USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 693 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 781 THR OG1 : rot 75:sc= 1.11 USER MOD Set 1.2: A 782 HIS : no HD1:sc= 1.05 K(o=2.2,f=-1.2) USER MOD Single : A 718 SER OG : rot 180:sc= 0.0107 USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 721 SER OG : rot 55:sc= -0.203! USER MOD Single : A 724 SER OG : rot 80:sc= 0.974 USER MOD Single : A 725 ASN : amide:sc= -0.0124 K(o=-0.012,f=-0.91) USER MOD Single : A 730 HIS : no HE2:sc= -0.696 K(o=-0.7,f=-4.1!) USER MOD Single : A 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 SER OG : rot -170:sc= 0 USER MOD Single : A 744 LYS NZ :NH3+ 173:sc=-0.000938 (180deg=-0.0491) USER MOD Single : A 746 SER OG : rot 180:sc= 0 USER MOD Single : A 750 ASN : amide:sc= 0.765 K(o=0.77,f=-0.018) USER MOD Single : A 752 TYR OH : rot -30:sc= -0.305 USER MOD Single : A 754 LYS NZ :NH3+ 158:sc= 1.1 (180deg=-0.114) USER MOD Single : A 758 SER OG : rot 180:sc= 0 USER MOD Single : A 762 SER OG : rot 180:sc= 0 USER MOD Single : A 768 ASN : amide:sc= -0.0922 X(o=-0.092,f=0) USER MOD Single : A 769 LYS NZ :NH3+ -179:sc= 0.451 (180deg=0.451) USER MOD Single : A 770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0506) USER MOD Single : A 778 HIS : no HD1:sc= -0.582 X(o=-0.58,f=-0.11) USER MOD Single : A 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 785 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 814 ASN : amide:sc= -0.0175 K(o=-0.018,f=-1.7) USER MOD Single : A 816 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 817 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -17.464 -0.858 -0.534 1.00 0.00 N ATOM 138 CA PHE A 717 -16.084 -0.721 -0.129 1.00 0.00 C ATOM 139 C PHE A 717 -15.713 -1.471 1.142 1.00 0.00 C ATOM 140 O PHE A 717 -14.693 -1.146 1.752 1.00 0.00 O ATOM 141 CB PHE A 717 -15.801 0.768 0.069 1.00 0.00 C ATOM 142 CG PHE A 717 -16.736 1.475 1.058 1.00 0.00 C ATOM 143 CD1 PHE A 717 -16.423 1.541 2.403 1.00 0.00 C ATOM 144 CD2 PHE A 717 -17.903 2.084 0.628 1.00 0.00 C ATOM 145 CE1 PHE A 717 -17.241 2.193 3.296 1.00 0.00 C ATOM 146 CE2 PHE A 717 -18.732 2.736 1.521 1.00 0.00 C ATOM 147 CZ PHE A 717 -18.393 2.791 2.857 1.00 0.00 C ATOM 0 HA PHE A 717 -15.478 -1.166 -0.918 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -14.774 0.885 0.415 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -15.871 1.268 -0.897 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -15.518 1.071 2.760 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -18.169 2.049 -0.418 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -16.976 2.234 4.342 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -19.643 3.201 1.174 1.00 0.00 H new ATOM 0 HZ PHE A 717 -19.035 3.305 3.557 1.00 0.00 H new ATOM 157 N SER A 718 -16.470 -2.471 1.526 1.00 0.00 N ATOM 158 CA SER A 718 -16.186 -3.189 2.766 1.00 0.00 C ATOM 159 C SER A 718 -14.768 -3.816 2.776 1.00 0.00 C ATOM 160 O SER A 718 -14.026 -3.698 3.763 1.00 0.00 O ATOM 161 CB SER A 718 -17.286 -4.210 3.049 1.00 0.00 C ATOM 162 OG SER A 718 -17.635 -4.937 1.873 1.00 0.00 O ATOM 0 H SER A 718 -17.282 -2.811 1.010 1.00 0.00 H new ATOM 0 HA SER A 718 -16.186 -2.467 3.582 1.00 0.00 H new ATOM 0 HB2 SER A 718 -16.952 -4.903 3.821 1.00 0.00 H new ATOM 0 HB3 SER A 718 -18.167 -3.700 3.438 1.00 0.00 H new ATOM 0 HG SER A 718 -18.340 -5.584 2.085 1.00 0.00 H new ATOM 168 N GLU A 719 -14.389 -4.419 1.673 1.00 0.00 N ATOM 169 CA GLU A 719 -13.063 -5.002 1.520 1.00 0.00 C ATOM 170 C GLU A 719 -12.025 -3.918 1.285 1.00 0.00 C ATOM 171 O GLU A 719 -10.943 -3.963 1.862 1.00 0.00 O ATOM 172 CB GLU A 719 -13.026 -6.087 0.413 1.00 0.00 C ATOM 173 CG GLU A 719 -13.225 -5.598 -1.033 1.00 0.00 C ATOM 174 CD GLU A 719 -14.516 -4.858 -1.251 1.00 0.00 C ATOM 175 OE1 GLU A 719 -15.531 -5.494 -1.548 1.00 0.00 O ATOM 176 OE2 GLU A 719 -14.533 -3.629 -1.103 1.00 0.00 O ATOM 0 H GLU A 719 -14.986 -4.523 0.853 1.00 0.00 H new ATOM 0 HA GLU A 719 -12.815 -5.508 2.453 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -12.067 -6.601 0.471 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -13.797 -6.826 0.633 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -12.394 -4.947 -1.304 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -13.191 -6.456 -1.705 1.00 0.00 H new ATOM 183 N TYR A 720 -12.382 -2.927 0.466 1.00 0.00 N ATOM 184 CA TYR A 720 -11.506 -1.802 0.145 1.00 0.00 C ATOM 185 C TYR A 720 -11.078 -1.085 1.426 1.00 0.00 C ATOM 186 O TYR A 720 -9.934 -0.613 1.550 1.00 0.00 O ATOM 187 CB TYR A 720 -12.216 -0.824 -0.817 1.00 0.00 C ATOM 188 CG TYR A 720 -11.357 0.351 -1.247 1.00 0.00 C ATOM 189 CD1 TYR A 720 -10.496 0.243 -2.326 1.00 0.00 C ATOM 190 CD2 TYR A 720 -11.397 1.559 -0.561 1.00 0.00 C ATOM 191 CE1 TYR A 720 -9.697 1.300 -2.709 1.00 0.00 C ATOM 192 CE2 TYR A 720 -10.598 2.617 -0.934 1.00 0.00 C ATOM 193 CZ TYR A 720 -9.750 2.483 -2.010 1.00 0.00 C ATOM 194 OH TYR A 720 -8.940 3.533 -2.380 1.00 0.00 O ATOM 0 H TYR A 720 -13.291 -2.883 0.005 1.00 0.00 H new ATOM 0 HA TYR A 720 -10.614 -2.182 -0.353 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -12.536 -1.371 -1.704 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.117 -0.445 -0.334 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -10.449 -0.685 -2.877 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -12.066 1.670 0.279 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -9.033 1.199 -3.554 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -10.637 3.546 -0.385 1.00 0.00 H new ATOM 0 HH TYR A 720 -9.100 4.295 -1.785 1.00 0.00 H new ATOM 204 N SER A 721 -11.987 -1.040 2.380 1.00 0.00 N ATOM 205 CA SER A 721 -11.729 -0.442 3.659 1.00 0.00 C ATOM 206 C SER A 721 -10.667 -1.206 4.427 1.00 0.00 C ATOM 207 O SER A 721 -9.883 -0.607 5.120 1.00 0.00 O ATOM 208 CB SER A 721 -12.998 -0.355 4.474 1.00 0.00 C ATOM 209 OG SER A 721 -13.963 0.432 3.815 1.00 0.00 O ATOM 0 H SER A 721 -12.928 -1.421 2.281 1.00 0.00 H new ATOM 0 HA SER A 721 -11.355 0.566 3.478 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.394 -1.356 4.646 1.00 0.00 H new ATOM 0 HB3 SER A 721 -12.779 0.074 5.452 1.00 0.00 H new ATOM 0 HG SER A 721 -14.114 0.078 2.914 1.00 0.00 H new ATOM 215 N ARG A 722 -10.621 -2.525 4.268 1.00 0.00 N ATOM 216 CA ARG A 722 -9.620 -3.326 4.964 1.00 0.00 C ATOM 217 C ARG A 722 -8.251 -3.048 4.384 1.00 0.00 C ATOM 218 O ARG A 722 -7.264 -2.932 5.121 1.00 0.00 O ATOM 219 CB ARG A 722 -9.934 -4.828 4.913 1.00 0.00 C ATOM 220 CG ARG A 722 -11.230 -5.233 5.604 1.00 0.00 C ATOM 221 CD ARG A 722 -11.272 -4.779 7.065 1.00 0.00 C ATOM 222 NE ARG A 722 -10.118 -5.251 7.855 1.00 0.00 N ATOM 223 CZ ARG A 722 -10.053 -5.248 9.194 1.00 0.00 C ATOM 224 NH1 ARG A 722 -11.104 -4.850 9.917 1.00 0.00 N ATOM 225 NH2 ARG A 722 -8.934 -5.645 9.804 1.00 0.00 N ATOM 0 H ARG A 722 -11.256 -3.056 3.672 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.637 -3.037 6.015 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -9.982 -5.140 3.870 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -9.109 -5.373 5.371 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -12.076 -4.803 5.067 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -11.341 -6.316 5.559 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -11.306 -3.690 7.099 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -12.191 -5.142 7.525 1.00 0.00 H new ATOM 0 HE ARG A 722 -9.310 -5.606 7.344 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -11.959 -4.547 9.450 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -11.051 -4.849 10.936 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -8.132 -5.949 9.252 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -8.881 -5.644 10.823 1.00 0.00 H new ATOM 239 N ILE A 723 -8.199 -2.913 3.068 1.00 0.00 N ATOM 240 CA ILE A 723 -6.948 -2.546 2.396 1.00 0.00 C ATOM 241 C ILE A 723 -6.474 -1.137 2.868 1.00 0.00 C ATOM 242 O ILE A 723 -5.321 -0.940 3.305 1.00 0.00 O ATOM 243 CB ILE A 723 -7.063 -2.568 0.820 1.00 0.00 C ATOM 244 CG1 ILE A 723 -7.081 -4.000 0.242 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.949 -1.771 0.162 1.00 0.00 C ATOM 246 CD1 ILE A 723 -8.343 -4.790 0.471 1.00 0.00 C ATOM 0 H ILE A 723 -8.995 -3.049 2.444 1.00 0.00 H new ATOM 0 HA ILE A 723 -6.213 -3.301 2.675 1.00 0.00 H new ATOM 0 HB ILE A 723 -8.020 -2.099 0.591 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -6.904 -3.939 -0.832 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -6.246 -4.554 0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -6.064 -1.811 -0.921 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -5.998 -0.734 0.494 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -4.984 -2.196 0.440 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -8.240 -5.778 0.022 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -8.518 -4.895 1.542 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -9.186 -4.270 0.015 1.00 0.00 H new ATOM 258 N SER A 724 -7.383 -0.187 2.816 1.00 0.00 N ATOM 259 CA SER A 724 -7.094 1.192 3.202 1.00 0.00 C ATOM 260 C SER A 724 -6.761 1.293 4.703 1.00 0.00 C ATOM 261 O SER A 724 -5.915 2.096 5.116 1.00 0.00 O ATOM 262 CB SER A 724 -8.285 2.067 2.838 1.00 0.00 C ATOM 263 OG SER A 724 -8.620 1.880 1.469 1.00 0.00 O ATOM 0 H SER A 724 -8.343 -0.340 2.507 1.00 0.00 H new ATOM 0 HA SER A 724 -6.215 1.541 2.660 1.00 0.00 H new ATOM 0 HB2 SER A 724 -9.138 1.816 3.468 1.00 0.00 H new ATOM 0 HB3 SER A 724 -8.049 3.115 3.024 1.00 0.00 H new ATOM 0 HG SER A 724 -9.146 1.059 1.370 1.00 0.00 H new ATOM 269 N ASN A 725 -7.396 0.440 5.495 1.00 0.00 N ATOM 270 CA ASN A 725 -7.176 0.374 6.937 1.00 0.00 C ATOM 271 C ASN A 725 -5.756 -0.106 7.192 1.00 0.00 C ATOM 272 O ASN A 725 -5.098 0.366 8.104 1.00 0.00 O ATOM 273 CB ASN A 725 -8.181 -0.591 7.578 1.00 0.00 C ATOM 274 CG ASN A 725 -8.278 -0.477 9.081 1.00 0.00 C ATOM 275 OD1 ASN A 725 -8.091 0.598 9.652 1.00 0.00 O ATOM 276 ND2 ASN A 725 -8.593 -1.571 9.731 1.00 0.00 N ATOM 0 H ASN A 725 -8.084 -0.232 5.154 1.00 0.00 H new ATOM 0 HA ASN A 725 -7.316 1.361 7.378 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -9.166 -0.411 7.147 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -7.902 -1.613 7.320 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -8.691 -1.551 10.746 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -8.740 -2.442 9.222 1.00 0.00 H new ATOM 283 N LEU A 726 -5.273 -1.028 6.338 1.00 0.00 N ATOM 284 CA LEU A 726 -3.896 -1.483 6.402 1.00 0.00 C ATOM 285 C LEU A 726 -2.966 -0.317 6.242 1.00 