USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=29 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 685 SER OG : rot 180:sc= 0.359 USER MOD Set 1.2: A 688 ASN : amide:sc= -0.0379 K(o=0.32,f=-1!) USER MOD Set 2.1: A 586 CYS SG : rot 180:sc= 0 USER MOD Set 2.2: A 636 GLN : amide:sc= -0.0468 X(o=-0.047,f=-0.18) USER MOD Single : A 588 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 592 SER OG : rot -29:sc= 0.913 USER MOD Single : A 593 MET CE :methyl -127:sc= -0.0199 (180deg=-0.297) USER MOD Single : A 598 ASN : amide:sc=-0.00855 X(o=-0.0085,f=0) USER MOD Single : A 602 ASN : amide:sc=-0.00583 K(o=-0.0058,f=-1.3) USER MOD Single : A 605 THR OG1 : rot 74:sc= 1.01 USER MOD Single : A 606 SER OG : rot 158:sc= 1.17 USER MOD Single : A 607 MET CE :methyl -164:sc= -1.32 (180deg=-2.07) USER MOD Single : A 609 THR OG1 : rot -9:sc= 1.13 USER MOD Single : A 610 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 617 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 621 TYR OH : rot 165:sc= 0.809 USER MOD Single : A 627 THR OG1 : rot -170:sc= 0 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 160:sc= -0.245 (180deg=-2.14) USER MOD Single : A 633 TYR OH : rot 180:sc= 0 USER MOD Single : A 637 HIS : no HD1:sc= -0.339 K(o=-0.34,f=-1.4) USER MOD Single : A 641 SER OG : rot 169:sc= 0.834 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= -0.331 X(o=-0.33,f=0) USER MOD Single : A 648 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 650 THR OG1 : rot -23:sc= 0.0735 USER MOD Single : A 651 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 656 SER OG : rot 180:sc= 0 USER MOD Single : A 657 TYR OH : rot 163:sc= 0.884 USER MOD Single : A 662 CYS SG : rot 180:sc= -0.134 USER MOD Single : A 665 THR OG1 : rot -66:sc= 1.57 USER MOD Single : A 670 THR OG1 : rot 180:sc= 0 USER MOD Single : A 672 SER OG : rot 180:sc= 0.482 USER MOD Single : A 677 THR OG1 : rot 180:sc= 0.498 USER MOD Single : A 678 TYR OH : rot 180:sc= 0 USER MOD Single : A 679 CYS SG : rot 83:sc= -2.72! USER MOD Single : A 682 TYR OH : rot 165:sc= 0 USER MOD Single : A 683 SER OG : rot 180:sc= -0.0158 USER MOD Single : A 690 ASN : amide:sc= -0.0248 K(o=-0.025,f=-1.3!) USER MOD Single : A 696 TYR OH : rot 120:sc= 0 USER MOD Single : A 698 MET CE :methyl -166:sc= -0.0124 (180deg=-0.268) USER MOD Single : A 699 MET CE :methyl -165:sc= -0.0203 (180deg=-0.268) USER MOD ----------------------------------------------------------------- ATOM 144 N CYS A 586 23.752 4.055 0.004 1.00 0.00 N ATOM 145 CA CYS A 586 22.974 2.823 -0.011 1.00 0.00 C ATOM 146 C CYS A 586 23.016 2.161 -1.383 1.00 0.00 C ATOM 147 O CYS A 586 22.654 0.994 -1.531 1.00 0.00 O ATOM 148 CB CYS A 586 21.561 3.312 0.308 1.00 0.00 C ATOM 149 SG CYS A 586 21.417 4.227 1.862 1.00 0.00 S ATOM 0 HA CYS A 586 23.346 2.074 0.688 1.00 0.00 H new ATOM 0 HB2 CYS A 586 21.218 3.949 -0.507 1.00 0.00 H new ATOM 0 HB3 CYS A 586 20.892 2.452 0.344 1.00 0.00 H new ATOM 0 HG CYS A 586 20.183 4.597 2.035 1.00 0.00 H new ATOM 155 N ARG A 587 23.459 2.914 -2.384 1.00 0.00 N ATOM 156 CA ARG A 587 23.598 2.387 -3.736 1.00 0.00 C ATOM 157 C ARG A 587 24.556 1.203 -3.769 1.00 0.00 C ATOM 158 O ARG A 587 24.283 0.189 -4.411 1.00 0.00 O ATOM 159 CB ARG A 587 24.007 3.462 -4.732 1.00 0.00 C ATOM 160 CG ARG A 587 22.970 4.550 -4.959 1.00 0.00 C ATOM 161 CD ARG A 587 23.402 5.623 -5.891 1.00 0.00 C ATOM 162 NE ARG A 587 22.431 6.690 -6.074 1.00 0.00 N ATOM 163 CZ ARG A 587 22.641 7.798 -6.811 1.00 0.00 C ATOM 164 NH1 ARG A 587 23.796 8.008 -7.404 1.00 0.00 N ATOM 165 NH2 ARG A 587 21.663 8.681 -6.904 1.00 0.00 N ATOM 0 H ARG A 587 23.728 3.893 -2.284 1.00 0.00 H new ATOM 0 HA ARG A 587 22.615 2.031 -4.044 1.00 0.00 H new ATOM 0 HB2 ARG A 587 24.930 3.926 -4.385 1.00 0.00 H new ATOM 0 HB3 ARG A 587 24.229 2.987 -5.687 1.00 0.00 H new ATOM 0 HG2 ARG A 587 22.060 4.093 -5.347 1.00 0.00 H new ATOM 0 HG3 ARG A 587 22.716 4.999 -3.999 1.00 0.00 H new ATOM 0 HD2 ARG A 587 24.332 6.055 -5.522 1.00 0.00 H new ATOM 0 HD3 ARG A 587 23.621 5.178 -6.861 1.00 0.00 H new ATOM 0 HE ARG A 587 21.527 6.593 -5.612 1.00 0.00 H new ATOM 0 HH11 ARG A 587 24.549 7.327 -7.309 1.00 0.00 H new ATOM 0 HH12 ARG A 587 23.939 8.852 -7.958 1.00 0.00 H new ATOM 0 HH21 ARG A 587 20.778 8.514 -6.425 1.00 0.00 H new ATOM 0 HH22 ARG A 587 21.793 9.530 -7.455 1.00 0.00 H new ATOM 179 N LYS A 588 25.680 1.338 -3.074 1.00 0.00 N ATOM 180 CA LYS A 588 26.674 0.273 -3.008 1.00 0.00 C ATOM 181 C LYS A 588 26.146 -0.925 -2.228 1.00 0.00 C ATOM 182 O LYS A 588 26.459 -2.072 -2.546 1.00 0.00 O ATOM 183 CB LYS A 588 27.968 0.785 -2.374 1.00 0.00 C ATOM 184 CG LYS A 588 28.745 1.769 -3.238 1.00 0.00 C ATOM 185 CD LYS A 588 30.010 2.241 -2.537 1.00 0.00 C ATOM 186 CE LYS A 588 30.778 3.239 -3.391 1.00 0.00 C ATOM 187 NZ LYS A 588 31.999 3.738 -2.703 1.00 0.00 N ATOM 0 H LYS A 588 25.926 2.176 -2.547 1.00 0.00 H new ATOM 0 HA LYS A 588 26.884 -0.050 -4.028 1.00 0.00 H new ATOM 0 HB2 LYS A 588 27.728 1.264 -1.425 1.00 0.00 H new ATOM 0 HB3 LYS A 588 28.610 -0.067 -2.148 1.00 0.00 H new ATOM 0 HG2 LYS A 588 29.006 1.297 -4.185 1.00 0.00 H new ATOM 0 HG3 LYS A 588 28.115 2.627 -3.472 1.00 0.00 H new ATOM 0 HD2 LYS A 588 29.750 2.700 -1.583 1.00 0.00 H new ATOM 0 HD3 LYS A 588 30.646 1.384 -2.315 1.00 0.00 H new ATOM 0 HE2 LYS A 588 31.059 2.769 -4.333 1.00 0.00 H new ATOM 0 HE3 LYS A 588 30.130 4.081 -3.636 1.00 0.00 H new ATOM 0 HZ1 LYS A 588 32.492 4.415 -3.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 588 31.730 4.210 -1.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 588 32.630 2.939 -2.492 1.00 0.00 H new ATOM 201 N LEU A 589 25.345 -0.651 -1.204 1.00 0.00 N ATOM 202 CA LEU A 589 24.729 -1.707 -0.409 1.00 0.00 C ATOM 203 C LEU A 589 23.871 -2.619 -1.276 1.00 0.00 C ATOM 204 O LEU A 589 23.981 -3.843 -1.203 1.00 0.00 O ATOM 205 CB LEU A 589 23.889 -1.098 0.721 1.00 0.00 C ATOM 206 CG LEU A 589 23.162 -2.113 1.612 1.00 0.00 C ATOM 207 CD1 LEU A 589 24.173 -3.007 2.318 1.00 0.00 C ATOM 208 CD2 LEU A 589 22.297 -1.374 2.623 1.00 0.00 C ATOM 0 H LEU A 589 25.107 0.295 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 589 25.525 -2.311 0.028 1.00 0.00 H new ATOM 0 HB2 LEU A 589 24.540 -0.488 1.348 1.00 0.00 H new ATOM 0 HB3 LEU A 589 23.150 -0.428 0.282 1.00 0.00 H new ATOM 0 HG LEU A 589 22.521 -2.744 0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 589 23.647 -3.724 2.948 1.00 0.00 H new ATOM 0 HD12 LEU A 589 24.766 -3.542 1.576 1.00 0.00 H new ATOM 0 HD13 LEU A 589 24.831 -2.395 2.936 1.00 0.00 H new ATOM 0 HD21 LEU A 589 21.780 -2.095 3.256 1.00 0.00 H new ATOM 0 HD22 LEU A 589 22.926 -0.734 3.241 1.00 0.00 H new ATOM 0 HD23 LEU A 589 21.564 -0.763 2.097 1.00 0.00 H new ATOM 220 N VAL A 590 23.016 -2.017 -2.095 1.00 0.00 N ATOM 221 CA VAL A 590 22.171 -2.772 -3.012 1.00 0.00 C ATOM 222 C VAL A 590 23.001 -3.441 -4.101 1.00 0.00 C ATOM 223 O VAL A 590 22.755 -4.591 -4.464 1.00 0.00 O ATOM 224 CB VAL A 590 21.107 -1.874 -3.670 1.00 0.00 C ATOM 225 CG1 VAL A 590 20.355 -2.642 -4.748 1.00 0.00 C ATOM 226 CG2 VAL A 590 20.139 -1.341 -2.625 1.00 0.00 C ATOM 0 H VAL A 590 22.890 -1.006 -2.142 1.00 0.00 H new ATOM 0 HA VAL A 590 21.670 -3.537 -2.419 1.00 0.00 H new ATOM 0 HB VAL A 590 21.612 -1.028 -4.136 1.00 0.00 H new ATOM 0 HG11 VAL A 590 19.607 -1.993 -5.203 1.00 0.00 H new ATOM 0 HG12 VAL A 590 21.056 -2.978 -5.512 1.00 0.00 H new ATOM 0 HG13 VAL A 590 19.862 -3.506 -4.302 1.00 0.00 H new ATOM 0 HG21 VAL A 590 19.394 -0.708 -3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 590 19.641 -2.175 -2.131 1.00 0.00 H new ATOM 0 HG23 VAL A 590 20.687 -0.757 -1.886 1.00 0.00 H new ATOM 236 N ALA A 591 23.985 -2.714 -4.619 1.00 0.00 N ATOM 237 CA ALA A 591 24.869 -3.244 -5.650 1.00 0.00 C ATOM 238 C ALA A 591 25.611 -4.479 -5.157 1.00 0.00 C ATOM 239 O ALA A 591 25.890 -5.397 -5.929 1.00 0.00 O ATOM 240 CB ALA A 591 25.854 -2.176 -6.104 1.00 0.00 C ATOM 0 H ALA A 591 24.191 -1.754 -4.341 1.00 0.00 H new ATOM 0 HA ALA A 591 24.256 -3.539 -6.501 1.00 0.00 H new ATOM 0 HB1 ALA A 591 26.507 -2.587 -6.874 1.00 0.00 H new ATOM 0 HB2 ALA A 591 25.307 -1.325 -6.509 1.00 0.00 H new ATOM 0 HB3 ALA A 591 26.455 -1.850 -5.255 1.00 0.00 H new ATOM 246 N SER A 592 25.928 -4.498 -3.867 1.00 0.00 N ATOM 247 CA SER A 592 26.660 -5.611 -3.274 1.00 0.00 C ATOM 248 C SER A 592 25.720 -6.746 -2.890 1.00 0.00 C ATOM 249 O SER A 592 26.163 -7.837 -2.532 1.00 0.00 O ATOM 250 CB SER A 592 27.438 -5.137 -2.062 1.00 0.00 C ATOM 251 OG SER A 592 26.596 -4.812 -0.990 1.00 0.00 O ATOM 0 H SER A 592 25.689 -3.754 -3.211 1.00 0.00 H new ATOM 0 HA SER A 592 27.359 -5.992 -4.018 1.00 0.00 H new ATOM 0 HB2 SER A 592 28.135 -5.915 -1.752 1.00 0.00 H new ATOM 0 HB3 SER A 592 28.034 -4.265 -2.332 1.00 0.00 H new ATOM 0 HG SER A 592 25.730 -4.510 -1.334 1.00 0.00 H new ATOM 257 N MET A 593 24.420 -6.483 -2.968 1.00 0.00 N ATOM 258 CA MET A 593 23.414 -7.493 -2.660 1.00 0.00 C ATOM 259 C MET A 593 23.513 -8.676 -3.614 1.00 0.00 C ATOM 260 O MET A 593 23.668 -8.501 -4.822 1.00 0.00 O ATOM 261 CB MET A 593 22.016 -6.880 -2.720 1.00 0.00 C ATOM 262 CG MET A 593 20.912 -7.778 -2.181 1.00 0.00 C ATOM 263 SD MET A 593 19.287 -6.998 -2.247 1.00 0.00 S ATOM 264 CE MET A 593 19.459 -5.749 -0.975 1.00 0.00 C ATOM 0 H MET A 593 24.038 -5.578 -3.242 1.00 0.00 H new ATOM 0 HA MET A 593 23.599 -7.858 -1.650 1.00 0.00 H new ATOM 0 HB2 MET A 593 22.017 -5.947 -2.156 1.00 0.00 H new ATOM 0 HB3 MET A 593 21.788 -6.626 -3.755 1.00 0.00 H new ATOM 0 HG2 MET A 593 20.890 -8.704 -2.755 1.00 0.00 H new ATOM 0 HG3 MET A 593 21.140 -8.048 -1.150 1.00 0.00 H new ATOM 0 HE1 MET A 593 18.637 -5.838 -0.264 1.00 0.00 H new ATOM 0 HE2 MET A 593 20.406 -5.888 -0.454 1.00 0.00 H new ATOM 0 HE3 MET A 593 19.438 -4.759 -1.432 1.00 0.00 H new ATOM 274 N PRO A 594 23.421 -9.882 -3.063 1.00 0.00 N ATOM 275 CA PRO A 594 23.511 -11.098 -3.863 1.00 0.00 C ATOM 276 C PRO A 594 22.599 -11.026 -5.080 1.00 0.00 C ATOM 277 O PRO A 594 22.994 -11.391 -6.187 1.00 0.00 O ATOM 278 CB PRO A 594 23.096 -12.213 -2.897 1.00 0.00 C ATOM 279 CG PRO A 594 23.571 -11.745 -1.564 1.00 0.00 C ATOM 280 CD PRO A 594 23.325 -10.260 -1.551 1.00 0.00 C ATOM 0 HA PRO A 594 24.509 -11.262 -4.270 1.00 0.00 H new ATOM 0 HB2 PRO A 594 22.016 -12.363 -2.904 1.00 0.00 H new ATOM 0 HB3 PRO A 594 23.552 -13.165 -3.170 1.00 0.00 H new ATOM 0 HG2 PRO A 594 23.029 -12.240 -0.758 1.00 0.00 H new ATOM 0 HG3 PRO A 594 24.628 -11.969 -1.423 1.00 0.00 H new ATOM 0 HD2 PRO A 594 22.348 -10.015 -1.134 1.00 0.00 H new ATOM 0 HD3 PRO A 594 24.068 -9.732 -0.954 1.00 0.00 H new ATOM 288 N LEU A 595 21.376 -10.551 -4.869 1.00 0.00 N ATOM 289 CA LEU A 595 20.400 -10.442 -5.947 1.00 0.00 C ATOM 290 C LEU A 595 20.955 -9.634 -7.113 1.00 0.00 C ATOM 291 O LEU A 595 20.715 -9.958 -8.276 1.00 0.00 O ATOM 292 CB LEU A 595 19.105 -9.806 -5.426 1.00 0.00 C ATOM 293 CG LEU A 595 17.971 -9.699 -6.455 1.00 0.00 C ATOM 294 CD1 LEU A 595 17.545 -11.089 -6.909 1.00 0.00 C ATOM 295 CD2 LEU A 595 16.798 -8.949 -5.842 1.00 0.00 C ATOM 0 H LEU A 595 21.037 -10.235 -3.960 1.00 0.00 H new ATOM 0 HA LEU A 595 20.181 -11.447 -6.309 1.00 0.00 H new ATOM 0 HB2 LEU A 595 18.749 -10.388 -4.576 1.00 0.00 H new ATOM 0 HB3 LEU A 595 19.333 -8.807 -5.055 1.00 0.00 H new ATOM 0 HG LEU A 595 18.322 -9.148 -7.328 1.00 0.00 H new ATOM 0 HD11 LEU A 595 16.740 -11.003 -7.639 1.00 0.00 H new ATOM 0 HD12 LEU A 595 18.394 -11.599 -7.364 1.00 0.00 H new ATOM 0 HD13 LEU A 595 17.196 -11.661 -6.050 1.00 0.00 H new ATOM 0 HD21 LEU A 595 15.993 -8.873 -6.573 1.00 0.00 H new ATOM 0 HD22 LEU A 595 16.441 -9.487 -4.964 1.00 0.00 H new ATOM 0 HD23 LEU A 595 17.118 -7.949 -5.550 1.00 0.00 H new ATOM 307 N PHE A 596 21.699 -8.580 -6.794 1.00 0.00 N ATOM 308 CA PHE A 596 22.181 -7.648 -7.807 1.00 0.00 C ATOM 309 C PHE A 596 23.681 -7.801 -8.027 1.00 0.00 C ATOM 310 O PHE A 596 24.306 -6.979 -8.697 1.00 0.00 O ATOM 311 CB PHE A 596 21.852 -6.208 -7.408 1.00 0.00 C ATOM 312 CG PHE A 596 20.380 -5.934 -7.288 1.00 0.00 C ATOM 313 CD1 PHE A 596 19.595 -5.767 -8.419 1.00 0.00 C ATOM 314 CD2 PHE A 596 19.776 -5.844 -6.042 1.00 0.00 C ATOM 315 CE1 PHE A 596 18.242 -5.514 -8.309 1.00 0.00 C ATOM 316 CE2 PHE A 596 18.422 -5.593 -5.930 1.00 0.00 C ATOM 317 CZ PHE A 596 17.655 -5.427 -7.063 1.00 0.00 C ATOM 0 H PHE A 596 21.981 -8.350 -5.841 1.00 0.00 H new ATOM 0 HA PHE A 596 21.674 -7.881 -8.743 1.00 0.00 H new ATOM 0 HB2 PHE A 596 22.332 -5.986 -6.455 1.00 0.00 H new ATOM 0 HB3 PHE A 596 22.280 -5.529 -8.146 1.00 0.00 H new ATOM 0 HD1 PHE A 596 20.047 -5.836 -9.397 1.00 0.00 H new ATOM 0 HD2 PHE A 596 20.371 -5.972 -5.150 1.00 0.00 H new ATOM 0 HE1 PHE A 596 17.643 -5.384 -9.198 1.00 0.00 H new ATOM 0 HE2 PHE A 596 17.964 -5.527 -4.954 1.00 0.00 H new ATOM 0 HZ PHE A 596 16.597 -5.229 -6.976 1.00 0.00 H new ATOM 327 N ALA A 597 24.252 -8.857 -7.459 1.00 0.00 N ATOM 328 CA ALA A 597 25.698 -9.045 -7.471 1.00 0.00 C ATOM 329 C ALA A 597 26.231 -9.124 -8.896 1.00 0.00 C ATOM 330 O ALA A 597 27.269 -8.543 -9.214 1.00 0.00 O ATOM 331 CB ALA A 597 26.076 -10.295 -6.690 1.00 0.00 C ATOM 0 H ALA A 597 23.735 -9.597 -6.984 1.00 0.00 H new ATOM 0 HA ALA A 597 26.155 -8.180 -6.990 1.00 0.00 H new ATOM 0 HB1 ALA A 597 27.158 -10.422 -6.708 1.00 0.00 H new ATOM 0 HB2 ALA A 597 25.740 -10.195 -5.658 1.00 0.00 H new ATOM 0 HB3 ALA A 597 25.601 -11.165 -7.144 1.00 0.00 H new ATOM 337 N ASN A 598 25.516 -9.847 -9.751 1.00 0.00 N ATOM 338 CA