 795 CA PRO B 751 -9.323 -5.856 2.396 1.00 0.00 C ATOM 796 C PRO B 751 -10.702 -5.526 1.819 1.00 0.00 C ATOM 797 O PRO B 751 -11.711 -5.998 2.303 1.00 0.00 O ATOM 798 CB PRO B 751 -9.179 -7.365 2.572 1.00 0.00 C ATOM 799 CG PRO B 751 -9.659 -7.631 3.963 1.00 0.00 C ATOM 800 CD PRO B 751 -9.323 -6.411 4.781 1.00 0.00 C ATOM 0 HA PRO B 751 -8.597 -5.419 1.710 1.00 0.00 H new ATOM 0 HB2 PRO B 751 -9.773 -7.908 1.837 1.00 0.00 H new ATOM 0 HB3 PRO B 751 -8.144 -7.682 2.442 1.00 0.00 H new ATOM 0 HG2 PRO B 751 -10.733 -7.819 3.972 1.00 0.00 H new ATOM 0 HG3 PRO B 751 -9.177 -8.517 4.375 1.00 0.00 H new ATOM 0 HD2 PRO B 751 -10.110 -6.183 5.500 1.00 0.00 H new ATOM 0 HD3 PRO B 751 -8.403 -6.552 5.349 1.00 0.00 H new ATOM 808 N VAL B 752 -10.757 -4.754 0.765 1.00 0.00 N ATOM 809 CA VAL B 752 -12.082 -4.449 0.148 1.00 0.00 C ATOM 810 C VAL B 752 -12.700 -5.762 -0.384 1.00 0.00 C ATOM 811 O VAL B 752 -13.088 -6.604 0.399 1.00 0.00 O ATOM 812 CB VAL B 752 -11.800 -3.404 -0.954 1.00 0.00 C ATOM 813 CG1 VAL B 752 -10.657 -3.873 -1.863 1.00 0.00 C ATOM 814 CG2 VAL B 752 -13.059 -3.146 -1.779 1.00 0.00 C ATOM 0 H VAL B 752 -9.951 -4.326 0.309 1.00 0.00 H new ATOM 0 HA VAL B 752 -12.810 -4.039 0.848 1.00 0.00 H new ATOM 0 HB VAL B 752 -11.500 -2.473 -0.474 1.00 0.00 H new ATOM 0 HG11 VAL B 752 -10.473 -3.123 -2.633 1.00 0.00 H new ATOM 0 HG12 VAL B 752 -9.754 -4.012 -1.269 1.00 0.00 H new ATOM 0 HG13 VAL B 752 -10.931 -4.817 -2.334 1.00 0.00 H new ATOM 0 HG21 VAL B 752 -12.843 -2.407 -2.551 1.00 0.00 H new ATOM 0 HG22 VAL B 752 -13.384 -4.075 -2.247 1.00 0.00 H new ATOM 0 HG23 VAL B 752 -13.849 -2.771 -1.129 1.00 0.00 H new ATOM 899 N ALA B 757 -17.473 -5.451 -3.771 1.00 0.00 N ATOM 900 CA ALA B 757 -17.122 -4.032 -3.477 1.00 0.00 C ATOM 901 C ALA B 757 -17.529 -3.147 -4.667 1.00 0.00 C ATOM 902 O ALA B 757 -16.703 -2.805 -5.490 1.00 0.00 O ATOM 903 CB ALA B 757 -15.600 -4.026 -3.285 1.00 0.00 C ATOM 0 HA ALA B 757 -17.634 -3.644 -2.596 1.00 0.00 H new ATOM 0 HB1 ALA B 757 -15.265 -3.012 -3.064 1.00 0.00 H new ATOM 0 HB2 ALA B 757 -15.335 -4.684 -2.457 1.00 0.00 H new ATOM 0 HB3 ALA B 757 -15.117 -4.377 -4.197 1.00 0.00 H new ATOM 909 N PRO B 758 -18.805 -2.833 -4.738 1.00 0.00 N ATOM 910 CA PRO B 758 -19.327 -2.016 -5.863 1.00 0.00 C ATOM 911 C PRO B 758 -18.495 -0.750 -6.067 1.00 0.00 C ATOM 912 O PRO B 758 -17.859 -0.256 -5.157 1.00 0.00 O ATOM 913 CB PRO B 758 -20.745 -1.655 -5.424 1.00 0.00 C ATOM 914 CG PRO B 758 -21.136 -2.708 -4.439 1.00 0.00 C ATOM 915 CD PRO B 758 -19.872 -3.219 -3.799 1.00 0.00 C ATOM 0 HA PRO B 758 -19.293 -2.551 -6.812 1.00 0.00 H new ATOM 0 HB2 PRO B 758 -20.776 -0.664 -4.972 1.00 0.00 H new ATOM 0 HB3 PRO B 758 -21.427 -1.639 -6.274 1.00 0.00 H new ATOM 0 HG2 PRO B 758 -21.809 -2.298 -3.686 1.00 0.00 H new ATOM 0 HG3 PRO B 758 -21.670 -3.519 -4.935 1.00 0.00 H new ATOM 0 HD2 PRO B 758 -19.716 -2.774 -2.816 1.00 0.00 H new ATOM 0 HD3 PRO B 758 -19.906 -4.299 -3.659 1.00 0.00 H new ATOM 923 N GLY B 759 -18.506 -0.216 -7.259 1.00 0.00 N ATOM 924 CA GLY B 759 -17.729 1.025 -7.530 1.00 0.00 C ATOM 925 C GLY B 759 -16.352 0.660 -8.084 1.00 0.00 C ATOM 926 O GLY B 759 -15.761 1.404 -8.840 1.00 0.00 O ATOM 0 H GLY B 759 -19.021 -0.587 -8.057 1.00 0.00 H new ATOM 0 HA2 GLY B 759 -18.264 1.652 -8.243 1.00 0.00 H new ATOM 0 HA3 GLY B 759 -17.621 1.605 -6.614 1.00 0.00 H new ATOM 930 N TYR B 760 -15.831 -0.475 -7.709 1.00 0.00 N ATOM 931 CA TYR B 760 -14.492 -0.879 -8.217 1.00 0.00 C ATOM 932 C TYR B 760 -14.549 -1.125 -9.725 1.00 0.00 C ATOM 933 O TYR B 760 -15.529 -0.826 -10.377 1.00 0.00 O ATOM 934 CB TYR B 760 -14.165 -2.176 -7.475 1.00 0.00 C ATOM 935 CG TYR B 760 -13.363 -1.855 -6.237 1.00 0.00 C ATOM 936 CD1 TYR B 760 -13.996 -1.293 -5.122 1.00 0.00 C ATOM 937 CD2 TYR B 760 -11.988 -2.114 -6.206 1.00 0.00 C ATOM 938 CE1 TYR B 760 -13.253 -0.993 -3.974 1.00 0.00 C ATOM 939 CE2 TYR B 760 -11.245 -1.815 -5.058 1.00 0.00 C ATOM 940 CZ TYR B 760 -11.878 -1.254 -3.942 1.00 0.00 C ATOM 941 OH TYR B 760 -11.146 -0.959 -2.810 1.00 0.00 O ATOM 0 H TYR B 760 -16.274 -1.139 -7.074 1.00 0.00 H new ATOM 0 HA TYR B 760 -13.738 -0.110 -8.050 1.00 0.00 H new ATOM 0 HB2 TYR B 760 -15.084 -2.694 -7.202 1.00 0.00 H new ATOM 0 HB3 TYR B 760 -13.601 -2.847 -8.123 1.00 0.00 H new ATOM 0 HD1 TYR B 760 -15.057 -1.091 -5.147 1.00 0.00 H new ATOM 0 HD2 TYR B 760 -11.500 -2.545 -7.068 1.00 0.00 H new ATOM 0 HE1 TYR B 760 -13.741 -0.560 -3.113 1.00 0.00 H new ATOM 0 HE2 TYR B 760 -10.184 -2.017 -5.033 1.00 0.00 H new ATOM 0 HH TYR B 760 -11.737 -0.576 -2.129 1.00 0.00 H new ATOM 951 N TYR B 761 -13.497 -1.669 -10.287 1.00 0.00 N ATOM 952 CA TYR B 761 -13.462 -1.942 -11.761 1.00 0.00 C ATOM 953 C TYR B 761 -13.483 -0.638 -12.572 1.00 0.00 C ATOM 954 O TYR B 761 -13.583 -0.658 -13.783 1.00 0.00 O ATOM 955 CB TYR B 761 -14.714 -2.776 -12.062 1.00 0.00 C ATOM 956 CG TYR B 761 -14.357 -3.902 -13.004 1.00 0.00 C ATOM 957 CD1 TYR B 761 -13.574 -4.970 -12.552 1.00 0.00 C ATOM 958 CD2 TYR B 761 -14.812 -3.877 -14.328 1.00 0.00 C ATOM 959 CE1 TYR B 761 -13.243 -6.014 -13.425 1.00 0.00 C ATOM 960 CE2 TYR B 761 -14.481 -4.921 -15.201 1.00 0.00 C ATOM 961 CZ TYR B 761 -13.696 -5.989 -14.750 1.00 0.00 C ATOM 962 OH TYR B 761 -13.371 -7.018 -15.610 1.00 0.00 O ATOM 0 H TYR B 761 -12.652 -1.939 -9.783 1.00 0.00 H new ATOM 0 HA TYR B 761 -12.547 -2.465 -12.039 1.00 0.00 H new ATOM 0 HB2 TYR B 761 -15.126 -3.179 -11.137 1.00 0.00 H new ATOM 0 HB3 TYR B 761 -15.485 -2.146 -12.507 1.00 0.00 H new ATOM 0 HD1 TYR B 761 -13.225 -4.989 -11.530 1.00 0.00 H new ATOM 0 HD2 TYR B 761 -15.418 -3.053 -14.676 1.00 0.00 H new ATOM 0 HE1 TYR B 761 -12.638 -6.838 -13.076 1.00 0.00 H new ATOM 0 HE2 TYR B 761 -14.831 -4.902 -16.222 1.00 0.00 H new ATOM 0 HH TYR B 761 -13.766 -6.846 -16.490 1.00 0.00 H new ATOM 972 N GLU B 762 -13.373 0.493 -11.927 1.00 0.00 N ATOM 973 CA GLU B 762 -13.360 1.782 -12.678 1.00 0.00 C ATOM 974 C GLU B 762 -12.595 2.850 -11.893 1.00 0.00 C ATOM 975 O GLU B 762 -12.756 4.033 -12.112 1.00 0.00 O ATOM 976 CB GLU B 762 -14.833 2.171 -12.823 1.00 0.00 C ATOM 977 CG GLU B 762 -15.466 2.292 -11.436 1.00 0.00 C ATOM 978 CD GLU B 762 -16.825 2.985 -11.554 1.00 0.00 C ATOM 979 OE1 GLU B 762 -17.761 2.337 -11.990 1.00 0.00 O ATOM 980 OE2 GLU B 762 -16.905 4.152 -11.206 1.00 0.00 O ATOM 0 H GLU B 762 -13.292 0.580 -10.914 1.00 0.00 H new ATOM 0 HA GLU B 762 -12.865 1.690 -13.645 1.00 0.00 H new ATOM 0 HB2 GLU B 762 -14.920 3.117 -13.358 1.00 0.00 H new ATOM 0 HB3 GLU B 762 -15.362 1.422 -13.412 1.00 0.00 H new ATOM 0 HG2 GLU B 762 -15.587 1.304 -10.992 1.00 0.00 H new ATOM 0 HG3 GLU B 762 -14.812 2.860 -10.775 1.00 0.00 H new ATOM 987 N VAL B 763 -11.756 2.427 -10.988 1.00 0.00 N ATOM 988 CA VAL B 763 -10.941 3.385 -10.176 1.00 0.00 C ATOM 989 C VAL B 763 -9.787 2.627 -9.514 1.00 0.00 C ATOM 990 O VAL B 763 -8.690 3.133 -9.386 1.00 0.00 O ATOM 991 CB VAL B 763 -11.875 3.970 -9.094 1.00 0.00 C ATOM 992 CG1 VAL B 763 -12.720 5.098 -9.689 1.00 0.00 C ATOM 993 CG2 VAL B 763 -12.800 2.887 -8.527 1.00 0.00 C ATOM 0 H VAL B 763 -11.596 1.443 -10.771 1.00 0.00 H new ATOM 0 HA VAL B 763 -10.526 4.179 -10.796 1.00 0.00 H new ATOM 0 HB VAL B 763 -11.256 4.361 -8.286 1.00 0.00 H new ATOM 0 HG11 VAL B 763 -13.376 5.506 -8.920 1.00 0.00 H new ATOM 0 HG12 VAL B 763 -12.065 5.885 -10.062 1.00 0.00 H new ATOM 0 HG13 VAL B 763 -13.322 4.708 -10.510 1.00 0.00 H new ATOM 0 HG21 VAL B 763 -13.448 3.323 -7.767 1.00 0.00 H new ATOM 0 HG22 VAL B 763 -13.410 2.473 -9.330 1.00 0.00 H new ATOM 0 HG23 VAL B 763 -12.200 2.094 -8.081 1.00 0.00 H new ATOM 1003 N ILE B 764 -10.028 1.409 -9.100 1.00 0.00 N ATOM 1004 CA ILE B 764 -8.948 0.607 -8.460 1.00 0.00 C ATOM 1005 C ILE B 764 -8.581 -0.580 -9.348 1.00 0.00 C ATOM 1006 O ILE B 764 -9.434 -1.314 -9.807 1.00 0.00 O ATOM 1007 CB ILE B 764 -9.542 0.109 -7.128 1.00 0.00 C ATOM 1008 CG1 ILE B 764 -10.257 1.240 -6.352 1.00 0.00 C ATOM 1009 CG2 ILE B 764 -8.423 -0.469 -6.259 1.00 0.00 C ATOM 1010 CD1 ILE B 764 -9.519 2.583 -6.486 1.00 0.00 C ATOM 0 H ILE B 764 -10.929 0.937 -9.179 1.00 0.00 H new ATOM 0 HA ILE B 764 -8.041 1.193 -8.307 1.00 0.00 H new ATOM 0 HB ILE B 764 -10.282 -0.656 -7.360 1.00 0.00 H new ATOM 0 HG12 ILE B 764 -11.276 1.347 -6.724 1.00 0.00 H new ATOM 0 HG13 ILE B 764 -10.329 0.969 -5.299 1.00 0.00 H new ATOM 0 HG21 ILE B 764 -8.840 -0.822 -5.316 1.00 0.00 H new ATOM 0 HG22 ILE B 764 -7.950 -1.301 -6.781 1.00 0.00 H new ATOM 0 HG23 ILE B 764 -7.680 0.304 -6.060 1.00 0.00 H new ATOM 0 HD11 ILE B 764 -10.054 3.350 -5.926 1.00 0.00 H new ATOM 0 HD12 ILE B 764 -8.508 2.484 -6.090 1.00 0.00 H new ATOM 0 HD13 ILE B 764 -9.471 2.868 -7.537 1.00 0.00 H new ATOM 1022 N ARG B 765 -7.317 -0.776 -9.592 1.00 0.00 N ATOM 1023 CA ARG B 765 -6.890 -1.913 -10.455 1.00 0.00 C ATOM 1024 C ARG B 765 -6.438 -3.085 -9.586 1.00 0.00 C ATOM 1025 O ARG B 765 -6.973 -4.173 -9.662 1.00 0.00 O ATOM 1026 CB ARG B 765 -5.703 -1.383 -11.267 1.00 0.00 C ATOM 1027 CG ARG B 765 -6.057 -0.032 -11.900 1.00 0.00 C ATOM 1028 CD ARG B 765 -5.381 