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= 0.821 K(o=1.5,f=0.66) USER MOD Set 1.2: A 696 TYR OH : rot 90:sc= 0.685 USER MOD Set 2.1: A 685 SER OG : rot 180:sc= 0.16 USER MOD Set 2.2: A 688 ASN : amide:sc= -0.909 X(o=-0.75,f=-1.2!) USER MOD Single : A 586 CYS SG : rot 180:sc= 0 USER MOD Single : A 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 SER OG : rot 53:sc= 1.07 USER MOD Single : A 593 MET CE :methyl 178:sc= -2.14 (180deg=-2.15) USER MOD Single : A 598 ASN : amide:sc= -0.011 K(o=-0.011,f=-0.99) USER MOD Single : A 605 THR OG1 : rot 76:sc= 0.682 USER MOD Single : A 606 SER OG : rot 76:sc= 1.01 USER MOD Single : A 607 MET CE :methyl -166:sc= -0.529 (180deg=-0.891) USER MOD Single : A 609 THR OG1 : rot -15:sc= 0.825 USER MOD Single : A 610 LYS NZ :NH3+ 167:sc= 0.816 (180deg=0.658) USER MOD Single : A 617 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 621 TYR OH : rot 180:sc= 0 USER MOD Single : A 627 THR OG1 : rot -74:sc= 1.25 USER MOD Single : A 630 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 631 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 632 MET CE :methyl 165:sc= -0.894 (180deg=-2.19) USER MOD Single : A 633 TYR OH : rot 180:sc= 0 USER MOD Single : A 636 GLN : amide:sc= -0.771 K(o=-0.77,f=-2.1!) USER MOD Single : A 637 HIS : no HE2:sc= 1.17 K(o=1.2,f=-4.5!) USER MOD Single : A 641 SER OG : rot 180:sc= 0 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= 0.0396 X(o=0.04,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= 0.292 USER MOD Single : A 657 TYR OH : rot 154:sc= 0.966 USER MOD Single : A 662 CYS SG : rot 85:sc= -0.416 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 173:sc= 0 USER MOD Single : A 677 THR OG1 : rot 180:sc= 0.614 USER MOD Single : A 678 TYR OH : rot 180:sc= 0 USER MOD Single : A 679 CYS SG : rot -48:sc= -3.95! USER MOD Single : A 682 TYR OH : rot 180:sc= 0 USER MOD Single : A 683 SER OG : rot 180:sc= 0 USER MOD Single : A 690 ASN : amide:sc=-0.00537 K(o=-0.0054,f=-1.2) USER MOD Single : A 698 MET CE :methyl -166:sc= -0.0207 (180deg=-0.267) USER MOD Single : A 699 MET CE :methyl -166:sc= -0.0237 (180deg=-0.308) USER MOD ----------------------------------------------------------------- ATOM 144 N CYS A 586 21.879 0.683 -0.101 1.00 0.00 N ATOM 145 CA CYS A 586 20.741 0.151 -0.841 1.00 0.00 C ATOM 146 C CYS A 586 21.180 -0.450 -2.170 1.00 0.00 C ATOM 147 O CYS A 586 20.654 -1.474 -2.604 1.00 0.00 O ATOM 148 CB CYS A 586 19.877 1.391 -1.070 1.00 0.00 C ATOM 149 SG CYS A 586 18.983 1.962 0.395 1.00 0.00 S ATOM 0 HA CYS A 586 20.225 -0.651 -0.313 1.00 0.00 H new ATOM 0 HB2 CYS A 586 20.513 2.200 -1.431 1.00 0.00 H new ATOM 0 HB3 CYS A 586 19.156 1.176 -1.859 1.00 0.00 H new ATOM 0 HG CYS A 586 18.285 3.016 0.094 1.00 0.00 H new ATOM 155 N ARG A 587 22.148 0.194 -2.813 1.00 0.00 N ATOM 156 CA ARG A 587 22.693 -0.300 -4.072 1.00 0.00 C ATOM 157 C ARG A 587 23.225 -1.720 -3.922 1.00 0.00 C ATOM 158 O ARG A 587 22.898 -2.603 -4.714 1.00 0.00 O ATOM 159 CB ARG A 587 23.748 0.632 -4.647 1.00 0.00 C ATOM 160 CG ARG A 587 24.243 0.260 -6.036 1.00 0.00 C ATOM 161 CD ARG A 587 25.238 1.204 -6.605 1.00 0.00 C ATOM 162 NE ARG A 587 24.733 2.548 -6.832 1.00 0.00 N ATOM 163 CZ ARG A 587 24.042 2.932 -7.923 1.00 0.00 C ATOM 164 NH1 ARG A 587 23.805 2.091 -8.905 1.00 0.00 N ATOM 165 NH2 ARG A 587 23.629 4.186 -7.992 1.00 0.00 N ATOM 0 H ARG A 587 22.572 1.061 -2.482 1.00 0.00 H new ATOM 0 HA ARG A 587 21.872 -0.324 -4.788 1.00 0.00 H new ATOM 0 HB2 ARG A 587 23.340 1.642 -4.681 1.00 0.00 H new ATOM 0 HB3 ARG A 587 24.600 0.655 -3.968 1.00 0.00 H new ATOM 0 HG2 ARG A 587 24.686 -0.735 -5.996 1.00 0.00 H new ATOM 0 HG3 ARG A 587 23.388 0.202 -6.710 1.00 0.00 H new ATOM 0 HD2 ARG A 587 26.093 1.260 -5.932 1.00 0.00 H new ATOM 0 HD3 ARG A 587 25.602 0.802 -7.550 1.00 0.00 H new ATOM 0 HE ARG A 587 24.915 3.250 -6.115 1.00 0.00 H new ATOM 0 HH11 ARG A 587 24.146 1.131 -8.848 1.00 0.00 H new ATOM 0 HH12 ARG A 587 23.280 2.398 -9.724 1.00 0.00 H new ATOM 0 HH21 ARG A 587 23.836 4.834 -7.232 1.00 0.00 H new ATOM 0 HH22 ARG A 587 23.104 4.506 -8.806 1.00 0.00 H new ATOM 179 N LYS A 588 24.048 -1.932 -2.900 1.00 0.00 N ATOM 180 CA LYS A 588 24.629 -3.245 -2.645 1.00 0.00 C ATOM 181 C LYS A 588 23.562 -4.249 -2.229 1.00 0.00 C ATOM 182 O LYS A 588 23.578 -5.402 -2.660 1.00 0.00 O ATOM 183 CB LYS A 588 25.711 -3.152 -1.568 1.00 0.00 C ATOM 184 CG LYS A 588 26.976 -2.426 -2.009 1.00 0.00 C ATOM 185 CD LYS A 588 28.006 -2.380 -0.890 1.00 0.00 C ATOM 186 CE LYS A 588 29.263 -1.642 -1.324 1.00 0.00 C ATOM 187 NZ LYS A 588 30.275 -1.577 -0.234 1.00 0.00 N ATOM 0 H LYS A 588 24.328 -1.211 -2.235 1.00 0.00 H new ATOM 0 HA LYS A 588 25.082 -3.594 -3.573 1.00 0.00 H new ATOM 0 HB2 LYS A 588 25.298 -2.641 -0.698 1.00 0.00 H new ATOM 0 HB3 LYS A 588 25.977 -4.160 -1.249 1.00 0.00 H new ATOM 0 HG2 LYS A 588 27.402 -2.928 -2.878 1.00 0.00 H new ATOM 0 HG3 LYS A 588 26.726 -1.411 -2.318 1.00 0.00 H new ATOM 0 HD2 LYS A 588 27.576 -1.888 -0.018 1.00 0.00 H new ATOM 0 HD3 LYS A 588 28.264 -3.395 -0.589 1.00 0.00 H new ATOM 0 HE2 LYS A 588 29.695 -2.141 -2.191 1.00 0.00 H new ATOM 0 HE3 LYS A 588 29.001 -0.631 -1.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 31.116 -1.066 -0.571 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 29.872 -1.078 0.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 30.545 -2.541 0.047 1.00 0.00 H new ATOM 201 N LEU A 589 22.634 -3.804 -1.388 1.00 0.00 N ATOM 202 CA LEU A 589 21.554 -4.662 -0.915 1.00 0.00 C ATOM 203 C LEU A 589 20.739 -5.214 -2.077 1.00 0.00 C ATOM 204 O LEU A 589 20.464 -6.412 -2.141 1.00 0.00 O ATOM 205 CB LEU A 589 20.649 -3.889 0.053 1.00 0.00 C ATOM 206 CG LEU A 589 19.413 -4.654 0.542 1.00 0.00 C ATOM 207 CD1 LEU A 589 19.829 -5.991 1.141 1.00 0.00 C ATOM 208 CD2 LEU A 589 18.666 -3.813 1.567 1.00 0.00 C ATOM 0 H LEU A 589 22.608 -2.853 -1.020 1.00 0.00 H new ATOM 0 HA LEU A 589 21.998 -5.506 -0.387 1.00 0.00 H new ATOM 0 HB2 LEU A 589 21.240 -3.593 0.920 1.00 0.00 H new ATOM 0 HB3 LEU A 589 20.319 -2.972 -0.436 1.00 0.00 H new ATOM 0 HG LEU A 589 18.750 -4.850 -0.301 1.00 0.00 H new ATOM 0 HD11 LEU A 589 18.944 -6.527 1.485 1.00 0.00 H new ATOM 0 HD12 LEU A 589 20.341 -6.585 0.384 1.00 0.00 H new ATOM 0 HD13 LEU A 589 20.500 -5.820 1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 589 17.788 -4.357 1.914 1.00 0.00 H new ATOM 0 HD22 LEU A 589 19.321 -3.604 2.413 1.00 0.00 H new ATOM 0 HD23 LEU A 589 18.354 -2.874 1.109 1.00 0.00 H new ATOM 220 N VAL A 590 20.355 -4.333 -2.995 1.00 0.00 N ATOM 221 CA VAL A 590 19.608 -4.737 -4.179 1.00 0.00 C ATOM 222 C VAL A 590 20.453 -5.620 -5.089 1.00 0.00 C ATOM 223 O VAL A 590 19.961 -6.597 -5.653 1.00 0.00 O ATOM 224 CB VAL A 590 19.112 -3.518 -4.979 1.00 0.00 C ATOM 225 CG1 VAL A 590 18.535 -3.957 -6.316 1.00 0.00 C ATOM 226 CG2 VAL A 590 18.075 -2.743 -4.181 1.00 0.00 C ATOM 0 H VAL A 590 20.550 -3.333 -2.941 1.00 0.00 H new ATOM 0 HA VAL A 590 18.746 -5.303 -3.827 1.00 0.00 H new ATOM 0 HB VAL A 590 19.962 -2.862 -5.169 1.00 0.00 H new ATOM 0 HG11 VAL A 590 18.189 -3.083 -6.868 1.00 0.00 H new ATOM 0 HG12 VAL A 590 19.304 -4.470 -6.893 1.00 0.00 H new ATOM 0 HG13 VAL A 590 17.697 -4.633 -6.146 1.00 0.00 H new ATOM 0 HG21 VAL A 590 17.736 -1.885 -4.762 1.00 0.00 H new ATOM 0 HG22 VAL A 590 17.226 -3.391 -3.961 1.00 0.00 H new ATOM 0 HG23 VAL A 590 18.519 -2.397 -3.247 1.00 0.00 H new ATOM 236 N ALA A 591 21.727 -5.269 -5.228 1.00 0.00 N ATOM 237 CA ALA A 591 22.622 -5.977 -6.136 1.00 0.00 C ATOM 238 C ALA A 591 22.942 -7.373 -5.615 1.00 0.00 C ATOM 239 O ALA A 591 23.507 -8.198 -6.333 1.00 0.00 O ATOM 240 CB ALA A 591 23.901 -5.180 -6.347 1.00 0.00 C ATOM 0 H ALA A 591 22.163 -4.498 -4.723 1.00 0.00 H new ATOM 0 HA ALA A 591 22.115 -6.085 -7.095 1.00 0.00 H new ATOM 0 HB1 ALA A 591 24.559 -5.721 -7.027 1.00 0.00 H new ATOM 0 HB2 ALA A 591 23.657 -4.208 -6.775 1.00 0.00 H new ATOM 0 HB3 ALA A 591 24.404 -5.039 -5.390 1.00 0.00 H new ATOM 246 N SER A 592 22.577 -7.630 -4.364 1.00 0.00 N ATOM 247 CA SER A 592 22.866 -8.911 -3.730 1.00 0.00 C ATOM 248 C SER A 592 22.080 -10.039 -4.384 1.00 0.00 C ATOM 249 O SER A 592 22.453 -11.208 -4.285 1.00 0.00 O ATOM 250 CB SER A 592 22.556 -8.841 -2.247 1.00 0.00 C ATOM 251 OG SER A 592 23.427 -7.981 -1.567 1.00 0.00 O ATOM 0 H SER A 592 22.080 -6.968 -3.768 1.00 0.00 H new ATOM 0 HA SER A 592 23.927 -9.123 -3.861 1.00 0.00 H new ATOM 0 HB2 SER A 592 21.530 -8.502 -2.107 1.00 0.00 H new ATOM 0 HB3 SER A 592 22.623 -9.840 -1.815 1.00 0.00 H new ATOM 0 HG SER A 592 23.429 -7.104 -2.005 1.00 0.00 H new ATOM 257 N MET A 593 20.989 -9.682 -5.054 1.00 0.00 N ATOM 258 CA MET A 593 20.146 -10.665 -5.725 1.00 0.00 C ATOM 259 C MET A 593 20.957 -11.516 -6.694 1.00 0.00 C ATOM 260 O MET A 593 21.686 -10.991 -7.535 1.00 0.00 O ATOM 261 CB MET A 593 19.005 -9.966 -6.462 1.00 0.00 C ATOM 262 CG MET A 593 17.886 -9.466 -5.559 1.00 0.00 C ATOM 263 SD MET A 593 16.522 -8.732 -6.485 1.00 0.00 S ATOM 264 CE MET A 593 17.280 -7.215 -7.058 1.00 0.00 C ATOM 0 H MET A 593 20.668 -8.718 -5.147 1.00 0.00 H new ATOM 0 HA MET A 593 19.727 -11.326 -4.966 1.00 0.00 H new ATOM 0 HB2 MET A 593 19.412 -9.121 -7.018 1.00 0.00 H new ATOM 0 HB3 MET A 593 18.584 -10.656 -7.193 1.00 0.00 H new ATOM 0 HG2 MET A 593 17.509 -10.295 -4.961 1.00 0.00 H new ATOM 0 HG3 MET A 593 18.287 -8.728 -4.864 1.00 0.00 H new ATOM 0 HE1 MET A 593 16.571 -6.665 -7.677 1.00 0.00 H new ATOM 0 HE2 MET A 593 17.563 -6.604 -6.201 1.00 0.00 H new ATOM 0 HE3 MET A 593 18.168 -7.451 -7.645 1.00 0.00 H new ATOM 274 N PRO A 594 20.824 -12.832 -6.571 1.00 0.00 N ATOM 275 CA PRO A 594 21.491 -13.757 -7.480 1.00 0.00 C ATOM 276 C PRO A 594 21.151 -13.445 -8.931 1.00 0.00 C ATOM 277 O PRO A 594 22.030 -13.420 -9.793 1.00 0.00 O ATOM 278 CB PRO A 594 20.979 -15.136 -7.052 1.00 0.00 C ATOM 279 CG PRO A 594 20.648 -14.978 -5.607 1.00 0.00 C ATOM 280 CD PRO A 594 20.055 -13.600 -5.483 1.00 0.00 C ATOM 0 HA PRO A 594 22.578 -13.692 -7.426 1.00 0.00 H new ATOM 0 HB2 PRO A 594 20.103 -15.431 -7.630 1.00 0.00 H new ATOM 0 HB3 PRO A 594 21.736 -15.905 -7.204 1.00 0.00 H new ATOM 0 HG2 PRO A 594 19.942 -15.741 -5.280 1.00 0.00 H new ATOM 0 HG3 PRO A 594 21.538 -15.080 -4.986 1.00 0.00 H new ATOM 0 HD2 PRO A 594 18.980 -13.599 -5.663 1.00 0.00 H new ATOM 0 HD3 PRO A 594 20.212 -13.174 -4.492 1.00 0.00 H new ATOM 288 N LEU A 595 19.871 -13.205 -9.196 1.00 0.00 N ATOM 289 CA LEU A 595 19.406 -12.936 -10.551 1.00 0.00 C ATOM 290 C LEU A 595 20.030 -11.661 -11.104 1.00 0.00 C ATOM 291 O LEU A 595 20.413 -11.602 -12.273 1.00 0.00 O ATOM 292 CB LEU A 595 17.876 -12.836 -10.577 1.00 0.00 C ATOM 293 CG LEU A 595 17.265 -12.530 -11.950 1.00 0.00 C ATOM 294 CD1 LEU A 595 17.639 -13.620 -12.944 1.00 0.00 C ATOM 295 CD2 LEU A 595 15.753 -12.415 -11.819 1.00 0.00 C ATOM 0 H LEU A 595 19.136 -13.191 -8.489 1.00 0.00 H new ATOM 0 HA LEU A 595 19.717 -13.765 -11.186 1.00 0.00 H new ATOM 0 HB2 LEU A 595 17.460 -13.776 -10.213 1.00 0.00 H new ATOM 0 HB3 LEU A 595 17.567 -12.059 -9.878 1.00 0.00 H new ATOM 0 HG LEU A 595 17.659 -11.583 -12.320 1.00 0.00 H new ATOM 0 HD11 LEU A 595 17.200 -13.393 -13.915 1.00 0.00 H new ATOM 0 HD12 LEU A 595 18.724 -13.669 -13.039 1.00 0.00 H new ATOM 0 HD13 LEU A 595 17.261 -14.580 -12.591 1.00 0.00 H new ATOM 0 HD21 LEU A 595 15.319 -12.197 -12.795 1.00 0.00 H new ATOM 0 HD22 LEU A 595 15.348 -13.354 -11.443 1.00 0.00 H new ATOM 0 HD23 LEU A 595 15.508 -11.611 -11.125 1.00 0.00 H new ATOM 307 N PHE A 596 20.130 -10.642 -10.258 1.00 0.00 N ATOM 308 CA PHE A 596 20.651 -9.346 -10.677 1.00 0.00 C ATOM 309 C PHE A 596 22.104 -9.174 -10.252 1.00 0.00 C ATOM 310 O PHE A 596 22.637 -8.065 -10.266 1.00 0.00 O ATOM 311 CB PHE A 596 19.797 -8.215 -10.102 1.00 0.00 C ATOM 312 CG PHE A 596 18.391 -8.189 -10.631 1.00 0.00 C ATOM 313 CD1 PHE A 596 17.396 -8.947 -10.033 1.00 0.00 C ATOM 314 CD2 PHE A 596 18.061 -7.406 -11.727 1.00 0.00 C ATOM 315 CE1 PHE A 596 16.102 -8.924 -10.519 1.00 0.00 C ATOM 316 CE2 PHE A 596 16.769 -7.380 -12.214 1.00 0.00 C ATOM 317 CZ PHE A 596 15.788 -8.140 -11.609 1.00 0.00 C ATOM 0 H PHE A 596 19.857 -10.688 -9.276 1.00 0.00 H new ATOM 0 HA PHE A 596 20.607 -9.304 -11.765 1.00 0.00 H new ATOM 0 HB2 PHE A 596 19.765 -8.312 -9.017 1.00 0.00 H new ATOM 0 HB3 PHE A 596 20.276 -7.261 -10.323 1.00 0.00 H new ATOM 0 HD1 PHE A 596 17.634 -9.562 -9.178 1.00 0.00 H new ATOM 0 HD2 PHE A 596 18.824 -6.809 -12.205 1.00 0.00 H new ATOM 0 HE1 PHE A 596 15.337 -9.520 -10.045 1.00 0.00 H new ATOM 0 HE2 PHE A 596 16.526 -6.765 -13.068 1.00 0.00 H new ATOM 0 HZ PHE A 596 14.777 -8.121 -11.989 1.00 0.00 H new ATOM 327 N ALA A 597 22.740 -10.278 -9.874 1.00 0.00 N ATOM 328 CA ALA A 597 24.140 -10.255 -9.470 1.00 0.00 C ATOM 329 C ALA A 597 25.031 -9.749 -10.598 1.00 0.00 C ATOM 330 O ALA A 597 26.023 -9.062 -10.357 1.00 0.00 O ATOM 331 CB ALA A 597 24.584 -11.640 -9.021 1.00 0.00 C ATOM 0 H ALA A 597 22.307 -11.201 -9.839 1.00 0.00 H new ATOM 0 HA ALA A 597 24.238 -9.566 -8.631 1.00 0.00 H new ATOM 0 HB1 ALA A 597 25.632 -11.607 -8.722 1.00 0.00 H new ATOM 0 HB2 ALA A 597 23.975 -11.961 -8.175 1.00 0.00 H new ATOM 0 HB3 ALA A 597 24.463 -12.345 -9.843 1.00 0.00 H new ATOM 337 N ASN A 598 24.669 -10.092 -11.830 1.00 0.00 N ATOM 338 CA ASN A 598 25.434 -9.671 -12.998 1.00 0.00 C ATOM 339 C ASN A 598 24.666 -8.642 -13.817 1.00 0.00 C ATOM 340 O ASN A 598 24.951 -8.435 -14.996 1.00 0.00 