ASN A 598 25.926 -10.019 -11.140 1.00 0.00 C ATOM 339 C ASN A 598 25.057 -9.190 -12.077 1.00 0.00 C ATOM 340 O ASN A 598 25.075 -9.388 -13.292 1.00 0.00 O ATOM 341 CB ASN A 598 25.896 -11.479 -11.550 1.00 0.00 C ATOM 342 CG ASN A 598 26.913 -12.329 -10.840 1.00 0.00 C ATOM 343 OD1 ASN A 598 28.125 -12.147 -11.001 1.00 0.00 O ATOM 344 ND2 ASN A 598 26.427 -13.307 -10.118 1.00 0.00 N ATOM 0 H ASN A 598 24.648 -10.324 -9.506 1.00 0.00 H new ATOM 0 HA ASN A 598 26.954 -9.665 -11.219 1.00 0.00 H new ATOM 0 HB2 ASN A 598 24.901 -11.881 -11.356 1.00 0.00 H new ATOM 0 HB3 ASN A 598 26.064 -11.549 -12.625 1.00 0.00 H new ATOM 0 HD21 ASN A 598 27.058 -13.963 -9.657 1.00 0.00 H new ATOM 0 HD22 ASN A 598 25.418 -13.413 -10.017 1.00 0.00 H new ATOM 351 N ALA A 599 24.298 -8.262 -11.506 1.00 0.00 N ATOM 352 CA ALA A 599 23.415 -7.406 -12.289 1.00 0.00 C ATOM 353 C ALA A 599 24.185 -6.256 -12.926 1.00 0.00 C ATOM 354 O ALA A 599 25.150 -5.750 -12.353 1.00 0.00 O ATOM 355 CB ALA A 599 22.285 -6.874 -11.420 1.00 0.00 C ATOM 0 H ALA A 599 24.276 -8.083 -10.502 1.00 0.00 H new ATOM 0 HA ALA A 599 22.987 -8.007 -13.091 1.00 0.00 H new ATOM 0 HB1 ALA A 599 21.634 -6.237 -12.019 1.00 0.00 H new ATOM 0 HB2 ALA A 599 21.708 -7.709 -11.022 1.00 0.00 H new ATOM 0 HB3 ALA A 599 22.702 -6.295 -10.596 1.00 0.00 H new ATOM 361 N ASP A 600 23.752 -5.848 -14.114 1.00 0.00 N ATOM 362 CA ASP A 600 24.380 -4.734 -14.816 1.00 0.00 C ATOM 363 C ASP A 600 24.249 -3.440 -14.024 1.00 0.00 C ATOM 364 O ASP A 600 23.179 -3.124 -13.504 1.00 0.00 O ATOM 365 CB ASP A 600 23.765 -4.563 -16.208 1.00 0.00 C ATOM 366 CG ASP A 600 24.548 -3.641 -17.132 1.00 0.00 C ATOM 367 OD1 ASP A 600 24.553 -2.456 -16.892 1.00 0.00 O ATOM 368 OD2 ASP A 600 25.259 -4.138 -17.973 1.00 0.00 O ATOM 0 H ASP A 600 22.969 -6.272 -14.611 1.00 0.00 H new ATOM 0 HA ASP A 600 25.440 -4.962 -14.923 1.00 0.00 H new ATOM 0 HB2 ASP A 600 23.681 -5.543 -16.678 1.00 0.00 H new ATOM 0 HB3 ASP A 600 22.752 -4.174 -16.099 1.00 0.00 H new ATOM 373 N PRO A 601 25.345 -2.693 -13.936 1.00 0.00 N ATOM 374 CA PRO A 601 25.358 -1.436 -13.197 1.00 0.00 C ATOM 375 C PRO A 601 24.181 -0.553 -13.592 1.00 0.00 C ATOM 376 O PRO A 601 23.578 0.108 -12.747 1.00 0.00 O ATOM 377 CB PRO A 601 26.703 -0.801 -13.563 1.00 0.00 C ATOM 378 CG PRO A 601 27.618 -1.960 -13.766 1.00 0.00 C ATOM 379 CD PRO A 601 26.784 -3.013 -14.446 1.00 0.00 C ATOM 0 HA PRO A 601 25.255 -1.577 -12.121 1.00 0.00 H new ATOM 0 HB2 PRO A 601 26.624 -0.195 -14.465 1.00 0.00 H new ATOM 0 HB3 PRO A 601 27.062 -0.146 -12.769 1.00 0.00 H new ATOM 0 HG2 PRO A 601 28.475 -1.681 -14.379 1.00 0.00 H new ATOM 0 HG3 PRO A 601 28.010 -2.322 -12.816 1.00 0.00 H new ATOM 0 HD2 PRO A 601 26.853 -2.946 -15.532 1.00 0.00 H new ATOM 0 HD3 PRO A 601 27.097 -4.019 -14.169 1.00 0.00 H new ATOM 387 N ASN A 602 23.858 -0.547 -14.881 1.00 0.00 N ATOM 388 CA ASN A 602 22.765 0.271 -15.393 1.00 0.00 C ATOM 389 C ASN A 602 21.413 -0.290 -14.971 1.00 0.00 C ATOM 390 O ASN A 602 20.518 0.456 -14.573 1.00 0.00 O ATOM 391 CB ASN A 602 22.831 0.402 -16.904 1.00 0.00 C ATOM 392 CG ASN A 602 23.951 1.280 -17.387 1.00 0.00 C ATOM 393 OD1 ASN A 602 24.474 2.119 -16.645 1.00 0.00 O ATOM 394 ND2 ASN A 602 24.266 1.148 -18.651 1.00 0.00 N ATOM 0 H ASN A 602 24.338 -1.100 -15.591 1.00 0.00 H new ATOM 0 HA ASN A 602 22.876 1.265 -14.960 1.00 0.00 H new ATOM 0 HB2 ASN A 602 22.945 -0.590 -17.341 1.00 0.00 H new ATOM 0 HB3 ASN A 602 21.885 0.803 -17.267 1.00 0.00 H new ATOM 0 HD21 ASN A 602 24.973 1.754 -19.066 1.00 0.00 H new ATOM 0 HD22 ASN A 602 23.804 0.439 -19.220 1.00 0.00 H new ATOM 401 N PHE A 603 21.271 -1.608 -15.060 1.00 0.00 N ATOM 402 CA PHE A 603 20.078 -2.285 -14.566 1.00 0.00 C ATOM 403 C PHE A 603 19.781 -1.896 -13.124 1.00 0.00 C ATOM 404 O PHE A 603 18.658 -1.516 -12.792 1.00 0.00 O ATOM 405 CB PHE A 603 20.239 -3.802 -14.680 1.00 0.00 C ATOM 406 CG PHE A 603 19.092 -4.578 -14.098 1.00 0.00 C ATOM 407 CD1 PHE A 603 17.977 -4.877 -14.866 1.00 0.00 C ATOM 408 CD2 PHE A 603 19.126 -5.011 -12.781 1.00 0.00 C ATOM 409 CE1 PHE A 603 16.921 -5.591 -14.330 1.00 0.00 C ATOM 410 CE2 PHE A 603 18.074 -5.726 -12.244 1.00 0.00 C ATOM 411 CZ PHE A 603 16.969 -6.016 -13.020 1.00 0.00 C ATOM 0 H PHE A 603 21.968 -2.229 -15.470 1.00 0.00 H new ATOM 0 HA PHE A 603 19.236 -1.971 -15.183 1.00 0.00 H new ATOM 0 HB2 PHE A 603 20.350 -4.068 -15.731 1.00 0.00 H new ATOM 0 HB3 PHE A 603 21.159 -4.099 -14.177 1.00 0.00 H new ATOM 0 HD1 PHE A 603 17.933 -4.549 -15.894 1.00 0.00 H new ATOM 0 HD2 PHE A 603 19.986 -4.786 -12.168 1.00 0.00 H new ATOM 0 HE1 PHE A 603 16.058 -5.816 -14.939 1.00 0.00 H new ATOM 0 HE2 PHE A 603 18.115 -6.058 -11.217 1.00 0.00 H new ATOM 0 HZ PHE A 603 16.145 -6.574 -12.601 1.00 0.00 H new ATOM 421 N VAL A 604 20.794 -1.994 -12.269 1.00 0.00 N ATOM 422 CA VAL A 604 20.639 -1.668 -10.857 1.00 0.00 C ATOM 423 C VAL A 604 20.267 -0.203 -10.667 1.00 0.00 C ATOM 424 O VAL A 604 19.302 0.117 -9.973 1.00 0.00 O ATOM 425 CB VAL A 604 21.925 -1.968 -10.063 1.00 0.00 C ATOM 426 CG1 VAL A 604 21.795 -1.470 -8.631 1.00 0.00 C ATOM 427 CG2 VAL A 604 22.227 -3.459 -10.082 1.00 0.00 C ATOM 0 H VAL A 604 21.732 -2.297 -12.531 1.00 0.00 H new ATOM 0 HA VAL A 604 19.833 -2.296 -10.477 1.00 0.00 H new ATOM 0 HB VAL A 604 22.753 -1.442 -10.538 1.00 0.00 H new ATOM 0 HG11 VAL A 604 22.712 -1.690 -8.085 1.00 0.00 H new ATOM 0 HG12 VAL A 604 21.624 -0.394 -8.634 1.00 0.00 H new ATOM 0 HG13 VAL A 604 20.956 -1.969 -8.147 1.00 0.00 H new ATOM 0 HG21 VAL A 604 23.138 -3.653 -9.517 1.00 0.00 H new ATOM 0 HG22 VAL A 604 21.398 -4.004 -9.631 1.00 0.00 H new ATOM 0 HG23 VAL A 604 22.362 -3.790 -11.112 1.00 0.00 H new ATOM 437 N THR A 605 21.039 0.683 -11.287 1.00 0.00 N ATOM 438 CA THR A 605 20.803 2.117 -11.171 1.00 0.00 C ATOM 439 C THR A 605 19.346 2.461 -11.454 1.00 0.00 C ATOM 440 O THR A 605 18.746 3.281 -10.760 1.00 0.00 O ATOM 441 CB THR A 605 21.704 2.917 -12.131 1.00 0.00 C ATOM 442 OG1 THR A 605 23.079 2.705 -11.787 1.00 0.00 O ATOM 443 CG2 THR A 605 21.387 4.402 -12.047 1.00 0.00 C ATOM 0 H THR A 605 21.834 0.433 -11.875 1.00 0.00 H new ATOM 0 HA THR A 605 21.045 2.393 -10.145 1.00 0.00 H new ATOM 0 HB THR A 605 21.520 2.574 -13.149 1.00 0.00 H new ATOM 0 HG1 THR A 605 23.352 1.806 -12.067 1.00 0.00 H new ATOM 0 HG21 THR A 605 22.033 4.951 -12.732 1.00 0.00 H new ATOM 0 HG22 THR A 605 20.345 4.568 -12.320 1.00 0.00 H new ATOM 0 HG23 THR A 605 21.556 4.753 -11.029 1.00 0.00 H new ATOM 451 N SER A 606 18.783 1.829 -12.478 1.00 0.00 N ATOM 452 CA SER A 606 17.379 2.025 -12.821 1.00 0.00 C ATOM 453 C SER A 606 16.465 1.516 -11.714 1.00 0.00 C ATOM 454 O SER A 606 15.524 2.199 -11.309 1.00 0.00 O ATOM 455 CB SER A 606 17.059 1.331 -14.130 1.00 0.00 C ATOM 456 OG SER A 606 15.720 1.502 -14.504 1.00 0.00 O ATOM 0 H SER A 606 19.278 1.176 -13.086 1.00 0.00 H new ATOM 0 HA SER A 606 17.204 3.095 -12.935 1.00 0.00 H new ATOM 0 HB2 SER A 606 17.707 1.722 -14.915 1.00 0.00 H new ATOM 0 HB3 SER A 606 17.276 0.267 -14.038 1.00 0.00 H new ATOM 0 HG SER A 606 15.630 1.365 -15.470 1.00 0.00 H new ATOM 462 N MET A 607 16.748 0.313 -11.226 1.00 0.00 N ATOM 463 CA MET A 607 15.948 -0.293 -10.168 1.00 0.00 C ATOM 464 C MET A 607 15.986 0.548 -8.899 1.00 0.00 C ATOM 465 O MET A 607 15.040 0.544 -8.111 1.00 0.00 O ATOM 466 CB MET A 607 16.441 -1.709 -9.879 1.00 0.00 C ATOM 467 CG MET A 607 16.207 -2.701 -11.011 1.00 0.00 C ATOM 468 SD MET A 607 14.467 -2.843 -11.462 1.00 0.00 S ATOM 469 CE MET A 607 13.788 -3.561 -9.969 1.00 0.00 C ATOM 0 H MET A 607 17.527 -0.262 -11.547 1.00 0.00 H new ATOM 0 HA MET A 607 14.914 -0.340 -10.511 1.00 0.00 H new ATOM 0 HB2 MET A 607 17.508 -1.671 -9.660 1.00 0.00 H new ATOM 0 HB3 MET A 607 15.944 -2.077 -8.981 1.00 0.00 H new ATOM 0 HG2 MET A 607 16.781 -2.391 -11.885 1.00 0.00 H new ATOM 0 HG3 MET A 607 16.582 -3.680 -10.714 1.00 0.00 H new ATOM 0 HE1 MET A 607 12.799 -3.969 -10.179 1.00 0.00 H new ATOM 0 HE2 MET A 607 14.443 -4.358 -9.618 1.00 0.00 H new ATOM 0 HE3 MET A 607 13.708 -2.793 -9.200 1.00 0.00 H new ATOM 479 N LEU A 608 17.085 1.269 -8.706 1.00 0.00 N ATOM 480 CA LEU A 608 17.275 2.070 -7.502 1.00 0.00 C ATOM 481 C LEU A 608 16.331 3.266 -7.483 1.00 0.00 C ATOM 482 O LEU A 608 16.158 3.915 -6.452 1.00 0.00 O ATOM 483 CB LEU A 608 18.732 2.538 -7.401 1.00 0.00 C ATOM 484 CG LEU A 608 19.753 1.433 -7.104 1.00 0.00 C ATOM 485 CD1 LEU A 608 21.162 2.012 -7.098 1.00 0.00 C ATOM 486 CD2 LEU A 608 19.429 0.787 -5.766 1.00 0.00 C ATOM 0 H LEU A 608 17.859 1.315 -9.369 1.00 0.00 H new ATOM 0 HA LEU A 608 17.044 1.445 -6.639 1.00 0.00 H new ATOM 0 HB2 LEU A 608 19.007 3.023 -8.338 1.00 0.00 H new ATOM 0 HB3 LEU A 608 18.801 3.294 -6.619 1.00 0.00 H new ATOM 0 HG LEU A 608 19.701 0.671 -7.882 1.00 0.00 H new ATOM 0 HD11 LEU A 608 21.880 1.220 -6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 608 21.380 2.448 -8.073 1.00 0.00 H new ATOM 0 HD13 LEU A 608 21.235 2.783 -6.331 1.00 0.00 H new ATOM 0 HD21 LEU A 608 20.155 0.002 -5.556 1.00 0.00 H new ATOM 0 HD22 LEU A 608 19.471 1.540 -4.979 1.00 0.00 H new ATOM 0 HD23 LEU A 608 18.429 0.356 -5.803 1.00 0.00 H new ATOM 498 N THR A 609 15.724 3.553 -8.629 1.00 0.00 N ATOM 499 CA THR A 609 14.727 4.613 -8.724 1.00 0.00 C ATOM 500 C THR A 609 13.318 4.040 -8.791 1.00 0.00 C ATOM 501 O THR A 609 12.346 4.776 -8.964 1.00 0.00 O ATOM 502 CB THR A 609 14.967 5.505 -9.957 1.00 0.00 C ATOM 503 OG1 THR A 609 14.863 4.715 -11.149 1.00 0.00 O ATOM 504 CG2 THR A 609 16.346 6.142 -9.894 1.00 0.00 C ATOM 0 H THR A 609 15.905 3.066 -9.507 1.00 0.00 H new ATOM 0 HA THR A 609 14.826 5.219 -7.823 1.00 0.00 H new ATOM 0 HB THR A 609 14.214 6.293 -9.969 1.00 0.00 H new ATOM 0 HG1 THR A 609 14.808 3.766 -10.909 1.00 0.00 H new ATOM 0 HG21 THR A 609 16.498 6.768 -10.773 1.00 0.00 H new ATOM 0 HG22 THR A 609 16.424 6.753 -8.995 1.00 0.00 H new ATOM 0 HG23 THR A 609 17.106 5.362 -9.869 1.00 0.00 H new ATOM 512 N LYS A 610 13.213 2.723 -8.653 1.00 0.00 N ATOM 513 CA LYS A 610 11.917 2.053 -8.653 1.00 0.00 C ATOM 514 C LYS A 610 11.504 1.653 -7.243 1.00 0.00 C ATOM 515 O LYS A 610 10.407 1.138 -7.030 1.00 0.00 O ATOM 516 CB LYS A 610 11.951 0.822 -9.560 1.00 0.00 C ATOM 517 CG LYS A 610 12.302 1.120 -11.012 1.00 0.00 C ATOM 518 CD LYS A 610 11.240 1.986 -11.672 1.00 0.00 C ATOM 519 CE LYS A 610 11.557 2.231 -13.140 1.00 0.00 C ATOM 520 NZ LYS A 610 10.604 3.189 -13.763 1.00 0.00 N ATOM 0 H LYS A 610 14.010 2.097 -8.540 1.00 0.00 H new ATOM 0 HA LYS A 610 11.178 2.756 -9.038 1.00 0.00 H new ATOM 0 HB2 LYS A 610 12.676 0.112 -9.162 1.00 0.00 H new ATOM 0 HB3 LYS A 610 10.977 0.334 -9.527 1.00 0.00 H new ATOM 0 HG2 LYS A 610 13.267 1.625 -11.059 1.00 0.00 H new ATOM 0 HG3 LYS A 610 12.405 0.185 -11.562 1.00 0.00 H new ATOM 0 HD2 LYS A 610 10.267 1.502 -11.584 1.00 0.00 H new ATOM 0 HD3 LYS A 610 11.170 2.940 -11.149 1.00 0.00 H new ATOM 0 HE2 LYS A 610 12.572 2.617 -13.232 1.00 0.00 H new ATOM 0 HE3 LYS A 610 11.526 1.285 -13.681 1.00 0.00 H new ATOM 0 HZ1 LYS A 610 10.855 3.328 -14.763 1.00 0.00 H new ATOM 0 HZ2 LYS A 610 9.638 2.809 -13.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 610 10.652 4.100 -13.264 1.00 0.00 H new ATOM 534 N LEU A 611 12.389 1.894 -6.281 1.00 0.00 N ATOM 535 CA LEU A 611 12.159 1.472 -4.905 1.00 0.00 C ATOM 536 C LEU A 611 10.895 2.105 -4.338 1.00 0.00 C ATOM 537 O LEU A 611 10.697 3.316 -4.438 1.00 0.00 O ATOM 538 CB LEU A 611 13.370 1.826 -4.033 1.00 0.00 C ATOM 539 CG LEU A 611 14.733 1.435 -4.619 1.00 0.00 C ATOM 540 CD1 LEU A 611 15.844 1.790 -3.639 1.00 0.00 C ATOM 541 CD2 LEU A 611 14.745 -0.054 -4.932 1.00 0.00 C ATOM 0 H LEU A 611 13.273 2.380 -6.430 1.00 0.00 H new ATOM 0 HA LEU A 611 12.023 0.390 -4.901 1.00 0.00 H new ATOM 0 HB2 LEU A 611 13.365 2.901 -3.852 1.00 0.00 H new ATOM 0 HB3 LEU A 611 13.255 1.339 -3.065 1.00 0.00 H new ATOM 0 HG LEU A 611 14.903 1.988 -5.543 1.00 0.00 H new ATOM 0 HD11 LEU A 611 16.808 1.509 -4.064 1.00 0.00 H new ATOM 0 HD12 LEU A 611 15.831 2.863 -3.448 1.00 0.00 H new ATOM 0 HD13 LEU A 611 15.689 1.253 -2.703 1.00 0.00 H new ATOM 0 HD21 LEU A 611 15.714 -0.331 -5.348 1.00 0.00 H new ATOM 0 HD22 LEU A 611 14.568 -0.620 -4.017 1.00 0.00 H new ATOM 0 HD23 LEU A 611 13.961 -0.280 -5.655 1.00 0.00 H new ATOM 553 N ARG A 612 10.041 1.279 -3.743 1.00 0.00 N ATOM 554 CA ARG A 612 8.857 1.771 -3.049 1.00 0.00 C ATOM 555 C ARG A 612 8.991 1.599 -1.541 1.00 0.00 C ATOM 556 O ARG A 612 8.775 0.510 -1.009 1.00 0.00 O ATOM 557 CB ARG A 612 7.579 1.131 -3.571 1.00 0.00 C ATOM 558 CG ARG A 612 7.171 1.566 -4.969 1.00 0.00 C ATOM 559 CD ARG A 612 5.982 0.857 -5.509 1.00 0.00 C ATOM 560 NE ARG A 612 5.698 1.135 -6.907 1.00 0.00 N ATOM 561 CZ ARG A 612 4.966 2.177 -7.347 1.00 0.00 C ATOM 562 NH1 ARG A 612 4.411 3.019 -6.503 1.00 0.00 N ATOM 563 NH2 ARG A 612 4.799 2.317 -8.650 1.00 0.00 N ATOM 0 H ARG A 612 10.147 0.265 -3.728 1.00 0.00 H new ATOM 0 HA ARG A 612 8.783 2.838 -3.258 1.00 0.00 H new ATOM 0 HB2 ARG A 612 7.703 0.048 -3.565 1.00 0.00 H new ATOM 0 HB3 ARG A 612 6.766 1.362 -2.882 1.00 0.00 H new ATOM 0 HG2 ARG A 612 6.967 2.637 -4.958 1.00 0.00 H new ATOM 0 HG3 ARG A 612 8.011 1.408 -5.645 1.00 0.00 H new ATOM 0 HD2 ARG A 612 6.129 -0.216 -5.388 1.00 0.00 H new ATOM 0 HD3 ARG A 612 5.111 1.129 -4.913 1.00 0.00 H new ATOM 0 HE ARG A 612 6.080 0.496 -7.604 1.00 0.00 H new ATOM 0 HH11 ARG A 612 4.532 2.888 -5.499 1.00 0.00 H new ATOM 0 HH12 ARG A 612 3.860 3.803 -6.853 1.00 0.00 H new