1.093 -11.112 1.00 0.00 C ATOM 1029 NE ARG B 765 -4.180 1.458 -11.921 1.00 0.00 N ATOM 1030 CZ ARG B 765 -4.300 2.146 -13.033 1.00 0.00 C ATOM 1031 NH1 ARG B 765 -5.475 2.531 -13.467 1.00 0.00 N ATOM 1032 NH2 ARG B 765 -3.231 2.449 -13.717 1.00 0.00 N ATOM 0 H ARG B 765 -6.559 -0.197 -9.231 1.00 0.00 H new ATOM 0 HA ARG B 765 -7.700 -2.266 -11.094 1.00 0.00 H new ATOM 0 HB2 ARG B 765 -4.831 -1.274 -10.622 1.00 0.00 H new ATOM 0 HB3 ARG B 765 -5.436 -2.099 -12.045 1.00 0.00 H new ATOM 0 HG2 ARG B 765 -5.731 -0.009 -12.940 1.00 0.00 H new ATOM 0 HG3 ARG B 765 -7.138 0.109 -11.901 1.00 0.00 H new ATOM 0 HD2 ARG B 765 -6.049 1.946 -10.988 1.00 0.00 H new ATOM 0 HD3 ARG B 765 -5.099 0.762 -10.113 1.00 0.00 H new ATOM 0 HE ARG B 765 -3.254 1.169 -11.606 1.00 0.00 H new ATOM 0 HH11 ARG B 765 -6.316 2.297 -12.939 1.00 0.00 H new ATOM 0 HH12 ARG B 765 -5.549 3.065 -14.333 1.00 0.00 H new ATOM 0 HH21 ARG B 765 -2.313 2.152 -13.387 1.00 0.00 H new ATOM 0 HH22 ARG B 765 -3.313 2.983 -14.582 1.00 0.00 H new ATOM 1046 N PHE B 766 -5.449 -2.867 -8.765 1.00 0.00 N ATOM 1047 CA PHE B 766 -4.953 -3.962 -7.890 1.00 0.00 C ATOM 1048 C PHE B 766 -5.252 -3.642 -6.420 1.00 0.00 C ATOM 1049 O PHE B 766 -4.354 -3.324 -5.666 1.00 0.00 O ATOM 1050 CB PHE B 766 -3.442 -4.007 -8.139 1.00 0.00 C ATOM 1051 CG PHE B 766 -3.035 -5.412 -8.511 1.00 0.00 C ATOM 1052 CD1 PHE B 766 -3.279 -6.469 -7.626 1.00 0.00 C ATOM 1053 CD2 PHE B 766 -2.408 -5.657 -9.739 1.00 0.00 C ATOM 1054 CE1 PHE B 766 -2.900 -7.772 -7.970 1.00 0.00 C ATOM 1055 CE2 PHE B 766 -2.029 -6.960 -10.083 1.00 0.00 C ATOM 1056 CZ PHE B 766 -2.274 -8.017 -9.198 1.00 0.00 C ATOM 0 H PHE B 766 -4.963 -1.976 -8.663 1.00 0.00 H new ATOM 0 HA PHE B 766 -5.431 -4.918 -8.106 1.00 0.00 H new ATOM 0 HB2 PHE B 766 -3.174 -3.316 -8.938 1.00 0.00 H new ATOM 0 HB3 PHE B 766 -2.906 -3.686 -7.246 1.00 0.00 H new ATOM 0 HD1 PHE B 766 -3.760 -6.279 -6.678 1.00 0.00 H new ATOM 0 HD2 PHE B 766 -2.217 -4.841 -10.420 1.00 0.00 H new ATOM 0 HE1 PHE B 766 -3.090 -8.588 -7.288 1.00 0.00 H new ATOM 0 HE2 PHE B 766 -1.548 -7.150 -11.031 1.00 0.00 H new ATOM 0 HZ PHE B 766 -1.980 -9.022 -9.463 1.00 0.00 H new ATOM 1066 N PRO B 767 -6.515 -3.747 -6.055 1.00 0.00 N ATOM 1067 CA PRO B 767 -6.942 -3.478 -4.657 1.00 0.00 C ATOM 1068 C PRO B 767 -5.932 -4.040 -3.648 1.00 0.00 C ATOM 1069 O PRO B 767 -5.995 -5.192 -3.267 1.00 0.00 O ATOM 1070 CB PRO B 767 -8.271 -4.222 -4.547 1.00 0.00 C ATOM 1071 CG PRO B 767 -8.797 -4.338 -5.949 1.00 0.00 C ATOM 1072 CD PRO B 767 -7.650 -4.123 -6.908 1.00 0.00 C ATOM 0 HA PRO B 767 -7.020 -2.413 -4.440 1.00 0.00 H new ATOM 0 HB2 PRO B 767 -8.131 -5.206 -4.100 1.00 0.00 H new ATOM 0 HB3 PRO B 767 -8.971 -3.679 -3.911 1.00 0.00 H new ATOM 0 HG2 PRO B 767 -9.244 -5.320 -6.106 1.00 0.00 H new ATOM 0 HG3 PRO B 767 -9.580 -3.600 -6.123 1.00 0.00 H new ATOM 0 HD2 PRO B 767 -7.435 -5.028 -7.477 1.00 0.00 H new ATOM 0 HD3 PRO B 767 -7.879 -3.339 -7.630 1.00 0.00 H new ATOM 1080 N MET B 768 -4.991 -3.237 -3.229 1.00 0.00 N ATOM 1081 CA MET B 768 -3.963 -3.727 -2.270 1.00 0.00 C ATOM 1082 C MET B 768 -4.209 -3.150 -0.876 1.00 0.00 C ATOM 1083 O MET B 768 -5.041 -2.285 -0.689 1.00 0.00 O ATOM 1084 CB MET B 768 -2.634 -3.217 -2.832 1.00 0.00 C ATOM 1085 CG MET B 768 -1.925 -4.353 -3.571 1.00 0.00 C ATOM 1086 SD MET B 768 -1.477 -5.652 -2.395 1.00 0.00 S ATOM 1087 CE MET B 768 -2.773 -6.825 -2.859 1.00 0.00 C ATOM 0 H MET B 768 -4.891 -2.262 -3.511 1.00 0.00 H new ATOM 0 HA MET B 768 -3.981 -4.812 -2.166 1.00 0.00 H new ATOM 0 HB2 MET B 768 -2.810 -2.382 -3.510 1.00 0.00 H new ATOM 0 HB3 MET B 768 -2.004 -2.845 -2.024 1.00 0.00 H new ATOM 0 HG2 MET B 768 -2.575 -4.758 -4.346 1.00 0.00 H new ATOM 0 HG3 MET B 768 -1.032 -3.975 -4.069 1.00 0.00 H new ATOM 0 HE1 MET B 768 -3.196 -7.274 -1.960 1.00 0.00 H new ATOM 0 HE2 MET B 768 -3.557 -6.303 -3.407 1.00 0.00 H new ATOM 0 HE3 MET B 768 -2.348 -7.606 -3.489 1.00 0.00 H new ATOM 1097 N ASP B 769 -3.498 -3.631 0.109 1.00 0.00 N ATOM 1098 CA ASP B 769 -3.701 -3.119 1.494 1.00 0.00 C ATOM 1099 C ASP B 769 -2.712 -3.760 2.462 1.00 0.00 C ATOM 1100 O ASP B 769 -2.326 -4.902 2.308 1.00 0.00 O ATOM 1101 CB ASP B 769 -5.128 -3.532 1.865 1.00 0.00 C ATOM 1102 CG ASP B 769 -5.297 -5.040 1.668 1.00 0.00 C ATOM 1103 OD1 ASP B 769 -4.731 -5.785 2.447 1.00 0.00 O ATOM 1104 OD2 ASP B 769 -5.990 -5.422 0.739 1.00 0.00 O ATOM 0 H ASP B 769 -2.786 -4.356 0.014 1.00 0.00 H new ATOM 0 HA ASP B 769 -3.547 -2.041 1.548 1.00 0.00 H new ATOM 0 HB2 ASP B 769 -5.336 -3.265 2.901 1.00 0.00 H new ATOM 0 HB3 ASP B 769 -5.845 -2.992 1.247 1.00 0.00 H new ATOM 1109 N LEU B 770 -2.320 -3.041 3.475 1.00 0.00 N ATOM 1110 CA LEU B 770 -1.409 -3.627 4.495 1.00 0.00 C ATOM 1111 C LEU B 770 -2.047 -4.896 5.056 1.00 0.00 C ATOM 1112 O LEU B 770 -1.373 -5.829 5.445 1.00 0.00 O ATOM 1113 CB LEU B 770 -1.281 -2.559 5.587 1.00 0.00 C ATOM 1114 CG LEU B 770 -0.756 -1.242 4.991 1.00 0.00 C ATOM 1115 CD1 LEU B 770 -0.447 -0.264 6.126 1.00 0.00 C ATOM 1116 CD2 LEU B 770 0.520 -1.497 4.182 1.00 0.00 C ATOM 0 H LEU B 770 -2.591 -2.072 3.641 1.00 0.00 H new ATOM 0 HA LEU B 770 -0.434 -3.895 4.089 1.00 0.00 H new ATOM 0 HB2 LEU B 770 -2.250 -2.392 6.056 1.00 0.00 H new ATOM 0 HB3 LEU B 770 -0.605 -2.907 6.368 1.00 0.00 H new ATOM 0 HG LEU B 770 -1.516 -0.822 4.332 1.00 0.00 H new ATOM 0 HD11 LEU B 770 -0.074 0.672 5.709 1.00 0.00 H new ATOM 0 HD12 LEU B 770 -1.355 -0.070 6.697 1.00 0.00 H new ATOM 0 HD13 LEU B 770 0.309 -0.695 6.782 1.00 0.00 H new ATOM 0 HD21 LEU B 770 0.881 -0.556 3.766 1.00 0.00 H new ATOM 0 HD22 LEU B 770 1.284 -1.923 4.832 1.00 0.00 H new ATOM 0 HD23 LEU B 770 0.304 -2.193 3.372 1.00 0.00 H new ATOM 1128 N LYS B 771 -3.355 -4.951 5.047 1.00 0.00 N ATOM 1129 CA LYS B 771 -4.066 -6.166 5.543 1.00 0.00 C ATOM 1130 C LYS B 771 -3.465 -7.425 4.893 1.00 0.00 C ATOM 1131 O LYS B 771 -3.305 -8.448 5.529 1.00 0.00 O ATOM 1132 CB LYS B 771 -5.551 -5.918 5.143 1.00 0.00 C ATOM 1133 CG LYS B 771 -6.181 -7.100 4.377 1.00 0.00 C ATOM 1134 CD LYS B 771 -6.505 -8.230 5.356 1.00 0.00 C ATOM 1135 CE LYS B 771 -5.949 -9.549 4.814 1.00 0.00 C ATOM 1136 NZ LYS B 771 -5.961 -10.475 5.981 1.00 0.00 N ATOM 0 H LYS B 771 -3.963 -4.202 4.715 1.00 0.00 H new ATOM 0 HA LYS B 771 -3.974 -6.331 6.617 1.00 0.00 H new ATOM 0 HB2 LYS B 771 -6.135 -5.724 6.043 1.00 0.00 H new ATOM 0 HB3 LYS B 771 -5.609 -5.021 4.526 1.00 0.00 H new ATOM 0 HG2 LYS B 771 -7.088 -6.775 3.868 1.00 0.00 H new ATOM 0 HG3 LYS B 771 -5.495 -7.456 3.609 1.00 0.00 H new ATOM 0 HD2 LYS B 771 -6.072 -8.015 6.333 1.00 0.00 H new ATOM 0 HD3 LYS B 771 -7.583 -8.307 5.495 1.00 0.00 H new ATOM 0 HE2 LYS B 771 -6.563 -9.932 3.999 1.00 0.00 H new ATOM 0 HE3 LYS B 771 -4.941 -9.421 4.421 1.00 0.00 H new ATOM 0 HZ1 LYS B 771 -5.593 -11.404 5.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 771 -5.363 -10.087 6.738 1.00 0.00 H new ATOM 0 HZ3 LYS B 771 -6.935 -10.582 6.329 1.00 0.00 H new ATOM 1150 N THR B 772 -3.154 -7.357 3.628 1.00 0.00 N ATOM 1151 CA THR B 772 -2.597 -8.552 2.937 1.00 0.00 C ATOM 1152 C THR B 772 -1.175 -8.285 2.436 1.00 0.00 C ATOM 1153 O THR B 772 -0.387 -9.198 2.286 1.00 0.00 O ATOM 1154 CB THR B 772 -3.546 -8.815 1.763 1.00 0.00 C ATOM 1155 OG1 THR B 772 -3.097 -9.951 1.038 1.00 0.00 O ATOM 1156 CG2 THR B 772 -3.578 -7.600 0.834 1.00 0.00 C ATOM 0 H THR B 772 -3.261 -6.527 3.045 1.00 0.00 H new ATOM 0 HA THR B 772 -2.528 -9.409 3.607 1.00 0.00 H new ATOM 0 HB THR B 772 -4.549 -8.997 2.149 1.00 0.00 H new ATOM 0 HG1 THR B 772 -3.704 -10.121 0.288 1.00 0.00 H new ATOM 0 HG21 THR B 772 -4.255 -7.796 0.002 1.00 0.00 H new ATOM 0 HG22 THR B 772 -3.926 -6.728 1.388 1.00 0.00 H new ATOM 0 HG23 THR B 772 -2.576 -7.410 0.449 1.00 0.00 H new ATOM 1164 N MET B 773 -0.823 -7.048 2.190 1.00 0.00 N ATOM 1165 CA MET B 773 0.569 -6.764 1.726 1.00 0.00 C ATOM 1166 C MET B 773 1.574 -7.364 2.703 1.00 0.00 C ATOM 1167 O MET B 773 2.648 -7.790 2.327 1.00 0.00 O ATOM 1168 CB MET B 773 0.705 -5.246 1.749 1.00 0.00 C ATOM 1169 CG MET B 773 0.246 -4.657 0.414 1.00 0.00 C ATOM 1170 SD MET B 773 0.741 -2.917 0.320 1.00 0.00 S ATOM 1171 CE MET B 773 2.524 -3.161 0.543 1.00 0.00 C ATOM 0 H MET B 773 -1.429 -6.233 2.288 1.00 0.00 H new ATOM 0 HA MET B 773 0.756 -7.185 0.738 1.00 0.00 H new ATOM 0 HB2 MET B 773 0.109 -4.832 2.562 1.00 0.00 H new ATOM 0 HB3 MET B 773 1.742 -4.969 1.940 1.00 0.00 H new ATOM 0 HG2 MET B 773 0.685 -5.216 -0.412 1.00 0.00 H new ATOM 0 HG3 MET B 773 -0.836 -4.744 0.319 1.00 0.00 H new ATOM 0 HE1 MET B 773 3.069 -2.453 -0.081 1.00 0.00 H new ATOM 0 HE2 MET B 773 2.785 -2.999 1.589 1.00 0.00 H new ATOM 0 HE3 MET B 773 2.791 -4.178 0.255 1.00 0.00 H new ATOM 1181 N SER B 774 1.248 -7.358 3.965 1.00 0.00 N ATOM 1182 CA SER B 774 2.192 -7.892 4.975 1.00 0.00 C ATOM 1183 C SER B 774 2.281 -9.413 4.866 1.00 0.00 C ATOM 1184 O SER B 774 3.328 -9.999 5.055 1.00 0.00 O ATOM 1185 CB SER B 774 1.596 -7.485 6.324 1.00 0.00 C ATOM 1186 OG SER B 774 0.564 -8.394 6.679 1.00 0.00 O ATOM 0 H SER B 774 0.366 -7.005 4.337 1.00 0.00 H new ATOM 