O ATOM 341 CB ASN A 598 25.815 -10.855 -13.868 1.00 0.00 C ATOM 342 CG ASN A 598 26.811 -11.781 -13.226 1.00 0.00 C ATOM 343 OD1 ASN A 598 27.642 -11.364 -12.411 1.00 0.00 O ATOM 344 ND2 ASN A 598 26.785 -13.019 -13.651 1.00 0.00 N ATOM 0 H ASN A 598 23.850 -10.661 -12.045 1.00 0.00 H new ATOM 0 HA ASN A 598 26.351 -9.208 -12.633 1.00 0.00 H new ATOM 0 HB2 ASN A 598 24.915 -11.418 -14.114 1.00 0.00 H new ATOM 0 HB3 ASN A 598 26.228 -10.487 -14.807 1.00 0.00 H new ATOM 0 HD21 ASN A 598 27.472 -13.690 -13.308 1.00 0.00 H new ATOM 0 HD22 ASN A 598 26.077 -13.312 -14.325 1.00 0.00 H new ATOM 351 N ALA A 599 23.690 -7.998 -13.184 1.00 0.00 N ATOM 352 CA ALA A 599 22.884 -6.983 -13.851 1.00 0.00 C ATOM 353 C ALA A 599 23.717 -5.755 -14.194 1.00 0.00 C ATOM 354 O ALA A 599 24.675 -5.427 -13.493 1.00 0.00 O ATOM 355 CB ALA A 599 21.695 -6.596 -12.983 1.00 0.00 C ATOM 0 H ALA A 599 23.439 -8.162 -12.209 1.00 0.00 H new ATOM 0 HA ALA A 599 22.513 -7.407 -14.784 1.00 0.00 H new ATOM 0 HB1 ALA A 599 21.103 -5.837 -13.495 1.00 0.00 H new ATOM 0 HB2 ALA A 599 21.078 -7.475 -12.799 1.00 0.00 H new ATOM 0 HB3 ALA A 599 22.052 -6.198 -12.033 1.00 0.00 H new ATOM 361 N ASP A 600 23.348 -5.079 -15.276 1.00 0.00 N ATOM 362 CA ASP A 600 24.037 -3.863 -15.693 1.00 0.00 C ATOM 363 C ASP A 600 23.993 -2.803 -14.600 1.00 0.00 C ATOM 364 O ASP A 600 22.997 -2.672 -13.888 1.00 0.00 O ATOM 365 CB ASP A 600 23.424 -3.314 -16.983 1.00 0.00 C ATOM 366 CG ASP A 600 23.744 -4.129 -18.229 1.00 0.00 C ATOM 367 OD1 ASP A 600 24.586 -4.992 -18.150 1.00 0.00 O ATOM 368 OD2 ASP A 600 23.040 -3.993 -19.200 1.00 0.00 O ATOM 0 H ASP A 600 22.574 -5.353 -15.881 1.00 0.00 H new ATOM 0 HA ASP A 600 25.080 -4.119 -15.879 1.00 0.00 H new ATOM 0 HB2 ASP A 600 22.342 -3.265 -16.864 1.00 0.00 H new ATOM 0 HB3 ASP A 600 23.775 -2.293 -17.132 1.00 0.00 H new ATOM 373 N PRO A 601 25.078 -2.047 -14.472 1.00 0.00 N ATOM 374 CA PRO A 601 25.133 -0.940 -13.525 1.00 0.00 C ATOM 375 C PRO A 601 23.940 -0.009 -13.697 1.00 0.00 C ATOM 376 O PRO A 601 23.437 0.556 -12.726 1.00 0.00 O ATOM 377 CB PRO A 601 26.460 -0.242 -13.842 1.00 0.00 C ATOM 378 CG PRO A 601 27.329 -1.325 -14.383 1.00 0.00 C ATOM 379 CD PRO A 601 26.419 -2.191 -15.212 1.00 0.00 C ATOM 0 HA PRO A 601 25.085 -1.269 -12.487 1.00 0.00 H new ATOM 0 HB2 PRO A 601 26.324 0.559 -14.569 1.00 0.00 H new ATOM 0 HB3 PRO A 601 26.895 0.208 -12.950 1.00 0.00 H new ATOM 0 HG2 PRO A 601 28.138 -0.915 -14.987 1.00 0.00 H new ATOM 0 HG3 PRO A 601 27.790 -1.897 -13.578 1.00 0.00 H new ATOM 0 HD2 PRO A 601 26.355 -1.845 -16.244 1.00 0.00 H new ATOM 0 HD3 PRO A 601 26.758 -3.226 -15.244 1.00 0.00 H new ATOM 387 N ASN A 602 23.491 0.148 -14.937 1.00 0.00 N ATOM 388 CA ASN A 602 22.350 1.003 -15.237 1.00 0.00 C ATOM 389 C ASN A 602 21.047 0.369 -14.767 1.00 0.00 C ATOM 390 O ASN A 602 20.130 1.063 -14.328 1.00 0.00 O ATOM 391 CB ASN A 602 22.271 1.326 -16.718 1.00 0.00 C ATOM 392 CG ASN A 602 23.341 2.272 -17.189 1.00 0.00 C ATOM 393 OD1 ASN A 602 23.996 2.949 -16.388 1.00 0.00 O ATOM 394 ND2 ASN A 602 23.466 2.382 -18.487 1.00 0.00 N ATOM 0 H ASN A 602 23.901 -0.307 -15.752 1.00 0.00 H new ATOM 0 HA ASN A 602 22.497 1.936 -14.692 1.00 0.00 H new ATOM 0 HB2 ASN A 602 22.342 0.399 -17.287 1.00 0.00 H new ATOM 0 HB3 ASN A 602 21.295 1.759 -16.935 1.00 0.00 H new ATOM 0 HD21 ASN A 602 24.128 3.050 -18.881 1.00 0.00 H new ATOM 0 HD22 ASN A 602 22.901 1.799 -19.105 1.00 0.00 H new ATOM 401 N PHE A 603 20.971 -0.954 -14.862 1.00 0.00 N ATOM 402 CA PHE A 603 19.815 -1.693 -14.369 1.00 0.00 C ATOM 403 C PHE A 603 19.721 -1.619 -12.850 1.00 0.00 C ATOM 404 O PHE A 603 18.627 -1.570 -12.288 1.00 0.00 O ATOM 405 CB PHE A 603 19.881 -3.153 -14.821 1.00 0.00 C ATOM 406 CG PHE A 603 19.520 -3.357 -16.265 1.00 0.00 C ATOM 407 CD1 PHE A 603 19.230 -2.274 -17.082 1.00 0.00 C ATOM 408 CD2 PHE A 603 19.469 -4.631 -16.810 1.00 0.00 C ATOM 409 CE1 PHE A 603 18.898 -2.460 -18.411 1.00 0.00 C ATOM 410 CE2 PHE A 603 19.138 -4.820 -18.137 1.00 0.00 C ATOM 411 CZ PHE A 603 18.852 -3.733 -18.938 1.00 0.00 C ATOM 0 H PHE A 603 21.698 -1.537 -15.277 1.00 0.00 H new ATOM 0 HA PHE A 603 18.921 -1.232 -14.789 1.00 0.00 H new ATOM 0 HB2 PHE A 603 20.889 -3.531 -14.651 1.00 0.00 H new ATOM 0 HB3 PHE A 603 19.209 -3.746 -14.201 1.00 0.00 H new ATOM 0 HD1 PHE A 603 19.264 -1.274 -16.675 1.00 0.00 H new ATOM 0 HD2 PHE A 603 19.691 -5.486 -16.189 1.00 0.00 H new ATOM 0 HE1 PHE A 603 18.675 -1.608 -19.036 1.00 0.00 H new ATOM 0 HE2 PHE A 603 19.103 -5.818 -18.548 1.00 0.00 H new ATOM 0 HZ PHE A 603 18.593 -3.880 -19.976 1.00 0.00 H new ATOM 421 N VAL A 604 20.875 -1.611 -12.191 1.00 0.00 N ATOM 422 CA VAL A 604 20.929 -1.452 -10.743 1.00 0.00 C ATOM 423 C VAL A 604 20.391 -0.091 -10.318 1.00 0.00 C ATOM 424 O VAL A 604 19.529 0.001 -9.444 1.00 0.00 O ATOM 425 CB VAL A 604 22.364 -1.615 -10.209 1.00 0.00 C ATOM 426 CG1 VAL A 604 22.427 -1.257 -8.731 1.00 0.00 C ATOM 427 CG2 VAL A 604 22.858 -3.036 -10.433 1.00 0.00 C ATOM 0 H VAL A 604 21.786 -1.713 -12.638 1.00 0.00 H new ATOM 0 HA VAL A 604 20.302 -2.236 -10.318 1.00 0.00 H new ATOM 0 HB VAL A 604 23.014 -0.933 -10.757 1.00 0.00 H new ATOM 0 HG11 VAL A 604 23.449 -1.378 -8.371 1.00 0.00 H new ATOM 0 HG12 VAL A 604 22.114 -0.222 -8.594 1.00 0.00 H new ATOM 0 HG13 VAL A 604 21.764 -1.914 -8.169 1.00 0.00 H new ATOM 0 HG21 VAL A 604 23.874 -3.133 -10.050 1.00 0.00 H new ATOM 0 HG22 VAL A 604 22.205 -3.735 -9.911 1.00 0.00 H new ATOM 0 HG23 VAL A 604 22.850 -3.260 -11.500 1.00 0.00 H new ATOM 437 N THR A 605 20.905 0.963 -10.941 1.00 0.00 N ATOM 438 CA THR A 605 20.408 2.313 -10.702 1.00 0.00 C ATOM 439 C THR A 605 18.915 2.409 -10.987 1.00 0.00 C ATOM 440 O THR A 605 18.160 2.987 -10.206 1.00 0.00 O ATOM 441 CB THR A 605 21.152 3.351 -11.562 1.00 0.00 C ATOM 442 OG1 THR A 605 22.542 3.360 -11.210 1.00 0.00 O ATOM 443 CG2 THR A 605 20.569 4.739 -11.347 1.00 0.00 C ATOM 0 H THR A 605 21.667 0.909 -11.617 1.00 0.00 H new ATOM 0 HA THR A 605 20.589 2.531 -9.649 1.00 0.00 H new ATOM 0 HB THR A 605 21.038 3.079 -12.611 1.00 0.00 H new ATOM 0 HG1 THR A 605 22.981 2.570 -11.589 1.00 0.00 H new ATOM 0 HG21 THR A 605 21.107 5.459 -11.963 1.00 0.00 H new ATOM 0 HG22 THR A 605 19.515 4.738 -11.627 1.00 0.00 H new ATOM 0 HG23 THR A 605 20.666 5.016 -10.297 1.00 0.00 H new ATOM 451 N SER A 606 18.495 1.837 -12.111 1.00 0.00 N ATOM 452 CA SER A 606 17.090 1.854 -12.500 1.00 0.00 C ATOM 453 C SER A 606 16.206 1.280 -11.400 1.00 0.00 C ATOM 454 O SER A 606 15.210 1.889 -11.009 1.00 0.00 O ATOM 455 CB SER A 606 16.896 1.082 -13.790 1.00 0.00 C ATOM 456 OG SER A 606 17.479 1.732 -14.886 1.00 0.00 O ATOM 0 H SER A 606 19.108 1.356 -12.769 1.00 0.00 H new ATOM 0 HA SER A 606 16.795 2.891 -12.659 1.00 0.00 H new ATOM 0 HB2 SER A 606 17.330 0.088 -13.686 1.00 0.00 H new ATOM 0 HB3 SER A 606 15.830 0.947 -13.974 1.00 0.00 H new ATOM 0 HG SER A 606 18.451 1.607 -14.862 1.00 0.00 H new ATOM 462 N MET A 607 16.577 0.105 -10.903 1.00 0.00 N ATOM 463 CA MET A 607 15.853 -0.527 -9.807 1.00 0.00 C ATOM 464 C MET A 607 15.788 0.388 -8.590 1.00 0.00 C ATOM 465 O MET A 607 14.732 0.552 -7.980 1.00 0.00 O ATOM 466 CB MET A 607 16.510 -1.855 -9.435 1.00 0.00 C ATOM 467 CG MET A 607 16.300 -2.968 -10.452 1.00 0.00 C ATOM 468 SD MET A 607 16.909 -4.563 -9.872 1.00 0.00 S ATOM 469 CE MET A 607 18.678 -4.309 -9.980 1.00 0.00 C ATOM 0 H MET A 607 17.376 -0.430 -11.243 1.00 0.00 H new ATOM 0 HA MET A 607 14.833 -0.717 -10.142 1.00 0.00 H new ATOM 0 HB2 MET A 607 17.580 -1.693 -9.307 1.00 0.00 H new ATOM 0 HB3 MET A 607 16.120 -2.182 -8.471 1.00 0.00 H new ATOM 0 HG2 MET A 607 15.237 -3.050 -10.680 1.00 0.00 H new ATOM 0 HG3 MET A 607 16.806 -2.706 -11.381 1.00 0.00 H new ATOM 0 HE1 MET A 607 19.189 -5.268 -9.897 1.00 0.00 H new ATOM 0 HE2 MET A 607 18.922 -3.849 -10.938 1.00 0.00 H new ATOM 0 HE3 MET A 607 19.002 -3.655 -9.171 1.00 0.00 H new ATOM 479 N LEU A 608 16.925 0.982 -8.242 1.00 0.00 N ATOM 480 CA LEU A 608 17.017 1.820 -7.053 1.00 0.00 C ATOM 481 C LEU A 608 16.045 2.990 -7.127 1.00 0.00 C ATOM 482 O LEU A 608 15.421 3.356 -6.130 1.00 0.00 O ATOM 483 CB LEU A 608 18.453 2.330 -6.875 1.00 0.00 C ATOM 484 CG LEU A 608 19.476 1.267 -6.455 1.00 0.00 C ATOM 485 CD1 LEU A 608 20.884 1.845 -6.514 1.00 0.00 C ATOM 486 CD2 LEU A 608 19.153 0.775 -5.052 1.00 0.00 C ATOM 0 H LEU A 608 17.795 0.898 -8.767 1.00 0.00 H new ATOM 0 HA LEU A 608 16.746 1.213 -6.189 1.00 0.00 H new ATOM 0 HB2 LEU A 608 18.782 2.777 -7.813 1.00 0.00 H new ATOM 0 HB3 LEU A 608 18.450 3.124 -6.128 1.00 0.00 H new ATOM 0 HG LEU A 608 19.425 0.422 -7.142 1.00 0.00 H new ATOM 0 HD11 LEU A 608 21.603 1.083 -6.214 1.00 0.00 H new ATOM 0 HD12 LEU A 608 21.102 2.169 -7.532 1.00 0.00 H new ATOM 0 HD13 LEU A 608 20.956 2.697 -5.839 1.00 0.00 H new ATOM 0 HD21 LEU A 608 19.881 0.020 -4.755 1.00 0.00 H new ATOM 0 HD22 LEU A 608 19.193 1.612 -4.355 1.00 0.00 H new ATOM 0 HD23 LEU A 608 18.153 0.340 -5.040 1.00 0.00 H new ATOM 498 N THR A 609 15.919 3.575 -8.313 1.00 0.00 N ATOM 499 CA THR A 609 15.083 4.754 -8.502 1.00 0.00 C ATOM 500 C THR A 609 13.607 4.380 -8.555 1.00 0.00 C ATOM 501 O THR A 609 12.735 5.248 -8.514 1.00 0.00 O ATOM 502 CB THR A 609 15.456 5.511 -9.790 1.00 0.00 C ATOM 503 OG1 THR A 609 15.275 4.652 -10.922 1.00 0.00 O ATOM 504 CG2 THR A 609 16.904 5.974 -9.736 1.00 0.00 C ATOM 0 H THR A 609 16.387 3.251 -9.160 1.00 0.00 H new ATOM 0 HA THR A 609 15.260 5.404 -7.645 1.00 0.00 H new ATOM 0 HB THR A 609 14.809 6.384 -9.881 1.00 0.00 H new ATOM 0 HG1 THR A 609 15.189 3.724 -10.618 1.00 0.00 H new ATOM 0 HG21 THR A 609 17.150 6.507 -10.654 1.00 0.00 H new ATOM 0 HG22 THR A 609 17.042 6.638 -8.883 1.00 0.00 H new ATOM 0 HG23 THR A 609 17.559 5.109 -9.632 1.00 0.00 H new ATOM 512 N LYS A 610 13.334 3.083 -8.646 1.00 0.00 N ATOM 513 CA LYS A 610 11.962 2.590 -8.684 1.00 0.00 C ATOM 514 C LYS A 610 11.522 2.078 -7.318 1.00 0.00 C ATOM 515 O LYS A 610 10.360 1.722 -7.123 1.00 0.00 O ATOM 516 CB LYS A 610 11.819 1.485 -9.731 1.00 0.00 C ATOM 517 CG LYS A 610 12.005 1.953 -11.169 1.00 0.00 C ATOM 518 CD LYS A 610 11.971 0.783 -12.140 1.00 0.00 C ATOM 519 CE LYS A 610 12.376 1.214 -13.542 1.00 0.00 C ATOM 520 NZ LYS A 610 11.353 2.093 -14.171 1.00 0.00 N ATOM 0 H LYS A 610 14.045 2.354 -8.695 1.00 0.00 H new ATOM 0 HA LYS A 610 11.316 3.424 -8.959 1.00 0.00 H new ATOM 0 HB2 LYS A 610 12.549 0.703 -9.519 1.00 0.00 H new ATOM 0 HB3 LYS A 610 10.831 1.034 -9.633 1.00 0.00 H new ATOM 0 HG2 LYS A 610 11.221 2.665 -11.426 1.00 0.00 H new ATOM 0 HG3 LYS A 610 12.955 2.478 -11.263 1.00 0.00 H new ATOM 0 HD2 LYS A 610 12.642 -0.002 -11.791 1.00 0.00 H new ATOM 0 HD3 LYS A 610 10.968 0.357 -12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 610 13.329 1.741 -13.498 1.00 0.00 H new ATOM 0 HE3 LYS A 610 12.527 0.331 -14.163 1.00 0.00 H new ATOM 0 HZ1 LYS A 610 11.754 2.540 -15.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 610 10.524 1.525 -14.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 610 11.065 2.830 -13.495 1.00 0.00 H new ATOM 534 N LEU A 611 12.458 2.042 -6.376 1.00 0.00 N ATOM 535 CA LEU A 611 12.181 1.531 -5.039 1.00 0.00 C ATOM 536 C LEU A 611 11.170 2.409 -4.313 1.00 0.00 C ATOM 537 O LEU A 611 11.303 3.632 -4.284 1.00 0.00 O ATOM 538 CB LEU A 611 13.480 1.431 -4.230 1.00 0.00 C ATOM 539 CG LEU A 611 14.434 0.310 -4.662 1.00 0.00 C ATOM 540 CD1 LEU A 611 15.692 0.337 -3.806 1.00 0.00 C ATOM 541 CD2 LEU A 611 13.728 -1.033 -4.543 1.00 0.00 C ATOM 0 H LEU A 611 13.417 2.361 -6.514 1.00 0.00 H new ATOM 0 HA LEU A 611 11.750 0.535 -5.140 1.00 0.00 H new ATOM 0 HB2 LEU A 611 14.007 2.382 -4.301 1.00 0.00 H new ATOM 0 HB3 LEU A 611 13.225 1.285 -3.180 1.00 0.00 H new ATOM 0 HG LEU A 611 14.726 0.461 -5.701 1.00 0.00 H new ATOM 0 HD11 LEU A 611 16.363 -0.462 -4.120 1.00 0.00 H new ATOM 0 HD12 LEU A 611 16.192 1.298 -3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 611 15.423 0.195 -2.759 1.00 0.00 H new ATOM 0 HD21 LEU A 611 14.406 -1.829 -4.850 1.00 0.00 H new ATOM 0 HD22 LEU A 611 13.424 -1.194 -3.509 1.00 0.00 H new ATOM 0 HD23 LEU A 611 12.847 -1.039 -5.185 1.00 0.00 H new ATOM 553 N ARG A 612 10.159 1.777 -3.726 1.00 0.00 N ATOM 554 CA ARG A 612 9.154 2.495 -2.951 1.00 0.00 C ATOM 555 C ARG A 612 9.388 2.325 -1.455 1.00 0.00 C ATOM 556 O ARG A 612 9.615 1.215 -0.974 1.00 0.00 O ATOM 557 CB ARG A 612 7.737 2.099 -3.341 1.00 0.00 C ATOM 558 CG ARG A 612 7.328 2.494 -4.751 1.00 0.00 C ATOM 559 CD ARG A 612 5.969 2.041 -5.144 1.00 0.00 C ATOM 560 NE ARG A 612 5.583 2.400 -6.499 1.00 0.00 N ATOM 561 CZ ARG A 612 4.397 2.097 -7.063 1.00 0.00 C ATOM 562 NH1 ARG A 612 3.495 1.399 -6.408 1.00 0.00 N ATOM 563 NH2 ARG A 612 4.174 2.499 -8.302 1.00 0.00 N ATOM 0 H ARG A 612 10.014 0.768 -3.772 1.00 0.00 H new ATOM 0 HA ARG A 612 9.262 3.553 -3.189 1.00 0.00 H new ATOM 0 HB2 ARG A 612 7.636 1.019 -3.238 1.00 0.00 H new ATOM 0 HB3 ARG A 612 7.041 2.553 -2.636 1.00 0.00 H new ATOM 0 HG2 ARG A 612 7.376 3.579 -4.840 1.00 0.00 H new ATOM 0 HG3 ARG A 612 8.052 2.084 -5.455 1.00 0.00 H new ATOM 0 HD2 ARG A 612 5.917 0.957 -5.040 1.00 0.00 H new ATOM 0 HD3 ARG A 612 5.244 2.464 -4.449 1.00 0.00 H new ATOM 0 HE ARG A 612 6.257 2.918 -7.063 1.00 0.00 H new ATOM 0 HH11 ARG A 612 3.688 1.079 -5.459 1.00 0.00 H new ATOM 0 HH12 ARG A 612 2.602 1.178 -6.849 1.00 0.00 H new ATOM 0 HH21 ARG A 612 4.890 3.023 -8.805 1.00 0.00 H new ATOM 0 HH22 ARG A 612 3.286 2.285 -8.756 1.00 