0.00 C ATOM 286 O LEU A 726 -2.039 -0.168 7.003 1.00 0.00 O ATOM 287 CB LEU A 726 -3.599 -2.599 5.344 1.00 0.00 C ATOM 288 CG LEU A 726 -2.108 -2.794 4.901 1.00 0.00 C ATOM 289 CD1 LEU A 726 -1.887 -4.175 4.401 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.739 -1.853 3.766 1.00 0.00 C ATOM 0 H LEU A 726 -5.826 -1.465 5.600 1.00 0.00 H new ATOM 0 HA LEU A 726 -3.731 -1.931 7.382 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -3.958 -3.547 5.744 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -4.190 -2.385 4.453 1.00 0.00 H new ATOM 0 HG LEU A 726 -1.495 -2.590 5.779 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -0.846 -4.290 4.098 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -2.116 -4.889 5.192 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -2.536 -4.360 3.545 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.699 -2.014 3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -2.383 -2.048 2.908 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.871 -0.821 4.092 1.00 0.00 H new ATOM 302 N ILE A 727 -3.252 0.522 5.269 1.00 0.00 N ATOM 303 CA ILE A 727 -2.407 1.667 4.979 1.00 0.00 C ATOM 304 C ILE A 727 -2.298 2.604 6.162 1.00 0.00 C ATOM 305 O ILE A 727 -1.185 2.924 6.610 1.00 0.00 O ATOM 306 CB ILE A 727 -2.855 2.421 3.685 1.00 0.00 C ATOM 307 CG1 ILE A 727 -2.426 1.645 2.434 1.00 0.00 C ATOM 308 CG2 ILE A 727 -2.319 3.846 3.637 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.912 1.537 2.286 1.00 0.00 C ATOM 0 H ILE A 727 -4.067 0.434 4.661 1.00 0.00 H new ATOM 0 HA ILE A 727 -1.409 1.274 4.786 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.943 2.484 3.708 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.854 0.643 2.471 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.837 2.135 1.551 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -2.656 4.331 2.721 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -2.688 4.403 4.499 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -1.229 3.826 3.657 1.00 0.00 H new ATOM 0 HD11 ILE A 727 -0.674 0.977 1.382 1.00 0.00 H new ATOM 0 HD12 ILE A 727 -0.481 2.536 2.218 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.498 1.021 3.152 1.00 0.00 H new ATOM 321 N VAL A 728 -3.426 2.994 6.695 1.00 0.00 N ATOM 322 CA VAL A 728 -3.437 3.911 7.798 1.00 0.00 C ATOM 323 C VAL A 728 -2.815 3.280 9.072 1.00 0.00 C ATOM 324 O VAL A 728 -1.996 3.910 9.744 1.00 0.00 O ATOM 325 CB VAL A 728 -4.863 4.522 8.047 1.00 0.00 C ATOM 326 CG1 VAL A 728 -5.917 3.455 8.247 1.00 0.00 C ATOM 327 CG2 VAL A 728 -4.871 5.466 9.221 1.00 0.00 C ATOM 0 H VAL A 728 -4.348 2.690 6.381 1.00 0.00 H new ATOM 0 HA VAL A 728 -2.798 4.752 7.529 1.00 0.00 H new ATOM 0 HB VAL A 728 -5.109 5.082 7.145 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -6.885 3.927 8.415 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -5.970 2.825 7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -5.656 2.843 9.111 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -5.875 5.866 9.359 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.567 4.931 10.120 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -4.176 6.285 9.034 1.00 0.00 H new ATOM 337 N LEU A 729 -3.160 2.024 9.353 1.00 0.00 N ATOM 338 CA LEU A 729 -2.640 1.315 10.522 1.00 0.00 C ATOM 339 C LEU A 729 -1.168 1.039 10.427 1.00 0.00 C ATOM 340 O LEU A 729 -0.431 1.325 11.356 1.00 0.00 O ATOM 341 CB LEU A 729 -3.366 0.010 10.729 1.00 0.00 C ATOM 342 CG LEU A 729 -4.752 0.112 11.304 1.00 0.00 C ATOM 343 CD1 LEU A 729 -5.480 -1.186 11.060 1.00 0.00 C ATOM 344 CD2 LEU A 729 -4.670 0.380 12.799 1.00 0.00 C ATOM 0 H LEU A 729 -3.802 1.473 8.783 1.00 0.00 H new ATOM 0 HA LEU A 729 -2.809 1.977 11.372 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -3.429 -0.504 9.770 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -2.765 -0.617 11.388 1.00 0.00 H new ATOM 0 HG LEU A 729 -5.289 0.932 10.826 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -6.486 -1.122 11.474 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -5.539 -1.374 9.988 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -4.941 -2.002 11.542 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -5.676 0.453 13.211 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -4.137 -0.436 13.286 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -4.138 1.315 12.972 1.00 0.00 H new ATOM 356 N HIS A 730 -0.739 0.490 9.311 1.00 0.00 N ATOM 357 CA HIS A 730 0.646 0.104 9.137 1.00 0.00 C ATOM 358 C HIS A 730 1.543 1.302 9.293 1.00 0.00 C ATOM 359 O HIS A 730 2.445 1.274 10.099 1.00 0.00 O ATOM 360 CB HIS A 730 0.864 -0.590 7.782 1.00 0.00 C ATOM 361 CG HIS A 730 2.254 -1.122 7.559 1.00 0.00 C ATOM 362 ND1 HIS A 730 2.690 -2.341 8.019 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.300 -0.584 6.889 1.00 0.00 C ATOM 364 CE1 HIS A 730 3.952 -2.507 7.627 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.370 -1.469 6.932 1.00 0.00 N ATOM 0 H HIS A 730 -1.334 0.300 8.505 1.00 0.00 H new ATOM 0 HA HIS A 730 0.904 -0.617 9.912 1.00 0.00 H new ATOM 0 HB2 HIS A 730 0.157 -1.415 7.695 1.00 0.00 H new ATOM 0 HB3 HIS A 730 0.629 0.117 6.986 1.00 0.00 H new ATOM 0 HD1 HIS A 730 2.142 -3.004 8.566 1.00 0.00 H new ATOM 0 HD2 HIS A 730 3.302 0.379 6.400 1.00 0.00 H new ATOM 0 HE1 HIS A 730 4.553 -3.377 7.849 1.00 0.00 H new ATOM 373 N LEU A 731 1.238 2.365 8.576 1.00 0.00 N ATOM 374 CA LEU A 731 2.033 3.579 8.636 1.00 0.00 C ATOM 375 C LEU A 731 2.105 4.131 10.078 1.00 0.00 C ATOM 376 O LEU A 731 3.203 4.428 10.575 1.00 0.00 O ATOM 377 CB LEU A 731 1.474 4.602 7.612 1.00 0.00 C ATOM 378 CG LEU A 731 2.180 5.974 7.419 1.00 0.00 C ATOM 379 CD1 LEU A 731 1.988 6.918 8.605 1.00 0.00 C ATOM 380 CD2 LEU A 731 3.654 5.777 7.114 1.00 0.00 C ATOM 0 H LEU A 731 0.441 2.414 7.941 1.00 0.00 H new ATOM 0 HA LEU A 731 3.065 3.363 8.358 1.00 0.00 H new ATOM 0 HB2 LEU A 731 1.452 4.109 6.640 1.00 0.00 H new ATOM 0 HB3 LEU A 731 0.440 4.806 7.889 1.00 0.00 H new ATOM 0 HG LEU A 731 1.702 6.455 6.565 1.00 0.00 H new ATOM 0 HD11 LEU A 731 2.504 7.858 8.409 1.00 0.00 H new ATOM 0 HD12 LEU A 731 0.925 7.111 8.748 1.00 0.00 H new ATOM 0 HD13 LEU A 731 2.398 6.460 9.505 1.00 0.00 H new ATOM 0 HD21 LEU A 731 4.131 6.748 6.982 1.00 0.00 H new ATOM 0 HD22 LEU A 731 4.129 5.248 7.940 1.00 0.00 H new ATOM 0 HD23 LEU A 731 3.762 5.193 6.200 1.00 0.00 H new ATOM 392 N ARG A 732 0.958 4.217 10.759 1.00 0.00 N ATOM 393 CA ARG A 732 0.940 4.770 12.111 1.00 0.00 C ATOM 394 C ARG A 732 1.670 3.855 13.104 1.00 0.00 C ATOM 395 O ARG A 732 2.237 4.324 14.096 1.00 0.00 O ATOM 396 CB ARG A 732 -0.480 5.094 12.593 1.00 0.00 C ATOM 397 CG ARG A 732 -1.386 3.896 12.798 1.00 0.00 C ATOM 398 CD ARG A 732 -2.755 4.324 13.289 1.00 0.00 C ATOM 399 NE ARG A 732 -2.643 5.126 14.525 1.00 0.00 N ATOM 400 CZ ARG A 732 -3.528 6.038 14.945 1.00 0.00 C ATOM 401 NH1 ARG A 732 -4.710 6.156 14.353 1.00 0.00 N ATOM 402 NH2 ARG A 732 -3.232 6.809 15.980 1.00 0.00 N ATOM 0 H ARG A 732 0.050 3.917 10.404 1.00 0.00 H new ATOM 0 HA ARG A 732 1.482 5.715 12.067 1.00 0.00 H new ATOM 0 HB2 ARG A 732 -0.410 5.641 13.533 1.00 0.00 H new ATOM 0 HB3 ARG A 732 -0.947 5.762 11.870 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -1.487 3.348 11.861 1.00 0.00 H new ATOM 0 HG3 ARG A 732 -0.935 3.214 13.519 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -3.257 4.906 12.517 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -3.371 3.444 13.476 1.00 0.00 H new ATOM 0 HE ARG A 732 -1.821 4.971 15.108 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -4.951 5.548 13.570 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -5.377 6.854 14.681 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -2.334 6.706 16.452 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -3.902 7.506 16.305 1.00 0.00 H new ATOM 416 N LYS A 733 1.651 2.565 12.845 1.00 0.00 N ATOM 417 CA LYS A 733 2.390 1.627 13.659 1.00 0.00 C ATOM 418 C LYS A 733 3.869 1.765 13.394 1.00 0.00 C ATOM 419 O LYS A 733 4.653 1.906 14.313 1.00 0.00 O ATOM 420 CB LYS A 733 1.964 0.190 13.393 1.00 0.00 C ATOM 421 CG LYS A 733 0.584 -0.185 13.915 1.00 0.00 C ATOM 422 CD LYS A 733 0.207 -1.603 13.501 1.00 0.00 C ATOM 423 CE LYS A 733 1.248 -2.616 13.955 1.00 0.00 C ATOM 424 NZ LYS A 733 0.921 -3.978 13.528 1.00 0.00 N ATOM 0 H LYS A 733 1.131 2.143 12.076 1.00 0.00 H new ATOM 0 HA LYS A 733 2.174 1.859 14.702 1.00 0.00 H new ATOM 0 HB2 LYS A 733 1.988 0.014 12.318 1.00 0.00 H new ATOM 0 HB3 LYS A 733 2.699 -0.479 13.842 1.00 0.00 H new ATOM 0 HG2 LYS A 733 0.569 -0.104 15.002 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -0.156 0.518 13.532 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -0.762 -1.861 13.927 1.00 0.00 H new ATOM 0 HD3 LYS A 733 0.102 -1.650 12.417 1.00 0.00 H new ATOM 0 HE2 LYS A 733 2.223 -2.336 13.555 1.00 0.00 H new ATOM 0 HE3 LYS A 733 1.329 -2.588 15.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 1.658 -4.632 13.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 0.003 -4.257 13.930 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 0.869 -4.013 12.490 1.00 0.00 H new ATOM 438 N VAL A 734 4.228 1.769 12.130 1.00 0.00 N ATOM 439 CA VAL A 734 5.606 1.830 11.690 1.00 0.00 C ATOM 440 C VAL A 734 6.339 3.059 12.224 1.00 0.00 C ATOM 441 O VAL A 734 7.415 2.917 12.778 1.00 0.00 O ATOM 442 CB VAL A 734 5.717 1.719 10.142 1.00 0.00 C ATOM 443 CG1 VAL A 734 7.116 1.981 9.659 1.00 0.00 C ATOM 444 CG2 VAL A 734 5.301 0.338 9.698 1.00 0.00 C ATOM 0 H VAL A 734 3.557 1.729 11.362 1.00 0.00 H new ATOM 0 HA VAL A 734 6.109 0.963 12.118 1.00 0.00 H new ATOM 0 HB VAL A 734 5.058 2.475 9.714 1.00 0.00 H new ATOM 0 HG11 VAL A 734 7.148 1.893 8.573 1.00 0.00 H new ATOM 0 HG12 VAL A 734 7.419 2.986 9.951 1.00 0.00 H new ATOM 0 HG13 VAL A 734 7.796 1.254 10.102 1.00 0.00 H new ATOM 0 HG21 VAL A 734 5.380 0.265 8.613 1.00 0.00 H new ATOM 0 HG22 VAL A 734 5.952 -0.404 10.160 1.00 0.00 H new ATOM 0 HG23 VAL A 734 4.270 0.154 9.999 1.00 0.00 H new ATOM 454 N GLU A 735 5.732 4.238 12.125 1.00 0.00 N ATOM 455 CA GLU A 735 6.378 5.479 12.603 1.00 0.00 C ATOM 456 C GLU A 735 6.651 5.432 14.128 1.00 0.00 C ATOM 457 O GLU A 735 7.618 6.015 14.619 1.00 0.00 O ATOM 458 CB GLU A 735 5.530 6.722 12.245 1.00 0.00 C ATOM 459 CG GLU A 735 4.157 6.740 12.898 1.00 0.00 C ATOM 460 CD GLU A 735 3.343 7.983 12.604 1.00 0.00 C ATOM 461 OE1 GLU A 735 3.894 8.989 12.111 1.00 0.00 O ATOM 462 OE2 GLU A 735 2.128 7.993 12.916 1.00 0.00 O ATOM 0 H GLU A 735 4.804 4.371 11.724 1.00 0.00 H new ATOM 0 HA GLU A 