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 Single : A 718 SER OG : rot 180:sc= 0 USER MOD Single : A 720 TYR OH : rot 110:sc= 1.05 USER MOD Single : A 721 SER OG : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot -80:sc= 1.3 USER MOD Single : A 725 ASN : amide:sc= -2.08! K(o=-2.1!,f=-1.2) USER MOD Single : A 730 HIS : no HE2:sc= -0.0162 K(o=-0.016,f=-1.3) USER MOD Single : A 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 SER OG : rot -123:sc= -1.72! USER MOD Single : A 744 LYS NZ :NH3+ -160:sc= -0.0532 (180deg=-0.342) USER MOD Single : A 746 SER OG : rot 180:sc= 0 USER MOD Single : A 750 ASN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 752 TYR OH : rot -110:sc= -0.108 USER MOD Single : A 754 LYS NZ :NH3+ 132:sc= 1.02 (180deg=-0.0859) USER MOD Single : A 758 SER OG : rot 89:sc= 0.00184 USER MOD Single : A 762 SER OG : rot 75:sc= 1.28 USER MOD Single : A 768 ASN : amide:sc= 1.14 K(o=1.1,f=-1.2) USER MOD Single : A 769 LYS NZ :NH3+ 173:sc= 0.802 (180deg=0.547) USER MOD Single : A 770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 778 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 781 THR OG1 : rot -1:sc= 0.882 USER MOD Single : A 782 HIS : no HE2:sc= 0.0237 X(o=0.024,f=-0.19) USER MOD Single : A 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 785 HIS : no HD1:sc= -0.194 X(o=-0.19,f=-0.0029) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 814 ASN : amide:sc= -1.29 K(o=-1.3,f=-3.8!) USER MOD Single : A 816 ASN : amide:sc= -1.72 K(o=-1.7,f=-6.6!) USER MOD Single : A 817 TYR OH : rot 44:sc= -1.31! USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -17.567 -0.179 -0.188 1.00 0.00 N ATOM 138 CA PHE A 717 -16.120 -0.170 -0.250 1.00 0.00 C ATOM 139 C PHE A 717 -15.555 -0.736 1.037 1.00 0.00 C ATOM 140 O PHE A 717 -14.545 -0.255 1.559 1.00 0.00 O ATOM 141 CB PHE A 717 -15.598 1.262 -0.502 1.00 0.00 C ATOM 142 CG PHE A 717 -15.770 1.742 -1.925 1.00 0.00 C ATOM 143 CD1 PHE A 717 -16.932 2.370 -2.332 1.00 0.00 C ATOM 144 CD2 PHE A 717 -14.760 1.554 -2.853 1.00 0.00 C ATOM 145 CE1 PHE A 717 -17.084 2.802 -3.637 1.00 0.00 C ATOM 146 CE2 PHE A 717 -14.904 1.983 -4.158 1.00 0.00 C ATOM 147 CZ PHE A 717 -16.068 2.608 -4.551 1.00 0.00 C ATOM 0 HA PHE A 717 -15.791 -0.794 -1.081 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -16.117 1.949 0.167 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -14.540 1.302 -0.242 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -17.731 2.525 -1.622 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -13.846 1.064 -2.552 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -17.998 3.291 -3.941 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -14.106 1.829 -4.869 1.00 0.00 H new ATOM 0 HZ PHE A 717 -16.185 2.945 -5.571 1.00 0.00 H new ATOM 157 N SER A 718 -16.194 -1.796 1.510 1.00 0.00 N ATOM 158 CA SER A 718 -15.804 -2.496 2.726 1.00 0.00 C ATOM 159 C SER A 718 -14.374 -3.008 2.602 1.00 0.00 C ATOM 160 O SER A 718 -13.579 -2.922 3.555 1.00 0.00 O ATOM 161 CB SER A 718 -16.776 -3.671 2.984 1.00 0.00 C ATOM 162 OG SER A 718 -16.402 -4.454 4.120 1.00 0.00 O ATOM 0 H SER A 718 -17.011 -2.201 1.053 1.00 0.00 H new ATOM 0 HA SER A 718 -15.851 -1.805 3.568 1.00 0.00 H new ATOM 0 HB2 SER A 718 -17.782 -3.279 3.133 1.00 0.00 H new ATOM 0 HB3 SER A 718 -16.810 -4.310 2.102 1.00 0.00 H new ATOM 0 HG SER A 718 -17.047 -5.182 4.242 1.00 0.00 H new ATOM 168 N GLU A 719 -14.040 -3.484 1.420 1.00 0.00 N ATOM 169 CA GLU A 719 -12.733 -4.026 1.164 1.00 0.00 C ATOM 170 C GLU A 719 -11.705 -2.924 1.203 1.00 0.00 C ATOM 171 O GLU A 719 -10.728 -3.016 1.940 1.00 0.00 O ATOM 172 CB GLU A 719 -12.706 -4.761 -0.166 1.00 0.00 C ATOM 173 CG GLU A 719 -13.804 -5.802 -0.290 1.00 0.00 C ATOM 174 CD GLU A 719 -13.816 -6.770 0.863 1.00 0.00 C ATOM 175 OE1 GLU A 719 -13.157 -7.801 0.780 1.00 0.00 O ATOM 176 OE2 GLU A 719 -14.513 -6.516 1.872 1.00 0.00 O ATOM 0 H GLU A 719 -14.668 -3.504 0.617 1.00 0.00 H new ATOM 0 HA GLU A 719 -12.490 -4.750 1.942 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -12.804 -4.039 -0.976 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -11.737 -5.246 -0.287 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -14.770 -5.301 -0.349 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -13.674 -6.353 -1.221 1.00 0.00 H new ATOM 183 N TYR A 720 -11.955 -1.854 0.451 1.00 0.00 N ATOM 184 CA TYR A 720 -11.078 -0.690 0.447 1.00 0.00 C ATOM 185 C TYR A 720 -10.879 -0.175 1.867 1.00 0.00 C ATOM 186 O TYR A 720 -9.764 0.158 2.251 1.00 0.00 O ATOM 187 CB TYR A 720 -11.646 0.428 -0.447 1.00 0.00 C ATOM 188 CG TYR A 720 -10.829 1.712 -0.445 1.00 0.00 C ATOM 189 CD1 TYR A 720 -11.069 2.707 0.498 1.00 0.00 C ATOM 190 CD2 TYR A 720 -9.822 1.924 -1.373 1.00 0.00 C ATOM 191 CE1 TYR A 720 -10.337 3.867 0.514 1.00 0.00 C ATOM 192 CE2 TYR A 720 -9.082 3.091 -1.361 1.00 0.00 C ATOM 193 CZ TYR A 720 -9.346 4.059 -0.412 1.00 0.00 C ATOM 194 OH TYR A 720 -8.616 5.236 -0.396 1.00 0.00 O ATOM 0 H TYR A 720 -12.763 -1.771 -0.166 1.00 0.00 H new ATOM 0 HA TYR A 720 -10.114 -0.995 0.040 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -11.716 0.058 -1.470 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -12.661 0.657 -0.121 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -11.848 