0.00 H new ATOM 577 N PHE A 613 9.331 3.433 -0.724 1.00 0.00 N ATOM 578 CA PHE A 613 9.716 3.443 0.683 1.00 0.00 C ATOM 579 C PHE A 613 8.515 3.185 1.584 1.00 0.00 C ATOM 580 O PHE A 613 7.444 3.757 1.386 1.00 0.00 O ATOM 581 CB PHE A 613 10.371 4.776 1.048 1.00 0.00 C ATOM 582 CG PHE A 613 10.793 4.869 2.487 1.00 0.00 C ATOM 583 CD1 PHE A 613 11.881 4.146 2.954 1.00 0.00 C ATOM 584 CD2 PHE A 613 10.103 5.679 3.376 1.00 0.00 C ATOM 585 CE1 PHE A 613 12.269 4.232 4.278 1.00 0.00 C ATOM 586 CE2 PHE A 613 10.490 5.767 4.699 1.00 0.00 C ATOM 587 CZ PHE A 613 11.574 5.042 5.150 1.00 0.00 C ATOM 0 H PHE A 613 9.022 4.336 -1.083 1.00 0.00 H new ATOM 0 HA PHE A 613 10.437 2.640 0.838 1.00 0.00 H new ATOM 0 HB2 PHE A 613 11.243 4.928 0.412 1.00 0.00 H new ATOM 0 HB3 PHE A 613 9.673 5.585 0.830 1.00 0.00 H new ATOM 0 HD1 PHE A 613 12.430 3.509 2.276 1.00 0.00 H new ATOM 0 HD2 PHE A 613 9.253 6.248 3.030 1.00 0.00 H new ATOM 0 HE1 PHE A 613 13.118 3.664 4.629 1.00 0.00 H new ATOM 0 HE2 PHE A 613 9.944 6.403 5.380 1.00 0.00 H new ATOM 0 HZ PHE A 613 11.877 5.109 6.184 1.00 0.00 H new ATOM 597 N GLU A 614 8.701 2.319 2.575 1.00 0.00 N ATOM 598 CA GLU A 614 7.675 2.077 3.583 1.00 0.00 C ATOM 599 C GLU A 614 8.294 1.649 4.907 1.00 0.00 C ATOM 600 O GLU A 614 9.163 0.778 4.944 1.00 0.00 O ATOM 601 CB GLU A 614 6.687 1.015 3.097 1.00 0.00 C ATOM 602 CG GLU A 614 5.460 0.846 3.982 1.00 0.00 C ATOM 603 CD GLU A 614 4.479 -0.119 3.377 1.00 0.00 C ATOM 604 OE1 GLU A 614 4.765 -0.651 2.331 1.00 0.00 O ATOM 605 OE2 GLU A 614 3.493 -0.411 4.013 1.00 0.00 O ATOM 0 H GLU A 614 9.553 1.773 2.702 1.00 0.00 H new ATOM 0 HA GLU A 614 7.139 3.012 3.744 1.00 0.00 H new ATOM 0 HB2 GLU A 614 6.361 1.274 2.090 1.00 0.00 H new ATOM 0 HB3 GLU A 614 7.205 0.058 3.028 1.00 0.00 H new ATOM 0 HG2 GLU A 614 5.765 0.489 4.966 1.00 0.00 H new ATOM 0 HG3 GLU A 614 4.979 1.813 4.129 1.00 0.00 H new ATOM 612 N VAL A 615 7.842 2.267 5.993 1.00 0.00 N ATOM 613 CA VAL A 615 8.245 1.856 7.332 1.00 0.00 C ATOM 614 C VAL A 615 7.248 0.873 7.931 1.00 0.00 C ATOM 615 O VAL A 615 6.041 0.988 7.712 1.00 0.00 O ATOM 616 CB VAL A 615 8.388 3.065 8.276 1.00 0.00 C ATOM 617 CG1 VAL A 615 8.724 2.604 9.686 1.00 0.00 C ATOM 618 CG2 VAL A 615 9.455 4.020 7.761 1.00 0.00 C ATOM 0 H VAL A 615 7.195 3.056 5.971 1.00 0.00 H new ATOM 0 HA VAL A 615 9.215 1.369 7.231 1.00 0.00 H new ATOM 0 HB VAL A 615 7.435 3.594 8.304 1.00 0.00 H new ATOM 0 HG11 VAL A 615 8.821 3.471 10.339 1.00 0.00 H new ATOM 0 HG12 VAL A 615 7.928 1.958 10.057 1.00 0.00 H new ATOM 0 HG13 VAL A 615 9.664 2.052 9.674 1.00 0.00 H new ATOM 0 HG21 VAL A 615 9.543 4.868 8.440 1.00 0.00 H new ATOM 0 HG22 VAL A 615 10.412 3.500 7.704 1.00 0.00 H new ATOM 0 HG23 VAL A 615 9.176 4.376 6.769 1.00 0.00 H new ATOM 628 N PHE A 616 7.757 -0.093 8.686 1.00 0.00 N ATOM 629 CA PHE A 616 6.908 -1.074 9.352 1.00 0.00 C ATOM 630 C PHE A 616 7.169 -1.101 10.853 1.00 0.00 C ATOM 631 O PHE A 616 8.319 -1.096 11.293 1.00 0.00 O ATOM 632 CB PHE A 616 7.129 -2.465 8.755 1.00 0.00 C ATOM 633 CG PHE A 616 6.731 -2.575 7.310 1.00 0.00 C ATOM 634 CD1 PHE A 616 5.429 -2.894 6.957 1.00 0.00 C ATOM 635 CD2 PHE A 616 7.658 -2.358 6.302 1.00 0.00 C ATOM 636 CE1 PHE A 616 5.061 -2.996 5.629 1.00 0.00 C ATOM 637 CE2 PHE A 616 7.293 -2.458 4.973 1.00 0.00 C ATOM 638 CZ PHE A 616 5.995 -2.777 4.636 1.00 0.00 C ATOM 0 H PHE A 616 8.755 -0.218 8.853 1.00 0.00 H new ATOM 0 HA PHE A 616 5.871 -0.780 9.192 1.00 0.00 H new ATOM 0 HB2 PHE A 616 8.182 -2.729 8.853 1.00 0.00 H new ATOM 0 HB3 PHE A 616 6.562 -3.193 9.335 1.00 0.00 H new ATOM 0 HD1 PHE A 616 4.693 -3.065 7.729 1.00 0.00 H new ATOM 0 HD2 PHE A 616 8.677 -2.108 6.558 1.00 0.00 H new ATOM 0 HE1 PHE A 616 4.043 -3.247 5.368 1.00 0.00 H new ATOM 0 HE2 PHE A 616 8.025 -2.286 4.198 1.00 0.00 H new ATOM 0 HZ PHE A 616 5.709 -2.855 3.597 1.00 0.00 H new ATOM 648 N GLN A 617 6.095 -1.129 11.634 1.00 0.00 N ATOM 649 CA GLN A 617 6.206 -1.134 13.088 1.00 0.00 C ATOM 650 C GLN A 617 6.183 -2.554 13.638 1.00 0.00 C ATOM 651 O GLN A 617 5.750 -3.486 12.959 1.00 0.00 O ATOM 652 CB GLN A 617 5.071 -0.319 13.715 1.00 0.00 C ATOM 653 CG GLN A 617 3.699 -0.956 13.579 1.00 0.00 C ATOM 654 CD GLN A 617 2.650 -0.255 14.421 1.00 0.00 C ATOM 655 OE1 GLN A 617 2.068 0.750 14.003 1.00 0.00 O ATOM 656 NE2 GLN A 617 2.404 -0.780 15.616 1.00 0.00 N ATOM 0 H GLN A 617 5.137 -1.149 11.284 1.00 0.00 H new ATOM 0 HA GLN A 617 7.161 -0.678 13.348 1.00 0.00 H new ATOM 0 HB2 GLN A 617 5.287 -0.170 14.773 1.00 0.00 H new ATOM 0 HB3 GLN A 617 5.049 0.668 13.252 1.00 0.00 H new ATOM 0 HG2 GLN A 617 3.394 -0.936 12.533 1.00 0.00 H new ATOM 0 HG3 GLN A 617 3.757 -2.004 13.874 1.00 0.00 H new ATOM 0 HE21 GLN A 617 2.909 -1.612 15.921 1.00 0.00 H new ATOM 0 HE22 GLN A 617 1.710 -0.351 16.228 1.00 0.00 H new ATOM 665 N PRO A 618 6.650 -2.714 14.871 1.00 0.00 N ATOM 666 CA PRO A 618 6.613 -4.007 15.543 1.00 0.00 C ATOM 667 C PRO A 618 5.213 -4.606 15.508 1.00 0.00 C ATOM 668 O PRO A 618 4.250 -3.983 15.954 1.00 0.00 O ATOM 669 CB PRO A 618 7.073 -3.700 16.972 1.00 0.00 C ATOM 670 CG PRO A 618 7.959 -2.510 16.829 1.00 0.00 C ATOM 671 CD PRO A 618 7.319 -1.661 15.763 1.00 0.00 C ATOM 0 HA PRO A 618 7.249 -4.751 15.062 1.00 0.00 H new ATOM 0 HB2 PRO A 618 6.226 -3.489 17.625 1.00 0.00 H new ATOM 0 HB3 PRO A 618 7.608 -4.544 17.407 1.00 0.00 H new ATOM 0 HG2 PRO A 618 8.040 -1.965 17.770 1.00 0.00 H new ATOM 0 HG3 PRO A 618 8.969 -2.804 16.543 1.00 0.00 H new ATOM 0 HD2 PRO A 618 6.595 -0.961 16.180 1.00 0.00 H new ATOM 0 HD3 PRO A 618 8.054 -1.071 15.216 1.00 0.00 H new ATOM 679 N GLY A 619 5.108 -5.819 14.976 1.00 0.00 N ATOM 680 CA GLY A 619 3.839 -6.538 14.954 1.00 0.00 C ATOM 681 C GLY A 619 3.109 -6.325 13.634 1.00 0.00 C ATOM 682 O GLY A 619 2.135 -7.017 13.334 1.00 0.00 O ATOM 0 H GLY A 619 5.887 -6.325 14.554 1.00 0.00 H new ATOM 0 HA2 GLY A 619 4.018 -7.602 15.106 1.00 0.00 H new ATOM 0 HA3 GLY A 619 3.212 -6.199 15.779 1.00 0.00 H new ATOM 686 N ASP A 620 3.583 -5.364 12.849 1.00 0.00 N ATOM 687 CA ASP A 620 2.986 -5.069 11.552 1.00 0.00 C ATOM 688 C ASP A 620 3.331 -6.145 10.530 1.00 0.00 C ATOM 689 O ASP A 620 4.501 -6.365 10.217 1.00 0.00 O ATOM 690 CB ASP A 620 3.445 -3.699 11.049 1.00 0.00 C ATOM 691 CG ASP A 620 2.749 -3.229 9.779 1.00 0.00 C ATOM 692 OD1 ASP A 620 1.965 -3.977 9.244 1.00 0.00 O ATOM 693 OD2 ASP A 620 2.885 -2.077 9.442 1.00 0.00 O ATOM 0 H ASP A 620 4.380 -4.775 13.089 1.00 0.00 H new ATOM 0 HA ASP A 620 1.904 -5.054 11.679 1.00 0.00 H new ATOM 0 HB2 ASP A 620 3.277 -2.962 11.835 1.00 0.00 H new ATOM 0 HB3 ASP A 620 4.519 -3.733 10.868 1.00 0.00 H new ATOM 698 N TYR A 621 2.305 -6.813 10.013 1.00 0.00 N ATOM 699 CA TYR A 621 2.496 -7.850 9.006 1.00 0.00 C ATOM 700 C TYR A 621 2.877 -7.249 7.660 1.00 0.00 C ATOM 701 O TYR A 621 2.350 -6.209 7.262 1.00 0.00 O ATOM 702 CB TYR A 621 1.229 -8.697 8.864 1.00 0.00 C ATOM 703 CG TYR A 621 1.031 -9.696 9.982 1.00 0.00 C ATOM 704 CD1 TYR A 621 0.355 -9.343 11.141 1.00 0.00 C ATOM 705 CD2 TYR A 621 1.518 -10.990 9.874 1.00 0.00 C ATOM 706 CE1 TYR A 621 0.171 -10.252 12.166 1.00 0.00 C ATOM 707 CE2 TYR A 621 1.339 -11.907 10.892 1.00 0.00 C ATOM 708 CZ TYR A 621 0.665 -11.534 12.036 1.00 0.00 C ATOM 709 OH TYR A 621 0.484 -12.444 13.053 1.00 0.00 O ATOM 0 H TYR A 621 1.332 -6.654 10.275 1.00 0.00 H new ATOM 0 HA TYR A 621 3.315 -8.489 9.337 1.00 0.00 H new ATOM 0 HB2 TYR A 621 0.364 -8.035 8.824 1.00 0.00 H new ATOM 0 HB3 TYR A 621 1.266 -9.231 7.915 1.00 0.00 H new ATOM 0 HD1 TYR A 621 -0.034 -8.341 11.244 1.00 0.00 H new ATOM 0 HD2 TYR A 621 2.046 -11.286 8.979 1.00 0.00 H new ATOM 0 HE1 TYR A 621 -0.356 -9.961 13.063 1.00 0.00 H new ATOM 0 HE2 TYR A 621 1.725 -12.911 10.792 1.00 0.00 H new ATOM 0 HH TYR A 621 0.891 -13.300 12.803 1.00 0.00 H new ATOM 719 N ILE A 622 3.795 -7.908 6.961 1.00 0.00 N ATOM 720 CA ILE A 622 4.221 -7.459 5.641 1.00 0.00 C ATOM 721 C ILE A 622 3.677 -8.370 4.548 1.00 0.00 C ATOM 722 O ILE A 622 3.180 -7.900 3.524 1.00 0.00 O ATOM 723 CB ILE A 622 5.755 -7.401 5.532 1.00 0.00 C ATOM 724 CG1 ILE A 622 6.335 -6.503 6.628 1.00 0.00 C ATOM 725 CG2 ILE A 622 6.172 -6.903 4.156 1.00 0.00 C ATOM 726 CD1 ILE A 622 7.840 -6.575 6.744 1.00 0.00 C ATOM 0 H ILE A 622 4.259 -8.756 7.287 1.00 0.00 H new ATOM 0 HA ILE A 622 3.819 -6.455 5.506 1.00 0.00 H new ATOM 0 HB ILE A 622 6.150 -8.408 5.667 1.00 0.00 H new ATOM 0 HG12 ILE A 622 6.044 -5.471 6.431 1.00 0.00 H new ATOM 0 HG13 ILE A 622 5.893 -6.781 7.585 1.00 0.00 H new ATOM 0 HG21 ILE A 622 7.260 -6.868 4.096 1.00 0.00 H new ATOM 0 HG22 ILE A 622 5.788 -7.579 3.392 1.00 0.00 H new ATOM 0 HG23 ILE A 622 5.767 -5.904 3.993 1.00 0.00 H new ATOM 0 HD11 ILE A 622 8.176 -5.912 7.541 1.00 0.00 H new ATOM 0 HD12 ILE A 622 8.139 -7.598 6.973 1.00 0.00 H new ATOM 0 HD13 ILE A 622 8.293 -6.267 5.801 1.00 0.00 H new ATOM 738 N ILE A 623 3.775 -9.676 4.770 1.00 0.00 N ATOM 739 CA ILE A 623 3.206 -10.655 3.851 1.00 0.00 C ATOM 740 C ILE A 623 2.455 -11.746 4.604 1.00 0.00 C ATOM 741 O ILE A 623 3.025 -12.436 5.448 1.00 0.00 O ATOM 742 CB ILE A 623 4.292 -11.304 2.974 1.00 0.00 C ATOM 743 CG1 ILE A 623 5.022 -10.238 2.153 1.00 0.00 C ATOM 744 CG2 ILE A 623 3.680 -12.356 2.062 1.00 0.00 C ATOM 745 CD1 ILE A 623 6.170 -10.780 1.331 1.00 0.00 C ATOM 0 H ILE A 623 4.244 -10.082 5.580 1.00 0.00 H new ATOM 0 HA ILE A 623 2.509 -10.116 3.210 1.00 0.00 H new ATOM 0 HB ILE A 623 5.017 -11.794 3.624 1.00 0.00 H new ATOM 0 HG12 ILE A 623 4.308 -9.753 1.487 1.00 0.00 H new ATOM 0 HG13 ILE A 623 5.401 -9.470 2.827 1.00 0.00 H new ATOM 0 HG21 ILE A 623 4.461 -12.805 1.449 1.00 0.00 H new ATOM 0 HG22 ILE A 623 3.204 -13.128 2.666 1.00 0.00 H new ATOM 0 HG23 ILE A 623 2.936 -11.890 1.417 1.00 0.00 H new ATOM 0 HD11 ILE A 623 6.637 -9.966 0.777 1.00 0.00 H new ATOM 0 HD12 ILE A 623 6.906 -11.239 1.992 1.00 0.00 H new ATOM 0 HD13 ILE A 623 5.795 -11.527 0.631 1.00 0.00 H new ATOM 757 N ARG A 624 1.172 -11.896 4.293 1.00 0.00 N ATOM 758 CA ARG A 624 0.355 -12.944 4.894 1.00 0.00 C ATOM 759 C ARG A 624 0.595 -14.287 4.216 1.00 0.00 C ATOM 760 O ARG A 624 0.698 -14.365 2.992 1.00 0.00 O ATOM 761 CB ARG A 624 -1.123 -12.583 4.908 1.00 0.00 C ATOM 762 CG ARG A 624 -1.492 -11.434 5.833 1.00 0.00 C ATOM 763 CD ARG A 624 -1.563 -11.804 7.270 1.00 0.00 C ATOM 764 NE ARG A 624 -1.995 -10.728 8.148 1.00 0.00 N ATOM 765 CZ ARG A 624 -2.201 -10.859 9.473 1.00 0.00 C ATOM 766 NH1 ARG A 624 -2.053 -12.020 10.071 1.00 0.00 N ATOM 767 NH2 ARG A 624 -2.580 -9.791 10.154 1.00 0.00 N ATOM 0 H ARG A 624 0.675 -11.304 3.627 1.00 0.00 H new ATOM 0 HA ARG A 624 0.666 -13.035 5.935 1.00 0.00 H new ATOM 0 HB2 ARG A 624 -1.429 -12.327 3.894 1.00 0.00 H new ATOM 0 HB3 ARG A 624 -1.695 -13.464 5.200 1.00 0.00 H new ATOM 0 HG2 ARG A 624 -0.760 -10.636 5.711 1.00 0.00 H new ATOM 0 HG3 ARG A 624 -2.457 -11.031 5.526 1.00 0.00 H new ATOM 0 HD2 ARG A 624 -2.247 -12.645 7.382 1.00 0.00 H new ATOM 0 HD3 ARG A 624 -0.580 -12.147 7.593 1.00 0.00 H new ATOM 0 HE ARG A 624 -2.153 -9.810 7.732 1.00 0.00 H new ATOM 0 HH11 ARG A 624 -1.778 -12.840 9.531 1.00 0.00 H new ATOM 0 HH12 ARG A 624 -2.213 -12.101 11.075 1.00 0.00 H new ATOM 0 HH21 ARG A 624 -2.709 -8.900 9.675 1.00 0.00 H new ATOM 0 HH22 ARG A 624 -2.744 -9.858 11.158 1.00 0.00 H new ATOM 781 N GLU A 625 0.683 -15.342 5.019 1.00 0.00 N ATOM 782 CA GLU A 625 0.876 -16.689 4.496 1.00 0.00 C ATOM 783 C GLU A 625 -0.351 -17.162 3.727 1.00 0.00 C ATOM 784 O GLU A 625 -1.477 -17.059 4.213 1.00 0.00 O ATOM 785 CB GLU A 625 1.194 -17.664 5.631 1.00 0.00 C ATOM 786 CG GLU A 625 1.542 -19.073 5.171 1.00 0.00 C ATOM 787 CD GLU A 625 2.078 -19.901 6.305 1.00 0.00 C ATOM 788 OE1 GLU A 625 3.066 -19.515 6.882 1.00 0.00 O ATOM 789 OE2 GLU A 625 1.439 -20.860 6.668 1.00 0.00 O ATOM 0 H GLU A 625 0.624 -15.290 6.036 1.00 0.00 H new ATOM 0 HA GLU A 625 1.720 -16.661 3.807 1.00 0.00 H new ATOM 0 HB2 GLU A 625 2.028 -17.268 6.211 1.00 0.00 H new ATOM 0 HB3 GLU A 625 0.336 -17.715 6.301 1.00 0.00 H new ATOM 0 HG2 GLU A 625 0.655 -19.552 4.756 1.00 0.00 H new ATOM 0 HG3 GLU A 625 2.282 -19.025 4.372 1.00 0.00 H new ATOM 796 N GLY A 626 -0.126 -17.681 2.525 1.00 0.00 N ATOM 797 CA GLY A 626 -1.206 -18.227 1.712 1.00 0.00 C ATOM 798 C GLY A 626 -1.650 -17.234 0.646 1.00 0.00 C ATOM 799 O GLY A 626 -2.492 -17.547 -0.196 1.00 0.00 O ATOM 0 H GLY A 626 0.796 -17.735 2.092 1.00 0.00 H new ATOM 0 HA2 GLY A 626 -0.876 -19.151 1.237 1.00 0.00 H new ATOM 0 HA3 GLY A 626 -2.052 -18.482 2.350 1.00 0.00 H new ATOM 803 N THR A 627 -1.078 -16.035 0.687 1.00 0.00 N ATOM 804 CA THR A 627 -1.398 -15.000 -0.289 1.00 0.00 C ATOM 805 C THR A 627 -0.333 -14.919 -1.375 1.00 0.00 C ATOM 806 O THR A 627 0.809 -15.332 -1.170 1.00 0.00 O ATOM 807 CB THR A 627 -1.542 -13.620 0.379 1.00 0.00 C ATOM 808 OG1 THR A 627 -0.270 -13.197 0.887 1.00 0.00 O ATOM 809 CG2 THR A 627 -2.545 -13.681 1.520 1.00 0.00 C ATOM 0 H THR A 627 -0.390 -15.756 1.386 1.00 0.00 H new ATOM 0 HA THR A 627 -2.351 -15.277 -0.740 1.00 0.00 H new ATOM 0 HB THR A 627 -1.898 -12.908 -0.366 1.00 0.00 H new ATOM 0 HG1 THR A 627 -0.056 -13.705 1.697 1.00 0.00 H new ATOM 0 HG21 THR A 627 -2.633 -12.697 1.980 1.00 0.00 H new ATOM 0 HG22 THR A 627 -3.517 -13.990 1.134 1.00 0.00 H new ATOM 0 HG23 THR A 627 -2.205 -14.400 2.265 1.00 0.00 H new ATOM 817 N ILE A 628 -0.713 -14.385 -2.530 1.00 0.00 N ATOM 818 CA ILE A 628 0.190 -14.308 -3.673 1.00 0.00 C ATOM 819 C ILE A 628 1.158 -13.141 -3.532 