ATOM 0 HH21 ARG A 612 5.219 1.646 -9.293 1.00 0.00 H new ATOM 0 HH22 ARG A 612 4.250 3.096 -9.013 1.00 0.00 H new ATOM 577 N PHE A 613 9.349 2.680 -0.857 1.00 0.00 N ATOM 578 CA PHE A 613 9.708 2.610 0.554 1.00 0.00 C ATOM 579 C PHE A 613 8.467 2.581 1.437 1.00 0.00 C ATOM 580 O PHE A 613 7.416 3.100 1.064 1.00 0.00 O ATOM 581 CB PHE A 613 10.599 3.792 0.938 1.00 0.00 C ATOM 582 CG PHE A 613 12.032 3.633 0.516 1.00 0.00 C ATOM 583 CD1 PHE A 613 12.433 3.968 -0.769 1.00 0.00 C ATOM 584 CD2 PHE A 613 12.982 3.149 1.403 1.00 0.00 C ATOM 585 CE1 PHE A 613 13.751 3.822 -1.158 1.00 0.00 C ATOM 586 CE2 PHE A 613 14.301 3.003 1.016 1.00 0.00 C ATOM 587 CZ PHE A 613 14.685 3.340 -0.266 1.00 0.00 C ATOM 0 H PHE A 613 9.398 3.617 -1.258 1.00 0.00 H new ATOM 0 HA PHE A 613 10.260 1.684 0.713 1.00 0.00 H new ATOM 0 HB2 PHE A 613 10.196 4.700 0.489 1.00 0.00 H new ATOM 0 HB3 PHE A 613 10.561 3.928 2.019 1.00 0.00 H new ATOM 0 HD1 PHE A 613 11.707 4.347 -1.473 1.00 0.00 H new ATOM 0 HD2 PHE A 613 12.688 2.883 2.408 1.00 0.00 H new ATOM 0 HE1 PHE A 613 14.050 4.086 -2.162 1.00 0.00 H new ATOM 0 HE2 PHE A 613 15.031 2.625 1.717 1.00 0.00 H new ATOM 0 HZ PHE A 613 15.715 3.226 -0.570 1.00 0.00 H new ATOM 597 N GLU A 614 8.596 1.969 2.610 1.00 0.00 N ATOM 598 CA GLU A 614 7.514 1.950 3.587 1.00 0.00 C ATOM 599 C GLU A 614 8.034 1.613 4.978 1.00 0.00 C ATOM 600 O GLU A 614 8.822 0.682 5.148 1.00 0.00 O ATOM 601 CB GLU A 614 6.435 0.947 3.171 1.00 0.00 C ATOM 602 CG GLU A 614 5.191 0.962 4.049 1.00 0.00 C ATOM 603 CD GLU A 614 4.156 -0.004 3.544 1.00 0.00 C ATOM 604 OE1 GLU A 614 4.409 -0.657 2.561 1.00 0.00 O ATOM 605 OE2 GLU A 614 3.157 -0.171 4.204 1.00 0.00 O ATOM 0 H GLU A 614 9.440 1.479 2.907 1.00 0.00 H new ATOM 0 HA GLU A 614 7.076 2.948 3.620 1.00 0.00 H new ATOM 0 HB2 GLU A 614 6.141 1.154 2.142 1.00 0.00 H new ATOM 0 HB3 GLU A 614 6.863 -0.055 3.185 1.00 0.00 H new ATOM 0 HG2 GLU A 614 5.463 0.705 5.073 1.00 0.00 H new ATOM 0 HG3 GLU A 614 4.772 1.968 4.073 1.00 0.00 H new ATOM 612 N VAL A 615 7.589 2.375 5.971 1.00 0.00 N ATOM 613 CA VAL A 615 8.022 2.169 7.348 1.00 0.00 C ATOM 614 C VAL A 615 7.065 1.249 8.095 1.00 0.00 C ATOM 615 O VAL A 615 5.852 1.306 7.896 1.00 0.00 O ATOM 616 CB VAL A 615 8.135 3.503 8.110 1.00 0.00 C ATOM 617 CG1 VAL A 615 8.497 3.255 9.567 1.00 0.00 C ATOM 618 CG2 VAL A 615 9.168 4.406 7.453 1.00 0.00 C ATOM 0 H VAL A 615 6.928 3.142 5.848 1.00 0.00 H new ATOM 0 HA VAL A 615 9.006 1.703 7.301 1.00 0.00 H new ATOM 0 HB VAL A 615 7.167 4.003 8.074 1.00 0.00 H new ATOM 0 HG11 VAL A 615 8.573 4.208 10.090 1.00 0.00 H new ATOM 0 HG12 VAL A 615 7.725 2.644 10.035 1.00 0.00 H new ATOM 0 HG13 VAL A 615 9.453 2.735 9.621 1.00 0.00 H new ATOM 0 HG21 VAL A 615 9.235 5.344 8.004 1.00 0.00 H new ATOM 0 HG22 VAL A 615 10.140 3.912 7.459 1.00 0.00 H new ATOM 0 HG23 VAL A 615 8.871 4.610 6.424 1.00 0.00 H new ATOM 628 N PHE A 616 7.619 0.401 8.956 1.00 0.00 N ATOM 629 CA PHE A 616 6.823 -0.579 9.685 1.00 0.00 C ATOM 630 C PHE A 616 7.127 -0.537 11.176 1.00 0.00 C ATOM 631 O PHE A 616 8.267 -0.305 11.581 1.00 0.00 O ATOM 632 CB PHE A 616 7.074 -1.985 9.136 1.00 0.00 C ATOM 633 CG PHE A 616 6.598 -2.179 7.725 1.00 0.00 C ATOM 634 CD1 PHE A 616 5.307 -2.615 7.465 1.00 0.00 C ATOM 635 CD2 PHE A 616 7.440 -1.925 6.653 1.00 0.00 C ATOM 636 CE1 PHE A 616 4.868 -2.794 6.168 1.00 0.00 C ATOM 637 CE2 PHE A 616 7.004 -2.103 5.353 1.00 0.00 C ATOM 638 CZ PHE A 616 5.718 -2.538 5.111 1.00 0.00 C ATOM 0 H PHE A 616 8.617 0.373 9.166 1.00 0.00 H new ATOM 0 HA PHE A 616 5.772 -0.326 9.546 1.00 0.00 H new ATOM 0 HB2 PHE A 616 8.142 -2.197 9.182 1.00 0.00 H new ATOM 0 HB3 PHE A 616 6.577 -2.710 9.780 1.00 0.00 H new ATOM 0 HD1 PHE A 616 4.637 -2.817 8.287 1.00 0.00 H new ATOM 0 HD2 PHE A 616 8.448 -1.584 6.836 1.00 0.00 H new ATOM 0 HE1 PHE A 616 3.860 -3.134 5.981 1.00 0.00 H new ATOM 0 HE2 PHE A 616 7.670 -1.901 4.527 1.00 0.00 H new ATOM 0 HZ PHE A 616 5.376 -2.678 4.096 1.00 0.00 H new ATOM 648 N GLN A 617 6.102 -0.762 11.991 1.00 0.00 N ATOM 649 CA GLN A 617 6.276 -0.843 13.437 1.00 0.00 C ATOM 650 C GLN A 617 6.281 -2.290 13.911 1.00 0.00 C ATOM 651 O GLN A 617 5.842 -3.190 13.195 1.00 0.00 O ATOM 652 CB GLN A 617 5.167 -0.068 14.154 1.00 0.00 C ATOM 653 CG GLN A 617 5.155 1.421 13.854 1.00 0.00 C ATOM 654 CD GLN A 617 4.004 2.139 14.534 1.00 0.00 C ATOM 655 OE1 GLN A 617 3.247 1.539 15.303 1.00 0.00 O ATOM 656 NE2 GLN A 617 3.861 3.428 14.250 1.00 0.00 N ATOM 0 H GLN A 617 5.141 -0.892 11.675 1.00 0.00 H new ATOM 0 HA GLN A 617 7.240 -0.397 13.680 1.00 0.00 H new ATOM 0 HB2 GLN A 617 4.203 -0.492 13.873 1.00 0.00 H new ATOM 0 HB3 GLN A 617 5.276 -0.210 15.229 1.00 0.00 H new ATOM 0 HG2 GLN A 617 6.097 1.862 14.179 1.00 0.00 H new ATOM 0 HG3 GLN A 617 5.088 1.571 12.777 1.00 0.00 H new ATOM 0 HE21 GLN A 617 4.510 3.884 13.609 1.00 0.00 H new ATOM 0 HE22 GLN A 617 3.102 3.962 14.673 1.00 0.00 H new ATOM 665 N PRO A 618 6.780 -2.509 15.123 1.00 0.00 N ATOM 666 CA PRO A 618 6.792 -3.840 15.718 1.00 0.00 C ATOM 667 C PRO A 618 5.409 -4.477 15.670 1.00 0.00 C ATOM 668 O PRO A 618 4.427 -3.886 16.117 1.00 0.00 O ATOM 669 CB PRO A 618 7.268 -3.603 17.155 1.00 0.00 C ATOM 670 CG PRO A 618 8.134 -2.393 17.065 1.00 0.00 C ATOM 671 CD PRO A 618 7.460 -1.495 16.062 1.00 0.00 C ATOM 0 HA PRO A 618 7.440 -4.535 15.185 1.00 0.00 H new ATOM 0 HB2 PRO A 618 6.428 -3.441 17.830 1.00 0.00 H new ATOM 0 HB3 PRO A 618 7.822 -4.461 17.536 1.00 0.00 H new ATOM 0 HG2 PRO A 618 8.225 -1.902 18.034 1.00 0.00 H new ATOM 0 HG3 PRO A 618 9.142 -2.654 16.744 1.00 0.00 H new ATOM 0 HD2 PRO A 618 6.738 -0.828 16.533 1.00 0.00 H new ATOM 0 HD3 PRO A 618 8.176 -0.866 15.533 1.00 0.00 H new ATOM 679 N GLY A 619 5.340 -5.687 15.124 1.00 0.00 N ATOM 680 CA GLY A 619 4.091 -6.438 15.083 1.00 0.00 C ATOM 681 C GLY A 619 3.427 -6.329 13.716 1.00 0.00 C ATOM 682 O GLY A 619 2.587 -7.153 13.356 1.00 0.00 O ATOM 0 H GLY A 619 6.135 -6.168 14.704 1.00 0.00 H new ATOM 0 HA2 GLY A 619 4.286 -7.485 15.313 1.00 0.00 H new ATOM 0 HA3 GLY A 619 3.413 -6.064 15.850 1.00 0.00 H new ATOM 686 N ASP A 620 3.809 -5.306 12.959 1.00 0.00 N ATOM 687 CA ASP A 620 3.227 -5.067 11.644 1.00 0.00 C ATOM 688 C ASP A 620 3.615 -6.166 10.662 1.00 0.00 C ATOM 689 O ASP A 620 4.769 -6.591 10.616 1.00 0.00 O ATOM 690 CB ASP A 620 3.662 -3.703 11.104 1.00 0.00 C ATOM 691 CG ASP A 620 2.986 -2.516 11.778 1.00 0.00 C ATOM 692 OD1 ASP A 620 2.085 -2.731 12.552 1.00 0.00 O ATOM 693 OD2 ASP A 620 3.476 -1.421 11.636 1.00 0.00 O ATOM 0 H ASP A 620 4.520 -4.628 13.234 1.00 0.00 H new ATOM 0 HA ASP A 620 2.143 -5.074 11.754 1.00 0.00 H new ATOM 0 HB2 ASP A 620 4.741 -3.606 11.222 1.00 0.00 H new ATOM 0 HB3 ASP A 620 3.454 -3.666 10.035 1.00 0.00 H new ATOM 698 N TYR A 621 2.644 -6.622 9.879 1.00 0.00 N ATOM 699 CA TYR A 621 2.877 -7.687 8.910 1.00 0.00 C ATOM 700 C TYR A 621 3.241 -7.119 7.544 1.00 0.00 C ATOM 701 O TYR A 621 2.679 -6.114 7.109 1.00 0.00 O ATOM 702 CB TYR A 621 1.643 -8.585 8.794 1.00 0.00 C ATOM 703 CG TYR A 621 1.469 -9.541 9.953 1.00 0.00 C ATOM 704 CD1 TYR A 621 0.852 -9.133 11.127 1.00 0.00 C ATOM 705 CD2 TYR A 621 1.921 -10.849 9.869 1.00 0.00 C ATOM 706 CE1 TYR A 621 0.691 -10.003 12.189 1.00 0.00 C ATOM 707 CE2 TYR A 621 1.765 -11.727 10.924 1.00 0.00 C ATOM 708 CZ TYR A 621 1.149 -11.300 12.083 1.00 0.00 C ATOM 709 OH TYR A 621 0.991 -12.171 13.136 1.00 0.00 O ATOM 0 H TYR A 621 1.687 -6.270 9.896 1.00 0.00 H new ATOM 0 HA TYR A 621 3.717 -8.283 9.266 1.00 0.00 H new ATOM 0 HB2 TYR A 621 0.755 -7.957 8.717 1.00 0.00 H new ATOM 0 HB3 TYR A 621 1.709 -9.159 7.869 1.00 0.00 H new ATOM 0 HD1 TYR A 621 0.491 -8.119 11.212 1.00 0.00 H new ATOM 0 HD2 TYR A 621 2.403 -11.187 8.964 1.00 0.00 H new ATOM 0 HE1 TYR A 621 0.210 -9.669 13.096 1.00 0.00 H new ATOM 0 HE2 TYR A 621 2.123 -12.743 10.842 1.00 0.00 H new ATOM 0 HH TYR A 621 1.141 -13.089 12.827 1.00 0.00 H new ATOM 719 N ILE A 622 4.185 -7.769 6.871 1.00 0.00 N ATOM 720 CA ILE A 622 4.568 -7.379 5.520 1.00 0.00 C ATOM 721 C ILE A 622 4.064 -8.385 4.493 1.00 0.00 C ATOM 722 O ILE A 622 3.609 -8.008 3.412 1.00 0.00 O ATOM 723 CB ILE A 622 6.095 -7.242 5.383 1.00 0.00 C ATOM 724 CG1 ILE A 622 6.620 -6.157 6.328 1.00 0.00 C ATOM 725 CG2 ILE A 622 6.475 -6.928 3.944 1.00 0.00 C ATOM 726 CD1 ILE A 622 7.059 -6.682 7.676 1.00 0.00 C ATOM 0 H ILE A 622 4.699 -8.569 7.240 1.00 0.00 H new ATOM 0 HA ILE A 622 4.108 -6.409 5.331 1.00 0.00 H new ATOM 0 HB ILE A 622 6.554 -8.191 5.659 1.00 0.00 H new ATOM 0 HG12 ILE A 622 7.461 -5.651 5.854 1.00 0.00 H new ATOM 0 HG13 ILE A 622 5.841 -5.409 6.476 1.00 0.00 H new ATOM 0 HG21 ILE A 622 7.558 -6.835 3.866 1.00 0.00 H new ATOM 0 HG22 ILE A 622 6.132 -7.733 3.293 1.00 0.00 H new ATOM 0 HG23 ILE A 622 6.007 -5.992 3.640 1.00 0.00 H new ATOM 0 HD11 ILE A 622 7.418 -5.855 8.289 1.00 0.00 H new ATOM 0 HD12 ILE A 622 6.215 -7.162 8.172 1.00 0.00 H new ATOM 0 HD13 ILE A 622 7.861 -7.408 7.540 1.00 0.00 H new ATOM 738 N ILE A 623 4.147 -9.666 4.836 1.00 0.00 N ATOM 739 CA ILE A 623 3.649 -10.725 3.967 1.00 0.00 C ATOM 740 C ILE A 623 2.768 -11.700 4.736 1.00 0.00 C ATOM 741 O ILE A 623 3.057 -12.042 5.883 1.00 0.00 O ATOM 742 CB ILE A 623 4.802 -11.502 3.306 1.00 0.00 C ATOM 743 CG1 ILE A 623 5.600 -10.585 2.375 1.00 0.00 C ATOM 744 CG2 ILE A 623 4.266 -12.703 2.542 1.00 0.00 C ATOM 745 CD1 ILE A 623 6.750 -11.274 1.677 1.00 0.00 C ATOM 0 H ILE A 623 4.555 -9.996 5.711 1.00 0.00 H new ATOM 0 HA ILE A 623 3.057 -10.241 3.190 1.00 0.00 H new ATOM 0 HB ILE A 623 5.469 -11.863 4.089 1.00 0.00 H new ATOM 0 HG12 ILE A 623 4.927 -10.171 1.624 1.00 0.00 H new ATOM 0 HG13 ILE A 623 5.988 -9.746 2.952 1.00 0.00 H new ATOM 0 HG21 ILE A 623 5.095 -13.241 2.081 1.00 0.00 H new ATOM 0 HG22 ILE A 623 3.740 -13.366 3.229 1.00 0.00 H new ATOM 0 HG23 ILE A 623 3.578 -12.364 1.767 1.00 0.00 H new ATOM 0 HD11 ILE A 623 7.267 -10.560 1.036 1.00 0.00 H new ATOM 0 HD12 ILE A 623 7.446 -11.664 2.420 1.00 0.00 H new ATOM 0 HD13 ILE A 623 6.368 -12.096 1.071 1.00 0.00 H new ATOM 757 N ARG A 624 1.690 -12.146 4.099 1.00 0.00 N ATOM 758 CA ARG A 624 0.828 -13.171 4.675 1.00 0.00 C ATOM 759 C ARG A 624 0.731 -14.386 3.762 1.00 0.00 C ATOM 760 O ARG A 624 0.412 -14.263 2.580 1.00 0.00 O ATOM 761 CB ARG A 624 -0.549 -12.630 5.030 1.00 0.00 C ATOM 762 CG ARG A 624 -0.568 -11.637 6.182 1.00 0.00 C ATOM 763 CD ARG A 624 -1.913 -11.090 6.496 1.00 0.00 C ATOM 764 NE ARG A 624 -1.918 -10.048 7.510 1.00 0.00 N ATOM 765 CZ ARG A 624 -1.950 -10.273 8.838 1.00 0.00 C ATOM 766 NH1 ARG A 624 -2.018 -11.496 9.317 1.00 0.00 N ATOM 767 NH2 ARG A 624 -1.936 -9.229 9.649 1.00 0.00 N ATOM 0 H ARG A 624 1.393 -11.813 3.182 1.00 0.00 H new ATOM 0 HA ARG A 624 1.291 -13.491 5.609 1.00 0.00 H new ATOM 0 HB2 ARG A 624 -0.973 -12.150 4.148 1.00 0.00 H new ATOM 0 HB3 ARG A 624 -1.199 -13.468 5.281 1.00 0.00 H new ATOM 0 HG2 ARG A 624 -0.170 -12.124 7.072 1.00 0.00 H new ATOM 0 HG3 ARG A 624 0.101 -10.810 5.944 1.00 0.00 H new ATOM 0 HD2 ARG A 624 -2.352 -10.691 5.581 1.00 0.00 H new ATOM 0 HD3 ARG A 624 -2.555 -11.906 6.828 1.00 0.00 H new ATOM 0 HE ARG A 624 -1.896 -9.079 7.194 1.00 0.00 H new ATOM 0 HH11 ARG A 624 -2.047 -12.292 8.680 1.00 0.00 H new ATOM 0 HH12 ARG A 624 -2.041 -11.648 10.325 1.00 0.00 H new ATOM 0 HH21 ARG A 624 -1.902 -8.285 9.264 1.00 0.00 H new ATOM 0 HH22 ARG A 624 -1.959 -9.368 10.659 1.00 0.00 H new ATOM 781 N GLU A 625 1.009 -15.561 4.318 1.00 0.00 N ATOM 782 CA GLU A 625 0.952 -16.802 3.554 1.00 0.00 C ATOM 783 C GLU A 625 -0.434 -17.020 2.960 1.00 0.00 C ATOM 784 O GLU A 625 -1.445 -16.873 3.647 1.00 0.00 O ATOM 785 CB GLU A 625 1.339 -17.991 4.436 1.00 0.00 C ATOM 786 CG GLU A 625 1.499 -19.305 3.684 1.00 0.00 C ATOM 787 CD GLU A 625 1.975 -20.402 4.596 1.00 0.00 C ATOM 788 OE1 GLU A 625 2.991 -20.227 5.225 1.00 0.00 O ATOM 789 OE2 GLU A 625 1.265 -21.368 4.751 1.00 0.00 O ATOM 0 H GLU A 625 1.276 -15.680 5.295 1.00 0.00 H new ATOM 0 HA GLU A 625 1.665 -16.722 2.734 1.00 0.00 H new ATOM 0 HB2 GLU A 625 2.275 -17.761 4.945 1.00 0.00 H new ATOM 0 HB3 GLU A 625 0.580 -18.118 5.208 1.00 0.00 H new ATOM 0 HG2 GLU A 625 0.546 -19.589 3.237 1.00 0.00 H new ATOM 0 HG3 GLU A 625 2.209 -19.175 2.867 1.00 0.00 H new ATOM 796 N GLY A 626 -0.474 -17.371 1.679 1.00 0.00 N ATOM 797 CA GLY A 626 -1.736 -17.624 0.993 1.00 0.00 C ATOM 798 C GLY A 626 -2.178 -16.408 0.189 1.00 0.00 C ATOM 799 O GLY A 626 -2.969 -16.525 -0.747 1.00 0.00 O ATOM 0 H GLY A 626 0.354 -17.487 1.094 1.00 0.00 H new ATOM 0 HA2 GLY A 626 -1.627 -18.482 0.330 1.00 0.00 H new ATOM 0 HA3 GLY A 626 -2.505 -17.880 1.722 1.00 0.00 H new ATOM 803 N THR A 627 -1.662 -15.241 0.558 1.00 0.00 N ATOM 804 CA THR A 627 -2.008 -14.000 -0.124 1.00 0.00 C ATOM 805 C THR A 627 -1.306 -13.897 -1.472 1.00 0.00 C ATOM 806 O THR A 627 -0.135 -14.254 -1.601 1.00 0.00 O ATOM 807 CB THR A 627 -1.648 -12.767 0.727 1.00 0.00 C ATOM 808 OG1 THR A 627 -2.374 -12.807 1.962 1.00 0.00 O ATOM 809 CG2 THR A 627 -1.991 -11.486 -0.018 1.00 0.00 C ATOM 0 H THR A 627 -1.001 -15.129 1.327 1.00 0.00 H new ATOM 0 HA THR A 627 -3.087 -14.019 -0.281 1.00 0.00 H new ATOM 0 HB THR A 627 -0.577 -12.783 0.927 1.00 0.00 H new ATOM 0 HG1 THR A 627 -2.269 -11.953 2.431 1.00 0.00 H new ATOM 0 HG21 THR A 627 -1.730 -10.626 0.598 1.00 0.00 H new ATOM 0 HG22 THR A 627 -1.430 -11.447 -0.952 1.00 0.00 H new ATOM 0 HG23 THR A 627 -3.059 -11.466 -0.235 1.00 0.00 H new ATOM 817 N ILE A 628 -2.028 -13.406 -2.473 1.00 0.00 N ATOM 818 