USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 930 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: A 602 ASN : amide:sc= 0.802 K(o=0.95,f=0.42!) USER MOD Set 1.2: A 696 TYR OH : rot 30:sc= 0.148 USER MOD Set 2.1: A 685 SER OG : rot 180:sc= 0.327 USER MOD Set 2.2: A 688 ASN : amide:sc= -0.612 K(o=-0.28,f=-1!) USER MOD Set 3.1: A 586 CYS SG : rot 180:sc= 0 USER MOD Set 3.2: A 636 GLN : amide:sc= 0.584 K(o=1.4,f=-0.047) USER MOD Set 3.3: A 682 TYR OH : rot 2:sc= 0.786 USER MOD Set 4.1: A 677 THR OG1 : rot 180:sc= 0.528 USER MOD Set 4.2: A 679 CYS SG : rot 72:sc= -0.687! USER MOD Single : A 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 SER OG : rot 52:sc= 1 USER MOD Single : A 593 MET CE :methyl -178:sc= -1.14 (180deg=-1.16) USER MOD Single : A 598 ASN : amide:sc= -0.0323 K(o=-0.032,f=-1.3!) USER MOD Single : A 605 THR OG1 : rot 71:sc= 0.0385 USER MOD Single : A 606 SER OG : rot 75:sc= 0.34 USER MOD Single : A 607 MET CE :methyl -145:sc= -0.0577 (180deg=-1.78!) USER MOD Single : A 609 THR OG1 : rot -22:sc= 1.07 USER MOD Single : A 610 LYS NZ :NH3+ 176:sc= 1.16 (180deg=1.13) USER MOD Single : A 617 GLN : amide:sc= 0 K(o=0,f=-0.84) USER MOD Single : A 621 TYR OH : rot 180:sc= 0.25 USER MOD Single : A 627 THR OG1 : rot -74:sc= 1.22 USER MOD Single : A 630 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00974) USER MOD Single : A 631 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 632 MET CE :methyl -169:sc= -0.323 (180deg=-0.692) USER MOD Single : A 633 TYR OH : rot 180:sc= 0 USER MOD Single : A 637 HIS : no HD1:sc= -0.761 X(o=-0.76,f=-0.33) USER MOD Single : A 641 SER OG : rot 66:sc= 0.95 USER MOD Single : A 644 THR OG1 : rot 180:sc= 0 USER MOD Single : A 645 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 647 ASN : amide:sc= -0.457 X(o=-0.46,f=0) USER MOD Single : A 648 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 650 THR OG1 : rot 180:sc= 0 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 656 SER OG : rot -150:sc= 0.136 USER MOD Single : A 657 TYR OH : rot 130:sc= 0.745 USER MOD Single : A 662 CYS SG : rot 170:sc= -0.195 USER MOD Single : A 665 THR OG1 : rot 180:sc= 0 USER MOD Single : A 670 THR OG1 : rot 180:sc= 0 USER MOD Single : A 672 SER OG : rot 180:sc= 0 USER MOD Single : A 678 TYR OH : rot 30:sc= 1.01 USER MOD Single : A 683 SER OG : rot -155:sc= 0.149 USER MOD Single : A 690 ASN : amide:sc= -0.044 K(o=-0.044,f=-1.2) USER MOD Single : A 698 MET CE :methyl -166:sc= -0.0202 (180deg=-0.268) USER MOD Single : A 699 MET CE :methyl -164:sc= -0.0279 (180deg=-0.334) USER MOD ----------------------------------------------------------------- ATOM 144 N CYS A 586 20.816 2.506 -1.720 1.00 0.00 N ATOM 145 CA CYS A 586 20.076 1.250 -1.737 1.00 0.00 C ATOM 146 C CYS A 586 20.548 0.347 -2.869 1.00 0.00 C ATOM 147 O CYS A 586 19.991 -0.727 -3.093 1.00 0.00 O ATOM 148 CB CYS A 586 18.638 1.709 -1.979 1.00 0.00 C ATOM 149 SG CYS A 586 17.944 2.729 -0.656 1.00 0.00 S ATOM 0 HA CYS A 586 20.202 0.667 -0.825 1.00 0.00 H new ATOM 0 HB2 CYS A 586 18.602 2.272 -2.912 1.00 0.00 H new ATOM 0 HB3 CYS A 586 18.007 0.830 -2.112 1.00 0.00 H new ATOM 0 HG CYS A 586 16.726 3.065 -0.961 1.00 0.00 H new ATOM 155 N ARG A 587 21.580 0.790 -3.581 1.00 0.00 N ATOM 156 CA ARG A 587 22.182 -0.014 -4.638 1.00 0.00 C ATOM 157 C ARG A 587 22.724 -1.328 -4.090 1.00 0.00 C ATOM 158 O ARG A 587 22.586 -2.377 -4.719 1.00 0.00 O ATOM 159 CB ARG A 587 23.250 0.753 -5.404 1.00 0.00 C ATOM 160 CG ARG A 587 23.874 -0.006 -6.564 1.00 0.00 C ATOM 161 CD ARG A 587 24.965 0.725 -7.258 1.00 0.00 C ATOM 162 NE ARG A 587 26.133 0.990 -6.432 1.00 0.00 N ATOM 163 CZ ARG A 587 27.081 0.080 -6.135 1.00 0.00 C ATOM 164 NH1 ARG A 587 26.987 -1.160 -6.559 1.00 0.00 N ATOM 165 NH2 ARG A 587 28.099 0.463 -5.383 1.00 0.00 N ATOM 0 H ARG A 587 22.016 1.702 -3.445 1.00 0.00 H new ATOM 0 HA ARG A 587 21.392 -0.250 -5.350 1.00 0.00 H new ATOM 0 HB2 ARG A 587 22.811 1.675 -5.786 1.00 0.00 H new ATOM 0 HB3 ARG A 587 24.040 1.040 -4.709 1.00 0.00 H new ATOM 0 HG2 ARG A 587 24.266 -0.953 -6.194 1.00 0.00 H new ATOM 0 HG3 ARG A 587 23.095 -0.244 -7.288 1.00 0.00 H new ATOM 0 HD2 ARG A 587 25.275 0.148 -8.129 1.00 0.00 H new ATOM 0 HD3 ARG A 587 24.573 1.673 -7.626 1.00 0.00 H new ATOM 0 HE ARG A 587 26.242 1.930 -6.051 1.00 0.00 H new ATOM 0 HH11 ARG A 587 26.187 -1.447 -7.123 1.00 0.00 H new ATOM 0 HH12 ARG A 587 27.714 -1.836 -6.325 1.00 0.00 H new ATOM 0 HH21 ARG A 587 28.150 1.424 -5.045 1.00 0.00 H new ATOM 0 HH22 ARG A 587 28.833 -0.203 -5.141 1.00 0.00 H new ATOM 179 N LYS A 588 23.340 -1.264 -2.915 1.00 0.00 N ATOM 180 CA LYS A 588 23.879 -2.454 -2.267 1.00 0.00 C ATOM 181 C LYS A 588 22.767 -3.418 -1.872 1.00 0.00 C ATOM 182 O LYS A 588 22.937 -4.635 -1.935 1.00 0.00 O ATOM 183 CB LYS A 588 24.701 -2.067 -1.037 1.00 0.00 C ATOM 184 CG LYS A 588 26.023 -1.380 -1.354 1.00 0.00 C ATOM 185 CD LYS A 588 26.792 -1.047 -0.085 1.00 0.00 C ATOM 186 CE LYS A 588 28.115 -0.366 -0.401 1.00 0.00 C ATOM 187 NZ LYS A 588 28.874 -0.024 0.833 1.00 0.00 N ATOM 0 H LYS A 588 23.479 -0.400 -2.391 1.00 0.00 H new ATOM 0 HA LYS A 588 24.528 -2.958 -2.983 1.00 0.00 H new ATOM 0 HB2 LYS A 588 24.104 -1.406 -0.409 1.00 0.00 H new ATOM 0 HB3 LYS A 588 24.903 -2.965 -0.453 1.00 0.00 H new ATOM 0 HG2 LYS A 588 26.628 -2.027 -1.989 1.00 0.00 H new ATOM 0 HG3 LYS A 588 25.834 -0.466 -1.918 1.00 0.00 H new ATOM 0 HD2 LYS A 588 26.188 -0.397 0.548 1.00 0.00 H new ATOM 0 HD3 LYS A 588 26.977 -1.960 0.481 1.00 0.00 H new ATOM 0 HE2 LYS A 588 28.719 -1.021 -1.029 1.00 0.00 H new ATOM 0 HE3 LYS A 588 27.928 0.542 -0.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 29.769 0.438 0.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 28.309 0.622 1.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 29.076 -0.892 1.368 1.00 0.00 H new ATOM 201 N LEU A 589 21.629 -2.865 -1.465 1.00 0.00 N ATOM 202 CA LEU A 589 20.466 -3.674 -1.121 1.00 0.00 C ATOM 203 C LEU A 589 19.936 -4.422 -2.337 1.00 0.00 C ATOM 204 O LEU A 589 19.743 -5.637 -2.295 1.00 0.00 O ATOM 205 CB LEU A 589 19.367 -2.790 -0.517 1.00 0.00 C ATOM 206 CG LEU A 589 19.640 -2.291 0.907 1.00 0.00 C ATOM 207 CD1 LEU A 589 18.581 -1.275 1.316 1.00 0.00 C ATOM 208 CD2 LEU A 589 19.653 -3.472 1.867 1.00 0.00 C ATOM 0 H LEU A 589 21.488 -1.860 -1.365 1.00 0.00 H new ATOM 0 HA LEU A 589 20.774 -4.413 -0.381 1.00 0.00 H new ATOM 0 HB2 LEU A 589 19.220 -1.926 -1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 589 18.432 -3.350 -0.516 1.00 0.00 H new ATOM 0 HG LEU A 589 20.613 -1.802 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 589 18.783 -0.926 2.329 1.00 0.00 H new ATOM 0 HD12 LEU A 589 18.604 -0.429 0.629 1.00 0.00 H new ATOM 0 HD13 LEU A 589 17.597 -1.742 1.283 1.00 0.00 H new ATOM 0 HD21 LEU A 589 19.847 -3.116 2.879 1.00 0.00 H new ATOM 0 HD22 LEU A 589 18.686 -3.975 1.838 1.00 0.00 H new ATOM 0 HD23 LEU A 589 20.435 -4.172 1.572 1.00 0.00 H new ATOM 220 N VAL A 590 19.702 -3.689 -3.421 1.00 0.00 N ATOM 221 CA VAL A 590 19.218 -4.286 -4.660 1.00 0.00 C ATOM 222 C VAL A 590 20.181 -5.351 -5.171 1.00 0.00 C ATOM 223 O VAL A 590 19.761 -6.420 -5.613 1.00 0.00 O ATOM 224 CB VAL A 590 19.014 -3.224 -5.757 1.00 0.00 C ATOM 225 CG1 VAL A 590 18.714 -3.889 -7.092 1.00 0.00 C ATOM 226 CG2 VAL A 590 17.892 -2.271 -5.374 1.00 0.00 C ATOM 0 H VAL A 590 19.840 -2.679 -3.466 1.00 0.00 H new ATOM 0 HA VAL A 590 18.258 -4.748 -4.432 1.00 0.00 H new ATOM 0 HB VAL A 590 19.935 -2.650 -5.856 1.00 0.00 H new ATOM 0 HG11 VAL A 590 18.573 -3.124 -7.856 1.00 0.00 H new ATOM 0 HG12 VAL A 590 19.547 -4.533 -7.373 1.00 0.00 H new ATOM 0 HG13 VAL A 590 17.807 -4.487 -7.005 1.00 0.00 H new ATOM 0 HG21 VAL A 590 17.762 -1.527 -6.160 1.00 0.00 H new ATOM 0 HG22 VAL A 590 16.966 -2.832 -5.248 1.00 0.00 H new ATOM 0 HG23 VAL A 590 18.143 -1.770 -4.439 1.00 0.00 H new ATOM 236 N ALA A 591 21.474 -5.052 -5.106 1.00 0.00 N ATOM 237 CA ALA A 591 22.493 -5.937 -5.658 1.00 0.00 C ATOM 238 C ALA A 591 22.616 -7.215 -4.839 1.00 0.00 C ATOM 239 O ALA A 591 23.211 -8.196 -5.285 1.00 0.00 O ATOM 240 CB ALA A 591 23.833 -5.220 -5.733 1.00 0.00 C ATOM 0 H ALA A 591 21.841 -4.203 -4.676 1.00 0.00 H new ATOM 0 HA ALA A 591 22.188 -6.215 -6.667 1.00 0.00 H new ATOM 0 HB1 ALA A 591 24.583 -5.894 -6.147 1.00 0.00 H new ATOM 0 HB2 ALA A 591 23.741 -4.342 -6.373 1.00 0.00 H new ATOM 0 HB3 ALA A 591 24.136 -4.910 -4.733 1.00 0.00 H new ATOM 246 N SER A 592 22.049 -7.197 -3.637 1.00 0.00 N ATOM 247 CA SER A 592 22.107 -8.350 -2.746 1.00 0.00 C ATOM 248 C SER A 592 21.434 -9.565 -3.372 1.00 0.00 C ATOM 249 O SER A 592 21.903 -10.693 -3.220 1.00 0.00 O ATOM 250 CB SER A 592 21.460 -8.015 -1.416 1.00 0.00 C ATOM 251 OG SER A 592 22.172 -7.030 -0.718 1.00 0.00 O ATOM 0 H SER A 592 21.544 -6.396 -3.258 1.00 0.00 H new ATOM 0 HA SER A 592 23.155 -8.597 -2.579 1.00 0.00 H new ATOM 0 HB2 SER A 592 20.439 -7.672 -1.586 1.00 0.00 H new ATOM 0 HB3 SER A 592 21.397 -8.917 -0.807 1.00 0.00 H new ATOM 0 HG SER A 592 22.320 -6.257 -1.302 1.00 0.00 H new ATOM 257 N MET A 593 20.333 -9.327 -4.077 1.00 0.00 N ATOM 258 CA MET A 593 19.645 -10.388 -4.803 1.00 0.00 C ATOM 259 C MET A 593 20.481 -10.885 -5.975 1.00 0.00 C ATOM 260 O MET A 593 20.836 -10.115 -6.867 1.00 0.00 O ATOM 261 CB MET A 593 18.286 -9.894 -5.295 1.00 0.00 C ATOM 262 CG MET A 593 17.478 -10.932 -6.061 1.00 0.00 C ATOM 263 SD MET A 593 16.865 -12.257 -5.001 1.00 0.00 S ATOM 264 CE MET A 593 16.908 -13.643 -6.133 1.00 0.00 C ATOM 0 H MET A 593 19.898 -8.408 -4.161 1.00 0.00 H new ATOM 0 HA MET A 593 19.494 -11.223 -4.119 1.00 0.00 H new ATOM 0 HB2 MET A 593 17.703 -9.558 -4.437 1.00 0.00 H new ATOM 0 HB3 MET A 593 18.439 -9.026 -5.936 1.00 0.00 H new ATOM 0 HG2 MET A 593 16.635 -10.443 -6.549 1.00 0.00 H new ATOM 0 HG3 MET A 593 18.098 -11.360 -6.849 1.00 0.00 H new ATOM 0 HE1 MET A 593 16.523 -14.532 -5.634 1.00 0.00 H new ATOM 0 HE2 MET A 593 16.292 -13.420 -7.004 1.00 0.00 H new ATOM 0 HE3 MET A 593 17.935 -13.821 -6.451 1.00 0.00 H new ATOM 274 N PRO A 594 20.792 -12.176 -5.967 1.00 0.00 N ATOM 275 CA PRO A 594 21.621 -12.771 -7.009 1.00 0.00 C ATOM 276 C PRO A 594 21.097 -12.421 -8.396 1.00 0.00 C ATOM 277 O PRO A 594 21.871 -12.120 -9.305 1.00 0.00 O ATOM 278 CB PRO A 594 21.551 -14.276 -6.730 1.00 0.00 C ATOM 279 CG PRO A 594 21.406 -14.372 -5.250 1.00 0.00 C ATOM 280 CD PRO A 594 20.505 -13.230 -4.862 1.00 0.00 C ATOM 0 HA PRO A 594 22.647 -12.402 -6.994 1.00 0.00 H new ATOM 0 HB2 PRO A 594 20.706 -14.736 -7.243 1.00 0.00 H new ATOM 0 HB3 PRO A 594 22.450 -14.786 -7.075 1.00 0.00 H new ATOM 0 HG2 PRO A 594 20.974 -15.330 -4.959 1.00 0.00 H new ATOM 0 HG3 PRO A 594 22.374 -14.295 -4.755 1.00 0.00 H new ATOM 0 HD2 PRO A 594 19.457 -13.528 -4.849 1.00 0.00 H new ATOM 0 HD3 PRO A 594 20.740 -12.849 -3.868 1.00 0.00 H new ATOM 288 N LEU A 595 19.778 -12.462 -8.553 1.00 0.00 N ATOM 289 CA LEU A 595 19.151 -12.194 -9.842 1.00 0.00 C ATOM 290 C LEU A 595 19.385 -10.754 -10.279 1.00 0.00 C ATOM 291 O LEU A 595 19.419 -10.455 -11.473 1.00 0.00 O ATOM 292 CB LEU A 595 17.648 -12.493 -9.772 1.00 0.00 C ATOM 293 CG LEU A 595 17.234 -13.878 -10.285 1.00 0.00 C ATOM 294 CD1 LEU A 595 18.090 -14.954 -9.631 1.00 0.00 C ATOM 295 CD2 LEU A 595 15.759 -14.110 -9.991 1.00 0.00 C ATOM 0 H LEU A 595 19.122 -12.679 -7.803 1.00 0.00 H new ATOM 0 HA LEU A 595 19.608 -12.848 -10.584 1.00 0.00 H new ATOM 0 HB2 LEU A 595 17.322 -12.394 -8.737 1.00 0.00 H new ATOM 0 HB3 LEU A 595 17.116 -11.736 -10.348 1.00 0.00 H new ATOM 0 HG LEU A 595 17.388 -13.927 -11.363 1.00 0.00 H new ATOM 0 HD11 LEU A 595 17.789 -15.934 -10.001 1.00 0.00 H new ATOM 0 HD12 LEU A 595 19.139 -14.781 -9.873 1.00 0.00 H new ATOM 0 HD13 LEU A 595 17.956 -14.918 -8.550 1.00 0.00 H new ATOM 0 HD21 LEU A 595 15.466 -15.094 -10.356 1.00 0.00 H new ATOM 0 HD22 LEU A 595 15.590 -14.056 -8.916 1.00 0.00 H new ATOM 0 HD23 LEU A 595 15.164 -13.346 -10.491 1.00 0.00 H new ATOM 307 N PHE A 596 19.547 -9.864 -9.306 1.00 0.00 N ATOM 308 CA PHE A 596 19.786 -8.454 -9.589 1.00 0.00 C ATOM 309 C PHE A 596 21.275 -8.166 -9.734 1.00 0.00 C ATOM 310 O PHE A 596 21.671 -7.216 -10.409 1.00 0.00 O ATOM 311 CB PHE A 596 19.186 -7.578 -8.488 1.00 0.00 C ATOM 312 CG PHE A 596 17.692 -7.687 -8.375 1.00 0.00 C ATOM 313 CD1 PHE A 596 16.959 -8.387 -9.321 1.00 0.00 C ATOM 314 CD2 PHE A 596 17.016 -7.089 -7.322 1.00 0.00 C ATOM 315 CE1 PHE A 596 15.584 -8.488 -9.218 1.00 0.00 C ATOM 316 CE2 PHE A 596 15.642 -7.188 -7.216 1.00 0.00 C ATOM 317 CZ PHE A 596 14.926 -7.889 -8.166 1.00 0.00 C ATOM 0 H PHE A 596 19.517 -10.095 -8.313 1.00 0.00 H new ATOM 0 HA PHE A 596 19.299 -8.217 -10.535 1.00 0.00 H new ATOM 0 HB2 PHE A 596 19.634 -7.852 -7.533 1.00 0.00 H new ATOM 0 HB3 PHE A 596 19.452 -6.538 -8.678 1.00 0.00 H new ATOM 0 HD1 PHE A 596 17.468 -8.859 -10.148 1.00 0.00 H new ATOM 0 HD2 PHE A 596 17.570 -6.539 -6.576 1.00 0.00 H new ATOM 0 HE1 PHE A 596 15.026 -9.036 -9.962 1.00 0.00 H new ATOM 0 HE2 PHE A 596 15.128 -6.717 -6.391 1.00 0.00 H new ATOM 0 HZ PHE A 596 13.852 -7.968 -8.085 1.00 0.00 H new ATOM 327 N ALA A 597 22.097 -8.992 -9.095 1.00 0.00 N ATOM 328 CA ALA A 597 23.543 -8.921 -9.269 1.00 0.00 C ATOM 329 C ALA A 597 23.949 -9.347 -10.674 1.00 0.00 C ATOM 330 O ALA A 597 24.885 -8.796 -11.254 1.00 0.00 O ATOM 331 CB ALA A 597 24.245 -9.781 -8.228 1.00 0.00 C ATOM 0 H ALA A 597 21.786 -9.719 -8.451 1.00 0.00 H new ATOM 0 HA ALA A 597 23.849 -7.884 -9.131 1.00 0.00 H new ATOM 0 HB1 ALA A 597 25.324 -9.718 -8.371 1.00 0.00 H new ATOM 0 HB2 ALA A 597 23.990 -9.425 -7.230 1.00 0.00 H new ATOM 0 HB3 ALA A 597 23.925 -10.817 -8.336 1.00 0.00 H new ATOM 337 N ASN A 598 23.240 -10.330 -11.218 1.00 0.00 N ATOM 338 CA ASN A 598 23.468 -10.772 -12.588 1.00 0.00 C ATOM 339 C ASN A 598 22.978 -9.735 -13.591 1.00 0.00 C ATOM 340 O ASN A 598 23.447 -9.687 -14.728 1.00 0.00 O ATOM 341 CB ASN A 598 22.809 -12.113 -12.856 1.00 0.00 C ATOM 342 CG ASN A 598 23.496 -13.270 -12.184 1.00 0.00 C ATOM 343 OD1 ASN A 598 24.678 -13.196 -11.830 1.00 0.00 O ATOM 344 ND2 ASN A 598 22.787 -14.365 -12.081 1.00 0.00 N ATOM 0 H ASN A 598 22.501 -10.836 -10.730 1.00 0.00 H new ATOM 0 HA ASN A 598 24.544 -10.891 -12.712 1.00 0.00 H new ATOM 0 HB2 ASN A 598 21.773 -12.072 -12.520 1.00 0.00 H new ATOM 0 HB3 ASN A 598 22.788 -12.289 -13.931 1.00 0.00 H new ATOM 0 HD21 ASN A 598 23.207 -15.210 -11.694 1.00 0.00 H new ATOM 0 HD22 ASN A 598 21.814 -14.374 -12.388 1.00 0.00 H new ATOM 351 N ALA A 599 22.031 -8.907 -13.162 1.00 0.00 N ATOM 352 CA ALA A 599 21.510 -7.838 -14.005 1.00 0.00 C ATOM 353 C ALA A 599 22.548 -6.742 -14.210 1.00 0.00 C ATOM 354 O ALA A 599 23.447 -6.565 -13.388 1.00 0.00 O ATOM 355 CB ALA A 599 20.237 -7.262 -13.403 1.00 0.00 C ATOM 0 H ALA A 599 21.609 -8.956 -12.235 1.00 0.00 H new ATOM 0 HA ALA A 599 21.275 -8.262 -14.981 1.00 0.00 H new ATOM 0 HB1 ALA A 599 19.860 -6.465 -14.044 1.00 0.00 H new ATOM 0 HB2 ALA A 599 19.486 -8.047 -13.321 1.00 0.00 H new ATOM 0 HB3 ALA A 599 20.452 -6.860 -12.413 1.00 0.00 H new ATOM 361 N ASP A 600 22.418 -6.009 -15.310 1.00 0.00 N ATOM 362 CA ASP A 600 23.355 -4.940 -15.634 1.00 0.00 C ATOM 363 C ASP A 600 23.414 -3.903 -14.519 1.00 0.00 C ATOM 364 O ASP A 600 22.419 -3.649 -13.841 1.00 0.00 O ATOM 365 CB ASP A 600 22.969 -4.270 -16.955 1.00 0.00 C ATOM 366 CG ASP A 600 23.227 -5.121 -18.191 1.00 0.00 C ATOM 367 OD1 ASP A 600 23.872 -6.135 -18.066 1.00 0.00 O ATOM 368 OD2 ASP A 600 22.649 -4.838 -19.213 1.00 0.00 O ATOM 0 H ASP A 600 21.672 -6.136 -15.993 1.00 0.00 H new ATOM 0 HA ASP A 600 24.344 -5.385 -15.739 1.00 0.00 H new ATOM 0 HB2 ASP A 600 21.911 -4.011 -16.921 1.00 0.00 H new ATOM 0 HB3 ASP A 600 23.523 -3.336 -17.050 1.00 0.00 H new ATOM 373 N PRO A 601 24.587 -3.307 -14.334 1.00 0.00 N ATOM 374 CA PRO A 601 24.757 -2.236 -13.360 1.00 0.00 C ATOM 375 C PRO A 601 23.717 -1.140 -13.558 1.00 0.00 C ATOM 376 O PRO A 601 23.232 -0.549 -12.594 1.00 0.00 O ATOM 377 CB PRO A 601 26.182 -1.729 -13.605 1.00 0.00 C ATOM 378 CG PRO A 601 26.910 -2.913 -14.142 1.00 0.00 C ATOM 379 CD PRO A 601 25.922 -3.621 -15.030 1.00 0.00 C ATOM 0 HA PRO A 601 24.617 -2.574 -12.333 1.00 0.00 H new ATOM 0 HB2 PRO A 601 26.193 -0.901 -14.314 1.00 0.00 H new ATOM 0 HB3 PRO A 601 26.638 -1.366 -12.684 1.00 0.00 H new ATOM 0 HG2 PRO A 601 27.794 -2.610 -14.702 1.00 0.00 H new ATOM 0 HG3 PRO A 601 27.251 -3.563 -13.336 1.00 0.00 H new ATOM 0 HD2 PRO A 601 25.948 -3.244 -16.052 1.00 0.00 H new ATOM 0 HD3 PRO A 601 26.114 -4.693 -15.081 1.00 0.00 H new ATOM 387 N ASN A 602 23.377 -0.875 -14.815 1.00 0.00 N ATOM 388 CA ASN A 602 22.367 0.125 -15.141 1.00 0.00 C ATOM 389 C ASN A 602 20.976 -0.347 -14.737 1.00 0.00 C ATOM 390 O ASN A 602 20.157 0.441 -14.262 1.00 0.00 O ATOM 391 CB ASN A 602 22.392 0.479 -16.616 1.00 0.00 C ATOM 392 CG ASN A 602 23.586 1.299 -17.021 1.00 0.00 C ATOM 393 OD1 ASN A 602 24.242 1.932 -16.186 1.00 0.00 O ATOM 394 ND2 ASN A 602 23.821 1.357 -18.307 1.00 0.00 N ATOM 0 H ASN A 602 23.787 -1.339 -15.625 1.00 0.00 H new ATOM 0 HA ASN A 602 22.607 1.023 -14.572 1.00 0.00 H new ATOM 0 HB2 ASN A 602 22.378 -0.440 -17.201 1.00 0.00 H new ATOM 0 HB3 ASN A 602 21.484 1.028 -16.864 1.00 0.00 H new ATOM 0 HD21 ASN A 602 24.575 1.945 -18.662 1.00 0.00 H new ATOM 0 HD22 ASN A 602 23.250 0.814 -18.955 1.00 0.00 H new ATOM 401 N PHE A 603 20.714 -1.635 -14.927 1.00 0.00 N ATOM 402 CA PHE A 603 19.467 -2.239 -14.475 1.00 0.00 C ATOM 403 C PHE A 603 19.314 -2.121 -12.964 1.00 0.00 C ATOM 404 O PHE A 603 18.225 -1.848 -12.459 1.00 0.00 O ATOM 405 CB PHE A 603 19.400 -3.708 -14.897 1.00 0.00 C ATOM 406 CG PHE A 603 19.099 -3.906 -16.355 1.00 0.00 C ATOM 407 CD1 PHE A 603 18.786 -2.825 -17.167 1.00 0.00 C ATOM 408 CD2 PHE A 603 19.128 -5.172 -16.919 1.00 0.00 C ATOM 409 CE1 PHE A 603 18.509 -3.006 -18.509 1.00 0.00 C ATOM 410 CE2 PHE A 603 18.853 -5.356 -18.260 1.00 0.00 C ATOM 411 CZ PHE A 603 18.543 -4.271 -19.055 1.00 0.00 C ATOM 0 H PHE A 603 21.350 -2.282 -15.392 1.00 0.00 H new ATOM 0 HA PHE A 603 18.645 -1.698 -14.944 1.00 0.00 H new ATOM 0 HB2 PHE A 603 20.351 -4.187 -14.663 1.00 0.00 H new ATOM 0 HB3 PHE A 603 18.635 -4.212 -14.306 1.00 0.00 H new ATOM 0 HD1 PHE A 603 18.759 -1.831 -16.746 1.00 0.00 H new ATOM 0 HD2 PHE A 603 19.369 -6.025 -16.302 1.00 0.00 H new ATOM 0 HE1 PHE A 603 18.266 -2.156 -19.130 1.00 0.00 H new ATOM 0 HE2 PHE A 603 18.880 -6.348 -18.686 1.00 0.00 H new ATOM 0 HZ PHE A 603 18.327 -4.413 -20.104 1.00 0.00 H new ATOM 421 N VAL A 604 20.412 -2.329 -12.245 1.00 0.00 N ATOM 422 CA VAL A 604 20.418 -2.184 -10.794 1.00 0.00 C ATOM 423 C VAL A 604 20.045 -0.765 -10.381 1.00 0.00 C ATOM 424 O VAL A 604 19.182 -0.564 -9.527 1.00 0.00 O ATOM 425 CB VAL A 604 21.792 -2.538 -10.196 1.00 0.00 C ATOM 426 CG1 VAL A 604 21.836 -2.182 -8.717 1.00 0.00 C ATOM 427 CG2 VAL A 604 22.096 -4.014 -10.397 1.00 0.00 C ATOM 0 H VAL A 604 21.311 -2.599 -12.645 1.00 0.00 H new ATOM 0 HA VAL A 604 19.674 -2.880 -10.406 1.00 0.00 H new ATOM 0 HB VAL A 604 22.554 -1.956 -10.714 1.00 0.00 H new ATOM 0 HG11 VAL A 604 22.814 -2.439 -8.310 1.00 0.00 H new ATOM 0 HG12 VAL A 604 21.661 -1.113 -8.595 1.00 0.00 H new ATOM 0 HG13 VAL A 604 21.064 -2.739 -8.186 1.00 0.00 H new ATOM 0 HG21 VAL A 604 23.071 -4.246 -9.968 1.00 0.00 H new ATOM 0 HG22 VAL A 604 21.331 -4.614 -9.904 1.00 0.00 H new ATOM 0 HG23 VAL A 604 22.105 -4.242 -11.463 1.00 0.00 H new ATOM 437 N THR A 605 20.701 0.215 -10.993 1.00 0.00 N ATOM 438 CA THR A 605 20.374 1.617 -10.760 1.00 0.00 C ATOM 439 C THR A 605 18.900 1.890 -11.026 1.00 0.00 C ATOM 440 O THR A 605 18.225 2.543 -10.229 1.00 0.00 O ATOM 441 CB THR A 605 21.226 2.550 -11.641 1.00 0.00 C ATOM 442 OG1 THR A 605 22.612 2.383 -11.316 1.00 0.00 O ATOM 443 CG2 THR A 605 20.828 4.001 -11.421 1.00 0.00 C ATOM 0 H THR A 605 21.463 0.064 -11.654 1.00 0.00 H new ATOM 0 HA THR A 605 20.595 1.821 -9.712 1.00 0.00 H new ATOM 0 HB THR A 605 21.057 2.293 -12.687 1.00 0.00 H new ATOM 0 HG1 THR A 605 22.921 1.511 -11.639 1.00 0.00 H new ATOM 0 HG21 THR A 605 21.440 4.646 -12.051 1.00 0.00 H new ATOM 0 HG22 THR A 605 19.777 4.133 -11.679 1.00 0.00 H new ATOM 0 HG23 THR A 605 20.981 4.266 -10.375 1.00 0.00 H new ATOM 451 N SER A 606 18.404 1.388 -12.152 1.00 0.00 N ATOM 452 CA SER A 606 17.012 1.594 -12.535 1.00 0.00 C ATOM 453 C SER A 606 16.063 1.021 -11.491 1.00 0.00 C ATOM 454 O SER A 606 15.095 1.671 -11.094 1.00 0.00 O ATOM 455 CB SER A 606 16.746 0.969 -13.890 1.00 0.00 C ATOM 456 OG SER A 606 17.448 1.616 -14.916 1.00 0.00 O ATOM 0 H SER A 606 18.946 0.835 -12.816 1.00 0.00 H new ATOM 0 HA SER A 606 16.832 2.667 -12.598 1.00 0.00 H new ATOM 0 HB2 SER A 606 17.029 -0.083 -13.865 1.00 0.00 H new ATOM 0 HB3 SER A 606 15.678 1.007 -14.103 1.00 0.00 H new ATOM 0 HG SER A 606 18.393 1.360 -14.878 1.00 0.00 H new ATOM 462 N MET A 607 16.345 -0.199 -11.048 1.00 0.00 N ATOM 463 CA MET A 607 15.548 -0.841 -10.009 1.00 0.00 C ATOM 464 C MET A 607 15.564 -0.028 -8.721 1.00 0.00 C ATOM 465 O MET A 607 14.544 0.103 -8.046 1.00 0.00 O ATOM 466 CB MET A 607 16.062 -2.255 -9.748 1.00 0.00 C ATOM 467 CG MET A 607 15.702 -3.266 -10.829 1.00 0.00 C ATOM 468 SD MET A 607 16.114 -4.959 -10.362 1.00 0.00 S ATOM 469 CE MET A 607 17.850 -5.017 -10.798 1.00 0.00 C ATOM 0 H MET A 607 17.121 -0.764 -11.393 1.00 0.00 H new ATOM 0 HA MET A 607 14.517 -0.896 -10.360 1.00 0.00 H new ATOM 0 HB2 MET A 607 17.147 -2.221 -9.646 1.00 0.00 H new ATOM 0 HB3 MET A 607 15.663 -2.603 -8.795 1.00 0.00 H new ATOM 0 HG2 MET A 607 14.635 -3.201 -11.041 1.00 0.00 H new ATOM 0 HG3 MET A 607 16.226 -3.010 -11.750 1.00 0.00 H new ATOM 0 HE1 MET A 607 18.099 -6.012 -11.167 1.00 0.00 H new ATOM 0 HE2 MET A 607 18.055 -4.280 -11.575 1.00 0.00 H new ATOM 0 HE3 MET A 607 18.454 -4.794 -9.918 1.00 0.00 H new ATOM 479 N LEU A 608 16.729 0.516 -8.386 1.00 0.00 N ATOM 480 CA LEU A 608 16.873 1.344 -7.195 1.00 0.00 C ATOM 481 C LEU A 608 15.855 2.477 -7.184 1.00 0.00 C ATOM 482 O LEU A 608 15.286 2.803 -6.142 1.00 0.00 O ATOM 483 CB LEU A 608 18.298 1.906 -7.109 1.00 0.00 C ATOM 484 CG LEU A 608 18.718 2.411 -5.723 1.00 0.00 C ATOM 485 CD1 LEU A 608 20.151 2.925 -5.767 1.00 0.00 C ATOM 486 CD2 LEU A 608 17.765 3.506 -5.269 1.00 0.00 C ATOM 0 H LEU A 608 17.588 0.398 -8.923 1.00 0.00 H new ATOM 0 HA LEU A 608 16.686 0.717 -6.323 1.00 0.00 H new ATOM 0 HB2 LEU A 608 18.997 1.131 -7.423 1.00 0.00 H new ATOM 0 HB3 LEU A 608 18.392 2.726 -7.821 1.00 0.00 H new ATOM 0 HG LEU A 608 18.672 1.590 -5.008 1.00 0.00 H new ATOM 0 HD11 LEU A 608 20.440 3.281 -4.778 1.00 0.00 H new ATOM 0 HD12 LEU A 608 20.818 2.118 -6.071 1.00 0.00 H new ATOM 0 HD13 LEU A 608 20.222 3.744 -6.483 1.00 0.00 H new ATOM 0 HD21 LEU A 608 18.065 3.864 -4.284 1.00 0.00 H new ATOM 0 HD22 LEU A 608 17.795 4.332 -5.980 1.00 0.00 H new ATOM 0 HD23 LEU A 608 16.752 3.108 -5.218 1.00 0.00 H new ATOM 498 N THR A 609 15.629 3.074 -8.349 1.00 0.00 N ATOM 499 CA THR A 609 14.764 4.243 -8.456 1.00 0.00 C ATOM 500 C THR A 609 13.302 3.836 -8.584 1.00 0.00 C ATOM 501 O THR A 609 12.406 4.678 -8.526 1.00 0.00 O ATOM 502 CB THR A 609 15.149 5.122 -9.661 1.00 0.00 C ATOM 503 OG1 THR A 609 14.935 4.392 -10.876 1.00 0.00 O ATOM 504 CG2 THR A 609 16.610 5.537 -9.573 1.00 0.00 C ATOM 0 H THR A 609 16.033 2.767 -9.234 1.00 0.00 H new ATOM 0 HA THR A 609 14.899 4.819 -7.540 1.00 0.00 H new ATOM 0 HB THR A 609 14.527 6.017 -9.653 1.00 0.00 H new ATOM 0 HG1 THR A 609 14.937 3.431 -10.685 1.00 0.00 H new ATOM 0 HG21 THR A 609 16.864 6.157 -10.432 1.00 0.00 H new ATOM 0 HG22 THR A 609 16.773 6.103 -8.656 1.00 0.00 H new ATOM 0 HG23 THR A 609 17.241 4.648 -9.568 1.00 0.00 H new ATOM 512 N LYS A 610 13.067 2.540 -8.757 1.00 0.00 N ATOM 513 CA LYS A 610 11.710 2.008 -8.811 1.00 0.00 C ATOM 514 C LYS A 610 11.303 1.403 -7.474 1.00 0.00 C ATOM 515 O LYS A 610 10.226 0.821 -7.347 1.00 0.00 O ATOM 516 CB LYS A 610 11.588 0.962 -9.920 1.00 0.00 C ATOM 517 CG LYS A 610 11.660 1.531 -11.331 1.00 0.00 C ATOM 518 CD LYS A 610 11.454 0.445 -12.377 1.00 0.00 C ATOM 519 CE LYS A 610 11.573 1.003 -13.787 1.00 0.00 C ATOM 520 NZ LYS A 610 10.417 1.871 -14.141 1.00 0.00 N ATOM 0 H LYS A 610 13.799 1.838 -8.862 1.00 0.00 H new ATOM 0 HA LYS A 610 11.036 2.836 -9.030 1.00 0.00 H new ATOM 0 HB2 LYS A 610 12.382 0.225 -9.797 1.00 0.00 H new ATOM 0 HB3 LYS A 610 10.642 0.434 -9.802 1.00 0.00 H new ATOM 0 HG2 LYS A 610 10.902 2.304 -11.453 1.00 0.00 H new ATOM 0 HG3 LYS A 610 12.628 2.007 -11.484 1.00 0.00 H new ATOM 0 HD2 LYS A 610 12.191 -0.345 -12.233 1.00 0.00 H new ATOM 0 HD3 LYS A 610 10.471 -0.008 -12.245 1.00 0.00 H new ATOM 0 HE2 LYS A 610 12.497 1.575 -13.874 1.00 0.00 H new ATOM 0 HE3 LYS A 610 11.640 0.180 -14.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 610 10.569 2.285 -15.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 610 9.546 1.303 -14.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 610 10.327 2.633 -13.439 1.00 0.00 H new ATOM 534 N LEU A 611 12.171 1.544 -6.477 1.00 0.00 N ATOM 535 CA LEU A 611 11.872 1.075 -5.129 1.00 0.00 C ATOM 536 C LEU A 611 10.730 1.871 -4.510 1.00 0.00 C ATOM 537 O LEU A 611 10.562 3.057 -4.794 1.00 0.00 O ATOM 538 CB LEU A 611 13.124 1.164 -4.248 1.00 0.00 C ATOM 539 CG LEU A 611 14.258 0.202 -4.625 1.00 0.00 C ATOM 540 CD1 LEU A 611 15.472 0.455 -3.742 1.00 0.00 C ATOM 541 CD2 LEU A 611 13.776 -1.234 -4.481 1.00 0.00 C ATOM 0 H LEU A 611 13.088 1.980 -6.578 1.00 0.00 H new ATOM 0 HA LEU A 611 11.558 0.033 -5.194 1.00 0.00 H new ATOM 0 HB2 LEU A 611 13.506 2.184 -4.289 1.00 0.00 H new ATOM 0 HB3 LEU A 611 12.836 0.973 -3.214 1.00 0.00 H new ATOM 0 HG LEU A 611 14.549 0.372 -5.662 1.00 0.00 H new ATOM 0 HD11 LEU A 611 16.272 -0.233 -4.017 1.00 0.00 H new ATOM 0 HD12 LEU A 611 15.813 1.481 -3.878 1.00 0.00 H new ATOM 0 HD13 LEU A 611 15.202 0.298 -2.698 1.00 0.00 H new ATOM 0 HD21 LEU A 611 14.582 -1.917 -4.749 1.00 0.00 H new ATOM 0 HD22 LEU A 611 13.475 -1.415 -3.449 1.00 0.00 H new ATOM 0 HD23 LEU A 611 12.925 -1.400 -5.142 1.00 0.00 H new ATOM 553 N ARG A 612 9.948 1.212 -3.662 1.00 0.00 N ATOM 554 CA ARG A 612 8.942 1.896 -2.858 1.00 0.00 C ATOM 555 C ARG A 612 9.295 1.847 -1.377 1.00 0.00 C ATOM 556 O ARG A 612 9.480 0.771 -0.808 1.00 0.00 O ATOM 557 CB ARG A 612 7.541 1.360 -3.115 1.00 0.00 C ATOM 558 CG ARG A 612 6.463 1.928 -2.205 1.00 0.00 C ATOM 559 CD ARG A 612 5.088 1.460 -2.518 1.00 0.00 C ATOM 560 NE ARG A 612 4.070 1.911 -1.584 1.00 0.00 N ATOM 561 CZ ARG A 612 2.744 1.765 -1.768 1.00 0.00 C ATOM 562 NH1 ARG A 612 2.268 1.217 -2.864 1.00 0.00 N ATOM 563 NH2 ARG A 612 1.930 2.211 -0.827 1.00 0.00 N ATOM 0 H ARG A 612 9.992 0.204 -3.514 1.00 0.00 H new ATOM 0 HA ARG A 612 8.941 2.941 -3.167 1.00 0.00 H new ATOM 0 HB2 ARG A 612 7.271 1.571 -4.150 1.00 0.00 H new ATOM 0 HB3 ARG A 612 7.556 0.276 -3.004 1.00 0.00 H new ATOM 0 HG2 ARG A 612 6.698 1.663 -1.174 1.00 0.00 H new ATOM 0 HG3 ARG A 612 6.487 3.016 -2.268 1.00 0.00 H new ATOM 0 HD2 ARG A 612 4.821 1.800 -3.519 1.00 0.00 H new ATOM 0 HD3 ARG