1.00 0.00 C ATOM 820 O ILE A 628 0.746 -12.006 -3.291 1.00 0.00 O ATOM 821 CB ILE A 628 -0.584 -14.165 -4.996 1.00 0.00 C ATOM 822 CG1 ILE A 628 -1.448 -15.404 -5.247 1.00 0.00 C ATOM 823 CG2 ILE A 628 0.377 -13.939 -6.153 1.00 0.00 C ATOM 824 CD1 ILE A 628 -2.409 -15.254 -6.404 1.00 0.00 C ATOM 0 H ILE A 628 -1.641 -13.998 -2.700 1.00 0.00 H new ATOM 0 HA ILE A 628 0.753 -15.241 -3.692 1.00 0.00 H new ATOM 0 HB ILE A 628 -1.240 -13.298 -4.921 1.00 0.00 H new ATOM 0 HG12 ILE A 628 -0.797 -16.257 -5.436 1.00 0.00 H new ATOM 0 HG13 ILE A 628 -2.014 -15.630 -4.343 1.00 0.00 H new ATOM 0 HG21 ILE A 628 -0.187 -13.840 -7.080 1.00 0.00 H new ATOM 0 HG22 ILE A 628 0.950 -13.028 -5.978 1.00 0.00 H new ATOM 0 HG23 ILE A 628 1.058 -14.786 -6.231 1.00 0.00 H new ATOM 0 HD11 ILE A 628 -2.986 -16.172 -6.519 1.00 0.00 H new ATOM 0 HD12 ILE A 628 -3.086 -14.422 -6.209 1.00 0.00 H new ATOM 0 HD13 ILE A 628 -1.849 -15.060 -7.319 1.00 0.00 H new ATOM 836 N GLY A 629 2.447 -13.426 -3.685 1.00 0.00 N ATOM 837 CA GLY A 629 3.473 -12.392 -3.620 1.00 0.00 C ATOM 838 C GLY A 629 3.896 -11.949 -5.015 1.00 0.00 C ATOM 839 O GLY A 629 4.171 -12.776 -5.883 1.00 0.00 O ATOM 0 H GLY A 629 2.806 -14.365 -3.855 1.00 0.00 H new ATOM 0 HA2 GLY A 629 3.095 -11.535 -3.062 1.00 0.00 H new ATOM 0 HA3 GLY A 629 4.339 -12.769 -3.077 1.00 0.00 H new ATOM 843 N LYS A 630 3.945 -10.637 -5.223 1.00 0.00 N ATOM 844 CA LYS A 630 4.314 -10.081 -6.519 1.00 0.00 C ATOM 845 C LYS A 630 5.376 -8.999 -6.372 1.00 0.00 C ATOM 846 O LYS A 630 5.866 -8.458 -7.363 1.00 0.00 O ATOM 847 CB LYS A 630 3.083 -9.516 -7.230 1.00 0.00 C ATOM 848 CG LYS A 630 2.027 -10.556 -7.582 1.00 0.00 C ATOM 849 CD LYS A 630 0.861 -9.929 -8.331 1.00 0.00 C ATOM 850 CE LYS A 630 -0.268 -10.929 -8.534 1.00 0.00 C ATOM 851 NZ LYS A 630 -1.378 -10.357 -9.344 1.00 0.00 N ATOM 0 H LYS A 630 3.734 -9.939 -4.510 1.00 0.00 H new ATOM 0 HA LYS A 630 4.731 -10.888 -7.121 1.00 0.00 H new ATOM 0 HB2 LYS A 630 2.629 -8.755 -6.595 1.00 0.00 H new ATOM 0 HB3 LYS A 630 3.404 -9.018 -8.145 1.00 0.00 H new ATOM 0 HG2 LYS A 630 2.475 -11.340 -8.193 1.00 0.00 H new ATOM 0 HG3 LYS A 630 1.663 -11.031 -6.671 1.00 0.00 H new ATOM 0 HD2 LYS A 630 0.491 -9.067 -7.776 1.00 0.00 H new ATOM 0 HD3 LYS A 630 1.203 -9.562 -9.299 1.00 0.00 H new ATOM 0 HE2 LYS A 630 0.120 -11.819 -9.028 1.00 0.00 H new ATOM 0 HE3 LYS A 630 -0.652 -11.245 -7.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 630 -2.127 -11.070 -9.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 630 -1.766 -9.522 -8.860 1.00 0.00 H new ATOM 0 HZ3 LYS A 630 -1.018 -10.079 -10.279 1.00 0.00 H new ATOM 865 N LYS A 631 5.728 -8.687 -5.129 1.00 0.00 N ATOM 866 CA LYS A 631 6.711 -7.647 -4.849 1.00 0.00 C ATOM 867 C LYS A 631 7.846 -8.181 -3.986 1.00 0.00 C ATOM 868 O LYS A 631 7.633 -9.022 -3.112 1.00 0.00 O ATOM 869 CB LYS A 631 6.046 -6.453 -4.164 1.00 0.00 C ATOM 870 CG LYS A 631 5.003 -5.740 -5.014 1.00 0.00 C ATOM 871 CD LYS A 631 4.402 -4.554 -4.274 1.00 0.00 C ATOM 872 CE LYS A 631 3.343 -3.856 -5.113 1.00 0.00 C ATOM 873 NZ LYS A 631 2.729 -2.707 -4.393 1.00 0.00 N ATOM 0 H LYS A 631 5.346 -9.140 -4.299 1.00 0.00 H new ATOM 0 HA LYS A 631 7.131 -7.320 -5.800 1.00 0.00 H new ATOM 0 HB2 LYS A 631 5.574 -6.795 -3.243 1.00 0.00 H new ATOM 0 HB3 LYS A 631 6.817 -5.737 -3.880 1.00 0.00 H new ATOM 0 HG2 LYS A 631 5.460 -5.398 -5.943 1.00 0.00 H new ATOM 0 HG3 LYS A 631 4.213 -6.440 -5.286 1.00 0.00 H new ATOM 0 HD2 LYS A 631 3.961 -4.893 -3.337 1.00 0.00 H new ATOM 0 HD3 LYS A 631 5.190 -3.846 -4.017 1.00 0.00 H new ATOM 0 HE2 LYS A 631 3.791 -3.504 -6.042 1.00 0.00 H new ATOM 0 HE3 LYS A 631 2.566 -4.571 -5.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 631 2.013 -2.260 -5.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 631 2.279 -3.046 -3.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 631 3.466 -2.012 -4.156 1.00 0.00 H new ATOM 887 N MET A 632 9.055 -7.689 -4.236 1.00 0.00 N ATOM 888 CA MET A 632 10.183 -7.940 -3.347 1.00 0.00 C ATOM 889 C MET A 632 10.297 -6.857 -2.282 1.00 0.00 C ATOM 890 O MET A 632 9.883 -5.718 -2.494 1.00 0.00 O ATOM 891 CB MET A 632 11.479 -8.028 -4.152 1.00 0.00 C ATOM 892 CG MET A 632 11.597 -9.271 -5.022 1.00 0.00 C ATOM 893 SD MET A 632 13.269 -9.525 -5.649 1.00 0.00 S ATOM 894 CE MET A 632 14.172 -9.756 -4.120 1.00 0.00 C ATOM 0 H MET A 632 9.279 -7.114 -5.048 1.00 0.00 H new ATOM 0 HA MET A 632 10.011 -8.891 -2.843 1.00 0.00 H new ATOM 0 HB2 MET A 632 11.558 -7.146 -4.788 1.00 0.00 H new ATOM 0 HB3 MET A 632 12.323 -8.001 -3.463 1.00 0.00 H new ATOM 0 HG2 MET A 632 11.293 -10.144 -4.444 1.00 0.00 H new ATOM 0 HG3 MET A 632 10.907 -9.189 -5.862 1.00 0.00 H new ATOM 0 HE1 MET A 632 15.151 -10.182 -4.337 1.00 0.00 H new ATOM 0 HE2 MET A 632 14.297 -8.794 -3.622 1.00 0.00 H new ATOM 0 HE3 MET A 632 13.618 -10.432 -3.469 1.00 0.00 H new ATOM 904 N TYR A 633 10.860 -7.221 -1.134 1.00 0.00 N ATOM 905 CA TYR A 633 11.075 -6.269 -0.051 1.00 0.00 C ATOM 906 C TYR A 633 12.514 -6.316 0.446 1.00 0.00 C ATOM 907 O TYR A 633 13.025 -7.379 0.796 1.00 0.00 O ATOM 908 CB TYR A 633 10.111 -6.546 1.104 1.00 0.00 C ATOM 909 CG TYR A 633 8.653 -6.364 0.743 1.00 0.00 C ATOM 910 CD1 TYR A 633 7.923 -7.402 0.182 1.00 0.00 C ATOM 911 CD2 TYR A 633 8.010 -5.156 0.967 1.00 0.00 C ATOM 912 CE1 TYR A 633 6.592 -7.241 -0.150 1.00 0.00 C ATOM 913 CE2 TYR A 633 6.680 -4.984 0.640 1.00 0.00 C ATOM 914 CZ TYR A 633 5.973 -6.030 0.081 1.00 0.00 C ATOM 915 OH TYR A 633 4.647 -5.864 -0.246 1.00 0.00 O ATOM 0 H TYR A 633 11.176 -8.169 -0.930 1.00 0.00 H new ATOM 0 HA TYR A 633 10.882 -5.270 -0.442 1.00 0.00 H new ATOM 0 HB2 TYR A 633 10.264 -7.567 1.455 1.00 0.00 H new ATOM 0 HB3 TYR A 633 10.355 -5.884 1.935 1.00 0.00 H new ATOM 0 HD1 TYR A 633 8.404 -8.352 0.002 1.00 0.00 H new ATOM 0 HD2 TYR A 633 8.559 -4.336 1.405 1.00 0.00 H new ATOM 0 HE1 TYR A 633 6.039 -8.059 -0.588 1.00 0.00 H new ATOM 0 HE2 TYR A 633 6.195 -4.036 0.820 1.00 0.00 H new ATOM 0 HH TYR A 633 4.365 -4.953 -0.018 1.00 0.00 H new ATOM 925 N PHE A 634 13.163 -5.156 0.476 1.00 0.00 N ATOM 926 CA PHE A 634 14.546 -5.064 0.927 1.00 0.00 C ATOM 927 C PHE A 634 14.644 -4.333 2.260 1.00 0.00 C ATOM 928 O PHE A 634 14.118 -3.231 2.414 1.00 0.00 O ATOM 929 CB PHE A 634 15.404 -4.358 -0.125 1.00 0.00 C ATOM 930 CG PHE A 634 15.445 -5.066 -1.449 1.00 0.00 C ATOM 931 CD1 PHE A 634 14.494 -4.799 -2.423 1.00 0.00 C ATOM 932 CD2 PHE A 634 16.432 -6.000 -1.723 1.00 0.00 C ATOM 933 CE1 PHE A 634 14.530 -5.449 -3.642 1.00 0.00 C ATOM 934 CE2 PHE A 634 16.471 -6.651 -2.941 1.00 0.00 C ATOM 935 CZ PHE A 634 15.518 -6.375 -3.901 1.00 0.00 C ATOM 0 H PHE A 634 12.752 -4.266 0.193 1.00 0.00 H new ATOM 0 HA PHE A 634 14.920 -6.078 1.068 1.00 0.00 H new ATOM 0 HB2 PHE A 634 15.021 -3.349 -0.275 1.00 0.00 H new ATOM 0 HB3 PHE A 634 16.421 -4.260 0.255 1.00 0.00 H new ATOM 0 HD1 PHE A 634 13.717 -4.075 -2.226 1.00 0.00 H new ATOM 0 HD2 PHE A 634 17.179 -6.221 -0.975 1.00 0.00 H new ATOM 0 HE1 PHE A 634 13.784 -5.232 -4.392 1.00 0.00 H new ATOM 0 HE2 PHE A 634 17.246 -7.375 -3.142 1.00 0.00 H new ATOM 0 HZ PHE A 634 15.546 -6.884 -4.853 1.00 0.00 H new ATOM 945 N ILE A 635 15.319 -4.954 3.221 1.00 0.00 N ATOM 946 CA ILE A 635 15.395 -4.416 4.574 1.00 0.00 C ATOM 947 C ILE A 635 16.626 -3.536 4.748 1.00 0.00 C ATOM 948 O ILE A 635 17.731 -4.033 4.964 1.00 0.00 O ATOM 949 CB ILE A 635 15.424 -5.538 5.627 1.00 0.00 C ATOM 950 CG1 ILE A 635 14.191 -6.435 5.487 1.00 0.00 C ATOM 951 CG2 ILE A 635 15.503 -4.951 7.028 1.00 0.00 C ATOM 952 CD1 ILE A 635 14.254 -7.695 6.319 1.00 0.00 C ATOM 0 H ILE A 635 15.822 -5.831 3.088 1.00 0.00 H new ATOM 0 HA ILE A 635 14.499 -3.814 4.724 1.00 0.00 H new ATOM 0 HB ILE A 635 16.312 -6.147 5.460 1.00 0.00 H new ATOM 0 HG12 ILE A 635 13.306 -5.867 5.772 1.00 0.00 H new ATOM 0 HG13 ILE A 635 14.070 -6.709 4.439 1.00 0.00 H new ATOM 0 HG21 ILE A 635 15.523 -5.758 7.760 1.00 0.00 H new ATOM 0 HG22 ILE A 635 16.410 -4.354 7.122 1.00 0.00 H new ATOM 0 HG23 ILE A 635 14.633 -4.319 7.207 1.00 0.00 H new ATOM 0 HD11 ILE A 635 13.345 -8.278 6.166 1.00 0.00 H new ATOM 0 HD12 ILE A 635 15.119 -8.286 6.019 1.00 0.00 H new ATOM 0 HD13 ILE A 635 14.343 -7.431 7.373 1.00 0.00 H new ATOM 964 N GLN A 636 16.428 -2.225 4.654 1.00 0.00 N ATOM 965 CA GLN A 636 17.529 -1.275 4.763 1.00 0.00 C ATOM 966 C GLN A 636 18.018 -1.162 6.201 1.00 0.00 C ATOM 967 O GLN A 636 19.200 -0.922 6.448 1.00 0.00 O ATOM 968 CB GLN A 636 17.098 0.104 4.254 1.00 0.00 C ATOM 969 CG GLN A 636 18.253 1.017 3.881 1.00 0.00 C ATOM 970 CD GLN A 636 18.868 1.696 5.090 1.00 0.00 C ATOM 971 OE1 GLN A 636 18.185 1.968 6.081 1.00 0.00 O ATOM 972 NE2 GLN A 636 20.164 1.978 5.014 1.00 0.00 N ATOM 0 H GLN A 636 15.515 -1.796 4.503 1.00 0.00 H new ATOM 0 HA GLN A 636 18.349 -1.645 4.147 1.00 0.00 H new ATOM 0 HB2 GLN A 636 16.456 -0.027 3.383 1.00 0.00 H new ATOM 0 HB3 GLN A 636 16.497 0.591 5.022 1.00 0.00 H new ATOM 0 HG2 GLN A 636 19.018 0.437 3.365 1.00 0.00 H new ATOM 0 HG3 GLN A 636 17.902 1.775 3.181 1.00 0.00 H new ATOM 0 HE21 GLN A 636 20.690 1.735 4.175 1.00 0.00 H new ATOM 0 HE22 GLN A 636 20.633 2.437 5.795 1.00 0.00 H new ATOM 981 N HIS A 637 17.102 -1.335 7.148 1.00 0.00 N ATOM 982 CA HIS A 637 17.454 -1.337 8.563 1.00 0.00 C ATOM 983 C HIS A 637 16.291 -1.822 9.419 1.00 0.00 C ATOM 984 O HIS A 637 15.136 -1.483 9.163 1.00 0.00 O ATOM 985 CB HIS A 637 17.889 0.061 9.015 1.00 0.00 C ATOM 986 CG HIS A 637 18.426 0.102 10.412 1.00 0.00 C ATOM 987 ND1 HIS A 637 19.655 -0.423 10.752 1.00 0.00 N ATOM 988 CD2 HIS A 637 17.901 0.604 11.554 1.00 0.00 C ATOM 989 CE1 HIS A 637 19.863 -0.245 12.045 1.00 0.00 C ATOM 990 NE2 HIS A 637 18.814 0.376 12.554 1.00 0.00 N ATOM 0 H HIS A 637 16.109 -1.476 6.961 1.00 0.00 H new ATOM 0 HA HIS A 637 18.288 -2.026 8.694 1.00 0.00 H new ATOM 0 HB2 HIS A 637 18.652 0.433 8.331 1.00 0.00 H new ATOM 0 HB3 HIS A 637 17.038 0.738 8.942 1.00 0.00 H new ATOM 0 HD1 HIS A 637 20.302 -0.877 10.107 1.00 0.00 H new ATOM 0 HD2 HIS A 637 16.943 1.092 11.659 1.00 0.00 H new ATOM 0 HE1 HIS A 637 20.741 -0.555 12.592 1.00 0.00 H new ATOM 998 N GLY A 638 16.604 -2.617 10.437 1.00 0.00 N ATOM 999 CA GLY A 638 15.584 -3.154 11.330 1.00 0.00 C ATOM 1000 C GLY A 638 15.480 -4.668 11.199 1.00 0.00 C ATOM 1001 O GLY A 638 16.215 -5.287 10.430 1.00 0.00 O ATOM 0 H GLY A 638 17.556 -2.904 10.664 1.00 0.00 H new ATOM 0 HA2 GLY A 638 15.824 -2.891 12.360 1.00 0.00 H new ATOM 0 HA3 GLY A 638 14.620 -2.699 11.101 1.00 0.00 H new ATOM 1005 N VAL A 639 14.561 -5.260 11.954 1.00 0.00 N ATOM 1006 CA VAL A 639 14.439 -6.712 12.016 1.00 0.00 C ATOM 1007 C VAL A 639 13.060 -7.169 11.556 1.00 0.00 C ATOM 1008 O VAL A 639 12.041 -6.640 11.999 1.00 0.00 O ATOM 1009 CB VAL A 639 14.695 -7.241 13.439 1.00 0.00 C ATOM 1010 CG1 VAL A 639 14.519 -8.751 13.486 1.00 0.00 C ATOM 1011 CG2 VAL A 639 16.090 -6.854 13.908 1.00 0.00 C ATOM 0 H VAL A 639 13.889 -4.756 12.532 1.00 0.00 H new ATOM 0 HA VAL A 639 15.196 -7.119 11.346 1.00 0.00 H new ATOM 0 HB VAL A 639 13.966 -6.788 14.111 1.00 0.00 H new ATOM 0 HG11 VAL A 639 14.704 -9.107 14.499 1.00 0.00 H new ATOM 0 HG12 VAL A 639 13.502 -9.008 13.191 1.00 0.00 H new ATOM 0 HG13 VAL A 639 15.225 -9.221 12.802 1.00 0.00 H new ATOM 0 HG21 VAL A 639 16.254 -7.236 14.916 1.00 0.00 H new ATOM 0 HG22 VAL A 639 16.832 -7.280 13.233 1.00 0.00 H new ATOM 0 HG23 VAL A 639 16.184 -5.768 13.912 1.00 0.00 H new ATOM 1021 N VAL A 640 13.036 -8.154 10.665 1.00 0.00 N ATOM 1022 CA VAL A 640 11.783 -8.750 10.215 1.00 0.00 C ATOM 1023 C VAL A 640 11.822 -10.268 10.333 1.00 0.00 C ATOM 1024 O VAL A 640 12.817 -10.902 9.983 1.00 0.00 O ATOM 1025 CB VAL A 640 11.466 -8.366 8.757 1.00 0.00 C ATOM 1026 CG1 VAL A 640 10.191 -9.052 8.291 1.00 0.00 C ATOM 1027 CG2 VAL A 640 11.338 -6.856 8.620 1.00 0.00 C ATOM 0 H VAL A 640 13.871 -8.557 10.240 1.00 0.00 H new ATOM 0 HA VAL A 640 10.999 -8.358 10.863 1.00 0.00 H new ATOM 0 HB VAL A 640 12.289 -8.701 8.126 1.00 0.00 H new ATOM 0 HG11 VAL A 640 9.982 -8.770 7.259 1.00 0.00 H new ATOM 0 HG12 VAL A 640 10.316 -10.133 8.353 1.00 0.00 H new ATOM 0 HG13 VAL A 640 9.360 -8.746 8.926 1.00 0.00 H new ATOM 0 HG21 VAL A 640 11.114 -6.602 7.584 1.00 0.00 H new ATOM 0 HG22 VAL A 640 10.533 -6.499 9.263 1.00 0.00 H new ATOM 0 HG23 VAL A 640 12.275 -6.383 8.915 1.00 0.00 H new ATOM 1037 N SER A 641 10.732 -10.845 10.827 1.00 0.00 N ATOM 1038 CA SER A 641 10.659 -12.286 11.042 1.00 0.00 C ATOM 1039 C SER A 641 9.883 -12.971 9.924 1.00 0.00 C ATOM 1040 O SER A 641 8.763 -12.576 9.600 1.00 0.00 O ATOM 1041 CB SER A 641 10.021 -12.581 12.386 1.00 0.00 C ATOM 1042 OG SER A 641 9.811 -13.953 12.578 1.00 0.00 O ATOM 0 H SER A 641 9.886 -10.337 11.086 1.00 0.00 H new ATOM 0 HA SER A 641 11.674 -12.683 11.036 1.00 0.00 H new ATOM 0 HB2 SER A 641 10.659 -12.197 13.182 1.00 0.00 H new ATOM 0 HB3 SER A 641 9.069 -12.055 12.459 1.00 0.00 H new ATOM 0 HG SER A 641 9.400 -14.101 13.455 1.00 0.00 H new ATOM 1048 N VAL A 642 10.485 -13.999 9.338 1.00 0.00 N ATOM 1049 CA VAL A 642 9.827 -14.781 8.298 1.00 0.00 C ATOM 1050 C VAL A 642 9.531 -16.197 8.777 1.00 0.00 C ATOM 1051 O VAL A 642 10.406 -17.063 8.761 1.00 0.00 O ATOM 1052 CB VAL A 642 10.681 -14.851 7.017 1.00 0.00 C ATOM 1053 CG1 VAL A 642 9.979 -15.683 5.954 1.00 0.00 C ATOM 1054 CG2 VAL A 642 10.970 -13.453 6.493 1.00 0.00 C ATOM 0 H VAL A 642 11.429 -14.311 9.566 1.00 0.00 H new ATOM 0 HA VAL A 642 8.889 -14.274 