CA ILE A 628 -1.475 -13.256 -3.814 1.00 0.00 C ATOM 819 C ILE A 628 -0.654 -11.978 -3.932 1.00 0.00 C ATOM 820 O ILE A 628 -1.142 -10.886 -3.641 1.00 0.00 O ATOM 821 CB ILE A 628 -2.583 -13.244 -4.884 1.00 0.00 C ATOM 822 CG1 ILE A 628 -3.341 -14.574 -4.882 1.00 0.00 C ATOM 823 CG2 ILE A 628 -1.993 -12.965 -6.257 1.00 0.00 C ATOM 824 CD1 ILE A 628 -4.591 -14.565 -5.732 1.00 0.00 C ATOM 0 H ILE A 628 -2.998 -13.105 -2.381 1.00 0.00 H new ATOM 0 HA ILE A 628 -0.828 -14.116 -3.985 1.00 0.00 H new ATOM 0 HB ILE A 628 -3.287 -12.447 -4.646 1.00 0.00 H new ATOM 0 HG12 ILE A 628 -2.676 -15.361 -5.238 1.00 0.00 H new ATOM 0 HG13 ILE A 628 -3.612 -14.826 -3.857 1.00 0.00 H new ATOM 0 HG21 ILE A 628 -2.789 -12.960 -7.001 1.00 0.00 H new ATOM 0 HG22 ILE A 628 -1.497 -11.994 -6.250 1.00 0.00 H new ATOM 0 HG23 ILE A 628 -1.269 -13.740 -6.506 1.00 0.00 H new ATOM 0 HD11 ILE A 628 -5.073 -15.541 -5.680 1.00 0.00 H new ATOM 0 HD12 ILE A 628 -5.276 -13.802 -5.363 1.00 0.00 H new ATOM 0 HD13 ILE A 628 -4.326 -14.345 -6.766 1.00 0.00 H new ATOM 836 N GLY A 629 0.595 -12.121 -4.361 1.00 0.00 N ATOM 837 CA GLY A 629 1.481 -10.977 -4.535 1.00 0.00 C ATOM 838 C GLY A 629 2.837 -11.407 -5.080 1.00 0.00 C ATOM 839 O GLY A 629 3.406 -12.405 -4.637 1.00 0.00 O ATOM 0 H GLY A 629 1.017 -13.020 -4.595 1.00 0.00 H new ATOM 0 HA2 GLY A 629 1.023 -10.260 -5.216 1.00 0.00 H new ATOM 0 HA3 GLY A 629 1.615 -10.469 -3.580 1.00 0.00 H new ATOM 843 N LYS A 630 3.349 -10.650 -6.044 1.00 0.00 N ATOM 844 CA LYS A 630 4.636 -10.956 -6.656 1.00 0.00 C ATOM 845 C LYS A 630 5.625 -9.814 -6.461 1.00 0.00 C ATOM 846 O LYS A 630 6.278 -9.376 -7.408 1.00 0.00 O ATOM 847 CB LYS A 630 4.463 -11.252 -8.147 1.00 0.00 C ATOM 848 CG LYS A 630 3.679 -12.522 -8.449 1.00 0.00 C ATOM 849 CD LYS A 630 3.649 -12.812 -9.942 1.00 0.00 C ATOM 850 CE LYS A 630 2.749 -13.997 -10.259 1.00 0.00 C ATOM 851 NZ LYS A 630 2.670 -14.261 -11.721 1.00 0.00 N ATOM 0 H LYS A 630 2.891 -9.819 -6.419 1.00 0.00 H new ATOM 0 HA LYS A 630 5.037 -11.842 -6.163 1.00 0.00 H new ATOM 0 HB2 LYS A 630 3.958 -10.408 -8.616 1.00 0.00 H new ATOM 0 HB3 LYS A 630 5.448 -11.330 -8.606 1.00 0.00 H new ATOM 0 HG2 LYS A 630 4.129 -13.363 -7.922 1.00 0.00 H new ATOM 0 HG3 LYS A 630 2.660 -12.420 -8.076 1.00 0.00 H new ATOM 0 HD2 LYS A 630 3.296 -11.931 -10.478 1.00 0.00 H new ATOM 0 HD3 LYS A 630 4.660 -13.016 -10.295 1.00 0.00 H new ATOM 0 HE2 LYS A 630 3.125 -14.884 -9.750 1.00 0.00 H new ATOM 0 HE3 LYS A 630 1.749 -13.807 -9.870 1.00 0.00 H new ATOM 0 HZ1 LYS A 630 2.047 -15.076 -11.893 1.00 0.00 H new ATOM 0 HZ2 LYS A 630 2.287 -13.424 -12.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 630 3.621 -14.468 -12.088 1.00 0.00 H new ATOM 865 N LYS A 631 5.731 -9.334 -5.226 1.00 0.00 N ATOM 866 CA LYS A 631 6.640 -8.241 -4.904 1.00 0.00 C ATOM 867 C LYS A 631 7.695 -8.680 -3.896 1.00 0.00 C ATOM 868 O LYS A 631 7.383 -9.340 -2.905 1.00 0.00 O ATOM 869 CB LYS A 631 5.863 -7.040 -4.362 1.00 0.00 C ATOM 870 CG LYS A 631 4.874 -6.434 -5.349 1.00 0.00 C ATOM 871 CD LYS A 631 4.171 -5.222 -4.755 1.00 0.00 C ATOM 872 CE LYS A 631 3.162 -4.633 -5.729 1.00 0.00 C ATOM 873 NZ LYS A 631 2.452 -3.459 -5.154 1.00 0.00 N ATOM 0 H LYS A 631 5.197 -9.686 -4.431 1.00 0.00 H new ATOM 0 HA LYS A 631 7.148 -7.949 -5.823 1.00 0.00 H new ATOM 0 HB2 LYS A 631 5.323 -7.346 -3.466 1.00 0.00 H new ATOM 0 HB3 LYS A 631 6.573 -6.270 -4.058 1.00 0.00 H new ATOM 0 HG2 LYS A 631 5.398 -6.143 -6.259 1.00 0.00 H new ATOM 0 HG3 LYS A 631 4.135 -7.183 -5.632 1.00 0.00 H new ATOM 0 HD2 LYS A 631 3.665 -5.509 -3.833 1.00 0.00 H new ATOM 0 HD3 LYS A 631 4.909 -4.465 -4.491 1.00 0.00 H new ATOM 0 HE2 LYS A 631 3.673 -4.335 -6.644 1.00 0.00 H new ATOM 0 HE3 LYS A 631 2.435 -5.397 -6.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 631 1.774 -3.088 -5.850 1.00 0.00 H new ATOM 0 HZ2 LYS A 631 1.943 -3.748 -4.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 631 3.142 -2.719 -4.915 1.00 0.00 H new ATOM 887 N MET A 632 8.944 -8.309 -4.156 1.00 0.00 N ATOM 888 CA MET A 632 10.031 -8.572 -3.220 1.00 0.00 C ATOM 889 C MET A 632 10.210 -7.415 -2.245 1.00 0.00 C ATOM 890 O MET A 632 10.004 -6.255 -2.599 1.00 0.00 O ATOM 891 CB MET A 632 11.331 -8.829 -3.980 1.00 0.00 C ATOM 892 CG MET A 632 11.337 -10.109 -4.803 1.00 0.00 C ATOM 893 SD MET A 632 12.913 -10.396 -5.632 1.00 0.00 S ATOM 894 CE MET A 632 13.995 -10.640 -4.227 1.00 0.00 C ATOM 0 H MET A 632 9.229 -7.825 -5.008 1.00 0.00 H new ATOM 0 HA MET A 632 9.774 -9.461 -2.644 1.00 0.00 H new ATOM 0 HB2 MET A 632 11.523 -7.985 -4.642 1.00 0.00 H new ATOM 0 HB3 MET A 632 12.153 -8.867 -3.266 1.00 0.00 H new ATOM 0 HG2 MET A 632 11.114 -10.955 -4.153 1.00 0.00 H new ATOM 0 HG3 MET A 632 10.543 -10.061 -5.548 1.00 0.00 H new ATOM 0 HE1 MET A 632 14.895 -11.166 -4.547 1.00 0.00 H new ATOM 0 HE2 MET A 632 14.270 -9.672 -3.807 1.00 0.00 H new ATOM 0 HE3 MET A 632 13.480 -11.231 -3.469 1.00 0.00 H new ATOM 904 N TYR A 633 10.596 -7.739 -1.016 1.00 0.00 N ATOM 905 CA TYR A 633 10.779 -6.730 0.020 1.00 0.00 C ATOM 906 C TYR A 633 12.216 -6.714 0.526 1.00 0.00 C ATOM 907 O TYR A 633 12.796 -7.762 0.808 1.00 0.00 O ATOM 908 CB TYR A 633 9.816 -6.976 1.184 1.00 0.00 C ATOM 909 CG TYR A 633 8.364 -6.725 0.842 1.00 0.00 C ATOM 910 CD1 TYR A 633 7.800 -5.470 1.013 1.00 0.00 C ATOM 911 CD2 TYR A 633 7.562 -7.744 0.350 1.00 0.00 C ATOM 912 CE1 TYR A 633 6.474 -5.235 0.703 1.00 0.00 C ATOM 913 CE2 TYR A 633 6.235 -7.521 0.035 1.00 0.00 C ATOM 914 CZ TYR A 633 5.695 -6.263 0.213 1.00 0.00 C ATOM 915 OH TYR A 633 4.374 -6.035 -0.097 1.00 0.00 O ATOM 0 H TYR A 633 10.788 -8.694 -0.713 1.00 0.00 H new ATOM 0 HA TYR A 633 10.561 -5.757 -0.421 1.00 0.00 H new ATOM 0 HB2 TYR A 633 9.926 -8.006 1.523 1.00 0.00 H new ATOM 0 HB3 TYR A 633 10.099 -6.334 2.018 1.00 0.00 H new ATOM 0 HD1 TYR A 633 8.407 -4.663 1.395 1.00 0.00 H new ATOM 0 HD2 TYR A 633 7.982 -8.729 0.211 1.00 0.00 H new ATOM 0 HE1 TYR A 633 6.050 -4.252 0.844 1.00 0.00 H new ATOM 0 HE2 TYR A 633 5.625 -8.325 -0.348 1.00 0.00 H new ATOM 0 HH TYR A 633 3.969 -6.863 -0.430 1.00 0.00 H new ATOM 925 N PHE A 634 12.786 -5.519 0.638 1.00 0.00 N ATOM 926 CA PHE A 634 14.172 -5.367 1.064 1.00 0.00 C ATOM 927 C PHE A 634 14.271 -4.512 2.321 1.00 0.00 C ATOM 928 O PHE A 634 13.634 -3.463 2.421 1.00 0.00 O ATOM 929 CB PHE A 634 15.012 -4.755 -0.058 1.00 0.00 C ATOM 930 CG PHE A 634 14.913 -5.494 -1.362 1.00 0.00 C ATOM 931 CD1 PHE A 634 13.813 -5.326 -2.189 1.00 0.00 C ATOM 932 CD2 PHE A 634 15.919 -6.360 -1.763 1.00 0.00 C ATOM 933 CE1 PHE A 634 13.721 -6.006 -3.389 1.00 0.00 C ATOM 934 CE2 PHE A 634 15.831 -7.040 -2.962 1.00 0.00 C ATOM 935 CZ PHE A 634 14.729 -6.862 -3.776 1.00 0.00 C ATOM 0 H PHE A 634 12.308 -4.640 0.439 1.00 0.00 H new ATOM 0 HA PHE A 634 14.561 -6.358 1.296 1.00 0.00 H new ATOM 0 HB2 PHE A 634 14.699 -3.722 -0.212 1.00 0.00 H new ATOM 0 HB3 PHE A 634 16.056 -4.728 0.255 1.00 0.00 H new ATOM 0 HD1 PHE A 634 13.019 -4.656 -1.892 1.00 0.00 H new ATOM 0 HD2 PHE A 634 16.782 -6.505 -1.130 1.00 0.00 H new ATOM 0 HE1 PHE A 634 12.858 -5.866 -4.024 1.00 0.00 H new ATOM 0 HE2 PHE A 634 16.623 -7.710 -3.263 1.00 0.00 H new ATOM 0 HZ PHE A 634 14.658 -7.393 -4.714 1.00 0.00 H new ATOM 945 N ILE A 635 15.074 -4.965 3.277 1.00 0.00 N ATOM 946 CA ILE A 635 15.156 -4.316 4.580 1.00 0.00 C ATOM 947 C ILE A 635 16.197 -3.204 4.578 1.00 0.00 C ATOM 948 O ILE A 635 17.394 -3.462 4.450 1.00 0.00 O ATOM 949 CB ILE A 635 15.497 -5.324 5.693 1.00 0.00 C ATOM 950 CG1 ILE A 635 14.428 -6.416 5.770 1.00 0.00 C ATOM 951 CG2 ILE A 635 15.634 -4.613 7.030 1.00 0.00 C ATOM 952 CD1 ILE A 635 14.801 -7.574 6.667 1.00 0.00 C ATOM 0 H ILE A 635 15.678 -5.780 3.174 1.00 0.00 H new ATOM 0 HA ILE A 635 14.174 -3.888 4.779 1.00 0.00 H new ATOM 0 HB ILE A 635 16.451 -5.794 5.455 1.00 0.00 H new ATOM 0 HG12 ILE A 635 13.498 -5.976 6.129 1.00 0.00 H new ATOM 0 HG13 ILE A 635 14.235 -6.794 4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 635 15.875 -5.340 7.806 1.00 0.00 H new ATOM 0 HG22 ILE A 635 16.430 -3.871 6.968 1.00 0.00 H new ATOM 0 HG23 ILE A 635 14.695 -4.117 7.276 1.00 0.00 H new ATOM 0 HD11 ILE A 635 13.994 -8.307 6.670 1.00 0.00 H new ATOM 0 HD12 ILE A 635 15.714 -8.041 6.297 1.00 0.00 H new ATOM 0 HD13 ILE A 635 14.965 -7.210 7.681 1.00 0.00 H new ATOM 964 N GLN A 636 15.734 -1.967 4.720 1.00 0.00 N ATOM 965 CA GLN A 636 16.630 -0.820 4.813 1.00 0.00 C ATOM 966 C GLN A 636 17.281 -0.740 6.188 1.00 0.00 C ATOM 967 O GLN A 636 18.465 -0.424 6.307 1.00 0.00 O ATOM 968 CB GLN A 636 15.870 0.478 4.525 1.00 0.00 C ATOM 969 CG GLN A 636 16.736 1.726 4.556 1.00 0.00 C ATOM 970 CD GLN A 636 17.818 1.707 3.493 1.00 0.00 C ATOM 971 OE1 GLN A 636 17.565 1.354 2.337 1.00 0.00 O ATOM 972 NE2 GLN A 636 19.032 2.082 3.878 1.00 0.00 N ATOM 0 H GLN A 636 14.743 -1.733 4.773 1.00 0.00 H new ATOM 0 HA GLN A 636 17.414 -0.950 4.067 1.00 0.00 H new ATOM 0 HB2 GLN A 636 15.399 0.400 3.545 1.00 0.00 H new ATOM 0 HB3 GLN A 636 15.069 0.587 5.256 1.00 0.00 H new ATOM 0 HG2 GLN A 636 16.107 2.605 4.414 1.00 0.00 H new ATOM 0 HG3 GLN A 636 17.198 1.820 5.539 1.00 0.00 H new ATOM 0 HE21 GLN A 636 19.196 2.366 4.844 1.00 0.00 H new ATOM 0 HE22 GLN A 636 19.801 2.086 3.208 1.00 0.00 H new ATOM 981 N HIS A 637 16.501 -1.027 7.224 1.00 0.00 N ATOM 982 CA HIS A 637 17.038 -1.160 8.573 1.00 0.00 C ATOM 983 C HIS A 637 15.996 -1.728 9.527 1.00 0.00 C ATOM 984 O HIS A 637 14.797 -1.686 9.249 1.00 0.00 O ATOM 985 CB HIS A 637 17.540 0.192 9.092 1.00 0.00 C ATOM 986 CG HIS A 637 16.461 1.218 9.239 1.00 0.00 C ATOM 987 ND1 HIS A 637 15.647 1.287 10.350 1.00 0.00 N ATOM 988 CD2 HIS A 637 16.060 2.216 8.416 1.00 0.00 C ATOM 989 CE1 HIS A 637 14.792 2.285 10.204 1.00 0.00 C ATOM 990 NE2 HIS A 637 15.022 2.863 9.040 1.00 0.00 N ATOM 0 H HIS A 637 15.494 -1.172 7.155 1.00 0.00 H new ATOM 0 HA HIS A 637 17.877 -1.854 8.527 1.00 0.00 H new ATOM 0 HB2 HIS A 637 18.022 0.044 10.058 1.00 0.00 H new ATOM 0 HB3 HIS A 637 18.301 0.573 8.411 1.00 0.00 H new ATOM 0 HD2 HIS A 637 16.478 2.458 7.450 1.00 0.00 H new ATOM 0 HE1 HIS A 637 14.034 2.577 10.916 1.00 0.00 H new ATOM 0 HE2 HIS A 637 14.511 3.662 8.664 1.00 0.00 H new ATOM 998 N GLY A 638 16.459 -2.260 10.653 1.00 0.00 N ATOM 999 CA GLY A 638 15.568 -2.847 11.647 1.00 0.00 C ATOM 1000 C GLY A 638 15.560 -4.367 11.551 1.00 0.00 C ATOM 1001 O GLY A 638 16.287 -4.952 10.748 1.00 0.00 O ATOM 0 H GLY A 638 17.448 -2.297 10.900 1.00 0.00 H new ATOM 0 HA2 GLY A 638 15.884 -2.545 12.646 1.00 0.00 H new ATOM 0 HA3 GLY A 638 14.557 -2.466 11.503 1.00 0.00 H new ATOM 1005 N VAL A 639 14.735 -5.003 12.376 1.00 0.00 N ATOM 1006 CA VAL A 639 14.683 -6.459 12.436 1.00 0.00 C ATOM 1007 C VAL A 639 13.310 -6.978 12.027 1.00 0.00 C ATOM 1008 O VAL A 639 12.295 -6.603 12.613 1.00 0.00 O ATOM 1009 CB VAL A 639 15.018 -6.979 13.847 1.00 0.00 C ATOM 1010 CG1 VAL A 639 14.925 -8.497 13.891 1.00 0.00 C ATOM 1011 CG2 VAL A 639 16.406 -6.519 14.268 1.00 0.00 C ATOM 0 H VAL A 639 14.092 -4.532 13.013 1.00 0.00 H new ATOM 0 HA VAL A 639 15.432 -6.829 11.736 1.00 0.00 H new ATOM 0 HB VAL A 639 14.291 -6.568 14.547 1.00 0.00 H new ATOM 0 HG11 VAL A 639 15.165 -8.847 14.895 1.00 0.00 H new ATOM 0 HG12 VAL A 639 13.913 -8.807 13.630 1.00 0.00 H new ATOM 0 HG13 VAL A 639 15.630 -8.926 13.179 1.00 0.00 H new ATOM 0 HG21 VAL A 639 16.627 -6.895 15.267 1.00 0.00 H new ATOM 0 HG22 VAL A 639 17.145 -6.902 13.565 1.00 0.00 H new ATOM 0 HG23 VAL A 639 16.442 -5.430 14.274 1.00 0.00 H new ATOM 1021 N VAL A 640 13.287 -7.843 11.019 1.00 0.00 N ATOM 1022 CA VAL A 640 12.037 -8.403 10.519 1.00 0.00 C ATOM 1023 C VAL A 640 12.087 -9.925 10.493 1.00 0.00 C ATOM 1024 O VAL A 640 13.040 -10.516 9.984 1.00 0.00 O ATOM 1025 CB VAL A 640 11.711 -7.885 9.106 1.00 0.00 C ATOM 1026 CG1 VAL A 640 10.413 -8.496 8.601 1.00 0.00 C ATOM 1027 CG2 VAL A 640 11.621 -6.367 9.102 1.00 0.00 C ATOM 0 H VAL A 640 14.121 -8.172 10.532 1.00 0.00 H new ATOM 0 HA VAL A 640 11.252 -8.080 11.203 1.00 0.00 H new ATOM 0 HB VAL A 640 12.517 -8.184 8.436 1.00 0.00 H new ATOM 0 HG11 VAL A 640 10.198 -8.119 7.601 1.00 0.00 H new ATOM 0 HG12 VAL A 640 10.511 -9.581 8.566 1.00 0.00 H new ATOM 0 HG13 VAL A 640 9.598 -8.227 9.273 1.00 0.00 H new ATOM 0 HG21 VAL A 640 11.390 -6.019 8.095 1.00 0.00 H new ATOM 0 HG22 VAL A 640 10.835 -6.047 9.786 1.00 0.00 H new ATOM 0 HG23 VAL A 640 12.574 -5.945 9.422 1.00 0.00 H new ATOM 1037 N SER A 641 11.055 -10.556 11.044 1.00 0.00 N ATOM 1038 CA SER A 641 11.023 -12.008 11.169 1.00 0.00 C ATOM 1039 C SER A 641 10.315 -12.647 9.981 1.00 0.00 C ATOM 1040 O SER A 641 9.230 -12.219 9.588 1.00 0.00 O ATOM 1041 CB SER A 641 10.343 -12.405 12.465 1.00 0.00 C ATOM 1042 OG SER A 641 10.163 -13.791 12.561 1.00 0.00 O ATOM 0 H SER A 641 10.229 -10.083 11.411 1.00 0.00 H new ATOM 0 HA SER A 641 12.051 -12.371 11.182 1.00 0.00 H new ATOM 0 HB2 SER A 641 10.940 -12.058 13.308 1.00 0.00 H new ATOM 0 HB3 SER A 641 9.375 -11.908 12.533 1.00 0.00 H new ATOM 0 HG SER A 641 9.896 -14.024 13.475 1.00 0.00 H new ATOM 1048 N VAL A 642 10.937 -13.674 9.412 1.00 0.00 N ATOM 1049 CA VAL A 642 10.362 -14.382 8.274 1.00 0.00 C ATOM 1050 C VAL A 642 10.093 -15.843 8.613 1.00 0.00 C ATOM 1051 O VAL A 642 11.002 -16.578 8.998 1.00 0.00 O ATOM 1052 CB VAL A 642 11.283 -14.313 7.041 1.00 0.00 C ATOM 1053 CG1 VAL A 642 10.694 -15.116 5.891 1.00 0.00 C ATOM 1054 CG2 VAL A 642 11.504 -12.868 6.622 1.00 0.00 C ATOM 0 H VAL A 642 11.840 -14.035 