2.563 1.232 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -9.613 1.168 -2.115 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -10.541 4.626 1.254 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -8.301 3.245 -2.090 1.00 0.00 H new ATOM 0 HH TYR A 720 -7.701 5.049 -0.099 1.00 0.00 H new ATOM 204 N SER A 721 -11.952 -0.132 2.634 1.00 0.00 N ATOM 205 CA SER A 721 -11.918 0.333 4.005 1.00 0.00 C ATOM 206 C SER A 721 -10.966 -0.543 4.845 1.00 0.00 C ATOM 207 O SER A 721 -10.130 -0.025 5.588 1.00 0.00 O ATOM 208 CB SER A 721 -13.342 0.339 4.583 1.00 0.00 C ATOM 209 OG SER A 721 -13.385 0.900 5.877 1.00 0.00 O ATOM 0 H SER A 721 -12.878 -0.421 2.319 1.00 0.00 H new ATOM 0 HA SER A 721 -11.534 1.353 4.035 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.999 0.903 3.921 1.00 0.00 H new ATOM 0 HB3 SER A 721 -13.724 -0.681 4.617 1.00 0.00 H new ATOM 0 HG SER A 721 -14.307 0.887 6.209 1.00 0.00 H new ATOM 215 N ARG A 722 -11.065 -1.852 4.671 1.00 0.00 N ATOM 216 CA ARG A 722 -10.211 -2.809 5.366 1.00 0.00 C ATOM 217 C ARG A 722 -8.728 -2.578 4.998 1.00 0.00 C ATOM 218 O ARG A 722 -7.863 -2.466 5.871 1.00 0.00 O ATOM 219 CB ARG A 722 -10.621 -4.236 4.971 1.00 0.00 C ATOM 220 CG ARG A 722 -9.809 -5.348 5.624 1.00 0.00 C ATOM 221 CD ARG A 722 -10.271 -5.699 7.034 1.00 0.00 C ATOM 222 NE ARG A 722 -10.244 -4.597 8.000 1.00 0.00 N ATOM 223 CZ ARG A 722 -9.466 -4.574 9.083 1.00 0.00 C ATOM 224 NH1 ARG A 722 -8.393 -5.342 9.153 1.00 0.00 N ATOM 225 NH2 ARG A 722 -9.741 -3.738 10.073 1.00 0.00 N ATOM 0 H ARG A 722 -11.742 -2.284 4.042 1.00 0.00 H new ATOM 0 HA ARG A 722 -10.330 -2.673 6.441 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -11.672 -4.378 5.224 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -10.538 -4.334 3.889 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -9.865 -6.240 5.001 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -8.762 -5.048 5.659 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -11.289 -6.085 6.978 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -9.644 -6.506 7.413 1.00 0.00 H new ATOM 0 HE ARG A 722 -10.857 -3.799 7.834 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -8.155 -5.958 8.375 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -7.803 -5.319 9.985 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -10.546 -3.115 10.006 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -9.148 -3.718 10.903 1.00 0.00 H new ATOM 239 N ILE A 723 -8.461 -2.495 3.707 1.00 0.00 N ATOM 240 CA ILE A 723 -7.103 -2.296 3.199 1.00 0.00 C ATOM 241 C ILE A 723 -6.519 -0.925 3.625 1.00 0.00 C ATOM 242 O ILE A 723 -5.382 -0.838 4.099 1.00 0.00 O ATOM 243 CB ILE A 723 -7.014 -2.470 1.640 1.00 0.00 C ATOM 244 CG1 ILE A 723 -7.040 -3.949 1.188 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.779 -1.804 1.082 1.00 0.00 C ATOM 246 CD1 ILE A 723 -8.334 -4.711 1.394 1.00 0.00 C ATOM 0 H ILE A 723 -9.172 -2.563 2.979 1.00 0.00 H new ATOM 0 HA ILE A 723 -6.496 -3.079 3.654 1.00 0.00 H new ATOM 0 HB ILE A 723 -7.906 -1.985 1.244 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -6.793 -3.983 0.127 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -6.248 -4.478 1.717 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -5.747 -1.943 0.001 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -5.806 -0.739 1.310 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -4.891 -2.249 1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -8.215 -5.733 1.035 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -8.583 -4.726 2.455 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -9.136 -4.223 0.840 1.00 0.00 H new ATOM 258 N SER A 724 -7.290 0.125 3.457 1.00 0.00 N ATOM 259 CA SER A 724 -6.850 1.468 3.850 1.00 0.00 C ATOM 260 C SER A 724 -6.594 1.543 5.361 1.00 0.00 C ATOM 261 O SER A 724 -5.713 2.279 5.824 1.00 0.00 O ATOM 262 CB SER A 724 -7.837 2.547 3.378 1.00 0.00 C ATOM 263 OG SER A 724 -9.163 2.250 3.784 1.00 0.00 O ATOM 0 H SER A 724 -8.226 0.088 3.053 1.00 0.00 H new ATOM 0 HA SER A 724 -5.903 1.669 3.350 1.00 0.00 H new ATOM 0 HB2 SER A 724 -7.540 3.515 3.781 1.00 0.00 H new ATOM 0 HB3 SER A 724 -7.797 2.628 2.292 1.00 0.00 H new ATOM 0 HG SER A 724 -9.553 1.591 3.172 1.00 0.00 H new ATOM 269 N ASN A 725 -7.345 0.752 6.113 1.00 0.00 N ATOM 270 CA ASN A 725 -7.176 0.674 7.548 1.00 0.00 C ATOM 271 C ASN A 725 -5.837 0.012 7.856 1.00 0.00 C ATOM 272 O ASN A 725 -5.167 0.387 8.802 1.00 0.00 O ATOM 273 CB ASN A 725 -8.319 -0.100 8.181 1.00 0.00 C ATOM 274 CG ASN A 725 -8.406 0.088 9.681 1.00 0.00 C ATOM 275 OD1 ASN A 725 -8.043 1.139 10.224 1.00 0.00 O ATOM 276 ND2 ASN A 725 -8.895 -0.905 10.354 1.00 0.00 N ATOM 0 H ASN A 725 -8.083 0.152 5.744 1.00 0.00 H new ATOM 0 HA ASN A 725 -7.186 1.679 7.969 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -9.258 0.215 7.726 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -8.198 -1.161 7.960 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -8.992 -0.836 11.367 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -9.183 -1.756 9.871 1.00 0.00 H new ATOM 283 N LEU A 726 -5.431 -0.965 7.021 1.00 0.00 N ATOM 284 CA LEU A 726 -4.090 -1.555 7.126 1.00 0.00 C ATOM 285 C LEU A 726 -3.049 -0.472 6.996 1.00 0.00 C ATOM 286 O LEU