A 612 5.085 0.370 -2.540 1.00 0.00 H new ATOM 0 HE ARG A 612 4.382 2.371 -0.729 1.00 0.00 H new ATOM 0 HH11 ARG A 612 2.906 0.895 -3.592 1.00 0.00 H new ATOM 0 HH12 ARG A 612 1.261 1.114 -2.987 1.00 0.00 H new ATOM 0 HH21 ARG A 612 2.311 2.652 0.010 1.00 0.00 H new ATOM 0 HH22 ARG A 612 0.921 2.115 -0.938 1.00 0.00 H new ATOM 577 N PHE A 613 9.386 3.019 -0.757 1.00 0.00 N ATOM 578 CA PHE A 613 9.827 3.120 0.629 1.00 0.00 C ATOM 579 C PHE A 613 8.694 2.790 1.592 1.00 0.00 C ATOM 580 O PHE A 613 7.772 3.585 1.777 1.00 0.00 O ATOM 581 CB PHE A 613 10.371 4.521 0.916 1.00 0.00 C ATOM 582 CG PHE A 613 11.048 4.646 2.251 1.00 0.00 C ATOM 583 CD1 PHE A 613 11.340 3.519 3.005 1.00 0.00 C ATOM 584 CD2 PHE A 613 11.394 5.890 2.756 1.00 0.00 C ATOM 585 CE1 PHE A 613 11.962 3.633 4.234 1.00 0.00 C ATOM 586 CE2 PHE A 613 12.018 6.007 3.983 1.00 0.00 C ATOM 587 CZ PHE A 613 12.302 4.877 4.722 1.00 0.00 C ATOM 0 H PHE A 613 9.160 3.913 -1.193 1.00 0.00 H new ATOM 0 HA PHE A 613 10.625 2.393 0.780 1.00 0.00 H new ATOM 0 HB2 PHE A 613 11.079 4.793 0.133 1.00 0.00 H new ATOM 0 HB3 PHE A 613 9.550 5.237 0.867 1.00 0.00 H new ATOM 0 HD1 PHE A 613 11.078 2.542 2.628 1.00 0.00 H new ATOM 0 HD2 PHE A 613 11.173 6.778 2.183 1.00 0.00 H new ATOM 0 HE1 PHE A 613 12.182 2.748 4.812 1.00 0.00 H new ATOM 0 HE2 PHE A 613 12.283 6.982 4.363 1.00 0.00 H new ATOM 0 HZ PHE A 613 12.790 4.967 5.681 1.00 0.00 H new ATOM 597 N GLU A 614 8.769 1.614 2.205 1.00 0.00 N ATOM 598 CA GLU A 614 7.703 1.135 3.078 1.00 0.00 C ATOM 599 C GLU A 614 8.185 1.010 4.518 1.00 0.00 C ATOM 600 O GLU A 614 9.067 0.206 4.819 1.00 0.00 O ATOM 601 CB GLU A 614 7.169 -0.211 2.584 1.00 0.00 C ATOM 602 CG GLU A 614 6.492 -0.157 1.222 1.00 0.00 C ATOM 603 CD GLU A 614 6.005 -1.515 0.799 1.00 0.00 C ATOM 604 OE1 GLU A 614 6.126 -2.435 1.572 1.00 0.00 O ATOM 605 OE2 GLU A 614 5.411 -1.611 -0.249 1.00 0.00 O ATOM 0 H GLU A 614 9.558 0.974 2.114 1.00 0.00 H new ATOM 0 HA GLU A 614 6.896 1.867 3.051 1.00 0.00 H new ATOM 0 HB2 GLU A 614 7.995 -0.921 2.538 1.00 0.00 H new ATOM 0 HB3 GLU A 614 6.458 -0.596 3.315 1.00 0.00 H new ATOM 0 HG2 GLU A 614 5.653 0.538 1.258 1.00 0.00 H new ATOM 0 HG3 GLU A 614 7.192 0.228 0.481 1.00 0.00 H new ATOM 612 N VAL A 615 7.602 1.811 5.403 1.00 0.00 N ATOM 613 CA VAL A 615 7.952 1.772 6.818 1.00 0.00 C ATOM 614 C VAL A 615 6.983 0.897 7.602 1.00 0.00 C ATOM 615 O VAL A 615 5.778 0.906 7.348 1.00 0.00 O ATOM 616 CB VAL A 615 7.967 3.184 7.435 1.00 0.00 C ATOM 617 CG1 VAL A 615 8.258 3.110 8.927 1.00 0.00 C ATOM 618 CG2 VAL A 615 8.996 4.060 6.736 1.00 0.00 C ATOM 0 H VAL A 615 6.884 2.496 5.165 1.00 0.00 H new ATOM 0 HA VAL A 615 8.953 1.346 6.882 1.00 0.00 H new ATOM 0 HB VAL A 615 6.982 3.631 7.297 1.00 0.00 H new ATOM 0 HG11 VAL A 615 8.265 4.116 9.347 1.00 0.00 H new ATOM 0 HG12 VAL A 615 7.487 2.517 9.419 1.00 0.00 H new ATOM 0 HG13 VAL A 615 9.231 2.644 9.085 1.00 0.00 H new ATOM 0 HG21 VAL A 615 8.993 5.053 7.185 1.00 0.00 H new ATOM 0 HG22 VAL A 615 9.986 3.616 6.844 1.00 0.00 H new ATOM 0 HG23 VAL A 615 8.748 4.139 5.678 1.00 0.00 H new ATOM 628 N PHE A 616 7.516 0.141 8.556 1.00 0.00 N ATOM 629 CA PHE A 616 6.715 -0.815 9.312 1.00 0.00 C ATOM 630 C PHE A 616 6.940 -0.656 10.811 1.00 0.00 C ATOM 631 O PHE A 616 8.052 -0.371 11.255 1.00 0.00 O ATOM 632 CB PHE A 616 7.040 -2.245 8.880 1.00 0.00 C ATOM 633 CG PHE A 616 6.705 -2.535 7.444 1.00 0.00 C ATOM 634 CD1 PHE A 616 5.412 -2.866 7.071 1.00 0.00 C ATOM 635 CD2 PHE A 616 7.685 -2.477 6.464 1.00 0.00 C ATOM 636 CE1 PHE A 616 5.102 -3.134 5.752 1.00 0.00 C ATOM 637 CE2 PHE A 616 7.378 -2.743 5.142 1.00 0.00 C ATOM 638 CZ PHE A 616 6.087 -3.072 4.787 1.00 0.00 C ATOM 0 H PHE A 616 8.500 0.172 8.824 1.00 0.00 H new ATOM 0 HA PHE A 616 5.665 -0.612 9.101 1.00 0.00 H new ATOM 0 HB2 PHE A 616 8.102 -2.431 9.040 1.00 0.00 H new ATOM 0 HB3 PHE A 616 6.495 -2.940 9.518 1.00 0.00 H new ATOM 0 HD1 PHE A 616 4.637 -2.915 7.821 1.00 0.00 H new ATOM 0 HD2 PHE A 616 8.698 -2.221 6.736 1.00 0.00 H new ATOM 0 HE1 PHE A 616 4.090 -3.392 5.476 1.00 0.00 H new ATOM 0 HE2 PHE A 616 8.149 -2.693 4.388 1.00 0.00 H new ATOM 0 HZ PHE A 616 5.847 -3.281 3.755 1.00 0.00 H new ATOM 648 N GLN A 617 5.878 -0.844 11.586 1.00 0.00 N ATOM 649 CA GLN A 617 5.966 -0.762 13.039 1.00 0.00 C ATOM 650 C GLN A 617 6.024 -2.148 13.667 1.00 0.00 C ATOM 651 O GLN A 617 5.670 -3.143 13.033 1.00 0.00 O ATOM 652 CB GLN A 617 4.772 0.012 13.606 1.00 0.00 C ATOM 653 CG GLN A 617 4.704 1.463 13.163 1.00 0.00 C ATOM 654 CD GLN A 617 3.472 2.172 13.693 1.00 0.00 C ATOM 655 OE1 GLN A 617 2.685 1.598 14.450 1.00 0.00 O ATOM 656 NE2 GLN A 617 3.294 3.426 13.292 1.00 0.00 N ATOM 0 H GLN A 617 4.945 -1.054 11.232 1.00 0.00 H new ATOM 0 HA GLN A 617 6.887 -0.233 13.285 1.00 0.00 H new ATOM 0 HB2 GLN A 617 3.852 -0.491 13.307 1.00 0.00 H new ATOM 0 HB3 GLN A 617 4.815 -0.022 14.695 1.00 0.00 H new ATOM 0 HG2 GLN A 617 5.597 1.987 13.505 1.00 0.00 H new ATOM 0 HG3 GLN A 617 4.706 1.508 12.074 1.00 0.00 H new ATOM 0 HE21 GLN A 617 3.970 3.862 12.665 1.00 0.00 H new ATOM 0 HE22 GLN A 617 2.481 3.953 13.611 1.00 0.00 H new ATOM 665 N PRO A 618 6.474 -2.209 14.916 1.00 0.00 N ATOM 666 CA PRO A 618 6.497 -3.461 15.662 1.00 0.00 C ATOM 667 C PRO A 618 5.133 -4.139 15.643 1.00 0.00 C ATOM 668 O PRO A 618 4.136 -3.562 16.077 1.00 0.00 O ATOM 669 CB PRO A 618 6.914 -3.046 17.077 1.00 0.00 C ATOM 670 CG PRO A 618 7.732 -1.816 16.877 1.00 0.00 C ATOM 671 CD PRO A 618 7.058 -1.065 15.760 1.00 0.00 C ATOM 0 HA PRO A 618 7.181 -4.194 15.235 1.00 0.00 H new ATOM 0 HB2 PRO A 618 6.045 -2.848 17.705 1.00 0.00 H new ATOM 0 HB3 PRO A 618 7.490 -3.831 17.568 1.00 0.00 H new ATOM 0 HG2 PRO A 618 7.769 -1.217 17.787 1.00 0.00 H new ATOM 0 HG3 PRO A 618 8.761 -2.066 16.618 1.00 0.00 H new ATOM 0 HD2 PRO A 618 6.283 -0.393 16.129 1.00 0.00 H new ATOM 0 HD3 PRO A 618 7.763 -0.458 15.193 1.00 0.00 H new ATOM 679 N GLY A 619 5.095 -5.366 15.136 1.00 0.00 N ATOM 680 CA GLY A 619 3.861 -6.142 15.098 1.00 0.00 C ATOM 681 C GLY A 619 3.181 -6.028 13.740 1.00 0.00 C ATOM 682 O GLY A 619 2.309 -6.828 13.402 1.00 0.00 O ATOM 0 H GLY A 619 5.906 -5.845 14.745 1.00 0.00 H new ATOM 0 HA2 GLY A 619 4.079 -7.188 15.312 1.00 0.00 H new ATOM 0 HA3 GLY A 619 3.184 -5.792 15.877 1.00 0.00 H new ATOM 686 N ASP A 620 3.585 -5.028 12.963 1.00 0.00 N ATOM 687 CA ASP A 620 3.006 -4.800 11.645 1.00 0.00 C ATOM 688 C ASP A 620 3.421 -5.889 10.665 1.00 0.00 C ATOM 689 O ASP A 620 4.605 -6.198 10.529 1.00 0.00 O ATOM 690 CB ASP A 620 3.417 -3.426 11.109 1.00 0.00 C ATOM 691 CG ASP A 620 2.685 -3.000 9.844 1.00 0.00 C ATOM 692 OD1 ASP A 620 1.900 -3.772 9.346 1.00 0.00 O ATOM 693 OD2 ASP A 620 2.796 -1.855 9.475 1.00 0.00 O ATOM 0 H ASP A 620 4.312 -4.362 13.224 1.00 0.00 H new ATOM 0 HA ASP A 620 1.921 -4.830 11.748 1.00 0.00 H new ATOM 0 HB2 ASP A 620 3.242 -2.680 11.884 1.00 0.00 H new ATOM 0 HB3 ASP A 620 4.489 -3.433 10.909 1.00 0.00 H new ATOM 698 N TYR A 621 2.439 -6.469 9.982 1.00 0.00 N ATOM 699 CA TYR A 621 2.694 -7.566 9.057 1.00 0.00 C ATOM 700 C TYR A 621 3.146 -7.047 7.698 1.00 0.00 C ATOM 701 O TYR A 621 2.604 -6.068 7.185 1.00 0.00 O ATOM 702 CB TYR A 621 1.443 -8.433 8.897 1.00 0.00 C ATOM 703 CG TYR A 621 1.193 -9.368 10.060 1.00 0.00 C ATOM 704 CD1 TYR A 621 0.488 -8.943 11.177 1.00 0.00 C ATOM 705 CD2 TYR A 621 1.660 -10.673 10.036 1.00 0.00 C ATOM 706 CE1 TYR A 621 0.257 -9.792 12.242 1.00 0.00 C ATOM 707 CE2 TYR A 621 1.435 -11.532 11.095 1.00 0.00 C ATOM 708 CZ TYR A 621 0.732 -11.087 12.196 1.00 0.00 C ATOM 709 OH TYR A 621 0.504 -11.938 13.253 1.00 0.00 O ATOM 0 H TYR A 621 1.459 -6.197 10.052 1.00 0.00 H new ATOM 0 HA TYR A 621 3.497 -8.174 9.475 1.00 0.00 H new ATOM 0 HB2 TYR A 621 0.576 -7.784 8.773 1.00 0.00 H new ATOM 0 HB3 TYR A 621 1.535 -9.021 7.984 1.00 0.00 H new ATOM 0 HD1 TYR A 621 0.113 -7.931 11.214 1.00 0.00 H new ATOM 0 HD2 TYR A 621 2.209 -11.024 9.175 1.00 0.00 H new ATOM 0 HE1 TYR A 621 -0.292 -9.445 13.105 1.00 0.00 H new ATOM 0 HE2 TYR A 621 1.807 -12.545 11.061 1.00 0.00 H new ATOM 0 HH TYR A 621 0.903 -12.812 13.061 1.00 0.00 H new ATOM 719 N ILE A 622 4.143 -7.708 7.119 1.00 0.00 N ATOM 720 CA ILE A 622 4.635 -7.348 5.795 1.00 0.00 C ATOM 721 C ILE A 622 4.101 -8.298 4.731 1.00 0.00 C ATOM 722 O ILE A 622 3.662 -7.869 3.665 1.00 0.00 O ATOM 723 CB ILE A 622 6.174 -7.347 5.745 1.00 0.00 C ATOM 724 CG1 ILE A 622 6.741 -6.360 6.768 1.00 0.00 C ATOM 725 CG2 ILE A 622 6.660 -7.005 4.345 1.00 0.00 C ATOM 726 CD1 ILE A 622 8.226 -6.515 7.008 1.00 0.00 C ATOM 0 H ILE A 622 4.627 -8.497 7.547 1.00 0.00 H new ATOM 0 HA ILE A 622 4.274 -6.340 5.590 1.00 0.00 H new ATOM 0 HB ILE A 622 6.530 -8.346 5.997 1.00 0.00 H new ATOM 0 HG12 ILE A 622 6.542 -5.344 6.428 1.00 0.00 H new ATOM 0 HG13 ILE A 622 6.214 -6.489 7.714 1.00 0.00 H new ATOM 0 HG21 ILE A 622 7.750 -7.009 4.327 1.00 0.00 H new ATOM 0 HG22 ILE A 622 6.283 -7.744 3.638 1.00 0.00 H new ATOM 0 HG23 ILE A 622 6.296 -6.017 4.065 1.00 0.00 H new ATOM 0 HD11 ILE A 622 8.554 -5.781 7.744 1.00 0.00 H new ATOM 0 HD12 ILE A 622 8.432 -7.519 7.379 1.00 0.00 H new ATOM 0 HD13 ILE A 622 8.764 -6.356 6.073 1.00 0.00 H new ATOM 738 N ILE A 623 4.142 -9.593 5.028 1.00 0.00 N ATOM 739 CA ILE A 623 3.621 -10.605 4.116 1.00 0.00 C ATOM 740 C ILE A 623 2.681 -11.563 4.836 1.00 0.00 C ATOM 741 O ILE A 623 2.943 -11.972 5.967 1.00 0.00 O ATOM 742 CB ILE A 623 4.757 -11.410 3.459 1.00 0.00 C ATOM 743 CG1 ILE A 623 5.624 -10.498 2.588 1.00 0.00 C ATOM 744 CG2 ILE A 623 4.188 -12.555 2.634 1.00 0.00 C ATOM 745 CD1 ILE A 623 6.784 -11.207 1.926 1.00 0.00 C ATOM 0 H ILE A 623 4.531 -9.966 5.894 1.00 0.00 H new ATOM 0 HA ILE A 623 3.068 -10.075 3.340 1.00 0.00 H new ATOM 0 HB ILE A 623 5.383 -11.831 4.245 1.00 0.00 H new ATOM 0 HG12 ILE A 623 4.999 -10.046 1.818 1.00 0.00 H new ATOM 0 HG13 ILE A 623 6.010 -9.685 3.202 1.00 0.00 H new ATOM 0 HG21 ILE A 623 5.004 -13.114 2.176 1.00 0.00 H new ATOM 0 HG22 ILE A 623 3.612 -13.217 3.280 1.00 0.00 H new ATOM 0 HG23 ILE A 623 3.540 -12.155 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 623 7.351 -10.495 1.326 1.00 0.00 H new ATOM 0 HD12 ILE A 623 7.433 -11.635 2.690 1.00 0.00 H new ATOM 0 HD13 ILE A 623 6.406 -12.002 1.284 1.00 0.00 H new ATOM 757 N ARG A 624 1.586 -11.919 4.173 1.00 0.00 N ATOM 758 CA ARG A 624 0.638 -12.882 4.720 1.00 0.00 C ATOM 759 C ARG A 624 0.752 -14.228 4.017 1.00 0.00 C ATOM 760 O ARG A 624 0.937 -14.291 2.802 1.00 0.00 O ATOM 761 CB ARG A 624 -0.791 -12.359 4.694 1.00 0.00 C ATOM 762 CG ARG A 624 -1.033 -11.115 5.534 1.00 0.00 C ATOM 763 CD ARG A 624 -1.286 -11.387 6.972 1.00 0.00 C ATOM 764 NE ARG A 624 -1.672 -10.219 7.747 1.00 0.00 N ATOM 765 CZ ARG A 624 -1.914 -10.226 9.073 1.00 0.00 C ATOM 766 NH1 ARG A 624 -1.849 -11.341 9.767 1.00 0.00 N ATOM 767 NH2 ARG A 624 -2.242 -9.086 9.653 1.00 0.00 N ATOM 0 H ARG A 624 1.333 -11.554 3.255 1.00 0.00 H new ATOM 0 HA ARG A 624 0.900 -13.030 5.768 1.00 0.00 H new ATOM 0 HB2 ARG A 624 -1.064 -12.141 3.661 1.00 0.00 H new ATOM 0 HB3 ARG A 624 -1.458 -13.149 5.040 1.00 0.00 H new ATOM 0 HG2 ARG A 624 -0.167 -10.459 5.448 1.00 0.00 H new ATOM 0 HG3 ARG A 624 -1.885 -10.574 5.123 1.00 0.00 H new ATOM 0 HD2 ARG A 624 -2.072 -12.138 7.054 1.00 0.00 H new ATOM 0 HD3 ARG A 624 -0.386 -11.818 7.411 1.00 0.00 H new ATOM 0 HE ARG A 624 -1.766 -9.332 7.253 1.00 0.00 H new ATOM 0 HH11 ARG A 624 -1.613 -12.218 9.302 1.00 0.00 H new ATOM 0 HH12 ARG A 624 -2.035 -11.329 10.770 1.00 0.00 H new ATOM 0 HH21 ARG A 624 -2.306 -8.232 9.099 1.00 0.00 H new ATOM 0 HH22 ARG A 624 -2.431 -9.059 10.655 1.00 0.00 H new ATOM 781 N GLU A 625 0.641 -15.304 4.789 1.00 0.00 N ATOM 782 CA GLU A 625 0.689 -16.652 4.236 1.00 0.00 C ATOM 783 C GLU A 625 -0.577 -16.972 3.452 1.00 0.00 C ATOM 784 O GLU A 625 -1.687 -16.694 3.907 1.00 0.00 O ATOM 785 CB GLU A 625 0.892 -17.682 5.350 1.00 0.00 C ATOM 786 CG GLU A 625 1.021 -19.118 4.863 1.00 0.00 C ATOM 787 CD GLU A 625 1.258 -20.064 6.007 1.00 0.00 C ATOM 788 OE1 GLU A 625 1.295 -19.614 7.127 1.00 0.00 O ATOM 789 OE2 GLU A 625 1.291 -21.249 5.775 1.00 0.00 O ATOM 0 H GLU A 625 0.517 -15.268 5.801 1.00 0.00 H new ATOM 0 HA GLU A 625 1.535 -16.700 3.551 1.00 0.00 H new ATOM 0 HB2 GLU A 625 1.789 -17.420 5.912 1.00 0.00 H new ATOM 0 HB3 GLU A 625 0.053 -17.620 6.043 1.00 0.00 H new ATOM 0 HG2 GLU A 625 0.114 -19.407 4.332 1.00 0.00 H new ATOM 0 HG3 GLU A 625 1.844 -19.191 4.152 1.00 0.00 H new ATOM 796 N GLY A 626 -0.405 -17.558 2.272 1.00 0.00 N ATOM 797 CA GLY A 626 -1.535 -17.993 1.461 1.00 0.00 C ATOM 798 C GLY A 626 -2.016 -16.878 0.542 1.00 0.00 C ATOM 799 O GLY A 626 -3.096 -16.965 -0.043 1.00 0.00 O ATOM 0 H GLY A 626 0.508 -17.743 1.856 1.00 0.00 H new ATOM 0 HA2 GLY A 626 -1.246 -18.859 0.866 1.00 0.00 H new ATOM 0 HA3 GLY A 626 -2.351 -18.310 2.110 1.00 0.00 H new ATOM 803 N THR A 627 -1.209 -15.830 0.419 1.00 0.00 N ATOM 804 CA THR A 627 -1.542 -14.703 -0.445 1.00 0.00 C ATOM 805 C THR A 627 -0.522 -14.549 -1.566 1.00 0.00 C ATOM 806 O THR A 627 0.563 -15.129 -1.516 1.00 0.00 O ATOM 807 CB THR A 627 -1.620 -13.386 0.349 1.00 0.00 C ATOM 808 OG1 THR A 627 -0.319 -13.047 0.847 1.00 0.00 O ATOM 809 CG2 THR A 627 -2.585 -13.524 1.516 1.00 0.00 C ATOM 0 H THR A 627 -0.318 -15.737 0.907 1.00 0.00 H new ATOM 0 HA THR A 627 -2.521 -14.915 -0.875 1.00 0.00 H new ATOM 0 HB THR A 627 -1.979 -12.600 -0.315 1.00 0.00 H new ATOM 0 HG1 THR A 627 -0.091 -13.638 1.595 1.00 0.00 H new ATOM 0 HG21 THR A 627 -2.628 -12.584 2.066 1.00 0.00 H new