735 7.338 5.557 12.094 1.00 0.00 H new ATOM 0 HB2 GLU A 735 6.074 7.619 12.541 1.00 0.00 H new ATOM 0 HB3 GLU A 735 5.407 6.767 11.163 1.00 0.00 H new ATOM 0 HG2 GLU A 735 3.597 5.866 12.564 1.00 0.00 H new ATOM 0 HG3 GLU A 735 4.280 6.647 13.977 1.00 0.00 H new ATOM 469 N GLU A 736 5.815 4.698 14.840 1.00 0.00 N ATOM 470 CA GLU A 736 5.884 4.589 16.292 1.00 0.00 C ATOM 471 C GLU A 736 6.828 3.447 16.702 1.00 0.00 C ATOM 472 O GLU A 736 7.822 3.641 17.410 1.00 0.00 O ATOM 473 CB GLU A 736 4.466 4.290 16.814 1.00 0.00 C ATOM 474 CG GLU A 736 4.319 4.183 18.325 1.00 0.00 C ATOM 475 CD GLU A 736 2.928 3.731 18.722 1.00 0.00 C ATOM 476 OE1 GLU A 736 1.947 4.441 18.416 1.00 0.00 O ATOM 477 OE2 GLU A 736 2.785 2.649 19.349 1.00 0.00 O ATOM 0 H GLU A 736 5.059 4.153 14.425 1.00 0.00 H new ATOM 0 HA GLU A 736 6.266 5.519 16.713 1.00 0.00 H new ATOM 0 HB2 GLU A 736 3.797 5.074 16.459 1.00 0.00 H new ATOM 0 HB3 GLU A 736 4.126 3.355 16.369 1.00 0.00 H new ATOM 0 HG2 GLU A 736 5.055 3.479 18.713 1.00 0.00 H new ATOM 0 HG3 GLU A 736 4.531 5.150 18.781 1.00 0.00 H new ATOM 484 N GLU A 737 6.517 2.279 16.212 1.00 0.00 N ATOM 485 CA GLU A 737 7.171 1.052 16.586 1.00 0.00 C ATOM 486 C GLU A 737 8.502 0.841 15.882 1.00 0.00 C ATOM 487 O GLU A 737 9.529 0.760 16.525 1.00 0.00 O ATOM 488 CB GLU A 737 6.237 -0.105 16.276 1.00 0.00 C ATOM 489 CG GLU A 737 4.943 -0.088 17.073 1.00 0.00 C ATOM 490 CD GLU A 737 5.104 -0.590 18.487 1.00 0.00 C ATOM 491 OE1 GLU A 737 6.019 -0.152 19.208 1.00 0.00 O ATOM 492 OE2 GLU A 737 4.317 -1.479 18.889 1.00 0.00 O ATOM 0 H GLU A 737 5.779 2.149 15.520 1.00 0.00 H new ATOM 0 HA GLU A 737 7.394 1.108 17.652 1.00 0.00 H new ATOM 0 HB2 GLU A 737 5.997 -0.089 15.213 1.00 0.00 H new ATOM 0 HB3 GLU A 737 6.759 -1.042 16.471 1.00 0.00 H new ATOM 0 HG2 GLU A 737 4.554 0.930 17.099 1.00 0.00 H new ATOM 0 HG3 GLU A 737 4.201 -0.700 16.560 1.00 0.00 H new ATOM 499 N GLU A 738 8.480 0.780 14.574 1.00 0.00 N ATOM 500 CA GLU A 738 9.672 0.417 13.814 1.00 0.00 C ATOM 501 C GLU A 738 10.541 1.633 13.446 1.00 0.00 C ATOM 502 O GLU A 738 11.703 1.487 13.027 1.00 0.00 O ATOM 503 CB GLU A 738 9.269 -0.458 12.623 1.00 0.00 C ATOM 504 CG GLU A 738 8.642 -1.773 13.102 1.00 0.00 C ATOM 505 CD GLU A 738 8.075 -2.655 12.014 1.00 0.00 C ATOM 506 OE1 GLU A 738 8.854 -3.305 11.287 1.00 0.00 O ATOM 507 OE2 GLU A 738 6.824 -2.753 11.920 1.00 0.00 O ATOM 0 H GLU A 738 7.656 0.975 14.005 1.00 0.00 H new ATOM 0 HA GLU A 738 10.329 -0.179 14.447 1.00 0.00 H new ATOM 0 HB2 GLU A 738 8.560 0.080 11.994 1.00 0.00 H new ATOM 0 HB3 GLU A 738 10.144 -0.670 12.009 1.00 0.00 H new ATOM 0 HG2 GLU A 738 9.397 -2.338 13.648 1.00 0.00 H new ATOM 0 HG3 GLU A 738 7.846 -1.540 13.809 1.00 0.00 H new ATOM 514 N ASP A 739 9.958 2.821 13.612 1.00 0.00 N ATOM 515 CA ASP A 739 10.625 4.149 13.484 1.00 0.00 C ATOM 516 C ASP A 739 10.983 4.537 12.045 1.00 0.00 C ATOM 517 O ASP A 739 10.606 5.615 11.568 1.00 0.00 O ATOM 518 CB ASP A 739 11.845 4.252 14.406 1.00 0.00 C ATOM 519 CG ASP A 739 12.515 5.596 14.356 1.00 0.00 C ATOM 520 OD1 ASP A 739 11.975 6.560 14.932 1.00 0.00 O ATOM 521 OD2 ASP A 739 13.622 5.708 13.795 1.00 0.00 O ATOM 0 H ASP A 739 8.969 2.905 13.849 1.00 0.00 H new ATOM 0 HA ASP A 739 9.881 4.878 13.805 1.00 0.00 H new ATOM 0 HB2 ASP A 739 11.536 4.046 15.431 1.00 0.00 H new ATOM 0 HB3 ASP A 739 12.567 3.483 14.130 1.00 0.00 H new ATOM 526 N GLU A 740 11.682 3.669 11.355 1.00 0.00 N ATOM 527 CA GLU A 740 12.077 3.908 9.999 1.00 0.00 C ATOM 528 C GLU A 740 10.949 3.553 9.092 1.00 0.00 C ATOM 529 O GLU A 740 10.798 2.411 8.641 1.00 0.00 O ATOM 530 CB GLU A 740 13.346 3.161 9.614 1.00 0.00 C ATOM 531 CG GLU A 740 14.553 3.577 10.415 1.00 0.00 C ATOM 532 CD GLU A 740 15.801 2.849 10.004 1.00 0.00 C ATOM 533 OE1 GLU A 740 15.998 1.699 10.434 1.00 0.00 O ATOM 534 OE2 GLU A 740 16.621 3.415 9.248 1.00 0.00 O ATOM 0 H GLU A 740 11.992 2.771 11.727 1.00 0.00 H new ATOM 0 HA GLU A 740 12.312 4.968 9.898 1.00 0.00 H new ATOM 0 HB2 GLU A 740 13.183 2.091 9.746 1.00 0.00 H new ATOM 0 HB3 GLU A 740 13.548 3.325 8.555 1.00 0.00 H new ATOM 0 HG2 GLU A 740 14.708 4.650 10.300 1.00 0.00 H new ATOM 0 HG3 GLU A 740 14.363 3.395 11.473 1.00 0.00 H new ATOM 541 N SER A 741 10.134 4.508 8.900 1.00 0.00 N ATOM 542 CA SER A 741 8.981 4.422 8.103 1.00 0.00 C ATOM 543 C SER A 741 9.361 4.582 6.650 1.00 0.00 C ATOM 544 O SER A 741 9.263 5.660 6.079 1.00 0.00 O ATOM 545 CB SER A 741 7.936 5.461 8.554 1.00 0.00 C ATOM 546 OG SER A 741 6.741 5.348 7.825 1.00 0.00 O ATOM 0 H SER A 741 10.261 5.429 9.321 1.00 0.00 H new ATOM 0 HA SER A 741 8.521 3.441 8.222 1.00 0.00 H new ATOM 0 HB2 SER A 741 7.728 5.330 9.616 1.00 0.00 H new ATOM 0 HB3 SER A 741 8.344 6.464 8.430 1.00 0.00 H new ATOM 0 HG SER A 741 6.163 6.114 8.023 1.00 0.00 H new ATOM 552 N ALA A 742 9.964 3.547 6.154 1.00 0.00 N ATOM 553 CA ALA A 742 10.313 3.389 4.754 1.00 0.00 C ATOM 554 C ALA A 742 10.570 1.915 4.485 1.00 0.00 C ATOM 555 O ALA A 742 11.582 1.373 4.931 1.00 0.00 O ATOM 556 CB ALA A 742 11.546 4.217 4.422 1.00 0.00 C ATOM 0 H ALA A 742 10.243 2.750 6.727 1.00 0.00 H new ATOM 0 HA ALA A 742 9.496 3.739 4.124 1.00 0.00 H new ATOM 0 HB1 ALA A 742 11.797 4.090 3.369 1.00 0.00 H new ATOM 0 HB2 ALA A 742 11.342 5.269 4.622 1.00 0.00 H new ATOM 0 HB3 ALA A 742 12.383 3.886 5.037 1.00 0.00 H new ATOM 562 N LEU A 743 9.656 1.257 3.792 1.00 0.00 N ATOM 563 CA LEU A 743 9.760 -0.188 3.578 1.00 0.00 C ATOM 564 C LEU A 743 9.555 -0.565 2.111 1.00 0.00 C ATOM 565 O LEU A 743 9.195 0.286 1.279 1.00 0.00 O ATOM 566 CB LEU A 743 8.735 -0.937 4.457 1.00 0.00 C ATOM 567 CG LEU A 743 8.875 -0.777 5.982 1.00 0.00 C ATOM 568 CD1 LEU A 743 7.769 -1.527 6.698 1.00 0.00 C ATOM 569 CD2 LEU A 743 10.232 -1.273 6.461 1.00 0.00 C ATOM 0 H LEU A 743 8.836 1.691 3.368 1.00 0.00 H new ATOM 0 HA LEU A 743 10.770 -0.484 3.862 1.00 0.00 H new ATOM 0 HB2 LEU A 743 7.737 -0.605 4.171 1.00 0.00 H new ATOM 0 HB3 LEU A 743 8.797 -1.999 4.220 1.00 0.00 H new ATOM 0 HG LEU A 743 8.793 0.285 6.216 1.00 0.00 H new ATOM 0 HD11 LEU A 743 7.883 -1.403 7.775 1.00 0.00 H new ATOM 0 HD12 LEU A 743 6.802 -1.132 6.388 1.00 0.00 H new ATOM 0 HD13 LEU A 743 7.826 -2.586 6.447 1.00 0.00 H new ATOM 0 HD21 LEU A 743 10.304 -1.148 7.541 1.00 0.00 H new ATOM 0 HD22 LEU A 743 10.344 -2.328 6.209 1.00 0.00 H new ATOM 0 HD23 LEU A 743 11.021 -0.699 5.976 1.00 0.00 H new ATOM 581 N LYS A 744 9.782 -1.836 1.810 1.00 0.00 N ATOM 582 CA LYS A 744 9.599 -2.391 0.478 1.00 0.00 C ATOM 583 C LYS A 744 8.096 -2.558 0.249 1.00 0.00 C ATOM 584 O LYS A 744 7.407 -3.140 1.095 1.00 0.00 O ATOM 585 CB LYS A 744 10.300 -3.770 0.406 1.00 0.00 C ATOM 586 CG LYS A 744 10.348 -4.424 -0.983 1.00 0.00 C ATOM 587 CD LYS A 744 11.269 -3.676 -1.957 1.00 0.00 C ATOM 588 CE LYS A 744 12.740 -3.688 -1.505 1.00 0.00 C ATOM 589 NZ LYS A 744 13.314 -5.055 -1.445 1.00 0.00 N ATOM 0 H LYS A 744 10.103 -2.520 2.495 1.00 0.00 H new ATOM 0 HA LYS A 744 10.026 -1.738 -0.283 1.00 0.00 H new ATOM 0 HB2 LYS A 744 11.322 -3.656 0.769 1.00 0.00 H new ATOM 0 HB3 LYS A 744 9.793 -4.450 1.090 1.00 0.00 H new ATOM 0 HG2 LYS A 744 10.690 -5.454 -0.884 1.00 0.00 H new ATOM 0 HG3 LYS A 744 9.341 -4.462 -1.398 1.00 0.00 H new ATOM 0 HD2 LYS A 744 11.192 -4.130 -2.945 1.00 0.00 H new ATOM 0 HD3 LYS A 744 10.930 -2.644 -2.053 1.00 0.00 H new ATOM 0 HE2 LYS A 744 13.331 -3.081 -2.191 1.00 0.00 H new ATOM 0 HE3 LYS A 744 12.817 -3.224 -0.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 14.334 -4.995 -1.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 12.849 -5.594 -0.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 13.162 -5.535 -2.355 1.00 0.00 H new ATOM 603 N ARG A 745 7.591 -2.079 -0.890 1.00 0.00 N ATOM 604 CA ARG A 745 6.137 -2.082 -1.151 1.00 0.00 C ATOM 605 C ARG A 745 5.527 -3.496 -1.125 1.00 0.00 C ATOM 606 O ARG A 745 4.379 -3.678 -0.729 1.00 0.00 O ATOM 607 CB ARG A 745 5.780 -1.406 -2.490 1.00 0.00 C ATOM 608 CG ARG A 745 6.123 -2.228 -3.730 1.00 0.00 C ATOM 609 CD ARG A 745 5.467 -1.657 -4.972 1.00 0.00 C ATOM 610 NE ARG A 745 5.501 -2.615 -6.078 1.00 0.00 N ATOM 611 CZ ARG A 745 4.431 -3.049 -6.774 1.00 0.00 C ATOM 612 NH1 ARG A 745 3.209 -2.622 -6.472 1.00 0.00 N ATOM 613 NH2 ARG A 745 4.603 -3.927 -7.749 1.00 0.00 N ATOM 0 H ARG A 745 8.155 -1.686 -1.644 1.00 0.00 H new ATOM 0 HA ARG A 745 5.705 -1.504 -0.334 1.00 0.00 H new ATOM 0 HB2 ARG A 745 4.712 -1.189 -2.499 1.00 0.00 H new ATOM 0 HB3 ARG A 745 6.300 -0.450 -2.549 1.00 0.00 H new ATOM 0 HG2 ARG A 745 7.204 -2.251 -3.866 1.00 0.00 H new ATOM 0 HG3 ARG A 745 5.798 -3.259 -3.586 1.00 0.00 H new ATOM 0 HD2 ARG A 745 4.434 -1.390 -4.750 1.00 0.00 H new ATOM 0 HD3 ARG A 745 5.977 -0.740 -5.266 1.00 0.00 H new ATOM 0 HE ARG A 745 6.413 -2.986 -6.345 1.00 0.00 H new ATOM 0 HH11 ARG A 745 3.074 -1.960 -5.708 1.00 0.00 H new ATOM 0 HH12 ARG A 745 2.406 -2.956 -7.005 1.00 0.00 H new ATOM 0 HH21 ARG A 745 5.539 -4.269 -7.968 1.00 0.00 H new ATOM 0 HH22 ARG A 745 3.800 -4.262 -8.282 1.00 0.00 H new ATOM 627 N SER A 746 6.306 -4.474 -1.534 1.00 0.00 N ATOM 628 CA SER A 746 5.851 -5.838 -1.654 1.00 0.00 C ATOM 629 C SER A 746 5.496 -6.451 -0.295 1.00 0.00 C ATOM 630 O SER A 746 4.596 -7.284 -0.205 1.00 0.00 O ATOM 631 CB SER A 746 6.937 -6.634 -2.346 1.00 0.00 C ATOM 632 OG SER A 746 7.346 -5.944 -3.518 1.00 0.00 O ATOM 0 H SER A 746 7.283 -4.341 -1.795 1.00 0.00 H new ATOM 0 HA SER A 746 4.933 -5.860 -2.242 1.00 0.00 H new ATOM 0 HB2 SER A 746 7.786 -6.773 -1.676 1.00 0.00 H new ATOM 0 HB3 SER A 746 6.569 -7.627 -2.604 1.00 0.00 H new ATOM 0 HG SER A 746 8.051 -6.454 -3.969 1.00 0.00 H new ATOM 638 N GLU A 747 6.156 -5.983 0.760 1.00 0.00 N ATOM 639 CA GLU A 747 5.945 -6.516 2.089 1.00 0.00 C ATOM 640 C GLU A 747 4.547 -6.172 2.575 1.00 0.00 C ATOM 641 O GLU A 747 3.930 -6.961 3.261 1.00 0.00 O ATOM 642 CB GLU A 747 6.993 -5.994 3.071 1.00 0.00 C ATOM 643 CG GLU A 747 6.961 -6.703 4.419 1.00 0.00 C ATOM 644 CD GLU A 747 7.186 -8.196 4.280 1.00 0.00 C ATOM 645 OE1 GLU A 747 8.330 -8.609 4.011 1.00 0.00 O ATOM 646 OE2 GLU A 747 6.234 -8.979 4.412 1.00 0.00 O ATOM 0 H GLU A 747 6.844 -5.231 0.713 1.00 0.00 H new ATOM 0 HA GLU A 747 6.047 -7.600 2.038 1.00 0.00 H new ATOM 0 HB2 GLU A 747 7.983 -6.110 2.631 1.00 0.00 H new ATOM 0 HB3 GLU A 747 6.836 -4.927 3.226 1.00 0.00 H new ATOM 0 HG2 GLU A 747 7.726 -6.280 5.070 1.00 0.00 H new ATOM 0 HG3 GLU A 747 5.999 -6.524 4.900 1.00 0.00 H new ATOM 653 N LEU A 748 4.042 -5.004 2.161 1.00 0.00 N ATOM 654 CA LEU A 748 2.686 -4.557 2.519 1.00 0.00 