A 726 -2.101 -0.433 7.748 1.00 0.00 O ATOM 287 CB LEU A 726 -3.866 -2.713 6.077 1.00 0.00 C ATOM 288 CG LEU A 726 -2.392 -3.048 5.649 1.00 0.00 C ATOM 289 CD1 LEU A 726 -2.329 -4.410 5.060 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.882 -2.085 4.580 1.00 0.00 C ATOM 0 H LEU A 726 -6.008 -1.356 6.276 1.00 0.00 H new ATOM 0 HA LEU A 726 -3.994 -2.017 8.109 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -4.310 -3.622 6.483 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -4.426 -2.460 5.176 1.00 0.00 H new ATOM 0 HG LEU A 726 -1.780 -2.969 6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -1.303 -4.632 4.767 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -2.662 -5.141 5.797 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -2.975 -4.458 4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.859 -2.349 4.310 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -2.519 -2.151 3.698 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.903 -1.067 4.968 1.00 0.00 H new ATOM 302 N ILE A 727 -3.269 0.424 6.053 1.00 0.00 N ATOM 303 CA ILE A 727 -2.349 1.519 5.794 1.00 0.00 C ATOM 304 C ILE A 727 -2.153 2.384 7.022 1.00 0.00 C ATOM 305 O ILE A 727 -1.019 2.593 7.464 1.00 0.00 O ATOM 306 CB ILE A 727 -2.789 2.356 4.545 1.00 0.00 C ATOM 307 CG1 ILE A 727 -2.440 1.610 3.253 1.00 0.00 C ATOM 308 CG2 ILE A 727 -2.210 3.773 4.534 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.948 1.355 3.092 1.00 0.00 C ATOM 0 H ILE A 727 -4.088 0.415 5.445 1.00 0.00 H new ATOM 0 HA ILE A 727 -1.378 1.084 5.557 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.871 2.472 4.610 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.969 0.657 3.237 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.798 2.187 2.400 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -2.553 4.299 3.643 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -2.543 4.309 5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -1.121 3.721 4.528 1.00 0.00 H new ATOM 0 HD11 ILE A 727 -0.768 0.824 2.157 1.00 0.00 H new ATOM 0 HD12 ILE A 727 -0.416 2.306 3.077 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.590 0.752 3.927 1.00 0.00 H new ATOM 321 N VAL A 728 -3.236 2.823 7.601 1.00 0.00 N ATOM 322 CA VAL A 728 -3.152 3.666 8.767 1.00 0.00 C ATOM 323 C VAL A 728 -2.610 2.893 9.994 1.00 0.00 C ATOM 324 O VAL A 728 -1.721 3.374 10.685 1.00 0.00 O ATOM 325 CB VAL A 728 -4.498 4.420 9.064 1.00 0.00 C ATOM 326 CG1 VAL A 728 -5.672 3.477 9.110 1.00 0.00 C ATOM 327 CG2 VAL A 728 -4.433 5.215 10.351 1.00 0.00 C ATOM 0 H VAL A 728 -4.184 2.614 7.289 1.00 0.00 H new ATOM 0 HA VAL A 728 -2.423 4.445 8.544 1.00 0.00 H new ATOM 0 HB VAL A 728 -4.642 5.115 8.237 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -6.582 4.039 9.318 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -5.770 2.970 8.150 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -5.515 2.738 9.896 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -5.385 5.719 10.516 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.230 4.542 11.184 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -3.637 5.956 10.281 1.00 0.00 H new ATOM 337 N LEU A 729 -3.097 1.680 10.206 1.00 0.00 N ATOM 338 CA LEU A 729 -2.670 0.849 11.337 1.00 0.00 C ATOM 339 C LEU A 729 -1.210 0.446 11.253 1.00 0.00 C ATOM 340 O LEU A 729 -0.480 0.505 12.250 1.00 0.00 O ATOM 341 CB LEU A 729 -3.522 -0.399 11.440 1.00 0.00 C ATOM 342 CG LEU A 729 -4.960 -0.193 11.864 1.00 0.00 C ATOM 343 CD1 LEU A 729 -5.733 -1.466 11.633 1.00 0.00 C ATOM 344 CD2 LEU A 729 -5.024 0.207 13.333 1.00 0.00 C ATOM 0 H LEU A 729 -3.795 1.240 9.607 1.00 0.00 H new ATOM 0 HA LEU A 729 -2.798 1.464 12.228 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -3.519 -0.897 10.470 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -3.050 -1.079 12.149 1.00 0.00 H new ATOM 0 HG LEU A 729 -5.401 0.609 11.272 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -6.770 -1.322 11.937 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -5.698 -1.726 10.575 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -5.291 -2.272 12.220 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -6.064 0.352 13.626 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -4.582 -0.580 13.944 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -4.472 1.135 13.482 1.00 0.00 H new ATOM 356 N HIS A 730 -0.783 0.044 10.088 1.00 0.00 N ATOM 357 CA HIS A 730 0.572 -0.413 9.915 1.00 0.00 C ATOM 358 C HIS A 730 1.539 0.754 9.990 1.00 0.00 C ATOM 359 O HIS A 730 2.555 0.670 10.663 1.00 0.00 O ATOM 360 CB HIS A 730 0.735 -1.215 8.612 1.00 0.00 C ATOM 361 CG HIS A 730 2.070 -1.888 8.448 1.00 0.00 C ATOM 362 ND1 HIS A 730 2.414 -3.070 9.064 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.142 -1.531 7.711 1.00 0.00 C ATOM 364 CE1 HIS A 730 3.652 -3.389 8.691 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.145 -2.485 7.865 1.00 0.00 N ATOM 0 H HIS A 730 -1.353 0.023 9.242 1.00 0.00 H new ATOM 0 HA HIS A 730 0.810 -1.094 10.732 1.00 0.00 H new ATOM 0 HB2 HIS A 730 -0.046 -1.974 8.569 1.00 0.00 H new ATOM 0 HB3 HIS A 730 0.576 -0.545 7.767 1.00 0.00 H new ATOM 0 HD1 HIS A 730 1.823 -3.609 9.697 1.00 0.00 H new ATOM 0 HD2 HIS A 730 3.212 -0.645 7.098 1.00 0.00 H new ATOM 0 HE1 