0 HA SER B 774 3.203 -7.506 4.840 1.00 0.00 H new ATOM 0 HB2 SER B 774 2.371 -7.481 7.090 1.00 0.00 H new ATOM 0 HB3 SER B 774 1.199 -6.471 6.267 1.00 0.00 H new ATOM 0 HG SER B 774 0.183 -8.135 7.544 1.00 0.00 H new ATOM 1192 N GLU B 775 1.190 -10.057 4.552 1.00 0.00 N ATOM 1193 CA GLU B 775 1.214 -11.539 4.425 1.00 0.00 C ATOM 1194 C GLU B 775 2.317 -11.967 3.458 1.00 0.00 C ATOM 1195 O GLU B 775 2.915 -13.015 3.605 1.00 0.00 O ATOM 1196 CB GLU B 775 -0.161 -11.904 3.870 1.00 0.00 C ATOM 1197 CG GLU B 775 -1.204 -11.705 4.968 1.00 0.00 C ATOM 1198 CD GLU B 775 -2.514 -12.382 4.559 1.00 0.00 C ATOM 1199 OE1 GLU B 775 -3.283 -11.757 3.847 1.00 0.00 O ATOM 1200 OE2 GLU B 775 -2.726 -13.513 4.964 1.00 0.00 O ATOM 0 H GLU B 775 0.285 -9.620 4.378 1.00 0.00 H new ATOM 0 HA GLU B 775 1.417 -12.036 5.374 1.00 0.00 H new ATOM 0 HB2 GLU B 775 -0.397 -11.281 3.008 1.00 0.00 H new ATOM 0 HB3 GLU B 775 -0.167 -12.939 3.527 1.00 0.00 H new ATOM 0 HG2 GLU B 775 -0.843 -12.125 5.907 1.00 0.00 H new ATOM 0 HG3 GLU B 775 -1.370 -10.641 5.138 1.00 0.00 H new ATOM 1207 N ARG B 776 2.602 -11.156 2.476 1.00 0.00 N ATOM 1208 CA ARG B 776 3.688 -11.502 1.519 1.00 0.00 C ATOM 1209 C ARG B 776 5.036 -11.445 2.233 1.00 0.00 C ATOM 1210 O ARG B 776 5.767 -12.414 2.276 1.00 0.00 O ATOM 1211 CB ARG B 776 3.611 -10.434 0.430 1.00 0.00 C ATOM 1212 CG ARG B 776 2.286 -10.575 -0.321 1.00 0.00 C ATOM 1213 CD ARG B 776 2.561 -10.747 -1.816 1.00 0.00 C ATOM 1214 NE ARG B 776 1.522 -11.710 -2.288 1.00 0.00 N ATOM 1215 CZ ARG B 776 1.652 -12.334 -3.435 1.00 0.00 C ATOM 1216 NH1 ARG B 776 2.698 -12.132 -4.199 1.00 0.00 N ATOM 1217 NH2 ARG B 776 0.727 -13.169 -3.821 1.00 0.00 N ATOM 0 H ARG B 776 2.130 -10.270 2.296 1.00 0.00 H new ATOM 0 HA ARG B 776 3.581 -12.506 1.107 1.00 0.00 H new ATOM 0 HB2 ARG B 776 3.688 -9.441 0.872 1.00 0.00 H new ATOM 0 HB3 ARG B 776 4.447 -10.541 -0.261 1.00 0.00 H new ATOM 0 HG2 ARG B 776 1.731 -11.433 0.058 1.00 0.00 H new ATOM 0 HG3 ARG B 776 1.666 -9.694 -0.154 1.00 0.00 H new ATOM 0 HD2 ARG B 776 2.487 -9.796 -2.343 1.00 0.00 H new ATOM 0 HD3 ARG B 776 3.566 -11.132 -1.991 1.00 0.00 H new ATOM 0 HE ARG B 776 0.700 -11.885 -1.711 1.00 0.00 H new ATOM 0 HH11 ARG B 776 3.426 -11.482 -3.905 1.00 0.00 H new ATOM 0 HH12 ARG B 776 2.783 -12.625 -5.088 1.00 0.00 H new ATOM 0 HH21 ARG B 776 -0.090 -13.333 -3.233 1.00 0.00 H new ATOM 0 HH22 ARG B 776 0.821 -13.658 -4.711 1.00 0.00 H new ATOM 1231 N LEU B 777 5.358 -10.326 2.823 1.00 0.00 N ATOM 1232 CA LEU B 777 6.638 -10.233 3.576 1.00 0.00 C ATOM 1233 C LEU B 777 6.673 -11.331 4.637 1.00 0.00 C ATOM 1234 O LEU B 777 7.699 -11.925 4.902 1.00 0.00 O ATOM 1235 CB LEU B 777 6.617 -8.852 4.229 1.00 0.00 C ATOM 1236 CG LEU B 777 8.006 -8.222 4.119 1.00 0.00 C ATOM 1237 CD1 LEU B 777 7.870 -6.745 3.746 1.00 0.00 C ATOM 1238 CD2 LEU B 777 8.732 -8.351 5.461 1.00 0.00 C ATOM 0 H LEU B 777 4.793 -9.477 2.816 1.00 0.00 H new ATOM 0 HA LEU B 777 7.515 -10.359 2.941 1.00 0.00 H new ATOM 0 HB2 LEU B 777 5.877 -8.217 3.741 1.00 0.00 H new ATOM 0 HB3 LEU B 777 6.325 -8.936 5.276 1.00 0.00 H new ATOM 0 HG LEU B 777 8.579 -8.736 3.347 1.00 0.00 H new ATOM 0 HD11 LEU B 777 8.860 -6.297 3.668 1.00 0.00 H new ATOM 0 HD12 LEU B 777 7.355 -6.657 2.789 1.00 0.00 H new ATOM 0 HD13 LEU B 777 7.297 -6.227 4.515 1.00 0.00 H new ATOM 0 HD21 LEU B 777 9.722 -7.902 5.384 1.00 0.00 H new ATOM 0 HD22 LEU B 777 8.161 -7.838 6.235 1.00 0.00 H new ATOM 0 HD23 LEU B 777 8.831 -9.405 5.721 1.00 0.00 H new ATOM 1250 N LYS B 778 5.541 -11.633 5.215 1.00 0.00 N ATOM 1251 CA LYS B 778 5.485 -12.735 6.209 1.00 0.00 C ATOM 1252 C LYS B 778 5.990 -14.019 5.554 1.00 0.00 C ATOM 1253 O LYS B 778 6.563 -14.877 6.195 1.00 0.00 O ATOM 1254 CB LYS B 778 4.004 -12.860 6.575 1.00 0.00 C ATOM 1255 CG LYS B 778 3.690 -11.933 7.751 1.00 0.00 C ATOM 1256 CD LYS B 778 3.047 -12.739 8.881 1.00 0.00 C ATOM 1257 CE LYS B 778 2.602 -11.788 9.993 1.00 0.00 C ATOM 1258 NZ LYS B 778 3.869 -11.259 10.573 1.00 0.00 N ATOM 0 H LYS B 778 4.654 -11.162 5.039 1.00 0.00 H new ATOM 0 HA LYS B 778 6.100 -12.550 7.090 1.00 0.00 H new ATOM 0 HB2 LYS B 778 3.383 -12.600 5.717 1.00 0.00 H new ATOM 0 HB3 LYS B 778 3.769 -13.891 6.838 1.00 0.00 H new ATOM 0 HG2 LYS B 778 4.604 -11.456 8.105 1.00 0.00 H new ATOM 0 HG3 LYS B 778 3.018 -11.137 7.430 1.00 0.00 H new ATOM 0 HD2 LYS B 778 2.192 -13.299 8.502 1.00 0.00 H new ATOM 0 HD3 LYS B 778 3.757 -13.467 9.273 1.00 0.00 H new ATOM 0 HE2 LYS B 778 1.981 -10.983 9.600 1.00 0.00 H new ATOM 0 HE3 LYS B 778 2.010 -12.309 10.745 1.00 0.00 H new ATOM 0 HZ1 LYS B 778 3.695 -10.930 11.544 1.00 0.00 H new ATOM 0 HZ2 LYS B 778 4.586 -12.012 10.585 1.00 0.00 H new ATOM 0 HZ3 LYS B 778 4.211 -10.465 9.995 1.00 0.00 H new ATOM 1272 N ASN B 779 5.803 -14.137 4.266 1.00 0.00 N ATOM 1273 CA ASN B 779 6.304 -15.337 3.543 1.00 0.00 C ATOM 1274 C ASN B 779 7.488 -14.950 2.652 1.00 0.00 C ATOM 1275 O ASN B 779 7.830 -15.648 1.718 1.00 0.00 O ATOM 1276 CB ASN B 779 5.123 -15.805 2.691 1.00 0.00 C ATOM 1277 CG ASN B 779 3.998 -16.296 3.605 1.00 0.00 C ATOM 1278 OD1 ASN B 779 3.918 -15.905 4.753 1.00 0.00 O ATOM 1279 ND2 ASN B 779 3.118 -17.141 3.141 1.00 0.00 N ATOM 0 H ASN B 779 5.323 -13.451 3.684 1.00 0.00 H new ATOM 0 HA ASN B 779 6.652 -16.118 4.220 1.00 0.00 H new ATOM 0 HB2 ASN B 779 4.766 -14.988 2.064 1.00 0.00 H new ATOM 0 HB3 ASN B 779 5.438 -16.606 2.022 1.00 0.00 H new ATOM 0 HD21 ASN B 779 2.364 -17.473 3.742 1.00 0.00 H new ATOM 0 HD22 ASN B 779 3.185 -17.469 2.178 1.00 0.00 H new ATOM 1286 N ARG B 780 8.114 -13.835 2.933 1.00 0.00 N ATOM 1287 CA ARG B 780 9.274 -13.393 2.109 1.00 0.00 C ATOM 1288 C ARG B 780 8.887 -13.321 0.630 1.00 0.00 C ATOM 1289 O ARG B 780 9.689 -13.582 -0.245 1.00 0.00 O ATOM 1290 CB ARG B 780 10.348 -14.459 2.337 1.00 0.00 C ATOM 1291 CG ARG B 780 11.643 -14.035 1.641 1.00 0.00 C ATOM 1292 CD ARG B 780 11.925 -14.978 0.469 1.00 0.00 C ATOM 1293 NE ARG B 780 12.954 -15.930 0.983 1.00 0.00 N ATOM 1294 CZ ARG B 780 13.291 -16.994 0.291 1.00 0.00 C ATOM 1295 NH1 ARG B 780 12.736 -17.251 -0.868 1.00 0.00 N ATOM 1296 NH2 ARG B 780 14.194 -17.808 0.765 1.00 0.00 N ATOM 0 H ARG B 780 7.868 -13.211 3.702 1.00 0.00 H new ATOM 0 HA ARG B 780 9.621 -12.398 2.387 1.00 0.00 H new ATOM 0 HB2 ARG B 780 10.523 -14.592 3.405 1.00 0.00 H new ATOM 0 HB3 ARG B 780 10.011 -15.420 1.947 1.00 0.00 H new ATOM 0 HG2 ARG B 780 11.557 -13.009 1.283 1.00 0.00 H new ATOM 0 HG3 ARG B 780 12.473 -14.058 2.348 1.00 0.00 H new ATOM 0 HD2 ARG B 780 11.022 -15.503 0.157 1.00 0.00 H new ATOM 0 HD3 ARG B 780 12.291 -14.431 -0.399 1.00 0.00 H new ATOM 0 HE ARG B 780 13.401 -15.752 1.883 1.00 0.00 H new ATOM 0 HH11 ARG B 780 12.030 -16.620 -1.246 1.00 0.00 H new ATOM 0 HH12 ARG B 780 13.010 -18.082 -1.392 1.00 0.00 H new ATOM 0 HH21 ARG B 780 14.632 -17.615 1.666 1.00 0.00 H new ATOM 0 HH22 ARG B 780 14.462 -18.637 0.235 1.00 0.00 H new ATOM 1310 N TYR B 781 7.667 -12.953 0.344 1.00 0.00 N ATOM 1311 CA TYR B 781 7.237 -12.839 -1.079 1.00 0.00 C ATOM 1312 C TYR B 781 7.612 -11.460 -1.625 1.00 0.00 C ATOM 1313 O TYR B 781 8.063 -11.324 -2.745 1.00 0.00 O ATOM 1314 CB TYR B 781 5.715 -13.004 -1.045 1.00 0.00 C ATOM 1315 CG TYR B 781 5.317 -14.197 -1.883 1.00 0.00 C ATOM 1316 CD1 TYR B 781 5.144 -14.056 -3.265 1.00 0.00 C ATOM 1317 CD2 TYR B 781 5.118 -15.443 -1.277 1.00 0.00 C ATOM 1318 CE1 TYR B 781 4.774 -15.161 -4.041 1.00 0.00 C ATOM 1319 CE2 TYR B 781 4.747 -16.548 -2.053 1.00 0.00 C ATOM 1320 CZ TYR B 781 4.576 -16.407 -3.435 1.00 0.00 C ATOM 1321 OH TYR B 781 4.210 -17.496 -4.201 1.00 0.00 O ATOM 0 H TYR B 781 6.950 -12.727 1.034 1.00 0.00 H new ATOM 0 HA TYR B 781 7.713 -13.581 -1.720 1.00 0.00 H new ATOM 0 HB2 TYR B 781 5.376 -13.139 -0.018 1.00 0.00 H new ATOM 0 HB3 TYR B 781 5.233 -12.103 -1.424 1.00 0.00 H new ATOM 0 HD1 TYR B 781 5.296 -13.094 -3.733 1.00 0.00 H new ATOM 0 HD2 TYR B 781 5.251 -15.552 -0.211 1.00 0.00 H new ATOM 0 HE1 TYR B 781 4.641 -15.052 -5.107 1.00 0.00 H new ATOM 0 HE2 TYR B 781 4.593 -17.509 -1.585 1.00 0.00 H new ATOM 0 HH TYR B 781 4.115 -18.284 -3.626 1.00 0.00 H new ATOM 1331 N TYR B 782 7.440 -10.438 -0.832 1.00 0.00 N ATOM 1332 CA TYR B 782 7.798 -9.064 -1.284 1.00 0.00 C ATOM 1333 C TYR B 782 9.112 -8.629 -0.632 1.00 0.00 C ATOM 1334 O TYR B 782 9.148 -8.259 0.524 1.00 0.00 O ATOM 1335 CB TYR B 782 6.640 -8.184 -0.798 1.00 0.00 C ATOM 1336 CG TYR B 782 5.581 -8.057 -1.878 1.00 0.00 C ATOM 1337 CD1 TYR B 782 5.340 -9.113 -2.772 1.00 0.00 C ATOM 1338 CD2 TYR B 782 4.820 -6.885 -1.966 1.00 0.00 C ATOM 1339 CE1 TYR B 782 4.359 -8.985 -3.761 1.00 0.00 C ATOM 1340 CE2 TYR B 782 3.833 -6.761 -2.951 1.00 0.00 C ATOM 1341 CZ TYR B 782 3.604 -7.810 -3.850 1.00 0.00 C ATOM 1342 OH TYR B 782 2.633 -7.684 -4.823 1.00 0.00 O ATOM 0 H TYR B 782 7.065 -10.496 0.115 1.00 0.00 H new ATOM 0 HA TYR B 782 7.939 -8.998 -2.363 1.00 0.00 H new ATOM 0 HB2 TYR B 782 6.201 -8.615 0.102 1.00 0.00 H new ATOM 0 HB3 TYR B 782 7.014 -7.196 -0.529 1.00 0.00 H new ATOM 0 HD1 TYR B 782 5.913 -10.025 -2.696 1.00 0.00 H