9.720 1.00 0.00 H new ATOM 0 HA VAL A 642 9.420 -13.887 8.040 1.00 0.00 H new ATOM 0 HB VAL A 642 12.247 -14.747 7.306 1.00 0.00 H new ATOM 0 HG11 VAL A 642 11.357 -15.056 5.028 1.00 0.00 H new ATOM 0 HG12 VAL A 642 10.584 -16.158 6.193 1.00 0.00 H new ATOM 0 HG13 VAL A 642 9.718 -14.710 5.627 1.00 0.00 H new ATOM 0 HG21 VAL A 642 12.157 -12.838 5.750 1.00 0.00 H new ATOM 0 HG22 VAL A 642 10.546 -12.410 6.374 1.00 0.00 H new ATOM 0 HG23 VAL A 642 11.968 -12.318 7.441 1.00 0.00 H new ATOM 1064 N LEU A 643 8.839 -16.258 8.467 1.00 0.00 N ATOM 1065 CA LEU A 643 8.456 -17.642 8.718 1.00 0.00 C ATOM 1066 C LEU A 643 7.979 -18.322 7.441 1.00 0.00 C ATOM 1067 O LEU A 643 6.933 -17.973 6.894 1.00 0.00 O ATOM 1068 CB LEU A 643 7.365 -17.703 9.794 1.00 0.00 C ATOM 1069 CG LEU A 643 6.813 -19.104 10.087 1.00 0.00 C ATOM 1070 CD1 LEU A 643 7.924 -20.004 10.609 1.00 0.00 C ATOM 1071 CD2 LEU A 643 5.680 -19.004 11.097 1.00 0.00 C ATOM 0 H LEU A 643 8.070 -15.654 8.176 1.00 0.00 H new ATOM 0 HA LEU A 643 9.336 -18.177 9.075 1.00 0.00 H new ATOM 0 HB2 LEU A 643 7.766 -17.287 10.719 1.00 0.00 H new ATOM 0 HB3 LEU A 643 6.539 -17.061 9.488 1.00 0.00 H new ATOM 0 HG LEU A 643 6.424 -19.541 9.167 1.00 0.00 H new ATOM 0 HD11 LEU A 643 7.522 -20.996 10.814 1.00 0.00 H new ATOM 0 HD12 LEU A 643 8.713 -20.079 9.861 1.00 0.00 H new ATOM 0 HD13 LEU A 643 8.334 -19.582 11.527 1.00 0.00 H new ATOM 0 HD21 LEU A 643 5.289 -20.000 11.304 1.00 0.00 H new ATOM 0 HD22 LEU A 643 6.054 -18.561 12.020 1.00 0.00 H new ATOM 0 HD23 LEU A 643 4.885 -18.379 10.691 1.00 0.00 H new ATOM 1083 N THR A 644 8.752 -19.294 6.971 1.00 0.00 N ATOM 1084 CA THR A 644 8.459 -19.964 5.709 1.00 0.00 C ATOM 1085 C THR A 644 7.767 -21.301 5.944 1.00 0.00 C ATOM 1086 O THR A 644 8.118 -22.040 6.863 1.00 0.00 O ATOM 1087 CB THR A 644 9.737 -20.198 4.882 1.00 0.00 C ATOM 1088 OG1 THR A 644 10.359 -18.939 4.594 1.00 0.00 O ATOM 1089 CG2 THR A 644 9.406 -20.906 3.577 1.00 0.00 C ATOM 0 H THR A 644 9.588 -19.636 7.445 1.00 0.00 H new ATOM 0 HA THR A 644 7.793 -19.305 5.152 1.00 0.00 H new ATOM 0 HB THR A 644 10.417 -20.824 5.460 1.00 0.00 H new ATOM 0 HG1 THR A 644 11.173 -19.089 4.069 1.00 0.00 H new ATOM 0 HG21 THR A 644 10.321 -21.063 3.006 1.00 0.00 H new ATOM 0 HG22 THR A 644 8.943 -21.869 3.793 1.00 0.00 H new ATOM 0 HG23 THR A 644 8.716 -20.294 2.996 1.00 0.00 H new ATOM 1097 N LYS A 645 6.780 -21.605 5.107 1.00 0.00 N ATOM 1098 CA LYS A 645 5.988 -22.819 5.266 1.00 0.00 C ATOM 1099 C LYS A 645 6.879 -24.052 5.349 1.00 0.00 C ATOM 1100 O LYS A 645 7.623 -24.355 4.416 1.00 0.00 O ATOM 1101 CB LYS A 645 4.994 -22.965 4.113 1.00 0.00 C ATOM 1102 CG LYS A 645 4.047 -24.150 4.245 1.00 0.00 C ATOM 1103 CD LYS A 645 3.028 -24.173 3.115 1.00 0.00 C ATOM 1104 CE LYS A 645 2.104 -25.376 3.226 1.00 0.00 C ATOM 1105 NZ LYS A 645 1.024 -25.345 2.202 1.00 0.00 N ATOM 0 H LYS A 645 6.510 -21.027 4.311 1.00 0.00 H new ATOM 0 HA LYS A 645 5.435 -22.735 6.202 1.00 0.00 H new ATOM 0 HB2 LYS A 645 4.405 -22.051 4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 645 5.550 -23.062 3.180 1.00 0.00 H new ATOM 0 HG2 LYS A 645 4.619 -25.078 4.240 1.00 0.00 H new ATOM 0 HG3 LYS A 645 3.530 -24.100 5.203 1.00 0.00 H new ATOM 0 HD2 LYS A 645 2.439 -23.256 3.136 1.00 0.00 H new ATOM 0 HD3 LYS A 645 3.546 -24.197 2.156 1.00 0.00 H new ATOM 0 HE2 LYS A 645 2.685 -26.291 3.113 1.00 0.00 H new ATOM 0 HE3 LYS A 645 1.660 -25.402 4.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 645 0.417 -26.182 2.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 645 0.453 -24.485 2.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 645 1.446 -25.347 1.252 1.00 0.00 H new ATOM 1119 N GLY A 646 6.798 -24.760 6.470 1.00 0.00 N ATOM 1120 CA GLY A 646 7.482 -26.039 6.620 1.00 0.00 C ATOM 1121 C GLY A 646 8.925 -25.843 7.067 1.00 0.00 C ATOM 1122 O GLY A 646 9.691 -26.802 7.160 1.00 0.00 O ATOM 0 H GLY A 646 6.265 -24.469 7.289 1.00 0.00 H new ATOM 0 HA2 GLY A 646 6.953 -26.654 7.348 1.00 0.00 H new ATOM 0 HA3 GLY A 646 7.462 -26.578 5.673 1.00 0.00 H new ATOM 1126 N ASN A 647 9.289 -24.596 7.343 1.00 0.00 N ATOM 1127 CA ASN A 647 10.650 -24.267 7.750 1.00 0.00 C ATOM 1128 C ASN A 647 10.662 -23.501 9.066 1.00 0.00 C ATOM 1129 O ASN A 647 9.679 -22.854 9.428 1.00 0.00 O ATOM 1130 CB ASN A 647 11.375 -23.477 6.676 1.00 0.00 C ATOM 1131 CG ASN A 647 11.669 -24.271 5.434 1.00 0.00 C ATOM 1132 OD1 ASN A 647 12.528 -25.160 5.430 1.00 0.00 O ATOM 1133 ND2 ASN A 647 11.020 -23.901 4.360 1.00 0.00 N ATOM 0 H ASN A 647 8.660 -23.795 7.292 1.00 0.00 H new ATOM 0 HA ASN A 647 11.179 -25.209 7.895 1.00 0.00 H new ATOM 0 HB2 ASN A 647 10.773 -22.609 6.407 1.00 0.00 H new ATOM 0 HB3 ASN A 647 12.312 -23.100 7.085 1.00 0.00 H new ATOM 0 HD21 ASN A 647 11.214 -24.352 3.466 1.00 0.00 H new ATOM 0 HD22 ASN A 647 10.320 -23.161 4.417 1.00 0.00 H new ATOM 1140 N LYS A 648 11.780 -23.578 9.780 1.00 0.00 N ATOM 1141 CA LYS A 648 11.920 -22.896 11.061 1.00 0.00 C ATOM 1142 C LYS A 648 11.891 -21.383 10.885 1.00 0.00 C ATOM 1143 O LYS A 648 12.292 -20.861 9.844 1.00 0.00 O ATOM 1144 CB LYS A 648 13.216 -23.319 11.755 1.00 0.00 C ATOM 1145 CG LYS A 648 13.246 -24.777 12.194 1.00 0.00 C ATOM 1146 CD LYS A 648 14.551 -25.116 12.898 1.00 0.00 C ATOM 1147 CE LYS A 648 14.583 -26.572 13.337 1.00 0.00 C ATOM 1148 NZ LYS A 648 15.850 -26.916 14.037 1.00 0.00 N ATOM 0 H LYS A 648 12.603 -24.107 9.493 1.00 0.00 H new ATOM 0 HA LYS A 648 11.074 -23.183 11.685 1.00 0.00 H new ATOM 0 HB2 LYS A 648 14.052 -23.138 11.079 1.00 0.00 H new ATOM 0 HB3 LYS A 648 13.370 -22.686 12.629 1.00 0.00 H new ATOM 0 HG2 LYS A 648 12.408 -24.975 12.862 1.00 0.00 H new ATOM 0 HG3 LYS A 648 13.121 -25.423 11.325 1.00 0.00 H new ATOM 0 HD2 LYS A 648 15.389 -24.917 12.230 1.00 0.00 H new ATOM 0 HD3 LYS A 648 14.676 -24.470 13.767 1.00 0.00 H new ATOM 0 HE2 LYS A 648 13.739 -26.770 13.997 1.00 0.00 H new ATOM 0 HE3 LYS A 648 14.464 -27.216 12.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 648 15.830 -27.917 14.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 648 16.655 -26.752 13.399 1.00 0.00 H new ATOM 0 HZ3 LYS A 648 15.952 -26.320 14.883 1.00 0.00 H new ATOM 1162 N GLU A 649 11.415 -20.682 11.908 1.00 0.00 N ATOM 1163 CA GLU A 649 11.360 -19.226 11.881 1.00 0.00 C ATOM 1164 C GLU A 649 12.758 -18.623 11.841 1.00 0.00 C ATOM 1165 O GLU A 649 13.639 -19.024 12.601 1.00 0.00 O ATOM 1166 CB GLU A 649 10.593 -18.695 13.094 1.00 0.00 C ATOM 1167 CG GLU A 649 10.367 -17.190 13.086 1.00 0.00 C ATOM 1168 CD GLU A 649 9.575 -16.750 14.286 1.00 0.00 C ATOM 1169 OE1 GLU A 649 9.216 -17.589 15.077 1.00 0.00 O ATOM 1170 OE2 GLU A 649 9.424 -15.565 14.471 1.00 0.00 O ATOM 0 H GLU A 649 11.061 -21.100 12.768 1.00 0.00 H new ATOM 0 HA GLU A 649 10.834 -18.930 10.973 1.00 0.00 H new ATOM 0 HB2 GLU A 649 9.626 -19.195 13.144 1.00 0.00 H new ATOM 0 HB3 GLU A 649 11.138 -18.963 13.999 1.00 0.00 H new ATOM 0 HG2 GLU A 649 11.328 -16.676 13.073 1.00 0.00 H new ATOM 0 HG3 GLU A 649 9.841 -16.904 12.175 1.00 0.00 H new ATOM 1177 N THR A 650 12.955 -17.656 10.951 1.00 0.00 N ATOM 1178 CA THR A 650 14.237 -16.971 10.834 1.00 0.00 C ATOM 1179 C THR A 650 14.069 -15.463 10.962 1.00 0.00 C ATOM 1180 O THR A 650 12.958 -14.941 10.863 1.00 0.00 O ATOM 1181 CB THR A 650 14.928 -17.289 9.495 1.00 0.00 C ATOM 1182 OG1 THR A 650 14.117 -16.815 8.412 1.00 0.00 O ATOM 1183 CG2 THR A 650 15.140 -18.788 9.347 1.00 0.00 C ATOM 0 H THR A 650 12.242 -17.329 10.299 1.00 0.00 H new ATOM 0 HA THR A 650 14.862 -17.334 11.650 1.00 0.00 H new ATOM 0 HB THR A 650 15.898 -16.792 9.476 1.00 0.00 H new ATOM 0 HG1 THR A 650 13.187 -16.736 8.710 1.00 0.00 H new ATOM 0 HG21 THR A 650 15.629 -18.994 8.395 1.00 0.00 H new ATOM 0 HG22 THR A 650 15.766 -19.149 10.163 1.00 0.00 H new ATOM 0 HG23 THR A 650 14.176 -19.296 9.377 1.00 0.00 H new ATOM 1191 N LYS A 651 15.178 -14.766 11.183 1.00 0.00 N ATOM 1192 CA LYS A 651 15.155 -13.315 11.329 1.00 0.00 C ATOM 1193 C LYS A 651 16.112 -12.647 10.350 1.00 0.00 C ATOM 1194 O LYS A 651 17.222 -13.130 10.126 1.00 0.00 O ATOM 1195 CB LYS A 651 15.506 -12.916 12.763 1.00 0.00 C ATOM 1196 CG LYS A 651 14.475 -13.333 13.803 1.00 0.00 C ATOM 1197 CD LYS A 651 14.860 -12.845 15.191 1.00 0.00 C ATOM 1198 CE LYS A 651 13.860 -13.310 16.240 1.00 0.00 C ATOM 1199 NZ LYS A 651 14.216 -12.828 17.602 1.00 0.00 N ATOM 0 H LYS A 651 16.105 -15.183 11.265 1.00 0.00 H new ATOM 0 HA LYS A 651 14.145 -12.973 11.104 1.00 0.00 H new ATOM 0 HB2 LYS A 651 16.467 -13.358 13.025 1.00 0.00 H new ATOM 0 HB3 LYS A 651 15.630 -11.834 12.806 1.00 0.00 H new ATOM 0 HG2 LYS A 651 13.499 -12.931 13.532 1.00 0.00 H new ATOM 0 HG3 LYS A 651 14.382 -14.419 13.810 1.00 0.00 H new ATOM 0 HD2 LYS A 651 15.854 -13.213 15.445 1.00 0.00 H new ATOM 0 HD3 LYS A 651 14.913 -11.756 15.194 1.00 0.00 H new ATOM 0 HE2 LYS A 651 12.865 -12.951 15.977 1.00 0.00 H new ATOM 0 HE3 LYS A 651 13.816 -14.399 16.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 651 13.510 -13.167 18.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 651 15.154 -13.191 17.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 651 14.233 -11.788 17.609 1.00 0.00 H new ATOM 1213 N LEU A 652 15.676 -11.535 9.770 1.00 0.00 N ATOM 1214 CA LEU A 652 16.514 -10.769 8.854 1.00 0.00 C ATOM 1215 C LEU A 652 16.702 -9.339 9.345 1.00 0.00 C ATOM 1216 O LEU A 652 15.884 -8.821 10.105 1.00 0.00 O ATOM 1217 CB LEU A 652 15.903 -10.774 7.447 1.00 0.00 C ATOM 1218 CG LEU A 652 15.739 -12.161 6.812 1.00 0.00 C ATOM 1219 CD1 LEU A 652 15.036 -12.039 5.467 1.00 0.00 C ATOM 1220 CD2 LEU A 652 17.106 -12.810 6.648 1.00 0.00 C ATOM 0 H LEU A 652 14.746 -11.143 9.918 1.00 0.00 H new ATOM 0 HA LEU A 652 17.495 -11.243 8.816 1.00 0.00 H new ATOM 0 HB2 LEU A 652 14.925 -10.294 7.491 1.00 0.00 H new ATOM 0 HB3 LEU A 652 16.528 -10.165 6.794 1.00 0.00 H new ATOM 0 HG LEU A 652 15.128 -12.788 7.461 1.00 0.00 H new ATOM 0 HD11 LEU A 652 14.924 -13.029 5.024 1.00 0.00 H new ATOM 0 HD12 LEU A 652 14.052 -11.592 5.610 1.00 0.00 H new ATOM 0 HD13 LEU A 652 15.628 -11.409 4.803 1.00 0.00 H new ATOM 0 HD21 LEU A 652 16.989 -13.795 6.197 1.00 0.00 H new ATOM 0 HD22 LEU A 652 17.729 -12.188 6.005 1.00 0.00 H new ATOM 0 HD23 LEU A 652 17.580 -12.912 7.624 1.00 0.00 H new ATOM 1232 N ALA A 653 17.785 -8.707 8.907 1.00 0.00 N ATOM 1233 CA ALA A 653 18.137 -7.373 9.380 1.00 0.00 C ATOM 1234 C ALA A 653 18.575 -6.478 8.229 1.00 0.00 C ATOM 1235 O ALA A 653 18.476 -6.858 7.062 1.00 0.00 O ATOM 1236 CB ALA A 653 19.231 -7.458 10.436 1.00 0.00 C ATOM 0 H ALA A 653 18.435 -9.097 8.225 1.00 0.00 H new ATOM 0 HA ALA A 653 17.249 -6.929 9.829 1.00 0.00 H new ATOM 0 HB1 ALA A 653 19.484 -6.455 10.780 1.00 0.00 H new ATOM 0 HB2 ALA A 653 18.878 -8.052 11.279 1.00 0.00 H new ATOM 0 HB3 ALA A 653 20.116 -7.928 10.006 1.00 0.00 H new ATOM 1242 N ASP A 654 19.060 -5.287 8.563 1.00 0.00 N ATOM 1243 CA ASP A 654 19.525 -4.339 7.558 1.00 0.00 C ATOM 1244 C ASP A 654 20.386 -5.029 6.507 1.00 0.00 C ATOM 1245 O ASP A 654 21.389 -5.665 6.833 1.00 0.00 O ATOM 1246 CB ASP A 654 20.309 -3.201 8.216 1.00 0.00 C ATOM 1247 CG ASP A 654 20.778 -2.120 7.251 1.00 0.00 C ATOM 1248 OD1 ASP A 654 20.601 -2.290 6.067 1.00 0.00 O ATOM 1249 OD2 ASP A 654 21.164 -1.071 7.707 1.00 0.00 O ATOM 0 H ASP A 654 19.141 -4.955 9.524 1.00 0.00 H new ATOM 0 HA ASP A 654 18.648 -3.923 7.061 1.00 0.00 H new ATOM 0 HB2 ASP A 654 19.684 -2.741 8.982 1.00 0.00 H new ATOM 0 HB3 ASP A 654 21.178 -3.620 8.723 1.00 0.00 H new ATOM 1254 N GLY A 655 19.990 -4.898 5.246 1.00 0.00 N ATOM 1255 CA GLY A 655 20.796 -5.389 4.135 1.00 0.00 C ATOM 1256 C GLY A 655 20.235 -6.692 3.580 1.00 0.00 C ATOM 1257 O GLY A 655 20.577 -7.105 2.472 1.00 0.00 O ATOM 0 H GLY A 655 19.114 -4.455 4.968 1.00 0.00 H new ATOM 0 HA2 GLY A 655 20.827 -4.638 3.345 1.00 0.00 H new ATOM 0 HA3 GLY A 655 21.822 -5.545 4.468 1.00 0.00 H new ATOM 1261 N SER A 656 19.372 -7.337 4.358 1.00 0.00 N ATOM 1262 CA SER A 656 18.747 -8.586 3.938 1.00 0.00 C ATOM 1263 C SER A 656 17.443 -8.327 3.195 1.00 0.00 C ATOM 1264 O SER A 656 16.941 -7.203 3.176 1.00 0.00 O ATOM 1265 CB SER A 656 18.503 -9.477 5.140 1.00 0.00 C ATOM 1266 OG SER A 656 19.700 -9.889 5.741 1.00 0.00 O ATOM 0 H SER A 656 19.089 -7.015 5.284 1.00 0.00 H new ATOM 0 HA SER A 656 19.427 -9.093 3.253 1.00 0.00 H new ATOM 0 HB2 SER A 656 17.896 -8.942 5.870 1.00 0.00 H new ATOM 0 HB3 SER A 656 17.932 -10.353 4.832 1.00 0.00 H new ATOM 0 HG SER A 656 19.499 -10.460 6.512 1.00 0.00 H new ATOM 1272 N TYR A 657 16.897 -9.373 2.585 1.00 0.00 N ATOM 1273 CA TYR A 657 15.675 -9.251 1.800 1.00 0.00 C ATOM 1274 C TYR A 657 14.931 -10.578 1.729 1.00 0.00 C ATOM 1275 O TYR A 657 15.455 -11.617 2.131 1.00 0.00 O ATOM 1276 CB TYR A 657 15.992 -8.752 0.389 1.00 0.00 C ATOM 1277 CG TYR A 657 16.730 -9.758 -0.466 1.00 0.00 C ATOM 1278 CD1 TYR A 657 18.114 -9.841 -0.433 1.00 0.00 C ATOM 1279 CD2 TYR A 657 16.041 -10.621 -1.306 1.00 0.00 C ATOM 1280 CE1 TYR A 657 18.793 -10.757 -1.212 1.00 0.00 C ATOM 1281 CE2 TYR A 657 16.709 -11.543 -2.088 1.00 0.00 C ATOM 1282 CZ TYR A 657 18.087 -11.607 -2.038 1.00 0.00 C ATOM 1283 OH TYR A 657 18.759 -12.522 -2.817 1.00 0.00 O ATOM 0 H TYR A 657 17.283 -10.317 2.619 1.00 0.00 H new ATOM 0 HA TYR A 657 15.032 -8.525 2.297 1.00 0.00 H new ATOM 0 HB2 TYR A 657 15.060 -8.482 -0.108 1.00 0.00 H new ATOM 0 HB3 TYR A 657 16.590 -7.843 0.461 1.00 0.00 H new ATOM 0 HD1 TYR A 657 18.670 -9.178 0.213 1.00 0.00 