C ATOM 655 C LEU A 748 1.677 -5.612 2.125 1.00 0.00 C ATOM 656 O LEU A 748 0.886 -6.077 2.946 1.00 0.00 O ATOM 657 CB LEU A 748 2.328 -3.215 1.830 1.00 0.00 C ATOM 658 CG LEU A 748 2.912 -1.911 2.417 1.00 0.00 C ATOM 659 CD1 LEU A 748 2.390 -1.680 3.814 1.00 0.00 C ATOM 660 CD2 LEU A 748 4.436 -1.898 2.409 1.00 0.00 C ATOM 0 H LEU A 748 4.554 -4.346 1.574 1.00 0.00 H new ATOM 0 HA LEU A 748 2.660 -4.402 3.598 1.00 0.00 H new ATOM 0 HB2 LEU A 748 2.644 -3.281 0.789 1.00 0.00 H new ATOM 0 HB3 LEU A 748 1.242 -3.122 1.828 1.00 0.00 H new ATOM 0 HG LEU A 748 2.583 -1.096 1.772 1.00 0.00 H new ATOM 0 HD11 LEU A 748 2.812 -0.757 4.212 1.00 0.00 H new ATOM 0 HD12 LEU A 748 1.303 -1.601 3.788 1.00 0.00 H new ATOM 0 HD13 LEU A 748 2.677 -2.515 4.453 1.00 0.00 H new ATOM 0 HD21 LEU A 748 4.794 -0.959 2.832 1.00 0.00 H new ATOM 0 HD22 LEU A 748 4.810 -2.731 3.005 1.00 0.00 H new ATOM 0 HD23 LEU A 748 4.795 -1.995 1.384 1.00 0.00 H new ATOM 672 N VAL A 749 1.763 -6.025 0.876 1.00 0.00 N ATOM 673 CA VAL A 749 0.890 -7.043 0.339 1.00 0.00 C ATOM 674 C VAL A 749 1.182 -8.355 1.042 1.00 0.00 C ATOM 675 O VAL A 749 0.283 -9.040 1.491 1.00 0.00 O ATOM 676 CB VAL A 749 1.129 -7.249 -1.185 1.00 0.00 C ATOM 677 CG1 VAL A 749 0.127 -8.228 -1.762 1.00 0.00 C ATOM 678 CG2 VAL A 749 1.066 -5.935 -1.934 1.00 0.00 C ATOM 0 H VAL A 749 2.442 -5.662 0.206 1.00 0.00 H new ATOM 0 HA VAL A 749 -0.141 -6.726 0.495 1.00 0.00 H new ATOM 0 HB VAL A 749 2.130 -7.663 -1.306 1.00 0.00 H new ATOM 0 HG11 VAL A 749 0.315 -8.355 -2.828 1.00 0.00 H new ATOM 0 HG12 VAL A 749 0.227 -9.190 -1.259 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -0.883 -7.845 -1.615 1.00 0.00 H new ATOM 0 HG21 VAL A 749 1.237 -6.113 -2.996 1.00 0.00 H new ATOM 0 HG22 VAL A 749 0.084 -5.484 -1.795 1.00 0.00 H new ATOM 0 HG23 VAL A 749 1.832 -5.261 -1.551 1.00 0.00 H new ATOM 688 N ASN A 750 2.458 -8.632 1.185 1.00 0.00 N ATOM 689 CA ASN A 750 2.961 -9.886 1.720 1.00 0.00 C ATOM 690 C ASN A 750 2.410 -10.181 3.128 1.00 0.00 C ATOM 691 O ASN A 750 1.756 -11.229 3.347 1.00 0.00 O ATOM 692 CB ASN A 750 4.501 -9.876 1.702 1.00 0.00 C ATOM 693 CG ASN A 750 5.102 -11.226 2.027 1.00 0.00 C ATOM 694 OD1 ASN A 750 5.230 -12.087 1.154 1.00 0.00 O ATOM 695 ND2 ASN A 750 5.567 -11.384 3.230 1.00 0.00 N ATOM 0 H ASN A 750 3.197 -7.978 0.927 1.00 0.00 H new ATOM 0 HA ASN A 750 2.607 -10.696 1.082 1.00 0.00 H new ATOM 0 HB2 ASN A 750 4.846 -9.558 0.718 1.00 0.00 H new ATOM 0 HB3 ASN A 750 4.863 -9.140 2.420 1.00 0.00 H new ATOM 0 HD21 ASN A 750 6.057 -12.243 3.478 1.00 0.00 H new ATOM 0 HD22 ASN A 750 5.442 -10.649 3.926 1.00 0.00 H new ATOM 702 N TRP A 751 2.603 -9.254 4.067 1.00 0.00 N ATOM 703 CA TRP A 751 2.111 -9.472 5.416 1.00 0.00 C ATOM 704 C TRP A 751 0.586 -9.410 5.441 1.00 0.00 C ATOM 705 O TRP A 751 -0.049 -10.084 6.258 1.00 0.00 O ATOM 706 CB TRP A 751 2.740 -8.520 6.487 1.00 0.00 C ATOM 707 CG TRP A 751 2.280 -7.075 6.464 1.00 0.00 C ATOM 708 CD1 TRP A 751 2.909 -6.021 5.884 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.099 -6.532 7.089 1.00 0.00 C ATOM 710 NE1 TRP A 751 2.186 -4.872 6.077 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.075 -5.161 6.813 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.056 -7.079 7.837 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.059 -4.330 7.259 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.955 -6.251 8.278 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.947 -4.893 7.986 1.00 0.00 C ATOM 0 H TRP A 751 3.085 -8.367 3.919 1.00 0.00 H new ATOM 0 HA TRP A 751 2.435 -10.473 5.702 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.527 -8.930 7.474 1.00 0.00 H new ATOM 0 HB3 TRP A 751 3.823 -8.535 6.362 1.00 0.00 H new ATOM 0 HD1 TRP A 751 3.845 -6.079 5.348 1.00 0.00 H new ATOM 0 HE1 TRP A 751 2.439 -3.948 5.726 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.041 -8.134 8.067 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 0.064 -3.273 7.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.766 -6.665 8.859 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -1.754 -4.271 8.342 1.00 0.00 H new ATOM 726 N TYR A 752 0.001 -8.619 4.522 1.00 0.00 N ATOM 727 CA TYR A 752 -1.446 -8.463 4.445 1.00 0.00 C ATOM 728 C TYR A 752 -2.088 -9.794 4.154 1.00 0.00 C ATOM 729 O TYR A 752 -3.051 -10.194 4.823 1.00 0.00 O ATOM 730 CB TYR A 752 -1.824 -7.466 3.353 1.00 0.00 C ATOM 731 CG TYR A 752 -3.298 -7.141 3.286 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.973 -6.682 4.417 1.00 0.00 C ATOM 733 CD2 TYR A 752 -4.012 -7.264 2.098 1.00 0.00 C ATOM 734 CE1 TYR A 752 -5.304 -6.365 4.367 1.00 0.00 C ATOM 735 CE2 TYR A 752 -5.343 -6.948 2.046 1.00 0.00 C ATOM 736 CZ TYR A 752 -5.987 -6.496 3.189 1.00 0.00 C ATOM 737 OH TYR A 752 -7.319 -6.186 3.152 1.00 0.00 O ATOM 0 H TYR A 752 0.518 -8.081 3.826 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.803 -8.085 5.403 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -1.268 -6.542 3.513 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.508 -7.865 2.389 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -3.437 -6.575 5.348 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -3.511 -7.613 1.207 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.812 -6.013 5.253 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -5.889 -7.050 1.120 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.720 -6.360 4.029 1.00 0.00 H new ATOM 747 N LEU A 753 -1.532 -10.487 3.176 1.00 0.00 N ATOM 748 CA LEU A 753 -2.008 -11.791 2.777 1.00 0.00 C ATOM 749 C LEU A 753 -1.924 -12.735 3.953 1.00 0.00 C ATOM 750 O LEU A 753 -2.880 -13.408 4.269 1.00 0.00 O ATOM 751 CB LEU A 753 -1.178 -12.319 1.619 1.00 0.00 C ATOM 752 CG LEU A 753 -1.059 -11.386 0.420 1.00 0.00 C ATOM 753 CD1 LEU A 753 -0.149 -11.971 -0.620 1.00 0.00 C ATOM 754 CD2 LEU A 753 -2.422 -11.021 -0.164 1.00 0.00 C ATOM 0 H LEU A 753 -0.733 -10.155 2.636 1.00 0.00 H new ATOM 0 HA LEU A 753 -3.045 -11.713 2.451 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -0.176 -12.542 1.985 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -1.612 -13.261 1.283 1.00 0.00 H new ATOM 0 HG LEU A 753 -0.615 -10.455 0.772 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -0.078 -11.289 -1.467 1.00 0.00 H new ATOM 0 HD12 LEU A 753 0.842 -12.123 -0.193 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -0.549 -12.927 -0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -2.286 -10.355 -1.016 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -2.933 -11.927 -0.490 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -3.021 -10.520 0.596 1.00 0.00 H new ATOM 766 N LYS A 754 -0.797 -12.700 4.644 1.00 0.00 N ATOM 767 CA LYS A 754 -0.570 -13.548 5.830 1.00 0.00 C ATOM 768 C LYS A 754 -1.563 -13.288 6.969 1.00 0.00 C ATOM 769 O LYS A 754 -1.803 -14.153 7.815 1.00 0.00 O ATOM 770 CB LYS A 754 0.884 -13.444 6.319 1.00 0.00 C ATOM 771 CG LYS A 754 1.826 -14.432 5.638 1.00 0.00 C ATOM 772 CD LYS A 754 1.803 -14.297 4.125 1.00 0.00 C ATOM 773 CE LYS A 754 2.450 -15.476 3.449 1.00 0.00 C ATOM 774 NZ LYS A 754 1.820 -16.750 3.866 1.00 0.00 N ATOM 0 H LYS A 754 -0.012 -12.092 4.411 1.00 0.00 H new ATOM 0 HA LYS A 754 -0.752 -14.573 5.506 1.00 0.00 H new ATOM 0 HB2 LYS A 754 1.246 -12.431 6.146 1.00 0.00 H new ATOM 0 HB3 LYS A 754 0.910 -13.612 7.396 1.00 0.00 H new ATOM 0 HG2 LYS A 754 2.842 -14.272 6.000 1.00 0.00 H new ATOM 0 HG3 LYS A 754 1.546 -15.448 5.915 1.00 0.00 H new ATOM 0 HD2 LYS A 754 0.772 -14.203 3.784 1.00 0.00 H new ATOM 0 HD3 LYS A 754 2.320 -13.382 3.834 1.00 0.00 H new ATOM 0 HE2 LYS A 754 2.371 -15.366 2.367 1.00 0.00 H new ATOM 0 HE3 LYS A 754 3.513 -15.498 3.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 2.004 -17.480 3.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 2.219 -17.053 4.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 0.794 -16.613 3.966 1.00 0.00 H new ATOM 788 N GLU A 755 -2.124 -12.120 6.992 1.00 0.00 N ATOM 789 CA GLU A 755 -3.098 -11.762 8.006 1.00 0.00 C ATOM 790 C GLU A 755 -4.476 -12.229 7.630 1.00 0.00 C ATOM 791 O GLU A 755 -5.192 -12.856 8.428 1.00 0.00 O ATOM 792 CB GLU A 755 -3.122 -10.262 8.249 1.00 0.00 C ATOM 793 CG GLU A 755 -1.914 -9.747 8.980 1.00 0.00 C ATOM 794 CD GLU A 755 -1.761 -10.392 10.324 1.00 0.00 C ATOM 795 OE1 GLU A 755 -2.599 -10.149 11.212 1.00 0.00 O ATOM 796 OE2 GLU A 755 -0.814 -11.175 10.510 1.00 0.00 O ATOM 0 H GLU A 755 -1.929 -11.381 6.316 1.00 0.00 H new ATOM 0 HA GLU A 755 -2.793 -12.262 8.925 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -3.201 -9.749 7.290 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -4.016 -10.010 8.820 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -1.021 -9.933 8.383 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -1.996 -8.667 9.102 1.00 0.00 H new ATOM 803 N ILE A 756 -4.841 -11.944 6.410 1.00 0.00 N ATOM 804 CA ILE A 756 -6.168 -12.228 5.925 1.00 0.00 C ATOM 805 C ILE A 756 -6.342 -13.688 5.571 1.00 0.00 C ATOM 806 O ILE A 756 -7.450 -14.175 5.544 1.00 0.00 O ATOM 807 CB ILE A 756 -6.533 -11.356 4.693 1.00 0.00 C ATOM 808 CG1 ILE A 756 -5.555 -11.624 3.537 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.540 -9.882 5.077 1.00 0.00 C ATOM 810 CD1 ILE A 756 -5.817 -10.823 2.288 1.00 0.00 C ATOM 0 H ILE A 756 -4.228 -11.508 5.722 1.00 0.00 H new ATOM 0 HA ILE A 756 -6.844 -11.983 6.744 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.534 -11.624 4.354 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -4.542 -11.414 3.881 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -5.593 -12.684 3.286 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -6.797 -9.280 4.205 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -7.276 -9.714 5.864 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.552 -9.595 5.437 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -5.078 -11.080 1.529 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -6.815 -11.050 1.913 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -5.748 -9.759 2.517 1.00 0.00 H new ATOM 822 N GLU A 757 -5.241 -14.396 5.348 1.00 0.00 N ATOM 823 CA GLU A 757 -5.285 -15.782 4.882 1.00 0.00 C ATOM 824 C GLU A 757 -6.010 -16.733 5.837 1.00 0.00 C ATOM 825 O GLU A 757 -6.438 -17.822 5.438 1.00 0.00 O ATOM 826 CB GLU A 757 -3.898 -16.297 4.496 1.00 0.00 C ATOM 827 CG GLU A 757 -2.885 -16.463 5.618 1.00 0.00 C ATOM 828 CD GLU A 757 -1.582 -17.064 5.104 1.00 0.00 C ATOM 829 OE1 GLU A 757 -0.791 -16.365 4.438 1.00 0.00 O ATOM 830 OE2 GLU A 757 -1.348 -18.271 5.315 1.00 