new ATOM 0 HD2 TYR B 782 4.995 -6.075 -1.273 1.00 0.00 H new ATOM 0 HE1 TYR B 782 4.184 -9.793 -4.456 1.00 0.00 H new ATOM 0 HE2 TYR B 782 3.248 -5.856 -3.018 1.00 0.00 H new ATOM 0 HH TYR B 782 1.764 -7.524 -4.399 1.00 0.00 H new ATOM 1352 N VAL B 783 10.196 -8.688 -1.357 1.00 0.00 N ATOM 1353 CA VAL B 783 11.508 -8.304 -0.761 1.00 0.00 C ATOM 1354 C VAL B 783 12.265 -7.339 -1.676 1.00 0.00 C ATOM 1355 O VAL B 783 13.478 -7.360 -1.743 1.00 0.00 O ATOM 1356 CB VAL B 783 12.278 -9.621 -0.629 1.00 0.00 C ATOM 1357 CG1 VAL B 783 11.571 -10.525 0.383 1.00 0.00 C ATOM 1358 CG2 VAL B 783 12.333 -10.324 -1.989 1.00 0.00 C ATOM 0 H VAL B 783 10.230 -8.984 -2.332 1.00 0.00 H new ATOM 0 HA VAL B 783 11.385 -7.794 0.194 1.00 0.00 H new ATOM 0 HB VAL B 783 13.292 -9.414 -0.288 1.00 0.00 H new ATOM 0 HG11 VAL B 783 12.118 -11.463 0.478 1.00 0.00 H new ATOM 0 HG12 VAL B 783 11.534 -10.027 1.352 1.00 0.00 H new ATOM 0 HG13 VAL B 783 10.556 -10.730 0.041 1.00 0.00 H new ATOM 0 HG21 VAL B 783 12.882 -11.261 -1.892 1.00 0.00 H new ATOM 0 HG22 VAL B 783 11.320 -10.531 -2.333 1.00 0.00 H new ATOM 0 HG23 VAL B 783 12.837 -9.681 -2.711 1.00 0.00 H new ATOM 1368 N SER B 784 11.569 -6.480 -2.370 1.00 0.00 N ATOM 1369 CA SER B 784 12.269 -5.513 -3.262 1.00 0.00 C ATOM 1370 C SER B 784 11.431 -4.248 -3.449 1.00 0.00 C ATOM 1371 O SER B 784 10.508 -3.985 -2.703 1.00 0.00 O ATOM 1372 CB SER B 784 12.430 -6.248 -4.592 1.00 0.00 C ATOM 1373 OG SER B 784 12.660 -7.628 -4.346 1.00 0.00 O ATOM 0 H SER B 784 10.552 -6.406 -2.358 1.00 0.00 H new ATOM 0 HA SER B 784 13.226 -5.196 -2.849 1.00 0.00 H new ATOM 0 HB2 SER B 784 11.535 -6.121 -5.201 1.00 0.00 H new ATOM 0 HB3 SER B 784 13.262 -5.825 -5.155 1.00 0.00 H new ATOM 0 HG SER B 784 12.762 -8.100 -5.199 1.00 0.00 H new ATOM 1379 N LYS B 785 11.750 -3.457 -4.437 1.00 0.00 N ATOM 1380 CA LYS B 785 10.980 -2.202 -4.668 1.00 0.00 C ATOM 1381 C LYS B 785 9.730 -2.483 -5.503 1.00 0.00 C ATOM 1382 O LYS B 785 8.622 -2.424 -5.009 1.00 0.00 O ATOM 1383 CB LYS B 785 11.938 -1.291 -5.440 1.00 0.00 C ATOM 1384 CG LYS B 785 11.218 0.008 -5.809 1.00 0.00 C ATOM 1385 CD LYS B 785 10.993 0.057 -7.321 1.00 0.00 C ATOM 1386 CE LYS B 785 9.708 0.833 -7.619 1.00 0.00 C ATOM 1387 NZ LYS B 785 9.582 0.806 -9.104 1.00 0.00 N ATOM 0 H LYS B 785 12.511 -3.626 -5.095 1.00 0.00 H new ATOM 0 HA LYS B 785 10.641 -1.753 -3.734 1.00 0.00 H new ATOM 0 HB2 LYS B 785 12.817 -1.073 -4.834 1.00 0.00 H new ATOM 0 HB3 LYS B 785 12.289 -1.794 -6.341 1.00 0.00 H new ATOM 0 HG2 LYS B 785 10.263 0.068 -5.287 1.00 0.00 H new ATOM 0 HG3 LYS B 785 11.809 0.867 -5.491 1.00 0.00 H new ATOM 0 HD2 LYS B 785 11.841 0.535 -7.811 1.00 0.00 H new ATOM 0 HD3 LYS B 785 10.922 -0.954 -7.722 1.00 0.00 H new ATOM 0 HE2 LYS B 785 8.846 0.369 -7.140 1.00 0.00 H new ATOM 0 HE3 LYS B 785 9.768 1.855 -7.246 1.00 0.00 H new ATOM 0 HZ1 LYS B 785 8.723 1.319 -9.389 1.00 0.00 H new ATOM 0 HZ2 LYS B 785 10.414 1.260 -9.531 1.00 0.00 H new ATOM 0 HZ3 LYS B 785 9.521 -0.180 -9.429 1.00 0.00 H new ATOM 1401 N LYS B 786 9.906 -2.786 -6.766 1.00 0.00 N ATOM 1402 CA LYS B 786 8.738 -3.055 -7.665 1.00 0.00 C ATOM 1403 C LYS B 786 7.679 -3.910 -6.965 1.00 0.00 C ATOM 1404 O LYS B 786 6.505 -3.822 -7.257 1.00 0.00 O ATOM 1405 CB LYS B 786 9.334 -3.819 -8.849 1.00 0.00 C ATOM 1406 CG LYS B 786 8.779 -3.250 -10.156 1.00 0.00 C ATOM 1407 CD LYS B 786 7.354 -3.763 -10.372 1.00 0.00 C ATOM 1408 CE LYS B 786 7.339 -4.750 -11.541 1.00 0.00 C ATOM 1409 NZ LYS B 786 7.290 -3.895 -12.760 1.00 0.00 N ATOM 0 H LYS B 786 10.818 -2.859 -7.218 1.00 0.00 H new ATOM 0 HA LYS B 786 8.237 -2.134 -7.962 1.00 0.00 H new ATOM 0 HB2 LYS B 786 10.421 -3.738 -8.837 1.00 0.00 H new ATOM 0 HB3 LYS B 786 9.092 -4.879 -8.770 1.00 0.00 H new ATOM 0 HG2 LYS B 786 8.783 -2.161 -10.121 1.00 0.00 H new ATOM 0 HG3 LYS B 786 9.414 -3.545 -10.992 1.00 0.00 H new ATOM 0 HD2 LYS B 786 6.990 -4.249 -9.467 1.00 0.00 H new ATOM 0 HD3 LYS B 786 6.683 -2.929 -10.578 1.00 0.00 H new ATOM 0 HE2 LYS B 786 8.227 -5.382 -11.537 1.00 0.00 H new ATOM 0 HE3 LYS B 786 6.476 -5.413 -11.488 1.00 0.00 H new ATOM 0 HZ1 LYS B 786 7.277 -4.498 -13.607 1.00 0.00 H new ATOM 0 HZ2 LYS B 786 6.431 -3.309 -12.739 1.00 0.00 H new ATOM 0 HZ3 LYS B 786 8.128 -3.279 -12.786 1.00 0.00 H new ATOM 1423 N LEU B 787 8.089 -4.751 -6.059 1.00 0.00 N ATOM 1424 CA LEU B 787 7.105 -5.593 -5.325 1.00 0.00 C ATOM 1425 C LEU B 787 6.477 -4.808 -4.172 1.00 0.00 C ATOM 1426 O LEU B 787 5.275 -4.782 -4.009 1.00 0.00 O ATOM 1427 CB LEU B 787 7.919 -6.769 -4.794 1.00 0.00 C ATOM 1428 CG LEU B 787 8.208 -7.729 -5.945 1.00 0.00 C ATOM 1429 CD1 LEU B 787 9.343 -7.164 -6.800 1.00 0.00 C ATOM 1430 CD2 LEU B 787 8.613 -9.092 -5.387 1.00 0.00 C ATOM 0 H LEU B 787 9.064 -4.892 -5.794 1.00 0.00 H new ATOM 0 HA LEU B 787 6.283 -5.916 -5.963 1.00 0.00 H new ATOM 0 HB2 LEU B 787 8.852 -6.415 -4.355 1.00 0.00 H new ATOM 0 HB3 LEU B 787 7.370 -7.282 -4.004 1.00 0.00 H new ATOM 0 HG LEU B 787 7.314 -7.845 -6.557 1.00 0.00 H new ATOM 0 HD11 LEU B 787 9.553 -7.847 -7.623 1.00 0.00 H new ATOM 0 HD12 LEU B 787 9.049 -6.193 -7.199 1.00 0.00 H new ATOM 0 HD13 LEU B 787 10.237 -7.049 -6.188 1.00 0.00 H new ATOM 0 HD21 LEU B 787 8.819 -9.776 -6.211 1.00 0.00 H new ATOM 0 HD22 LEU B 787 9.507 -8.983 -4.774 1.00 0.00 H new ATOM 0 HD23 LEU B 787 7.802 -9.491 -4.778 1.00 0.00 H new ATOM 1442 N PHE B 788 7.285 -4.187 -3.357 1.00 0.00 N ATOM 1443 CA PHE B 788 6.737 -3.422 -2.205 1.00 0.00 C ATOM 1444 C PHE B 788 6.193 -2.077 -2.672 1.00 0.00 C ATOM 1445 O PHE B 788 5.041 -1.753 -2.463 1.00 0.00 O ATOM 1446 CB PHE B 788 7.934 -3.214 -1.280 1.00 0.00 C ATOM 1447 CG PHE B 788 7.468 -2.605 0.019 1.00 0.00 C ATOM 1448 CD1 PHE B 788 6.750 -3.379 0.938 1.00 0.00 C ATOM 1449 CD2 PHE B 788 7.755 -1.265 0.305 1.00 0.00 C ATOM 1450 CE1 PHE B 788 6.319 -2.814 2.143 1.00 0.00 C ATOM 1451 CE2 PHE B 788 7.327 -0.700 1.512 1.00 0.00 C ATOM 1452 CZ PHE B 788 6.606 -1.474 2.430 1.00 0.00 C ATOM 0 H PHE B 788 8.302 -4.177 -3.440 1.00 0.00 H new ATOM 0 HA PHE B 788 5.915 -3.943 -1.714 1.00 0.00 H new ATOM 0 HB2 PHE B 788 8.430 -4.166 -1.090 1.00 0.00 H new ATOM 0 HB3 PHE B 788 8.666 -2.563 -1.757 1.00 0.00 H new ATOM 0 HD1 PHE B 788 6.529 -4.413 0.717 1.00 0.00 H new ATOM 0 HD2 PHE B 788 8.307 -0.667 -0.406 1.00 0.00 H new ATOM 0 HE1 PHE B 788 5.765 -3.411 2.852 1.00 0.00 H new ATOM 0 HE2 PHE B 788 7.553 0.332 1.735 1.00 0.00 H new ATOM 0 HZ PHE B 788 6.271 -1.037 3.359 1.00 0.00 H new ATOM 1462 N MET B 789 7.015 -1.292 -3.310 1.00 0.00 N ATOM 1463 CA MET B 789 6.554 0.035 -3.798 1.00 0.00 C ATOM 1464 C MET B 789 5.255 -0.109 -4.591 1.00 0.00 C ATOM 1465 O MET B 789 4.330 0.653 -4.424 1.00 0.00 O ATOM 1466 CB MET B 789 7.683 0.522 -4.708 1.00 0.00 C ATOM 1467 CG MET B 789 8.437 1.648 -4.018 1.00 0.00 C ATOM 1468 SD MET B 789 7.354 3.086 -3.863 1.00 0.00 S ATOM 1469 CE MET B 789 7.214 3.054 -2.061 1.00 0.00 C ATOM 0 H MET B 789 7.989 -1.514 -3.515 1.00 0.00 H new ATOM 0 HA MET B 789 6.348 0.729 -2.983 1.00 0.00 H new ATOM 0 HB2 MET B 789 8.362 -0.300 -4.935 1.00 0.00 H new ATOM 0 HB3 MET B 789 7.276 0.870 -5.657 1.00 0.00 H new ATOM 0 HG2 MET B 789 8.774 1.325 -3.033 1.00 0.00 H new ATOM 0 HG3 MET B 789 9.327 1.909 -4.590 1.00 0.00 H new ATOM 0 HE1 MET B 789 7.086 4.070 -1.688 1.00 0.00 H new ATOM 0 HE2 MET B 789 6.353 2.451 -1.774 1.00 0.00 H new ATOM 0 HE3 MET B 789 8.119 2.622 -1.633 1.00 0.00 H new ATOM 1479 N ALA B 790 5.173 -1.100 -5.432 1.00 0.00 N ATOM 1480 CA ALA B 790 3.941 -1.292 -6.251 1.00 0.00 C ATOM 1481 C ALA B 790 2.689 -1.353 -5.373 1.00 0.00 C ATOM 1482 O ALA B 790 1.936 -0.403 -5.280 1.00 0.00 O ATOM 1483 CB ALA B 790 4.144 -2.636 -6.952 1.00 0.00 C ATOM 0 H ALA B 790 5.908 -1.789 -5.590 1.00 0.00 H new ATOM 0 HA ALA B 790 3.794 -0.465 -6.946 1.00 0.00 H new ATOM 0 HB1 ALA B 790 3.279 -2.854 -7.578 1.00 0.00 H new ATOM 0 HB2 ALA B 790 5.039 -2.591 -7.573 1.00 0.00 H new ATOM 0 HB3 ALA B 790 4.259 -3.422 -6.206 1.00 0.00 H new ATOM 1489 N ASP B 791 2.436 -2.482 -4.767 1.00 0.00 N ATOM 1490 CA ASP B 791 1.205 -2.638 -3.941 1.00 0.00 C ATOM 1491 C ASP B 791 1.020 -1.458 -2.987 1.00 0.00 C ATOM 1492 O ASP B 791 -0.089 -1.055 -2.697 1.00 0.00 O ATOM 1493 CB ASP B 791 1.427 -3.931 -3.153 1.00 0.00 C ATOM 1494 CG ASP B 791 1.152 -5.139 -4.054 1.00 0.00 C ATOM 1495 OD1 ASP B 791 1.025 -4.947 -5.253 1.00 0.00 O ATOM 1496 OD2 ASP B 791 1.075 -6.238 -3.530 1.00 0.00 O ATOM 0 H ASP B 791 3.033 -3.308 -4.809 1.00 0.00 H new ATOM 0 HA ASP B 791 0.308 -2.671 -4.559 1.00 0.00 H new ATOM 0 HB2 ASP B 791 2.450 -3.969 -2.779 1.00 0.00 H new ATOM 0 HB3 ASP B 791 0.769 -3.956 -2.284 1.00 0.00 H new ATOM 1501 N LEU B 792 2.089 -0.903 -2.489 1.00 0.00 N ATOM 1502 CA LEU B 792 1.950 0.248 -1.557 1.00 0.00 C ATOM 1503 C LEU B 792 1.480 1.484 -2.327 1.00 0.00 C ATOM 1504 O LEU B 792 0.574 2.179 -1.907 1.00 0.00 O ATOM 1505 CB LEU B 792 3.354 0.449 -0.970 1.00 0.00 C ATOM 1506 CG LEU B 792 3.270 1.047 0.444 1.00 0.00 C ATOM 1507 CD1 LEU B 792 2.327 0.222 1.325 1.00 0.00 C ATOM 1508 CD2 LEU B 792 4.663 1.039 