H new ATOM 0 HD2 TYR A 657 14.963 -10.571 -1.349 1.00 0.00 H new ATOM 0 HE1 TYR A 657 19.871 -10.808 -1.175 1.00 0.00 H new ATOM 0 HE2 TYR A 657 16.157 -12.209 -2.734 1.00 0.00 H new ATOM 0 HH TYR A 657 18.134 -13.211 -3.125 1.00 0.00 H new ATOM 1293 N PHE A 658 13.706 -10.537 1.216 1.00 0.00 N ATOM 1294 CA PHE A 658 12.872 -11.730 1.126 1.00 0.00 C ATOM 1295 C PHE A 658 11.787 -11.566 0.070 1.00 0.00 C ATOM 1296 O PHE A 658 11.492 -10.451 -0.362 1.00 0.00 O ATOM 1297 CB PHE A 658 12.242 -12.046 2.484 1.00 0.00 C ATOM 1298 CG PHE A 658 11.510 -10.886 3.097 1.00 0.00 C ATOM 1299 CD1 PHE A 658 12.182 -9.956 3.875 1.00 0.00 C ATOM 1300 CD2 PHE A 658 10.148 -10.722 2.895 1.00 0.00 C ATOM 1301 CE1 PHE A 658 11.511 -8.889 4.440 1.00 0.00 C ATOM 1302 CE2 PHE A 658 9.473 -9.655 3.458 1.00 0.00 C ATOM 1303 CZ PHE A 658 10.154 -8.739 4.231 1.00 0.00 C ATOM 0 H PHE A 658 13.268 -9.689 0.856 1.00 0.00 H new ATOM 0 HA PHE A 658 13.511 -12.562 0.830 1.00 0.00 H new ATOM 0 HB2 PHE A 658 11.550 -12.880 2.368 1.00 0.00 H new ATOM 0 HB3 PHE A 658 13.024 -12.374 3.169 1.00 0.00 H new ATOM 0 HD1 PHE A 658 13.243 -10.067 4.041 1.00 0.00 H new ATOM 0 HD2 PHE A 658 9.608 -11.436 2.291 1.00 0.00 H new ATOM 0 HE1 PHE A 658 12.047 -8.173 5.045 1.00 0.00 H new ATOM 0 HE2 PHE A 658 8.412 -9.539 3.292 1.00 0.00 H new ATOM 0 HZ PHE A 658 9.627 -7.906 4.672 1.00 0.00 H new ATOM 1313 N GLY A 659 11.195 -12.682 -0.341 1.00 0.00 N ATOM 1314 CA GLY A 659 10.176 -12.669 -1.385 1.00 0.00 C ATOM 1315 C GLY A 659 10.692 -13.311 -2.666 1.00 0.00 C ATOM 1316 O GLY A 659 9.920 -13.609 -3.577 1.00 0.00 O ATOM 0 H GLY A 659 11.403 -13.608 0.033 1.00 0.00 H new ATOM 0 HA2 GLY A 659 9.290 -13.202 -1.039 1.00 0.00 H new ATOM 0 HA3 GLY A 659 9.871 -11.642 -1.587 1.00 0.00 H new ATOM 1320 N GLU A 660 12.002 -13.522 -2.730 1.00 0.00 N ATOM 1321 CA GLU A 660 12.625 -14.121 -3.904 1.00 0.00 C ATOM 1322 C GLU A 660 11.984 -15.459 -4.247 1.00 0.00 C ATOM 1323 O GLU A 660 11.728 -15.755 -5.414 1.00 0.00 O ATOM 1324 CB GLU A 660 14.129 -14.300 -3.680 1.00 0.00 C ATOM 1325 CG GLU A 660 14.889 -14.809 -4.897 1.00 0.00 C ATOM 1326 CD GLU A 660 16.370 -14.841 -4.641 1.00 0.00 C ATOM 1327 OE1 GLU A 660 16.779 -14.439 -3.578 1.00 0.00 O ATOM 1328 OE2 GLU A 660 17.083 -15.370 -5.461 1.00 0.00 O ATOM 0 H GLU A 660 12.654 -13.287 -1.981 1.00 0.00 H new ATOM 0 HA GLU A 660 12.470 -13.444 -4.744 1.00 0.00 H new ATOM 0 HB2 GLU A 660 14.555 -13.344 -3.374 1.00 0.00 H new ATOM 0 HB3 GLU A 660 14.281 -14.995 -2.855 1.00 0.00 H new ATOM 0 HG2 GLU A 660 14.540 -15.809 -5.154 1.00 0.00 H new ATOM 0 HG3 GLU A 660 14.679 -14.168 -5.754 1.00 0.00 H new ATOM 1335 N ILE A 661 11.726 -16.265 -3.222 1.00 0.00 N ATOM 1336 CA ILE A 661 11.084 -17.561 -3.410 1.00 0.00 C ATOM 1337 C ILE A 661 9.617 -17.399 -3.789 1.00 0.00 C ATOM 1338 O ILE A 661 9.092 -18.151 -4.610 1.00 0.00 O ATOM 1339 CB ILE A 661 11.183 -18.429 -2.142 1.00 0.00 C ATOM 1340 CG1 ILE A 661 12.638 -18.831 -1.883 1.00 0.00 C ATOM 1341 CG2 ILE A 661 10.302 -19.662 -2.272 1.00 0.00 C ATOM 1342 CD1 ILE A 661 12.866 -19.460 -0.528 1.00 0.00 C ATOM 0 H ILE A 661 11.952 -16.043 -2.252 1.00 0.00 H new ATOM 0 HA ILE A 661 11.613 -18.059 -4.223 1.00 0.00 H new ATOM 0 HB ILE A 661 10.831 -17.844 -1.292 1.00 0.00 H new ATOM 0 HG12 ILE A 661 12.955 -19.531 -2.656 1.00 0.00 H new ATOM 0 HG13 ILE A 661 13.271 -17.948 -1.974 1.00 0.00 H new ATOM 0 HG21 ILE A 661 10.384 -20.265 -1.367 1.00 0.00 H new ATOM 0 HG22 ILE A 661 9.265 -19.355 -2.411 1.00 0.00 H new ATOM 0 HG23 ILE A 661 10.625 -20.251 -3.131 1.00 0.00 H new ATOM 0 HD11 ILE A 661 13.920 -19.717 -0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 661 12.582 -18.755 0.253 1.00 0.00 H new ATOM 0 HD13 ILE A 661 12.261 -20.362 -0.439 1.00 0.00 H new ATOM 1354 N CYS A 662 8.961 -16.414 -3.187 1.00 0.00 N ATOM 1355 CA CYS A 662 7.539 -16.186 -3.420 1.00 0.00 C ATOM 1356 C CYS A 662 7.264 -15.875 -4.885 1.00 0.00 C ATOM 1357 O CYS A 662 6.232 -16.267 -5.430 1.00 0.00 O ATOM 1358 CB CYS A 662 7.246 -14.966 -2.546 1.00 0.00 C ATOM 1359 SG CYS A 662 7.345 -15.278 -0.767 1.00 0.00 S ATOM 0 H CYS A 662 9.391 -15.760 -2.533 1.00 0.00 H new ATOM 0 HA CYS A 662 6.922 -17.053 -3.183 1.00 0.00 H new ATOM 0 HB2 CYS A 662 7.949 -14.173 -2.803 1.00 0.00 H new ATOM 0 HB3 CYS A 662 6.248 -14.596 -2.782 1.00 0.00 H new ATOM 0 HG CYS A 662 7.083 -14.182 -0.119 1.00 0.00 H new ATOM 1365 N LEU A 663 8.193 -15.167 -5.519 1.00 0.00 N ATOM 1366 CA LEU A 663 8.073 -14.839 -6.935 1.00 0.00 C ATOM 1367 C LEU A 663 8.113 -16.095 -7.796 1.00 0.00 C ATOM 1368 O LEU A 663 7.672 -16.085 -8.946 1.00 0.00 O ATOM 1369 CB LEU A 663 9.187 -13.871 -7.351 1.00 0.00 C ATOM 1370 CG LEU A 663 8.793 -12.389 -7.365 1.00 0.00 C ATOM 1371 CD1 LEU A 663 8.318 -11.962 -5.982 1.00 0.00 C ATOM 1372 CD2 LEU A 663 9.981 -11.550 -7.810 1.00 0.00 C ATOM 0 H LEU A 663 9.038 -14.809 -5.074 1.00 0.00 H new ATOM 0 HA LEU A 663 7.108 -14.356 -7.090 1.00 0.00 H new ATOM 0 HB2 LEU A 663 10.030 -14.000 -6.673 1.00 0.00 H new ATOM 0 HB3 LEU A 663 9.534 -14.148 -8.347 1.00 0.00 H new ATOM 0 HG LEU A 663 7.975 -12.237 -8.069 1.00 0.00 H new ATOM 0 HD11 LEU A 663 8.040 -10.908 -6.002 1.00 0.00 H new ATOM 0 HD12 LEU A 663 7.453 -12.560 -5.694 1.00 0.00 H new ATOM 0 HD13 LEU A 663 9.120 -12.112 -5.259 1.00 0.00 H new ATOM 0 HD21 LEU A 663 9.700 -10.497 -7.820 1.00 0.00 H new ATOM 0 HD22 LEU A 663 10.810 -11.698 -7.118 1.00 0.00 H new ATOM 0 HD23 LEU A 663 10.286 -11.853 -8.812 1.00 0.00 H new ATOM 1384 N LEU A 664 8.643 -17.176 -7.234 1.00 0.00 N ATOM 1385 CA LEU A 664 8.812 -18.420 -7.974 1.00 0.00 C ATOM 1386 C LEU A 664 7.608 -19.336 -7.797 1.00 0.00 C ATOM 1387 O LEU A 664 7.604 -20.471 -8.272 1.00 0.00 O ATOM 1388 CB LEU A 664 10.095 -19.133 -7.526 1.00 0.00 C ATOM 1389 CG LEU A 664 11.389 -18.334 -7.726 1.00 0.00 C ATOM 1390 CD1 LEU A 664 12.568 -19.093 -7.132 1.00 0.00 C ATOM 1391 CD2 LEU A 664 11.605 -18.077 -9.210 1.00 0.00 C ATOM 0 H LEU A 664 8.963 -17.215 -6.266 1.00 0.00 H new ATOM 0 HA LEU A 664 8.893 -18.175 -9.033 1.00 0.00 H new ATOM 0 HB2 LEU A 664 10.002 -19.385 -6.470 1.00 0.00 H new ATOM 0 HB3 LEU A 664 10.179 -20.073 -8.072 1.00 0.00 H new ATOM 0 HG LEU A 664 11.307 -17.376 -7.213 1.00 0.00 H new ATOM 0 HD11 LEU A 664 13.482 -18.518 -7.279 1.00 0.00 H new ATOM 0 HD12 LEU A 664 12.403 -19.245 -6.065 1.00 0.00 H new ATOM 0 HD13 LEU A 664 12.664 -20.060 -7.626 1.00 0.00 H new ATOM 0 HD21 LEU A 664 12.525 -17.509 -9.351 1.00 0.00 H new ATOM 0 HD22 LEU A 664 11.682 -19.028 -9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 664 10.764 -17.509 -9.607 1.00 0.00 H new ATOM 1403 N THR A 665 6.587 -18.835 -7.110 1.00 0.00 N ATOM 1404 CA THR A 665 5.360 -19.594 -6.898 1.00 0.00 C ATOM 1405 C THR A 665 4.338 -19.305 -7.990 1.00 0.00 C ATOM 1406 O THR A 665 4.651 -18.666 -8.994 1.00 0.00 O ATOM 1407 CB THR A 665 4.733 -19.283 -5.526 1.00 0.00 C ATOM 1408 OG1 THR A 665 4.204 -17.951 -5.531 1.00 0.00 O ATOM 1409 CG2 THR A 665 5.773 -19.408 -4.424 1.00 0.00 C ATOM 0 H THR A 665 6.585 -17.905 -6.690 1.00 0.00 H new ATOM 0 HA THR A 665 5.634 -20.649 -6.931 1.00 0.00 H new ATOM 0 HB THR A 665 3.932 -19.998 -5.338 1.00 0.00 H new ATOM 0 HG1 THR A 665 4.938 -17.308 -5.621 1.00 0.00 H new ATOM 0 HG21 THR A 665 5.312 -19.185 -3.462 1.00 0.00 H new ATOM 0 HG22 THR A 665 6.168 -20.424 -4.410 1.00 0.00 H new ATOM 0 HG23 THR A 665 6.585 -18.705 -4.609 1.00 0.00 H new ATOM 1417 N ARG A 666 3.113 -19.780 -7.787 1.00 0.00 N ATOM 1418 CA ARG A 666 2.032 -19.542 -8.736 1.00 0.00 C ATOM 1419 C ARG A 666 1.370 -18.192 -8.489 1.00 0.00 C ATOM 1420 O ARG A 666 0.407 -17.829 -9.165 1.00 0.00 O ATOM 1421 CB ARG A 666 1.012 -20.670 -8.739 1.00 0.00 C ATOM 1422 CG ARG A 666 1.538 -22.006 -9.241 1.00 0.00 C ATOM 1423 CD ARG A 666 0.539 -23.106 -9.215 1.00 0.00 C ATOM 1424 NE ARG A 666 1.054 -24.397 -9.641 1.00 0.00 N ATOM 1425 CZ ARG A 666 0.354 -25.548 -9.611 1.00 0.00 C ATOM 1426 NH1 ARG A 666 -0.874 -25.581 -9.142 1.00 0.00 N ATOM 1427 NH2 ARG A 666 0.943 -26.649 -10.043 1.00 0.00 N ATOM 0 H ARG A 666 2.844 -20.333 -6.973 1.00 0.00 H new ATOM 0 HA ARG A 666 2.478 -19.519 -9.730 1.00 0.00 H new ATOM 0 HB2 ARG A 666 0.635 -20.802 -7.725 1.00 0.00 H new ATOM 0 HB3 ARG A 666 0.165 -20.373 -9.358 1.00 0.00 H new ATOM 0 HG2 ARG A 666 1.897 -21.881 -10.263 1.00 0.00 H new ATOM 0 HG3 ARG A 666 2.396 -22.296 -8.635 1.00 0.00 H new ATOM 0 HD2 ARG A 666 0.148 -23.201 -8.202 1.00 0.00 H new ATOM 0 HD3 ARG A 666 -0.299 -22.834 -9.856 1.00 0.00 H new ATOM 0 HE ARG A 666 2.013 -24.434 -9.987 1.00 0.00 H new ATOM 0 HH11 ARG A 666 -1.310 -24.727 -8.794 1.00 0.00 H new ATOM 0 HH12 ARG A 666 -1.390 -26.460 -9.126 1.00 0.00 H new ATOM 0 HH21 ARG A 666 1.903 -26.613 -10.387 1.00 0.00 H new ATOM 0 HH22 ARG A 666 0.438 -27.535 -10.032 1.00 0.00 H new ATOM 1441 N GLY A 667 1.891 -17.452 -7.516 1.00 0.00 N ATOM 1442 CA GLY A 667 1.408 -16.105 -7.235 1.00 0.00 C ATOM 1443 C GLY A 667 1.137 -15.917 -5.748 1.00 0.00 C ATOM 1444 O GLY A 667 1.328 -14.828 -5.206 1.00 0.00 O ATOM 0 H GLY A 667 2.649 -17.763 -6.908 1.00 0.00 H new ATOM 0 HA2 GLY A 667 2.145 -15.374 -7.568 1.00 0.00 H new ATOM 0 HA3 GLY A 667 0.495 -15.918 -7.800 1.00 0.00 H new ATOM 1448 N ARG A 668 0.691 -16.983 -5.093 1.00 0.00 N ATOM 1449 CA ARG A 668 0.415 -16.943 -3.662 1.00 0.00 C ATOM 1450 C ARG A 668 1.694 -17.099 -2.850 1.00 0.00 C ATOM 1451 O ARG A 668 2.584 -17.868 -3.215 1.00 0.00 O ATOM 1452 CB ARG A 668 -0.634 -17.965 -3.251 1.00 0.00 C ATOM 1453 CG ARG A 668 -2.017 -17.734 -3.838 1.00 0.00 C ATOM 1454 CD ARG A 668 -2.998 -18.808 -3.536 1.00 0.00 C ATOM 1455 NE ARG A 668 -3.428 -18.858 -2.148 1.00 0.00 N ATOM 1456 CZ ARG A 668 -4.066 -19.902 -1.582 1.00 0.00 C ATOM 1457 NH1 ARG A 668 -4.382 -20.965 -2.287 1.00 0.00 N ATOM 1458 NH2 ARG A 668 -4.387 -19.818 -0.303 1.00 0.00 N ATOM 0 H ARG A 668 0.513 -17.887 -5.531 1.00 0.00 H new ATOM 0 HA ARG A 668 -0.001 -15.960 -3.443 1.00 0.00 H new ATOM 0 HB2 ARG A 668 -0.290 -18.956 -3.547 1.00 0.00 H new ATOM 0 HB3 ARG A 668 -0.712 -17.967 -2.164 1.00 0.00 H new ATOM 0 HG2 ARG A 668 -2.405 -16.788 -3.461 1.00 0.00 H new ATOM 0 HG3 ARG A 668 -1.927 -17.634 -4.920 1.00 0.00 H new ATOM 0 HD2 ARG A 668 -3.874 -18.671 -4.170 1.00 0.00 H new ATOM 0 HD3 ARG A 668 -2.559 -19.769 -3.802 1.00 0.00 H new ATOM 0 HE ARG A 668 -3.233 -18.046 -1.562 1.00 0.00 H new ATOM 0 HH11 ARG A 668 -4.145 -21.009 -3.278 1.00 0.00 H new ATOM 0 HH12 ARG A 668 -4.865 -21.746 -1.843 1.00 0.00 H new ATOM 0 HH21 ARG A 668 -4.152 -18.979 0.228 1.00 0.00 H new ATOM 0 HH22 ARG A 668 -4.870 -20.592 0.153 1.00 0.00 H new ATOM 1472 N ARG A 669 1.781 -16.365 -1.745 1.00 0.00 N ATOM 1473 CA ARG A 669 2.950 -16.425 -0.876 1.00 0.00 C ATOM 1474 C ARG A 669 3.005 -17.744 -0.117 1.00 0.00 C ATOM 1475 O ARG A 669 1.972 -18.302 0.253 1.00 0.00 O ATOM 1476 CB ARG A 669 3.024 -15.235 0.069 1.00 0.00 C ATOM 1477 CG ARG A 669 2.919 -13.876 -0.605 1.00 0.00 C ATOM 1478 CD ARG A 669 4.201 -13.362 -1.152 1.00 0.00 C ATOM 1479 NE ARG A 669 4.152 -11.983 -1.608 1.00 0.00 N ATOM 1480 CZ ARG A 669 5.203 -11.305 -2.109 1.00 0.00 C ATOM 1481 NH1 ARG A 669 6.393 -11.859 -2.184 1.00 0.00 N ATOM 1482 NH2 ARG A 669 5.012 -10.057 -2.500 1.00 0.00 N ATOM 0 H ARG A 669 1.055 -15.721 -1.430 1.00 0.00 H new ATOM 0 HA ARG A 669 3.829 -16.372 -1.518 1.00 0.00 H new ATOM 0 HB2 ARG A 669 2.224 -15.323 0.804 1.00 0.00 H new ATOM 0 HB3 ARG A 669 3.966 -15.282 0.616 1.00 0.00 H new ATOM 0 HG2 ARG A 669 2.192 -13.941 -1.415 1.00 0.00 H new ATOM 0 HG3 ARG A 669 2.530 -13.156 0.115 1.00 0.00 H new ATOM 0 HD2 ARG A 669 4.970 -13.451 -0.385 1.00 0.00 H new ATOM 0 HD3 ARG A 669 4.506 -13.996 -1.984 1.00 0.00 H new ATOM 0 HE ARG A 669 3.259 -11.494 -1.544 1.00 0.00 H new ATOM 0 HH11 ARG A 669 6.531 -12.816 -1.860 1.00 0.00 H new ATOM 0 HH12 ARG A 669 7.178 -11.332 -2.566 1.00 0.00 H new ATOM 0 HH21 ARG A 669 4.088 -9.633 -2.418 1.00 0.00 H new ATOM 0 HH22 ARG A 669 5.789 -9.518 -2.883 1.00 0.00 H new ATOM 1496 N THR A 670 4.217 -18.238 0.114 1.00 0.00 N ATOM 1497 CA THR A 670 4.412 -19.464 0.880 1.00 0.00 C ATOM 1498 C THR A 670 5.086 -19.177 2.215 1.00 0.00 C ATOM 1499 O THR A 670 5.729 -20.051 2.797 1.00 0.00 O ATOM 1500 CB THR A 670 5.256 -20.489 0.100 1.00 0.00 C ATOM 1501 OG1 THR A 670 6.510 -19.900 -0.266 1.00 0.00 O ATOM 1502 CG2 THR A 670 4.524 -20.937 -1.156 1.00 0.00 C ATOM 0 H THR A 670 5.080 -17.808 -0.219 1.00 0.00 H new ATOM 0 HA THR A 670 3.422 -19.884 1.059 1.00 0.00 H new ATOM 0 HB THR A 670 5.427 -21.357 0.737 1.00 0.00 H new ATOM 0 HG1 THR A 670 7.047 -20.554 -0.761 1.00 0.00 H new ATOM 0 HG21 THR A 670 5.135 -21.661 -1.695 1.00 0.00 H new ATOM 0 HG22 THR A 670 3.575 -21.397 -0.880 1.00 0.00 H new ATOM 0 HG23 THR A 670 4.336 -20.074 -1.795 1.00 0.00 H new ATOM 1510 N ALA A 671 4.934 -17.948 2.697 1.00 0.00 N ATOM 1511 CA ALA A 671 5.555 -17.535 3.950 1.00 0.00 C ATOM 1512 C ALA A 671 4.798 -16.374 4.583 1.00 0.00 C ATOM 1513 O ALA A 671 4.067 -15.653 3.903 1.00 0.00 O ATOM 1514 CB ALA A 671 7.012 -17.159 3.721 1.00 0.00 C ATOM 0 H ALA A 671 4.386 -17.220 2.238 1.00 0.00 H new ATOM 0 HA ALA A 671 5.515 -18.378 4.640 1.00 0.00 H new ATOM 0 HB1 ALA A 671 7.462 -16.853 4.666 1.00 0.00 H new ATOM 0 HB2 ALA A 671 7.552 -18.019 3.324 1.00 0.00 H new ATOM 0 HB3 ALA A 671 7.068 -16.335 3.009 1.00 0.00 H new ATOM 1520 N SER A 672 4.977 -16.199 5.888 1.00 0.00 N ATOM 1521 CA SER A 672 4.432 -15.042 6.587 1.00 0.00 C ATOM 1522 C SER A 672 5.535 -14.233 