HIS A 730 4.182 -4.270 9.021 1.00 0.00 H new ATOM 373 N LEU A 731 1.211 1.862 9.346 1.00 0.00 N ATOM 374 CA LEU A 731 2.098 3.010 9.406 1.00 0.00 C ATOM 375 C LEU A 731 2.165 3.579 10.834 1.00 0.00 C ATOM 376 O LEU A 731 3.252 3.948 11.308 1.00 0.00 O ATOM 377 CB LEU A 731 1.719 4.087 8.351 1.00 0.00 C ATOM 378 CG LEU A 731 2.705 5.281 8.144 1.00 0.00 C ATOM 379 CD1 LEU A 731 2.619 6.317 9.257 1.00 0.00 C ATOM 380 CD2 LEU A 731 4.140 4.768 8.020 1.00 0.00 C ATOM 0 H LEU A 731 0.364 1.990 8.792 1.00 0.00 H new ATOM 0 HA LEU A 731 3.102 2.673 9.148 1.00 0.00 H new ATOM 0 HB2 LEU A 731 1.593 3.586 7.391 1.00 0.00 H new ATOM 0 HB3 LEU A 731 0.748 4.498 8.626 1.00 0.00 H new ATOM 0 HG LEU A 731 2.408 5.777 7.220 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.326 7.123 9.060 1.00 0.00 H new ATOM 0 HD12 LEU A 731 1.608 6.723 9.298 1.00 0.00 H new ATOM 0 HD13 LEU A 731 2.861 5.848 10.211 1.00 0.00 H new ATOM 0 HD21 LEU A 731 4.816 5.611 7.876 1.00 0.00 H new ATOM 0 HD22 LEU A 731 4.415 4.233 8.929 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.213 4.094 7.166 1.00 0.00 H new ATOM 392 N ARG A 732 1.031 3.605 11.534 1.00 0.00 N ATOM 393 CA ARG A 732 1.006 4.164 12.877 1.00 0.00 C ATOM 394 C ARG A 732 1.850 3.327 13.835 1.00 0.00 C ATOM 395 O ARG A 732 2.494 3.871 14.723 1.00 0.00 O ATOM 396 CB ARG A 732 -0.427 4.384 13.399 1.00 0.00 C ATOM 397 CG ARG A 732 -1.181 3.137 13.831 1.00 0.00 C ATOM 398 CD ARG A 732 -2.656 3.439 14.055 1.00 0.00 C ATOM 399 NE ARG A 732 -2.858 4.592 14.941 1.00 0.00 N ATOM 400 CZ ARG A 732 -4.028 5.204 15.147 1.00 0.00 C ATOM 401 NH1 ARG A 732 -5.154 4.674 14.665 1.00 0.00 N ATOM 402 NH2 ARG A 732 -4.076 6.323 15.864 1.00 0.00 N ATOM 0 H ARG A 732 0.135 3.252 11.198 1.00 0.00 H new ATOM 0 HA ARG A 732 1.458 5.155 12.823 1.00 0.00 H new ATOM 0 HB2 ARG A 732 -0.382 5.068 14.246 1.00 0.00 H new ATOM 0 HB3 ARG A 732 -1.004 4.880 12.619 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -1.076 2.363 13.070 1.00 0.00 H new ATOM 0 HG3 ARG A 732 -0.744 2.743 14.749 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -3.135 3.632 13.095 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -3.143 2.563 14.484 1.00 0.00 H new ATOM 0 HE ARG A 732 -2.043 4.953 15.437 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -5.122 3.801 14.139 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -6.046 5.142 14.823 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -3.220 6.714 16.257 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -4.969 6.790 16.021 1.00 0.00 H new ATOM 416 N LYS A 733 1.880 1.999 13.641 1.00 0.00 N ATOM 417 CA LYS A 733 2.767 1.197 14.455 1.00 0.00 C ATOM 418 C LYS A 733 4.202 1.433 14.028 1.00 0.00 C ATOM 419 O LYS A 733 5.062 1.577 14.846 1.00 0.00 O ATOM 420 CB LYS A 733 2.453 -0.312 14.463 1.00 0.00 C ATOM 421 CG LYS A 733 2.518 -1.017 13.120 1.00 0.00 C ATOM 422 CD LYS A 733 2.683 -2.528 13.259 1.00 0.00 C ATOM 423 CE LYS A 733 4.041 -2.879 13.874 1.00 0.00 C ATOM 424 NZ LYS A 733 4.296 -4.326 13.884 1.00 0.00 N ATOM 0 H LYS A 733 1.322 1.488 12.956 1.00 0.00 H new ATOM 0 HA LYS A 733 2.608 1.526 15.482 1.00 0.00 H new ATOM 0 HB2 LYS A 733 3.150 -0.803 15.142 1.00 0.00 H new ATOM 0 HB3 LYS A 733 1.454 -0.452 14.875 1.00 0.00 H new ATOM 0 HG2 LYS A 733 1.609 -0.805 12.558 1.00 0.00 H new ATOM 0 HG3 LYS A 733 3.351 -0.616 12.543 1.00 0.00 H new ATOM 0 HD2 LYS A 733 1.883 -2.929 13.882 1.00 0.00 H new ATOM 0 HD3 LYS A 733 2.591 -2.999 12.280 1.00 0.00 H new ATOM 0 HE2 LYS A 733 4.830 -2.378 13.314 1.00 0.00 H new ATOM 0 HE3 LYS A 733 4.083 -2.499 14.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 5.227 -4.512 14.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 3.559 -4.805 14.440 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 4.283 -4.688 12.909 1.00 0.00 H new ATOM 438 N VAL A 734 4.419 1.503 12.730 1.00 0.00 N ATOM 439 CA VAL A 734 5.734 1.752 12.141 1.00 0.00 C ATOM 440 C VAL A 734 6.420 2.987 12.726 1.00 0.00 C ATOM 441 O VAL A 734 7.583 2.913 13.114 1.00 0.00 O ATOM 442 CB VAL A 734 5.654 1.816 10.578 1.00 0.00 C ATOM 443 CG1 VAL A 734 6.807 2.598 9.959 1.00 0.00 C ATOM 444 CG2 VAL A 734 5.652 0.404 10.020 1.00 0.00 C ATOM 0 H VAL A 734 3.679 1.388 12.037 1.00 0.00 H new ATOM 0 HA VAL A 734 6.363 0.902 12.407 1.00 0.00 H new ATOM 0 HB VAL A 734 4.733 2.339 10.322 1.00 0.00 H new ATOM 0 HG11 VAL A 734 6.699 2.609 8.874 1.00 0.00 H new ATOM 0 HG12 VAL A 734 6.796 3.621 10.335 1.00 0.00 H new ATOM 0 HG13 VAL A 734 7.752 2.124 10.225 1.00 0.00 H new ATOM 0 HG21 VAL A 734 5.596 0.443 8.932 1.00 0.00 H new ATOM 0 HG22 VAL A 734 6.568 -0.107 10.319 1.00 0.00 H new ATOM 0 HG23 VAL A 734 4.791 -0.139 10.408 1.00 0.00 H new ATOM 454 N GLU A 735 5.705 4.093 12.836 1.00 0.00 N ATOM 455 CA GLU A 735 6.292 5.318 13.383 1.00 0.00 C ATOM 456 C GLU A 735 6.535 5.190 14.890 1.00 0.00 C ATOM 457 O GLU A 735 7.471 5.795 15.444 1.00 0.00 O ATOM 458 CB GLU A 735 5.440 6.550 13.015 1.00 0.00 C ATOM 459 CG GLU A 735 4.049 6.620 13.638 1.00 0.00 C ATOM 460 CD GLU A 735 4.004 7.383 14.946 1.00 0.00 C ATOM 461 OE1 GLU A 735 4.186 8.620 14.940 1.00 0.00 O ATOM 462 OE2 GLU A 735 3.740 6.781 15.982 1.00 0.00 O ATOM 0 H GLU A 735 4.727 4.175 12.559 1.00 0.00 H new ATOM 0 HA GLU A 735 7.270 5.467 12.926 