1.074 1.00 0.00 C ATOM 0 H LEU B 792 3.046 -1.195 -2.686 1.00 0.00 H new ATOM 0 HA LEU B 792 1.214 0.075 -0.772 1.00 0.00 H new ATOM 0 HB2 LEU B 792 3.880 -0.505 -0.936 1.00 0.00 H new ATOM 0 HB3 LEU B 792 3.933 1.109 -1.616 1.00 0.00 H new ATOM 0 HG LEU B 792 2.888 2.065 0.370 1.00 0.00 H new ATOM 0 HD11 LEU B 792 2.282 0.662 2.321 1.00 0.00 H new ATOM 0 HD12 LEU B 792 1.330 0.217 0.885 1.00 0.00 H new ATOM 0 HD13 LEU B 792 2.698 -0.801 1.397 1.00 0.00 H new ATOM 0 HD21 LEU B 792 4.611 1.462 2.077 1.00 0.00 H new ATOM 0 HD22 LEU B 792 5.031 0.015 1.131 1.00 0.00 H new ATOM 0 HD23 LEU B 792 5.342 1.635 0.464 1.00 0.00 H new ATOM 1520 N GLN B 793 2.049 1.743 -3.474 1.00 0.00 N ATOM 1521 CA GLN B 793 1.560 2.890 -4.288 1.00 0.00 C ATOM 1522 C GLN B 793 0.116 2.615 -4.692 1.00 0.00 C ATOM 1523 O GLN B 793 -0.754 3.450 -4.550 1.00 0.00 O ATOM 1524 CB GLN B 793 2.459 2.933 -5.526 1.00 0.00 C ATOM 1525 CG GLN B 793 3.080 4.325 -5.658 1.00 0.00 C ATOM 1526 CD GLN B 793 1.970 5.370 -5.782 1.00 0.00 C ATOM 1527 OE1 GLN B 793 0.810 5.029 -5.903 1.00 0.00 O ATOM 1528 NE2 GLN B 793 2.278 6.637 -5.757 1.00 0.00 N ATOM 0 H GLN B 793 2.823 1.216 -3.878 1.00 0.00 H new ATOM 0 HA GLN B 793 1.592 3.836 -3.747 1.00 0.00 H new ATOM 0 HB2 GLN B 793 3.243 2.180 -5.446 1.00 0.00 H new ATOM 0 HB3 GLN B 793 1.879 2.696 -6.418 1.00 0.00 H new ATOM 0 HG2 GLN B 793 3.702 4.541 -4.789 1.00 0.00 H new ATOM 0 HG3 GLN B 793 3.729 4.364 -6.533 1.00 0.00 H new ATOM 0 HE21 GLN B 793 3.252 6.923 -5.655 1.00 0.00 H new ATOM 0 HE22 GLN B 793 1.545 7.342 -5.839 1.00 0.00 H new ATOM 1537 N ARG B 794 -0.146 1.419 -5.145 1.00 0.00 N ATOM 1538 CA ARG B 794 -1.534 1.038 -5.527 1.00 0.00 C ATOM 1539 C ARG B 794 -2.498 1.372 -4.389 1.00 0.00 C ATOM 1540 O ARG B 794 -3.581 1.876 -4.607 1.00 0.00 O ATOM 1541 CB ARG B 794 -1.461 -0.477 -5.745 1.00 0.00 C ATOM 1542 CG ARG B 794 -2.209 -0.874 -7.022 1.00 0.00 C ATOM 1543 CD ARG B 794 -1.620 -0.152 -8.240 1.00 0.00 C ATOM 1544 NE ARG B 794 -0.153 -0.430 -8.187 1.00 0.00 N ATOM 1545 CZ ARG B 794 0.696 0.296 -8.877 1.00 0.00 C ATOM 1546 NH1 ARG B 794 0.284 1.289 -9.627 1.00 0.00 N ATOM 1547 NH2 ARG B 794 1.972 0.028 -8.812 1.00 0.00 N ATOM 0 H ARG B 794 0.550 0.683 -5.268 1.00 0.00 H new ATOM 0 HA ARG B 794 -1.893 1.567 -6.410 1.00 0.00 H new ATOM 0 HB2 ARG B 794 -0.419 -0.790 -5.815 1.00 0.00 H new ATOM 0 HB3 ARG B 794 -1.893 -0.994 -4.888 1.00 0.00 H new ATOM 0 HG2 ARG B 794 -2.146 -1.953 -7.166 1.00 0.00 H new ATOM 0 HG3 ARG B 794 -3.266 -0.627 -6.922 1.00 0.00 H new ATOM 0 HD2 ARG B 794 -2.058 -0.522 -9.167 1.00 0.00 H new ATOM 0 HD3 ARG B 794 -1.820 0.919 -8.198 1.00 0.00 H new ATOM 0 HE ARG B 794 0.194 -1.194 -7.607 1.00 0.00 H new ATOM 0 HH11 ARG B 794 -0.711 1.508 -9.681 1.00 0.00 H new ATOM 0 HH12 ARG B 794 0.958 1.842 -10.156 1.00 0.00 H new ATOM 0 HH21 ARG B 794 2.303 -0.740 -8.228 1.00 0.00 H new ATOM 0 HH22 ARG B 794 2.638 0.587 -9.345 1.00 0.00 H new ATOM 1561 N VAL B 795 -2.105 1.113 -3.173 1.00 0.00 N ATOM 1562 CA VAL B 795 -2.979 1.462 -2.027 1.00 0.00 C ATOM 1563 C VAL B 795 -3.159 2.975 -1.981 1.00 0.00 C ATOM 1564 O VAL B 795 -4.225 3.471 -1.701 1.00 0.00 O ATOM 1565 CB VAL B 795 -2.240 0.970 -0.782 1.00 0.00 C ATOM 1566 CG1 VAL B 795 -3.024 1.385 0.467 1.00 0.00 C ATOM 1567 CG2 VAL B 795 -2.122 -0.557 -0.828 1.00 0.00 C ATOM 0 H VAL B 795 -1.217 0.675 -2.927 1.00 0.00 H new ATOM 0 HA VAL B 795 -3.968 1.011 -2.101 1.00 0.00 H new ATOM 0 HB VAL B 795 -1.243 1.409 -0.751 1.00 0.00 H new ATOM 0 HG11 VAL B 795 -2.501 1.036 1.357 1.00 0.00 H new ATOM 0 HG12 VAL B 795 -3.110 2.471 0.499 1.00 0.00 H new ATOM 0 HG13 VAL B 795 -4.020 0.943 0.435 1.00 0.00 H new ATOM 0 HG21 VAL B 795 -1.595 -0.908 0.059 1.00 0.00 H new ATOM 0 HG22 VAL B 795 -3.118 -0.998 -0.857 1.00 0.00 H new ATOM 0 HG23 VAL B 795 -1.568 -0.852 -1.719 1.00 0.00 H new ATOM 1577 N PHE B 796 -2.127 3.713 -2.290 1.00 0.00 N ATOM 1578 CA PHE B 796 -2.250 5.197 -2.288 1.00 0.00 C ATOM 1579 C PHE B 796 -3.000 5.666 -3.538 1.00 0.00 C ATOM 1580 O PHE B 796 -4.000 6.351 -3.451 1.00 0.00 O ATOM 1581 CB PHE B 796 -0.807 5.717 -2.296 1.00 0.00 C ATOM 1582 CG PHE B 796 -0.075 5.231 -1.061 1.00 0.00 C ATOM 1583 CD1 PHE B 796 -0.723 5.206 0.182 1.00 0.00 C ATOM 1584 CD2 PHE B 796 1.259 4.816 -1.160 1.00 0.00 C ATOM 1585 CE1 PHE B 796 -0.041 4.757 1.319 1.00 0.00 C ATOM 1586 CE2 PHE B 796 1.941 4.369 -0.022 1.00 0.00 C ATOM 1587 CZ PHE B 796 1.291 4.339 1.217 1.00 0.00 C ATOM 0 H PHE B 796 -1.207 3.353 -2.543 1.00 0.00 H new ATOM 0 HA PHE B 796 -2.808 5.565 -1.427 1.00 0.00 H new ATOM 0 HB2 PHE B 796 -0.292 5.373 -3.193 1.00 0.00 H new ATOM 0 HB3 PHE B 796 -0.804 6.807 -2.325 1.00 0.00 H new ATOM 0 HD1 PHE B 796 -1.749 5.533 0.262 1.00 0.00 H new ATOM 0 HD2 PHE B 796 1.762 4.841 -2.115 1.00 0.00 H new ATOM 0 HE1 PHE B 796 -0.543 4.733 2.275 1.00 0.00 H new ATOM 0 HE2 PHE B 796 2.969 4.047 -0.100 1.00 0.00 H new ATOM 0 HZ PHE B 796 1.817 3.993 2.095 1.00 0.00 H new ATOM 1597 N THR B 797 -2.541 5.287 -4.702 1.00 0.00 N ATOM 1598 CA THR B 797 -3.244 5.708 -5.950 1.00 0.00 C ATOM 1599 C THR B 797 -4.711 5.288 -5.901 1.00 0.00 C ATOM 1600 O THR B 797 -5.602 6.114 -5.905 1.00 0.00 O ATOM 1601 CB THR B 797 -2.530 4.981 -7.094 1.00 0.00 C ATOM 1602 OG1 THR B 797 -1.954 3.774 -6.616 1.00 0.00 O ATOM 1603 CG2 THR B 797 -1.435 5.882 -7.665 1.00 0.00 C ATOM 0 H THR B 797 -1.714 4.707 -4.842 1.00 0.00 H new ATOM 0 HA THR B 797 -3.219 6.790 -6.077 1.00 0.00 H new ATOM 0 HB THR B 797 -3.252 4.745 -7.876 1.00 0.00 H new ATOM 0 HG1 THR B 797 -1.064 3.959 -6.250 1.00 0.00 H new ATOM 0 HG21 THR B 797 -0.926 5.365 -8.479 1.00 0.00 H new ATOM 0 HG22 THR B 797 -1.881 6.802 -8.042 1.00 0.00 H new ATOM 0 HG23 THR B 797 -0.716 6.121 -6.882 1.00 0.00 H new ATOM 1611 N ASN B 798 -4.975 4.008 -5.855 1.00 0.00 N ATOM 1612 CA ASN B 798 -6.392 3.543 -5.831 1.00 0.00 C ATOM 1613 C ASN B 798 -7.190 4.298 -4.751 1.00 0.00 C ATOM 1614 O ASN B 798 -8.259 4.815 -5.009 1.00 0.00 O ATOM 1615 CB ASN B 798 -6.305 2.018 -5.574 1.00 0.00 C ATOM 1616 CG ASN B 798 -6.507 1.661 -4.092 1.00 0.00 C ATOM 1617 OD1 ASN B 798 -5.603 1.183 -3.444 1.00 0.00 O ATOM 1618 ND2 ASN B 798 -7.673 1.855 -3.538 1.00 0.00 N ATOM 0 H ASN B 798 -4.273 3.268 -5.833 1.00 0.00 H new ATOM 0 HA ASN B 798 -6.925 3.743 -6.760 1.00 0.00 H new ATOM 0 HB2 ASN B 798 -7.059 1.508 -6.174 1.00 0.00 H new ATOM 0 HB3 ASN B 798 -5.333 1.652 -5.904 1.00 0.00 H new ATOM 0 HD21 ASN B 798 -7.821 1.604 -2.561 1.00 0.00 H new ATOM 0 HD22 ASN B 798 -8.436 2.258 -4.083 1.00 0.00 H new ATOM 1625 N CYS B 799 -6.675 4.380 -3.551 1.00 0.00 N ATOM 1626 CA CYS B 799 -7.419 5.118 -2.484 1.00 0.00 C ATOM 1627 C CYS B 799 -7.466 6.610 -2.811 1.00 0.00 C ATOM 1628 O CYS B 799 -8.414 7.297 -2.486 1.00 0.00 O ATOM 1629 CB CYS B 799 -6.642 4.871 -1.193 1.00 0.00 C ATOM 1630 SG CYS B 799 -6.855 3.143 -0.693 1.00 0.00 S ATOM 0 H CYS B 799 -5.784 3.974 -3.265 1.00 0.00 H new ATOM 0 HA CYS B 799 -8.451 4.778 -2.397 1.00 0.00 H new ATOM 0 HB2 CYS B 799 -5.585 5.091 -1.342 1.00 0.00 H new ATOM 0 HB3 CYS B 799 -6.998 5.536 -0.407 1.00 0.00 H new ATOM 0 HG CYS B 799 -6.185 2.921 0.399 1.00 0.00 H new ATOM 1636 N LYS B 800 -6.459 7.117 -3.464 1.00 0.00 N ATOM 1637 CA LYS B 800 -6.470 8.559 -3.834 1.00 0.00 C ATOM 1638 C LYS B 800 -7.377 8.788 -5.049 1.00 0.00 C ATOM 1639 O LYS B 800 -7.720 9.907 -5.377 1.00 0.00 O ATOM 1640 CB LYS B 800 -5.015 8.887 -4.176 1.00 0.00 C ATOM 1641 CG LYS B 800 -4.236 9.147 -2.883 1.00 0.00 C ATOM 1642 CD LYS B 800 -3.496 10.482 -2.989 1.00 0.00 C ATOM 1643 CE LYS B 800 -2.004 10.221 -3.207 1.00 0.00 C ATOM 1644 NZ LYS B 800 -1.695 10.852 -4.520 1.00 0.00 N ATOM 0 H LYS B 800 -5.631 6.598 -3.757 1.00 0.00 H new ATOM 0 HA LYS B 800 -6.853 9.191 -3.033 1.00 0.00 H new ATOM 0 HB2 LYS B 800 -4.564 8.061 -4.726 1.00 0.00 H new ATOM 0 HB3 LYS B 800 -4.970 9.763 -4.823 1.00 0.00 H new ATOM 0 HG2 LYS B 800 -4.918 9.164 -2.033 1.00 0.00 H new ATOM 0 HG3 LYS B 800 -3.526 8.339 -2.706 1.00 0.00 H new ATOM 0 HD2 LYS B 800 -3.898 11.069 -3.815 1.00 0.00 H new ATOM 0 HD3 LYS B 800 -3.645 11.066 -2.081 1.00 0.00 H new ATOM 0 HE2 LYS B 800 -1.405 10.658 -2.408 1.00 0.00 H new ATOM 0 HE3 LYS B 800 -1.787 9.153 -3.