7.257 1.00 0.00 C ATOM 1523 O SER A 672 6.444 -14.793 7.870 1.00 0.00 O ATOM 1524 CB SER A 672 3.406 -15.486 7.612 1.00 0.00 C ATOM 1525 OG SER A 672 2.253 -16.007 7.011 1.00 0.00 O ATOM 0 H SER A 672 5.496 -16.845 6.483 1.00 0.00 H new ATOM 0 HA SER A 672 3.945 -14.401 5.852 1.00 0.00 H new ATOM 0 HB2 SER A 672 3.848 -16.240 8.263 1.00 0.00 H new ATOM 0 HB3 SER A 672 3.135 -14.640 8.243 1.00 0.00 H new ATOM 0 HG SER A 672 1.618 -16.283 7.705 1.00 0.00 H new ATOM 1531 N VAL A 673 5.450 -12.912 7.137 1.00 0.00 N ATOM 1532 CA VAL A 673 6.527 -12.032 7.574 1.00 0.00 C ATOM 1533 C VAL A 673 5.989 -10.868 8.395 1.00 0.00 C ATOM 1534 O VAL A 673 5.003 -10.234 8.018 1.00 0.00 O ATOM 1535 CB VAL A 673 7.326 -11.479 6.378 1.00 0.00 C ATOM 1536 CG1 VAL A 673 8.439 -10.561 6.861 1.00 0.00 C ATOM 1537 CG2 VAL A 673 7.898 -12.617 5.547 1.00 0.00 C ATOM 0 H VAL A 673 4.645 -12.427 6.740 1.00 0.00 H new ATOM 0 HA VAL A 673 7.191 -12.633 8.195 1.00 0.00 H new ATOM 0 HB VAL A 673 6.649 -10.900 5.749 1.00 0.00 H new ATOM 0 HG11 VAL A 673 8.993 -10.179 6.004 1.00 0.00 H new ATOM 0 HG12 VAL A 673 8.008 -9.727 7.415 1.00 0.00 H new ATOM 0 HG13 VAL A 673 9.114 -11.118 7.511 1.00 0.00 H new ATOM 0 HG21 VAL A 673 8.459 -12.208 4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 673 8.561 -13.222 6.166 1.00 0.00 H new ATOM 0 HG23 VAL A 673 7.085 -13.238 5.172 1.00 0.00 H new ATOM 1547 N ARG A 674 6.641 -10.591 9.518 1.00 0.00 N ATOM 1548 CA ARG A 674 6.245 -9.485 10.382 1.00 0.00 C ATOM 1549 C ARG A 674 7.452 -8.867 11.075 1.00 0.00 C ATOM 1550 O ARG A 674 8.465 -9.533 11.288 1.00 0.00 O ATOM 1551 CB ARG A 674 5.176 -9.894 11.384 1.00 0.00 C ATOM 1552 CG ARG A 674 5.607 -10.957 12.382 1.00 0.00 C ATOM 1553 CD ARG A 674 4.507 -11.485 13.228 1.00 0.00 C ATOM 1554 NE ARG A 674 4.938 -12.390 14.281 1.00 0.00 N ATOM 1555 CZ ARG A 674 4.109 -13.137 15.036 1.00 0.00 C ATOM 1556 NH1 ARG A 674 2.805 -13.063 14.884 1.00 0.00 N ATOM 1557 NH2 ARG A 674 4.640 -13.929 15.951 1.00 0.00 N ATOM 0 H ARG A 674 7.448 -11.118 9.852 1.00 0.00 H new ATOM 0 HA ARG A 674 5.801 -8.722 9.742 1.00 0.00 H new ATOM 0 HB2 ARG A 674 4.856 -9.009 11.934 1.00 0.00 H new ATOM 0 HB3 ARG A 674 4.307 -10.261 10.837 1.00 0.00 H new ATOM 0 HG2 ARG A 674 6.061 -11.786 11.839 1.00 0.00 H new ATOM 0 HG3 ARG A 674 6.378 -10.539 13.029 1.00 0.00 H new ATOM 0 HD2 ARG A 674 3.979 -10.646 13.681 1.00 0.00 H new ATOM 0 HD3 ARG A 674 3.792 -12.004 12.590 1.00 0.00 H new ATOM 0 HE ARG A 674 5.939 -12.465 14.461 1.00 0.00 H new ATOM 0 HH11 ARG A 674 2.408 -12.433 14.187 1.00 0.00 H new ATOM 0 HH12 ARG A 674 2.191 -13.635 15.463 1.00 0.00 H new ATOM 0 HH21 ARG A 674 5.652 -13.963 16.071 1.00 0.00 H new ATOM 0 HH22 ARG A 674 4.037 -14.506 16.538 1.00 0.00 H new ATOM 1571 N ALA A 675 7.338 -7.591 11.426 1.00 0.00 N ATOM 1572 CA ALA A 675 8.454 -6.852 12.005 1.00 0.00 C ATOM 1573 C ALA A 675 8.599 -7.150 13.492 1.00 0.00 C ATOM 1574 O ALA A 675 7.608 -7.246 14.215 1.00 0.00 O ATOM 1575 CB ALA A 675 8.277 -5.358 11.774 1.00 0.00 C ATOM 0 H ALA A 675 6.482 -7.046 11.319 1.00 0.00 H new ATOM 0 HA ALA A 675 9.368 -7.177 11.508 1.00 0.00 H new ATOM 0 HB1 ALA A 675 9.118 -4.820 12.212 1.00 0.00 H new ATOM 0 HB2 ALA A 675 8.236 -5.158 10.703 1.00 0.00 H new ATOM 0 HB3 ALA A 675 7.350 -5.025 12.241 1.00 0.00 H new ATOM 1581 N ASP A 676 9.841 -7.294 13.942 1.00 0.00 N ATOM 1582 CA ASP A 676 10.123 -7.492 15.359 1.00 0.00 C ATOM 1583 C ASP A 676 10.472 -6.175 16.040 1.00 0.00 C ATOM 1584 O ASP A 676 10.127 -5.955 17.201 1.00 0.00 O ATOM 1585 CB ASP A 676 11.263 -8.497 15.543 1.00 0.00 C ATOM 1586 CG ASP A 676 10.872 -9.946 15.283 1.00 0.00 C ATOM 1587 OD1 ASP A 676 9.699 -10.217 15.194 1.00 0.00 O ATOM 1588 OD2 ASP A 676 11.746 -10.737 15.021 1.00 0.00 O ATOM 0 H ASP A 676 10.668 -7.277 13.346 1.00 0.00 H new ATOM 0 HA ASP A 676 9.222 -7.889 15.826 1.00 0.00 H new ATOM 0 HB2 ASP A 676 12.080 -8.228 14.873 1.00 0.00 H new ATOM 0 HB3 ASP A 676 11.644 -8.413 16.561 1.00 0.00 H new ATOM 1593 N THR A 677 11.158 -5.301 15.312 1.00 0.00 N ATOM 1594 CA THR A 677 11.483 -3.972 15.815 1.00 0.00 C ATOM 1595 C THR A 677 11.056 -2.890 14.832 1.00 0.00 C ATOM 1596 O THR A 677 10.766 -3.174 13.669 1.00 0.00 O ATOM 1597 CB THR A 677 12.990 -3.828 16.098 1.00 0.00 C ATOM 1598 OG1 THR A 677 13.719 -3.893 14.865 1.00 0.00 O ATOM 1599 CG2 THR A 677 13.468 -4.937 17.023 1.00 0.00 C ATOM 0 H THR A 677 11.500 -5.490 14.370 1.00 0.00 H new ATOM 0 HA THR A 677 10.933 -3.847 16.748 1.00 0.00 H new ATOM 0 HB THR A 677 13.163 -2.866 16.581 1.00 0.00 H new ATOM 0 HG1 THR A 677 14.678 -3.800 15.046 1.00 0.00 H new ATOM 0 HG21 THR A 677 14.535 -4.819 17.212 1.00 0.00 H new ATOM 0 HG22 THR A 677 12.925 -4.883 17.966 1.00 0.00 H new ATOM 0 HG23 THR A 677 13.287 -5.905 16.555 1.00 0.00 H new ATOM 1607 N TYR A 678 11.020 -1.649 15.304 1.00 0.00 N ATOM 1608 CA TYR A 678 10.733 -0.509 14.442 1.00 0.00 C ATOM 1609 C TYR A 678 11.704 -0.447 13.270 1.00 0.00 C ATOM 1610 O TYR A 678 12.898 -0.207 13.452 1.00 0.00 O ATOM 1611 CB TYR A 678 10.791 0.795 15.241 1.00 0.00 C ATOM 1612 CG TYR A 678 10.337 2.011 14.464 1.00 0.00 C ATOM 1613 CD1 TYR A 678 8.997 2.207 14.166 1.00 0.00 C ATOM 1614 CD2 TYR A 678 11.251 2.961 14.033 1.00 0.00 C ATOM 1615 CE1 TYR A 678 8.577 3.315 13.456 1.00 0.00 C ATOM 1616 CE2 TYR A 678 10.843 4.073 13.323 1.00 0.00 C ATOM 1617 CZ TYR A 678 9.504 4.247 13.037 1.00 0.00 C ATOM 1618 OH TYR A 678 9.092 5.354 12.331 1.00 0.00 O ATOM 0 H TYR A 678 11.186 -1.407 16.281 1.00 0.00 H new ATOM 0 HA TYR A 678 9.726 -0.637 14.045 1.00 0.00 H new ATOM 0 HB2 TYR A 678 10.170 0.692 16.131 1.00 0.00 H new ATOM 0 HB3 TYR A 678 11.814 0.955 15.582 1.00 0.00 H new ATOM 0 HD1 TYR A 678 8.269 1.480 14.495 1.00 0.00 H new ATOM 0 HD2 TYR A 678 12.299 2.829 14.256 1.00 0.00 H new ATOM 0 HE1 TYR A 678 7.530 3.451 13.230 1.00 0.00 H new ATOM 0 HE2 TYR A 678 11.568 4.803 12.993 1.00 0.00 H new ATOM 0 HH TYR A 678 9.869 5.911 12.113 1.00 0.00 H new ATOM 1628 N CYS A 679 11.185 -0.664 12.066 1.00 0.00 N ATOM 1629 CA CYS A 679 12.025 -0.956 10.911 1.00 0.00 C ATOM 1630 C CYS A 679 11.534 -0.219 9.672 1.00 0.00 C ATOM 1631 O CYS A 679 10.450 0.364 9.674 1.00 0.00 O ATOM 1632 CB CYS A 679 11.854 -2.466 10.742 1.00 0.00 C ATOM 1633 SG CYS A 679 10.172 -2.988 10.326 1.00 0.00 S ATOM 0 H CYS A 679 10.185 -0.643 11.865 1.00 0.00 H new ATOM 0 HA CYS A 679 13.061 -0.645 11.046 1.00 0.00 H new ATOM 0 HB2 CYS A 679 12.532 -2.811 9.961 1.00 0.00 H new ATOM 0 HB3 CYS A 679 12.156 -2.959 11.666 1.00 0.00 H new ATOM 0 HG CYS A 679 9.984 -2.866 9.045 1.00 0.00 H new ATOM 1639 N ARG A 680 12.339 -0.247 8.615 1.00 0.00 N ATOM 1640 CA ARG A 680 11.956 0.355 7.344 1.00 0.00 C ATOM 1641 C ARG A 680 12.367 -0.525 6.170 1.00 0.00 C ATOM 1642 O ARG A 680 13.492 -1.022 6.119 1.00 0.00 O ATOM 1643 CB ARG A 680 12.495 1.770 7.194 1.00 0.00 C ATOM 1644 CG ARG A 680 12.068 2.486 5.922 1.00 0.00 C ATOM 1645 CD ARG A 680 12.561 3.883 5.811 1.00 0.00 C ATOM 1646 NE ARG A 680 12.180 4.560 4.582 1.00 0.00 N ATOM 1647 CZ ARG A 680 12.445 5.852 4.307 1.00 0.00 C ATOM 1648 NH1 ARG A 680 13.055 6.620 5.182 1.00 0.00 N ATOM 1649 NH2 ARG A 680 12.052 6.335 3.141 1.00 0.00 N ATOM 0 H ARG A 680 13.262 -0.681 8.614 1.00 0.00 H new ATOM 0 HA ARG A 680 10.869 0.429 7.340 1.00 0.00 H new ATOM 0 HB2 ARG A 680 12.171 2.359 8.052 1.00 0.00 H new ATOM 0 HB3 ARG A 680 13.584 1.734 7.225 1.00 0.00 H new ATOM 0 HG2 ARG A 680 12.424 1.918 5.062 1.00 0.00 H new ATOM 0 HG3 ARG A 680 10.979 2.492 5.871 1.00 0.00 H new ATOM 0 HD2 ARG A 680 12.185 4.456 6.658 1.00 0.00 H new ATOM 0 HD3 ARG A 680 13.648 3.878 5.887 1.00 0.00 H new ATOM 0 HE ARG A 680 11.677 4.019 3.879 1.00 0.00 H new ATOM 0 HH11 ARG A 680 13.336 6.240 6.086 1.00 0.00 H new ATOM 0 HH12 ARG A 680 13.248 7.596 4.957 1.00 0.00 H new ATOM 0 HH21 ARG A 680 11.563 5.733 2.479 1.00 0.00 H new ATOM 0 HH22 ARG A 680 12.238 7.309 2.904 1.00 0.00 H new ATOM 1663 N LEU A 681 11.448 -0.714 5.229 1.00 0.00 N ATOM 1664 CA LEU A 681 11.706 -1.552 4.065 1.00 0.00 C ATOM 1665 C LEU A 681 11.386 -0.813 2.772 1.00 0.00 C ATOM 1666 O LEU A 681 10.860 0.300 2.796 1.00 0.00 O ATOM 1667 CB LEU A 681 10.892 -2.849 4.153 1.00 0.00 C ATOM 1668 CG LEU A 681 11.351 -3.836 5.234 1.00 0.00 C ATOM 1669 CD1 LEU A 681 10.544 -3.628 6.508 1.00 0.00 C ATOM 1670 CD2 LEU A 681 11.194 -5.260 4.723 1.00 0.00 C ATOM 0 H LEU A 681 10.517 -0.297 5.250 1.00 0.00 H new ATOM 0 HA LEU A 681 12.767 -1.800 4.057 1.00 0.00 H new ATOM 0 HB2 LEU A 681 9.849 -2.593 4.337 1.00 0.00 H new ATOM 0 HB3 LEU A 681 10.931 -3.350 3.186 1.00 0.00 H new ATOM 0 HG LEU A 681 12.402 -3.660 5.464 1.00 0.00 H new ATOM 0 HD11 LEU A 681 10.877 -4.333 7.269 1.00 0.00 H new ATOM 0 HD12 LEU A 681 10.689 -2.610 6.869 1.00 0.00 H new ATOM 0 HD13 LEU A 681 9.487 -3.792 6.300 1.00 0.00 H new ATOM 0 HD21 LEU A 681 11.520 -5.960 5.492 1.00 0.00 H new ATOM 0 HD22 LEU A 681 10.147 -5.447 4.482 1.00 0.00 H new ATOM 0 HD23 LEU A 681 11.802 -5.394 3.828 1.00 0.00 H new ATOM 1682 N TYR A 682 11.706 -1.438 1.644 1.00 0.00 N ATOM 1683 CA TYR A 682 11.222 -0.976 0.348 1.00 0.00 C ATOM 1684 C TYR A 682 10.951 -2.146 -0.588 1.00 0.00 C ATOM 1685 O TYR A 682 11.607 -3.185 -0.505 1.00 0.00 O ATOM 1686 CB TYR A 682 12.230 -0.017 -0.289 1.00 0.00 C ATOM 1687 CG TYR A 682 13.636 -0.570 -0.370 1.00 0.00 C ATOM 1688 CD1 TYR A 682 14.507 -0.460 0.704 1.00 0.00 C ATOM 1689 CD2 TYR A 682 14.088 -1.200 -1.520 1.00 0.00 C ATOM 1690 CE1 TYR A 682 15.791 -0.963 0.635 1.00 0.00 C ATOM 1691 CE2 TYR A 682 15.371 -1.707 -1.600 1.00 0.00 C ATOM 1692 CZ TYR A 682 16.220 -1.586 -0.519 1.00 0.00 C ATOM 1693 OH TYR A 682 17.499 -2.088 -0.592 1.00 0.00 O ATOM 0 H TYR A 682 12.299 -2.267 1.601 1.00 0.00 H new ATOM 0 HA TYR A 682 10.284 -0.447 0.513 1.00 0.00 H new ATOM 0 HB2 TYR A 682 11.891 0.236 -1.294 1.00 0.00 H new ATOM 0 HB3 TYR A 682 12.247 0.910 0.284 1.00 0.00 H new ATOM 0 HD1 TYR A 682 14.175 0.027 1.609 1.00 0.00 H new ATOM 0 HD2 TYR A 682 13.426 -1.296 -2.368 1.00 0.00 H new ATOM 0 HE1 TYR A 682 16.457 -0.869 1.480 1.00 0.00 H new ATOM 0 HE2 TYR A 682 15.707 -2.195 -2.503 1.00 0.00 H new ATOM 0 HH TYR A 682 17.569 -2.695 -1.358 1.00 0.00 H new ATOM 1703 N SER A 683 9.981 -1.972 -1.479 1.00 0.00 N ATOM 1704 CA SER A 683 9.459 -3.081 -2.269 1.00 0.00 C ATOM 1705 C SER A 683 9.808 -2.919 -3.743 1.00 0.00 C ATOM 1706 O SER A 683 9.853 -1.804 -4.262 1.00 0.00 O ATOM 1707 CB SER A 683 7.957 -3.186 -2.091 1.00 0.00 C ATOM 1708 OG SER A 683 7.395 -4.160 -2.928 1.00 0.00 O ATOM 0 H SER A 683 9.540 -1.073 -1.672 1.00 0.00 H new ATOM 0 HA SER A 683 9.924 -4.000 -1.913 1.00 0.00 H new ATOM 0 HB2 SER A 683 7.731 -3.427 -1.052 1.00 0.00 H new ATOM 0 HB3 SER A 683 7.499 -2.220 -2.301 1.00 0.00 H new ATOM 0 HG SER A 683 6.427 -4.198 -2.782 1.00 0.00 H new ATOM 1714 N LEU A 684 10.056 -4.039 -4.413 1.00 0.00 N ATOM 1715 CA LEU A 684 10.165 -4.054 -5.867 1.00 0.00 C ATOM 1716 C LEU A 684 9.336 -5.181 -6.470 1.00 0.00 C ATOM 1717 O LEU A 684 9.522 -6.350 -6.133 1.00 0.00 O ATOM 1718 CB LEU A 684 11.634 -4.188 -6.287 1.00 0.00 C ATOM 1719 CG LEU A 684 12.499 -2.946 -6.040 1.00 0.00 C ATOM 1720 CD1 LEU A 684 13.970 -3.288 -6.232 1.00 0.00 C ATOM 1721 CD2 LEU A 684 12.076 -1.833 -6.988 1.00 0.00 C ATOM 0 H LEU A 684 10.185 -4.949 -3.972 1.00 0.00 H new ATOM 0 HA LEU A 684 9.773 -3.110 -6.246 1.00 0.00 H new ATOM 0 HB2 LEU A 684 12.073 -5.030 -5.751 1.00 0.00 H new ATOM 0 HB3 LEU A 684 11.671 -4.432 -7.349 1.00 0.00 H new ATOM 0 HG LEU A 684 12.359 -2.604 -5.014 1.00 0.00 H new ATOM 0 HD11 LEU A 684 14.576 -2.400 -6.054 1.00 0.00 H new ATOM 0 HD12 LEU A 684 14.257 -4.070 -5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 684 14.132 -3.640 -7.251 1.00 0.00 H new ATOM 0 HD21 LEU A 684 12.692 -0.951 -6.811 1.00 0.00 H new ATOM 0 HD22 LEU A 684 12.204 -2.164 -8.018 1.00 0.00 H new ATOM 0 HD23 LEU A 684 11.029 -1.585 -6.814 1.00 0.00 H new ATOM 1733 N SER A 685 8.421 -4.823 -7.365 1.00 0.00 N ATOM 1734 CA SER A 685 7.552 -5.802 -8.006 1.00 0.00 C ATOM 1735 C SER A 685 8.291 -6.559 -9.103 1.00 0.00 C ATOM 1736 O SER A 685 9.219 -6.032 -9.717 1.00 0.00 O ATOM 1737 CB SER A 685 6.323 -5.118 -8.572 1.00 0.00 C ATOM 1738 OG SER A 685 6.627 -4.329 -9.689 1.00 0.00 O ATOM 0 H SER A 685 8.262 -3.860 -7.663 1.00 0.00 H new ATOM 0 HA SER A 685 7.240 -6.525 -7.252 1.00 0.00 H new ATOM 0 HB2 SER A 685 5.585 -5.871 -8.850 1.00 0.00 H new ATOM 0 HB3 SER A 685 5.868 -4.495 -7.802 1.00 0.00 H new ATOM 0 HG SER A 685 5.808 -3.907 -10.024 1.00 0.00 H new ATOM 1744 N VAL A 686 7.874 -7.797 -9.345 1.00 0.00 N ATOM 1745 CA VAL A 686 8.394 -8.576 -10.462 1.00 0.00 C ATOM 1746 C VAL A 686 8.158 -7.864 -11.788 1.00 0.00 C ATOM 1747 O VAL A 686 8.911 -8.047 -12.744 1.00 0.00 O ATOM 1748 CB VAL A 686 7.753 -9.976 -10.522 1.00 0.00 C ATOM 1749 CG1 VAL A 686 6.301 -9.878 -10.963 1.00 0.00 C ATOM 1750 CG2 VAL A 686 8.535 -10.880 -11.462 1.00 0.00 C ATOM 0 H VAL A 686 7.176 -8.283 -8.781 1.00 0.00 H new ATOM 0 HA VAL A 686 9.466 -8.684 -10.297 1.00 0.00 H new ATOM 0 HB VAL A 686 7.781 -10.411 -9.523 1.00 0.00 H new ATOM 0 HG11 VAL A 686 5.864 -10.876 -11.000 1.00 0.00 H new ATOM 0 HG12 VAL A 686 5.746 -9.265 -10.253 1.00 0.00 H new ATOM 0 HG13 VAL A 686 6.251 -9.423 -11.952 1.00 0.00 H new ATOM 0 HG21 VAL A 686 8.068 -11.865 -11.492 1.00 0.00 H new ATOM 0 HG22 VAL A 686 8.538 -10.449 -12.463 1.00 0.00 H new ATOM 0 HG23 VAL A 686 9.561 -10.976 -11.106 1.00 0.00 H new ATOM 1760 N ASP A 687 