1.00 0.00 H new ATOM 0 HB2 GLU A 735 5.990 7.445 13.305 1.00 0.00 H new ATOM 0 HB3 GLU A 735 5.331 6.579 11.931 1.00 0.00 H new ATOM 0 HG2 GLU A 735 3.367 7.090 12.930 1.00 0.00 H new ATOM 0 HG3 GLU A 735 3.685 5.607 13.806 1.00 0.00 H new ATOM 469 N GLU A 736 5.714 4.385 15.524 1.00 0.00 N ATOM 470 CA GLU A 736 5.803 4.121 16.936 1.00 0.00 C ATOM 471 C GLU A 736 7.043 3.244 17.209 1.00 0.00 C ATOM 472 O GLU A 736 7.863 3.542 18.080 1.00 0.00 O ATOM 473 CB GLU A 736 4.519 3.393 17.384 1.00 0.00 C ATOM 474 CG GLU A 736 4.391 3.123 18.873 1.00 0.00 C ATOM 475 CD GLU A 736 4.347 4.382 19.689 1.00 0.00 C ATOM 476 OE1 GLU A 736 3.364 5.154 19.570 1.00 0.00 O ATOM 477 OE2 GLU A 736 5.288 4.641 20.452 1.00 0.00 O ATOM 0 H GLU A 736 4.953 3.888 15.062 1.00 0.00 H new ATOM 0 HA GLU A 736 5.902 5.052 17.494 1.00 0.00 H new ATOM 0 HB2 GLU A 736 3.660 3.985 17.067 1.00 0.00 H new ATOM 0 HB3 GLU A 736 4.462 2.441 16.856 1.00 0.00 H new ATOM 0 HG2 GLU A 736 3.486 2.544 19.057 1.00 0.00 H new ATOM 0 HG3 GLU A 736 5.232 2.512 19.201 1.00 0.00 H new ATOM 484 N GLU A 737 7.168 2.202 16.411 1.00 0.00 N ATOM 485 CA GLU A 737 8.230 1.213 16.513 1.00 0.00 C ATOM 486 C GLU A 737 9.588 1.758 16.077 1.00 0.00 C ATOM 487 O GLU A 737 10.565 1.685 16.823 1.00 0.00 O ATOM 488 CB GLU A 737 7.894 0.005 15.628 1.00 0.00 C ATOM 489 CG GLU A 737 6.619 -0.736 15.999 1.00 0.00 C ATOM 490 CD GLU A 737 6.720 -1.451 17.302 1.00 0.00 C ATOM 491 OE1 GLU A 737 7.225 -2.587 17.315 1.00 0.00 O ATOM 492 OE2 GLU A 737 6.282 -0.908 18.336 1.00 0.00 O ATOM 0 H GLU A 737 6.516 2.012 15.650 1.00 0.00 H new ATOM 0 HA GLU A 737 8.297 0.932 17.564 1.00 0.00 H new ATOM 0 HB2 GLU A 737 7.811 0.344 14.595 1.00 0.00 H new ATOM 0 HB3 GLU A 737 8.727 -0.697 15.667 1.00 0.00 H new ATOM 0 HG2 GLU A 737 5.793 -0.027 16.043 1.00 0.00 H new ATOM 0 HG3 GLU A 737 6.381 -1.454 15.214 1.00 0.00 H new ATOM 499 N GLU A 738 9.650 2.290 14.873 1.00 0.00 N ATOM 500 CA GLU A 738 10.930 2.668 14.269 1.00 0.00 C ATOM 501 C GLU A 738 10.900 4.056 13.676 1.00 0.00 C ATOM 502 O GLU A 738 11.774 4.872 13.948 1.00 0.00 O ATOM 503 CB GLU A 738 11.248 1.704 13.124 1.00 0.00 C ATOM 504 CG GLU A 738 11.388 0.248 13.542 1.00 0.00 C ATOM 505 CD GLU A 738 11.375 -0.688 12.368 1.00 0.00 C ATOM 506 OE1 GLU A 738 12.395 -0.823 11.650 1.00 0.00 O ATOM 507 OE2 GLU A 738 10.300 -1.266 12.095 1.00 0.00 O ATOM 0 H GLU A 738 8.835 2.474 14.287 1.00 0.00 H new ATOM 0 HA GLU A 738 11.677 2.634 15.062 1.00 0.00 H new ATOM 0 HB2 GLU A 738 10.460 1.779 12.374 1.00 0.00 H new ATOM 0 HB3 GLU A 738 12.175 2.022 12.646 1.00 0.00 H new ATOM 0 HG2 GLU A 738 12.318 0.119 14.095 1.00 0.00 H new ATOM 0 HG3 GLU A 738 10.575 -0.012 14.220 1.00 0.00 H new ATOM 514 N ASP A 739 9.872 4.300 12.874 1.00 0.00 N ATOM 515 CA ASP A 739 9.759 5.467 11.995 1.00 0.00 C ATOM 516 C ASP A 739 10.693 5.279 10.823 1.00 0.00 C ATOM 517 O ASP A 739 11.914 5.205 10.983 1.00 0.00 O ATOM 518 CB ASP A 739 9.966 6.832 12.688 1.00 0.00 C ATOM 519 CG ASP A 739 9.870 7.995 11.714 1.00 0.00 C ATOM 520 OD1 ASP A 739 8.755 8.305 11.243 1.00 0.00 O ATOM 521 OD2 ASP A 739 10.904 8.632 11.417 1.00 0.00 O ATOM 0 H ASP A 739 9.068 3.676 12.812 1.00 0.00 H new ATOM 0 HA ASP A 739 8.724 5.513 11.655 1.00 0.00 H new ATOM 0 HB2 ASP A 739 9.219 6.956 13.472 1.00 0.00 H new ATOM 0 HB3 ASP A 739 10.942 6.847 13.172 1.00 0.00 H new ATOM 526 N GLU A 740 10.087 5.110 9.664 1.00 0.00 N ATOM 527 CA GLU A 740 10.766 4.834 8.404 1.00 0.00 C ATOM 528 C GLU A 740 11.363 3.454 8.436 1.00 0.00 C ATOM 529 O GLU A 740 12.519 3.242 8.058 1.00 0.00 O ATOM 530 CB GLU A 740 11.819 5.879 8.036 1.00 0.00 C ATOM 531 CG GLU A 740 11.271 7.266 7.815 1.00 0.00 C ATOM 532 CD GLU A 740 12.351 8.219 7.404 1.00 0.00 C ATOM 533 OE1 GLU A 740 13.141 8.641 8.274 1.00 0.00 O ATOM 534 OE2 GLU A 740 12.430 8.570 6.224 1.00 0.00 O ATOM 0 H GLU A 740 9.073 5.162 9.566 1.00 0.00 H new ATOM 0 HA GLU A 740 10.011 4.888 7.619 1.00 0.00 H new ATOM 0 HB2 GLU A 740 12.566 5.919 8.829 1.00 0.00 H new ATOM 0 HB3 GLU A 740 12.332 5.556 7.130 1.00 0.00 H new ATOM 0 HG2 GLU A 740 10.498 7.236 7.047 1.00 0.00 H new ATOM 0 HG3 GLU A 740 10.798 7.622 8.730 1.00 0.00 H new ATOM 541 N SER A 741 10.544 2.504 8.885 1.00 0.00 N ATOM 542 CA SER A 741 10.898 1.089 8.943 1.00 0.00 C ATOM 543 C SER A 741 11.336 0.582 7.579 1.00 0.00 C ATOM 544 O SER A 741 12.148 -0.338 7.494 1.00 0.00 O ATOM 545 CB SER A 741 9.692 0.290 9.410 1.00 0.00 C ATOM 546 OG SER A 741 9.246 0.764 10.662 1.00 0.00 O ATOM 0 H SER A 741 9.602 2.700 9.223 1.00 0.00 H new ATOM 0 HA SER A 741 11.726 0.967 9.641 1.00 0.00 H new ATOM 0 HB2 SER A 741 8.889 0.368 8.677 1.00 0.00 H new ATOM 0 HB3 SER A 741 9.953 -0.766 9.485 1.00 0.00 H new ATOM 0 HG SER A 741 9.240 0.027 11.308 1.00 0.00 H new ATOM 552 N ALA A 742 10.792 1.226 6.526 1.00 0.00 N ATOM 553 CA ALA A 742 11.074 0.921 5.138 1.00 0.00 C ATOM 554 C ALA A 742 10.518 -0.429 4.769 1.00 0.00 C ATOM 555 O ALA A 742 11.059 -1.479 5.117 1.00 0.00 O ATOM 556 CB ALA A 742 12.541 1.083 4.824 1.00 0.00 C ATOM 0 H ALA A 742 10.128 1.992 6.638 1.00 0.00 H new ATOM 0 HA ALA A 742 10.562 1.646 4.505 1.00 0.00 H new ATOM 0 HB1 ALA A 742 12.717 0.846 3.775 1.00 0.00 H new ATOM 0 HB2 ALA A 742 12.843 2.112 5.019 1.00 0.00 H new ATOM 0 HB3 