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 800 -0.688 10.716 -4.742 1.00 0.00 H new ATOM 0 HZ2 LYS B 800 -2.276 10.412 -5.262 1.00 0.00 H new ATOM 0 HZ3 LYS B 800 -1.905 11.869 -4.474 1.00 0.00 H new ATOM 1658 N GLU B 801 -7.783 7.734 -5.712 1.00 0.00 N ATOM 1659 CA GLU B 801 -8.675 7.889 -6.895 1.00 0.00 C ATOM 1660 C GLU B 801 -10.150 7.776 -6.487 1.00 0.00 C ATOM 1661 O GLU B 801 -11.037 7.894 -7.308 1.00 0.00 O ATOM 1662 CB GLU B 801 -8.291 6.729 -7.816 1.00 0.00 C ATOM 1663 CG GLU B 801 -7.752 7.280 -9.137 1.00 0.00 C ATOM 1664 CD GLU B 801 -7.165 6.136 -9.965 1.00 0.00 C ATOM 1665 OE1 GLU B 801 -6.332 5.416 -9.439 1.00 0.00 O ATOM 1666 OE2 GLU B 801 -7.560 5.998 -11.111 1.00 0.00 O ATOM 0 H GLU B 801 -7.533 6.772 -5.482 1.00 0.00 H new ATOM 0 HA GLU B 801 -8.559 8.862 -7.372 1.00 0.00 H new ATOM 0 HB2 GLU B 801 -7.537 6.105 -7.336 1.00 0.00 H new ATOM 0 HB3 GLU B 801 -9.159 6.096 -8.001 1.00 0.00 H new ATOM 0 HG2 GLU B 801 -8.551 7.771 -9.692 1.00 0.00 H new ATOM 0 HG3 GLU B 801 -6.988 8.033 -8.944 1.00 0.00 H new ATOM 1673 N TYR B 802 -10.424 7.543 -5.229 1.00 0.00 N ATOM 1674 CA TYR B 802 -11.842 7.419 -4.786 1.00 0.00 C ATOM 1675 C TYR B 802 -12.060 8.228 -3.498 1.00 0.00 C ATOM 1676 O TYR B 802 -12.930 9.073 -3.429 1.00 0.00 O ATOM 1677 CB TYR B 802 -12.037 5.906 -4.542 1.00 0.00 C ATOM 1678 CG TYR B 802 -13.189 5.663 -3.587 1.00 0.00 C ATOM 1679 CD1 TYR B 802 -14.421 6.284 -3.810 1.00 0.00 C ATOM 1680 CD2 TYR B 802 -12.997 4.879 -2.443 1.00 0.00 C ATOM 1681 CE1 TYR B 802 -15.479 6.083 -2.916 1.00 0.00 C ATOM 1682 CE2 TYR B 802 -14.054 4.678 -1.547 1.00 0.00 C ATOM 1683 CZ TYR B 802 -15.295 5.283 -1.782 1.00 0.00 C ATOM 1684 OH TYR B 802 -16.336 5.088 -0.898 1.00 0.00 O ATOM 0 H TYR B 802 -9.727 7.434 -4.492 1.00 0.00 H new ATOM 0 HA TYR B 802 -12.555 7.805 -5.515 1.00 0.00 H new ATOM 0 HB2 TYR B 802 -12.230 5.402 -5.489 1.00 0.00 H new ATOM 0 HB3 TYR B 802 -11.122 5.477 -4.133 1.00 0.00 H new ATOM 0 HD1 TYR B 802 -14.557 6.919 -4.673 1.00 0.00 H new ATOM 0 HD2 TYR B 802 -12.034 4.429 -2.252 1.00 0.00 H new ATOM 0 HE1 TYR B 802 -16.437 6.545 -3.101 1.00 0.00 H new ATOM 0 HE2 TYR B 802 -13.912 4.057 -0.675 1.00 0.00 H new ATOM 0 HH TYR B 802 -16.040 4.506 -0.167 1.00 0.00 H new ATOM 1694 N ASN B 803 -11.299 7.924 -2.475 1.00 0.00 N ATOM 1695 CA ASN B 803 -11.455 8.608 -1.148 1.00 0.00 C ATOM 1696 C ASN B 803 -11.812 10.095 -1.294 1.00 0.00 C ATOM 1697 O ASN B 803 -11.517 10.707 -2.301 1.00 0.00 O ATOM 1698 CB ASN B 803 -10.086 8.461 -0.481 1.00 0.00 C ATOM 1699 CG ASN B 803 -9.799 6.980 -0.225 1.00 0.00 C ATOM 1700 OD1 ASN B 803 -10.434 6.118 -0.800 1.00 0.00 O ATOM 1701 ND2 ASN B 803 -8.857 6.646 0.614 1.00 0.00 N ATOM 0 H ASN B 803 -10.563 7.219 -2.502 1.00 0.00 H new ATOM 0 HA ASN B 803 -12.268 8.166 -0.572 1.00 0.00 H new ATOM 0 HB2 ASN B 803 -9.311 8.887 -1.118 1.00 0.00 H new ATOM 0 HB3 ASN B 803 -10.066 9.014 0.458 1.00 0.00 H new ATOM 0 HD21 ASN B 803 -8.654 5.662 0.787 1.00 0.00 H new ATOM 0 HD22 ASN B 803 -8.324 7.369 1.097 1.00 0.00 H new ATOM 1708 N PRO B 804 -12.464 10.621 -0.282 1.00 0.00 N ATOM 1709 CA PRO B 804 -12.880 12.044 -0.300 1.00 0.00 C ATOM 1710 C PRO B 804 -11.714 12.954 -0.696 1.00 0.00 C ATOM 1711 O PRO B 804 -10.572 12.643 -0.428 1.00 0.00 O ATOM 1712 CB PRO B 804 -13.301 12.312 1.142 1.00 0.00 C ATOM 1713 CG PRO B 804 -13.682 10.977 1.694 1.00 0.00 C ATOM 1714 CD PRO B 804 -12.860 9.948 0.966 1.00 0.00 C ATOM 0 HA PRO B 804 -13.672 12.240 -1.022 1.00 0.00 H new ATOM 0 HB2 PRO B 804 -12.486 12.756 1.714 1.00 0.00 H new ATOM 0 HB3 PRO B 804 -14.138 13.009 1.185 1.00 0.00 H new ATOM 0 HG2 PRO B 804 -13.491 10.935 2.766 1.00 0.00 H new ATOM 0 HG3 PRO B 804 -14.747 10.791 1.552 1.00 0.00 H new ATOM 0 HD2 PRO B 804 -11.990 9.647 1.550 1.00 0.00 H new ATOM 0 HD3 PRO B 804 -13.437 9.045 0.766 1.00 0.00 H new ATOM 1722 N PRO B 805 -12.037 14.059 -1.322 1.00 0.00 N ATOM 1723 CA PRO B 805 -10.989 15.023 -1.734 1.00 0.00 C ATOM 1724 C PRO B 805 -10.291 15.596 -0.501 1.00 0.00 C ATOM 1725 O PRO B 805 -10.604 16.678 -0.045 1.00 0.00 O ATOM 1726 CB PRO B 805 -11.760 16.119 -2.474 1.00 0.00 C ATOM 1727 CG PRO B 805 -13.183 15.971 -2.034 1.00 0.00 C ATOM 1728 CD PRO B 805 -13.386 14.524 -1.676 1.00 0.00 C ATOM 0 HA PRO B 805 -10.214 14.570 -2.352 1.00 0.00 H new ATOM 0 HB2 PRO B 805 -11.373 17.107 -2.226 1.00 0.00 H new ATOM 0 HB3 PRO B 805 -11.669 16.003 -3.554 1.00 0.00 H new ATOM 0 HG2 PRO B 805 -13.390 16.613 -1.178 1.00 0.00 H new ATOM 0 HG3 PRO B 805 -13.865 16.271 -2.829 1.00 0.00 H new ATOM 0 HD2 PRO B 805 -14.080 14.411 -0.843 1.00 0.00 H new ATOM 0 HD3 PRO B 805 -13.798 13.959 -2.512 1.00 0.00 H new ATOM 1736 N GLU B 806 -9.353 14.874 0.050 1.00 0.00 N ATOM 1737 CA GLU B 806 -8.648 15.366 1.266 1.00 0.00 C ATOM 1738 C GLU B 806 -9.662 15.704 2.360 1.00 0.00 C ATOM 1739 O GLU B 806 -9.647 16.781 2.923 1.00 0.00 O ATOM 1740 CB GLU B 806 -7.908 16.629 0.817 1.00 0.00 C ATOM 1741 CG GLU B 806 -6.785 16.940 1.809 1.00 0.00 C ATOM 1742 CD GLU B 806 -6.492 18.441 1.794 1.00 0.00 C ATOM 1743 OE1 GLU B 806 -7.431 19.209 1.926 1.00 0.00 O ATOM 1744 OE2 GLU B 806 -5.334 18.797 1.651 1.00 0.00 O ATOM 0 H GLU B 806 -9.045 13.963 -0.291 1.00 0.00 H new ATOM 0 HA GLU B 806 -7.967 14.620 1.677 1.00 0.00 H new ATOM 0 HB2 GLU B 806 -7.496 16.487 -0.182 1.00 0.00 H new ATOM 0 HB3 GLU B 806 -8.601 17.469 0.760 1.00 0.00 H new ATOM 0 HG2 GLU B 806 -7.074 16.625 2.812 1.00 0.00 H new ATOM 0 HG3 GLU B 806 -5.887 16.381 1.545 1.00 0.00 H new ATOM 1751 N SER B 807 -10.548 14.793 2.662 1.00 0.00 N ATOM 1752 CA SER B 807 -11.564 15.067 3.716 1.00 0.00 C ATOM 1753 C SER B 807 -11.281 14.230 4.962 1.00 0.00 C ATOM 1754 O SER B 807 -11.291 14.728 6.070 1.00 0.00 O ATOM 1755 CB SER B 807 -12.901 14.664 3.093 1.00 0.00 C ATOM 1756 OG SER B 807 -13.936 15.472 3.633 1.00 0.00 O ATOM 0 H SER B 807 -10.611 13.874 2.225 1.00 0.00 H new ATOM 0 HA SER B 807 -11.557 16.111 4.030 1.00 0.00 H new ATOM 0 HB2 SER B 807 -12.860 14.782 2.010 1.00 0.00 H new ATOM 0 HB3 SER B 807 -13.105 13.612 3.292 1.00 0.00 H new ATOM 0 HG SER B 807 -14.793 15.216 3.233 1.00 0.00 H new ATOM 1762 N GLU B 808 -11.024 12.966 4.792 1.00 0.00 N ATOM 1763 CA GLU B 808 -10.742 12.105 5.973 1.00 0.00 C ATOM 1764 C GLU B 808 -9.993 10.845 5.546 1.00 0.00 C ATOM 1765 O GLU B 808 -9.009 10.459 6.147 1.00 0.00 O ATOM 1766 CB GLU B 808 -12.119 11.743 6.527 1.00 0.00 C ATOM 1767 CG GLU B 808 -12.203 12.170 7.993 1.00 0.00 C ATOM 1768 CD GLU B 808 -11.826 10.989 8.890 1.00 0.00 C ATOM 1769 OE1 GLU B 808 -12.032 9.862 8.471 1.00 0.00 O ATOM 1770 OE2 GLU B 808 -11.338 11.233 9.982 1.00 0.00 O ATOM 0 H GLU B 808 -10.997 12.492 3.889 1.00 0.00 H new ATOM 0 HA GLU B 808 -10.118 12.608 6.712 1.00 0.00 H new ATOM 0 HB2 GLU B 808 -12.898 12.238 5.947 1.00 0.00 H new ATOM 0 HB3 GLU B 808 -12.288 10.670 6.439 1.00 0.00 H new ATOM 0 HG2 GLU B 808 -11.532 13.009 8.178 1.00 0.00 H new ATOM 0 HG3 GLU B 808 -13.212 12.511 8.227 1.00 0.00 H new ATOM 1777 N TYR B 809 -10.476 10.178 4.538 1.00 0.00 N ATOM 1778 CA TYR B 809 -9.797 8.933 4.076 1.00 0.00 C ATOM 1779 C TYR B 809 -8.608 9.267 3.171 1.00 0.00 C ATOM 1780 O TYR B 809 -7.549 8.681 3.281 1.00 0.00 O ATOM 1781 CB TYR B 809 -10.869 8.165 3.301 1.00 0.00 C ATOM 1782 CG TYR B 809 -11.199 6.888 4.037 1.00 0.00 C ATOM 1783 CD1 TYR B 809 -11.788 6.946 5.306 1.00 0.00 C ATOM 1784 CD2 TYR B 809 -10.911 5.648 3.455 1.00 0.00 C ATOM 1785 CE1 TYR B 809 -12.092 5.763 5.991 1.00 0.00 C ATOM 1786 CE2 TYR B 809 -11.215 4.466 4.140 1.00 0.00 C ATOM 1787 CZ TYR B 809 -11.806 4.523 5.408 1.00 0.00 C ATOM 1788 OH TYR B 809 -12.104 3.358 6.084 1.00 0.00 O ATOM 0 H TYR B 809 -11.311 10.439 4.013 1.00 0.00 H new ATOM 0 HA TYR B 809 -9.397 8.352 4.907 1.00 0.00 H new ATOM 0 HB2 TYR B 809 -11.764 8.777 3.192 1.00 0.00 H new ATOM 0 HB3 TYR B 809 -10.514 7.938 2.296 1.00 0.00 H new ATOM 0 HD1 TYR B 809 -12.008 7.903 5.756 1.00 0.00 H new ATOM 0 HD2 TYR B 809 -10.454 5.603 2.477 1.00 0.00 H new ATOM 0 HE1 TYR B 809 -12.547 5.807 6.969 1.00 0.00 H new ATOM 0 HE2 TYR B 809 -10.994 3.509 3.690 1.00 0.00 H new ATOM 0 HH TYR B 809 -11.843 2.587 5.538 1.00 0.00 H new ATOM 1798 N TYR B 810 -8.774 10.200 2.273 1.00 0.00 N ATOM 1799 CA TYR B 810 -7.656 10.562 1.355 1.00 0.00 C ATOM 1800 C TYR B 810 -6.500 11.190 2.138 1.00 0.00 C ATOM 1801 O TYR B 810 -5.344 10.975 1.834 1.00 0.00 O ATOM 1802 CB TYR B 810 -8.261 11.581 0.387 1.00 0.00 C ATOM 1803 CG TYR B 810 -7.191 12.105 -0.543 1.00 0.00 C ATOM 1804 CD1 TYR B 810 -6.295 13.085 -0.096 1.00 0.00 C ATOM 1805 CD2 TYR B 810 -7.100 11.620 -1.853 1.00 0.00 C ATOM 1806 CE1 TYR B 810 -5.306 13.575 -0.957 1.00 0.00 C ATOM 1807 CE2 TYR B 810 -6.111 12.111 -2.715 1.00 0.00 C ATOM 1808 CZ TYR B 810 -5.214 13.088 -2.267 1.00 0.00 C ATOM 1809 OH TYR B 810 -4.239 13.571 -3.115 1.00 0.00 O ATOM 0 H TYR B 810 -9.636 10.728 2.135 1.00 0.00 H new ATOM 0 HA TYR B 810 -7.249 9.692 0.839 1.00 0.00 H new ATOM 0 HB2 TYR B 810 -9.061 11.117 -0.190 1.00 0.00 H new ATOM 0 HB3 TYR B 810 -8.706 12.405 0.944 1.00 0.00 H new ATOM 0 HD1 TYR B 810 -6.367 13.463 0.913 1.00 0.00 H new ATOM 0 HD2 TYR B 810 -7.793 10.867 -2.199 1.00 0.00 H new ATOM 0 HE1 TYR B 810 -4.614 14.329 -0.611 1.00 0.00 H new ATOM 0 HE2 TYR B 810 -6.040 11.736 -3.725 1.00 0.00 H new ATOM 0 HH TYR B 810 -3.454 13.838 -2.593 1.00 0.00 H new ATOM 1819 N LYS B 811 -6.802 11.966 3.142 1.00 0.00 N ATOM 1820 CA LYS B 811 -5.718 12.608 3.939 1.00 0.00 C ATOM 1821 C LYS B 811 -4.729 11.553 4.440 1.00 0.00 C ATOM 1822 O LYS B 811 -3.592 11.851 4.748 1.00 0.00 O ATOM 1823 CB LYS B 811 -6.437 13.270 5.114 1.00 0.00 C ATOM 1824 CG LYS B 811 -7.261 14.454 4.603 1.00 0.00 C ATOM 1825 CD LYS B 811 -8.450 14.691 5.534 1.00 0.00 C ATOM 1826 CE LYS B 811 -7.946 15.199 6.886 1.00 0.00 C ATOM 1827 NZ LYS B 811 -7.957 16.683 6.763 1.00 0.00 N ATOM 0 H LYS B 811 -7.751 12.183 3.445 1.00 0.00 H new ATOM 