8.071 1.00 0.00 H new ATOM 0 HB VAL A 642 11.629 -15.331 7.260 1.00 0.00 H new ATOM 0 HG11 VAL A 642 10.596 -15.722 5.056 1.00 0.00 H new ATOM 0 HG12 VAL A 642 9.820 -16.694 6.329 1.00 0.00 H new ATOM 0 HG13 VAL A 642 9.017 -15.230 5.714 1.00 0.00 H new ATOM 0 HG21 VAL A 642 11.574 -13.521 5.588 1.00 0.00 H new ATOM 0 HG22 VAL A 642 10.031 -12.948 6.265 1.00 0.00 H new ATOM 0 HG23 VAL A 642 11.512 -12.886 7.249 1.00 0.00 H new ATOM 1064 N LEU A 643 8.294 -16.425 9.202 1.00 0.00 N ATOM 1065 CA LEU A 643 7.886 -17.730 9.709 1.00 0.00 C ATOM 1066 C LEU A 643 7.474 -18.658 8.574 1.00 0.00 C ATOM 1067 O LEU A 643 6.438 -18.458 7.940 1.00 0.00 O ATOM 1068 CB LEU A 643 6.738 -17.573 10.714 1.00 0.00 C ATOM 1069 CG LEU A 643 6.176 -18.887 11.273 1.00 0.00 C ATOM 1070 CD1 LEU A 643 7.256 -19.631 12.045 1.00 0.00 C ATOM 1071 CD2 LEU A 643 4.981 -18.589 12.167 1.00 0.00 C ATOM 0 H LEU A 643 7.555 -15.722 9.206 1.00 0.00 H new ATOM 0 HA LEU A 643 8.741 -18.179 10.215 1.00 0.00 H new ATOM 0 HB2 LEU A 643 7.086 -16.962 11.547 1.00 0.00 H new ATOM 0 HB3 LEU A 643 5.928 -17.025 10.233 1.00 0.00 H new ATOM 0 HG LEU A 643 5.848 -19.522 10.450 1.00 0.00 H new ATOM 0 HD11 LEU A 643 6.847 -20.562 12.437 1.00 0.00 H new ATOM 0 HD12 LEU A 643 8.091 -19.853 11.380 1.00 0.00 H new ATOM 0 HD13 LEU A 643 7.605 -19.011 12.871 1.00 0.00 H new ATOM 0 HD21 LEU A 643 4.582 -19.522 12.564 1.00 0.00 H new ATOM 0 HD22 LEU A 643 5.294 -17.948 12.991 1.00 0.00 H new ATOM 0 HD23 LEU A 643 4.210 -18.082 11.587 1.00 0.00 H new ATOM 1083 N THR A 644 8.292 -19.675 8.322 1.00 0.00 N ATOM 1084 CA THR A 644 8.057 -20.589 7.210 1.00 0.00 C ATOM 1085 C THR A 644 7.133 -21.728 7.619 1.00 0.00 C ATOM 1086 O THR A 644 7.282 -22.304 8.697 1.00 0.00 O ATOM 1087 CB THR A 644 9.375 -21.177 6.674 1.00 0.00 C ATOM 1088 OG1 THR A 644 10.216 -20.118 6.198 1.00 0.00 O ATOM 1089 CG2 THR A 644 9.102 -22.152 5.539 1.00 0.00 C ATOM 0 H THR A 644 9.124 -19.887 8.873 1.00 0.00 H new ATOM 0 HA THR A 644 7.582 -20.007 6.420 1.00 0.00 H new ATOM 0 HB THR A 644 9.873 -21.709 7.484 1.00 0.00 H new ATOM 0 HG1 THR A 644 11.055 -20.494 5.859 1.00 0.00 H new ATOM 0 HG21 THR A 644 10.045 -22.557 5.173 1.00 0.00 H new ATOM 0 HG22 THR A 644 8.474 -22.966 5.901 1.00 0.00 H new ATOM 0 HG23 THR A 644 8.591 -21.633 4.728 1.00 0.00 H new ATOM 1097 N LYS A 645 6.179 -22.050 6.753 1.00 0.00 N ATOM 1098 CA LYS A 645 5.191 -23.080 7.049 1.00 0.00 C ATOM 1099 C LYS A 645 5.861 -24.399 7.410 1.00 0.00 C ATOM 1100 O LYS A 645 6.590 -24.978 6.604 1.00 0.00 O ATOM 1101 CB LYS A 645 4.250 -23.278 5.859 1.00 0.00 C ATOM 1102 CG LYS A 645 3.116 -24.263 6.110 1.00 0.00 C ATOM 1103 CD LYS A 645 2.162 -24.323 4.927 1.00 0.00 C ATOM 1104 CE LYS A 645 1.056 -25.342 5.157 1.00 0.00 C ATOM 1105 NZ LYS A 645 0.048 -25.327 4.062 1.00 0.00 N ATOM 0 H LYS A 645 6.069 -21.612 5.839 1.00 0.00 H new ATOM 0 HA LYS A 645 4.610 -22.746 7.909 1.00 0.00 H new ATOM 0 HB2 LYS A 645 3.823 -22.313 5.585 1.00 0.00 H new ATOM 0 HB3 LYS A 645 4.832 -23.623 5.005 1.00 0.00 H new ATOM 0 HG2 LYS A 645 3.528 -25.254 6.298 1.00 0.00 H new ATOM 0 HG3 LYS A 645 2.569 -23.970 7.006 1.00 0.00 H new ATOM 0 HD2 LYS A 645 1.723 -23.339 4.761 1.00 0.00 H new ATOM 0 HD3 LYS A 645 2.715 -24.582 4.024 1.00 0.00 H new ATOM 0 HE2 LYS A 645 1.491 -26.338 5.235 1.00 0.00 H new ATOM 0 HE3 LYS A 645 0.563 -25.134 6.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 645 -0.688 -26.036 4.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 645 -0.387 -24.384 4.003 1.00 0.00 H new ATOM 0 HZ3 LYS A 645 0.513 -25.551 3.159 1.00 0.00 H new ATOM 1119 N GLY A 646 5.611 -24.871 8.627 1.00 0.00 N ATOM 1120 CA GLY A 646 6.078 -26.186 9.050 1.00 0.00 C ATOM 1121 C GLY A 646 7.583 -26.187 9.285 1.00 0.00 C ATOM 1122 O GLY A 646 8.205 -27.245 9.377 1.00 0.00 O ATOM 0 H GLY A 646 5.087 -24.361 9.338 1.00 0.00 H new ATOM 0 HA2 GLY A 646 5.564 -26.480 9.965 1.00 0.00 H new ATOM 0 HA3 GLY A 646 5.825 -26.926 8.291 1.00 0.00 H new ATOM 1126 N ASN A 647 8.162 -24.995 9.382 1.00 0.00 N ATOM 1127 CA ASN A 647 9.605 -24.855 9.535 1.00 0.00 C ATOM 1128 C ASN A 647 9.950 -23.753 10.529 1.00 0.00 C ATOM 1129 O ASN A 647 9.129 -22.880 10.810 1.00 0.00 O ATOM 1130 CB ASN A 647 10.281 -24.589 8.202 1.00 0.00 C ATOM 1131 CG ASN A 647 10.341 -25.793 7.303 1.00 0.00 C ATOM 1132 OD1 ASN A 647 11.187 -26.678 7.472 1.00 0.00 O ATOM 1133 ND2 ASN A 647 9.500 -25.791 6.300 1.00 0.00 N ATOM 0 H ASN A 647 7.653 -24.111 9.357 1.00 0.00 H new ATOM 0 HA ASN A 647 9.980 -25.801 9.925 1.00 0.00 H new ATOM 0 HB2 ASN A 647 9.748 -23.789 7.688 1.00 0.00 H new ATOM 0 HB3 ASN A 647 11.295 -24.232 8.384 1.00 0.00 H new ATOM 0 HD21 ASN A 647 9.524 -26.544 5.613 1.00 0.00 H new ATOM 0 HD22 ASN A 647 8.820 -25.036 6.206 1.00 0.00 H new ATOM 1140 N LYS A 648 11.168 -23.800 11.057 1.00 0.00 N ATOM 1141 CA LYS A 648 11.655 -22.757 11.952 1.00 0.00 C ATOM 1142 C LYS A 648 11.735 -21.413 11.240 1.00 0.00 C ATOM 1143 O LYS A 648 12.152 -21.336 10.084 1.00 0.00 O ATOM 1144 CB LYS A 648 13.024 -23.135 12.519 1.00 0.00 C ATOM 1145 CG LYS A 648 13.587 -22.136 13.521 1.00 0.00 C ATOM 1146 CD LYS A 648 14.909 -22.618 14.100 1.00 0.00 C ATOM 1147 CE LYS A 648 15.461 -21.632 15.119 1.00 0.00 C ATOM 1148 NZ LYS A 648 16.758 -22.087 15.689 1.00 0.00 N ATOM 0 H LYS A 648 11.837 -24.550 10.881 1.00 0.00 H new ATOM 0 HA LYS A 648 10.945 -22.664 12.774 1.00 0.00 H new ATOM 0 HB2 LYS A 648 12.948 -24.110 13.000 1.00 0.00 H new ATOM 0 HB3 LYS A 648 13.729 -23.241 11.694 1.00 0.00 H new ATOM 0 HG2 LYS A 648 13.731 -21.171 13.034 1.00 0.00 H new ATOM 0 HG3 LYS A 648 12.869 -21.982 14.327 1.00 0.00 H new ATOM 0 HD2 LYS A 648 14.768 -23.591 14.572 1.00 0.00 H new ATOM 0 HD3 LYS A 648 15.632 -22.755 13.296 1.00 0.00 H new ATOM 0 HE2 LYS A 648 15.594 -20.659 14.647 1.00 0.00 H new ATOM 0 HE3 LYS A 648 14.738 -21.499 15.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 648 17.099 -21.387 16.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 648 16.627 -23.004 16.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 648 17.456 -22.189 14.925 1.00 0.00 H new ATOM 1162 N GLU A 649 11.334 -20.355 11.937 1.00 0.00 N ATOM 1163 CA GLU A 649 11.322 -19.017 11.358 1.00 0.00 C ATOM 1164 C GLU A 649 12.733 -18.547 11.029 1.00 0.00 C ATOM 1165 O GLU A 649 13.691 -18.895 11.720 1.00 0.00 O ATOM 1166 CB GLU A 649 10.647 -18.028 12.311 1.00 0.00 C ATOM 1167 CG GLU A 649 11.424 -17.759 13.592 1.00 0.00 C ATOM 1168 CD GLU A 649 11.212 -18.854 14.600 1.00 0.00 C ATOM 1169 OE1 GLU A 649 10.481 -19.770 14.309 1.00 0.00 O ATOM 1170 OE2 GLU A 649 11.866 -18.834 15.616 1.00 0.00 O ATOM 0 H GLU A 649 11.013 -20.399 12.904 1.00 0.00 H new ATOM 0 HA GLU A 649 10.752 -19.060 10.430 1.00 0.00 H new ATOM 0 HB2 GLU A 649 10.495 -17.084 11.788 1.00 0.00 H new ATOM 0 HB3 GLU A 649 9.660 -18.410 12.572 1.00 0.00 H new ATOM 0 HG2 GLU A 649 12.486 -17.672 13.364 1.00 0.00 H new ATOM 0 HG3 GLU A 649 11.110 -16.805 14.017 1.00 0.00 H new ATOM 1177 N THR A 650 12.855 -17.754 9.970 1.00 0.00 N ATOM 1178 CA THR A 650 14.129 -17.139 9.616 1.00 0.00 C ATOM 1179 C THR A 650 14.163 -15.671 10.018 1.00 0.00 C ATOM 1180 O THR A 650 13.237 -14.915 9.724 1.00 0.00 O ATOM 1181 CB THR A 650 14.411 -17.254 8.106 1.00 0.00 C ATOM 1182 OG1 THR A 650 14.498 -18.637 7.737 1.00 0.00 O ATOM 1183 CG2 THR A 650 15.715 -16.556 7.753 1.00 0.00 C ATOM 0 H THR A 650 12.086 -17.522 9.341 1.00 0.00 H new ATOM 0 HA THR A 650 14.901 -17.680 10.163 1.00 0.00 H new ATOM 0 HB THR A 650 13.596 -16.777 7.562 1.00 0.00 H new ATOM 0 HG1 THR A 650 14.676 -18.709 6.776 1.00 0.00 H new ATOM 0 HG21 THR A 650 15.898 -16.647 6.682 1.00 0.00 H new ATOM 0 HG22 THR A 650 15.647 -15.502 8.021 1.00 0.00 H new ATOM 0 HG23 THR A 650 16.535 -17.018 8.302 1.00 0.00 H new ATOM 1191 N LYS A 651 15.236 -15.272 10.692 1.00 0.00 N ATOM 1192 CA LYS A 651 15.386 -13.895 11.148 1.00 0.00 C ATOM 1193 C LYS A 651 16.145 -13.056 10.129 1.00 0.00 C ATOM 1194 O LYS A 651 17.275 -13.380 9.762 1.00 0.00 O ATOM 1195 CB LYS A 651 16.101 -13.854 12.500 1.00 0.00 C ATOM 1196 CG LYS A 651 16.233 -12.460 13.100 1.00 0.00 C ATOM 1197 CD LYS A 651 16.971 -12.498 14.430 1.00 0.00 C ATOM 1198 CE LYS A 651 17.101 -11.106 15.031 1.00 0.00 C ATOM 1199 NZ LYS A 651 17.830 -11.126 16.328 1.00 0.00 N ATOM 0 H LYS A 651 16.016 -15.883 10.935 1.00 0.00 H new ATOM 0 HA LYS A 651 14.388 -13.471 11.262 1.00 0.00 H new ATOM 0 HB2 LYS A 651 15.561 -14.489 13.202 1.00 0.00 H new ATOM 0 HB3 LYS A 651 17.097 -14.282 12.384 1.00 0.00 H new ATOM 0 HG2 LYS A 651 16.766 -11.811 12.405 1.00 0.00 H new ATOM 0 HG3 LYS A 651 15.242 -12.028 13.244 1.00 0.00 H new ATOM 0 HD2 LYS A 651 16.439 -13.148 15.125 1.00 0.00 H new ATOM 0 HD3 LYS A 651 17.962 -12.928 14.286 1.00 0.00 H new ATOM 0 HE2 LYS A 651 17.625 -10.456 14.330 1.00 0.00 H new ATOM 0 HE3 LYS A 651 16.108 -10.681 15.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 17.897 -10.159 16.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 17.317 -11.726 17.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 18.786 -11.508 16.183 1.00 0.00 H new ATOM 1213 N LEU A 652 15.518 -11.977 9.674 1.00 0.00 N ATOM 1214 CA LEU A 652 16.155 -11.059 8.737 1.00 0.00 C ATOM 1215 C LEU A 652 16.411 -9.703 9.382 1.00 0.00 C ATOM 1216 O LEU A 652 15.591 -9.209 10.156 1.00 0.00 O ATOM 1217 CB LEU A 652 15.289 -10.898 7.481 1.00 0.00 C ATOM 1218 CG LEU A 652 14.957 -12.202 6.745 1.00 0.00 C ATOM 1219 CD1 LEU A 652 14.078 -11.911 5.536 1.00 0.00 C ATOM 1220 CD2 LEU A 652 16.246 -12.890 6.322 1.00 0.00 C ATOM 0 H LEU A 652 14.568 -11.716 9.939 1.00 0.00 H new ATOM 0 HA LEU A 652 17.118 -11.482 8.451 1.00 0.00 H new ATOM 0 HB2 LEU A 652 14.356 -10.411 7.763 1.00 0.00 H new ATOM 0 HB3 LEU A 652 15.801 -10.229 6.789 1.00 0.00 H new ATOM 0 HG LEU A 652 14.408 -12.866 7.413 1.00 0.00 H new ATOM 0 HD11 LEU A 652 13.848 -12.843 5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 652 13.152 -11.440 5.865 1.00 0.00 H new ATOM 0 HD13 LEU A 652 14.604 -11.241 4.856 1.00 0.00 H new ATOM 0 HD21 LEU A 652 16.009 -13.817 5.799 1.00 0.00 H new ATOM 0 HD22 LEU A 652 16.809 -12.233 5.659 1.00 0.00 H new ATOM 0 HD23 LEU A 652 16.845 -13.114 7.204 1.00 0.00 H new ATOM 1232 N ALA A 653 17.552 -9.105 9.058 1.00 0.00 N ATOM 1233 CA ALA A 653 17.983 -7.873 9.708 1.00 0.00 C ATOM 1234 C ALA A 653 18.483 -6.858 8.689 1.00 0.00 C ATOM 1235 O ALA A 653 18.322 -7.044 7.483 1.00 0.00 O ATOM 1236 CB ALA A 653 19.062 -8.168 10.740 1.00 0.00 C ATOM 0 H ALA A 653 18.196 -9.454 8.348 1.00 0.00 H new ATOM 0 HA ALA A 653 17.121 -7.440 10.216 1.00 0.00 H new ATOM 0 HB1 ALA A 653 19.373 -7.239 11.217 1.00 0.00 H new ATOM 0 HB2 ALA A 653 18.667 -8.848 11.495 1.00 0.00 H new ATOM 0 HB3 ALA A 653 19.919 -8.629 10.249 1.00 0.00 H new ATOM 1242 N ASP A 654 19.089 -5.782 9.181 1.00 0.00 N ATOM 1243 CA ASP A 654 19.676 -4.769 8.312 1.00 0.00 C ATOM 1244 C ASP A 654 20.611 -5.398 7.286 1.00 0.00 C ATOM 1245 O ASP A 654 21.638 -5.975 7.641 1.00 0.00 O ATOM 1246 CB ASP A 654 20.429 -3.724 9.139 1.00 0.00 C ATOM 1247 CG ASP A 654 21.049 -2.601 8.319 1.00 0.00 C ATOM 1248 OD1 ASP A 654 21.161 -2.755 7.125 1.00 0.00 O ATOM 1249 OD2 ASP A 654 21.259 -1.543 8.862 1.00 0.00 O ATOM 0 H ASP A 654 19.186 -5.589 10.178 1.00 0.00 H new ATOM 0 HA ASP A 654 18.863 -4.278 7.777 1.00 0.00 H new ATOM 0 HB2 ASP A 654 19.743 -3.290 9.866 1.00 0.00 H new ATOM 0 HB3 ASP A 654 21.217 -4.223 9.703 1.00 0.00 H new ATOM 1254 N GLY A 655 20.248 -5.282 6.013 1.00 0.00 N ATOM 1255 CA GLY A 655 21.060 -5.829 4.933 1.00 0.00 C ATOM 1256 C GLY A 655 20.460 -7.121 4.393 1.00 0.00 C ATOM 1257 O GLY A 655 21.033 -7.762 3.512 1.00 0.00 O ATOM 0 H GLY A 655 19.396 -4.814 5.704 1.00 0.00 H new ATOM 0 HA2 GLY A 655 21.140 -5.098 4.128 1.00 0.00 H new ATOM 0 HA3 GLY A 655 22.071 -6.017 5.294 1.00 0.00 H new ATOM 1261 N SER A 656 19.304 -7.500 4.928 1.00 0.00 N ATOM 1262 CA SER A 656 18.585 -8.673 4.447 1.00 0.00 C ATOM 1263 C SER A 656 17.451 -8.279 3.510 1.00 0.00 C ATOM 1264 O SER A 656 17.122 -7.099 3.380 1.00 0.00 O ATOM 1265 CB SER A 656 18.049 -9.474 5.618 1.00 0.00 C ATOM 1266 OG SER A 656 19.068 -9.870 6.495 1.00 0.00 O ATOM 0 H SER A 656 18.845 -7.011 5.696 1.00 0.00 H new ATOM 0 HA SER A 656 19.284 -9.292 3.884 1.00 0.00 H new ATOM 0 HB2 SER A 656 17.316 -8.877 6.160 1.00 0.00 H new ATOM 0 HB3 SER A 656 17.528 -10.356 5.245 1.00 0.00 H new ATOM 0 HG SER A 656 18.820 -10.716 6.924 1.00 0.00 H new ATOM 1272 N TYR A 657 16.854 -9.272 2.860 1.00 0.00 N ATOM 1273 CA TYR A 657 15.687 -9.044 2.016 1.00 0.00 C ATOM 1274 C TYR A 657 14.909 -10.334 1.792 1.00 0.00 C ATOM 1275 O TYR A 657 15.380 -11.421 2.128 1.00 0.00 O ATOM 1276 CB TYR A 657 16.106 -8.443 0.673 1.00 0.00 C ATOM 1277 CG TYR A 657 16.905 -9.388 -0.198 1.00 0.00 C ATOM 1278 CD1 TYR A 657 18.286 -9.453 -0.096 1.00 0.00 C ATOM 1279 CD2 TYR A 657 16.276 -10.209 -1.122 1.00 0.00 C ATOM 1280 CE1 TYR A 657 19.021 -10.313 -0.888 1.00 0.00 C ATOM 1281 CE2 TYR A 657 17.000 -11.074 -1.920 1.00 0.00 C ATOM 1282 CZ TYR A 657 18.374 -11.122 -1.800 1.00 0.00 C ATOM 1283 OH TYR A 657 19.101 -11.980 -2.593 1.00 0.00 O ATOM 0 H TYR A 657 17.160 -10.244 2.902 1.00 0.00 H new ATOM 0 HA TYR A 657 15.036 -8.338 2.532 1.00 0.00 H new ATOM 0 HB2 TYR A 657 15.213 -8.132 0.131 1.00 0.00 H new ATOM 0 HB3 TYR A 657 16.697 -7.546 0.856 1.00 0.00 H new ATOM 0 HD1 TYR A 657 18.796 -8.820 0.615 1.00 0.00 H new ATOM 0 HD2 TYR A 657 15.201 -10.172 -1.220 