7.108 -7.051 -11.838 1.00 0.00 N ATOM 1761 CA ASP A 687 6.826 -6.236 -13.014 1.00 0.00 C ATOM 1762 C ASP A 687 7.899 -5.174 -13.218 1.00 0.00 C ATOM 1763 O ASP A 687 8.318 -4.910 -14.345 1.00 0.00 O ATOM 1764 CB ASP A 687 5.450 -5.577 -12.892 1.00 0.00 C ATOM 1765 CG ASP A 687 4.277 -6.534 -13.058 1.00 0.00 C ATOM 1766 OD1 ASP A 687 4.495 -7.639 -13.495 1.00 0.00 O ATOM 1767 OD2 ASP A 687 3.205 -6.212 -12.604 1.00 0.00 O ATOM 0 H ASP A 687 6.438 -6.939 -11.077 1.00 0.00 H new ATOM 0 HA ASP A 687 6.828 -6.893 -13.883 1.00 0.00 H new ATOM 0 HB2 ASP A 687 5.376 -5.097 -11.916 1.00 0.00 H new ATOM 0 HB3 ASP A 687 5.370 -4.790 -13.642 1.00 0.00 H new ATOM 1772 N ASN A 688 8.340 -4.567 -12.122 1.00 0.00 N ATOM 1773 CA ASN A 688 9.405 -3.572 -12.172 1.00 0.00 C ATOM 1774 C ASN A 688 10.731 -4.205 -12.575 1.00 0.00 C ATOM 1775 O ASN A 688 11.494 -3.630 -13.350 1.00 0.00 O ATOM 1776 CB ASN A 688 9.550 -2.847 -10.847 1.00 0.00 C ATOM 1777 CG ASN A 688 8.453 -1.856 -10.576 1.00 0.00 C ATOM 1778 OD1 ASN A 688 7.767 -1.392 -11.495 1.00 0.00 O ATOM 1779 ND2 ASN A 688 8.337 -1.468 -9.332 1.00 0.00 N ATOM 0 H ASN A 688 7.976 -4.747 -11.186 1.00 0.00 H new ATOM 0 HA ASN A 688 9.127 -2.840 -12.931 1.00 0.00 H new ATOM 0 HB2 ASN A 688 9.571 -3.581 -10.042 1.00 0.00 H new ATOM 0 HB3 ASN A 688 10.508 -2.328 -10.830 1.00 0.00 H new ATOM 0 HD21 ASN A 688 7.656 -0.751 -9.083 1.00 0.00 H new ATOM 0 HD22 ASN A 688 8.927 -1.883 -8.611 1.00 0.00 H new ATOM 1786 N PHE A 689 10.999 -5.393 -12.043 1.00 0.00 N ATOM 1787 CA PHE A 689 12.196 -6.142 -12.406 1.00 0.00 C ATOM 1788 C PHE A 689 12.239 -6.422 -13.902 1.00 0.00 C ATOM 1789 O PHE A 689 13.251 -6.178 -14.560 1.00 0.00 O ATOM 1790 CB PHE A 689 12.263 -7.454 -11.623 1.00 0.00 C ATOM 1791 CG PHE A 689 12.888 -7.318 -10.263 1.00 0.00 C ATOM 1792 CD1 PHE A 689 14.261 -7.182 -10.125 1.00 0.00 C ATOM 1793 CD2 PHE A 689 12.103 -7.324 -9.120 1.00 0.00 C ATOM 1794 CE1 PHE A 689 14.837 -7.057 -8.875 1.00 0.00 C ATOM 1795 CE2 PHE A 689 12.676 -7.198 -7.868 1.00 0.00 C ATOM 1796 CZ PHE A 689 14.043 -7.065 -7.746 1.00 0.00 C ATOM 0 H PHE A 689 10.403 -5.858 -11.358 1.00 0.00 H new ATOM 0 HA PHE A 689 13.062 -5.532 -12.150 1.00 0.00 H new ATOM 0 HB2 PHE A 689 11.254 -7.851 -11.511 1.00 0.00 H new ATOM 0 HB3 PHE A 689 12.830 -8.183 -12.202 1.00 0.00 H new ATOM 0 HD1 PHE A 689 14.888 -7.174 -11.005 1.00 0.00 H new ATOM 0 HD2 PHE A 689 11.032 -7.428 -9.209 1.00 0.00 H new ATOM 0 HE1 PHE A 689 15.908 -6.953 -8.782 1.00 0.00 H new ATOM 0 HE2 PHE A 689 12.053 -7.204 -6.986 1.00 0.00 H new ATOM 0 HZ PHE A 689 14.492 -6.967 -6.769 1.00 0.00 H new ATOM 1806 N ASN A 690 11.135 -6.935 -14.435 1.00 0.00 N ATOM 1807 CA ASN A 690 11.050 -7.263 -15.853 1.00 0.00 C ATOM 1808 C ASN A 690 11.062 -6.005 -16.712 1.00 0.00 C ATOM 1809 O ASN A 690 11.645 -5.988 -17.796 1.00 0.00 O ATOM 1810 CB ASN A 690 9.817 -8.094 -16.157 1.00 0.00 C ATOM 1811 CG ASN A 690 9.903 -9.510 -15.657 1.00 0.00 C ATOM 1812 OD1 ASN A 690 10.992 -10.032 -15.393 1.00 0.00 O ATOM 1813 ND2 ASN A 690 8.768 -10.160 -15.605 1.00 0.00 N ATOM 0 H ASN A 690 10.286 -7.133 -13.905 1.00 0.00 H new ATOM 0 HA ASN A 690 11.930 -7.857 -16.099 1.00 0.00 H new ATOM 0 HB2 ASN A 690 8.947 -7.613 -15.711 1.00 0.00 H new ATOM 0 HB3 ASN A 690 9.656 -8.108 -17.235 1.00 0.00 H new ATOM 0 HD21 ASN A 690 8.756 -11.144 -15.337 1.00 0.00 H new ATOM 0 HD22 ASN A 690 7.896 -9.682 -15.833 1.00 0.00 H new ATOM 1820 N GLU A 691 10.416 -4.953 -16.220 1.00 0.00 N ATOM 1821 CA GLU A 691 10.350 -3.689 -16.943 1.00 0.00 C ATOM 1822 C GLU A 691 11.742 -3.131 -17.207 1.00 0.00 C ATOM 1823 O GLU A 691 12.079 -2.785 -18.339 1.00 0.00 O ATOM 1824 CB GLU A 691 9.513 -2.671 -16.166 1.00 0.00 C ATOM 1825 CG GLU A 691 9.381 -1.315 -16.845 1.00 0.00 C ATOM 1826 CD GLU A 691 8.524 -0.380 -16.039 1.00 0.00 C ATOM 1827 OE1 GLU A 691 8.036 -0.789 -15.012 1.00 0.00 O ATOM 1828 OE2 GLU A 691 8.448 0.774 -16.387 1.00 0.00 O ATOM 0 H GLU A 691 9.931 -4.951 -15.323 1.00 0.00 H new ATOM 0 HA GLU A 691 9.873 -3.880 -17.904 1.00 0.00 H new ATOM 0 HB2 GLU A 691 8.516 -3.083 -16.008 1.00 0.00 H new ATOM 0 HB3 GLU A 691 9.958 -2.529 -15.181 1.00 0.00 H new ATOM 0 HG2 GLU A 691 10.370 -0.877 -16.983 1.00 0.00 H new ATOM 0 HG3 GLU A 691 8.948 -1.444 -17.837 1.00 0.00 H new ATOM 1835 N VAL A 692 12.549 -3.045 -16.154 1.00 0.00 N ATOM 1836 CA VAL A 692 13.910 -2.537 -16.271 1.00 0.00 C ATOM 1837 C VAL A 692 14.804 -3.522 -17.014 1.00 0.00 C ATOM 1838 O VAL A 692 15.704 -3.122 -17.753 1.00 0.00 O ATOM 1839 CB VAL A 692 14.524 -2.242 -14.890 1.00 0.00 C ATOM 1840 CG1 VAL A 692 16.000 -1.897 -15.026 1.00 0.00 C ATOM 1841 CG2 VAL A 692 13.775 -1.110 -14.204 1.00 0.00 C ATOM 0 H VAL A 692 12.283 -3.321 -15.209 1.00 0.00 H new ATOM 0 HA VAL A 692 13.850 -1.608 -16.837 1.00 0.00 H new ATOM 0 HB VAL A 692 14.434 -3.138 -14.275 1.00 0.00 H new ATOM 0 HG11 VAL A 692 16.418 -1.691 -14.041 1.00 0.00 H new ATOM 0 HG12 VAL A 692 16.530 -2.736 -15.477 1.00 0.00 H new ATOM 0 HG13 VAL A 692 16.111 -1.016 -15.658 1.00 0.00 H new ATOM 0 HG21 VAL A 692 14.223 -0.915 -13.229 1.00 0.00 H new ATOM 0 HG22 VAL A 692 13.834 -0.211 -14.817 1.00 0.00 H new ATOM 0 HG23 VAL A 692 12.730 -1.392 -14.073 1.00 0.00 H new ATOM 1851 N LEU A 693 14.551 -4.810 -16.813 1.00 0.00 N ATOM 1852 CA LEU A 693 15.255 -5.853 -17.549 1.00 0.00 C ATOM 1853 C LEU A 693 15.110 -5.660 -19.053 1.00 0.00 C ATOM 1854 O LEU A 693 16.078 -5.790 -19.801 1.00 0.00 O ATOM 1855 CB LEU A 693 14.736 -7.236 -17.136 1.00 0.00 C ATOM 1856 CG LEU A 693 15.548 -8.424 -17.667 1.00 0.00 C ATOM 1857 CD1 LEU A 693 16.931 -8.438 -17.029 1.00 0.00 C ATOM 1858 CD2 LEU A 693 14.806 -9.720 -17.374 1.00 0.00 C ATOM 0 H LEU A 693 13.862 -5.157 -16.145 1.00 0.00 H new ATOM 0 HA LEU A 693 16.315 -5.784 -17.302 1.00 0.00 H new ATOM 0 HB2 LEU A 693 14.715 -7.288 -16.047 1.00 0.00 H new ATOM 0 HB3 LEU A 693 13.707 -7.338 -17.480 1.00 0.00 H new ATOM 0 HG LEU A 693 15.671 -8.327 -18.746 1.00 0.00 H new ATOM 0 HD11 LEU A 693 17.500 -9.285 -17.412 1.00 0.00 H new ATOM 0 HD12 LEU A 693 17.452 -7.512 -17.270 1.00 0.00 H new ATOM 0 HD13 LEU A 693 16.832 -8.527 -15.947 1.00 0.00 H new ATOM 0 HD21 LEU A 693 15.384 -10.563 -17.752 1.00 0.00 H new ATOM 0 HD22 LEU A 693 14.670 -9.826 -16.298 1.00 0.00 H new ATOM 0 HD23 LEU A 693 13.832 -9.700 -17.862 1.00 0.00 H new ATOM 1870 N GLU A 694 13.894 -5.350 -19.490 1.00 0.00 N ATOM 1871 CA GLU A 694 13.618 -5.144 -20.907 1.00 0.00 C ATOM 1872 C GLU A 694 13.922 -3.711 -21.324 1.00 0.00 C ATOM 1873 O GLU A 694 14.114 -3.426 -22.506 1.00 0.00 O ATOM 1874 CB GLU A 694 12.161 -5.487 -21.224 1.00 0.00 C ATOM 1875 CG GLU A 694 11.805 -6.955 -21.034 1.00 0.00 C ATOM 1876 CD GLU A 694 10.366 -7.217 -21.380 1.00 0.00 C ATOM 1877 OE1 GLU A 694 9.512 -6.574 -20.818 1.00 0.00 O ATOM 1878 OE2 GLU A 694 10.123 -7.979 -22.287 1.00 0.00 O ATOM 0 H GLU A 694 13.083 -5.236 -18.882 1.00 0.00 H new ATOM 0 HA GLU A 694 14.269 -5.809 -21.474 1.00 0.00 H new ATOM 0 HB2 GLU A 694 11.512 -4.883 -20.590 1.00 0.00 H new ATOM 0 HB3 GLU A 694 11.950 -5.205 -22.256 1.00 0.00 H new ATOM 0 HG2 GLU A 694 12.450 -7.572 -21.660 1.00 0.00 H new ATOM 0 HG3 GLU A 694 11.991 -7.246 -20.000 1.00 0.00 H new ATOM 1885 N GLU A 695 13.963 -2.811 -20.347 1.00 0.00 N ATOM 1886 CA GLU A 695 14.309 -1.418 -20.603 1.00 0.00 C ATOM 1887 C GLU A 695 15.635 -1.306 -21.343 1.00 0.00 C ATOM 1888 O GLU A 695 15.747 -0.579 -22.330 1.00 0.00 O ATOM 1889 CB GLU A 695 14.371 -0.632 -19.291 1.00 0.00 C ATOM 1890 CG GLU A 695 14.721 0.840 -19.456 1.00 0.00 C ATOM 1891 CD GLU A 695 14.700 1.557 -18.135 1.00 0.00 C ATOM 1892 OE1 GLU A 695 15.379 1.125 -17.235 1.00 0.00 O ATOM 1893 OE2 GLU A 695 14.095 2.601 -18.058 1.00 0.00 O ATOM 0 H GLU A 695 13.761 -3.022 -19.370 1.00 0.00 H new ATOM 0 HA GLU A 695 13.530 -0.992 -21.235 1.00 0.00 H new ATOM 0 HB2 GLU A 695 13.406 -0.710 -18.789 1.00 0.00 H new ATOM 0 HB3 GLU A 695 15.109 -1.097 -18.637 1.00 0.00 H new ATOM 0 HG2 GLU A 695 15.709 0.933 -19.907 1.00 0.00 H new ATOM 0 HG3 GLU A 695 14.013 1.310 -20.139 1.00 0.00 H new ATOM 1900 N TYR A 696 16.639 -2.032 -20.862 1.00 0.00 N ATOM 1901 CA TYR A 696 17.947 -2.052 -21.505 1.00 0.00 C ATOM 1902 C TYR A 696 18.064 -3.218 -22.479 1.00 0.00 C ATOM 1903 O TYR A 696 17.918 -4.378 -22.094 1.00 0.00 O ATOM 1904 CB TYR A 696 19.058 -2.131 -20.456 1.00 0.00 C ATOM 1905 CG TYR A 696 19.132 -0.923 -19.549 1.00 0.00 C ATOM 1906 CD1 TYR A 696 19.789 0.230 -19.953 1.00 0.00 C ATOM 1907 CD2 TYR A 696 18.547 -0.939 -18.291 1.00 0.00 C ATOM 1908 CE1 TYR A 696 19.860 1.336 -19.129 1.00 0.00 C ATOM 1909 CE2 TYR A 696 18.612 0.161 -17.459 1.00 0.00 C ATOM 1910 CZ TYR A 696 19.270 1.298 -17.882 1.00 0.00 C ATOM 1911 OH TYR A 696 19.339 2.397 -17.057 1.00 0.00 O ATOM 0 H TYR A 696 16.571 -2.615 -20.028 1.00 0.00 H new ATOM 0 HA TYR A 696 18.056 -1.125 -22.068 1.00 0.00 H new ATOM 0 HB2 TYR A 696 18.906 -3.022 -19.847 1.00 0.00 H new ATOM 0 HB3 TYR A 696 20.015 -2.251 -20.963 1.00 0.00 H new ATOM 0 HD1 TYR A 696 20.253 0.263 -20.928 1.00 0.00 H new ATOM 0 HD2 TYR A 696 18.032 -1.827 -17.957 1.00 0.00 H new ATOM 0 HE1 TYR A 696 20.375 2.226 -19.459 1.00 0.00 H new ATOM 0 HE2 TYR A 696 18.151 0.132 -16.483 1.00 0.00 H new ATOM 0 HH TYR A 696 18.433 2.710 -16.853 1.00 0.00 H new ATOM 1921 N PRO A 697 18.328 -2.902 -23.742 1.00 0.00 N ATOM 1922 CA PRO A 697 18.456 -3.922 -24.776 1.00 0.00 C ATOM 1923 C PRO A 697 19.487 -4.974 -24.387 1.00 0.00 C ATOM 1924 O PRO A 697 19.345 -6.150 -24.721 1.00 0.00 O ATOM 1925 CB PRO A 697 18.874 -3.140 -26.025 1.00 0.00 C ATOM 1926 CG PRO A 697 18.274 -1.789 -25.835 1.00 0.00 C ATOM 1927 CD PRO A 697 18.413 -1.494 -24.365 1.00 0.00 C ATOM 0 HA PRO A 697 17.533 -4.479 -24.936 1.00 0.00 H new ATOM 0 HB2 PRO A 697 19.959 -3.084 -26.114 1.00 0.00 H new ATOM 0 HB3 PRO A 697 18.504 -3.615 -26.934 1.00 0.00 H new ATOM 0 HG2 PRO A 697 18.791 -1.041 -26.437 1.00 0.00 H new ATOM 0 HG3 PRO A 697 17.228 -1.777 -26.141 1.00 0.00 H new ATOM 0 HD2 PRO A 697 19.359 -1.004 -24.136 1.00 0.00 H new ATOM 0 HD3 PRO A 697 17.619 -0.840 -24.004 1.00 0.00 H new ATOM 1935 N MET A 698 20.526 -4.543 -23.679 1.00 0.00 N ATOM 1936 CA MET A 698 21.595 -5.443 -23.262 1.00 0.00 C ATOM 1937 C MET A 698 21.098 -6.449 -22.232 1.00 0.00 C ATOM 1938 O MET A 698 21.598 -7.571 -22.154 1.00 0.00 O ATOM 1939 CB MET A 698 22.767 -4.643 -22.698 1.00 0.00 C ATOM 1940 CG MET A 698 23.502 -3.793 -23.724 1.00 0.00 C ATOM 1941 SD MET A 698 24.191 -4.772 -25.074 1.00 0.00 S ATOM 1942 CE MET A 698 25.467 -5.685 -24.212 1.00 0.00 C ATOM 0 H MET A 698 20.650 -3.575 -23.382 1.00 0.00 H new ATOM 0 HA MET A 698 21.932 -5.997 -24.138 1.00 0.00 H new ATOM 0 HB2 MET A 698 22.399 -3.994 -21.904 1.00 0.00 H new ATOM 0 HB3 MET A 698 23.476 -5.334 -22.242 1.00 0.00 H new ATOM 0 HG2 MET A 698 22.817 -3.050 -24.132 1.00 0.00 H new ATOM 0 HG3 MET A 698 24.306 -3.248 -23.229 1.00 0.00 H new ATOM 0 HE1 MET A 698 26.140 -6.142 -24.937 1.00 0.00 H new ATOM 0 HE2 MET A 698 26.030 -5.006 -23.571 1.00 0.00 H new ATOM 0 HE3 MET A 698 25.008 -6.463 -23.602 1.00 0.00 H new ATOM 1952 N MET A 699 20.112 -6.040 -21.441 1.00 0.00 N ATOM 1953 CA MET A 699 19.560 -6.898 -20.399 1.00 0.00 C ATOM 1954 C MET A 699 18.299 -7.606 -20.878 1.00 0.00 C ATOM 1955 O MET A 699 17.894 -8.622 -20.314 1.00 0.00 O ATOM 1956 CB MET A 699 19.261 -6.078 -19.145 1.00 0.00 C ATOM 1957 CG MET A 699 20.487 -5.455 -18.493 1.00 0.00 C ATOM 1958 SD MET A 699 21.680 -6.688 -17.934 1.00 0.00 S ATOM 1959 CE MET A 699 20.785 -7.431 -16.573 1.00 0.00 C ATOM 0 H MET A 699 19.678 -5.119 -21.502 1.00 0.00 H new ATOM 0 HA MET A 699 20.303 -7.659 -20.159 1.00 0.00 H new ATOM 0 HB2 MET A 699 18.560 -5.285 -19.403 1.00 0.00 H new ATOM 0 HB3 MET A 699 18.764 -6.719 -18.417 1.00 0.00 H new ATOM 0 HG2 MET A 699 20.970 -4.784 -19.203 1.00 0.00 H new ATOM 0 HG3 MET A 699 20.173 -4.848 -17.644 1.00 0.00 H new ATOM 0 HE1 MET A 699 21.472 -8.015 -15.961 1.00 0.00 H new ATOM 0 HE2 MET A 699 20.333 -6.648 -15.964 1.00 0.00 H new ATOM 0 HE3 MET A 699 20.004 -8.083 -16.964 1.00 0.00 H new ATOM 1969 N ARG A 700 17.683 -7.064 -21.923 1.00 0.00 N ATOM 1970 CA ARG A 700 16.436 -7.610 -22.445 1.00 0.00 C ATOM 1971 C ARG A 700 16.602 -9.067 -22.856 1.00 0.00 C ATOM 1972 O ARG A 700 15.675 -9.867 -22.731 1.00 0.00 O ATOM 1973 CB ARG A 700 15.874 -6.771 -23.583 1.00 0.00 C ATOM 1974 CG ARG A 700 14.503 -7.202 -24.080 1.00 0.00 C ATOM 1975 CD ARG A 700 13.931 -6.327 -25.134 1.00 0.00 C ATOM 1976 NE ARG A 700 13.828 -4.925 -24.764 1.00 0.00 N ATOM 1977 CZ ARG A 700 13.872 -3.898 -25.636 1.00 0.00 C ATOM 1978 NH1 ARG A 700 14.053 -4.108 -26.921 1.00 0.00 N ATOM 1979 NH2 ARG A 700 13.752 -2.671 -25.161 1.00 0.00 N ATOM 0 H ARG A 700 18.028 -6.246 -22.426 1.00 0.00 H new ATOM 0 HA ARG A 700 15.707 -7.572 -21.636 1.00 0.00 H new ATOM 0 HB2 ARG A 700 15.816 -5.733 -23.255 1.00 0.00 H new ATOM 0 HB3 ARG A 700 16.574 -6.803 -24.418 1.00 0.00 H new ATOM 0 HG2 ARG A 700 14.573 -8.219 -24.467 1.00 0.00 H new ATOM 0 HG3 ARG A 700 13.815 -7.229 -23.235 1.00 0.00 H new ATOM 0 HD2 ARG A 700 14.547 -6.409 -26.030 1.00 0.00 H new ATOM 0 HD3 ARG A 700 12.939 -6.695 -25.394 1.00 0.00 H new ATOM 0 HE ARG A 700 13.714 -4.703 -23.775 1.00 0.00 H new ATOM 0 HH11 ARG A 700 14.163 -5.059 -27.272 1.00 0.00 H new ATOM 0 HH12 ARG A 700 14.084 -3.319 -27.567 1.00 0.00 H new ATOM 0 HH21 ARG A 700 13.630 -2.522 -24.159 1.00 0.00 H new ATOM 0 HH22 ARG A 700 13.781 -1.873 -25.796 1.00 0.00 H new