0 HA LYS B 811 -5.143 13.325 3.353 1.00 0.00 H new ATOM 0 HB2 LYS B 811 -7.086 12.549 5.611 1.00 0.00 H new ATOM 0 HB3 LYS B 811 -5.712 13.609 5.854 1.00 0.00 H new ATOM 0 HG2 LYS B 811 -6.640 15.348 4.555 1.00 0.00 H new ATOM 0 HG3 LYS B 811 -7.613 14.255 3.591 1.00 0.00 H new ATOM 0 HD2 LYS B 811 -9.132 15.417 5.092 1.00 0.00 H new ATOM 0 HD3 LYS B 811 -9.011 13.766 5.667 1.00 0.00 H new ATOM 0 HE2 LYS B 811 -8.590 14.865 7.699 1.00 0.00 H new ATOM 0 HE3 LYS B 811 -6.944 14.827 7.100 1.00 0.00 H new ATOM 0 HZ1 LYS B 811 -7.624 17.108 7.652 1.00 0.00 H new ATOM 0 HZ2 LYS B 811 -7.330 16.972 5.985 1.00 0.00 H new ATOM 0 HZ3 LYS B 811 -8.925 17.008 6.566 1.00 0.00 H new ATOM 1841 N CYS B 812 -5.150 10.321 4.519 1.00 0.00 N ATOM 1842 CA CYS B 812 -4.233 9.248 4.995 1.00 0.00 C ATOM 1843 C CYS B 812 -3.112 9.015 3.988 1.00 0.00 C ATOM 1844 O CYS B 812 -1.946 9.047 4.327 1.00 0.00 O ATOM 1845 CB CYS B 812 -5.101 8.000 5.083 1.00 0.00 C ATOM 1846 SG CYS B 812 -6.191 8.114 6.524 1.00 0.00 S ATOM 0 H CYS B 812 -6.090 10.011 4.274 1.00 0.00 H new ATOM 0 HA CYS B 812 -3.768 9.508 5.946 1.00 0.00 H new ATOM 0 HB2 CYS B 812 -5.694 7.893 4.174 1.00 0.00 H new ATOM 0 HB3 CYS B 812 -4.472 7.113 5.160 1.00 0.00 H new ATOM 0 HG CYS B 812 -5.881 7.184 7.378 1.00 0.00 H new ATOM 1852 N ALA B 813 -3.455 8.754 2.750 1.00 0.00 N ATOM 1853 CA ALA B 813 -2.406 8.506 1.720 1.00 0.00 C ATOM 1854 C ALA B 813 -1.338 9.594 1.789 1.00 0.00 C ATOM 1855 O ALA B 813 -0.160 9.315 1.793 1.00 0.00 O ATOM 1856 CB ALA B 813 -3.135 8.565 0.376 1.00 0.00 C ATOM 0 H ALA B 813 -4.416 8.703 2.411 1.00 0.00 H new ATOM 0 HA ALA B 813 -1.905 7.549 1.868 1.00 0.00 H new ATOM 0 HB1 ALA B 813 -2.424 8.391 -0.432 1.00 0.00 H new ATOM 0 HB2 ALA B 813 -3.910 7.799 0.349 1.00 0.00 H new ATOM 0 HB3 ALA B 813 -3.591 9.547 0.252 1.00 0.00 H new ATOM 1862 N ASN B 814 -1.745 10.828 1.897 1.00 0.00 N ATOM 1863 CA ASN B 814 -0.752 11.930 2.004 1.00 0.00 C ATOM 1864 C ASN B 814 0.167 11.686 3.203 1.00 0.00 C ATOM 1865 O ASN B 814 1.360 11.508 3.057 1.00 0.00 O ATOM 1866 CB ASN B 814 -1.586 13.196 2.220 1.00 0.00 C ATOM 1867 CG ASN B 814 -1.322 14.183 1.081 1.00 0.00 C ATOM 1868 OD1 ASN B 814 -0.330 14.076 0.387 1.00 0.00 O ATOM 1869 ND2 ASN B 814 -2.174 15.145 0.857 1.00 0.00 N ATOM 0 H ASN B 814 -2.722 11.120 1.916 1.00 0.00 H new ATOM 0 HA ASN B 814 -0.118 12.006 1.121 1.00 0.00 H new ATOM 0 HB2 ASN B 814 -2.646 12.944 2.258 1.00 0.00 H new ATOM 0 HB3 ASN B 814 -1.332 13.652 3.177 1.00 0.00 H new ATOM 0 HD21 ASN B 814 -2.008 15.807 0.099 1.00 0.00 H new ATOM 0 HD22 ASN B 814 -3.007 15.235 1.439 1.00 0.00 H new ATOM 1876 N ILE B 815 -0.384 11.653 4.386 1.00 0.00 N ATOM 1877 CA ILE B 815 0.454 11.416 5.597 1.00 0.00 C ATOM 1878 C ILE B 815 1.312 10.162 5.415 1.00 0.00 C ATOM 1879 O ILE B 815 2.524 10.234 5.377 1.00 0.00 O ATOM 1880 CB ILE B 815 -0.550 11.224 6.740 1.00 0.00 C ATOM 1881 CG1 ILE B 815 -1.310 12.532 6.975 1.00 0.00 C ATOM 1882 CG2 ILE B 815 0.192 10.833 8.020 1.00 0.00 C ATOM 1883 CD1 ILE B 815 -2.420 12.300 8.002 1.00 0.00 C ATOM 0 H ILE B 815 -1.380 11.780 4.567 1.00 0.00 H new ATOM 0 HA ILE B 815 1.141 12.239 5.791 1.00 0.00 H new ATOM 0 HB ILE B 815 -1.252 10.434 6.473 1.00 0.00 H new ATOM 0 HG12 ILE B 815 -0.627 13.303 7.330 1.00 0.00 H new ATOM 0 HG13 ILE B 815 -1.736 12.891 6.038 1.00 0.00 H new ATOM 0 HG21 ILE B 815 -0.525 10.698 8.829 1.00 0.00 H new ATOM 0 HG22 ILE B 815 0.734 9.902 7.856 1.00 0.00 H new ATOM 0 HG23 ILE B 815 0.896 11.621 8.287 1.00 0.00 H new ATOM 0 HD11 ILE B 815 -2.961 13.231 8.169 1.00 0.00 H new ATOM 0 HD12 ILE B 815 -3.109 11.542 7.628 1.00 0.00 H new ATOM 0 HD13 ILE B 815 -1.982 11.961 8.941 1.00 0.00 H new ATOM 1895 N LEU B 816 0.703 9.012 5.289 1.00 0.00 N ATOM 1896 CA LEU B 816 1.507 7.771 5.106 1.00 0.00 C ATOM 1897 C LEU B 816 2.532 7.944 3.984 1.00 0.00 C ATOM 1898 O LEU B 816 3.715 7.746 4.174 1.00 0.00 O ATOM 1899 CB LEU B 816 0.487 6.712 4.713 1.00 0.00 C ATOM 1900 CG LEU B 816 0.303 5.726 5.861 1.00 0.00 C ATOM 1901 CD1 LEU B 816 -0.712 4.680 5.434 1.00 0.00 C ATOM 1902 CD2 LEU B 816 1.630 5.038 6.175 1.00 0.00 C ATOM 0 H LEU B 816 -0.308 8.880 5.305 1.00 0.00 H new ATOM 0 HA LEU B 816 2.066 7.512 6.005 1.00 0.00 H new ATOM 0 HB2 LEU B 816 -0.465 7.183 4.469 1.00 0.00 H new ATOM 0 HB3 LEU B 816 0.821 6.186 3.819 1.00 0.00 H new ATOM 0 HG LEU B 816 -0.042 6.254 6.750 1.00 0.00 H new ATOM 0 HD11 LEU B 816 -0.858 3.964 6.242 1.00 0.00 H new ATOM 0 HD12 LEU B 816 -1.660 5.166 5.204 1.00 0.00 H new ATOM 0 HD13 LEU B 816 -0.347 4.159 4.549 1.00 0.00 H new ATOM 0 HD21 LEU B 816 1.490 4.335 6.996 1.00 0.00 H new ATOM 0 HD22 LEU B 816 1.979 4.501 5.293 1.00 0.00 H new ATOM 0 HD23 LEU B 816 2.369 5.786 6.460 1.00 0.00 H new ATOM 1914 N GLU B 817 2.085 8.304 2.810 1.00 0.00 N ATOM 1915 CA GLU B 817 3.032 8.472 1.669 1.00 0.00 C ATOM 1916 C GLU B 817 4.214 9.355 2.082 1.00 0.00 C ATOM 1917 O GLU B 817 5.299 9.244 1.548 1.00 0.00 O ATOM 1918 CB GLU B 817 2.205 9.146 0.560 1.00 0.00 C ATOM 1919 CG GLU B 817 3.122 9.603 -0.582 1.00 0.00 C ATOM 1920 CD GLU B 817 3.648 8.380 -1.335 1.00 0.00 C ATOM 1921 OE1 GLU B 817 3.008 7.343 -1.262 1.00 0.00 O ATOM 1922 OE2 GLU B 817 4.683 8.499 -1.970 1.00 0.00 O ATOM 0 H GLU B 817 1.106 8.489 2.592 1.00 0.00 H new ATOM 0 HA GLU B 817 3.454 7.523 1.339 1.00 0.00 H new ATOM 0 HB2 GLU B 817 1.458 8.450 0.179 1.00 0.00 H new ATOM 0 HB3 GLU B 817 1.666 10.001 0.967 1.00 0.00 H new ATOM 0 HG2 GLU B 817 2.575 10.255 -1.263 1.00 0.00 H new ATOM 0 HG3 GLU B 817 3.954 10.184 -0.184 1.00 0.00 H new ATOM 1929 N LYS B 818 4.010 10.241 3.011 1.00 0.00 N ATOM 1930 CA LYS B 818 5.119 11.135 3.433 1.00 0.00 C ATOM 1931 C LYS B 818 6.054 10.418 4.409 1.00 0.00 C ATOM 1932 O LYS B 818 7.261 10.459 4.271 1.00 0.00 O ATOM 1933 CB LYS B 818 4.427 12.307 4.125 1.00 0.00 C ATOM 1934 CG LYS B 818 3.551 13.043 3.113 1.00 0.00 C ATOM 1935 CD LYS B 818 4.213 14.365 2.732 1.00 0.00 C ATOM 1936 CE LYS B 818 3.823 14.737 1.300 1.00 0.00 C ATOM 1937 NZ LYS B 818 4.862 15.709 0.861 1.00 0.00 N ATOM 0 H LYS B 818 3.125 10.385 3.496 1.00 0.00 H new ATOM 0 HA LYS B 818 5.734 11.451 2.590 1.00 0.00 H new ATOM 0 HB2 LYS B 818 3.820 11.947 4.956 1.00 0.00 H new ATOM 0 HB3 LYS B 818 5.169 12.987 4.544 1.00 0.00 H new ATOM 0 HG2 LYS B 818 3.407 12.427 2.225 1.00 0.00 H new ATOM 0 HG3 LYS B 818 2.564 13.227 3.537 1.00 0.00 H new ATOM 0 HD2 LYS B 818 3.903 15.151 3.421 1.00 0.00 H new ATOM 0 HD3 LYS B 818 5.296 14.278 2.814 1.00 0.00 H new ATOM 0 HE2 LYS B 818 3.805 13.859 0.654 1.00 0.00 H new ATOM 0 HE3 LYS B 818 2.827 15.179 1.264 1.00 0.00 H new ATOM 0 HZ1 LYS B 818 4.664 16.012 -0.114 1.00 0.00 H new ATOM 0 HZ2 LYS B 818 4.851 16.537 1.490 1.00 0.00 H new ATOM 0 HZ3 LYS B 818 5.798 15.258 0.900 1.00 0.00 H new ATOM 1951 N PHE B 819 5.507 9.772 5.402 1.00 0.00 N ATOM 1952 CA PHE B 819 6.362 9.073 6.401 1.00 0.00 C ATOM 1953 C PHE B 819 7.034 7.846 5.782 1.00 0.00 C ATOM 1954 O PHE B 819 8.233 7.673 5.873 1.00 0.00 O ATOM 1955 CB PHE B 819 5.397 8.645 7.507 1.00 0.00 C ATOM 1956 CG PHE B 819 5.967 9.030 8.851 1.00 0.00 C ATOM 1957 CD1 PHE B 819 7.215 8.536 9.249 1.00 0.00 C ATOM 1958 CD2 PHE B 819 5.248 9.881 9.698 1.00 0.00 C ATOM 1959 CE1 PHE B 819 7.744 8.893 10.495 1.00 0.00 C ATOM 1960 CE2 PHE B 819 5.777 10.238 10.944 1.00 0.00 C ATOM 1961 CZ PHE B 819 7.025 9.745 11.343 1.00 0.00 C ATOM 0 H PHE B 819 4.503 9.698 5.564 1.00 0.00 H new ATOM 0 HA PHE B 819 7.163 9.714 6.769 1.00 0.00 H new ATOM 0 HB2 PHE B 819 4.427 9.121 7.362 1.00 0.00 H new ATOM 0 HB3 PHE B 819 5.233 7.568 7.465 1.00 0.00 H new ATOM 0 HD1 PHE B 819 7.770 7.880 8.595 1.00 0.00 H new ATOM 0 HD2 PHE B 819 4.285 10.262 9.391 1.00 0.00 H new ATOM 0 HE1 PHE B 819 8.706 8.511 10.802 1.00 0.00 H new ATOM 0 HE2 PHE B 819 5.222 10.894 11.598 1.00 0.00 H new ATOM 0 HZ PHE B 819 7.433 10.021 12.304 1.00 0.00 H new ATOM 1971 N PHE B 820 6.272 6.983 5.168 1.00 0.00 N ATOM 1972 CA PHE B 820 6.874 5.756 4.575 1.00 0.00 C ATOM 1973 C PHE B 820 7.953 6.131 3.543 1.00 0.00 C ATOM 1974 O PHE B 820 8.792 5.327 3.194 1.00 0.00 O ATOM 1975 CB PHE B 820 5.675 4.990 3.954 1.00 0.00 C ATOM 1976 CG PHE B 820 5.584 5.180 2.449 1.00 0.00 C ATOM 1977 CD1 PHE B 820 5.556 6.467 1.903 1.00 0.00 C ATOM 1978 CD2 PHE B 820 5.547 4.064 1.608 1.00 0.00 C ATOM 1979 CE1 PHE B 820 5.488 6.637 0.515 1.00 0.00 C ATOM 1980 CE2 PHE B 820 5.473 4.233 0.220 1.00 0.00 C ATOM 1981 CZ PHE B 820 5.442 5.521 -0.326 1.00 0.00 C ATOM 0 H PHE B 820 5.263 7.074 5.052 1.00 0.00 H new ATOM 0 HA PHE B 820 7.390 5.133 5.305 1.00 0.00 H new ATOM 0 HB2 PHE B 820 5.770 3.928 4.178 1.00 0.00 H new ATOM 0 HB3 PHE B 820 4.750 5.332 4.417 1.00 0.00 H new ATOM 0 HD1 PHE B 820 5.587 7.330 2.552 1.00 0.00 H new ATOM 0 HD2 PHE B 820 5.576 3.070 2.029 1.00 0.00 H new ATOM 0 HE1 PHE B 820 5.471 7.631 0.093 1.00 0.00 H new ATOM 0 HE2 PHE B 820 5.440 3.370 -0.429 1.00 0.00 H new ATOM 0 HZ PHE B 820 5.383 5.653 -1.396 1.00 0.00 H new ATOM 1991 N PHE B 821 7.925 7.340 3.046 1.00 0.00 N ATOM 1992 CA PHE B 821 8.933 7.754 2.027 