ATOM 0 HG22 THR A 627 -3.578 -13.770 1.140 1.00 0.00 H new ATOM 0 HG23 THR A 627 -2.242 -14.318 2.180 1.00 0.00 H new ATOM 817 N ILE A 628 -0.876 -13.763 -2.577 1.00 0.00 N ATOM 818 CA ILE A 628 -0.005 -13.554 -3.727 1.00 0.00 C ATOM 819 C ILE A 628 1.257 -12.798 -3.331 1.00 0.00 C ATOM 820 O ILE A 628 1.189 -11.752 -2.686 1.00 0.00 O ATOM 821 CB ILE A 628 -0.724 -12.782 -4.848 1.00 0.00 C ATOM 822 CG1 ILE A 628 -1.892 -13.605 -5.398 1.00 0.00 C ATOM 823 CG2 ILE A 628 0.251 -12.429 -5.960 1.00 0.00 C ATOM 824 CD1 ILE A 628 -2.789 -12.837 -6.342 1.00 0.00 C ATOM 0 H ILE A 628 -1.762 -13.259 -2.623 1.00 0.00 H new ATOM 0 HA ILE A 628 0.268 -14.542 -4.098 1.00 0.00 H new ATOM 0 HB ILE A 628 -1.121 -11.856 -4.432 1.00 0.00 H new ATOM 0 HG12 ILE A 628 -1.496 -14.478 -5.917 1.00 0.00 H new ATOM 0 HG13 ILE A 628 -2.489 -13.974 -4.564 1.00 0.00 H new ATOM 0 HG21 ILE A 628 -0.274 -11.884 -6.744 1.00 0.00 H new ATOM 0 HG22 ILE A 628 1.051 -11.807 -5.559 1.00 0.00 H new ATOM 0 HG23 ILE A 628 0.676 -13.343 -6.375 1.00 0.00 H new ATOM 0 HD11 ILE A 628 -3.593 -13.486 -6.689 1.00 0.00 H new ATOM 0 HD12 ILE A 628 -3.215 -11.979 -5.822 1.00 0.00 H new ATOM 0 HD13 ILE A 628 -2.207 -12.491 -7.196 1.00 0.00 H new ATOM 836 N GLY A 629 2.409 -13.334 -3.721 1.00 0.00 N ATOM 837 CA GLY A 629 3.689 -12.707 -3.414 1.00 0.00 C ATOM 838 C GLY A 629 4.530 -12.528 -4.671 1.00 0.00 C ATOM 839 O GLY A 629 5.051 -13.497 -5.224 1.00 0.00 O ATOM 0 H GLY A 629 2.482 -14.202 -4.251 1.00 0.00 H new ATOM 0 HA2 GLY A 629 3.519 -11.737 -2.946 1.00 0.00 H new ATOM 0 HA3 GLY A 629 4.233 -13.318 -2.693 1.00 0.00 H new ATOM 843 N LYS A 630 4.660 -11.284 -5.118 1.00 0.00 N ATOM 844 CA LYS A 630 5.416 -10.979 -6.327 1.00 0.00 C ATOM 845 C LYS A 630 6.211 -9.689 -6.170 1.00 0.00 C ATOM 846 O LYS A 630 6.404 -8.947 -7.132 1.00 0.00 O ATOM 847 CB LYS A 630 4.480 -10.877 -7.532 1.00 0.00 C ATOM 848 CG LYS A 630 3.425 -9.784 -7.418 1.00 0.00 C ATOM 849 CD LYS A 630 2.455 -9.826 -8.590 1.00 0.00 C ATOM 850 CE LYS A 630 1.327 -8.821 -8.412 1.00 0.00 C ATOM 851 NZ LYS A 630 1.809 -7.418 -8.519 1.00 0.00 N ATOM 0 H LYS A 630 4.251 -10.469 -4.660 1.00 0.00 H new ATOM 0 HA LYS A 630 6.120 -11.794 -6.494 1.00 0.00 H new ATOM 0 HB2 LYS A 630 5.077 -10.697 -8.426 1.00 0.00 H new ATOM 0 HB3 LYS A 630 3.979 -11.835 -7.670 1.00 0.00 H new ATOM 0 HG2 LYS A 630 2.875 -9.902 -6.484 1.00 0.00 H new ATOM 0 HG3 LYS A 630 3.911 -8.809 -7.380 1.00 0.00 H new ATOM 0 HD2 LYS A 630 2.991 -9.614 -9.515 1.00 0.00 H new ATOM 0 HD3 LYS A 630 2.039 -10.829 -8.685 1.00 0.00 H new ATOM 0 HE2 LYS A 630 0.560 -8.999 -9.166 1.00 0.00 H new ATOM 0 HE3 LYS A 630 0.859 -8.970 -7.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 630 1.002 -6.767 -8.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 630 2.484 -7.224 -7.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 630 2.278 -7.281 -9.437 1.00 0.00 H new ATOM 865 N LYS A 631 6.669 -9.428 -4.951 1.00 0.00 N ATOM 866 CA LYS A 631 7.522 -8.276 -4.684 1.00 0.00 C ATOM 867 C LYS A 631 8.766 -8.681 -3.903 1.00 0.00 C ATOM 868 O LYS A 631 8.692 -9.480 -2.969 1.00 0.00 O ATOM 869 CB LYS A 631 6.748 -7.202 -3.919 1.00 0.00 C ATOM 870 CG LYS A 631 5.576 -6.604 -4.687 1.00 0.00 C ATOM 871 CD LYS A 631 4.873 -5.527 -3.875 1.00 0.00 C ATOM 872 CE LYS A 631 3.655 -4.986 -4.608 1.00 0.00 C ATOM 873 NZ LYS A 631 2.936 -3.956 -3.809 1.00 0.00 N ATOM 0 H LYS A 631 6.464 -9.999 -4.131 1.00 0.00 H new ATOM 0 HA LYS A 631 7.840 -7.867 -5.643 1.00 0.00 H new ATOM 0 HB2 LYS A 631 6.376 -7.632 -2.989 1.00 0.00 H new ATOM 0 HB3 LYS A 631 7.435 -6.401 -3.647 1.00 0.00 H new ATOM 0 HG2 LYS A 631 5.932 -6.180 -5.626 1.00 0.00 H new ATOM 0 HG3 LYS A 631 4.866 -7.391 -4.942 1.00 0.00 H new ATOM 0 HD2 LYS A 631 4.568 -5.936 -2.912 1.00 0.00 H new ATOM 0 HD3 LYS A 631 5.568 -4.712 -3.670 1.00 0.00 H new ATOM 0 HE2 LYS A 631 3.966 -4.555 -5.559 1.00 0.00 H new ATOM 0 HE3 LYS A 631 2.975 -5.807 -4.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 631 2.113 -3.613 -4.344 1.00 0.00 H new ATOM 0 HZ2 LYS A 631 2.616 -4.374 -2.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 631 3.576 -3.160 -3.612 1.00 0.00 H new ATOM 887 N MET A 632 9.909 -8.124 -4.290 1.00 0.00 N ATOM 888 CA MET A 632 11.115 -8.205 -3.475 1.00 0.00 C ATOM 889 C MET A 632 11.072 -7.205 -2.326 1.00 0.00 C ATOM 890 O MET A 632 10.539 -6.104 -2.469 1.00 0.00 O ATOM 891 CB MET A 632 12.352 -7.966 -4.338 1.00 0.00 C ATOM 892 CG MET A 632 12.698 -9.114 -5.275 1.00 0.00 C ATOM 893 SD MET A 632 13.150 -10.621 -4.392 1.00 0.00 S ATOM 894 CE MET A 632 14.627 -10.080 -3.536 1.00 0.00 C ATOM 0 H MET A 632 10.025 -7.611 -5.164 1.00 0.00 H new ATOM 0 HA MET A 632 11.167 -9.207 -3.048 1.00 0.00 H new ATOM 0 HB2 MET A 632 12.198 -7.064 -4.930 1.00 0.00 H new ATOM 0 HB3 MET A 632 13.204 -7.777 -3.685 1.00 0.00 H new ATOM 0 HG2 MET A 632 11.845 -9.319 -5.922 1.00 0.00 H new ATOM 0 HG3 MET A 632 13.524 -8.814 -5.921 1.00 0.00 H new ATOM 0 HE1 MET A 632 15.134 -10.943 -3.105 1.00 0.00 H new ATOM 0 HE2 MET A 632 15.294 -9.582 -4.240 1.00 0.00 H new ATOM 0 HE3 MET A 632 14.353 -9.385 -2.742 1.00 0.00 H new ATOM 904 N TYR A 633 11.636 -7.594 -1.188 1.00 0.00 N ATOM 905 CA TYR A 633 11.740 -6.701 -0.040 1.00 0.00 C ATOM 906 C TYR A 633 13.169 -6.641 0.483 1.00 0.00 C ATOM 907 O TYR A 633 13.774 -7.669 0.787 1.00 0.00 O ATOM 908 CB TYR A 633 10.792 -7.150 1.074 1.00 0.00 C ATOM 909 CG TYR A 633 9.329 -7.087 0.697 1.00 0.00 C ATOM 910 CD1 TYR A 633 8.588 -5.934 0.914 1.00 0.00 C ATOM 911 CD2 TYR A 633 8.692 -8.179 0.127 1.00 0.00 C ATOM 912 CE1 TYR A 633 7.251 -5.870 0.572 1.00 0.00 C ATOM 913 CE2 TYR A 633 7.355 -8.126 -0.220 1.00 0.00 C ATOM 914 CZ TYR A 633 6.638 -6.969 0.004 1.00 0.00 C ATOM 915 OH TYR A 633 5.307 -6.910 -0.338 1.00 0.00 O ATOM 0 H TYR A 633 12.029 -8.523 -1.036 1.00 0.00 H new ATOM 0 HA TYR A 633 11.455 -5.701 -0.368 1.00 0.00 H new ATOM 0 HB2 TYR A 633 11.040 -8.173 1.358 1.00 0.00 H new ATOM 0 HB3 TYR A 633 10.958 -6.526 1.952 1.00 0.00 H new ATOM 0 HD1 TYR A 633 9.064 -5.072 1.358 1.00 0.00 H new ATOM 0 HD2 TYR A 633 9.250 -9.087 -0.049 1.00 0.00 H new ATOM 0 HE1 TYR A 633 6.688 -4.965 0.748 1.00 0.00 H new ATOM 0 HE2 TYR A 633 6.875 -8.985 -0.664 1.00 0.00 H new ATOM 0 HH TYR A 633 5.031 -7.766 -0.727 1.00 0.00 H new ATOM 925 N PHE A 634 13.705 -5.429 0.586 1.00 0.00 N ATOM 926 CA PHE A 634 15.056 -5.230 1.098 1.00 0.00 C ATOM 927 C PHE A 634 15.044 -4.399 2.375 1.00 0.00 C ATOM 928 O PHE A 634 14.368 -3.373 2.453 1.00 0.00 O ATOM 929 CB PHE A 634 15.934 -4.558 0.041 1.00 0.00 C ATOM 930 CG PHE A 634 16.082 -5.357 -1.222 1.00 0.00 C ATOM 931 CD1 PHE A 634 17.032 -6.362 -1.317 1.00 0.00 C ATOM 932 CD2 PHE A 634 15.269 -5.106 -2.318 1.00 0.00 C ATOM 933 CE1 PHE A 634 17.170 -7.097 -2.479 1.00 0.00 C ATOM 934 CE2 PHE A 634 15.404 -5.841 -3.480 1.00 0.00 C ATOM 935 CZ PHE A 634 16.354 -6.836 -3.561 1.00 0.00 C ATOM 0 H PHE A 634 13.224 -4.569 0.321 1.00 0.00 H new ATOM 0 HA PHE A 634 15.472 -6.210 1.334 1.00 0.00 H new ATOM 0 HB2 PHE A 634 15.510 -3.584 -0.204 1.00 0.00 H new ATOM 0 HB3 PHE A 634 16.922 -4.378 0.464 1.00 0.00 H new ATOM 0 HD1 PHE A 634 17.672 -6.573 -0.473 1.00 0.00 H new ATOM 0 HD2 PHE A 634 14.522 -4.328 -2.262 1.00 0.00 H new ATOM 0 HE1 PHE A 634 17.916 -7.875 -2.540 1.00 0.00 H new ATOM 0 HE2 PHE A 634 14.764 -5.636 -4.326 1.00 0.00 H new ATOM 0 HZ PHE A 634 16.460 -7.410 -4.469 1.00 0.00 H new ATOM 945 N ILE A 635 15.796 -4.848 3.374 1.00 0.00 N ATOM 946 CA ILE A 635 15.758 -4.235 4.696 1.00 0.00 C ATOM 947 C ILE A 635 16.921 -3.270 4.888 1.00 0.00 C ATOM 948 O ILE A 635 18.081 -3.680 4.929 1.00 0.00 O ATOM 949 CB ILE A 635 15.794 -5.296 5.812 1.00 0.00 C ATOM 950 CG1 ILE A 635 14.632 -6.279 5.651 1.00 0.00 C ATOM 951 CG2 ILE A 635 15.747 -4.631 7.179 1.00 0.00 C ATOM 952 CD1 ILE A 635 14.767 -7.527 6.494 1.00 0.00 C ATOM 0 H ILE A 635 16.440 -5.635 3.293 1.00 0.00 H new ATOM 0 HA ILE A 635 14.819 -3.685 4.761 1.00 0.00 H new ATOM 0 HB ILE A 635 16.728 -5.852 5.733 1.00 0.00 H new ATOM 0 HG12 ILE A 635 13.702 -5.774 5.913 1.00 0.00 H new ATOM 0 HG13 ILE A 635 14.554 -6.567 4.603 1.00 0.00 H new ATOM 0 HG21 ILE A 635 15.773 -5.395 7.956 1.00 0.00 H new ATOM 0 HG22 ILE A 635 16.606 -3.969 7.291 1.00 0.00 H new ATOM 0 HG23 ILE A 635 14.828 -4.052 7.270 1.00 0.00 H new ATOM 0 HD11 ILE A 635 13.906 -8.174 6.326 1.00 0.00 H new ATOM 0 HD12 ILE A 635 15.679 -8.056 6.217 1.00 0.00 H new ATOM 0 HD13 ILE A 635 14.813 -7.251 7.548 1.00 0.00 H new ATOM 964 N GLN A 636 16.603 -1.985 5.006 1.00 0.00 N ATOM 965 CA GLN A 636 17.614 -0.965 5.257 1.00 0.00 C ATOM 966 C GLN A 636 17.823 -0.752 6.751 1.00 0.00 C ATOM 967 O GLN A 636 18.952 -0.580 7.211 1.00 0.00 O ATOM 968 CB GLN A 636 17.216 0.358 4.597 1.00 0.00 C ATOM 969 CG GLN A 636 18.257 1.457 4.728 1.00 0.00 C ATOM 970 CD GLN A 636 17.886 2.702 3.946 1.00 0.00 C ATOM 971 OE1 GLN A 636 16.889 3.366 4.245 1.00 0.00 O ATOM 972 NE2 GLN A 636 18.684 3.026 2.936 1.00 0.00 N ATOM 0 H GLN A 636 15.651 -1.625 4.932 1.00 0.00 H new ATOM 0 HA GLN A 636 18.551 -1.314 4.824 1.00 0.00 H new ATOM 0 HB2 GLN A 636 17.023 0.180 3.539 1.00 0.00 H new ATOM 0 HB3 GLN A 636 16.281 0.704 5.038 1.00 0.00 H new ATOM 0 HG2 GLN A 636 18.378 1.715 5.780 1.00 0.00 H new ATOM 0 HG3 GLN A 636 19.220 1.085 4.378 1.00 0.00 H new ATOM 0 HE21 GLN A 636 19.498 2.449 2.724 1.00 0.00 H new ATOM 0 HE22 GLN A 636 18.483 3.852 2.372 1.00 0.00 H new ATOM 981 N HIS A 637 16.729 -0.765 7.504 1.00 0.00 N ATOM 982 CA HIS A 637 16.799 -0.694 8.958 1.00 0.00 C ATOM 983 C HIS A 637 15.755 -1.595 9.605 1.00 0.00 C ATOM 984 O HIS A 637 14.695 -1.844 9.032 1.00 0.00 O ATOM 985 CB HIS A 637 16.615 0.749 9.439 1.00 0.00 C ATOM 986 CG HIS A 637 17.687 1.682 8.968 1.00 0.00 C ATOM 987 ND1 HIS A 637 18.985 1.617 9.429 1.00 0.00 N ATOM 988 CD2 HIS A 637 17.654 2.702 8.078 1.00 0.00 C ATOM 989 CE1 HIS A 637 19.705 2.557 8.842 1.00 0.00 C ATOM 990 NE2 HIS A 637 18.921 3.228 8.018 1.00 0.00 N ATOM 0 H HIS A 637 15.782 -0.824 7.130 1.00 0.00 H new ATOM 0 HA HIS A 637 17.787 -1.043 9.258 1.00 0.00 H new ATOM 0 HB2 HIS A 637 15.648 1.117 9.095 1.00 0.00 H new ATOM 0 HB3 HIS A 637 16.590 0.759 10.529 1.00 0.00 H new ATOM 0 HD2 HIS A 637 16.793 3.039 7.520 1.00 0.00 H new ATOM 0 HE1 HIS A 637 20.756 2.744 9.008 1.00 0.00 H new ATOM 0 HE2 HIS A 637 19.210 4.011 7.431 1.00 0.00 H new ATOM 998 N GLY A 638 16.062 -2.082 10.803 1.00 0.00 N ATOM 999 CA GLY A 638 15.067 -2.743 11.639 1.00 0.00 C ATOM 1000 C GLY A 638 15.174 -4.259 11.528 1.00 0.00 C ATOM 1001 O GLY A 638 15.965 -4.779 10.742 1.00 0.00 O ATOM 0 H GLY A 638 16.993 -2.031 11.217 1.00 0.00 H new ATOM 0 HA2 GLY A 638 15.202 -2.441 12.678 1.00 0.00 H new ATOM 0 HA3 GLY A 638 14.068 -2.423 11.342 1.00 0.00 H new ATOM 1005 N VAL A 639 14.372 -4.962 12.321 1.00 0.00 N ATOM 1006 CA VAL A 639 14.404 -6.420 12.344 1.00 0.00 C ATOM 1007 C VAL A 639 13.033 -7.006 12.032 1.00 0.00 C ATOM 1008 O VAL A 639 12.016 -6.532 12.537 1.00 0.00 O ATOM 1009 CB VAL A 639 14.882 -6.953 13.708 1.00 0.00 C ATOM 1010 CG1 VAL A 639 14.856 -8.474 13.723 1.00 0.00 C ATOM 1011 CG2 VAL A 639 16.280 -6.443 14.020 1.00 0.00 C ATOM 0 H VAL A 639 13.692 -4.545 12.957 1.00 0.00 H new ATOM 0 HA VAL A 639 15.111 -6.731 11.575 1.00 0.00 H new ATOM 0 HB VAL A 639 14.202 -6.587 14.478 1.00 0.00 H new ATOM 0 HG11 VAL A 639 15.197 -8.834 14.694 1.00 0.00 H new ATOM 0 HG12 VAL A 639 13.839 -8.822 13.543 1.00 0.00 H new ATOM 0 HG13 VAL A 639 15.514 -8.857 12.943 1.00 0.00 H new ATOM 0 HG21 VAL A 639 16.601 -6.830 14.987 1.00 0.00 H new ATOM 0 HG22 VAL A 639 16.971 -6.780 13.247 1.00 0.00 H new ATOM 0 HG23 VAL A 639 16.272 -5.353 14.050 1.00 0.00 H new ATOM 1021 N VAL A 640 13.013 -8.039 11.197 1.00 0.00 N ATOM 1022 CA VAL A 640 11.774 -8.730 10.863 1.00 0.00 C ATOM 1023 C VAL A 640 11.905 -10.232 11.081 1.00 0.00 C ATOM 1024 O VAL A 640 13.012 -10.768 11.130 1.00 0.00 O ATOM 1025 CB VAL A 640 11.356 -8.468 9.404 1.00 0.00 C ATOM 1026 CG1 VAL A 640 11.189 -6.976 9.157 1.00 0.00 C ATOM 1027 CG2 VAL A 640 12.378 -9.054 8.443 1.00 0.00 C ATOM 0 H VAL A 640 13.842 -8.416 10.739 1.00 0.00 H new ATOM 0 HA VAL A 640 11.006 -8.335 11.528 1.00 0.00 H new ATOM 0 HB VAL A 640 10.398 -8.957 9.228 1.00 0.00 H new ATOM 0 HG11 VAL A 640 10.894 -6.810 8.121 1.00 0.00 H new ATOM 0 HG12 VAL A 640 10.421 -6.581 9.821 1.00 0.00 H new ATOM 0 HG13 VAL A 640 12.133 -6.467 9.351 1.00 0.00 H new ATOM 0 HG21 VAL A 640 12.066 -8.859 7.417 1.00 0.00 H new ATOM 0 HG22 VAL A 640 13.350 -8.594 8.620 1.00 0.00 H new ATOM 0 HG23 VAL A 640 12.452 -10.130 8.602 1.00 0.00 H new ATOM 1037 N SER A 641 10.768 -10.907 11.213 1.00 0.00 N ATOM 1038 CA SER A 641 10.746 -12.363 11.289 1.00 0.00 C ATOM 1039 C SER A 641 10.057 -12.968 10.073 1.00 0.00 C ATOM 1040 O SER A 641 8.934 -12.595 9.734 1.00 0.00 O ATOM 1041 CB SER A 641 10.055 -12.808 12.564 1.00 0.00 C ATOM 1042 OG SER A 641 10.824 -12.534 13.703 1.00 0.00 O ATOM 0 H SER A 641 9.849 -10.468 11.270 1.00 0.00 H new ATOM 0 HA SER A 641 11.776 -12.718 11.301 1.00 0.00 H new ATOM 0 HB2 SER A 641 9.091 -12.305 12.648 1.00 0.00 H new ATOM 0 HB3 SER A 641 9.853 -13.878 12.512 1.00 0.00 H new ATOM 0 HG SER A 641 10.910 -11.564 13.814 1.00 0.00 H new ATOM 1048 N VAL A 642 10.736 -13.904 9.420 1.00 0.00 N ATOM 1049 CA VAL A 642 10.186 -14.571 8.246 1.00 0.00 C ATOM 1050 C VAL A 642 9.843 -16.025 8.548 1.00 0.00 C ATOM 1051 O VAL A 642 10.731 -16.849 8.767 1.00 0.00 O ATOM 1052 CB VAL A 642 11.163 -14.521 7.057 1.00 0.00 C ATOM 