0.00 O ATOM 0 H GLU A 757 -4.298 -14.031 5.483 1.00 0.00 H new ATOM 0 HA GLU A 757 -5.893 -15.768 3.977 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -4.020 -17.262 4.005 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -3.477 -15.614 3.758 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -2.685 -15.495 6.077 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -3.302 -17.104 6.395 1.00 0.00 H new ATOM 837 N SER A 758 -6.170 -16.308 7.067 1.00 0.00 N ATOM 838 CA SER A 758 -6.881 -17.066 8.061 1.00 0.00 C ATOM 839 C SER A 758 -8.403 -16.953 7.853 1.00 0.00 C ATOM 840 O SER A 758 -9.155 -17.874 8.179 1.00 0.00 O ATOM 841 CB SER A 758 -6.502 -16.525 9.418 1.00 0.00 C ATOM 842 OG SER A 758 -5.090 -16.413 9.513 1.00 0.00 O ATOM 0 H SER A 758 -5.806 -15.418 7.407 1.00 0.00 H new ATOM 0 HA SER A 758 -6.614 -18.120 7.981 1.00 0.00 H new ATOM 0 HB2 SER A 758 -6.965 -15.550 9.573 1.00 0.00 H new ATOM 0 HB3 SER A 758 -6.877 -17.184 10.201 1.00 0.00 H new ATOM 0 HG SER A 758 -4.848 -16.060 10.395 1.00 0.00 H new ATOM 848 N GLU A 759 -8.837 -15.844 7.272 1.00 0.00 N ATOM 849 CA GLU A 759 -10.258 -15.582 7.077 1.00 0.00 C ATOM 850 C GLU A 759 -10.632 -15.707 5.601 1.00 0.00 C ATOM 851 O GLU A 759 -11.768 -15.453 5.198 1.00 0.00 O ATOM 852 CB GLU A 759 -10.649 -14.198 7.645 1.00 0.00 C ATOM 853 CG GLU A 759 -9.913 -13.023 7.017 1.00 0.00 C ATOM 854 CD GLU A 759 -10.304 -11.695 7.616 1.00 0.00 C ATOM 855 OE1 GLU A 759 -11.350 -11.137 7.228 1.00 0.00 O ATOM 856 OE2 GLU A 759 -9.563 -11.163 8.470 1.00 0.00 O ATOM 0 H GLU A 759 -8.223 -15.107 6.925 1.00 0.00 H new ATOM 0 HA GLU A 759 -10.823 -16.333 7.628 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -11.721 -14.053 7.508 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -10.462 -14.195 8.719 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -8.839 -13.168 7.137 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.114 -13.006 5.946 1.00 0.00 H new ATOM 863 N ILE A 760 -9.668 -16.109 4.799 1.00 0.00 N ATOM 864 CA ILE A 760 -9.903 -16.316 3.395 1.00 0.00 C ATOM 865 C ILE A 760 -10.611 -17.643 3.185 1.00 0.00 C ATOM 866 O ILE A 760 -10.016 -18.720 3.313 1.00 0.00 O ATOM 867 CB ILE A 760 -8.600 -16.267 2.553 1.00 0.00 C ATOM 868 CG1 ILE A 760 -7.945 -14.878 2.603 1.00 0.00 C ATOM 869 CG2 ILE A 760 -8.867 -16.673 1.122 1.00 0.00 C ATOM 870 CD1 ILE A 760 -8.807 -13.739 2.082 1.00 0.00 C ATOM 0 H ILE A 760 -8.713 -16.298 5.102 1.00 0.00 H new ATOM 0 HA ILE A 760 -10.533 -15.497 3.049 1.00 0.00 H new ATOM 0 HB ILE A 760 -7.903 -16.981 2.992 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -7.668 -14.661 3.635 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -7.022 -14.908 2.025 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -7.939 -16.631 0.552 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -9.260 -17.689 1.099 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -9.595 -15.992 0.680 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -8.257 -12.801 2.159 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -9.063 -13.924 1.039 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -9.720 -13.674 2.674 1.00 0.00 H new ATOM 882 N ASP A 761 -11.879 -17.547 2.916 1.00 0.00 N ATOM 883 CA ASP A 761 -12.732 -18.701 2.673 1.00 0.00 C ATOM 884 C ASP A 761 -12.484 -19.309 1.298 1.00 0.00 C ATOM 885 O ASP A 761 -12.543 -20.517 1.124 1.00 0.00 O ATOM 886 CB ASP A 761 -14.201 -18.287 2.808 1.00 0.00 C ATOM 887 CG ASP A 761 -15.181 -19.393 2.464 1.00 0.00 C ATOM 888 OD1 ASP A 761 -15.499 -20.225 3.341 1.00 0.00 O ATOM 889 OD2 ASP A 761 -15.681 -19.423 1.311 1.00 0.00 O ATOM 0 H ASP A 761 -12.370 -16.655 2.855 1.00 0.00 H new ATOM 0 HA ASP A 761 -12.491 -19.462 3.415 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -14.384 -17.957 3.831 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -14.389 -17.432 2.159 1.00 0.00 H new ATOM 894 N SER A 762 -12.144 -18.480 0.347 1.00 0.00 N ATOM 895 CA SER A 762 -12.007 -18.924 -1.016 1.00 0.00 C ATOM 896 C SER A 762 -10.831 -18.228 -1.671 1.00 0.00 C ATOM 897 O SER A 762 -10.526 -17.077 -1.325 1.00 0.00 O ATOM 898 CB SER A 762 -13.303 -18.625 -1.782 1.00 0.00 C ATOM 899 OG SER A 762 -13.204 -19.013 -3.129 1.00 0.00 O ATOM 0 H SER A 762 -11.956 -17.488 0.492 1.00 0.00 H new ATOM 0 HA SER A 762 -11.824 -19.998 -1.033 1.00 0.00 H new ATOM 0 HB2 SER A 762 -14.135 -19.149 -1.311 1.00 0.00 H new ATOM 0 HB3 SER A 762 -13.524 -17.559 -1.724 1.00 0.00 H new ATOM 0 HG SER A 762 -14.045 -18.812 -3.590 1.00 0.00 H new ATOM 905 N GLU A 763 -10.199 -18.910 -2.626 1.00 0.00 N ATOM 906 CA GLU A 763 -9.032 -18.409 -3.343 1.00 0.00 C ATOM 907 C GLU A 763 -9.364 -17.078 -3.994 1.00 0.00 C ATOM 908 O GLU A 763 -8.544 -16.162 -3.980 1.00 0.00 O ATOM 909 CB GLU A 763 -8.585 -19.424 -4.408 1.00 0.00 C ATOM 910 CG GLU A 763 -7.239 -19.124 -5.057 1.00 0.00 C ATOM 911 CD GLU A 763 -6.087 -19.249 -4.087 1.00 0.00 C ATOM 912 OE1 GLU A 763 -5.812 -18.295 -3.335 1.00 0.00 O ATOM 913 OE2 GLU A 763 -5.429 -20.308 -4.055 1.00 0.00 O ATOM 0 H GLU A 763 -10.490 -19.840 -2.926 1.00 0.00 H new ATOM 0 HA GLU A 763 -8.215 -18.266 -2.636 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -8.539 -20.412 -3.950 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -9.346 -19.469 -5.188 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -7.082 -19.807 -5.892 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -7.255 -18.115 -5.469 1.00 0.00 H new ATOM 920 N GLU A 764 -10.607 -16.961 -4.491 1.00 0.00 N ATOM 921 CA GLU A 764 -11.093 -15.744 -5.139 1.00 0.00 C ATOM 922 C GLU A 764 -10.908 -14.522 -4.249 1.00 0.00 C ATOM 923 O GLU A 764 -10.463 -13.482 -4.709 1.00 0.00 O ATOM 924 CB GLU A 764 -12.555 -15.886 -5.548 1.00 0.00 C ATOM 925 CG GLU A 764 -12.790 -16.964 -6.586 1.00 0.00 C ATOM 926 CD GLU A 764 -14.200 -16.978 -7.111 1.00 0.00 C ATOM 927 OE1 GLU A 764 -14.502 -16.203 -8.042 1.00 0.00 O ATOM 928 OE2 GLU A 764 -15.035 -17.771 -6.622 1.00 0.00 O ATOM 0 H GLU A 764 -11.298 -17.710 -4.452 1.00 0.00 H new ATOM 0 HA GLU A 764 -10.495 -15.598 -6.038 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -13.152 -16.108 -4.663 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -12.909 -14.932 -5.940 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -12.100 -16.817 -7.417 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -12.561 -17.936 -6.150 1.00 0.00 H new ATOM 935 N GLU A 765 -11.215 -14.677 -2.971 1.00 0.00 N ATOM 936 CA GLU A 765 -11.023 -13.626 -1.992 1.00 0.00 C ATOM 937 C GLU A 765 -9.598 -13.206 -1.882 1.00 0.00 C ATOM 938 O GLU A 765 -9.309 -12.024 -1.862 1.00 0.00 O ATOM 939 CB GLU A 765 -11.515 -14.052 -0.641 1.00 0.00 C ATOM 940 CG GLU A 765 -12.964 -13.827 -0.466 1.00 0.00 C ATOM 941 CD GLU A 765 -13.282 -12.340 -0.536 1.00 0.00 C ATOM 942 OE1 GLU A 765 -12.682 -11.559 0.238 1.00 0.00 O ATOM 943 OE2 GLU A 765 -14.083 -11.916 -1.414 1.00 0.00 O ATOM 0 H GLU A 765 -11.605 -15.537 -2.586 1.00 0.00 H new ATOM 0 HA GLU A 765 -11.604 -12.773 -2.343 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -11.295 -15.110 -0.496 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -10.971 -13.505 0.129 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -13.517 -14.361 -1.239 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -13.288 -14.230 0.494 1.00 0.00 H new ATOM 950 N LEU A 766 -8.716 -14.164 -1.817 1.00 0.00 N ATOM 951 CA LEU A 766 -7.300 -13.869 -1.693 1.00 0.00 C ATOM 952 C LEU A 766 -6.795 -13.178 -2.954 1.00 0.00 C ATOM 953 O LEU A 766 -6.052 -12.198 -2.869 1.00 0.00 O ATOM 954 CB LEU A 766 -6.485 -15.127 -1.387 1.00 0.00 C ATOM 955 CG LEU A 766 -4.984 -14.921 -1.127 1.00 0.00 C ATOM 956 CD1 LEU A 766 -4.759 -14.011 0.072 1.00 0.00 C ATOM 957 CD2 LEU A 766 -4.309 -16.251 -0.896 1.00 0.00 C ATOM 0 H LEU A 766 -8.944 -15.158 -1.847 1.00 0.00 H new ATOM 0 HA LEU A 766 -7.168 -13.192 -0.849 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -6.920 -15.612 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -6.596 -15.818 -2.223 1.00 0.00 H new ATOM 0 HG LEU A 766 -4.549 -14.446 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -3.689 -13.881 0.235 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -5.218 -13.040 -0.117 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -5.209 -14.459 0.958 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -3.246 -16.093 -0.713 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -4.757 -16.741 -0.032 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -4.436 -16.881 -1.776 1.00 0.00 H new ATOM 969 N ILE A 767 -7.238 -13.665 -4.112 1.00 0.00 N ATOM 970 CA ILE A 767 -6.876 -13.061 -5.387 1.00 0.00 C ATOM 971 C ILE A 767 -7.404 -11.621 -5.426 1.00 0.00 C ATOM 972 O ILE A 767 -6.671 -10.696 -5.731 1.00 0.00 O ATOM 973 CB ILE A 767 -7.455 -13.847 -6.600 1.00 0.00 C ATOM 974 CG1 ILE A 767 -7.054 -15.328 -6.539 1.00 0.00 C ATOM 975 CG2 ILE A 767 -6.946 -13.234 -7.903 1.00 0.00 C ATOM 976 CD1 ILE A 767 -7.665 -16.184 -7.635 1.00 0.00 C ATOM 0 H ILE A 767 -7.849 -14.478 -4.190 1.00 0.00 H new ATOM 0 HA ILE A 767 -5.789 -13.083 -5.467 1.00 0.00 H new ATOM 0 HB ILE A 767 -8.542 -13.781 -6.561 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -5.968 -15.402 -6.599 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -7.348 -15.733 -5.571 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -7.354 -13.787 -8.749 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -7.263 -12.193 -7.964 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -5.857 -13.284 -7.928 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -7.331 -17.215 -7.520 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -8.752 -16.144 -7.564 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -7.351 -15.808 -8.608 1.00 0.00 H new ATOM 988 N ASN A 768 -8.664 -11.454 -5.058 1.00 0.00 N ATOM 989 CA ASN A 768 -9.321 -10.148 -5.002 1.00 0.00 C ATOM 990 C ASN A 768 -8.624 -9.195 -4.038 1.00 0.00 C ATOM 991 O ASN A 768 -8.338 -8.053 -4.387 1.00 0.00 O ATOM 992 CB ASN A 768 -10.808 -10.304 -4.625 1.00 0.00 C ATOM 993 CG ASN A 768 -11.435 -9.001 -4.161 1.00 0.00 C ATOM 994 OD1 ASN A 768 -11.936 -8.206 -4.959 1.00 0.00 O ATOM 995 ND2 ASN A 768 -11.445 -8.799 -2.861 1.00 0.00 N ATOM 0 H ASN A 768 -9.271 -12.227 -4.786 1.00 0.00 H new ATOM 0 HA ASN A 768 -9.252 -9.710 -5.998 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -11.359 -10.681 -5.486 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -10.902 -11.049 -3.835 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -11.879 -7.959 -2.479 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -11.019 -9.483 -2.235 1.00 0.00 H new ATOM 1002 N LYS A 769 -8.350 -9.667 -2.833 1.00 0.00 N ATOM 1003 CA LYS A 769 -7.699 -8.857 -1.820 1.00 0.00 C ATOM 1004 C LYS A 769 -6.318 -8.432 -2.291 1.00 0.00 C ATOM 1005 O LYS A 769 -5.944 -7.271 -2.150 1.00 0.00 O ATOM 1006 CB LYS A 769 -7.578 -9.612 -0.491 1.00 0.00 C ATOM 1007 CG LYS A 769 -8.874 -9.804 0.311 1.00 0.00 C ATOM 1008 CD LYS A 769 -9.411 -8.485 0.860 1.00 0.00 C ATOM 1009 CE LYS A 769 -10.499 -8.712 1.919 1.00 0.00 C ATOM 1010 NZ LYS A 769 -11.733 -9.368 1.401 1.00 0.00 N ATOM 0 H LYS A 769 -8.571 -10.616 -2.532 1.00 0.00 H new ATOM 0 HA LYS A 769 -8.317 -7.974 -1.658 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -7.155 -10.596 -0.695 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -6.863 -9.082 0.138 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -9.629 -10.265 -0.326 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -8.690 -10.492 1.137 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -8.593 -7.912 1.296 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -9.817 -7.889 0.043 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -10.086 -9.323 2.721 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -10.769 -7.751 2.