1.00 0.00 C ATOM 1993 C PHE B 821 10.337 7.772 2.635 1.00 0.00 C ATOM 1994 O PHE B 821 11.260 7.181 2.111 1.00 0.00 O ATOM 1995 CB PHE B 821 8.514 9.170 1.624 1.00 0.00 C ATOM 1996 CG PHE B 821 9.346 9.633 0.452 1.00 0.00 C ATOM 1997 CD1 PHE B 821 10.682 10.003 0.645 1.00 0.00 C ATOM 1998 CD2 PHE B 821 8.777 9.702 -0.825 1.00 0.00 C ATOM 1999 CE1 PHE B 821 11.451 10.436 -0.442 1.00 0.00 C ATOM 2000 CE2 PHE B 821 9.546 10.135 -1.911 1.00 0.00 C ATOM 2001 CZ PHE B 821 10.883 10.503 -1.720 1.00 0.00 C ATOM 0 H PHE B 821 7.247 8.058 3.302 1.00 0.00 H new ATOM 0 HA PHE B 821 8.966 7.070 1.179 1.00 0.00 H new ATOM 0 HB2 PHE B 821 7.457 9.185 1.360 1.00 0.00 H new ATOM 0 HB3 PHE B 821 8.643 9.851 2.465 1.00 0.00 H new ATOM 0 HD1 PHE B 821 11.119 9.955 1.631 1.00 0.00 H new ATOM 0 HD2 PHE B 821 7.745 9.421 -0.972 1.00 0.00 H new ATOM 0 HE1 PHE B 821 12.483 10.718 -0.295 1.00 0.00 H new ATOM 0 HE2 PHE B 821 9.108 10.185 -2.897 1.00 0.00 H new ATOM 0 HZ PHE B 821 11.476 10.838 -2.558 1.00 0.00 H new ATOM 2011 N SER B 822 10.502 8.449 3.738 1.00 0.00 N ATOM 2012 CA SER B 822 11.848 8.530 4.380 1.00 0.00 C ATOM 2013 C SER B 822 12.504 7.149 4.480 1.00 0.00 C ATOM 2014 O SER B 822 13.706 7.021 4.372 1.00 0.00 O ATOM 2015 CB SER B 822 11.576 9.088 5.778 1.00 0.00 C ATOM 2016 OG SER B 822 11.084 8.052 6.614 1.00 0.00 O ATOM 0 H SER B 822 9.761 8.952 4.225 1.00 0.00 H new ATOM 0 HA SER B 822 12.532 9.151 3.802 1.00 0.00 H new ATOM 0 HB2 SER B 822 12.491 9.506 6.199 1.00 0.00 H new ATOM 0 HB3 SER B 822 10.851 9.900 5.722 1.00 0.00 H new ATOM 0 HG SER B 822 10.140 7.887 6.410 1.00 0.00 H new ATOM 2022 N LYS B 823 11.738 6.116 4.699 1.00 0.00 N ATOM 2023 CA LYS B 823 12.349 4.760 4.819 1.00 0.00 C ATOM 2024 C LYS B 823 12.647 4.181 3.436 1.00 0.00 C ATOM 2025 O LYS B 823 13.744 3.730 3.172 1.00 0.00 O ATOM 2026 CB LYS B 823 11.311 3.902 5.551 1.00 0.00 C ATOM 2027 CG LYS B 823 10.889 4.592 6.854 1.00 0.00 C ATOM 2028 CD LYS B 823 12.125 4.901 7.706 1.00 0.00 C ATOM 2029 CE LYS B 823 12.882 3.605 8.000 1.00 0.00 C ATOM 2030 NZ LYS B 823 13.754 3.928 9.165 1.00 0.00 N ATOM 0 H LYS B 823 10.724 6.150 4.800 1.00 0.00 H new ATOM 0 HA LYS B 823 13.296 4.792 5.358 1.00 0.00 H new ATOM 0 HB2 LYS B 823 10.441 3.746 4.914 1.00 0.00 H new ATOM 0 HB3 LYS B 823 11.727 2.918 5.768 1.00 0.00 H new ATOM 0 HG2 LYS B 823 10.352 5.513 6.630 1.00 0.00 H new ATOM 0 HG3 LYS B 823 10.205 3.951 7.410 1.00 0.00 H new ATOM 0 HD2 LYS B 823 12.774 5.602 7.182 1.00 0.00 H new ATOM 0 HD3 LYS B 823 11.826 5.379 8.639 1.00 0.00 H new ATOM 0 HE2 LYS B 823 12.196 2.791 8.233 1.00 0.00 H new ATOM 0 HE3 LYS B 823 13.472 3.288 7.140 1.00 0.00 H new ATOM 0 HZ1 LYS B 823 14.307 3.088 9.428 1.00 0.00 H new ATOM 0 HZ2 LYS B 823 14.400 4.702 8.911 1.00 0.00 H new ATOM 0 HZ3 LYS B 823 13.164 4.220 9.970 1.00 0.00 H new ATOM 2044 N ILE B 824 11.689 4.188 2.547 1.00 0.00 N ATOM 2045 CA ILE B 824 11.951 3.626 1.194 1.00 0.00 C ATOM 2046 C ILE B 824 12.992 4.474 0.463 1.00 0.00 C ATOM 2047 O ILE B 824 13.876 3.956 -0.191 1.00 0.00 O ATOM 2048 CB ILE B 824 10.612 3.652 0.457 1.00 0.00 C ATOM 2049 CG1 ILE B 824 10.077 5.070 0.345 1.00 0.00 C ATOM 2050 CG2 ILE B 824 9.602 2.787 1.195 1.00 0.00 C ATOM 2051 CD1 ILE B 824 8.798 5.029 -0.480 1.00 0.00 C ATOM 0 H ILE B 824 10.749 4.554 2.698 1.00 0.00 H new ATOM 0 HA ILE B 824 12.347 2.612 1.249 1.00 0.00 H new ATOM 0 HB ILE B 824 10.770 3.261 -0.548 1.00 0.00 H new ATOM 0 HG12 ILE B 824 9.879 5.481 1.335 1.00 0.00 H new ATOM 0 HG13 ILE B 824 10.814 5.719 -0.128 1.00 0.00 H new ATOM 0 HG21 ILE B 824 8.649 2.809 0.666 1.00 0.00 H new ATOM 0 HG22 ILE B 824 9.967 1.761 1.243 1.00 0.00 H new ATOM 0 HG23 ILE B 824 9.464 3.170 2.206 1.00 0.00 H new ATOM 0 HD11 ILE B 824 8.394 6.037 -0.575 1.00 0.00 H new ATOM 0 HD12 ILE B 824 9.017 4.631 -1.471 1.00 0.00 H new ATOM 0 HD13 ILE B 824 8.066 4.390 0.014 1.00 0.00 H new ATOM 2063 N LYS B 825 12.915 5.772 0.582 1.00 0.00 N ATOM 2064 CA LYS B 825 13.929 6.630 -0.085 1.00 0.00 C ATOM 2065 C LYS B 825 15.308 6.274 0.458 1.00 0.00 C ATOM 2066 O LYS B 825 16.287 6.241 -0.261 1.00 0.00 O ATOM 2067 CB LYS B 825 13.558 8.064 0.291 1.00 0.00 C ATOM 2068 CG LYS B 825 14.603 9.021 -0.283 1.00 0.00 C ATOM 2069 CD LYS B 825 15.303 9.755 0.863 1.00 0.00 C ATOM 2070 CE LYS B 825 16.749 10.060 0.468 1.00 0.00 C ATOM 2071 NZ LYS B 825 16.725 11.469 -0.017 1.00 0.00 N ATOM 0 H LYS B 825 12.198 6.270 1.109 1.00 0.00 H new ATOM 0 HA LYS B 825 13.950 6.499 -1.167 1.00 0.00 H new ATOM 0 HB2 LYS B 825 12.570 8.310 -0.097 1.00 0.00 H new ATOM 0 HB3 LYS B 825 13.509 8.167 1.375 1.00 0.00 H new ATOM 0 HG2 LYS B 825 15.332 8.468 -0.875 1.00 0.00 H new ATOM 0 HG3 LYS B 825 14.127 9.738 -0.952 1.00 0.00 H new ATOM 0 HD2 LYS B 825 14.775 10.681 1.092 1.00 0.00 H new ATOM 0 HD3 LYS B 825 15.283 9.144 1.766 1.00 0.00 H new ATOM 0 HE2 LYS B 825 17.423 9.946 1.317 1.00 0.00 H new ATOM 0 HE3 LYS B 825 17.098 9.380 -0.310 1.00 0.00 H new ATOM 0 HZ1 LYS B 825 17.683 11.753 -0.307 1.00 0.00 H new ATOM 0 HZ2 LYS B 825 16.080 11.546 -0.829 1.00 0.00 H new ATOM 0 HZ3 LYS B 825 16.395 12.093 0.747 1.00 0.00 H new ATOM 2085 N GLU B 826 15.381 5.986 1.727 1.00 0.00 N ATOM 2086 CA GLU B 826 16.678 5.573 2.325 1.00 0.00 C ATOM 2087 C GLU B 826 16.929 4.096 2.016 1.00 0.00 C ATOM 2088 O GLU B 826 18.054 3.638 1.980 1.00 0.00 O ATOM 2089 CB GLU B 826 16.506 5.792 3.829 1.00 0.00 C ATOM 2090 CG GLU B 826 16.461 7.294 4.123 1.00 0.00 C ATOM 2091 CD GLU B 826 17.848 7.771 4.556 1.00 0.00 C ATOM 2092 OE1 GLU B 826 18.800 7.483 3.850 1.00 0.00 O ATOM 2093 OE2 GLU B 826 17.935 8.418 5.588 1.00 0.00 O ATOM 0 H GLU B 826 14.595 6.019 2.377 1.00 0.00 H new ATOM 0 HA GLU B 826 17.526 6.135 1.934 1.00 0.00 H new ATOM 0 HB2 GLU B 826 15.589 5.315 4.174 1.00 0.00 H new ATOM 0 HB3 GLU B 826 17.330 5.329 4.372 1.00 0.00 H new ATOM 0 HG2 GLU B 826 16.138 7.839 3.236 1.00 0.00 H new ATOM 0 HG3 GLU B 826 15.733 7.500 4.907 1.00 0.00 H new ATOM 2100 N ALA B 827 15.881 3.355 1.766 1.00 0.00 N ATOM 2101 CA ALA B 827 16.038 1.914 1.430 1.00 0.00 C ATOM 2102 C ALA B 827 16.549 1.760 0.000 1.00 0.00 C ATOM 2103 O ALA B 827 17.300 0.857 -0.313 1.00 0.00 O ATOM 2104 CB ALA B 827 14.625 1.337 1.531 1.00 0.00 C ATOM 0 H ALA B 827 14.918 3.691 1.781 1.00 0.00 H new ATOM 0 HA ALA B 827 16.747 1.413 2.089 1.00 0.00 H new ATOM 0 HB1 ALA B 827 14.649 0.273 1.297 1.00 0.00 H new ATOM 0 HB2 ALA B 827 14.246 1.478 2.543 1.00 0.00 H new ATOM 0 HB3 ALA B 827 13.972 1.849 0.824 1.00 0.00 H new ATOM 2110 N GLY B 828 16.114 2.619 -0.878 1.00 0.00 N ATOM 2111 CA GLY B 828 16.540 2.519 -2.300 1.00 0.00 C ATOM 2112 C GLY B 828 15.313 2.243 -3.174 1.00 0.00 C ATOM 2113 O GLY B 828 15.413 1.644 -4.227 1.00 0.00 O ATOM 0 H GLY B 828 15.479 3.390 -0.670 1.00 0.00 H new ATOM 0 HA2 GLY B 828 17.024 3.444 -2.613 1.00 0.00 H new ATOM 0 HA3 GLY B 828 17.272 1.720 -2.418 1.00 0.00 H new ATOM 2117 N LEU B 829 14.151 2.659 -2.739 1.00 0.00 N ATOM 2118 CA LEU B 829 12.926 2.433 -3.556 1.00 0.00 C ATOM 2119 C LEU B 829 12.636 3.656 -4.408 1.00 0.00 C ATOM 2120 O LEU B 829 12.469 3.580 -5.608 1.00 0.00 O ATOM 2121 CB LEU B 829 11.788 2.275 -2.557 1.00 0.00 C ATOM 2122 CG LEU B 829 12.125 1.234 -1.484 1.00 0.00 C ATOM 2123 CD1 LEU B 829 10.846 0.858 -0.748 1.00 0.00 C ATOM 2124 CD2 LEU B 829 12.698 -0.024 -2.131 1.00 0.00 C ATOM 0 H LEU B 829 14.000 3.144 -1.855 1.00 0.00 H new ATOM 0 HA LEU B 829 13.044 1.568 -4.208 1.00 0.00 H new ATOM 0 HB2 LEU B 829 11.582 3.235 -2.083 1.00 0.00 H new ATOM 0 HB3 LEU B 829 10.880 1.978 -3.082 1.00 0.00 H new ATOM 0 HG LEU B 829 12.859 1.654 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU B 829 11.072 0.117 0.019 1.00 0.00 H new ATOM 0 HD12 LEU B 829 10.421 1.746 -0.281 1.00 0.00 H new ATOM 0 HD13 LEU B 829 10.129 0.441 -1.455 1.00 0.00 H new ATOM 0 HD21 LEU B 829 12.933 -0.756 -1.358 1.00 0.00 H new ATOM 0 HD22 LEU B 829 11.965 -0.446 -2.819 1.00 0.00 H new ATOM 0 HD23 LEU B 829 13.606 0.230 -2.679 1.00 0.00 H new ATOM 2136 N ILE B 830 12.511 4.777 -3.762 1.00 0.00 N ATOM 2137 CA ILE B 830 12.162 6.030 -4.477 1.00 0.00 C ATOM 2138 C ILE B 830 13.436 6.737 -4.946 1.00 0.00 C ATOM 2139 O ILE B 830 13.412 7.535 -5.862 1.00 0.00 O ATOM 2140 CB ILE B 830 11.413 6.879 -3.432 1.00 0.00 C ATOM 2141 CG1 ILE B 830 10.370 6.032 -2.697 1.00 0.00 C ATOM 2142 CG2 ILE B 830 10.700 8.036 -4.129 1.00 0.00 C ATOM 2143 CD1 ILE B 830 9.400 5.414 -3.701 1.00 0.00 C ATOM 0 H ILE B 830 12.638 4.879 -2.755 1.00 0.00 H new ATOM 0 HA ILE B 830 11.556 5.854 -5.366 1.00 0.00 H new ATOM 0 HB ILE B 830 12.139 7.259 -2.714 1.00 0.00 H new ATOM 0 HG12 ILE B 830 10.864 5.247 -2.125 1.00 0.00 H new ATOM 0 HG13 ILE B 830 9.824 6.650 -1.984 1.00 0.00 H new ATOM 0 HG21 ILE B 830 10.170 8.636 -3.389 1.00 0.00 H new ATOM 0 HG22 ILE B 830 11.433 8.658 -4.643 1.00 0.00 H new ATOM 0 HG23 ILE B 830 9.987 7.641 -4.853 1.00 0.00 H new ATOM 0 HD11 ILE B 830 8.661 4.813 -3.171 1.00 0.00 H new ATOM 0 HD12 ILE B 830 8.895 6.206 -4.253 1.00 0.00 H new ATOM 0 HD13 ILE B 830 9.951 4.781 -4.397 1.00 0.00 H new