ALA A 742 13.124 0.408 5.451 1.00 0.00 H new ATOM 562 N LEU A 743 9.425 -0.388 4.083 1.00 0.00 N ATOM 563 CA LEU A 743 8.659 -1.555 3.800 1.00 0.00 C ATOM 564 C LEU A 743 8.806 -1.900 2.329 1.00 0.00 C ATOM 565 O LEU A 743 9.591 -1.281 1.609 1.00 0.00 O ATOM 566 CB LEU A 743 7.195 -1.234 4.129 1.00 0.00 C ATOM 567 CG LEU A 743 6.963 -0.561 5.496 1.00 0.00 C ATOM 568 CD1 LEU A 743 5.532 -0.079 5.628 1.00 0.00 C ATOM 569 CD2 LEU A 743 7.308 -1.510 6.635 1.00 0.00 C ATOM 0 H LEU A 743 9.033 0.471 3.697 1.00 0.00 H new ATOM 0 HA LEU A 743 8.998 -2.406 4.390 1.00 0.00 H new ATOM 0 HB2 LEU A 743 6.798 -0.584 3.350 1.00 0.00 H new ATOM 0 HB3 LEU A 743 6.620 -2.159 4.095 1.00 0.00 H new ATOM 0 HG LEU A 743 7.624 0.304 5.556 1.00 0.00 H new ATOM 0 HD11 LEU A 743 5.395 0.392 6.601 1.00 0.00 H new ATOM 0 HD12 LEU A 743 5.318 0.645 4.842 1.00 0.00 H new ATOM 0 HD13 LEU A 743 4.853 -0.926 5.536 1.00 0.00 H new ATOM 0 HD21 LEU A 743 7.136 -1.011 7.589 1.00 0.00 H new ATOM 0 HD22 LEU A 743 6.680 -2.398 6.571 1.00 0.00 H new ATOM 0 HD23 LEU A 743 8.356 -1.801 6.562 1.00 0.00 H new ATOM 581 N LYS A 744 8.081 -2.875 1.897 1.00 0.00 N ATOM 582 CA LYS A 744 8.049 -3.267 0.520 1.00 0.00 C ATOM 583 C LYS A 744 6.661 -3.669 0.165 1.00 0.00 C ATOM 584 O LYS A 744 5.965 -4.262 0.989 1.00 0.00 O ATOM 585 CB LYS A 744 9.044 -4.388 0.224 1.00 0.00 C ATOM 586 CG LYS A 744 10.336 -3.890 -0.399 1.00 0.00 C ATOM 587 CD LYS A 744 11.324 -5.016 -0.635 1.00 0.00 C ATOM 588 CE LYS A 744 12.472 -4.550 -1.513 1.00 0.00 C ATOM 589 NZ LYS A 744 12.025 -4.270 -2.900 1.00 0.00 N ATOM 0 H LYS A 744 7.480 -3.437 2.500 1.00 0.00 H new ATOM 0 HA LYS A 744 8.350 -2.419 -0.095 1.00 0.00 H new ATOM 0 HB2 LYS A 744 9.274 -4.915 1.150 1.00 0.00 H new ATOM 0 HB3 LYS A 744 8.579 -5.110 -0.447 1.00 0.00 H new ATOM 0 HG2 LYS A 744 10.115 -3.397 -1.346 1.00 0.00 H new ATOM 0 HG3 LYS A 744 10.788 -3.142 0.252 1.00 0.00 H new ATOM 0 HD2 LYS A 744 11.711 -5.372 0.320 1.00 0.00 H new ATOM 0 HD3 LYS A 744 10.817 -5.858 -1.107 1.00 0.00 H new ATOM 0 HE2 LYS A 744 12.915 -3.651 -1.085 1.00 0.00 H new ATOM 0 HE3 LYS A 744 13.251 -5.313 -1.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 12.845 -4.288 -3.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 11.339 -4.994 -3.197 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 11.577 -3.332 -2.938 1.00 0.00 H new ATOM 603 N ARG A 745 6.247 -3.349 -1.040 1.00 0.00 N ATOM 604 CA ARG A 745 4.890 -3.632 -1.494 1.00 0.00 C ATOM 605 C ARG A 745 4.592 -5.115 -1.475 1.00 0.00 C ATOM 606 O ARG A 745 3.521 -5.527 -1.040 1.00 0.00 O ATOM 607 CB ARG A 745 4.625 -3.031 -2.874 1.00 0.00 C ATOM 608 CG ARG A 745 5.583 -3.475 -3.962 1.00 0.00 C ATOM 609 CD ARG A 745 5.299 -2.764 -5.257 1.00 0.00 C ATOM 610 NE ARG A 745 3.973 -3.053 -5.804 1.00 0.00 N ATOM 611 CZ ARG A 745 3.354 -2.278 -6.713 1.00 0.00 C ATOM 612 NH1 ARG A 745 3.935 -1.144 -7.132 1.00 0.00 N ATOM 613 NH2 ARG A 745 2.175 -2.638 -7.204 1.00 0.00 N ATOM 0 H ARG A 745 6.833 -2.887 -1.736 1.00 0.00 H new ATOM 0 HA ARG A 745 4.209 -3.154 -0.790 1.00 0.00 H new ATOM 0 HB2 ARG A 745 3.610 -3.289 -3.177 1.00 0.00 H new ATOM 0 HB3 ARG A 745 4.668 -1.945 -2.795 1.00 0.00 H new ATOM 0 HG2 ARG A 745 6.609 -3.276 -3.651 1.00 0.00 H new ATOM 0 HG3 ARG A 745 5.498 -4.552 -4.108 1.00 0.00 H new ATOM 0 HD2 ARG A 745 5.392 -1.689 -5.100 1.00 0.00 H new ATOM 0 HD3 ARG A 745 6.055 -3.046 -5.990 1.00 0.00 H new ATOM 0 HE ARG A 745 3.490 -3.890 -5.477 1.00 0.00 H new ATOM 0 HH11 ARG A 745 4.845 -0.870 -6.762 1.00 0.00 H new ATOM 0 HH12 ARG A 745 3.467 -0.556 -7.821 1.00 0.00 H new ATOM 0 HH21 ARG A 745 1.736 -3.504 -6.892 1.00 0.00 H new ATOM 0 HH22 ARG A 745 1.708 -2.048 -7.893 1.00 0.00 H new ATOM 627 N SER A 746 5.575 -5.915 -1.870 1.00 0.00 N ATOM 628 CA SER A 746 5.419 -7.353 -1.892 1.00 0.00 C ATOM 629 C SER A 746 5.205 -7.865 -0.466 1.00 0.00 C ATOM 630 O SER A 746 4.346 -8.703 -0.220 1.00 0.00 O ATOM 631 CB SER A 746 6.649 -7.999 -2.533 1.00 0.00 C ATOM 632 OG SER A 746 6.889 -7.447 -3.832 1.00 0.00 O ATOM 0 H SER A 746 6.489 -5.585 -2.179 1.00 0.00 H new ATOM 0 HA SER A 746 4.547 -7.621 -2.489 1.00 0.00 H new ATOM 0 HB2 SER A 746 7.521 -7.842 -1.898 1.00 0.00 H new ATOM 0 HB3 SER A 746 6.502 -9.076 -2.611 1.00 0.00 H new ATOM 0 HG SER A 746 7.680 -7.870 -4.226 1.00 0.00 H new ATOM 638 N GLU A 747 5.936 -7.266 0.460 1.00 0.00 N ATOM 639 CA GLU A 747 5.887 -7.594 1.867 1.00 0.00 C ATOM 640 C GLU A 747 4.548 -7.204 2.474 1.00 0.00 C ATOM 641 O GLU A 747 3.973 -7.973 3.244 1.00 0.00 O ATOM 642 CB GLU A 747 7.052 -6.910 2.593 1.00 0.00 C ATOM 643 CG GLU A 747 7.054 -7.073 4.103 1.00 0.00 C ATOM 644 CD GLU A 747 8.336 -6.589 4.715 1.00 0.00 C ATOM 645 OE1 GLU A 747 9.291 -7.398 4.805 1.00 0.00 O ATOM 646 OE2 GLU A 747 8.430 -5.408 5.105 1.00 0.00 O ATOM 0 H GLU A 747 6.596 -6.519 0.243 1.00 0.00 H new ATOM 0 HA GLU A 747 5.988 -8.673 1.984 1.00 0.00 H new ATOM 0 HB2 GLU A 747 7.988 -7.306 2.199 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.032 -5.846 2.358 1.00 0.00 H new ATOM 0 HG2 GLU A 747 6.217 -6.520 4.529 1.00 0.00 H new ATOM 0 HG3 GLU A 747 6.905 -8.123 4.355 1.00 0.00 H new ATOM 653 N LEU A 748 4.050 -6.026 2.102 1.00 0.00 N ATOM 654 CA LEU A 748 2.760 -5.536 2.586 1.00 0.00 C ATOM 655 C LEU A 