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -12.422 -9.469 2.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -12.144 -8.786 0.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -11.495 -10.308 1.024 1.00 0.00 H new ATOM 1024 N LYS A 770 -5.584 -9.378 -2.883 1.00 0.00 N ATOM 1025 CA LYS A 770 -4.249 -9.120 -3.390 1.00 0.00 C ATOM 1026 C LYS A 770 -4.295 -8.184 -4.593 1.00 0.00 C ATOM 1027 O LYS A 770 -3.417 -7.354 -4.781 1.00 0.00 O ATOM 1028 CB LYS A 770 -3.519 -10.433 -3.714 1.00 0.00 C ATOM 1029 CG LYS A 770 -2.078 -10.261 -4.198 1.00 0.00 C ATOM 1030 CD LYS A 770 -1.287 -11.564 -4.086 1.00 0.00 C ATOM 1031 CE LYS A 770 -1.865 -12.688 -4.926 1.00 0.00 C ATOM 1032 NZ LYS A 770 -1.717 -12.462 -6.382 1.00 0.00 N ATOM 0 H LYS A 770 -5.903 -10.337 -3.020 1.00 0.00 H new ATOM 0 HA LYS A 770 -3.678 -8.618 -2.609 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -3.516 -11.061 -2.823 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -4.083 -10.967 -4.478 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -2.080 -9.924 -5.235 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -1.587 -9.485 -3.611 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -0.257 -11.383 -4.392 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -1.260 -11.876 -3.042 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -1.373 -13.623 -4.658 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -2.922 -12.804 -4.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -2.130 -13.263 -6.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -2.209 -11.585 -6.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -0.708 -12.379 -6.620 1.00 0.00 H new ATOM 1046 N ARG A 771 -5.339 -8.310 -5.374 1.00 0.00 N ATOM 1047 CA ARG A 771 -5.559 -7.465 -6.525 1.00 0.00 C ATOM 1048 C ARG A 771 -5.794 -6.029 -6.065 1.00 0.00 C ATOM 1049 O ARG A 771 -5.183 -5.102 -6.578 1.00 0.00 O ATOM 1050 CB ARG A 771 -6.780 -7.961 -7.277 1.00 0.00 C ATOM 1051 CG ARG A 771 -7.018 -7.320 -8.629 1.00 0.00 C ATOM 1052 CD ARG A 771 -8.327 -7.817 -9.212 1.00 0.00 C ATOM 1053 NE ARG A 771 -8.408 -9.288 -9.243 1.00 0.00 N ATOM 1054 CZ ARG A 771 -9.461 -10.011 -8.817 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -10.484 -9.410 -8.205 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -9.467 -11.330 -8.973 1.00 0.00 N ATOM 0 H ARG A 771 -6.068 -9.008 -5.229 1.00 0.00 H new ATOM 0 HA ARG A 771 -4.686 -7.497 -7.177 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -6.687 -9.038 -7.416 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -7.660 -7.795 -6.656 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -7.044 -6.235 -8.527 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -6.196 -7.558 -9.304 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -9.156 -7.423 -8.624 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -8.441 -7.429 -10.224 1.00 0.00 H new ATOM 0 HE ARG A 771 -7.606 -9.797 -9.615 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -10.469 -8.401 -8.059 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -11.280 -9.960 -7.883 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -8.674 -11.795 -9.415 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -10.264 -11.878 -8.650 1.00 0.00 H new ATOM 1070 N ILE A 772 -6.671 -5.863 -5.080 1.00 0.00 N ATOM 1071 CA ILE A 772 -6.997 -4.544 -4.562 1.00 0.00 C ATOM 1072 C ILE A 772 -5.813 -3.913 -3.859 1.00 0.00 C ATOM 1073 O ILE A 772 -5.496 -2.771 -4.129 1.00 0.00 O ATOM 1074 CB ILE A 772 -8.238 -4.541 -3.624 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -9.480 -4.994 -4.399 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -8.471 -3.144 -3.021 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -10.747 -4.964 -3.584 1.00 0.00 C ATOM 0 H ILE A 772 -7.168 -6.629 -4.625 1.00 0.00 H new ATOM 0 HA ILE A 772 -7.253 -3.944 -5.435 1.00 0.00 H new ATOM 0 HB ILE A 772 -8.051 -5.237 -2.806 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -9.605 -4.355 -5.273 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -9.319 -6.008 -4.766 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.344 -3.170 -2.369 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -7.596 -2.847 -2.443 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -8.638 -2.425 -3.823 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -11.583 -5.297 -4.199 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -10.642 -5.626 -2.724 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -10.933 -3.947 -3.239 1.00 0.00 H new ATOM 1089 N ILE A 773 -5.136 -4.666 -2.987 1.00 0.00 N ATOM 1090 CA ILE A 773 -3.981 -4.124 -2.267 1.00 0.00 C ATOM 1091 C ILE A 773 -2.909 -3.660 -3.277 1.00 0.00 C ATOM 1092 O ILE A 773 -2.337 -2.585 -3.127 1.00 0.00 O ATOM 1093 CB ILE A 773 -3.399 -5.131 -1.195 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -2.274 -4.519 -0.364 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -2.924 -6.397 -1.818 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.714 -3.375 0.509 1.00 0.00 C ATOM 0 H ILE A 773 -5.362 -5.636 -2.765 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.316 -3.259 -1.694 1.00 0.00 H new ATOM 0 HB ILE A 773 -4.231 -5.357 -0.528 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -1.836 -5.295 0.264 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -1.489 -4.170 -1.034 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -2.533 -7.058 -1.045 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -3.754 -6.886 -2.328 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -2.137 -6.175 -2.538 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.859 -2.994 1.068 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -3.125 -2.580 -0.113 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.477 -3.722 1.206 1.00 0.00 H new ATOM 1108 N GLU A 774 -2.729 -4.443 -4.348 1.00 0.00 N ATOM 1109 CA GLU A 774 -1.820 -4.097 -5.428 1.00 0.00 C ATOM 1110 C GLU A 774 -2.297 -2.818 -6.113 1.00 0.00 C ATOM 1111 O GLU A 774 -1.542 -1.873 -6.250 1.00 0.00 O ATOM 1112 CB GLU A 774 -1.739 -5.254 -6.438 1.00 0.00 C ATOM 1113 CG GLU A 774 -0.874 -4.993 -7.669 1.00 0.00 C ATOM 1114 CD GLU A 774 0.566 -4.680 -7.341 1.00 0.00 C ATOM 1115 OE1 GLU A 774 1.316 -5.605 -6.964 1.00 0.00 O ATOM 1116 OE2 GLU A 774 0.989 -3.524 -7.512 1.00 0.00 O ATOM 0 H GLU A 774 -3.212 -5.331 -4.482 1.00 0.00 H new ATOM 0 HA GLU A 774 -0.824 -3.925 -5.020 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -1.353 -6.135 -5.925 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -2.749 -5.495 -6.770 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -0.908 -5.868 -8.319 1.00 0.00 H new ATOM 0 HG3 GLU A 774 -1.299 -4.162 -8.231 1.00 0.00 H new ATOM 1123 N LYS A 775 -3.572 -2.786 -6.492 1.00 0.00 N ATOM 1124 CA LYS A 775 -4.154 -1.634 -7.169 1.00 0.00 C ATOM 1125 C LYS A 775 -4.134 -0.370 -6.327 1.00 0.00 C ATOM 1126 O LYS A 775 -3.964 0.704 -6.861 1.00 0.00 O ATOM 1127 CB LYS A 775 -5.567 -1.913 -7.678 1.00 0.00 C ATOM 1128 CG LYS A 775 -5.620 -2.872 -8.858 1.00 0.00 C ATOM 1129 CD LYS A 775 -7.055 -3.151 -9.306 1.00 0.00 C ATOM 1130 CE LYS A 775 -7.773 -1.890 -9.800 1.00 0.00 C ATOM 1131 NZ LYS A 775 -7.140 -1.313 -11.003 1.00 0.00 N ATOM 0 H LYS A 775 -4.226 -3.554 -6.339 1.00 0.00 H new ATOM 0 HA LYS A 775 -3.510 -1.457 -8.030 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -6.162 -2.323 -6.862 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -6.031 -0.970 -7.968 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -5.055 -2.453 -9.691 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -5.137 -3.810 -8.585 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -7.045 -3.895 -10.103 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -7.614 -3.581 -8.475 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -8.813 -2.131 -10.021 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -7.780 -1.145 -9.004 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -7.728 -0.536 -11.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -6.197 -0.949 -10.