1.00 0.00 H new ATOM 0 HE1 TYR A 657 20.096 -10.352 -0.794 1.00 0.00 H new ATOM 0 HE2 TYR A 657 16.494 -11.708 -2.633 1.00 0.00 H new ATOM 0 HH TYR A 657 18.539 -12.739 -2.855 1.00 0.00 H new ATOM 1293 N PHE A 658 13.716 -10.208 1.221 1.00 0.00 N ATOM 1294 CA PHE A 658 12.861 -11.362 0.970 1.00 0.00 C ATOM 1295 C PHE A 658 11.895 -11.093 -0.176 1.00 0.00 C ATOM 1296 O PHE A 658 11.790 -9.966 -0.660 1.00 0.00 O ATOM 1297 CB PHE A 658 12.086 -11.738 2.235 1.00 0.00 C ATOM 1298 CG PHE A 658 11.279 -10.609 2.808 1.00 0.00 C ATOM 1299 CD1 PHE A 658 11.854 -9.699 3.683 1.00 0.00 C ATOM 1300 CD2 PHE A 658 9.942 -10.454 2.474 1.00 0.00 C ATOM 1301 CE1 PHE A 658 11.113 -8.661 4.212 1.00 0.00 C ATOM 1302 CE2 PHE A 658 9.198 -9.415 3.001 1.00 0.00 C ATOM 1303 CZ PHE A 658 9.783 -8.519 3.870 1.00 0.00 C ATOM 0 H PHE A 658 13.319 -9.317 0.923 1.00 0.00 H new ATOM 0 HA PHE A 658 13.502 -12.197 0.686 1.00 0.00 H new ATOM 0 HB2 PHE A 658 11.420 -12.570 2.008 1.00 0.00 H new ATOM 0 HB3 PHE A 658 12.789 -12.090 2.990 1.00 0.00 H new ATOM 0 HD1 PHE A 658 12.894 -9.804 3.954 1.00 0.00 H new ATOM 0 HD2 PHE A 658 9.477 -11.153 1.795 1.00 0.00 H new ATOM 0 HE1 PHE A 658 11.574 -7.961 4.893 1.00 0.00 H new ATOM 0 HE2 PHE A 658 8.158 -9.305 2.732 1.00 0.00 H new ATOM 0 HZ PHE A 658 9.202 -7.707 4.283 1.00 0.00 H new ATOM 1313 N GLY A 659 11.190 -12.134 -0.606 1.00 0.00 N ATOM 1314 CA GLY A 659 10.319 -12.041 -1.772 1.00 0.00 C ATOM 1315 C GLY A 659 11.054 -12.450 -3.042 1.00 0.00 C ATOM 1316 O GLY A 659 10.511 -12.355 -4.143 1.00 0.00 O ATOM 0 H GLY A 659 11.205 -13.053 -0.164 1.00 0.00 H new ATOM 0 HA2 GLY A 659 9.448 -12.681 -1.631 1.00 0.00 H new ATOM 0 HA3 GLY A 659 9.951 -11.020 -1.874 1.00 0.00 H new ATOM 1320 N GLU A 660 12.293 -12.905 -2.883 1.00 0.00 N ATOM 1321 CA GLU A 660 13.127 -13.269 -4.021 1.00 0.00 C ATOM 1322 C GLU A 660 12.434 -14.298 -4.905 1.00 0.00 C ATOM 1323 O GLU A 660 12.576 -14.276 -6.128 1.00 0.00 O ATOM 1324 CB GLU A 660 14.477 -13.811 -3.544 1.00 0.00 C ATOM 1325 CG GLU A 660 15.508 -13.992 -4.650 1.00 0.00 C ATOM 1326 CD GLU A 660 16.768 -14.620 -4.124 1.00 0.00 C ATOM 1327 OE1 GLU A 660 17.329 -14.093 -3.193 1.00 0.00 O ATOM 1328 OE2 GLU A 660 17.109 -15.688 -4.576 1.00 0.00 O ATOM 0 H GLU A 660 12.741 -13.030 -1.975 1.00 0.00 H new ATOM 0 HA GLU A 660 13.295 -12.369 -4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 660 14.882 -13.133 -2.793 1.00 0.00 H new ATOM 0 HB3 GLU A 660 14.317 -14.771 -3.053 1.00 0.00 H new ATOM 0 HG2 GLU A 660 15.091 -14.616 -5.441 1.00 0.00 H new ATOM 0 HG3 GLU A 660 15.740 -13.025 -5.096 1.00 0.00 H new ATOM 1335 N ILE A 661 11.684 -15.198 -4.280 1.00 0.00 N ATOM 1336 CA ILE A 661 10.976 -16.245 -5.009 1.00 0.00 C ATOM 1337 C ILE A 661 10.081 -15.655 -6.090 1.00 0.00 C ATOM 1338 O ILE A 661 9.898 -16.250 -7.152 1.00 0.00 O ATOM 1339 CB ILE A 661 10.123 -17.112 -4.065 1.00 0.00 C ATOM 1340 CG1 ILE A 661 11.022 -17.939 -3.142 1.00 0.00 C ATOM 1341 CG2 ILE A 661 9.199 -18.017 -4.865 1.00 0.00 C ATOM 1342 CD1 ILE A 661 10.279 -18.615 -2.012 1.00 0.00 C ATOM 0 H ILE A 661 11.550 -15.224 -3.269 1.00 0.00 H new ATOM 0 HA ILE A 661 11.736 -16.872 -5.475 1.00 0.00 H new ATOM 0 HB ILE A 661 9.510 -16.455 -3.449 1.00 0.00 H new ATOM 0 HG12 ILE A 661 11.534 -18.698 -3.733 1.00 0.00 H new ATOM 0 HG13 ILE A 661 11.791 -17.290 -2.722 1.00 0.00 H new ATOM 0 HG21 ILE A 661 8.603 -18.623 -4.183 1.00 0.00 H new ATOM 0 HG22 ILE A 661 8.538 -17.408 -5.481 1.00 0.00 H new ATOM 0 HG23 ILE A 661 9.793 -18.669 -5.505 1.00 0.00 H new ATOM 0 HD11 ILE A 661 10.982 -19.182 -1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 661 9.790 -17.861 -1.396 1.00 0.00 H new ATOM 0 HD13 ILE A 661 9.529 -19.291 -2.423 1.00 0.00 H new ATOM 1354 N CYS A 662 9.523 -14.481 -5.814 1.00 0.00 N ATOM 1355 CA CYS A 662 8.593 -13.839 -6.734 1.00 0.00 C ATOM 1356 C CYS A 662 9.220 -13.651 -8.110 1.00 0.00 C ATOM 1357 O CYS A 662 8.526 -13.664 -9.126 1.00 0.00 O ATOM 1358 CB CYS A 662 8.339 -12.486 -6.069 1.00 0.00 C ATOM 1359 SG CYS A 662 7.584 -12.588 -4.428 1.00 0.00 S ATOM 0 H CYS A 662 9.700 -13.954 -4.959 1.00 0.00 H new ATOM 0 HA CYS A 662 7.687 -14.421 -6.901 1.00 0.00 H new ATOM 0 HB2 CYS A 662 9.286 -11.952 -5.987 1.00 0.00 H new ATOM 0 HB3 CYS A 662 7.693 -11.893 -6.716 1.00 0.00 H new ATOM 0 HG CYS A 662 8.511 -12.771 -3.535 1.00 0.00 H new ATOM 1365 N LEU A 663 10.537 -13.476 -8.135 1.00 0.00 N ATOM 1366 CA LEU A 663 11.261 -13.290 -9.387 1.00 0.00 C ATOM 1367 C LEU A 663 11.147 -14.521 -10.277 1.00 0.00 C ATOM 1368 O LEU A 663 11.138 -14.413 -11.503 1.00 0.00 O ATOM 1369 CB LEU A 663 12.734 -12.971 -9.104 1.00 0.00 C ATOM 1370 CG LEU A 663 12.993 -11.607 -8.452 1.00 0.00 C ATOM 1371 CD1 LEU A 663 14.465 -11.475 -8.084 1.00 0.00 C ATOM 1372 CD2 LEU A 663 12.575 -10.499 -9.408 1.00 0.00 C ATOM 0 H LEU A 663 11.125 -13.459 -7.302 1.00 0.00 H new ATOM 0 HA LEU A 663 10.812 -12.450 -9.917 1.00 0.00 H new ATOM 0 HB2 LEU A 663 13.140 -13.748 -8.456 1.00 0.00 H new ATOM 0 HB3 LEU A 663 13.286 -13.018 -10.043 1.00 0.00 H new ATOM 0 HG LEU A 663 12.404 -11.523 -7.538 1.00 0.00 H new ATOM 0 HD11 LEU A 663 14.639 -10.503 -7.622 1.00 0.00 H new ATOM 0 HD12 LEU A 663 14.737 -12.264 -7.383 1.00 0.00 H new ATOM 0 HD13 LEU A 663 15.074 -11.563 -8.984 1.00 0.00 H new ATOM 0 HD21 LEU A 663 12.759 -9.530 -8.944 1.00 0.00 H new ATOM 0 HD22 LEU A 663 13.152 -10.576 -10.329 1.00 0.00 H new ATOM 0 HD23 LEU A 663 11.514 -10.596 -9.636 1.00 0.00 H new ATOM 1384 N LEU A 664 11.059 -15.690 -9.653 1.00 0.00 N ATOM 1385 CA LEU A 664 10.959 -16.946 -10.388 1.00 0.00 C ATOM 1386 C LEU A 664 9.507 -17.296 -10.685 1.00 0.00 C ATOM 1387 O LEU A 664 9.190 -17.816 -11.755 1.00 0.00 O ATOM 1388 CB LEU A 664 11.631 -18.077 -9.599 1.00 0.00 C ATOM 1389 CG LEU A 664 13.133 -17.895 -9.348 1.00 0.00 C ATOM 1390 CD1 LEU A 664 13.654 -19.019 -8.462 1.00 0.00 C ATOM 1391 CD2 LEU A 664 13.872 -17.869 -10.677 1.00 0.00 C ATOM 0 H LEU A 664 11.055 -15.795 -8.638 1.00 0.00 H new ATOM 0 HA LEU A 664 11.476 -16.823 -11.340 1.00 0.00 H new ATOM 0 HB2 LEU A 664 11.128 -18.176 -8.637 1.00 0.00 H new ATOM 0 HB3 LEU A 664 11.479 -19.013 -10.136 1.00 0.00 H new ATOM 0 HG LEU A 664 13.304 -16.949 -8.834 1.00 0.00 H new ATOM 0 HD11 LEU A 664 14.721 -18.881 -8.289 1.00 0.00 H new ATOM 0 HD12 LEU A 664 13.127 -19.004 -7.508 1.00 0.00 H new ATOM 0 HD13 LEU A 664 13.487 -19.977 -8.954 1.00 0.00 H new ATOM 0 HD21 LEU A 664 14.939 -17.740 -10.497 1.00 0.00 H new ATOM 0 HD22 LEU A 664 13.704 -18.808 -11.205 1.00 0.00 H new ATOM 0 HD23 LEU A 664 13.503 -17.041 -11.282 1.00 0.00 H new ATOM 1403 N THR A 665 8.628 -17.009 -9.732 1.00 0.00 N ATOM 1404 CA THR A 665 7.199 -17.240 -9.912 1.00 0.00 C ATOM 1405 C THR A 665 6.379 -16.409 -8.933 1.00 0.00 C ATOM 1406 O THR A 665 6.636 -16.417 -7.730 1.00 0.00 O ATOM 1407 CB THR A 665 6.841 -18.727 -9.732 1.00 0.00 C ATOM 1408 OG1 THR A 665 5.421 -18.895 -9.836 1.00 0.00 O ATOM 1409 CG2 THR A 665 7.309 -19.229 -8.375 1.00 0.00 C ATOM 0 H THR A 665 8.880 -16.615 -8.825 1.00 0.00 H new ATOM 0 HA THR A 665 6.958 -16.938 -10.931 1.00 0.00 H new ATOM 0 HB THR A 665 7.340 -19.302 -10.512 1.00 0.00 H new ATOM 0 HG1 THR A 665 5.194 -19.842 -9.723 1.00 0.00 H new ATOM 0 HG21 THR A 665 7.047 -20.281 -8.266 1.00 0.00 H new ATOM 0 HG22 THR A 665 8.390 -19.114 -8.298 1.00 0.00 H new ATOM 0 HG23 THR A 665 6.826 -18.652 -7.587 1.00 0.00 H new ATOM 1417 N ARG A 666 5.390 -15.693 -9.458 1.00 0.00 N ATOM 1418 CA ARG A 666 4.510 -14.880 -8.627 1.00 0.00 C ATOM 1419 C ARG A 666 3.331 -15.696 -8.112 1.00 0.00 C ATOM 1420 O ARG A 666 2.205 -15.546 -8.586 1.00 0.00 O ATOM 1421 CB ARG A 666 4.044 -13.622 -9.345 1.00 0.00 C ATOM 1422 CG ARG A 666 5.147 -12.627 -9.672 1.00 0.00 C ATOM 1423 CD ARG A 666 4.674 -11.382 -10.329 1.00 0.00 C ATOM 1424 NE ARG A 666 4.024 -11.587 -11.613 1.00 0.00 N ATOM 1425 CZ ARG A 666 3.271 -10.667 -12.246 1.00 0.00 C ATOM 1426 NH1 ARG A 666 3.038 -9.493 -11.702 1.00 0.00 N ATOM 1427 NH2 ARG A 666 2.751 -10.984 -13.419 1.00 0.00 N ATOM 0 H ARG A 666 5.178 -15.659 -10.455 1.00 0.00 H new ATOM 0 HA ARG A 666 5.093 -14.554 -7.766 1.00 0.00 H new ATOM 0 HB2 ARG A 666 3.549 -13.912 -10.272 1.00 0.00 H new ATOM 0 HB3 ARG A 666 3.297 -13.124 -8.727 1.00 0.00 H new ATOM 0 HG2 ARG A 666 5.666 -12.363 -8.751 1.00 0.00 H new ATOM 0 HG3 ARG A 666 5.876 -13.112 -10.321 1.00 0.00 H new ATOM 0 HD2 ARG A 666 3.978 -10.875 -9.660 1.00 0.00 H new ATOM 0 HD3 ARG A 666 5.524 -10.715 -10.469 1.00 0.00 H new ATOM 0 HE ARG A 666 4.147 -12.492 -12.067 1.00 0.00 H new ATOM 0 HH11 ARG A 666 3.430 -9.268 -10.787 1.00 0.00 H new ATOM 0 HH12 ARG A 666 2.466 -8.807 -12.194 1.00 0.00 H new ATOM 0 HH21 ARG A 666 2.924 -11.905 -13.822 1.00 0.00 H new ATOM 0 HH22 ARG A 666 2.176 -10.308 -13.922 1.00 0.00 H new ATOM 1441 N GLY A 667 3.597 -16.559 -7.137 1.00 0.00 N ATOM 1442 CA GLY A 667 2.576 -17.455 -6.608 1.00 0.00 C ATOM 1443 C GLY A 667 2.334 -17.200 -5.125 1.00 0.00 C ATOM 1444 O GLY A 667 2.791 -16.198 -4.575 1.00 0.00 O ATOM 0 H GLY A 667 4.512 -16.657 -6.697 1.00 0.00 H new ATOM 0 HA2 GLY A 667 1.646 -17.317 -7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 667 2.884 -18.490 -6.756 1.00 0.00 H new ATOM 1448 N ARG A 668 1.613 -18.113 -4.483 1.00 0.00 N ATOM 1449 CA ARG A 668 1.313 -17.991 -3.062 1.00 0.00 C ATOM 1450 C ARG A 668 2.542 -18.286 -2.212 1.00 0.00 C ATOM 1451 O ARG A 668 3.282 -19.232 -2.481 1.00 0.00 O ATOM 1452 CB ARG A 668 0.130 -18.854 -2.649 1.00 0.00 C ATOM 1453 CG ARG A 668 -1.207 -18.431 -3.237 1.00 0.00 C ATOM 1454 CD ARG A 668 -2.287 -19.441 -3.093 1.00 0.00 C ATOM 1455 NE ARG A 668 -2.682 -19.709 -1.719 1.00 0.00 N ATOM 1456 CZ ARG A 668 -3.274 -20.845 -1.301 1.00 0.00 C ATOM 1457 NH1 ARG A 668 -3.575 -21.803 -2.149 1.00 0.00 N ATOM 1458 NH2 ARG A 668 -3.567 -20.960 -0.017 1.00 0.00 N ATOM 0 H ARG A 668 1.225 -18.946 -4.925 1.00 0.00 H new ATOM 0 HA ARG A 668 1.025 -16.955 -2.884 1.00 0.00 H new ATOM 0 HB2 ARG A 668 0.330 -19.884 -2.943 1.00 0.00 H new ATOM 0 HB3 ARG A 668 0.052 -18.842 -1.562 1.00 0.00 H new ATOM 0 HG2 ARG A 668 -1.525 -17.506 -2.757 1.00 0.00 H new ATOM 0 HG3 ARG A 668 -1.071 -18.210 -4.296 1.00 0.00 H new ATOM 0 HD2 ARG A 668 -3.161 -19.102 -3.650 1.00 0.00 H new ATOM 0 HD3 ARG A 668 -1.959 -20.374 -3.552 1.00 0.00 H new ATOM 0 HE ARG A 668 -2.498 -18.986 -1.023 1.00 0.00 H new ATOM 0 HH11 ARG A 668 -3.361 -21.693 -3.140 1.00 0.00 H new ATOM 0 HH12 ARG A 668 -4.023 -22.657 -1.816 1.00 0.00 H new ATOM 0 HH21 ARG A 668 -3.345 -20.201 0.627 1.00 0.00 H new ATOM 0 HH22 ARG A 668 -4.015 -21.808 0.330 1.00 0.00 H new ATOM 1472 N ARG A 669 2.754 -17.470 -1.185 1.00 0.00 N ATOM 1473 CA ARG A 669 3.890 -17.647 -0.288 1.00 0.00 C ATOM 1474 C ARG A 669 3.529 -18.545 0.888 1.00 0.00 C ATOM 1475 O ARG A 669 2.511 -18.340 1.549 1.00 0.00 O ATOM 1476 CB ARG A 669 4.463 -16.318 0.181 1.00 0.00 C ATOM 1477 CG ARG A 669 5.762 -16.423 0.966 1.00 0.00 C ATOM 1478 CD ARG A 669 6.319 -15.118 1.404 1.00 0.00 C ATOM 1479 NE ARG A 669 7.633 -15.201 2.021 1.00 0.00 N ATOM 1480 CZ ARG A 669 8.799 -15.129 1.350 1.00 0.00 C ATOM 1481 NH1 ARG A 669 8.821 -15.012 0.041 1.00 0.00 N ATOM 1482 NH2 ARG A 669 9.923 -15.204 2.041 1.00 0.00 N ATOM 0 H ARG A 669 2.153 -16.679 -0.953 1.00 0.00 H new ATOM 0 HA ARG A 669 4.674 -18.144 -0.859 1.00 0.00 H new ATOM 0 HB2 ARG A 669 4.632 -15.684 -0.689 1.00 0.00 H new ATOM 0 HB3 ARG A 669 3.720 -15.817 0.801 1.00 0.00 H new ATOM 0 HG2 ARG A 669 5.593 -17.046 1.845 1.00 0.00 H new ATOM 0 HG3 ARG A 669 6.504 -16.934 0.352 1.00 0.00 H new ATOM 0 HD2 ARG A 669 6.378 -14.454 0.541 1.00 0.00 H new ATOM 0 HD3 ARG A 669 5.627 -14.661 2.112 1.00 0.00 H new ATOM 0 HE ARG A 669 7.675 -15.322 3.033 1.00 0.00 H new ATOM 0 HH11 ARG A 669 7.946 -14.974 -0.482 1.00 0.00 H new ATOM 0 HH12 ARG A 669 9.713 -14.959 -0.451 1.00 0.00 H new ATOM 0 HH21 ARG A 669 9.892 -15.313 3.055 1.00 0.00 H new ATOM 0 HH22 ARG A 669 10.821 -15.153 1.561 1.00 0.00 H new ATOM 1496 N THR A 670 4.370 -19.542 1.145 1.00 0.00 N ATOM 1497 CA THR A 670 4.156 -20.456 2.260 1.00 0.00 C ATOM 1498 C THR A 670 4.905 -19.992 3.503 1.00 0.00 C ATOM 1499 O THR A 670 5.512 -20.796 4.211 1.00 0.00 O ATOM 1500 CB THR A 670 4.601 -21.888 1.911 1.00 0.00 C ATOM 1501 OG1 THR A 670 5.961 -21.871 1.456 1.00 0.00 O ATOM 1502 CG2 THR A 670 3.713 -22.472 0.823 1.00 0.00 C ATOM 0 H THR A 670 5.207 -19.737 0.595 1.00 0.00 H new ATOM 0 HA THR A 670 3.085 -20.458 2.463 1.00 0.00 H new ATOM 0 HB THR A 670 4.517 -22.507 2.805 1.00 0.00 H new ATOM 0 HG1 THR A 670 6.244 -22.783 1.236 1.00 0.00 H new ATOM 0 HG21 THR A 670 4.042 -23.484 0.589 1.00 0.00 H new ATOM 0 HG22 THR A 670 2.680 -22.497 1.171 1.00 0.00 H new ATOM 0 HG23 THR A 670 3.779 -21.853 -0.072 1.00 0.00 H new ATOM 1510 N ALA A 671 4.857 -18.690 3.764 1.00 0.00 N ATOM 1511 CA ALA A 671 5.525 -18.117 4.927 1.00 0.00 C ATOM 1512 C ALA A 671 4.843 -16.831 5.376 1.00 0.00 C ATOM 1513 O ALA A 671 4.373 -16.046 4.552 1.00 0.00 O ATOM 1514 CB ALA A 671 6.994 -17.864 4.623 1.00 0.00 C ATOM 0 H ALA A 671 4.362 -18.011 3.185 1.00 0.00 H new ATOM 0 HA ALA A 671 5.455 -18.835 5.744 1.00 0.00 H new ATOM 0 HB1 ALA A 671 7.479 -17.436 5.501 1.00 0.00 H new ATOM 0 HB2 ALA A 671 7.479 -18.805 4.363 1.00 0.00 H new ATOM 0 HB3 ALA A 671 7.078 -17.169 3.787 1.00 0.00 H new ATOM 1520 N SER A 672 4.792 -16.620 6.686 1.00 0.00 N ATOM 1521 CA SER A 672 4.219 -15.401 7.245 1.00 0.00 C ATOM 1522 C SER A 672 5.307 -14.412 