748 1.661 -6.516 2.234 1.00 0.00 C ATOM 656 O LEU A 748 0.908 -6.966 3.105 1.00 0.00 O ATOM 657 CB LEU A 748 2.433 -4.155 1.998 1.00 0.00 C ATOM 658 CG LEU A 748 3.392 -3.015 2.350 1.00 0.00 C ATOM 659 CD1 LEU A 748 2.957 -1.726 1.673 1.00 0.00 C ATOM 660 CD2 LEU A 748 3.472 -2.823 3.855 1.00 0.00 C ATOM 0 H LEU A 748 4.524 -5.389 1.462 1.00 0.00 H new ATOM 0 HA LEU A 748 2.825 -5.440 3.670 1.00 0.00 H new ATOM 0 HB2 LEU A 748 2.397 -4.247 0.912 1.00 0.00 H new ATOM 0 HB3 LEU A 748 1.433 -3.873 2.327 1.00 0.00 H new ATOM 0 HG LEU A 748 4.385 -3.280 1.986 1.00 0.00 H new ATOM 0 HD11 LEU A 748 3.650 -0.926 1.934 1.00 0.00 H new ATOM 0 HD12 LEU A 748 2.955 -1.866 0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 748 1.954 -1.460 2.007 1.00 0.00 H new ATOM 0 HD21 LEU A 748 4.159 -2.008 4.082 1.00 0.00 H new ATOM 0 HD22 LEU A 748 2.483 -2.583 4.244 1.00 0.00 H new ATOM 0 HD23 LEU A 748 3.832 -3.741 4.320 1.00 0.00 H new ATOM 672 N VAL A 749 1.607 -6.881 0.964 1.00 0.00 N ATOM 673 CA VAL A 749 0.612 -7.820 0.487 1.00 0.00 C ATOM 674 C VAL A 749 0.835 -9.178 1.160 1.00 0.00 C ATOM 675 O VAL A 749 -0.102 -9.802 1.630 1.00 0.00 O ATOM 676 CB VAL A 749 0.670 -7.987 -1.063 1.00 0.00 C ATOM 677 CG1 VAL A 749 -0.465 -8.854 -1.552 1.00 0.00 C ATOM 678 CG2 VAL A 749 0.613 -6.647 -1.764 1.00 0.00 C ATOM 0 H VAL A 749 2.244 -6.539 0.245 1.00 0.00 H new ATOM 0 HA VAL A 749 -0.373 -7.429 0.742 1.00 0.00 H new ATOM 0 HB VAL A 749 1.619 -8.467 -1.300 1.00 0.00 H new ATOM 0 HG11 VAL A 749 -0.404 -8.956 -2.635 1.00 0.00 H new ATOM 0 HG12 VAL A 749 -0.396 -9.839 -1.090 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -1.416 -8.394 -1.284 1.00 0.00 H new ATOM 0 HG21 VAL A 749 0.655 -6.799 -2.843 1.00 0.00 H new ATOM 0 HG22 VAL A 749 -0.317 -6.140 -1.505 1.00 0.00 H new ATOM 0 HG23 VAL A 749 1.459 -6.036 -1.450 1.00 0.00 H new ATOM 688 N ASN A 750 2.101 -9.558 1.264 1.00 0.00 N ATOM 689 CA ASN A 750 2.542 -10.841 1.841 1.00 0.00 C ATOM 690 C ASN A 750 1.958 -11.063 3.234 1.00 0.00 C ATOM 691 O ASN A 750 1.176 -12.020 3.458 1.00 0.00 O ATOM 692 CB ASN A 750 4.086 -10.879 1.920 1.00 0.00 C ATOM 693 CG ASN A 750 4.643 -12.182 2.486 1.00 0.00 C ATOM 694 OD1 ASN A 750 4.044 -13.246 2.360 1.00 0.00 O ATOM 695 ND2 ASN A 750 5.810 -12.110 3.079 1.00 0.00 N ATOM 0 H ASN A 750 2.876 -8.976 0.945 1.00 0.00 H new ATOM 0 HA ASN A 750 2.182 -11.638 1.190 1.00 0.00 H new ATOM 0 HB2 ASN A 750 4.495 -10.723 0.922 1.00 0.00 H new ATOM 0 HB3 ASN A 750 4.429 -10.049 2.538 1.00 0.00 H new ATOM 0 HD21 ASN A 750 6.246 -12.954 3.452 1.00 0.00 H new ATOM 0 HD22 ASN A 750 6.282 -11.210 3.168 1.00 0.00 H new ATOM 702 N TRP A 751 2.274 -10.154 4.158 1.00 0.00 N ATOM 703 CA TRP A 751 1.837 -10.317 5.527 1.00 0.00 C ATOM 704 C TRP A 751 0.330 -10.173 5.623 1.00 0.00 C ATOM 705 O TRP A 751 -0.300 -10.801 6.473 1.00 0.00 O ATOM 706 CB TRP A 751 2.572 -9.370 6.532 1.00 0.00 C ATOM 707 CG TRP A 751 2.187 -7.899 6.509 1.00 0.00 C ATOM 708 CD1 TRP A 751 2.826 -6.889 5.860 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.087 -7.284 7.211 1.00 0.00 C ATOM 710 NE1 TRP A 751 2.181 -5.694 6.095 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.114 -5.914 6.917 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.079 -7.768 8.049 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.174 -5.022 7.428 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.851 -6.883 8.556 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.796 -5.527 8.242 1.00 0.00 C ATOM 0 H TRP A 751 2.823 -9.313 3.978 1.00 0.00 H new ATOM 0 HA TRP A 751 2.112 -11.328 5.827 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.401 -9.748 7.540 1.00 0.00 H new ATOM 0 HB3 TRP A 751 3.643 -9.442 6.342 1.00 0.00 H new ATOM 0 HD1 TRP A 751 3.709 -7.006 5.250 1.00 0.00 H new ATOM 0 HE1 TRP A 751 2.457 -4.789 5.715 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.028 -8.818 8.296 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 0.212 -3.970 7.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.633 -7.247 9.206 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -1.539 -4.860 8.653 1.00 0.00 H new ATOM 726 N TYR A 752 -0.238 -9.375 4.717 1.00 0.00 N ATOM 727 CA TYR A 752 -1.660 -9.106 4.705 1.00 0.00 C ATOM 728 C TYR A 752 -2.430 -10.372 4.411 1.00 0.00 C ATOM 729 O TYR A 752 -3.357 -10.732 5.144 1.00 0.00 O ATOM 730 CB TYR A 752 -1.992 -8.043 3.657 1.00 0.00 C ATOM 731 CG TYR A 752 -3.427 -7.576 3.695 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.982 -7.114 4.881 1.00 0.00 C ATOM 733 CD2 TYR A 752 -4.233 -7.583 2.560 1.00 0.00 C ATOM 734 CE1 TYR A 752 -5.270 -6.682 4.937 1.00 0.00 C ATOM 735 CE2 TYR A 752 -5.517 -7.153 2.625 1.00 0.00 C ATOM 736 CZ TYR A 752 -6.032 -6.703 3.819 1.00 0.00 C ATOM 737 OH TYR A 752 -7.323 -6.282 3.891 1.00 0.00 O ATOM 0 H TYR A 752 0.281 -8.903 3.977 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.949 -8.735 5.688 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -1.337 -7.185 3.804 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.776 -8.443 2.666 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -3.379 -7.097 5.777 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -3.832 -7.934 1.620 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.683 -6.324 5.869 