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -7.048 -2.048 -11.733 1.00 0.00 H new ATOM 1145 N VAL A 776 -4.299 -0.496 -5.029 1.00 0.00 N ATOM 1146 CA VAL A 776 -4.254 0.660 -4.147 1.00 0.00 C ATOM 1147 C VAL A 776 -2.815 1.177 -4.017 1.00 0.00 C ATOM 1148 O VAL A 776 -2.578 2.392 -4.048 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.898 0.372 -2.756 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -4.777 1.576 -1.825 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -6.370 0.007 -2.934 1.00 0.00 C ATOM 0 H VAL A 776 -4.466 -1.384 -4.556 1.00 0.00 H new ATOM 0 HA VAL A 776 -4.858 1.446 -4.600 1.00 0.00 H new ATOM 0 HB VAL A 776 -4.362 -0.462 -2.303 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -5.236 1.341 -0.865 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -3.724 1.816 -1.675 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -5.284 2.432 -2.270 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -6.816 -0.193 -1.960 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -6.895 0.835 -3.410 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -6.451 -0.882 -3.560 1.00 0.00 H new ATOM 1161 N ILE A 777 -1.855 0.258 -3.927 1.00 0.00 N ATOM 1162 CA ILE A 777 -0.438 0.630 -3.905 1.00 0.00 C ATOM 1163 C ILE A 777 -0.064 1.256 -5.263 1.00 0.00 C ATOM 1164 O ILE A 777 0.654 2.258 -5.332 1.00 0.00 O ATOM 1165 CB ILE A 777 0.482 -0.602 -3.598 1.00 0.00 C ATOM 1166 CG1 ILE A 777 0.190 -1.149 -2.187 1.00 0.00 C ATOM 1167 CG2 ILE A 777 1.963 -0.231 -3.730 1.00 0.00 C ATOM 1168 CD1 ILE A 777 0.923 -2.440 -1.848 1.00 0.00 C ATOM 0 H ILE A 777 -2.029 -0.745 -3.868 1.00 0.00 H new ATOM 0 HA ILE A 777 -0.281 1.354 -3.105 1.00 0.00 H new ATOM 0 HB ILE A 777 0.262 -1.379 -4.330 1.00 0.00 H new ATOM 0 HG12 ILE A 777 0.459 -0.389 -1.453 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -0.882 -1.319 -2.091 1.00 0.00 H new ATOM 0 HG21 ILE A 777 2.578 -1.104 -3.512 1.00 0.00 H new ATOM 0 HG22 ILE A 777 2.164 0.109 -4.746 1.00 0.00 H new ATOM 0 HG23 ILE A 777 2.202 0.566 -3.027 1.00 0.00 H new ATOM 0 HD11 ILE A 777 0.660 -2.753 -0.838 1.00 0.00 H new ATOM 0 HD12 ILE A 777 0.636 -3.218 -2.556 1.00 0.00 H new ATOM 0 HD13 ILE A 777 1.999 -2.274 -1.908 1.00 0.00 H new ATOM 1180 N HIS A 778 -0.588 0.668 -6.321 1.00 0.00 N ATOM 1181 CA HIS A 778 -0.420 1.145 -7.690 1.00 0.00 C ATOM 1182 C HIS A 778 -1.009 2.550 -7.829 1.00 0.00 C ATOM 1183 O HIS A 778 -0.368 3.452 -8.353 1.00 0.00 O ATOM 1184 CB HIS A 778 -1.113 0.158 -8.657 1.00 0.00 C ATOM 1185 CG HIS A 778 -1.106 0.547 -10.108 1.00 0.00 C ATOM 1186 ND1 HIS A 778 -0.049 0.346 -10.962 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -2.071 1.142 -10.844 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -0.388 0.826 -12.159 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -1.611 1.320 -12.142 1.00 0.00 N ATOM 0 H HIS A 778 -1.157 -0.176 -6.256 1.00 0.00 H new ATOM 0 HA HIS A 778 0.640 1.197 -7.938 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -0.631 -0.815 -8.559 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -2.148 0.034 -8.339 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -3.045 1.433 -10.480 1.00 0.00 H new ATOM 0 HE1 HIS A 778 0.254 0.812 -13.027 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -2.114 1.745 -12.921 1.00 0.00 H new ATOM 1197 N ARG A 779 -2.211 2.715 -7.329 1.00 0.00 N ATOM 1198 CA ARG A 779 -2.920 3.974 -7.346 1.00 0.00 C ATOM 1199 C ARG A 779 -2.105 5.050 -6.635 1.00 0.00 C ATOM 1200 O ARG A 779 -1.850 6.131 -7.177 1.00 0.00 O ATOM 1201 CB ARG A 779 -4.265 3.792 -6.669 1.00 0.00 C ATOM 1202 CG ARG A 779 -5.140 5.010 -6.655 1.00 0.00 C ATOM 1203 CD ARG A 779 -6.432 4.680 -5.955 1.00 0.00 C ATOM 1204 NE ARG A 779 -7.286 5.839 -5.754 1.00 0.00 N ATOM 1205 CZ ARG A 779 -8.559 5.763 -5.395 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -9.161 4.583 -5.293 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -9.241 6.860 -5.129 1.00 0.00 N ATOM 0 H ARG A 779 -2.736 1.960 -6.888 1.00 0.00 H new ATOM 0 HA ARG A 779 -3.074 4.293 -8.377 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -4.800 2.985 -7.170 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -4.096 3.473 -5.640 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -4.635 5.830 -6.145 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -5.338 5.342 -7.674 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -6.973 3.934 -6.537 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -6.209 4.229 -4.988 1.00 0.00 H new ATOM 0 HE ARG A 779 -6.882 6.764 -5.898 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -8.643 3.727 -5.492 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -10.141 4.533 -5.016 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -8.789 7.771 -5.199 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -10.221 6.797 -4.853 1.00 0.00 H new ATOM 1221 N LEU A 780 -1.658 4.708 -5.453 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.835 5.554 -4.623 1.00 0.00 C ATOM 1223 C LEU A 780 0.436 6.024 -5.357 1.00 0.00 C ATOM 1224 O LEU A 780 0.739 7.224 -5.397 1.00 0.00 O ATOM 1225 CB LEU A 780 -0.464 4.764 -3.362 1.00 0.00 C ATOM 1226 CG LEU A 780 0.537 5.394 -2.405 1.00 0.00 C ATOM 1227 CD1 LEU A 780 0.046 6.735 -1.934 1.00 0.00 C ATOM 1228 CD2 LEU A 780 0.759 4.476 -1.225 1.00 0.00 C ATOM 0 H LEU A 780 -1.863 3.804 -5.027 1.00 0.00 H new ATOM 0 HA LEU A 780 -1.395 6.453 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -1.381 4.567 -2.807 1.00 0.00 H new ATOM 0 HB3 LEU A 780 -0.067 3.798 -3.675 1.00 0.00 H new ATOM 0 HG LEU A 780 1.481 5.540 -2.929 1.00 0.00 H new ATOM 0 HD11 LEU A 780 0.775 7.170 -1.250 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -0.087 7.395 -2.791 1.00 0.00 H new ATOM 0 HD13 LEU A 780 -0.907 6.613 -1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 780 1.476 4.930 -0.541 1.00 0.00 H new ATOM 0 HD22 LEU A 780 -0.186 4.316 -0.706 1.00 0.00 H new ATOM 0 HD23 LEU A 780 1.147 3.520 -1.576 1.00 0.00 H new ATOM 1240 N THR A 781 1.120 5.098 -5.972 1.00 0.00 N ATOM 1241 CA THR A 781 2.401 5.363 -6.593 1.00 0.00 C ATOM 1242 C THR A 781 2.303 6.017 -7.983 1.00 0.00 C ATOM 1243 O THR A 781 3.263 6.636 -8.443 1.00 0.00 O ATOM 1244 CB THR A 781 3.208 4.052 -6.695 1.00 0.00 C ATOM 1245 OG1 THR A 781 2.367 3.013 -7.234 1.00 0.00 O ATOM 1246 CG2 THR A 781 3.728 3.622 -5.335 1.00 0.00 C ATOM 0 H THR A 781 0.808 4.131 -6.060 1.00 0.00 H new ATOM 0 HA THR A 781 2.906 6.085 -5.951 1.00 0.00 H new ATOM 0 HB THR A 781 4.061 4.224 -7.351 1.00 0.00 H new ATOM 0 HG1 THR A 781 2.249 3.154 -8.197 1.00 0.00 H new ATOM 0 HG21 THR A 781 4.293 2.695 -5.438 1.00 0.00 H new ATOM 0 HG22 THR A 781 4.377 4.399 -4.931 1.00 0.00 H new ATOM 0 HG23 THR A 781 2.889 3.462 -4.658 1.00 0.00 H new ATOM 1254 N HIS A 782 1.154 5.910 -8.624 1.00 0.00 N ATOM 1255 CA HIS A 782 1.028 6.359 -10.023 1.00 0.00 C ATOM 1256 C HIS A 782 0.012 7.472 -10.231 1.00 0.00 C ATOM 1257 O HIS A 782 0.160 8.281 -11.135 1.00 0.00 O ATOM 1258 CB HIS A 782 0.658 5.180 -10.931 1.00 0.00 C ATOM 1259 CG HIS A 782 1.721 4.133 -11.077 1.00 0.00 C ATOM 1260 ND1 HIS A 782 2.011 3.180 -10.125 1.00 0.00 N ATOM 1261 CD2 HIS A 782 2.558 3.894 -12.105 1.00 0.00 C ATOM 1262 CE1 HIS A 782 2.986 2.407 -10.591 1.00 0.00 C ATOM 1263 NE2 HIS A 782 3.360 2.798 -11.799 1.00 0.00 N ATOM 0 H HIS A 782 0.301 5.525 -8.219 1.00 0.00 H new ATOM 0 HA HIS A 782 2.006 6.765 -10.284 1.00 0.00 H new ATOM 0 HB2 HIS A 782 -0.243 4.709 -10.539 1.00 0.00 H new ATOM 0 HB3 HIS A 782 0.412 5.566 -11.920 1.00 0.00 H new ATOM 0 HD2 HIS A 782 2.600 4.463 -13.022 1.00 0.00 H new ATOM 0 HE1 HIS A 782 3.415 1.573 -10.056 1.00 0.00 H new ATOM 0 HE2 HIS A 782 4.085 2.383 -12.384 1.00 0.00 H new ATOM 1271 N TYR A 783 -1.017 7.495 -9.434 1.00 0.00 N ATOM 1272 CA TYR A 783 -2.089 8.462 -9.618 1.00 0.00 C ATOM 1273 C TYR A 783 -1.968 9.569 -8.602 1.00 0.00 C ATOM 1274 O TYR A 783 -2.139 10.751 -8.919 1.00 0.00 O ATOM 1275 CB TYR A 783 -3.461 7.792 -9.441 1.00 0.00 C ATOM 1276 CG TYR A 783 -3.767 6.633 -10.370 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -3.076 5.451 -10.266 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -4.772 6.713 -11.314 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -3.356 4.381 -11.059 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -5.072 5.631 -12.119 1.00 0.00 C ATOM 1281 CZ TYR A 783 -4.358 4.467 -11.982 1.00 0.00 C ATOM 1282 OH TYR A 783 -4.657 3.376 -12.765 1.00 0.00 O ATOM 0 H TYR A 783 -1.147 6.860 -8.647 1.00 0.00 H new ATOM 0 HA TYR A 783 -2.006 8.865 -10.627 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -3.538 7.437 -8.413 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -4.232 8.551 -9.575 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -2.287 5.368 -9.533 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -5.329 7.631 -11.424 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -2.788 3.468 -10.958 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -5.863 5.701 -12.851 1.00 0.00 H new ATOM 0 HH TYR A 783 -5.395 3.600 -13.370 1.00 0.00 H new ATOM 1292 N ASP A 784 -1.696 9.183 -7.373 1.00 0.00 N ATOM 1293 CA ASP A 784 -1.612 10.140 -6.279 1.00 0.00 C ATOM 1294 C ASP A 784 -0.272 10.806 -6.179 1.00 0.00 C ATOM 1295 O ASP A 784 -0.200 12.028 -6.102 1.00 0.00 O ATOM 1296 CB ASP A 784 -1.994 9.528 -4.931 1.00 0.00 C ATOM 1297 CG ASP A 784 -3.486 9.412 -4.742 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -4.141 10.453 -4.490 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -4.032 8.297 -4.830 1.00 0.00 O ATOM 0 H ASP A 784 -1.529 8.214 -7.102 1.00 0.00 H new ATOM 0 HA ASP A 784 -2.345 10.908 -6.525 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -1.544 8.539 -4.846 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -1.577 10.138 -4.129 1.00 0.00 H new ATOM 1304 N HIS A 785 0.791 10.001 -6.153 1.00 0.00 N ATOM 1305 CA HIS A 785 2.180 10.497 -6.019 1.00 0.00 C ATOM 1306 C HIS A 785 2.400 11.139 -4.652 1.00 0.00 C ATOM 1307 O HIS A 785 3.323 11.912 -4.461 1.00 0.00 O ATOM 1308 CB HIS A 785 2.581 11.485 -7.146 1.00 0.00 C ATOM 1309 CG HIS A 785 2.663 10.883 -8.517 1.00 0.00 C ATOM 1310 ND1 HIS A 785 1.837 11.232 -9.559 1.00 0.00 N ATOM 1311 CD2 HIS A 785 3.531 9.971 -9.019 1.00 0.00 C ATOM 1312 CE1 HIS A 785 2.215 10.541 -10.638 1.00 0.00 C ATOM 1313 NE2 HIS A 785 3.246 9.756 -10.364 1.00 0.00 N ATOM 0 H HIS A 785 0.724 8.986 -6.224 1.00 0.00 H new ATOM 0 HA HIS A 785 2.826 9.624 -6.114 1.00 0.00 H new ATOM 0 HB2 HIS A 785 1.859 12.301 -7.167 1.00 0.00 H new ATOM 0 HB3 HIS A 785 3.549 11.921 -6.899 1.00 0.00 H new ATOM 0 HD2 HIS A 785 4.320 9.487 -8.462 1.00 0.00 H new ATOM 0 HE1 HIS A 785 1.742 10.613 -11.606 1.00 0.00 H new ATOM 0 HE2 HIS A 785 3.729 9.126 -11.004 1.00 0.00 H new ATOM 1321 N VAL A 786 1.588 10.743 -3.683 1.00 0.00 N ATOM 1322 CA VAL A 786 1.682 11.289 -2.330 1.00 0.00 C ATOM 1323 C VAL A 786 2.594 10.388 -1.475 1.00 0.00 C ATOM 1324 O VAL A 786 2.733 10.541 -0.257 1.00 0.00 O ATOM 1325 CB VAL A 786 0.261 11.446 -1.689 1.00 0.00 C ATOM 1326 CG1 VAL A 786 -0.418 10.113 -1.471 1.00 0.00 C ATOM 1327 CG2 VAL A 786 0.311 12.235 -0.397 1.00 0.00 C ATOM 0 H VAL A 786 0.855 10.045 -3.805 1.00 0.00 H new ATOM 0 HA VAL A 786 2.122 12.285 -2.375 1.00 0.00 H new ATOM 0 HB VAL A 786 -0.337 12.008 -2.406 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -1.400 10.273 -1.025 1.00 0.00 H new ATOM 0 HG12 VAL A 786 -0.533 9.603 -2.427 1.00 0.00 H new ATOM 0 HG13 VAL A 786 0.188 9.501 -0.803 1.00 0.00 H new ATOM 0 HG21 VAL A 786 -0.694 12.321 0.016 1.00 0.00 H new ATOM 0 HG22 VAL A 786 0.954 11.722 0.318 1.00 0.00 H new ATOM 0 HG23 VAL A 786 0.709 13.230 -0.594 1.00 0.00 H new ATOM 1337 N LEU A 787 3.217 9.460 -2.134 