1053 CG1 VAL A 642 10.577 -15.246 5.854 1.00 0.00 C ATOM 1054 CG2 VAL A 642 11.494 -13.080 6.699 1.00 0.00 C ATOM 0 H VAL A 642 11.670 -14.219 9.684 1.00 0.00 H new ATOM 0 HA VAL A 642 9.276 -14.034 7.979 1.00 0.00 H new ATOM 0 HB VAL A 642 12.085 -15.025 7.348 1.00 0.00 H new ATOM 0 HG11 VAL A 642 11.281 -15.200 5.023 1.00 0.00 H new ATOM 0 HG12 VAL A 642 10.389 -16.288 6.113 1.00 0.00 H new ATOM 0 HG13 VAL A 642 9.641 -14.770 5.563 1.00 0.00 H new ATOM 0 HG21 VAL A 642 12.186 -13.064 5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 642 10.579 -12.553 6.427 1.00 0.00 H new ATOM 0 HG23 VAL A 642 11.955 -12.589 7.556 1.00 0.00 H new ATOM 1064 N LEU A 643 8.551 -16.333 8.557 1.00 0.00 N ATOM 1065 CA LEU A 643 8.086 -17.674 8.891 1.00 0.00 C ATOM 1066 C LEU A 643 7.574 -18.403 7.656 1.00 0.00 C ATOM 1067 O LEU A 643 6.635 -17.952 7.001 1.00 0.00 O ATOM 1068 CB LEU A 643 6.989 -17.603 9.962 1.00 0.00 C ATOM 1069 CG LEU A 643 6.384 -18.953 10.367 1.00 0.00 C ATOM 1070 CD1 LEU A 643 7.447 -19.827 11.020 1.00 0.00 C ATOM 1071 CD2 LEU A 643 5.217 -18.724 11.315 1.00 0.00 C ATOM 0 H LEU A 643 7.806 -15.672 8.337 1.00 0.00 H new ATOM 0 HA LEU A 643 8.932 -18.237 9.286 1.00 0.00 H new ATOM 0 HB2 LEU A 643 7.402 -17.126 10.851 1.00 0.00 H new ATOM 0 HB3 LEU A 643 6.189 -16.959 9.598 1.00 0.00 H new ATOM 0 HG LEU A 643 6.018 -19.468 9.479 1.00 0.00 H new ATOM 0 HD11 LEU A 643 7.008 -20.783 11.304 1.00 0.00 H new ATOM 0 HD12 LEU A 643 8.261 -19.997 10.316 1.00 0.00 H new ATOM 0 HD13 LEU A 643 7.834 -19.327 11.908 1.00 0.00 H new ATOM 0 HD21 LEU A 643 4.788 -19.684 11.602 1.00 0.00 H new ATOM 0 HD22 LEU A 643 5.568 -18.203 12.205 1.00 0.00 H new ATOM 0 HD23 LEU A 643 4.457 -18.121 10.818 1.00 0.00 H new ATOM 1083 N THR A 644 8.198 -19.534 7.342 1.00 0.00 N ATOM 1084 CA THR A 644 7.827 -20.312 6.166 1.00 0.00 C ATOM 1085 C THR A 644 7.146 -21.616 6.562 1.00 0.00 C ATOM 1086 O THR A 644 7.571 -22.289 7.502 1.00 0.00 O ATOM 1087 CB THR A 644 9.052 -20.631 5.289 1.00 0.00 C ATOM 1088 OG1 THR A 644 9.660 -19.408 4.851 1.00 0.00 O ATOM 1089 CG2 THR A 644 8.641 -21.451 4.076 1.00 0.00 C ATOM 0 H THR A 644 8.963 -19.932 7.886 1.00 0.00 H new ATOM 0 HA THR A 644 7.131 -19.701 5.592 1.00 0.00 H new ATOM 0 HB THR A 644 9.763 -21.208 5.880 1.00 0.00 H new ATOM 0 HG1 THR A 644 10.440 -19.612 4.294 1.00 0.00 H new ATOM 0 HG21 THR A 644 9.520 -21.667 3.468 1.00 0.00 H new ATOM 0 HG22 THR A 644 8.189 -22.387 4.405 1.00 0.00 H new ATOM 0 HG23 THR A 644 7.919 -20.888 3.484 1.00 0.00 H new ATOM 1097 N LYS A 645 6.088 -21.969 5.840 1.00 0.00 N ATOM 1098 CA LYS A 645 5.293 -23.145 6.170 1.00 0.00 C ATOM 1099 C LYS A 645 6.166 -24.390 6.270 1.00 0.00 C ATOM 1100 O LYS A 645 6.821 -24.780 5.304 1.00 0.00 O ATOM 1101 CB LYS A 645 4.193 -23.357 5.128 1.00 0.00 C ATOM 1102 CG LYS A 645 3.250 -24.513 5.436 1.00 0.00 C ATOM 1103 CD LYS A 645 2.125 -24.596 4.414 1.00 0.00 C ATOM 1104 CE LYS A 645 1.209 -25.779 4.693 1.00 0.00 C ATOM 1105 NZ LYS A 645 0.034 -25.800 3.782 1.00 0.00 N ATOM 0 H LYS A 645 5.761 -21.456 5.021 1.00 0.00 H new ATOM 0 HA LYS A 645 4.832 -22.973 7.142 1.00 0.00 H new ATOM 0 HB2 LYS A 645 3.609 -22.441 5.042 1.00 0.00 H new ATOM 0 HB3 LYS A 645 4.657 -23.531 4.157 1.00 0.00 H new ATOM 0 HG2 LYS A 645 3.808 -25.449 5.442 1.00 0.00 H new ATOM 0 HG3 LYS A 645 2.829 -24.386 6.434 1.00 0.00 H new ATOM 0 HD2 LYS A 645 1.546 -23.673 4.432 1.00 0.00 H new ATOM 0 HD3 LYS A 645 2.546 -24.688 3.413 1.00 0.00 H new ATOM 0 HE2 LYS A 645 1.771 -26.707 4.582 1.00 0.00 H new ATOM 0 HE3 LYS A 645 0.866 -25.736 5.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 645 -0.564 -26.621 4.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 645 -0.517 -24.927 3.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 645 0.360 -25.867 2.797 1.00 0.00 H new ATOM 1119 N GLY A 646 6.170 -25.010 7.445 1.00 0.00 N ATOM 1120 CA GLY A 646 6.835 -26.294 7.631 1.00 0.00 C ATOM 1121 C GLY A 646 8.349 -26.129 7.675 1.00 0.00 C ATOM 1122 O GLY A 646 9.092 -27.102 7.545 1.00 0.00 O ATOM 0 H GLY A 646 5.720 -24.644 8.284 1.00 0.00 H new ATOM 0 HA2 GLY A 646 6.490 -26.755 8.557 1.00 0.00 H new ATOM 0 HA3 GLY A 646 6.563 -26.968 6.819 1.00 0.00 H new ATOM 1126 N ASN A 647 8.799 -24.893 7.857 1.00 0.00 N ATOM 1127 CA ASN A 647 10.226 -24.592 7.875 1.00 0.00 C ATOM 1128 C ASN A 647 10.586 -23.701 9.056 1.00 0.00 C ATOM 1129 O ASN A 647 9.735 -22.995 9.596 1.00 0.00 O ATOM 1130 CB ASN A 647 10.673 -23.948 6.575 1.00 0.00 C ATOM 1131 CG ASN A 647 10.739 -24.904 5.417 1.00 0.00 C ATOM 1132 OD1 ASN A 647 11.673 -25.705 5.300 1.00 0.00 O ATOM 1133 ND2 ASN A 647 9.798 -24.768 4.518 1.00 0.00 N ATOM 0 H ASN A 647 8.196 -24.082 7.994 1.00 0.00 H new ATOM 0 HA ASN A 647 10.754 -25.539 7.985 1.00 0.00 H new ATOM 0 HB2 ASN A 647 9.987 -23.138 6.327 1.00 0.00 H new ATOM 0 HB3 ASN A 647 11.656 -23.500 6.721 1.00 0.00 H new ATOM 0 HD21 ASN A 647 9.814 -25.338 3.673 1.00 0.00 H new ATOM 0 HD22 ASN A 647 9.048 -24.092 4.663 1.00 0.00 H new ATOM 1140 N LYS A 648 11.854 -23.738 9.453 1.00 0.00 N ATOM 1141 CA LYS A 648 12.329 -22.935 10.574 1.00 0.00 C ATOM 1142 C LYS A 648 12.239 -21.447 10.263 1.00 0.00 C ATOM 1143 O LYS A 648 12.583 -21.010 9.165 1.00 0.00 O ATOM 1144 CB LYS A 648 13.769 -23.311 10.929 1.00 0.00 C ATOM 1145 CG LYS A 648 14.330 -22.576 12.140 1.00 0.00 C ATOM 1146 CD LYS A 648 15.728 -23.066 12.484 1.00 0.00 C ATOM 1147 CE LYS A 648 16.282 -22.347 13.706 1.00 0.00 C ATOM 1148 NZ LYS A 648 17.648 -22.819 14.058 1.00 0.00 N ATOM 0 H LYS A 648 12.571 -24.316 9.015 1.00 0.00 H new ATOM 0 HA LYS A 648 11.687 -23.144 11.429 1.00 0.00 H new ATOM 0 HB2 LYS A 648 13.816 -24.384 11.116 1.00 0.00 H new ATOM 0 HB3 LYS A 648 14.407 -23.109 10.069 1.00 0.00 H new ATOM 0 HG2 LYS A 648 14.357 -21.505 11.938 1.00 0.00 H new ATOM 0 HG3 LYS A 648 13.670 -22.723 12.995 1.00 0.00 H new ATOM 0 HD2 LYS A 648 15.703 -24.139 12.671 1.00 0.00 H new ATOM 0 HD3 LYS A 648 16.391 -22.906 11.634 1.00 0.00 H new ATOM 0 HE2 LYS A 648 16.307 -21.274 13.515 1.00 0.00 H new ATOM 0 HE3 LYS A 648 15.614 -22.505 14.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 648 17.988 -22.304 14.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 648 17.621 -23.838 14.265 1.00 0.00 H new ATOM 0 HZ3 LYS A 648 18.292 -22.645 13.260 1.00 0.00 H new ATOM 1162 N GLU A 649 11.773 -20.671 11.236 1.00 0.00 N ATOM 1163 CA GLU A 649 11.668 -19.225 11.080 1.00 0.00 C ATOM 1164 C GLU A 649 13.043 -18.586 10.933 1.00 0.00 C ATOM 1165 O GLU A 649 13.983 -18.943 11.643 1.00 0.00 O ATOM 1166 CB GLU A 649 10.927 -18.610 12.269 1.00 0.00 C ATOM 1167 CG GLU A 649 10.614 -17.129 12.117 1.00 0.00 C ATOM 1168 CD GLU A 649 9.829 -16.613 13.291 1.00 0.00 C ATOM 1169 OE1 GLU A 649 10.346 -16.633 14.382 1.00 0.00 O ATOM 1170 OE2 GLU A 649 8.757 -16.095 13.082 1.00 0.00 O ATOM 0 H GLU A 649 11.462 -21.020 12.142 1.00 0.00 H new ATOM 0 HA GLU A 649 11.101 -19.028 10.170 1.00 0.00 H new ATOM 0 HB2 GLU A 649 9.994 -19.152 12.420 1.00 0.00 H new ATOM 0 HB3 GLU A 649 11.527 -18.752 13.168 1.00 0.00 H new ATOM 0 HG2 GLU A 649 11.543 -16.567 12.023 1.00 0.00 H new ATOM 0 HG3 GLU A 649 10.049 -16.967 11.199 1.00 0.00 H new ATOM 1177 N THR A 650 13.154 -17.639 10.008 1.00 0.00 N ATOM 1178 CA THR A 650 14.418 -16.957 9.757 1.00 0.00 C ATOM 1179 C THR A 650 14.366 -15.510 10.230 1.00 0.00 C ATOM 1180 O THR A 650 13.432 -14.776 9.910 1.00 0.00 O ATOM 1181 CB THR A 650 14.789 -16.985 8.263 1.00 0.00 C ATOM 1182 OG1 THR A 650 14.937 -18.344 7.830 1.00 0.00 O ATOM 1183 CG2 THR A 650 16.090 -16.236 8.022 1.00 0.00 C ATOM 0 H THR A 650 12.383 -17.326 9.419 1.00 0.00 H new ATOM 0 HA THR A 650 15.181 -17.493 10.321 1.00 0.00 H new ATOM 0 HB THR A 650 13.993 -16.501 7.698 1.00 0.00 H new ATOM 0 HG1 THR A 650 15.171 -18.361 6.879 1.00 0.00 H new ATOM 0 HG21 THR A 650 16.336 -16.267 6.961 1.00 0.00 H new ATOM 0 HG22 THR A 650 15.977 -15.199 8.339 1.00 0.00 H new ATOM 0 HG23 THR A 650 16.891 -16.705 8.594 1.00 0.00 H new ATOM 1191 N LYS A 651 15.376 -15.106 10.993 1.00 0.00 N ATOM 1192 CA LYS A 651 15.452 -13.742 11.503 1.00 0.00 C ATOM 1193 C LYS A 651 16.315 -12.866 10.604 1.00 0.00 C ATOM 1194 O LYS A 651 17.474 -13.183 10.339 1.00 0.00 O ATOM 1195 CB LYS A 651 16.003 -13.734 12.930 1.00 0.00 C ATOM 1196 CG LYS A 651 16.041 -12.358 13.581 1.00 0.00 C ATOM 1197 CD LYS A 651 16.630 -12.425 14.982 1.00 0.00 C ATOM 1198 CE LYS A 651 16.648 -11.054 15.643 1.00 0.00 C ATOM 1199 NZ LYS A 651 17.237 -11.102 17.008 1.00 0.00 N ATOM 0 H LYS A 651 16.154 -15.704 11.272 1.00 0.00 H new ATOM 0 HA LYS A 651 14.442 -13.332 11.511 1.00 0.00 H new ATOM 0 HB2 LYS A 651 15.395 -14.397 13.545 1.00 0.00 H new ATOM 0 HB3 LYS A 651 17.012 -14.146 12.919 1.00 0.00 H new ATOM 0 HG2 LYS A 651 16.633 -11.679 12.967 1.00 0.00 H new ATOM 0 HG3 LYS A 651 15.032 -11.947 13.628 1.00 0.00 H new ATOM 0 HD2 LYS A 651 16.047 -13.116 15.591 1.00 0.00 H new ATOM 0 HD3 LYS A 651 17.645 -12.820 14.933 1.00 0.00 H new ATOM 0 HE2 LYS A 651 17.220 -10.361 15.026 1.00 0.00 H new ATOM 0 HE3 LYS A 651 15.631 -10.666 15.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 17.230 -10.148 17.423 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 16.677 -11.743 17.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 18.216 -11.448 16.952 1.00 0.00 H new ATOM 1213 N LEU A 652 15.742 -11.762 10.137 1.00 0.00 N ATOM 1214 CA LEU A 652 16.439 -10.864 9.224 1.00 0.00 C ATOM 1215 C LEU A 652 16.516 -9.452 9.791 1.00 0.00 C ATOM 1216 O LEU A 652 15.627 -9.018 10.523 1.00 0.00 O ATOM 1217 CB LEU A 652 15.744 -10.852 7.857 1.00 0.00 C ATOM 1218 CG LEU A 652 15.642 -12.218 7.165 1.00 0.00 C ATOM 1219 CD1 LEU A 652 14.881 -12.082 5.853 1.00 0.00 C ATOM 1220 CD2 LEU A 652 17.038 -12.772 6.924 1.00 0.00 C ATOM 0 H LEU A 652 14.795 -11.467 10.376 1.00 0.00 H new ATOM 0 HA LEU A 652 17.457 -11.233 9.100 1.00 0.00 H new ATOM 0 HB2 LEU A 652 14.739 -10.450 7.982 1.00 0.00 H new ATOM 0 HB3 LEU A 652 16.282 -10.169 7.200 1.00 0.00 H new ATOM 0 HG LEU A 652 15.096 -12.911 7.806 1.00 0.00 H new ATOM 0 HD11 LEU A 652 14.814 -13.056 5.369 1.00 0.00 H new ATOM 0 HD12 LEU A 652 13.878 -11.705 6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 652 15.406 -11.387 5.198 1.00 0.00 H new ATOM 0 HD21 LEU A 652 16.965 -13.742 6.433 1.00 0.00 H new ATOM 0 HD22 LEU A 652 17.597 -12.085 6.289 1.00 0.00 H new ATOM 0 HD23 LEU A 652 17.554 -12.886 7.877 1.00 0.00 H new ATOM 1232 N ALA A 653 17.584 -8.739 9.449 1.00 0.00 N ATOM 1233 CA ALA A 653 17.841 -7.422 10.019 1.00 0.00 C ATOM 1234 C ALA A 653 18.439 -6.480 8.982 1.00 0.00 C ATOM 1235 O ALA A 653 18.471 -6.792 7.791 1.00 0.00 O ATOM 1236 CB ALA A 653 18.759 -7.537 11.227 1.00 0.00 C ATOM 0 H ALA A 653 18.286 -9.052 8.779 1.00 0.00 H new ATOM 0 HA ALA A 653 16.888 -7.003 10.342 1.00 0.00 H new ATOM 0 HB1 ALA A 653 18.941 -6.545 11.641 1.00 0.00 H new ATOM 0 HB2 ALA A 653 18.288 -8.165 11.983 1.00 0.00 H new ATOM 0 HB3 ALA A 653 19.706 -7.983 10.923 1.00 0.00 H new ATOM 1242 N ASP A 654 18.911 -5.326 9.441 1.00 0.00 N ATOM 1243 CA ASP A 654 19.585 -4.373 8.567 1.00 0.00 C ATOM 1244 C ASP A 654 20.584 -5.072 7.655 1.00 0.00 C ATOM 1245 O ASP A 654 21.515 -5.727 8.123 1.00 0.00 O ATOM 1246 CB ASP A 654 20.292 -3.295 9.393 1.00 0.00 C ATOM 1247 CG ASP A 654 21.010 -2.239 8.565 1.00 0.00 C ATOM 1248 OD1 ASP A 654 21.103 -2.408 7.372 1.00 0.00 O ATOM 1249 OD2 ASP A 654 21.321 -1.202 9.102 1.00 0.00 O ATOM 0 H ASP A 654 18.839 -5.028 10.414 1.00 0.00 H new ATOM 0 HA ASP A 654 18.827 -3.901 7.943 1.00 0.00 H new ATOM 0 HB2 ASP A 654 19.557 -2.802 10.030 1.00 0.00 H new ATOM 0 HB3 ASP A 654 21.015 -3.775 10.053 1.00 0.00 H new ATOM 1254 N GLY A 655 20.385 -4.930 6.349 1.00 0.00 N ATOM 1255 CA GLY A 655 21.306 -5.491 5.368 1.00 0.00 C ATOM 1256 C GLY A 655 20.780 -6.805 4.806 1.00 0.00 C ATOM 1257 O GLY A 655 21.374 -7.386 3.898 1.00 0.00 O ATOM 0 H GLY A 655 19.593 -4.430 5.945 1.00 0.00 H new ATOM 0 HA2 GLY A 655 21.455 -4.779 4.556 1.00 0.00 H new ATOM 0 HA3 GLY A 655 22.279 -5.654 5.831 1.00 0.00 H new ATOM 1261 N SER A 656 19.661 -7.270 5.352 1.00 0.00 N ATOM 1262 CA SER A 656 19.044 -8.510 4.896 1.00 0.00 C ATOM 1263 C SER A 656 17.941 -8.236 3.882 1.00 0.00 C ATOM 1264 O SER A 656 17.596 -7.083 3.622 1.00 0.00 O ATOM 1265 CB SER A 656 18.495 -9.285 6.078 1.00 0.00 C ATOM 1266 OG SER A 656 19.488 -9.580 7.021 1.00 0.00 O ATOM 0 H SER A 656 19.163 -6.806 6.112 1.00 0.00 H new ATOM 0 HA SER A 656 19.810 -9.109 4.404 1.00 0.00 H new ATOM 0 HB2 SER A 656 17.704 -8.706 6.554 1.00 0.00 H new ATOM 0 HB3 SER A 656 18.044 -10.212 5.725 1.00 0.00 H new ATOM 0 HG SER A 656 19.266 -10.418 7.478 1.00 0.00 H new ATOM 1272 N TYR A 657 17.389 -9.302 3.313 1.00 0.00 N ATOM 1273 CA TYR A 657 16.297 -9.180 2.355 1.00 0.00 C ATOM 1274 C TYR A 657 15.512 -10.481 2.246 1.00 0.00 C ATOM 1275 O TYR A 657 15.940 -11.520 2.749 1.00 0.00 O ATOM 1276 CB TYR A 657 16.832 -8.774 0.980 1.00 0.00 C ATOM 1277 CG TYR A 657 17.585 -9.874 0.266 1.00 0.00 C ATOM 1278 CD1 TYR A 657 18.925 -10.110 0.534 1.00 0.00 C ATOM 1279 CD2 TYR A 657 16.954 -10.673 -0.676 1.00 0.00 C ATOM 1280 CE1 TYR A 657 19.617 -11.113 -0.115 1.00 0.00 C ATOM 1281 CE2 TYR A 657 17.636 -11.680 -1.332 1.00 0.00 C ATOM 1282 CZ TYR A 657 18.969 -11.897 -1.048 1.00 0.00 C ATOM 1283 OH TYR A 657 19.655 -12.897 -1.698 1.00 0.00 O ATOM 0 H TYR A 657 17.681 -10.262 3.499 1.00 0.00 H new ATOM 0 HA TYR A 657 15.623 -8.403 2.716 1.00 0.00 H new ATOM 0 HB2 TYR A 657 15.997 -8.454 0.356 1.00 