7.641 1.00 0.00 C ATOM 1523 O SER A 672 6.148 -14.706 8.490 1.00 0.00 O ATOM 1524 CB SER A 672 3.347 -15.734 8.440 1.00 0.00 C ATOM 1525 OG SER A 672 2.846 -14.584 9.063 1.00 0.00 O ATOM 0 H SER A 672 5.141 -17.279 7.382 1.00 0.00 H new ATOM 0 HA SER A 672 3.604 -14.932 6.477 1.00 0.00 H new ATOM 0 HB2 SER A 672 2.517 -16.363 8.118 1.00 0.00 H new ATOM 0 HB3 SER A 672 3.925 -16.313 9.160 1.00 0.00 H new ATOM 0 HG SER A 672 2.205 -14.841 9.758 1.00 0.00 H new ATOM 1531 N VAL A 673 5.285 -13.236 7.021 1.00 0.00 N ATOM 1532 CA VAL A 673 6.325 -12.237 7.238 1.00 0.00 C ATOM 1533 C VAL A 673 5.801 -11.068 8.061 1.00 0.00 C ATOM 1534 O VAL A 673 4.870 -10.374 7.651 1.00 0.00 O ATOM 1535 CB VAL A 673 6.883 -11.704 5.905 1.00 0.00 C ATOM 1536 CG1 VAL A 673 7.972 -10.672 6.158 1.00 0.00 C ATOM 1537 CG2 VAL A 673 7.421 -12.847 5.057 1.00 0.00 C ATOM 0 H VAL A 673 4.558 -12.952 6.364 1.00 0.00 H new ATOM 0 HA VAL A 673 7.127 -12.732 7.785 1.00 0.00 H new ATOM 0 HB VAL A 673 6.071 -11.223 5.360 1.00 0.00 H new ATOM 0 HG11 VAL A 673 8.355 -10.306 5.205 1.00 0.00 H new ATOM 0 HG12 VAL A 673 7.559 -9.839 6.727 1.00 0.00 H new ATOM 0 HG13 VAL A 673 8.783 -11.130 6.723 1.00 0.00 H new ATOM 0 HG21 VAL A 673 7.811 -12.452 4.119 1.00 0.00 H new ATOM 0 HG22 VAL A 673 8.220 -13.356 5.597 1.00 0.00 H new ATOM 0 HG23 VAL A 673 6.618 -13.553 4.847 1.00 0.00 H new ATOM 1547 N ARG A 674 6.405 -10.853 9.225 1.00 0.00 N ATOM 1548 CA ARG A 674 5.967 -9.800 10.133 1.00 0.00 C ATOM 1549 C ARG A 674 7.155 -9.032 10.699 1.00 0.00 C ATOM 1550 O ARG A 674 8.164 -9.624 11.083 1.00 0.00 O ATOM 1551 CB ARG A 674 5.069 -10.332 11.240 1.00 0.00 C ATOM 1552 CG ARG A 674 4.514 -9.272 12.179 1.00 0.00 C ATOM 1553 CD ARG A 674 3.665 -9.808 13.273 1.00 0.00 C ATOM 1554 NE ARG A 674 4.400 -10.488 14.328 1.00 0.00 N ATOM 1555 CZ ARG A 674 3.830 -11.175 15.337 1.00 0.00 C ATOM 1556 NH1 ARG A 674 2.523 -11.245 15.455 1.00 0.00 N ATOM 1557 NH2 ARG A 674 4.621 -11.758 16.221 1.00 0.00 N ATOM 0 H ARG A 674 7.201 -11.395 9.562 1.00 0.00 H new ATOM 0 HA ARG A 674 5.366 -9.103 9.549 1.00 0.00 H new ATOM 0 HB2 ARG A 674 4.235 -10.867 10.786 1.00 0.00 H new ATOM 0 HB3 ARG A 674 5.632 -11.058 11.827 1.00 0.00 H new ATOM 0 HG2 ARG A 674 5.346 -8.721 12.617 1.00 0.00 H new ATOM 0 HG3 ARG A 674 3.930 -8.559 11.598 1.00 0.00 H new ATOM 0 HD2 ARG A 674 3.099 -8.987 13.713 1.00 0.00 H new ATOM 0 HD3 ARG A 674 2.940 -10.502 12.847 1.00 0.00 H new ATOM 0 HE ARG A 674 5.419 -10.441 14.302 1.00 0.00 H new ATOM 0 HH11 ARG A 674 1.924 -10.775 14.777 1.00 0.00 H new ATOM 0 HH12 ARG A 674 2.108 -11.769 16.225 1.00 0.00 H new ATOM 0 HH21 ARG A 674 5.634 -11.681 16.128 1.00 0.00 H new ATOM 0 HH22 ARG A 674 4.219 -12.285 16.996 1.00 0.00 H new ATOM 1571 N ALA A 675 7.028 -7.710 10.750 1.00 0.00 N ATOM 1572 CA ALA A 675 8.096 -6.857 11.258 1.00 0.00 C ATOM 1573 C ALA A 675 8.238 -6.994 12.769 1.00 0.00 C ATOM 1574 O ALA A 675 7.244 -7.068 13.491 1.00 0.00 O ATOM 1575 CB ALA A 675 7.843 -5.406 10.876 1.00 0.00 C ATOM 0 H ALA A 675 6.195 -7.206 10.445 1.00 0.00 H new ATOM 0 HA ALA A 675 9.032 -7.181 10.802 1.00 0.00 H new ATOM 0 HB1 ALA A 675 8.649 -4.782 11.263 1.00 0.00 H new ATOM 0 HB2 ALA A 675 7.804 -5.317 9.790 1.00 0.00 H new ATOM 0 HB3 ALA A 675 6.894 -5.078 11.301 1.00 0.00 H new ATOM 1581 N ASP A 676 9.479 -7.027 13.241 1.00 0.00 N ATOM 1582 CA ASP A 676 9.754 -7.168 14.666 1.00 0.00 C ATOM 1583 C ASP A 676 10.076 -5.822 15.300 1.00 0.00 C ATOM 1584 O ASP A 676 9.701 -5.557 16.443 1.00 0.00 O ATOM 1585 CB ASP A 676 10.908 -8.147 14.896 1.00 0.00 C ATOM 1586 CG ASP A 676 10.549 -9.609 14.662 1.00 0.00 C ATOM 1587 OD1 ASP A 676 9.382 -9.905 14.561 1.00 0.00 O ATOM 1588 OD2 ASP A 676 11.442 -10.389 14.430 1.00 0.00 O ATOM 0 H ASP A 676 10.312 -6.958 12.656 1.00 0.00 H new ATOM 0 HA ASP A 676 8.856 -7.563 15.141 1.00 0.00 H new ATOM 0 HB2 ASP A 676 11.733 -7.878 14.237 1.00 0.00 H new ATOM 0 HB3 ASP A 676 11.267 -8.033 15.919 1.00 0.00 H new ATOM 1593 N THR A 677 10.773 -4.973 14.553 1.00 0.00 N ATOM 1594 CA THR A 677 11.139 -3.647 15.038 1.00 0.00 C ATOM 1595 C THR A 677 10.634 -2.559 14.099 1.00 0.00 C ATOM 1596 O THR A 677 10.046 -2.848 13.057 1.00 0.00 O ATOM 1597 CB THR A 677 12.664 -3.505 15.198 1.00 0.00 C ATOM 1598 OG1 THR A 677 13.287 -3.523 13.907 1.00 0.00 O ATOM 1599 CG2 THR A 677 13.220 -4.642 16.041 1.00 0.00 C ATOM 0 H THR A 677 11.096 -5.180 13.608 1.00 0.00 H new ATOM 0 HA THR A 677 10.668 -3.528 16.014 1.00 0.00 H new ATOM 0 HB THR A 677 12.875 -2.559 15.697 1.00 0.00 H new ATOM 0 HG1 THR A 677 14.257 -3.431 14.011 1.00 0.00 H new ATOM 0 HG21 THR A 677 14.299 -4.525 16.143 1.00 0.00 H new ATOM 0 HG22 THR A 677 12.758 -4.623 17.028 1.00 0.00 H new ATOM 0 HG23 THR A 677 13.002 -5.594 15.557 1.00 0.00 H new ATOM 1607 N TYR A 678 10.867 -1.306 14.475 1.00 0.00 N ATOM 1608 CA TYR A 678 10.620 -0.180 13.582 1.00 0.00 C ATOM 1609 C TYR A 678 11.622 -0.155 12.436 1.00 0.00 C ATOM 1610 O TYR A 678 12.710 0.406 12.562 1.00 0.00 O ATOM 1611 CB TYR A 678 10.675 1.139 14.356 1.00 0.00 C ATOM 1612 CG TYR A 678 9.517 1.341 15.308 1.00 0.00 C ATOM 1613 CD1 TYR A 678 8.291 1.800 14.849 1.00 0.00 C ATOM 1614 CD2 TYR A 678 9.652 1.074 16.662 1.00 0.00 C ATOM 1615 CE1 TYR A 678 7.230 1.987 15.713 1.00 0.00 C ATOM 1616 CE2 TYR A 678 8.597 1.256 17.536 1.00 0.00 C ATOM 1617 CZ TYR A 678 7.387 1.713 17.056 1.00 0.00 C ATOM 1618 OH TYR A 678 6.333 1.898 17.921 1.00 0.00 O ATOM 0 H TYR A 678 11.227 -1.045 15.393 1.00 0.00 H new ATOM 0 HA TYR A 678 9.623 -0.303 13.160 1.00 0.00 H new ATOM 0 HB2 TYR A 678 11.607 1.179 14.920 1.00 0.00 H new ATOM 0 HB3 TYR A 678 10.696 1.965 13.645 1.00 0.00 H new ATOM 0 HD1 TYR A 678 8.164 2.015 13.798 1.00 0.00 H new ATOM 0 HD2 TYR A 678 10.599 0.717 17.040 1.00 0.00 H new ATOM 0 HE1 TYR A 678 6.282 2.346 15.339 1.00 0.00 H new ATOM 0 HE2 TYR A 678 8.719 1.042 18.588 1.00 0.00 H new ATOM 0 HH TYR A 678 6.610 1.658 18.830 1.00 0.00 H new ATOM 1628 N CYS A 679 11.250 -0.768 11.317 1.00 0.00 N ATOM 1629 CA CYS A 679 12.201 -1.064 10.252 1.00 0.00 C ATOM 1630 C CYS A 679 11.878 -0.275 8.990 1.00 0.00 C ATOM 1631 O CYS A 679 10.725 0.085 8.749 1.00 0.00 O ATOM 1632 CB CYS A 679 11.992 -2.561 10.020 1.00 0.00 C ATOM 1633 SG CYS A 679 10.316 -3.013 9.511 1.00 0.00 S ATOM 0 H CYS A 679 10.295 -1.070 11.124 1.00 0.00 H new ATOM 0 HA CYS A 679 13.227 -0.800 10.508 1.00 0.00 H new ATOM 0 HB2 CYS A 679 12.694 -2.899 9.257 1.00 0.00 H new ATOM 0 HB3 CYS A 679 12.236 -3.096 10.938 1.00 0.00 H new ATOM 0 HG CYS A 679 9.454 -2.443 10.300 1.00 0.00 H new ATOM 1639 N ARG A 680 12.902 -0.008 8.187 1.00 0.00 N ATOM 1640 CA ARG A 680 12.731 0.752 6.954 1.00 0.00 C ATOM 1641 C ARG A 680 12.985 -0.120 5.731 1.00 0.00 C ATOM 1642 O ARG A 680 14.103 -0.583 5.508 1.00 0.00 O ATOM 1643 CB ARG A 680 13.589 2.008 6.931 1.00 0.00 C ATOM 1644 CG ARG A 680 13.207 3.063 7.957 1.00 0.00 C ATOM 1645 CD ARG A 680 14.068 4.273 7.941 1.00 0.00 C ATOM 1646 NE ARG A 680 13.664 5.312 8.875 1.00 0.00 N ATOM 1647 CZ ARG A 680 14.248 6.522 8.972 1.00 0.00 C ATOM 1648 NH1 ARG A 680 15.284 6.837 8.225 1.00 0.00 N ATOM 1649 NH2 ARG A 680 13.768 7.378 9.858 1.00 0.00 N ATOM 0 H ARG A 680 13.860 -0.307 8.368 1.00 0.00 H new ATOM 0 HA ARG A 680 11.692 1.080 6.920 1.00 0.00 H new ATOM 0 HB2 ARG A 680 14.629 1.723 7.094 1.00 0.00 H new ATOM 0 HB3 ARG A 680 13.532 2.451 5.937 1.00 0.00 H new ATOM 0 HG2 ARG A 680 12.174 3.364 7.783 1.00 0.00 H new ATOM 0 HG3 ARG A 680 13.246 2.617 8.951 1.00 0.00 H new ATOM 0 HD2 ARG A 680 15.093 3.978 8.167 1.00 0.00 H new ATOM 0 HD3 ARG A 680 14.071 4.689 6.933 1.00 0.00 H new ATOM 0 HE ARG A 680 12.884 5.110 9.500 1.00 0.00 H new ATOM 0 HH11 ARG A 680 15.657 6.160 7.559 1.00 0.00 H new ATOM 0 HH12 ARG A 680 15.714 7.758 8.311 1.00 0.00 H new ATOM 0 HH21 ARG A 680 12.976 7.114 10.445 1.00 0.00 H new ATOM 0 HH22 ARG A 680 14.189 8.302 9.955 1.00 0.00 H new ATOM 1663 N LEU A 681 11.940 -0.339 4.940 1.00 0.00 N ATOM 1664 CA LEU A 681 12.007 -1.274 3.823 1.00 0.00 C ATOM 1665 C LEU A 681 11.814 -0.557 2.493 1.00 0.00 C ATOM 1666 O LEU A 681 11.122 0.457 2.418 1.00 0.00 O ATOM 1667 CB LEU A 681 10.956 -2.378 3.992 1.00 0.00 C ATOM 1668 CG LEU A 681 11.462 -3.664 4.659 1.00 0.00 C ATOM 1669 CD1 LEU A 681 11.905 -3.372 6.087 1.00 0.00 C ATOM 1670 CD2 LEU A 681 10.360 -4.713 4.641 1.00 0.00 C ATOM 0 H LEU A 681 11.036 0.119 5.052 1.00 0.00 H new ATOM 0 HA LEU A 681 12.998 -1.727 3.819 1.00 0.00 H new ATOM 0 HB2 LEU A 681 10.129 -1.983 4.582 1.00 0.00 H new ATOM 0 HB3 LEU A 681 10.556 -2.630 3.010 1.00 0.00 H new ATOM 0 HG LEU A 681 12.320 -4.047 4.107 1.00 0.00 H new ATOM 0 HD11 LEU A 681 12.262 -4.291 6.552 1.00 0.00 H new ATOM 0 HD12 LEU A 681 12.708 -2.635 6.075 1.00 0.00 H new ATOM 0 HD13 LEU A 681 11.062 -2.981 6.657 1.00 0.00 H new ATOM 0 HD21 LEU A 681 10.719 -5.626 5.115 1.00 0.00 H new ATOM 0 HD22 LEU A 681 9.493 -4.339 5.185 1.00 0.00 H new ATOM 0 HD23 LEU A 681 10.077 -4.926 3.610 1.00 0.00 H new ATOM 1682 N TYR A 682 12.431 -1.092 1.444 1.00 0.00 N ATOM 1683 CA TYR A 682 12.151 -0.649 0.083 1.00 0.00 C ATOM 1684 C TYR A 682 11.545 -1.772 -0.748 1.00 0.00 C ATOM 1685 O TYR A 682 12.087 -2.875 -0.808 1.00 0.00 O ATOM 1686 CB TYR A 682 13.428 -0.132 -0.584 1.00 0.00 C ATOM 1687 CG TYR A 682 13.887 1.214 -0.070 1.00 0.00 C ATOM 1688 CD1 TYR A 682 13.410 2.390 -0.629 1.00 0.00 C ATOM 1689 CD2 TYR A 682 14.799 1.305 0.972 1.00 0.00 C ATOM 1690 CE1 TYR A 682 13.826 3.622 -0.164 1.00 0.00 C ATOM 1691 CE2 TYR A 682 15.221 2.532 1.446 1.00 0.00 C ATOM 1692 CZ TYR A 682 14.732 3.689 0.875 1.00 0.00 C ATOM 1693 OH TYR A 682 15.150 4.914 1.341 1.00 0.00 O ATOM 0 H TYR A 682 13.128 -1.833 1.511 1.00 0.00 H new ATOM 0 HA TYR A 682 11.426 0.163 0.139 1.00 0.00 H new ATOM 0 HB2 TYR A 682 14.226 -0.859 -0.432 1.00 0.00 H new ATOM 0 HB3 TYR A 682 13.262 -0.062 -1.659 1.00 0.00 H new ATOM 0 HD1 TYR A 682 12.701 2.342 -1.442 1.00 0.00 H new ATOM 0 HD2 TYR A 682 15.185 0.401 1.420 1.00 0.00 H new ATOM 0 HE1 TYR A 682 13.444 4.528 -0.611 1.00 0.00 H new ATOM 0 HE2 TYR A 682 15.930 2.585 2.259 1.00 0.00 H new ATOM 0 HH TYR A 682 15.787 4.785 2.075 1.00 0.00 H new ATOM 1703 N SER A 683 10.417 -1.484 -1.388 1.00 0.00 N ATOM 1704 CA SER A 683 9.678 -2.497 -2.132 1.00 0.00 C ATOM 1705 C SER A 683 9.742 -2.236 -3.631 1.00 0.00 C ATOM 1706 O SER A 683 9.937 -1.101 -4.066 1.00 0.00 O ATOM 1707 CB SER A 683 8.236 -2.540 -1.665 1.00 0.00 C ATOM 1708 OG SER A 683 7.561 -1.341 -1.929 1.00 0.00 O ATOM 0 H SER A 683 9.994 -0.556 -1.406 1.00 0.00 H new ATOM 0 HA SER A 683 10.142 -3.464 -1.940 1.00 0.00 H new ATOM 0 HB2 SER A 683 7.720 -3.363 -2.159 1.00 0.00 H new ATOM 0 HB3 SER A 683 8.208 -2.743 -0.595 1.00 0.00 H new ATOM 0 HG SER A 683 6.635 -1.411 -1.615 1.00 0.00 H new ATOM 1714 N LEU A 684 9.578 -3.294 -4.419 1.00 0.00 N ATOM 1715 CA LEU A 684 9.533 -3.169 -5.870 1.00 0.00 C ATOM 1716 C LEU A 684 8.925 -4.409 -6.512 1.00 0.00 C ATOM 1717 O LEU A 684 9.276 -5.536 -6.162 1.00 0.00 O ATOM 1718 CB LEU A 684 10.942 -2.918 -6.424 1.00 0.00 C ATOM 1719 CG LEU A 684 11.009 -2.624 -7.928 1.00 0.00 C ATOM 1720 CD1 LEU A 684 10.282 -1.322 -8.238 1.00 0.00 C ATOM 1721 CD2 LEU A 684 12.464 -2.547 -8.367 1.00 0.00 C ATOM 0 H LEU A 684 9.474 -4.249 -4.075 1.00 0.00 H new ATOM 0 HA LEU A 684 8.898 -2.318 -6.116 1.00 0.00 H new ATOM 0 HB2 LEU A 684 11.383 -2.079 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 684 11.559 -3.791 -6.213 1.00 0.00 H new ATOM 0 HG LEU A 684 10.519 -3.428 -8.478 1.00 0.00 H new ATOM 0 HD11 LEU A 684 10.335 -1.122 -9.308 1.00 0.00 H new ATOM 0 HD12 LEU A 684 9.238 -1.407 -7.936 1.00 0.00 H new ATOM 0 HD13 LEU A 684 10.752 -0.504 -7.692 1.00 0.00 H new ATOM 0 HD21 LEU A 684 12.511 -2.338 -9.436 1.00 0.00 H new ATOM 0 HD22 LEU A 684 12.968 -1.751 -7.819 1.00 0.00 H new ATOM 0 HD23 LEU A 684 12.957 -3.497 -8.161 1.00 0.00 H new ATOM 1733 N SER A 685 8.011 -4.195 -7.452 1.00 0.00 N ATOM 1734 CA SER A 685 7.247 -5.288 -8.041 1.00 0.00 C ATOM 1735 C SER A 685 8.081 -6.060 -9.055 1.00 0.00 C ATOM 1736 O SER A 685 9.037 -5.529 -9.620 1.00 0.00 O ATOM 1737 CB SER A 685 5.987 -4.753 -8.692 1.00 0.00 C ATOM 1738 OG SER A 685 6.265 -4.025 -9.857 1.00 0.00 O ATOM 0 H SER A 685 7.781 -3.273 -7.823 1.00 0.00 H new ATOM 0 HA SER A 685 6.969 -5.976 -7.243 1.00 0.00 H new ATOM 0 HB2 SER A 685 5.323 -5.583 -8.933 1.00 0.00 H new ATOM 0 HB3 SER A 685 5.456 -4.116 -7.985 1.00 0.00 H new ATOM 0 HG SER A 685 5.427 -3.699 -10.247 1.00 0.00 H new ATOM 1744 N VAL A 686 7.715 -7.317 -9.281 1.00 0.00 N ATOM 1745 CA VAL A 686 8.345 -8.124 -10.319 1.00 0.00 C ATOM 1746 C VAL A 686 8.112 -7.525 -11.700 1.00 0.00 C ATOM 1747 O VAL A 686 8.962 -7.631 -12.584 1.00 0.00 O ATOM 1748 CB VAL A 686 7.822 -9.573 -10.304 1.00 0.00 C ATOM 1749 CG1 VAL A 686 8.336 -10.337 -11.515 1.00 0.00 C ATOM 1750 CG2 VAL A 686 8.235 -10.275 -9.019 1.00 0.00 C ATOM 0 H VAL A 686 6.984 -7.800 -8.758 1.00 0.00 H new ATOM 0 HA VAL A 686 9.414 -8.131 -10.105 1.00 0.00 H new ATOM 0 HB VAL A 686 6.733 -9.547 -10.349 1.00 0.00 H new ATOM 0 HG11 VAL A 686 7.957 -11.359 -11.488 1.00 0.00 H new ATOM 0 HG12 VAL A 686 7.994 -9.847 -12.427 1.00 0.00 H new ATOM 0 HG13 VAL A 686 9.426 -10.354 -11.499 1.00 0.00 H new ATOM 0 HG21 VAL A 686 7.857 -11.297 -9.025 1.00 0.00 H new ATOM 0 HG22 VAL A 686 9.322 -10.290 -8.946 1.00 0.00 H new ATOM 0 HG23 VAL A 686 7.822 -9.741 -8.164 1.00 0.00 H new ATOM 1760 N ASP A 687 6.956 -6.897 -11.879 1.00 