1.00 0.00 N ATOM 1338 CA LEU A 787 4.112 8.584 -1.480 1.00 0.00 C ATOM 1339 C LEU A 787 5.512 9.167 -1.542 1.00 0.00 C ATOM 1340 O LEU A 787 5.936 9.711 -2.578 1.00 0.00 O ATOM 1341 CB LEU A 787 4.015 7.129 -2.056 1.00 0.00 C ATOM 1342 CG LEU A 787 4.560 6.793 -3.486 1.00 0.00 C ATOM 1343 CD1 LEU A 787 4.092 7.747 -4.575 1.00 0.00 C ATOM 1344 CD2 LEU A 787 6.065 6.607 -3.503 1.00 0.00 C ATOM 0 H LEU A 787 3.114 9.297 -3.136 1.00 0.00 H new ATOM 0 HA LEU A 787 3.838 8.492 -0.429 1.00 0.00 H new ATOM 0 HB2 LEU A 787 4.530 6.472 -1.355 1.00 0.00 H new ATOM 0 HB3 LEU A 787 2.962 6.848 -2.041 1.00 0.00 H new ATOM 0 HG LEU A 787 4.110 5.832 -3.734 1.00 0.00 H new ATOM 0 HD11 LEU A 787 4.515 7.442 -5.532 1.00 0.00 H new ATOM 0 HD12 LEU A 787 3.004 7.724 -4.636 1.00 0.00 H new ATOM 0 HD13 LEU A 787 4.421 8.759 -4.338 1.00 0.00 H new ATOM 0 HD21 LEU A 787 6.392 6.376 -4.517 1.00 0.00 H new ATOM 0 HD22 LEU A 787 6.549 7.524 -3.166 1.00 0.00 H new ATOM 0 HD23 LEU A 787 6.338 5.787 -2.838 1.00 0.00 H new ATOM 1356 N ILE A 788 6.189 9.091 -0.456 1.00 0.00 N ATOM 1357 CA ILE A 788 7.511 9.571 -0.336 1.00 0.00 C ATOM 1358 C ILE A 788 8.439 8.424 -0.701 1.00 0.00 C ATOM 1359 O ILE A 788 8.252 7.288 -0.238 1.00 0.00 O ATOM 1360 CB ILE A 788 7.839 10.088 1.116 1.00 0.00 C ATOM 1361 CG1 ILE A 788 6.911 11.244 1.585 1.00 0.00 C ATOM 1362 CG2 ILE A 788 9.296 10.508 1.249 1.00 0.00 C ATOM 1363 CD1 ILE A 788 5.507 10.830 2.015 1.00 0.00 C ATOM 0 H ILE A 788 5.823 8.678 0.402 1.00 0.00 H new ATOM 0 HA ILE A 788 7.642 10.425 -1.000 1.00 0.00 H new ATOM 0 HB ILE A 788 7.652 9.237 1.771 1.00 0.00 H new ATOM 0 HG12 ILE A 788 7.391 11.755 2.419 1.00 0.00 H new ATOM 0 HG13 ILE A 788 6.825 11.968 0.775 1.00 0.00 H new ATOM 0 HG21 ILE A 788 9.482 10.858 2.264 1.00 0.00 H new ATOM 0 HG22 ILE A 788 9.941 9.656 1.035 1.00 0.00 H new ATOM 0 HG23 ILE A 788 9.509 11.311 0.543 1.00 0.00 H new ATOM 0 HD11 ILE A 788 4.946 11.712 2.322 1.00 0.00 H new ATOM 0 HD12 ILE A 788 4.998 10.349 1.180 1.00 0.00 H new ATOM 0 HD13 ILE A 788 5.573 10.133 2.850 1.00 0.00 H new ATOM 1375 N GLU A 789 9.366 8.695 -1.556 1.00 0.00 N ATOM 1376 CA GLU A 789 10.328 7.727 -1.999 1.00 0.00 C ATOM 1377 C GLU A 789 11.705 8.251 -1.650 1.00 0.00 C ATOM 1378 O GLU A 789 12.046 9.402 -1.975 1.00 0.00 O ATOM 1379 CB GLU A 789 10.143 7.460 -3.500 1.00 0.00 C ATOM 1380 CG GLU A 789 10.057 8.719 -4.336 1.00 0.00 C ATOM 1381 CD GLU A 789 9.768 8.454 -5.786 1.00 0.00 C ATOM 1382 OE1 GLU A 789 8.577 8.370 -6.158 1.00 0.00 O ATOM 1383 OE2 GLU A 789 10.721 8.353 -6.592 1.00 0.00 O ATOM 0 H GLU A 789 9.484 9.615 -1.980 1.00 0.00 H new ATOM 0 HA GLU A 789 10.194 6.766 -1.502 1.00 0.00 H new ATOM 0 HB2 GLU A 789 10.975 6.853 -3.857 1.00 0.00 H new ATOM 0 HB3 GLU A 789 9.235 6.874 -3.647 1.00 0.00 H new ATOM 0 HG2 GLU A 789 9.277 9.363 -3.930 1.00 0.00 H new ATOM 0 HG3 GLU A 789 10.997 9.265 -4.254 1.00 0.00 H new ATOM 1666 N TYR A 810 12.238 1.861 -1.213 1.00 0.00 N ATOM 1667 CA TYR A 810 11.605 2.107 0.064 1.00 0.00 C ATOM 1668 C TYR A 810 10.625 3.223 -0.068 1.00 0.00 C ATOM 1669 O TYR A 810 11.001 4.364 -0.372 1.00 0.00 O ATOM 1670 CB TYR A 810 12.644 2.431 1.149 1.00 0.00 C ATOM 1671 CG TYR A 810 13.635 1.318 1.395 1.00 0.00 C ATOM 1672 CD1 TYR A 810 13.304 0.236 2.191 1.00 0.00 C ATOM 1673 CD2 TYR A 810 14.893 1.342 0.812 1.00 0.00 C ATOM 1674 CE1 TYR A 810 14.195 -0.790 2.405 1.00 0.00 C ATOM 1675 CE2 TYR A 810 15.789 0.318 1.016 1.00 0.00 C ATOM 1676 CZ TYR A 810 15.436 -0.747 1.814 1.00 0.00 C ATOM 1677 OH TYR A 810 16.329 -1.776 2.022 1.00 0.00 O ATOM 0 HA TYR A 810 11.081 1.201 0.369 1.00 0.00 H new ATOM 0 HB2 TYR A 810 13.187 3.331 0.862 1.00 0.00 H new ATOM 0 HB3 TYR A 810 12.125 2.655 2.081 1.00 0.00 H new ATOM 0 HD1 TYR A 810 12.328 0.196 2.653 1.00 0.00 H new ATOM 0 HD2 TYR A 810 15.174 2.178 0.188 1.00 0.00 H new ATOM 0 HE1 TYR A 810 13.921 -1.625 3.034 1.00 0.00 H new ATOM 0 HE2 TYR A 810 16.764 0.349 0.553 1.00 0.00 H new ATOM 0 HH TYR A 810 17.159 -1.593 1.533 1.00 0.00 H new ATOM 1687 N LEU A 811 9.384 2.907 0.145 1.00 0.00 N ATOM 1688 CA LEU A 811 8.320 3.850 -0.026 1.00 0.00 C ATOM 1689 C LEU A 811 7.620 4.067 1.285 1.00 0.00 C ATOM 1690 O LEU A 811 7.594 3.175 2.150 1.00 0.00 O ATOM 1691 CB LEU A 811 7.314 3.326 -1.050 1.00 0.00 C ATOM 1692 CG LEU A 811 7.883 2.940 -2.412 1.00 0.00 C ATOM 1693 CD1 LEU A 811 6.768 2.523 -3.348 1.00 0.00 C ATOM 1694 CD2 LEU A 811 8.696 4.082 -3.000 1.00 0.00 C ATOM 0 H LEU A 811 9.078 1.981 0.445 1.00 0.00 H new ATOM 0 HA LEU A 811 8.739 4.792 -0.380 1.00 0.00 H new ATOM 0 HB2 LEU A 811 6.816 2.454 -0.626 1.00 0.00 H new ATOM 0 HB3 LEU A 811 6.549 4.088 -1.201 1.00 0.00 H new ATOM 0 HG LEU A 811 8.553 2.090 -2.281 1.00 0.00 H new ATOM 0 HD11 LEU A 811 7.188 2.250 -4.316 1.00 0.00 H new ATOM 0 HD12 LEU A 811 6.241 1.667 -2.927 1.00 0.00 H new ATOM 0 HD13 LEU A 811 6.071 3.351 -3.476 1.00 0.00 H new ATOM 0 HD21 LEU A 811 9.092 3.784 -3.971 1.00 0.00 H new ATOM 0 HD22 LEU A 811 8.059 4.958 -3.121 1.00 0.00 H new ATOM 0 HD23 LEU A 811 9.521 4.324 -2.330 1.00 0.00 H new ATOM 1706 N VAL A 812 7.100 5.241 1.450 1.00 0.00 N ATOM 1707 CA VAL A 812 6.353 5.614 2.618 1.00 0.00 C ATOM 1708 C VAL A 812 5.271 6.622 2.245 1.00 0.00 C ATOM 1709 O VAL A 812 5.489 7.460 1.424 1.00 0.00 O ATOM 1710 CB VAL A 812 7.300 6.127 3.765 1.00 0.00 C ATOM 1711 CG1 VAL A 812 8.458 6.933 3.215 1.00 0.00 C ATOM 1712 CG2 VAL A 812 6.559 6.980 4.770 1.00 0.00 C ATOM 0 H VAL A 812 7.183 5.989 0.761 1.00 0.00 H new ATOM 0 HA VAL A 812 5.852 4.732 3.017 1.00 0.00 H new ATOM 0 HB VAL A 812 7.679 5.234 4.261 1.00 0.00 H new ATOM 0 HG11 VAL A 812 9.090 7.270 4.037 1.00 0.00 H new ATOM 0 HG12 VAL A 812 9.044 6.312 2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 812 8.075 7.798 2.674 1.00 0.00 H new ATOM 0 HG21 VAL A 812 7.250 7.313 5.544 1.00 0.00 H new ATOM 0 HG22 VAL A 812 6.133 7.848 4.267 1.00 0.00 H new ATOM 0 HG23 VAL A 812 5.759 6.395 5.224 1.00 0.00 H new ATOM 1722 N VAL A 813 4.106 6.506 2.812 1.00 0.00 N ATOM 1723 CA VAL A 813 3.033 7.426 2.499 1.00 0.00 C ATOM 1724 C VAL A 813 2.541 8.132 3.762 1.00 0.00 C ATOM 1725 O VAL A 813 1.786 7.564 4.552 1.00 0.00 O ATOM 1726 CB VAL A 813 1.859 6.721 1.733 1.00 0.00 C ATOM 1727 CG1 VAL A 813 1.348 5.466 2.461 1.00 0.00 C ATOM 1728 CG2 VAL A 813 0.720 7.694 1.493 1.00 0.00 C ATOM 0 H VAL A 813 3.867 5.786 3.494 1.00 0.00 H new ATOM 0 HA VAL A 813 3.433 8.183 1.825 1.00 0.00 H new ATOM 0 HB VAL A 813 2.259 6.393 0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 813 0.536 5.018 1.888 1.00 0.00 H new ATOM 0 HG12 VAL A 813 2.161 4.747 2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 813 0.984 5.742 3.450 1.00 0.00 H new ATOM 0 HG21 VAL A 813 -0.085 7.188 0.961 1.00 0.00 H new ATOM 0 HG22 VAL A 813 0.348 8.062 2.449 1.00 0.00 H new ATOM 0 HG23 VAL A 813 1.078 8.533 0.896 1.00 0.00 H new ATOM 1738 N ASN A 814 2.978 9.361 3.989 1.00 0.00 N ATOM 1739 CA ASN A 814 2.559 10.009 5.219 1.00 0.00 C ATOM 1740 C ASN A 814 2.264 11.496 5.214 1.00 0.00 C ATOM 1741 O ASN A 814 3.059 12.309 5.694 1.00 0.00 O ATOM 1742 CB ASN A 814 3.293 9.573 6.497 1.00 0.00 C ATOM 1743 CG ASN A 814 4.769 9.922 6.569 1.00 0.00 C ATOM 1744 OD1 ASN A 814 5.465 10.010 5.557 1.00 0.00 O ATOM 1745 ND2 ASN A 814 5.249 10.135 7.766 1.00 0.00 N ATOM 0 H ASN A 814 3.587 9.903 3.377 1.00 0.00 H new ATOM 0 HA ASN A 814 1.561 9.571 5.252 1.00 0.00 H new ATOM 0 HB2 ASN A 814 2.791 10.025 7.353 1.00 0.00 H new ATOM 0 HB3 ASN A 814 3.190 8.493 6.601 1.00 0.00 H new ATOM 0 HD21 ASN A 814 6.231 10.384 7.885 1.00 0.00 H new ATOM 0 HD22 ASN A 814 4.641 10.053 8.581 1.00 0.00 H new ATOM 1752 N PRO A 815 1.150 11.882 4.605 1.00 0.00 N ATOM 1753 CA PRO A 815 0.490 13.151 4.905 1.00 0.00 C ATOM 1754 C PRO A 815 -0.701 12.786 5.801 1.00 0.00 C ATOM 1755 O PRO A 815 -1.633 13.552 6.007 1.00 0.00 O ATOM 1756 CB PRO A 815 -0.012 13.554 3.537 1.00 0.00 C ATOM 1757 CG PRO A 815 -0.475 12.262 2.944 1.00 0.00 C ATOM 1758 CD PRO A 815 0.477 11.200 3.457 1.00 0.00 C ATOM 0 HA PRO A 815 1.092 13.921 5.387 1.00 0.00 H new ATOM 0 HB2 PRO A 815 -0.823 14.279 3.604 1.00 0.00 H new ATOM 0 HB3 PRO A 815 0.776 14.012 2.938 1.00 0.00 H new ATOM 0 HG2 PRO A 815 -1.501 12.042 3.241 1.00 0.00 H new ATOM 0 HG3 PRO A 815 -0.460 12.305 1.855 1.00 0.00 H new ATOM 0 HD2 PRO A 815 -0.053 10.302 3.775 1.00 0.00 H new ATOM 0 HD3 PRO A 815 1.192 10.895 2.693 1.00 0.00 H new ATOM 1766 N ASN A 816 -0.589 11.542 6.302 1.00 0.00 N ATOM 1767 CA ASN A 816 -1.602 10.797 6.991 1.00 0.00 C ATOM 1768 C ASN A 816 -2.706 10.512 5.993 1.00 0.00 C ATOM 1769 O ASN A 816 -3.619 11.310 5.792 1.00 0.00 O ATOM 1770 CB ASN A 816 -2.075 11.470 8.267 1.00 0.00 C ATOM 1771 CG ASN A 816 -3.025 10.602 9.066 1.00 0.00 C ATOM 1772 OD1 ASN A 816 -4.241 10.645 8.881 1.00 0.00 O ATOM 1773 ND2 ASN A 816 -2.489 9.821 9.972 1.00 0.00 N ATOM 0 H ASN A 816 0.280 11.015 6.218 1.00 0.00 H new ATOM 0 HA ASN A 816 -1.196 9.853 7.355 1.00 0.00 H new ATOM 0 HB2 ASN A 816 -1.211 11.720 8.883 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -2.570 12.408 8.017 1.00 0.00 H new ATOM 0 HD21 ASN A 816 -3.084 9.226 10.548 1.00 0.00 H new ATOM 0 HD22 ASN A 816 -1.477 9.809 10.101 1.00 0.00 H new ATOM 1780 N TYR A 817 -2.516 9.389 5.289 1.00 0.00 N ATOM 1781 CA TYR A 817 -3.322 8.981 4.134 1.00 0.00 C ATOM 1782 C TYR A 817 -4.811 9.067 4.416 1.00 0.00 C ATOM 1783 O TYR A 817 -5.309 8.542 5.414 1.00 0.00 O ATOM 1784 CB TYR A 817 -2.919 7.562 3.690 1.00 0.00 C ATOM 1785 CG TYR A 817 -3.472 7.101 2.337 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -2.831 7.450 1.151 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -4.603 6.293 2.249 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -3.301 7.013 -0.078 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -5.076 5.849 1.022 1.00 0.00 C ATOM 1790 CZ TYR A 817 -4.419 6.214 -0.137 1.00 0.00 C ATOM 1791 OH TYR A 817 -4.876 5.769 -1.364 1.00 0.00 O ATOM 0 H TYR A 817 -1.778 8.722 5.514 1.00 0.00 H new ATOM 0 HA TYR A 817 -3.120 9.677 3.320 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -1.831 7.509 3.653 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -3.246 6.857 4.454 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -1.950 8.074 1.189 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -5.121 6.007 3.152 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -2.791 7.299 -0.986 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -5.953 5.221 0.974 1.00 0.00 H new ATOM 0 HH TYR A 817 -5.674 5.214 -1.235 1.00 0.00 H new