0.00 H new ATOM 0 HB3 TYR A 657 17.490 -7.913 1.097 1.00 0.00 H new ATOM 0 HD1 TYR A 657 19.436 -9.499 1.263 1.00 0.00 H new ATOM 0 HD2 TYR A 657 15.911 -10.505 -0.901 1.00 0.00 H new ATOM 0 HE1 TYR A 657 20.660 -11.283 0.106 1.00 0.00 H new ATOM 0 HE2 TYR A 657 17.129 -12.293 -2.062 1.00 0.00 H new ATOM 0 HH TYR A 657 19.143 -13.731 -1.648 1.00 0.00 H new ATOM 1293 N PHE A 658 14.360 -10.418 1.586 1.00 0.00 N ATOM 1294 CA PHE A 658 13.535 -11.601 1.371 1.00 0.00 C ATOM 1295 C PHE A 658 12.571 -11.395 0.209 1.00 0.00 C ATOM 1296 O PHE A 658 12.329 -10.266 -0.217 1.00 0.00 O ATOM 1297 CB PHE A 658 12.760 -11.951 2.642 1.00 0.00 C ATOM 1298 CG PHE A 658 11.917 -10.824 3.167 1.00 0.00 C ATOM 1299 CD1 PHE A 658 12.459 -9.869 4.014 1.00 0.00 C ATOM 1300 CD2 PHE A 658 10.580 -10.716 2.815 1.00 0.00 C ATOM 1301 CE1 PHE A 658 11.685 -8.833 4.499 1.00 0.00 C ATOM 1302 CE2 PHE A 658 9.803 -9.680 3.298 1.00 0.00 C ATOM 1303 CZ PHE A 658 10.355 -8.738 4.140 1.00 0.00 C ATOM 0 H PHE A 658 13.977 -9.559 1.191 1.00 0.00 H new ATOM 0 HA PHE A 658 14.198 -12.430 1.122 1.00 0.00 H new ATOM 0 HB2 PHE A 658 12.119 -12.809 2.441 1.00 0.00 H new ATOM 0 HB3 PHE A 658 13.466 -12.255 3.415 1.00 0.00 H new ATOM 0 HD1 PHE A 658 13.499 -9.936 4.298 1.00 0.00 H new ATOM 0 HD2 PHE A 658 10.141 -11.450 2.156 1.00 0.00 H new ATOM 0 HE1 PHE A 658 12.120 -8.097 5.159 1.00 0.00 H new ATOM 0 HE2 PHE A 658 8.763 -9.608 3.016 1.00 0.00 H new ATOM 0 HZ PHE A 658 9.749 -7.928 4.518 1.00 0.00 H new ATOM 1313 N GLY A 659 12.023 -12.494 -0.300 1.00 0.00 N ATOM 1314 CA GLY A 659 11.138 -12.443 -1.457 1.00 0.00 C ATOM 1315 C GLY A 659 11.785 -13.094 -2.673 1.00 0.00 C ATOM 1316 O GLY A 659 11.356 -12.878 -3.807 1.00 0.00 O ATOM 0 H GLY A 659 12.177 -13.431 0.072 1.00 0.00 H new ATOM 0 HA2 GLY A 659 10.201 -12.950 -1.225 1.00 0.00 H new ATOM 0 HA3 GLY A 659 10.891 -11.406 -1.684 1.00 0.00 H new ATOM 1320 N GLU A 660 12.819 -13.892 -2.431 1.00 0.00 N ATOM 1321 CA GLU A 660 13.553 -14.543 -3.509 1.00 0.00 C ATOM 1322 C GLU A 660 12.624 -15.370 -4.388 1.00 0.00 C ATOM 1323 O GLU A 660 12.809 -15.448 -5.603 1.00 0.00 O ATOM 1324 CB GLU A 660 14.666 -15.427 -2.942 1.00 0.00 C ATOM 1325 CG GLU A 660 15.831 -14.659 -2.333 1.00 0.00 C ATOM 1326 CD GLU A 660 16.856 -15.592 -1.753 1.00 0.00 C ATOM 1327 OE1 GLU A 660 16.611 -16.775 -1.730 1.00 0.00 O ATOM 1328 OE2 GLU A 660 17.931 -15.139 -1.436 1.00 0.00 O ATOM 0 H GLU A 660 13.168 -14.104 -1.496 1.00 0.00 H new ATOM 0 HA GLU A 660 14.000 -13.763 -4.126 1.00 0.00 H new ATOM 0 HB2 GLU A 660 14.241 -16.082 -2.181 1.00 0.00 H new ATOM 0 HB3 GLU A 660 15.046 -16.068 -3.738 1.00 0.00 H new ATOM 0 HG2 GLU A 660 16.295 -14.034 -3.095 1.00 0.00 H new ATOM 0 HG3 GLU A 660 15.462 -13.991 -1.554 1.00 0.00 H new ATOM 1335 N ILE A 661 11.624 -15.987 -3.767 1.00 0.00 N ATOM 1336 CA ILE A 661 10.652 -16.793 -4.495 1.00 0.00 C ATOM 1337 C ILE A 661 9.757 -15.923 -5.367 1.00 0.00 C ATOM 1338 O ILE A 661 9.259 -16.368 -6.401 1.00 0.00 O ATOM 1339 CB ILE A 661 9.773 -17.619 -3.537 1.00 0.00 C ATOM 1340 CG1 ILE A 661 10.608 -18.699 -2.844 1.00 0.00 C ATOM 1341 CG2 ILE A 661 8.608 -18.243 -4.289 1.00 0.00 C ATOM 1342 CD1 ILE A 661 9.894 -19.382 -1.700 1.00 0.00 C ATOM 0 H ILE A 661 11.466 -15.944 -2.760 1.00 0.00 H new ATOM 0 HA ILE A 661 11.220 -17.473 -5.129 1.00 0.00 H new ATOM 0 HB ILE A 661 9.371 -16.953 -2.774 1.00 0.00 H new ATOM 0 HG12 ILE A 661 10.897 -19.450 -3.580 1.00 0.00 H new ATOM 0 HG13 ILE A 661 11.528 -18.249 -2.469 1.00 0.00 H new ATOM 0 HG21 ILE A 661 7.997 -18.823 -3.597 1.00 0.00 H new ATOM 0 HG22 ILE A 661 8.001 -17.456 -4.737 1.00 0.00 H new ATOM 0 HG23 ILE A 661 8.990 -18.898 -5.073 1.00 0.00 H new ATOM 0 HD11 ILE A 661 10.549 -20.134 -1.259 1.00 0.00 H new ATOM 0 HD12 ILE A 661 9.629 -18.643 -0.944 1.00 0.00 H new ATOM 0 HD13 ILE A 661 8.988 -19.862 -2.071 1.00 0.00 H new ATOM 1354 N CYS A 662 9.556 -14.679 -4.945 1.00 0.00 N ATOM 1355 CA CYS A 662 8.616 -13.786 -5.611 1.00 0.00 C ATOM 1356 C CYS A 662 9.065 -13.475 -7.033 1.00 0.00 C ATOM 1357 O CYS A 662 8.252 -13.121 -7.887 1.00 0.00 O ATOM 1358 CB CYS A 662 8.670 -12.530 -4.742 1.00 0.00 C ATOM 1359 SG CYS A 662 8.057 -12.758 -3.055 1.00 0.00 S ATOM 0 H CYS A 662 10.033 -14.266 -4.143 1.00 0.00 H new ATOM 0 HA CYS A 662 7.616 -14.210 -5.705 1.00 0.00 H new ATOM 0 HB2 CYS A 662 9.701 -12.179 -4.696 1.00 0.00 H new ATOM 0 HB3 CYS A 662 8.087 -11.745 -5.224 1.00 0.00 H new ATOM 0 HG CYS A 662 8.341 -11.707 -2.344 1.00 0.00 H new ATOM 1365 N LEU A 663 10.363 -13.608 -7.280 1.00 0.00 N ATOM 1366 CA LEU A 663 10.917 -13.379 -8.609 1.00 0.00 C ATOM 1367 C LEU A 663 10.740 -14.602 -9.499 1.00 0.00 C ATOM 1368 O LEU A 663 10.815 -14.507 -10.724 1.00 0.00 O ATOM 1369 CB LEU A 663 12.401 -13.004 -8.507 1.00 0.00 C ATOM 1370 CG LEU A 663 12.689 -11.650 -7.845 1.00 0.00 C ATOM 1371 CD1 LEU A 663 14.190 -11.459 -7.679 1.00 0.00 C ATOM 1372 CD2 LEU A 663 12.092 -10.534 -8.689 1.00 0.00 C ATOM 0 H LEU A 663 11.052 -13.874 -6.576 1.00 0.00 H new ATOM 0 HA LEU A 663 10.372 -12.552 -9.064 1.00 0.00 H new ATOM 0 HB2 LEU A 663 12.918 -13.782 -7.946 1.00 0.00 H new ATOM 0 HB3 LEU A 663 12.827 -12.998 -9.510 1.00 0.00 H new ATOM 0 HG LEU A 663 12.231 -11.624 -6.856 1.00 0.00 H new ATOM 0 HD11 LEU A 663 14.384 -10.495 -7.208 1.00 0.00 H new ATOM 0 HD12 LEU A 663 14.591 -12.256 -7.053 1.00 0.00 H new ATOM 0 HD13 LEU A 663 14.671 -11.489 -8.657 1.00 0.00 H new ATOM 0 HD21 LEU A 663 12.297 -9.572 -8.218 1.00 0.00 H new ATOM 0 HD22 LEU A 663 12.536 -10.553 -9.684 1.00 0.00 H new ATOM 0 HD23 LEU A 663 11.014 -10.676 -8.770 1.00 0.00 H new ATOM 1384 N LEU A 664 10.504 -15.751 -8.876 1.00 0.00 N ATOM 1385 CA LEU A 664 10.424 -17.014 -9.601 1.00 0.00 C ATOM 1386 C LEU A 664 8.988 -17.516 -9.678 1.00 0.00 C ATOM 1387 O LEU A 664 8.657 -18.352 -10.518 1.00 0.00 O ATOM 1388 CB LEU A 664 11.322 -18.065 -8.935 1.00 0.00 C ATOM 1389 CG LEU A 664 12.805 -17.686 -8.832 1.00 0.00 C ATOM 1390 CD1 LEU A 664 13.569 -18.768 -8.081 1.00 0.00 C ATOM 1391 CD2 LEU A 664 13.378 -17.490 -10.227 1.00 0.00 C ATOM 0 H LEU A 664 10.365 -15.834 -7.869 1.00 0.00 H new ATOM 0 HA LEU A 664 10.774 -16.842 -10.619 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.943 -18.261 -7.932 1.00 0.00 H new ATOM 0 HB3 LEU A 664 11.240 -18.997 -9.494 1.00 0.00 H new ATOM 0 HG LEU A 664 12.904 -16.752 -8.279 1.00 0.00 H new ATOM 0 HD11 LEU A 664 14.621 -18.490 -8.013 1.00 0.00 H new ATOM 0 HD12 LEU A 664 13.156 -18.875 -7.078 1.00 0.00 H new ATOM 0 HD13 LEU A 664 13.478 -19.714 -8.614 1.00 0.00 H new ATOM 0 HD21 LEU A 664 14.432 -17.221 -10.153 1.00 0.00 H new ATOM 0 HD22 LEU A 664 13.279 -18.415 -10.794 1.00 0.00 H new ATOM 0 HD23 LEU A 664 12.835 -16.693 -10.735 1.00 0.00 H new ATOM 1403 N THR A 665 8.139 -17.000 -8.795 1.00 0.00 N ATOM 1404 CA THR A 665 6.742 -17.414 -8.745 1.00 0.00 C ATOM 1405 C THR A 665 5.810 -16.209 -8.754 1.00 0.00 C ATOM 1406 O THR A 665 5.983 -15.273 -7.974 1.00 0.00 O ATOM 1407 CB THR A 665 6.449 -18.267 -7.497 1.00 0.00 C ATOM 1408 OG1 THR A 665 7.282 -19.434 -7.507 1.00 0.00 O ATOM 1409 CG2 THR A 665 4.989 -18.692 -7.471 1.00 0.00 C ATOM 0 H THR A 665 8.394 -16.294 -8.104 1.00 0.00 H new ATOM 0 HA THR A 665 6.562 -18.016 -9.635 1.00 0.00 H new ATOM 0 HB THR A 665 6.658 -17.669 -6.610 1.00 0.00 H new ATOM 0 HG1 THR A 665 7.096 -19.975 -6.712 1.00 0.00 H new ATOM 0 HG21 THR A 665 4.801 -19.294 -6.582 1.00 0.00 H new ATOM 0 HG22 THR A 665 4.353 -17.807 -7.451 1.00 0.00 H new ATOM 0 HG23 THR A 665 4.765 -19.280 -8.361 1.00 0.00 H new ATOM 1417 N ARG A 666 4.821 -16.239 -9.640 1.00 0.00 N ATOM 1418 CA ARG A 666 3.877 -15.135 -9.772 1.00 0.00 C ATOM 1419 C ARG A 666 2.495 -15.529 -9.267 1.00 0.00 C ATOM 1420 O ARG A 666 1.493 -15.331 -9.955 1.00 0.00 O ATOM 1421 CB ARG A 666 3.818 -14.597 -11.194 1.00 0.00 C ATOM 1422 CG ARG A 666 3.172 -13.228 -11.334 1.00 0.00 C ATOM 1423 CD ARG A 666 3.206 -12.672 -12.711 1.00 0.00 C ATOM 1424 NE ARG A 666 2.648 -11.336 -12.835 1.00 0.00 N ATOM 1425 CZ ARG A 666 2.609 -10.626 -13.980 1.00 0.00 C ATOM 1426 NH1 ARG A 666 3.127 -11.103 -15.090 1.00 0.00 N ATOM 1427 NH2 ARG A 666 2.057 -9.425 -13.952 1.00 0.00 N ATOM 0 H ARG A 666 4.652 -17.016 -10.278 1.00 0.00 H new ATOM 0 HA ARG A 666 4.243 -14.323 -9.144 1.00 0.00 H new ATOM 0 HB2 ARG A 666 4.832 -14.546 -11.590 1.00 0.00 H new ATOM 0 HB3 ARG A 666 3.269 -15.307 -11.813 1.00 0.00 H new ATOM 0 HG2 ARG A 666 2.134 -13.294 -11.007 1.00 0.00 H new ATOM 0 HG3 ARG A 666 3.674 -12.532 -10.662 1.00 0.00 H new ATOM 0 HD2 ARG A 666 4.240 -12.654 -13.057 1.00 0.00 H new ATOM 0 HD3 ARG A 666 2.660 -13.343 -13.374 1.00 0.00 H new ATOM 0 HE ARG A 666 2.258 -10.905 -11.997 1.00 0.00 H new ATOM 0 HH11 ARG A 666 3.567 -12.023 -15.093 1.00 0.00 H new ATOM 0 HH12 ARG A 666 3.089 -10.553 -15.948 1.00 0.00 H new ATOM 0 HH21 ARG A 666 1.675 -9.059 -13.080 1.00 0.00 H new ATOM 0 HH22 ARG A 666 2.013 -8.864 -14.803 1.00 0.00 H new ATOM 1441 N GLY A 667 2.447 -16.088 -8.063 1.00 0.00 N ATOM 1442 CA GLY A 667 1.194 -16.561 -7.487 1.00 0.00 C ATOM 1443 C GLY A 667 1.235 -16.514 -5.965 1.00 0.00 C ATOM 1444 O GLY A 667 1.961 -15.710 -5.379 1.00 0.00 O ATOM 0 H GLY A 667 3.263 -16.225 -7.466 1.00 0.00 H new ATOM 0 HA2 GLY A 667 0.369 -15.948 -7.850 1.00 0.00 H new ATOM 0 HA3 GLY A 667 1.002 -17.582 -7.817 1.00 0.00 H new ATOM 1448 N ARG A 668 0.452 -17.379 -5.329 1.00 0.00 N ATOM 1449 CA ARG A 668 0.358 -17.402 -3.875 1.00 0.00 C ATOM 1450 C ARG A 668 1.547 -18.128 -3.257 1.00 0.00 C ATOM 1451 O ARG A 668 2.050 -19.102 -3.817 1.00 0.00 O ATOM 1452 CB ARG A 668 -0.962 -17.986 -3.394 1.00 0.00 C ATOM 1453 CG ARG A 668 -2.189 -17.150 -3.723 1.00 0.00 C ATOM 1454 CD ARG A 668 -3.474 -17.748 -3.280 1.00 0.00 C ATOM 1455 NE ARG A 668 -4.657 -17.017 -3.705 1.00 0.00 N ATOM 1456 CZ ARG A 668 -5.186 -15.968 -3.046 1.00 0.00 C ATOM 1457 NH1 ARG A 668 -4.665 -15.546 -1.915 1.00 0.00 N ATOM 1458 NH2 ARG A 668 -6.258 -15.387 -3.555 1.00 0.00 N ATOM 0 H ARG A 668 -0.127 -18.074 -5.799 1.00 0.00 H new ATOM 0 HA ARG A 668 0.386 -16.366 -3.536 1.00 0.00 H new ATOM 0 HB2 ARG A 668 -1.086 -18.976 -3.833 1.00 0.00 H new ATOM 0 HB3 ARG A 668 -0.911 -18.121 -2.314 1.00 0.00 H new ATOM 0 HG2 ARG A 668 -2.080 -16.169 -3.261 1.00 0.00 H new ATOM 0 HG3 ARG A 668 -2.228 -16.992 -4.801 1.00 0.00 H new ATOM 0 HD2 ARG A 668 -3.536 -18.768 -3.660 1.00 0.00 H new ATOM 0 HD3 ARG A 668 -3.474 -17.813 -2.192 1.00 0.00 H new ATOM 0 HE ARG A 668 -5.119 -17.320 -4.563 1.00 0.00 H new ATOM 0 HH11 ARG A 668 -3.848 -16.014 -1.524 1.00 0.00 H new ATOM 0 HH12 ARG A 668 -5.078 -14.750 -1.429 1.00 0.00 H new ATOM 0 HH21 ARG A 668 -6.662 -15.735 -4.424 1.00 0.00 H new ATOM 0 HH22 ARG A 668 -6.681 -14.590 -3.079 1.00 0.00 H new ATOM 1472 N ARG A 669 1.991 -17.648 -2.101 1.00 0.00 N ATOM 1473 CA ARG A 669 3.139 -18.234 -1.419 1.00 0.00 C ATOM 1474 C ARG A 669 2.756 -18.742 -0.034 1.00 0.00 C ATOM 1475 O ARG A 669 1.790 -18.270 0.565 1.00 0.00 O ATOM 1476 CB ARG A 669 4.318 -17.275 -1.354 1.00 0.00 C ATOM 1477 CG ARG A 669 4.965 -16.964 -2.695 1.00 0.00 C ATOM 1478 CD ARG A 669 6.123 -16.038 -2.616 1.00 0.00 C ATOM 1479 NE ARG A 669 7.187 -16.477 -1.727 1.00 0.00 N ATOM 1480 CZ ARG A 669 7.446 -15.938 -0.520 1.00 0.00 C ATOM 1481 NH1 ARG A 669 6.749 -14.919 -0.069 1.00 0.00 N ATOM 1482 NH2 ARG A 669 8.438 -16.447 0.190 1.00 0.00 N ATOM 0 H ARG A 669 1.573 -16.854 -1.616 1.00 0.00 H new ATOM 0 HA ARG A 669 3.462 -19.090 -2.011 1.00 0.00 H new ATOM 0 HB2 ARG A 669 3.983 -16.341 -0.903 1.00 0.00 H new ATOM 0 HB3 ARG A 669 5.074 -17.696 -0.691 1.00 0.00 H new ATOM 0 HG2 ARG A 669 5.292 -17.898 -3.152 1.00 0.00 H new ATOM 0 HG3 ARG A 669 4.214 -16.532 -3.356 1.00 0.00 H new ATOM 0 HD2 ARG A 669 6.535 -15.905 -3.617 1.00 0.00 H new ATOM 0 HD3 ARG A 669 5.769 -15.062 -2.284 1.00 0.00 H new ATOM 0 HE ARG A 669 7.779 -17.247 -2.039 1.00 0.00 H new ATOM 0 HH11 ARG A 669 5.998 -14.524 -0.635 1.00 0.00 H new ATOM 0 HH12 ARG A 669 6.959 -14.523 0.847 1.00 0.00 H new ATOM 0 HH21 ARG A 669 8.983 -17.226 -0.180 1.00 0.00 H new ATOM 0 HH22 ARG A 669 8.659 -16.061 1.108 1.00 0.00 H new ATOM 1496 N THR A 670 3.520 -19.706 0.468 1.00 0.00 N ATOM 1497 CA THR A 670 3.228 -20.321 1.757 1.00 0.00 C ATOM 1498 C THR A 670 4.187 -19.828 2.833 1.00 0.00 C ATOM 1499 O THR A 670 4.850 -20.623 3.499 1.00 0.00 O ATOM 1500 CB THR A 670 3.305 -21.857 1.681 1.00 0.00 C ATOM 1501 OG1 THR A 670 4.586 -22.249 1.170 1.00 0.00 O ATOM 1502 CG2 THR A 670 2.213 -22.402 0.773 1.00 0.00 C ATOM 0 H THR A 670 4.347 -20.078 0.001 1.00 0.00 H new ATOM 0 HA THR A 670 2.211 -20.030 2.020 1.00 0.00 H new ATOM 0 HB THR A 670 3.166 -22.263 2.683 1.00 0.00 H new ATOM 0 HG1 THR A 670 4.634 -23.227 1.124 1.00 0.00 H new ATOM 0 HG21 THR A 670 2.283 -23.489 0.732 1.00 0.00 H new ATOM 0 HG22 THR A 670 1.237 -22.116 1.165 1.00 0.00 H new ATOM 0 HG23 THR A 670 2.335 -21.992 -0.230 1.00 0.00 H new ATOM 1510 N ALA A 671 4.256 -18.511 2.998 1.00 0.00 N ATOM 1511 CA ALA A 671 5.109 -17.910 4.017 1.00 0.00 C ATOM 1512 C ALA A 671 4.592 -16.538 4.428 1.00 0.00 C ATOM 1513 O ALA A 671 3.909 -15.864 3.657 1.00 0.00 O ATOM 1514 CB ALA A 671 6.542 -17.813 3.517 1.00 0.00 C ATOM 0 H ALA A 671 3.731 -17.839 2.439 1.00 0.00 H new ATOM 0 HA ALA A 671 5.088 -18.552 4.897 1.00 0.00 H new ATOM 0 HB1 ALA A 671 7.167 -17.363 4.288 1.00 0.00 H new ATOM 0 HB2 ALA A 671 6.915 -18.811 3.285 1.00 0.00 H new ATOM 0 HB3 ALA A 671 6.573 -17.196 2.619 1.00 0.00 H new ATOM 1520 N SER A 672 4.922 -16.128 5.649 