0.00 N ATOM 1761 CA ASP A 687 6.648 -6.199 -13.122 1.00 0.00 C ATOM 1762 C ASP A 687 7.670 -5.106 -13.408 1.00 0.00 C ATOM 1763 O ASP A 687 8.101 -4.929 -14.547 1.00 0.00 O ATOM 1764 CB ASP A 687 5.240 -5.600 -13.066 1.00 0.00 C ATOM 1765 CG ASP A 687 4.117 -6.624 -13.155 1.00 0.00 C ATOM 1766 OD1 ASP A 687 4.392 -7.751 -13.491 1.00 0.00 O ATOM 1767 OD2 ASP A 687 3.026 -6.316 -12.738 1.00 0.00 O ATOM 0 H ASP A 687 6.216 -6.857 -11.179 1.00 0.00 H new ATOM 0 HA ASP A 687 6.691 -6.927 -13.932 1.00 0.00 H new ATOM 0 HB2 ASP A 687 5.133 -5.041 -12.136 1.00 0.00 H new ATOM 0 HB3 ASP A 687 5.129 -4.886 -13.882 1.00 0.00 H new ATOM 1772 N ASN A 688 8.055 -4.376 -12.367 1.00 0.00 N ATOM 1773 CA ASN A 688 9.030 -3.300 -12.504 1.00 0.00 C ATOM 1774 C ASN A 688 10.437 -3.853 -12.687 1.00 0.00 C ATOM 1775 O ASN A 688 11.247 -3.285 -13.421 1.00 0.00 O ATOM 1776 CB ASN A 688 8.986 -2.357 -11.316 1.00 0.00 C ATOM 1777 CG ASN A 688 7.773 -1.470 -11.291 1.00 0.00 C ATOM 1778 OD1 ASN A 688 7.163 -1.189 -12.329 1.00 0.00 O ATOM 1779 ND2 ASN A 688 7.468 -0.962 -10.124 1.00 0.00 N ATOM 0 H ASN A 688 7.706 -4.510 -11.418 1.00 0.00 H new ATOM 0 HA ASN A 688 8.763 -2.734 -13.397 1.00 0.00 H new ATOM 0 HB2 ASN A 688 9.015 -2.943 -10.397 1.00 0.00 H new ATOM 0 HB3 ASN A 688 9.880 -1.734 -11.325 1.00 0.00 H new ATOM 0 HD21 ASN A 688 6.695 -0.301 -10.042 1.00 0.00 H new ATOM 0 HD22 ASN A 688 8.003 -1.227 -9.297 1.00 0.00 H new ATOM 1786 N PHE A 689 10.724 -4.963 -12.016 1.00 0.00 N ATOM 1787 CA PHE A 689 11.961 -5.699 -12.245 1.00 0.00 C ATOM 1788 C PHE A 689 12.086 -6.126 -13.702 1.00 0.00 C ATOM 1789 O PHE A 689 13.159 -6.027 -14.298 1.00 0.00 O ATOM 1790 CB PHE A 689 12.031 -6.924 -11.330 1.00 0.00 C ATOM 1791 CG PHE A 689 12.491 -6.612 -9.934 1.00 0.00 C ATOM 1792 CD1 PHE A 689 13.743 -6.061 -9.707 1.00 0.00 C ATOM 1793 CD2 PHE A 689 11.670 -6.868 -8.846 1.00 0.00 C ATOM 1794 CE1 PHE A 689 14.167 -5.775 -8.424 1.00 0.00 C ATOM 1795 CE2 PHE A 689 12.092 -6.581 -7.561 1.00 0.00 C ATOM 1796 CZ PHE A 689 13.340 -6.035 -7.350 1.00 0.00 C ATOM 0 H PHE A 689 10.115 -5.373 -11.308 1.00 0.00 H new ATOM 0 HA PHE A 689 12.793 -5.035 -12.012 1.00 0.00 H new ATOM 0 HB2 PHE A 689 11.046 -7.388 -11.283 1.00 0.00 H new ATOM 0 HB3 PHE A 689 12.707 -7.657 -11.770 1.00 0.00 H new ATOM 0 HD1 PHE A 689 14.394 -5.853 -10.543 1.00 0.00 H new ATOM 0 HD2 PHE A 689 10.691 -7.296 -9.004 1.00 0.00 H new ATOM 0 HE1 PHE A 689 15.146 -5.348 -8.261 1.00 0.00 H new ATOM 0 HE2 PHE A 689 11.443 -6.785 -6.722 1.00 0.00 H new ATOM 0 HZ PHE A 689 13.670 -5.811 -6.346 1.00 0.00 H new ATOM 1806 N ASN A 690 10.983 -6.601 -14.271 1.00 0.00 N ATOM 1807 CA ASN A 690 10.949 -6.977 -15.679 1.00 0.00 C ATOM 1808 C ASN A 690 11.156 -5.766 -16.579 1.00 0.00 C ATOM 1809 O ASN A 690 11.823 -5.852 -17.610 1.00 0.00 O ATOM 1810 CB ASN A 690 9.651 -7.679 -16.034 1.00 0.00 C ATOM 1811 CG ASN A 690 9.515 -9.046 -15.423 1.00 0.00 C ATOM 1812 OD1 ASN A 690 10.495 -9.644 -14.966 1.00 0.00 O ATOM 1813 ND2 ASN A 690 8.319 -9.575 -15.485 1.00 0.00 N ATOM 0 H ASN A 690 10.100 -6.735 -13.778 1.00 0.00 H new ATOM 0 HA ASN A 690 11.770 -7.674 -15.845 1.00 0.00 H new ATOM 0 HB2 ASN A 690 8.814 -7.061 -15.709 1.00 0.00 H new ATOM 0 HB3 ASN A 690 9.581 -7.767 -17.118 1.00 0.00 H new ATOM 0 HD21 ASN A 690 8.163 -10.524 -15.146 1.00 0.00 H new ATOM 0 HD22 ASN A 690 7.543 -9.038 -15.872 1.00 0.00 H new ATOM 1820 N GLU A 691 10.580 -4.636 -16.182 1.00 0.00 N ATOM 1821 CA GLU A 691 10.740 -3.392 -16.927 1.00 0.00 C ATOM 1822 C GLU A 691 12.207 -2.990 -17.018 1.00 0.00 C ATOM 1823 O GLU A 691 12.674 -2.545 -18.067 1.00 0.00 O ATOM 1824 CB GLU A 691 9.927 -2.270 -16.277 1.00 0.00 C ATOM 1825 CG GLU A 691 10.049 -0.922 -16.972 1.00 0.00 C ATOM 1826 CD GLU A 691 9.159 0.106 -16.330 1.00 0.00 C ATOM 1827 OE1 GLU A 691 9.278 0.311 -15.146 1.00 0.00 O ATOM 1828 OE2 GLU A 691 8.440 0.767 -17.041 1.00 0.00 O ATOM 0 H GLU A 691 9.998 -4.556 -15.348 1.00 0.00 H new ATOM 0 HA GLU A 691 10.368 -3.558 -17.938 1.00 0.00 H new ATOM 0 HB2 GLU A 691 8.877 -2.562 -16.259 1.00 0.00 H new ATOM 0 HB3 GLU A 691 10.245 -2.161 -15.240 1.00 0.00 H new ATOM 0 HG2 GLU A 691 11.085 -0.584 -16.935 1.00 0.00 H new ATOM 0 HG3 GLU A 691 9.786 -1.028 -18.024 1.00 0.00 H new ATOM 1835 N VAL A 692 12.929 -3.150 -15.915 1.00 0.00 N ATOM 1836 CA VAL A 692 14.360 -2.873 -15.889 1.00 0.00 C ATOM 1837 C VAL A 692 15.123 -3.834 -16.792 1.00 0.00 C ATOM 1838 O VAL A 692 15.946 -3.415 -17.606 1.00 0.00 O ATOM 1839 CB VAL A 692 14.928 -2.966 -14.460 1.00 0.00 C ATOM 1840 CG1 VAL A 692 16.448 -2.898 -14.486 1.00 0.00 C ATOM 1841 CG2 VAL A 692 14.362 -1.856 -13.588 1.00 0.00 C ATOM 0 H VAL A 692 12.546 -3.471 -15.026 1.00 0.00 H new ATOM 0 HA VAL A 692 14.490 -1.855 -16.255 1.00 0.00 H new ATOM 0 HB VAL A 692 14.632 -3.924 -14.034 1.00 0.00 H new ATOM 0 HG11 VAL A 692 16.833 -2.965 -13.468 1.00 0.00 H new ATOM 0 HG12 VAL A 692 16.839 -3.726 -15.077 1.00 0.00 H new ATOM 0 HG13 VAL A 692 16.762 -1.954 -14.931 1.00 0.00 H new ATOM 0 HG21 VAL A 692 14.774 -1.937 -12.582 1.00 0.00 H new ATOM 0 HG22 VAL A 692 14.629 -0.888 -14.012 1.00 0.00 H new ATOM 0 HG23 VAL A 692 13.277 -1.946 -13.544 1.00 0.00 H new ATOM 1851 N LEU A 693 14.845 -5.125 -16.643 1.00 0.00 N ATOM 1852 CA LEU A 693 15.523 -6.150 -17.427 1.00 0.00 C ATOM 1853 C LEU A 693 15.231 -5.989 -18.914 1.00 0.00 C ATOM 1854 O LEU A 693 16.052 -6.345 -19.759 1.00 0.00 O ATOM 1855 CB LEU A 693 15.104 -7.546 -16.950 1.00 0.00 C ATOM 1856 CG LEU A 693 15.650 -7.958 -15.576 1.00 0.00 C ATOM 1857 CD1 LEU A 693 15.017 -9.270 -15.135 1.00 0.00 C ATOM 1858 CD2 LEU A 693 17.164 -8.086 -15.648 1.00 0.00 C ATOM 0 H LEU A 693 14.154 -5.486 -15.986 1.00 0.00 H new ATOM 0 HA LEU A 693 16.597 -6.033 -17.280 1.00 0.00 H new ATOM 0 HB2 LEU A 693 14.015 -7.590 -16.919 1.00 0.00 H new ATOM 0 HB3 LEU A 693 15.432 -8.278 -17.688 1.00 0.00 H new ATOM 0 HG LEU A 693 15.398 -7.194 -14.840 1.00 0.00 H new ATOM 0 HD11 LEU A 693 15.411 -9.554 -14.159 1.00 0.00 H new ATOM 0 HD12 LEU A 693 13.936 -9.148 -15.069 1.00 0.00 H new ATOM 0 HD13 LEU A 693 15.250 -10.049 -15.861 1.00 0.00 H new ATOM 0 HD21 LEU A 693 17.551 -8.379 -14.672 1.00 0.00 H new ATOM 0 HD22 LEU A 693 17.430 -8.843 -16.386 1.00 0.00 H new ATOM 0 HD23 LEU A 693 17.597 -7.128 -15.938 1.00 0.00 H new ATOM 1870 N GLU A 694 14.057 -5.450 -19.226 1.00 0.00 N ATOM 1871 CA GLU A 694 13.650 -5.252 -20.612 1.00 0.00 C ATOM 1872 C GLU A 694 13.853 -3.805 -21.043 1.00 0.00 C ATOM 1873 O GLU A 694 13.339 -3.378 -22.077 1.00 0.00 O ATOM 1874 CB GLU A 694 12.187 -5.657 -20.804 1.00 0.00 C ATOM 1875 CG GLU A 694 11.910 -7.137 -20.582 1.00 0.00 C ATOM 1876 CD GLU A 694 10.449 -7.451 -20.751 1.00 0.00 C ATOM 1877 OE1 GLU A 694 9.646 -6.806 -20.121 1.00 0.00 O ATOM 1878 OE2 GLU A 694 10.129 -8.258 -21.592 1.00 0.00 O ATOM 0 H GLU A 694 13.370 -5.142 -18.537 1.00 0.00 H new ATOM 0 HA GLU A 694 14.278 -5.886 -21.238 1.00 0.00 H new ATOM 0 HB2 GLU A 694 11.569 -5.077 -20.118 1.00 0.00 H new ATOM 0 HB3 GLU A 694 11.878 -5.390 -21.815 1.00 0.00 H new ATOM 0 HG2 GLU A 694 12.495 -7.728 -21.286 1.00 0.00 H new ATOM 0 HG3 GLU A 694 12.232 -7.423 -19.581 1.00 0.00 H new ATOM 1885 N GLU A 695 14.605 -3.055 -20.245 1.00 0.00 N ATOM 1886 CA GLU A 695 14.882 -1.655 -20.546 1.00 0.00 C ATOM 1887 C GLU A 695 15.782 -1.522 -21.768 1.00 0.00 C ATOM 1888 O GLU A 695 15.575 -0.648 -22.610 1.00 0.00 O ATOM 1889 CB GLU A 695 15.526 -0.966 -19.341 1.00 0.00 C ATOM 1890 CG GLU A 695 15.814 0.515 -19.544 1.00 0.00 C ATOM 1891 CD GLU A 695 16.354 1.144 -18.290 1.00 0.00 C ATOM 1892 OE1 GLU A 695 16.482 0.451 -17.309 1.00 0.00 O ATOM 1893 OE2 GLU A 695 16.745 2.286 -18.343 1.00 0.00 O ATOM 0 H GLU A 695 15.034 -3.393 -19.384 1.00 0.00 H new ATOM 0 HA GLU A 695 13.933 -1.167 -20.768 1.00 0.00 H new ATOM 0 HB2 GLU A 695 14.870 -1.081 -18.478 1.00 0.00 H new ATOM 0 HB3 GLU A 695 16.459 -1.476 -19.102 1.00 0.00 H new ATOM 0 HG2 GLU A 695 16.532 0.640 -20.354 1.00 0.00 H new ATOM 0 HG3 GLU A 695 14.900 1.027 -19.846 1.00 0.00 H new ATOM 1900 N TYR A 696 16.780 -2.394 -21.859 1.00 0.00 N ATOM 1901 CA TYR A 696 17.639 -2.455 -23.035 1.00 0.00 C ATOM 1902 C TYR A 696 17.226 -3.592 -23.961 1.00 0.00 C ATOM 1903 O TYR A 696 17.056 -4.730 -23.524 1.00 0.00 O ATOM 1904 CB TYR A 696 19.103 -2.621 -22.621 1.00 0.00 C ATOM 1905 CG TYR A 696 19.680 -1.416 -21.912 1.00 0.00 C ATOM 1906 CD1 TYR A 696 19.070 -0.174 -22.005 1.00 0.00 C ATOM 1907 CD2 TYR A 696 20.833 -1.525 -21.148 1.00 0.00 C ATOM 1908 CE1 TYR A 696 19.593 0.930 -21.360 1.00 0.00 C ATOM 1909 CE2 TYR A 696 21.364 -0.429 -20.498 1.00 0.00 C ATOM 1910 CZ TYR A 696 20.741 0.798 -20.606 1.00 0.00 C ATOM 1911 OH TYR A 696 21.266 1.893 -19.959 1.00 0.00 O ATOM 0 H TYR A 696 17.014 -3.069 -21.131 1.00 0.00 H new ATOM 0 HA TYR A 696 17.528 -1.516 -23.577 1.00 0.00 H new ATOM 0 HB2 TYR A 696 19.190 -3.490 -21.969 1.00 0.00 H new ATOM 0 HB3 TYR A 696 19.700 -2.828 -23.509 1.00 0.00 H new ATOM 0 HD1 TYR A 696 18.170 -0.068 -22.592 1.00 0.00 H new ATOM 0 HD2 TYR A 696 21.323 -2.483 -21.060 1.00 0.00 H new ATOM 0 HE1 TYR A 696 19.106 1.890 -21.445 1.00 0.00 H new ATOM 0 HE2 TYR A 696 22.263 -0.531 -19.908 1.00 0.00 H new ATOM 0 HH TYR A 696 20.879 1.959 -19.061 1.00 0.00 H new ATOM 1921 N PRO A 697 17.066 -3.277 -25.242 1.00 0.00 N ATOM 1922 CA PRO A 697 16.676 -4.273 -26.233 1.00 0.00 C ATOM 1923 C PRO A 697 17.605 -5.479 -26.197 1.00 0.00 C ATOM 1924 O PRO A 697 17.169 -6.616 -26.374 1.00 0.00 O ATOM 1925 CB PRO A 697 16.755 -3.524 -27.567 1.00 0.00 C ATOM 1926 CG PRO A 697 16.460 -2.106 -27.215 1.00 0.00 C ATOM 1927 CD PRO A 697 17.132 -1.876 -25.888 1.00 0.00 C ATOM 0 HA PRO A 697 15.681 -4.680 -26.054 1.00 0.00 H new ATOM 0 HB2 PRO A 697 17.741 -3.624 -28.021 1.00 0.00 H new ATOM 0 HB3 PRO A 697 16.033 -3.914 -28.285 1.00 0.00 H new ATOM 0 HG2 PRO A 697 16.845 -1.425 -27.974 1.00 0.00 H new ATOM 0 HG3 PRO A 697 15.386 -1.933 -27.147 1.00 0.00 H new ATOM 0 HD2 PRO A 697 18.159 -1.530 -26.006 1.00 0.00 H new ATOM 0 HD3 PRO A 697 16.610 -1.128 -25.292 1.00 0.00 H new ATOM 1935 N MET A 698 18.889 -5.224 -25.965 1.00 0.00 N ATOM 1936 CA MET A 698 19.891 -6.283 -25.954 1.00 0.00 C ATOM 1937 C MET A 698 19.632 -7.275 -24.827 1.00 0.00 C ATOM 1938 O MET A 698 19.956 -8.457 -24.940 1.00 0.00 O ATOM 1939 CB MET A 698 21.290 -5.685 -25.821 1.00 0.00 C ATOM 1940 CG MET A 698 21.749 -4.883 -27.030 1.00 0.00 C ATOM 1941 SD MET A 698 21.792 -5.867 -28.541 1.00 0.00 S ATOM 1942 CE MET A 698 23.141 -6.987 -28.178 1.00 0.00 C ATOM 0 H MET A 698 19.260 -4.292 -25.782 1.00 0.00 H new ATOM 0 HA MET A 698 19.823 -6.822 -26.899 1.00 0.00 H new ATOM 0 HB2 MET A 698 21.314 -5.040 -24.942 1.00 0.00 H new ATOM 0 HB3 MET A 698 22.001 -6.492 -25.644 1.00 0.00 H new ATOM 0 HG2 MET A 698 21.081 -4.034 -27.173 1.00 0.00 H new ATOM 0 HG3 MET A 698 22.742 -4.478 -26.837 1.00 0.00 H new ATOM 0 HE1 MET A 698 23.455 -7.487 -29.094 1.00 0.00 H new ATOM 0 HE2 MET A 698 23.979 -6.425 -27.765 1.00 0.00 H new ATOM 0 HE3 MET A 698 22.811 -7.731 -27.453 1.00 0.00 H new ATOM 1952 N MET A 699 19.045 -6.786 -23.739 1.00 0.00 N ATOM 1953 CA MET A 699 18.725 -7.632 -22.596 1.00 0.00 C ATOM 1954 C MET A 699 17.268 -8.076 -22.630 1.00 0.00 C ATOM 1955 O MET A 699 16.893 -9.059 -21.991 1.00 0.00 O ATOM 1956 CB MET A 699 19.021 -6.893 -21.293 1.00 0.00 C ATOM 1957 CG MET A 699 20.488 -6.538 -21.090 1.00 0.00 C ATOM 1958 SD MET A 699 21.560 -7.988 -21.085 1.00 0.00 S ATOM 1959 CE MET A 699 21.026 -8.799 -19.580 1.00 0.00 C ATOM 0 H MET A 699 18.781 -5.807 -23.626 1.00 0.00 H new ATOM 0 HA MET A 699 19.351 -8.523 -22.650 1.00 0.00 H new ATOM 0 HB2 MET A 699 18.431 -5.977 -21.267 1.00 0.00 H new ATOM 0 HB3 MET A 699 18.690 -7.509 -20.457 1.00 0.00 H new ATOM 0 HG2 MET A 699 20.806 -5.859 -21.881 1.00 0.00 H new ATOM 0 HG3 MET A 699 20.601 -6.004 -20.146 1.00 0.00 H new ATOM 0 HE1 MET A 699 21.749 -9.566 -19.304 1.00 0.00 H new ATOM 0 HE2 MET A 699 20.952 -8.065 -18.778 1.00 0.00 H new ATOM 0 HE3 MET A 699 20.051 -9.260 -19.741 1.00 0.00 H new ATOM 1969 N ARG A 700 16.450 -7.346 -23.380 1.00 0.00 N ATOM 1970 CA ARG A 700 15.059 -7.729 -23.593 1.00 0.00 C ATOM 1971 C ARG A 700 14.960 -9.038 -24.366 1.00 0.00 C ATOM 1972 O ARG A 700 14.081 -9.859 -24.105 1.00 0.00 O ATOM 1973 CB ARG A 700 14.256 -6.624 -24.263 1.00 0.00 C ATOM 1974 CG ARG A 700 12.756 -6.868 -24.320 1.00 0.00 C ATOM 1975 CD ARG A 700 11.977 -5.756 -24.921 1.00 0.00 C ATOM 1976 NE ARG A 700 12.213 -4.457 -24.312 1.00 0.00 N ATOM 1977 CZ ARG A 700 12.042 -3.276 -24.938 1.00 0.00 C ATOM 1978 NH1 ARG A 700 11.671 -3.225 -26.199 1.00 0.00 N ATOM 1979 NH2 ARG A 700 12.280 -2.168 -24.258 1.00 0.00 N ATOM 0 H ARG A 700 16.726 -6.485 -23.851 1.00 0.00 H new ATOM 0 HA ARG A 700 14.616 -7.888 -22.610 1.00 0.00 H new ATOM 0 HB2 ARG A 700 14.438 -5.690 -23.732 1.00 0.00 H new ATOM 0 HB3 ARG A 700 14.627 -6.490 -25.279 1.00 0.00 H new ATOM 0 HG2 ARG A 700 12.569 -7.777 -24.892 1.00 0.00 H new ATOM 0 HG3 ARG A 700 12.390 -7.047 -23.309 1.00 0.00 H new ATOM 0 HD2 ARG A 700 12.216 -5.694 -25.983 1.00 0.00 H new ATOM 0 HD3 ARG A 700 10.915 -5.991 -24.846 1.00 0.00 H new ATOM 0 HE ARG A 700 12.530 -4.438 -23.343 1.00 0.00 H new ATOM 0 HH11 ARG A 700 11.508 -4.088 -26.718 1.00 0.00 H new ATOM 0 HH12 ARG A 700 11.546 -2.323 -26.658 1.00 0.00 H new ATOM 0 HH21 ARG A 700 12.584 -2.222 -23.286 1.00 0.00 H new ATOM 0 HH22 ARG A 700 12.159 -1.259 -24.705 1.00 0.00 H new