1.00 0.00 N ATOM 1521 CA SER A 672 4.506 -14.828 6.159 1.00 0.00 C ATOM 1522 C SER A 672 5.672 -14.091 6.806 1.00 0.00 C ATOM 1523 O SER A 672 6.633 -14.709 7.263 1.00 0.00 O ATOM 1524 CB SER A 672 3.371 -14.996 7.151 1.00 0.00 C ATOM 1525 OG SER A 672 3.767 -15.716 8.286 1.00 0.00 O ATOM 0 H SER A 672 5.477 -16.679 6.304 1.00 0.00 H new ATOM 0 HA SER A 672 4.157 -14.229 5.318 1.00 0.00 H new ATOM 0 HB2 SER A 672 3.006 -14.015 7.454 1.00 0.00 H new ATOM 0 HB3 SER A 672 2.540 -15.510 6.667 1.00 0.00 H new ATOM 0 HG SER A 672 3.008 -15.801 8.901 1.00 0.00 H new ATOM 1531 N VAL A 673 5.581 -12.766 6.841 1.00 0.00 N ATOM 1532 CA VAL A 673 6.634 -11.941 7.421 1.00 0.00 C ATOM 1533 C VAL A 673 6.052 -10.847 8.306 1.00 0.00 C ATOM 1534 O VAL A 673 5.117 -10.148 7.913 1.00 0.00 O ATOM 1535 CB VAL A 673 7.510 -11.294 6.331 1.00 0.00 C ATOM 1536 CG1 VAL A 673 8.619 -10.466 6.962 1.00 0.00 C ATOM 1537 CG2 VAL A 673 8.096 -12.359 5.417 1.00 0.00 C ATOM 0 H VAL A 673 4.788 -12.240 6.474 1.00 0.00 H new ATOM 0 HA VAL A 673 7.253 -12.603 8.027 1.00 0.00 H new ATOM 0 HB VAL A 673 6.883 -10.633 5.732 1.00 0.00 H new ATOM 0 HG11 VAL A 673 9.228 -10.016 6.178 1.00 0.00 H new ATOM 0 HG12 VAL A 673 8.181 -9.680 7.577 1.00 0.00 H new ATOM 0 HG13 VAL A 673 9.244 -11.108 7.584 1.00 0.00 H new ATOM 0 HG21 VAL A 673 8.712 -11.884 4.653 1.00 0.00 H new ATOM 0 HG22 VAL A 673 8.709 -13.044 6.003 1.00 0.00 H new ATOM 0 HG23 VAL A 673 7.288 -12.913 4.939 1.00 0.00 H new ATOM 1547 N ARG A 674 6.610 -10.702 9.503 1.00 0.00 N ATOM 1548 CA ARG A 674 6.132 -9.708 10.457 1.00 0.00 C ATOM 1549 C ARG A 674 7.287 -8.909 11.045 1.00 0.00 C ATOM 1550 O ARG A 674 8.312 -9.472 11.429 1.00 0.00 O ATOM 1551 CB ARG A 674 5.270 -10.326 11.547 1.00 0.00 C ATOM 1552 CG ARG A 674 4.702 -9.336 12.552 1.00 0.00 C ATOM 1553 CD ARG A 674 3.769 -9.934 13.541 1.00 0.00 C ATOM 1554 NE ARG A 674 4.407 -10.781 14.536 1.00 0.00 N ATOM 1555 CZ ARG A 674 3.779 -11.748 15.233 1.00 0.00 C ATOM 1556 NH1 ARG A 674 2.493 -11.970 15.076 1.00 0.00 N ATOM 1557 NH2 ARG A 674 4.487 -12.453 16.099 1.00 0.00 N ATOM 0 H ARG A 674 7.395 -11.261 9.836 1.00 0.00 H new ATOM 0 HA ARG A 674 5.494 -9.017 9.906 1.00 0.00 H new ATOM 0 HB2 ARG A 674 4.444 -10.860 11.078 1.00 0.00 H new ATOM 0 HB3 ARG A 674 5.864 -11.066 12.084 1.00 0.00 H new ATOM 0 HG2 ARG A 674 5.527 -8.866 13.087 1.00 0.00 H new ATOM 0 HG3 ARG A 674 4.181 -8.546 12.011 1.00 0.00 H new ATOM 0 HD2 ARG A 674 3.238 -9.131 14.052 1.00 0.00 H new ATOM 0 HD3 ARG A 674 3.022 -10.521 13.008 1.00 0.00 H new ATOM 0 HE ARG A 674 5.399 -10.633 14.719 1.00 0.00 H new ATOM 0 HH11 ARG A 674 1.955 -11.406 14.418 1.00 0.00 H new ATOM 0 HH12 ARG A 674 2.033 -12.706 15.612 1.00 0.00 H new ATOM 0 HH21 ARG A 674 5.480 -12.258 16.224 1.00 0.00 H new ATOM 0 HH22 ARG A 674 4.040 -13.192 16.642 1.00 0.00 H new ATOM 1571 N ALA A 675 7.116 -7.593 11.114 1.00 0.00 N ATOM 1572 CA ALA A 675 8.151 -6.712 11.640 1.00 0.00 C ATOM 1573 C ALA A 675 8.211 -6.778 13.161 1.00 0.00 C ATOM 1574 O ALA A 675 7.180 -6.844 13.830 1.00 0.00 O ATOM 1575 CB ALA A 675 7.915 -5.281 11.178 1.00 0.00 C ATOM 0 H ALA A 675 6.268 -7.113 10.811 1.00 0.00 H new ATOM 0 HA ALA A 675 9.111 -7.052 11.252 1.00 0.00 H new ATOM 0 HB1 ALA A 675 8.696 -4.636 11.579 1.00 0.00 H new ATOM 0 HB2 ALA A 675 7.936 -5.242 10.089 1.00 0.00 H new ATOM 0 HB3 ALA A 675 6.943 -4.939 11.535 1.00 0.00 H new ATOM 1581 N ASP A 676 9.424 -6.761 13.702 1.00 0.00 N ATOM 1582 CA ASP A 676 9.622 -6.849 15.144 1.00 0.00 C ATOM 1583 C ASP A 676 9.939 -5.483 15.740 1.00 0.00 C ATOM 1584 O ASP A 676 9.568 -5.190 16.877 1.00 0.00 O ATOM 1585 CB ASP A 676 10.741 -7.839 15.473 1.00 0.00 C ATOM 1586 CG ASP A 676 10.465 -9.270 15.032 1.00 0.00 C ATOM 1587 OD1 ASP A 676 9.466 -9.814 15.437 1.00 0.00 O ATOM 1588 OD2 ASP A 676 11.167 -9.752 14.174 1.00 0.00 O ATOM 0 H ASP A 676 10.287 -6.687 13.163 1.00 0.00 H new ATOM 0 HA ASP A 676 8.693 -7.207 15.587 1.00 0.00 H new ATOM 0 HB2 ASP A 676 11.662 -7.497 15.001 1.00 0.00 H new ATOM 0 HB3 ASP A 676 10.912 -7.830 16.549 1.00 0.00 H new ATOM 1593 N THR A 677 10.628 -4.651 14.967 1.00 0.00 N ATOM 1594 CA THR A 677 10.992 -3.313 15.415 1.00 0.00 C ATOM 1595 C THR A 677 10.523 -2.253 14.426 1.00 0.00 C ATOM 1596 O THR A 677 9.906 -2.570 13.409 1.00 0.00 O ATOM 1597 CB THR A 677 12.513 -3.177 15.613 1.00 0.00 C ATOM 1598 OG1 THR A 677 13.170 -3.230 14.340 1.00 0.00 O ATOM 1599 CG2 THR A 677 13.038 -4.298 16.497 1.00 0.00 C ATOM 0 H THR A 677 10.946 -4.881 14.025 1.00 0.00 H new ATOM 0 HA THR A 677 10.495 -3.158 16.372 1.00 0.00 H new ATOM 0 HB THR A 677 12.717 -2.221 16.096 1.00 0.00 H new ATOM 0 HG1 THR A 677 14.138 -3.142 14.467 1.00 0.00 H new ATOM 0 HG21 THR A 677 14.115 -4.186 16.626 1.00 0.00 H new ATOM 0 HG22 THR A 677 12.549 -4.253 17.470 1.00 0.00 H new ATOM 0 HG23 THR A 677 12.827 -5.260 16.029 1.00 0.00 H new ATOM 1607 N TYR A 678 10.819 -0.994 14.730 1.00 0.00 N ATOM 1608 CA TYR A 678 10.665 0.084 13.762 1.00 0.00 C ATOM 1609 C TYR A 678 11.532 -0.151 12.532 1.00 0.00 C ATOM 1610 O TYR A 678 12.735 0.112 12.549 1.00 0.00 O ATOM 1611 CB TYR A 678 11.013 1.431 14.400 1.00 0.00 C ATOM 1612 CG TYR A 678 11.070 2.579 13.417 1.00 0.00 C ATOM 1613 CD1 TYR A 678 9.909 3.128 12.894 1.00 0.00 C ATOM 1614 CD2 TYR A 678 12.286 3.112 13.016 1.00 0.00 C ATOM 1615 CE1 TYR A 678 9.955 4.177 11.995 1.00 0.00 C ATOM 1616 CE2 TYR A 678 12.345 4.161 12.119 1.00 0.00 C ATOM 1617 CZ TYR A 678 11.177 4.691 11.611 1.00 0.00 C ATOM 1618 OH TYR A 678 11.230 5.736 10.717 1.00 0.00 O ATOM 0 H TYR A 678 11.167 -0.695 15.641 1.00 0.00 H new ATOM 0 HA TYR A 678 9.622 0.100 13.446 1.00 0.00 H new ATOM 0 HB2 TYR A 678 10.274 1.660 15.168 1.00 0.00 H new ATOM 0 HB3 TYR A 678 11.977 1.346 14.901 1.00 0.00 H new ATOM 0 HD1 TYR A 678 8.952 2.729 13.194 1.00 0.00 H new ATOM 0 HD2 TYR A 678 13.202 2.700 13.412 1.00 0.00 H new ATOM 0 HE1 TYR A 678 9.041 4.592 11.596 1.00 0.00 H new ATOM 0 HE2 TYR A 678 13.300 4.564 11.817 1.00 0.00 H new ATOM 0 HH TYR A 678 10.427 6.289 10.813 1.00 0.00 H new ATOM 1628 N CYS A 679 10.915 -0.647 11.465 1.00 0.00 N ATOM 1629 CA CYS A 679 11.658 -1.157 10.319 1.00 0.00 C ATOM 1630 C CYS A 679 11.497 -0.246 9.108 1.00 0.00 C ATOM 1631 O CYS A 679 10.436 0.340 8.897 1.00 0.00 O ATOM 1632 CB CYS A 679 10.998 -2.512 10.064 1.00 0.00 C ATOM 1633 SG CYS A 679 11.166 -3.695 11.423 1.00 0.00 S ATOM 0 H CYS A 679 9.901 -0.707 11.370 1.00 0.00 H new ATOM 0 HA CYS A 679 12.731 -1.220 10.499 1.00 0.00 H new ATOM 0 HB2 CYS A 679 9.938 -2.354 9.865 1.00 0.00 H new ATOM 0 HB3 CYS A 679 11.430 -2.949 9.163 1.00 0.00 H new ATOM 0 HG CYS A 679 10.413 -3.325 12.416 1.00 0.00 H new ATOM 1639 N ARG A 680 12.558 -0.132 8.316 1.00 0.00 N ATOM 1640 CA ARG A 680 12.507 0.632 7.075 1.00 0.00 C ATOM 1641 C ARG A 680 12.892 -0.232 5.881 1.00 0.00 C ATOM 1642 O ARG A 680 14.061 -0.572 5.700 1.00 0.00 O ATOM 1643 CB ARG A 680 13.352 1.895 7.143 1.00 0.00 C ATOM 1644 CG ARG A 680 12.822 2.969 8.080 1.00 0.00 C ATOM 1645 CD ARG A 680 13.705 4.156 8.214 1.00 0.00 C ATOM 1646 NE ARG A 680 13.131 5.251 8.978 1.00 0.00 N ATOM 1647 CZ ARG A 680 13.715 6.453 9.150 1.00 0.00 C ATOM 1648 NH1 ARG A 680 14.903 6.707 8.647 1.00 0.00 N ATOM 1649 NH2 ARG A 680 13.071 7.365 9.858 1.00 0.00 N ATOM 0 H ARG A 680 13.463 -0.559 8.511 1.00 0.00 H new ATOM 0 HA ARG A 680 11.474 0.952 6.938 1.00 0.00 H new ATOM 0 HB2 ARG A 680 14.360 1.624 7.457 1.00 0.00 H new ATOM 0 HB3 ARG A 680 13.433 2.315 6.141 1.00 0.00 H new ATOM 0 HG2 ARG A 680 11.846 3.296 7.723 1.00 0.00 H new ATOM 0 HG3 ARG A 680 12.670 2.531 9.066 1.00 0.00 H new ATOM 0 HD2 ARG A 680 14.637 3.848 8.688 1.00 0.00 H new ATOM 0 HD3 ARG A 680 13.959 4.519 7.218 1.00 0.00 H new ATOM 0 HE ARG A 680 12.222 5.099 9.415 1.00 0.00 H new ATOM 0 HH11 ARG A 680 15.397 5.989 8.117 1.00 0.00 H new ATOM 0 HH12 ARG A 680 15.331 7.622 8.787 1.00 0.00 H new ATOM 0 HH21 ARG A 680 12.157 7.149 10.257 1.00 0.00 H new ATOM 0 HH22 ARG A 680 13.488 8.284 10.005 1.00 0.00 H new ATOM 1663 N LEU A 681 11.902 -0.585 5.068 1.00 0.00 N ATOM 1664 CA LEU A 681 12.104 -1.538 3.983 1.00 0.00 C ATOM 1665 C LEU A 681 11.840 -0.893 2.628 1.00 0.00 C ATOM 1666 O LEU A 681 11.168 0.134 2.539 1.00 0.00 O ATOM 1667 CB LEU A 681 11.200 -2.762 4.177 1.00 0.00 C ATOM 1668 CG LEU A 681 11.829 -3.919 4.963 1.00 0.00 C ATOM 1669 CD1 LEU A 681 11.838 -3.596 6.451 1.00 0.00 C ATOM 1670 CD2 LEU A 681 11.051 -5.199 4.693 1.00 0.00 C ATOM 0 H LEU A 681 10.950 -0.225 5.140 1.00 0.00 H new ATOM 0 HA LEU A 681 13.145 -1.860 4.005 1.00 0.00 H new ATOM 0 HB2 LEU A 681 10.292 -2.446 4.691 1.00 0.00 H new ATOM 0 HB3 LEU A 681 10.899 -3.131 3.196 1.00 0.00 H new ATOM 0 HG LEU A 681 12.860 -4.060 4.639 1.00 0.00 H new ATOM 0 HD11 LEU A 681 12.287 -4.424 7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 681 12.418 -2.690 6.623 1.00 0.00 H new ATOM 0 HD13 LEU A 681 10.816 -3.443 6.796 1.00 0.00 H new ATOM 0 HD21 LEU A 681 11.498 -6.021 5.252 1.00 0.00 H new ATOM 0 HD22 LEU A 681 10.015 -5.068 5.006 1.00 0.00 H new ATOM 0 HD23 LEU A 681 11.082 -5.425 3.627 1.00 0.00 H new ATOM 1682 N TYR A 682 12.372 -1.503 1.575 1.00 0.00 N ATOM 1683 CA TYR A 682 12.082 -1.073 0.212 1.00 0.00 C ATOM 1684 C TYR A 682 11.550 -2.226 -0.629 1.00 0.00 C ATOM 1685 O TYR A 682 12.191 -3.271 -0.743 1.00 0.00 O ATOM 1686 CB TYR A 682 13.334 -0.481 -0.440 1.00 0.00 C ATOM 1687 CG TYR A 682 13.836 0.779 0.228 1.00 0.00 C ATOM 1688 CD1 TYR A 682 14.637 0.716 1.359 1.00 0.00 C ATOM 1689 CD2 TYR A 682 13.509 2.030 -0.275 1.00 0.00 C ATOM 1690 CE1 TYR A 682 15.098 1.864 1.974 1.00 0.00 C ATOM 1691 CE2 TYR A 682 13.965 3.184 0.331 1.00 0.00 C ATOM 1692 CZ TYR A 682 14.760 3.097 1.455 1.00 0.00 C ATOM 1693 OH TYR A 682 15.217 4.244 2.062 1.00 0.00 O ATOM 0 H TYR A 682 13.008 -2.298 1.639 1.00 0.00 H new ATOM 0 HA TYR A 682 11.311 -0.304 0.262 1.00 0.00 H new ATOM 0 HB2 TYR A 682 14.127 -1.229 -0.426 1.00 0.00 H new ATOM 0 HB3 TYR A 682 13.119 -0.265 -1.486 1.00 0.00 H new ATOM 0 HD1 TYR A 682 14.905 -0.248 1.766 1.00 0.00 H new ATOM 0 HD2 TYR A 682 12.887 2.102 -1.155 1.00 0.00 H new ATOM 0 HE1 TYR A 682 15.719 1.797 2.855 1.00 0.00 H new ATOM 0 HE2 TYR A 682 13.701 4.150 -0.073 1.00 0.00 H new ATOM 0 HH TYR A 682 15.794 4.007 2.818 1.00 0.00 H new ATOM 1703 N SER A 683 10.375 -2.030 -1.216 1.00 0.00 N ATOM 1704 CA SER A 683 9.735 -3.068 -2.015 1.00 0.00 C ATOM 1705 C SER A 683 9.994 -2.858 -3.501 1.00 0.00 C ATOM 1706 O SER A 683 10.188 -1.730 -3.954 1.00 0.00 O ATOM 1707 CB SER A 683 8.244 -3.096 -1.738 1.00 0.00 C ATOM 1708 OG SER A 683 7.605 -1.931 -2.180 1.00 0.00 O ATOM 0 H SER A 683 9.846 -1.160 -1.153 1.00 0.00 H new ATOM 0 HA SER A 683 10.167 -4.028 -1.732 1.00 0.00 H new ATOM 0 HB2 SER A 683 7.800 -3.961 -2.230 1.00 0.00 H new ATOM 0 HB3 SER A 683 8.077 -3.217 -0.668 1.00 0.00 H new ATOM 0 HG SER A 683 6.782 -1.794 -1.666 1.00 0.00 H new ATOM 1714 N LEU A 684 9.997 -3.951 -4.257 1.00 0.00 N ATOM 1715 CA LEU A 684 10.234 -3.889 -5.694 1.00 0.00 C ATOM 1716 C LEU A 684 9.484 -4.995 -6.424 1.00 0.00 C ATOM 1717 O LEU A 684 9.865 -6.164 -6.359 1.00 0.00 O ATOM 1718 CB LEU A 684 11.737 -3.978 -5.988 1.00 0.00 C ATOM 1719 CG LEU A 684 12.123 -3.824 -7.465 1.00 0.00 C ATOM 1720 CD1 LEU A 684 11.745 -2.436 -7.962 1.00 0.00 C ATOM 1721 CD2 LEU A 684 13.616 -4.067 -7.628 1.00 0.00 C ATOM 0 H LEU A 684 9.838 -4.892 -3.897 1.00 0.00 H new ATOM 0 HA LEU A 684 9.859 -2.933 -6.058 1.00 0.00 H new ATOM 0 HB2 LEU A 684 12.250 -3.207 -5.413 1.00 0.00 H new ATOM 0 HB3 LEU A 684 12.105 -4.940 -5.631 1.00 0.00 H new ATOM 0 HG LEU A 684 11.581 -4.558 -8.061 1.00 0.00 H new ATOM 0 HD11 LEU A 684 12.023 -2.337 -9.011 1.00 0.00 H new ATOM 0 HD12 LEU A 684 10.670 -2.292 -7.857 1.00 0.00 H new ATOM 0 HD13 LEU A 684 12.271 -1.683 -7.375 1.00 0.00 H new ATOM 0 HD21 LEU A 684 13.890 -3.958 -8.677 1.00 0.00 H new ATOM 0 HD22 LEU A 684 14.170 -3.343 -7.031 1.00 0.00 H new ATOM 0 HD23 LEU A 684 13.859 -5.075 -7.293 1.00 0.00 H new ATOM 1733 N SER A 685 8.416 -4.620 -7.120 1.00 0.00 N ATOM 1734 CA SER A 685 7.558 -5.591 -7.788 1.00 0.00 C ATOM 1735 C SER A 685 8.263 -6.219 -8.983 1.00 0.00 C ATOM 1736 O SER A 685 9.192 -5.638 -9.544 1.00 0.00 O ATOM 1737 CB SER A 685 6.265 -4.930 -8.226 1.00 0.00 C ATOM 1738 OG SER A 685 6.467 -4.018 -9.270 1.00 0.00 O ATOM 0 H SER A 685 8.124 -3.650 -7.236 1.00 0.00 H new ATOM 0 HA SER A 685 7.329 -6.386 -7.079 1.00 0.00 H new ATOM 0 HB2 SER A 685 5.557 -5.695 -8.545 1.00 0.00 H new ATOM 0 HB3 SER A 685 5.816 -4.415 -7.377 1.00 0.00 H new ATOM 0 HG SER A 685 5.610 -3.616 -9.523 1.00 0.00 H new ATOM 1744 N VAL A 686 7.816 -7.410 -9.368 1.00 0.00 N ATOM 1745 CA VAL A 686 8.294 -8.049 -10.589 1.00 0.00 C ATOM 1746 C VAL A 686 7.936 -7.226 -11.819 1.00 0.00 C ATOM 1747 O VAL A 686 8.615 -7.295 -12.843 1.00 0.00 O ATOM 1748 CB VAL A 686 7.716 -9.468 -10.747 1.00 0.00 C ATOM 1749 CG1 VAL A 686 8.220 -10.376 -9.634 1.00 0.00 C ATOM 1750 CG2 VAL A 686 6.196 -9.427 -10.751 1.00 0.00 C ATOM 0 H VAL A 686 7.123 -7.952 -8.852 1.00 0.00 H new ATOM 0 HA VAL A 686 9.379 -8.115 -10.504 1.00 0.00 H new ATOM 0 HB VAL A 686 8.053 -9.872 -11.702 1.00 0.00 H new ATOM 0 HG11 VAL A 686 7.802 -11.374 -9.761 1.00 0.00 H new ATOM 0 HG12 VAL A 686 9.308 -10.431 -9.674 1.00 0.00 H new ATOM 0 HG13 VAL A 686 7.912 -9.974 -8.669 1.00 0.00 H new ATOM 0 HG21 VAL A 686 5.805 -10.438 -10.864 1.00 0.00 H new ATOM 0 HG22 VAL A 686 5.841 -9.003 -9.812 1.00 0.00 H new ATOM 0 HG23 VAL A 686 5.851 -8.810 -11.581 1.00 0.00 H new ATOM 1760 N ASP A 687 6.866 -6.446 -11.711 1.00 0.00 N ATOM 1761 CA ASP A 687 6.474 -5.531 -12.777 1.00 0.00 C ATOM 1762 C ASP A 687 7.524 -4.448 -12.986 1.00 0.00 C ATOM 1763 O ASP A 687 7.881 -4.126 -14.120 1.00 0.00 O ATOM 1764 CB ASP A 687 5.117 -4.895 -12.467 1.00 0.00 C ATOM 1765 CG ASP A 687 3.932 -5.841 -12.607 1.00 0.00 C ATOM 1766 OD1 ASP A 687 4.106 -6.902 -13.160 1.00 0.00 O ATOM 1767 OD2 ASP A 687 2.908 -5.569 -12.028 1.00 0.00 O ATOM 0 H ASP A 687 6.254 -6.429 -10.895 1.00 0.00 H new ATOM 0 HA ASP A 687 6.391 -6.109 -13.698 1.00 0.00 H new ATOM 0 HB2 ASP A 687 5.136 -4.505 -11.449 1.00 0.00 H new ATOM 0 HB3 ASP A 687 4.968 -4.044 -13.132 1.00 0.00 H new ATOM 1772 N ASN A 688 8.016 -3.887 -11.886 1.00 0.00 N ATOM 1773 CA ASN A 688 9.084 -2.896 -11.943 1.00 0.00 C ATOM 1774 C ASN A 688 10.361 -3.495 -12.518 1.00 0.00 C ATOM 1775 O ASN A 688 11.029 -2.878 -13.348 1.00 0.00 O ATOM 1776 CB ASN A 688 9.356 -2.294 -10.577 1.00 0.00 C ATOM 1777 CG ASN A 688 8.283 -1.351 -10.107 1.00 0.00 C ATOM 1778 OD1 ASN A 688 7.501 -0.822 -10.904 1.00 0.00 O ATOM 1779 ND2 ASN A 688 8.294 -1.076 -8.828 1.00 0.00 N ATOM 0 H ASN A 688 7.691 -4.102 -10.943 1.00 0.00 H new ATOM 0 HA ASN A 688 8.748 -2.099 -12.606 1.00 0.00 H new ATOM 0 HB2 ASN A 688 9.464 -3.099 -9.850 1.00 0.00 H new ATOM 0 HB3 ASN A 688 10.307 -1.762 -10.607 1.00 0.00 H new ATOM 0 HD21 ASN A 688 7.636 -0.396 -8.447 1.00 0.00 H new ATOM 0 HD22 ASN A 688 8.961 -1.541 -8.212 1.00 0.00 H new ATOM 1786 N PHE A 689 10.695 -4.701 -12.073 1.00 0.00 N ATOM 1787 CA PHE A 689 11.846 -5.423 -12.604 1.00 0.00 C ATOM 1788 C PHE A 689 11.717 -5.635 -14.107 1.00 0.00 C ATOM 1789 O PHE A 689 12.680 -5.461 -14.853 1.00 0.00 O ATOM 1790 CB PHE A 689 12.008 -6.768 -11.894 1.00 0.00 C ATOM 1791 CG PHE A 689 13.286 -7.481 -12.232 1.00 0.00 C ATOM 1792 CD1 PHE A 689 14.394 -6.776 -12.678 1.00 0.00 C ATOM 1793 CD2 PHE A 689 13.383 -8.859 -12.105 1.00 0.00 C ATOM 1794 CE1 PHE A 689 15.570 -7.432 -12.989 1.00 0.00 C ATOM 1795 CE2 PHE A 689 14.558 -9.517 -12.414 1.00 0.00 C ATOM 1796 CZ PHE A 689 15.652 -8.802 -12.857 1.00 0.00 C ATOM 0 H PHE A 689 10.184 -5.200 -11.345 1.00 0.00 H new ATOM 0 HA PHE A 689 12.734 -4.818 -12.421 1.00 0.00 H new ATOM 0 HB2 PHE A 689 11.966 -6.607 -10.817 1.00 0.00 H new ATOM 0 HB3 PHE A 689 11.165 -7.409 -12.153 1.00 0.00 H new ATOM 0 HD1 PHE A 689 14.337 -5.703 -12.783 1.00 0.00 H new ATOM 0 HD2 PHE A 689 12.530 -9.424 -11.760 1.00 0.00 H new ATOM 0 HE1 PHE A 689 16.425 -6.871 -13.336 1.00 0.00 H new ATOM 0 HE2 PHE A 689 14.620 -10.590 -12.309 1.00 0.00 H new ATOM 0 HZ PHE A 689 16.571 -9.315 -13.100 1.00 0.00 H new ATOM 1806 N ASN A 690 10.521 -6.013 -14.545 1.00 0.00 N ATOM 1807 CA ASN A 690 10.254 -6.218 -15.964 1.00 0.00 C ATOM 1808 C ASN A 690 10.486 -4.940 -16.758 1.00 0.00 C ATOM 1809 O ASN A 690 11.074 -4.968 -17.840 1.00 0.00 O ATOM 1810 CB ASN A 690 8.845 -6.731 -16.195 1.00 0.00 C ATOM 1811 CG ASN A 690 8.645 -8.161 -15.776 1.00 0.00 C ATOM 1812 OD1 ASN A 690 9.606 -8.921 -15.610 1.00 0.00 O ATOM 1813 ND2 ASN A 690 7.400 -8.554 -15.683 1.00 0.00 N ATOM 0 H ASN A 690 9.720 -6.184 -13.937 1.00 0.00 H new ATOM 0 HA ASN A 690 10.954 -6.975 -16.317 1.00 0.00 H new ATOM 0 HB2 ASN A 690 8.144 -6.100 -15.648 1.00 0.00 H new ATOM 0 HB3 ASN A 690 8.602 -6.635 -17.253 1.00 0.00 H new ATOM 0 HD21 ASN A 690 7.187 -9.527 -15.464 1.00 0.00 H new ATOM 0 HD22 ASN A 690 6.642 -7.887 -15.829 1.00 0.00 H new ATOM 1820 N GLU A 691 10.022 -3.819 -16.216 1.00 0.00 N ATOM 1821 CA GLU A 691 10.222 -2.521 -16.849 1.00 0.00 C ATOM 1822 C GLU A 691 11.704 -2.214 -17.019 1.00 0.00 C ATOM 1823 O GLU A 691 12.126 -1.691 -18.050 1.00 0.00 O ATOM 1824 CB GLU A 691 9.546 -1.417 -16.033 1.00 0.00 C ATOM 1825 CG GLU A 691 8.026 -1.423 -16.105 1.00 0.00 C ATOM 1826 CD GLU A 691 7.430 -0.407 -15.171 1.00 0.00 C ATOM 1827 OE1 GLU A 691 8.168 0.186 -14.420 1.00 0.00 O ATOM 1828 OE2 GLU A 691 6.257 -0.142 -15.283 1.00 0.00 O ATOM 0 H GLU A 691 9.504 -3.784 -15.338 1.00 0.00 H new ATOM 0 HA GLU A 691 9.766 -2.559 -17.838 1.00 0.00 H new ATOM 0 HB2 GLU A 691 9.849 -1.516 -14.990 1.00 0.00 H new ATOM 0 HB3 GLU A 691 9.910 -0.450 -16.381 1.00 0.00 H new ATOM 0 HG2 GLU A 691 7.708 -1.212 -17.126 1.00 0.00 H new ATOM 0 HG3 GLU A 691 7.652 -2.415 -15.853 1.00 0.00 H new ATOM 1835 N VAL A 692 12.492 -2.542 -16.000 1.00 0.00 N ATOM 1836 CA VAL A 692 13.936 -2.351 -16.056 1.00 0.00 C ATOM 1837 C VAL A 692 14.568 -3.238 -17.121 1.00 0.00 C ATOM 1838 O VAL A 692 15.419 -2.791 -17.889 1.00 0.00 O ATOM 1839 CB VAL A 692 14.598 -2.647 -14.696 1.00 0.00 C ATOM 1840 CG1 VAL A 692 16.113 -2.672 -14.836 1.00 0.00 C ATOM 1841 CG2 VAL A 692 14.177 -1.613 -13.663 1.00 0.00 C ATOM 0 H VAL A 692 12.154 -2.942 -15.125 1.00 0.00 H new ATOM 0 HA VAL A 692 14.105 -1.305 -16.312 1.00 0.00 H new ATOM 0 HB VAL A 692 14.266 -3.628 -14.357 1.00 0.00 H new ATOM 0 HG11 VAL A 692 16.565 -2.882 -13.866 1.00 0.00 H new ATOM 0 HG12 VAL A 692 16.400 -3.448 -15.546 1.00 0.00 H new ATOM 0 HG13 VAL A 692 16.461 -1.704 -15.196 1.00 0.00 H new ATOM 0 HG21 VAL A 692 14.654 -1.837 -12.709 1.00 0.00 H new ATOM 0 HG22 VAL A 692 14.481 -0.621 -13.996 1.00 0.00 H new ATOM 0 HG23 VAL A 692 13.094 -1.639 -13.543 1.00 0.00 H new ATOM 1851 N LEU A 693 14.147 -4.498 -17.161 1.00 0.00 N ATOM 1852 CA LEU A 693 14.669 -5.450 -18.134 1.00 0.00 C ATOM 1853 C LEU A 693 14.302 -5.043 -19.555 1.00 0.00 C ATOM 1854 O LEU A 693 15.054 -5.292 -20.497 1.00 0.00 O ATOM 1855 CB LEU A 693 14.146 -6.859 -17.830 1.00 0.00 C ATOM 1856 CG LEU A 693 14.686 -7.493 -16.542 1.00 0.00 C ATOM 1857 CD1 LEU A 693 13.964 -8.803 -16.262 1.00 0.00 C ATOM 1858 CD2 LEU A 693 16.184 -7.722 -16.677 1.00 0.00 C ATOM 0 H LEU A 693 13.445 -4.884 -16.530 1.00 0.00 H new ATOM 0 HA LEU A 693 15.756 -5.452 -18.056 1.00 0.00 H new ATOM 0 HB2 LEU A 693 13.058 -6.820 -17.768 1.00 0.00 H new ATOM 0 HB3 LEU A 693 14.395 -7.510 -18.668 1.00 0.00 H new ATOM 0 HG LEU A 693 14.508 -6.820 -15.704 1.00 0.00 H new ATOM 0 HD11 LEU A 693 14.355 -9.245 -15.346 1.00 0.00 H new ATOM 0 HD12 LEU A 693 12.897 -8.613 -16.147 1.00 0.00 H new ATOM 0 HD13 LEU A 693 14.123 -9.491 -17.093 1.00 0.00 H new ATOM 0 HD21 LEU A 693 16.567 -8.173 -15.761 1.00 0.00 H new ATOM 0 HD22 LEU A 693 16.376 -8.389 -17.517 1.00 0.00 H new ATOM 0 HD23 LEU A 693 16.684 -6.769 -16.849 1.00 0.00 H new ATOM 1870 N GLU A 694 13.141 -4.414 -19.703 1.00 0.00 N ATOM 1871 CA GLU A 694 12.670 -3.973 -21.011 1.00 0.00 C ATOM 1872 C GLU A 694 13.208 -2.589 -21.352 1.00 0.00 C ATOM 1873 O GLU A 694 12.792 -1.976 -22.335 1.00 0.00 O ATOM 1874 CB GLU A 694 11.141 -3.968 -21.056 1.00 0.00 C ATOM 1875 CG GLU A 694 10.506 -5.350 -20.998 1.00 0.00 C ATOM 1876 CD GLU A 694 9.006 -5.261 -20.961 1.00 0.00 C ATOM 1877 OE1 GLU A 694 8.493 -4.168 -20.998 1.00 0.00 O ATOM 1878 OE2 GLU A 694 8.368 -6.287 -21.008 1.00 0.00 O ATOM 0 H GLU A 694 12.508 -4.198 -18.933 1.00 0.00 H new ATOM 0 HA GLU A 694 13.044 -4.677 -21.755 1.00 0.00 H new ATOM 0 HB2 GLU A 694 10.767 -3.374 -20.222 1.00 0.00 H new ATOM 0 HB3 GLU A 694 10.818 -3.471 -21.971 1.00 0.00 H new ATOM 0 HG2 GLU A 694 10.817 -5.932 -21.866 1.00 0.00 H new ATOM 0 HG3 GLU A 694 10.863 -5.880 -20.115 1.00 0.00 H new ATOM 1885 N GLU A 695 14.135 -2.102 -20.534 1.00 0.00 N ATOM 1886 CA GLU A 695 14.792 -0.826 -20.793 1.00 0.00 C ATOM 1887 C GLU A 695 15.721 -0.919 -21.996 1.00 0.00 C ATOM 1888 O GLU A 695 15.740 -0.029 -22.847 1.00 0.00 O ATOM 1889 CB GLU A 695 15.572 -0.365 -19.560 1.00 0.00 C ATOM 1890 CG GLU A 695 16.242 0.993 -19.711 1.00 0.00 C ATOM 1891 CD GLU A 695 16.931 1.407 -18.441 1.00 0.00 C ATOM 1892 OE1 GLU A 695 16.859 0.675 -17.483 1.00 0.00 O ATOM 1893 OE2 GLU A 695 17.622 2.398 -18.459 1.00 0.00 O ATOM 0 H GLU A 695 14.449 -2.572 -19.685 1.00 0.00 H new ATOM 0 HA GLU A 695 14.018 -0.092 -21.017 1.00 0.00 H new ATOM 0 HB2 GLU A 695 14.893 -0.329 -18.708 1.00 0.00 H new ATOM 0 HB3 GLU A 695 16.334 -1.109 -19.328 1.00 0.00 H new ATOM 0 HG2 GLU A 695 16.967 0.955 -20.524 1.00 0.00 H new ATOM 0 HG3 GLU A 695 15.497 1.740 -19.983 1.00 0.00 H new ATOM 1900 N TYR A 696 16.490 -2.000 -22.061 1.00 0.00 N ATOM 1901 CA TYR A 696 17.393 -2.231 -23.183 1.00 0.00 C ATOM 1902 C TYR A 696 16.793 -3.214 -24.179 1.00 0.00 C ATOM 1903 O TYR A 696 16.419 -4.330 -23.817 1.00 0.00 O ATOM 1904 CB TYR A 696 18.744 -2.748 -22.684 1.00 0.00 C ATOM 1905 CG TYR A 696 19.551 -1.720 -21.923 1.00 0.00 C ATOM 1906 CD1 TYR A 696 19.244 -0.370 -22.004 1.00 0.00 C ATOM 1907 CD2 TYR A 696 20.617 -2.104 -21.123 1.00 0.00 C ATOM 1908 CE1 TYR A 696 19.977 0.573 -21.311 1.00 0.00 C ATOM 1909 CE2 TYR A 696 21.358 -1.170 -20.424 1.00 0.00 C ATOM 1910 CZ TYR A 696 21.035 0.169 -20.521 1.00 0.00 C ATOM 1911 OH TYR A 696 21.768 1.103 -19.827 1.00 0.00 O ATOM 0 H TYR A 696 16.506 -2.731 -21.350 1.00 0.00 H new ATOM 0 HA TYR A 696 17.543 -1.279 -23.692 1.00 0.00 H new ATOM 0 HB2 TYR A 696 18.576 -3.612 -22.041 1.00 0.00 H new ATOM 0 HB3 TYR A 696 19.327 -3.094 -23.537 1.00 0.00 H new ATOM 0 HD1 TYR A 696 18.417 -0.050 -22.620 1.00 0.00 H new ATOM 0 HD2 TYR A 696 20.872 -3.150 -21.045 1.00 0.00 H new ATOM 0 HE1 TYR A 696 19.724 1.620 -21.386 1.00 0.00 H new ATOM 0 HE2 TYR A 696 22.185 -1.486 -19.805 1.00 0.00 H new ATOM 0 HH TYR A 696 21.195 1.864 -19.598 1.00 0.00 H new ATOM 1921 N PRO A 697 16.703 -2.794 -25.437 1.00 0.00 N ATOM 1922 CA PRO A 697 16.177 -3.648 -26.495 1.00 0.00 C ATOM 1923 C PRO A 697 16.923 -4.975 -26.553 1.00 0.00 C ATOM 1924 O PRO A 697 16.329 -6.022 -26.809 1.00 0.00 O ATOM 1925 CB PRO A 697 16.368 -2.824 -27.771 1.00 0.00 C ATOM 1926 CG PRO A 697 16.312 -1.407 -27.310 1.00 0.00 C ATOM 1927 CD PRO A 697 17.020 -1.392 -25.982 1.00 0.00 C ATOM 0 HA PRO A 697 15.133 -3.919 -26.339 1.00 0.00 H new ATOM 0 HB2 PRO A 697 17.321 -3.049 -28.250 1.00 0.00 H new ATOM 0 HB3 PRO A 697 15.587 -3.035 -28.501 1.00 0.00 H new ATOM 0 HG2 PRO A 697 16.800 -0.742 -28.023 1.00 0.00 H new ATOM 0 HG3 PRO A 697 15.281 -1.067 -27.210 1.00 0.00 H new ATOM 0 HD2 PRO A 697 18.092 -1.230 -26.093 1.00 0.00 H new ATOM 0 HD3 PRO A 697 16.644 -0.605 -25.328 1.00 0.00 H new ATOM 1935 N MET A 698 18.229 -4.925 -26.313 1.00 0.00 N ATOM 1936 CA MET A 698 19.073 -6.109 -26.418 1.00 0.00 C ATOM 1937 C MET A 698 18.701 -7.146 -25.366 1.00 0.00 C ATOM 1938 O MET A 698 18.881 -8.346 -25.573 1.00 0.00 O ATOM 1939 CB MET A 698 20.545 -5.722 -26.280 1.00 0.00 C ATOM 1940 CG MET A 698 21.088 -4.891 -27.434 1.00 0.00 C ATOM 1941 SD MET A 698 20.958 -5.737 -29.022 1.00 0.00 S ATOM 1942 CE MET A 698 22.132 -7.069 -28.792 1.00 0.00 C ATOM 0 H MET A 698 18.726 -4.076 -26.044 1.00 0.00 H new ATOM 0 HA MET A 698 18.912 -6.552 -27.401 1.00 0.00 H new ATOM 0 HB2 MET A 698 20.676 -5.164 -25.353 1.00 0.00 H new ATOM 0 HB3 MET A 698 21.140 -6.631 -26.191 1.00 0.00 H new ATOM 0 HG2 MET A 698 20.545 -3.947 -27.484 1.00 0.00 H new ATOM 0 HG3 MET A 698 22.133 -4.647 -27.241 1.00 0.00 H new ATOM 0 HE1 MET A 698 22.353 -7.530 -29.755 1.00 0.00 H new ATOM 0 HE2 MET A 698 23.051 -6.673 -28.360 1.00 0.00 H new ATOM 0 HE3 MET A 698 21.708 -7.816 -28.121 1.00 0.00 H new ATOM 1952 N MET A 699 18.180 -6.677 -24.238 1.00 0.00 N ATOM 1953 CA MET A 699 17.815 -7.560 -23.137 1.00 0.00 C ATOM 1954 C MET A 699 16.324 -7.481 -22.839 1.00 0.00 C ATOM 1955 O MET A 699 15.875 -7.872 -21.761 1.00 0.00 O ATOM 1956 CB MET A 699 18.623 -7.208 -21.889 1.00 0.00 C ATOM 1957 CG MET A 699 20.119 -7.460 -22.014 1.00 0.00 C ATOM 1958 SD MET A 699 20.514 -9.206 -22.233 1.00 0.00 S ATOM 1959 CE MET A 699 20.088 -9.854 -20.619 1.00 0.00 C ATOM 0 H MET A 699 18.001 -5.688 -24.062 1.00 0.00 H new ATOM 0 HA MET A 699 18.046 -8.583 -23.434 1.00 0.00 H new ATOM 0 HB2 MET A 699 18.463 -6.156 -21.653 1.00 0.00 H new ATOM 0 HB3 MET A 699 18.239 -7.786 -21.048 1.00 0.00 H new ATOM 0 HG2 MET A 699 20.509 -6.894 -22.860 1.00 0.00 H new ATOM 0 HG3 MET A 699 20.622 -7.087 -21.122 1.00 0.00 H new ATOM 0 HE1 MET A 699 20.531 -10.842 -20.495 1.00 0.00 H new ATOM 0 HE2 MET A 699 20.469 -9.186 -19.847 1.00 0.00 H new ATOM 0 HE3 MET A 699 19.004 -9.929 -20.532 1.00 0.00 H new ATOM 1969 N ARG A 700 15.559 -6.975 -23.800 1.00 0.00 N ATOM 1970 CA ARG A 700 14.162 -6.630 -23.566 1.00 0.00 C ATOM 1971 C ARG A 700 13.359 -7.851 -23.134 1.00 0.00 C ATOM 1972 O ARG A 700 12.498 -7.761 -22.259 1.00 0.00 O ATOM 1973 CB ARG A 700 13.530 -5.946 -24.769 1.00 0.00 C ATOM 1974 CG ARG A 700 12.100 -5.475 -24.559 1.00 0.00 C ATOM 1975 CD ARG A 700 11.510 -4.770 -25.726 1.00 0.00 C ATOM 1976 NE ARG A 700 12.143 -3.501 -26.047 1.00 0.00 N ATOM 1977 CZ ARG A 700 11.876 -2.335 -25.429 1.00 0.00 C ATOM 1978 NH1 ARG A 700 10.964 -2.262 -24.485 1.00 0.00 N ATOM 1979 NH2 ARG A 700 12.538 -1.258 -25.814 1.00 0.00 N ATOM 0 H ARG A 700 15.884 -6.794 -24.750 1.00 0.00 H new ATOM 0 HA ARG A 700 14.143 -5.910 -22.748 1.00 0.00 H new ATOM 0 HB2 ARG A 700 14.143 -5.088 -25.044 1.00 0.00 H new ATOM 0 HB3 ARG A 700 13.550 -6.636 -25.613 1.00 0.00 H new ATOM 0 HG2 ARG A 700 11.478 -6.337 -24.318 1.00 0.00 H new ATOM 0 HG3 ARG A 700 12.072 -4.810 -23.696 1.00 0.00 H new ATOM 0 HD2 ARG A 700 11.570 -5.422 -26.597 1.00 0.00 H new ATOM 0 HD3 ARG A 700 10.452 -4.595 -25.532 1.00 0.00 H new ATOM 0 HE ARG A 700 12.838 -3.494 -26.793 1.00 0.00 H new ATOM 0 HH11 ARG A 700 10.446 -3.097 -24.211 1.00 0.00 H new ATOM 0 HH12 ARG A 700 10.774 -1.371 -24.027 1.00 0.00 H new ATOM 0 HH21 ARG A 700 13.230 -1.324 -26.561 1.00 0.00 H new ATOM 0 HH22 ARG A 700 12.357 -0.360 -25.364 1.00 0.00 H new