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -6.136 -7.164 1.740 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.924 -7.049 3.787 1.00 0.00 H new ATOM 747 N LEU A 753 -2.014 -11.064 3.365 1.00 0.00 N ATOM 748 CA LEU A 753 -2.649 -12.295 2.938 1.00 0.00 C ATOM 749 C LEU A 753 -2.583 -13.325 4.047 1.00 0.00 C ATOM 750 O LEU A 753 -3.542 -14.017 4.320 1.00 0.00 O ATOM 751 CB LEU A 753 -1.962 -12.830 1.696 1.00 0.00 C ATOM 752 CG LEU A 753 -1.840 -11.855 0.528 1.00 0.00 C ATOM 753 CD1 LEU A 753 -1.061 -12.478 -0.588 1.00 0.00 C ATOM 754 CD2 LEU A 753 -3.199 -11.342 0.048 1.00 0.00 C ATOM 0 H LEU A 753 -1.222 -10.785 2.786 1.00 0.00 H new ATOM 0 HA LEU A 753 -3.694 -12.090 2.706 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -0.961 -13.162 1.973 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -2.507 -13.710 1.354 1.00 0.00 H new ATOM 0 HG LEU A 753 -1.296 -10.981 0.885 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -0.981 -11.772 -1.415 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -0.063 -12.737 -0.235 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -1.571 -13.379 -0.928 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -3.055 -10.652 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -3.810 -12.183 -0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -3.702 -10.825 0.865 1.00 0.00 H new ATOM 766 N LYS A 754 -1.452 -13.375 4.708 1.00 0.00 N ATOM 767 CA LYS A 754 -1.241 -14.300 5.831 1.00 0.00 C ATOM 768 C LYS A 754 -2.111 -13.990 7.066 1.00 0.00 C ATOM 769 O LYS A 754 -2.361 -14.871 7.910 1.00 0.00 O ATOM 770 CB LYS A 754 0.248 -14.417 6.174 1.00 0.00 C ATOM 771 CG LYS A 754 0.970 -15.514 5.381 1.00 0.00 C ATOM 772 CD LYS A 754 0.793 -15.352 3.877 1.00 0.00 C ATOM 773 CE LYS A 754 1.244 -16.584 3.119 1.00 0.00 C ATOM 774 NZ LYS A 754 0.536 -17.803 3.575 1.00 0.00 N ATOM 0 H LYS A 754 -0.647 -12.786 4.496 1.00 0.00 H new ATOM 0 HA LYS A 754 -1.583 -15.278 5.493 1.00 0.00 H new ATOM 0 HB2 LYS A 754 0.734 -13.460 5.982 1.00 0.00 H new ATOM 0 HB3 LYS A 754 0.353 -14.620 7.240 1.00 0.00 H new ATOM 0 HG2 LYS A 754 2.032 -15.495 5.624 1.00 0.00 H new ATOM 0 HG3 LYS A 754 0.591 -16.489 5.686 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -0.255 -15.152 3.654 1.00 0.00 H new ATOM 0 HD3 LYS A 754 1.362 -14.487 3.536 1.00 0.00 H new ATOM 0 HE2 LYS A 754 1.068 -16.439 2.053 1.00 0.00 H new ATOM 0 HE3 LYS A 754 2.318 -16.718 3.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 0.187 -18.331 2.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 1.190 -18.402 4.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -0.267 -17.533 4.178 1.00 0.00 H new ATOM 788 N GLU A 755 -2.560 -12.770 7.167 1.00 0.00 N ATOM 789 CA GLU A 755 -3.441 -12.357 8.256 1.00 0.00 C ATOM 790 C GLU A 755 -4.876 -12.693 7.911 1.00 0.00 C ATOM 791 O GLU A 755 -5.614 -13.260 8.716 1.00 0.00 O ATOM 792 CB GLU A 755 -3.329 -10.858 8.529 1.00 0.00 C ATOM 793 CG GLU A 755 -1.994 -10.415 9.081 1.00 0.00 C ATOM 794 CD GLU A 755 -1.697 -10.998 10.433 1.00 0.00 C ATOM 795 OE1 GLU A 755 -2.225 -10.483 11.438 1.00 0.00 O ATOM 796 OE2 GLU A 755 -0.903 -11.964 10.531 1.00 0.00 O ATOM 0 H GLU A 755 -2.334 -12.027 6.506 1.00 0.00 H new ATOM 0 HA GLU A 755 -3.135 -12.895 9.153 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -3.521 -10.318 7.602 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -4.111 -10.571 9.232 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -1.206 -10.703 8.386 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -1.978 -9.327 9.149 1.00 0.00 H new ATOM 803 N ILE A 756 -5.252 -12.371 6.692 1.00 0.00 N ATOM 804 CA ILE A 756 -6.618 -12.542 6.229 1.00 0.00 C ATOM 805 C ILE A 756 -6.898 -13.967 5.795 1.00 0.00 C ATOM 806 O ILE A 756 -8.027 -14.304 5.509 1.00 0.00 O ATOM 807 CB ILE A 756 -6.948 -11.607 5.043 1.00 0.00 C ATOM 808 CG1 ILE A 756 -6.019 -11.932 3.863 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.831 -10.144 5.467 1.00 0.00 C ATOM 810 CD1 ILE A 756 -6.270 -11.147 2.613 1.00 0.00 C ATOM 0 H ILE A 756 -4.621 -11.983 5.991 1.00 0.00 H new ATOM 0 HA ILE A 756 -7.248 -12.289 7.082 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.978 -11.770 4.724 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -4.989 -11.764 4.177 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -6.112 -12.993 3.631 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -7.067 -9.500 4.620 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -7.529 -9.944 6.280 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.814 -9.943 5.804 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -5.562 -11.453 1.843 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -7.286 -11.332 2.265 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -6.145 -10.084 2.820 1.00 0.00 H new ATOM 822 N GLU A 757 -5.886 -14.815 5.765 1.00 0.00 N ATOM 823 CA GLU A 757 -6.076 -16.191 5.306 1.00 0.00 C ATOM 824 C GLU A 757 -6.987 -17.022 6.236 1.00 0.00 C ATOM 825 O GLU A 757 -7.338 -18.164 5.936 1.00 0.00 O ATOM 826 CB GLU A 757 -4.748 -16.884 4.967 1.00 0.00 C ATOM 827 CG GLU A 757 -3.789 -17.093 6.111 1.00 0.00 C ATOM 828 CD GLU A 757 -2.551 -17.851 5.671 1.00 0.00 C ATOM 829 OE1 GLU A 757 -1.925 -17.486 4.643 1.00 0.00 O ATOM 830 OE2 GLU A 757 -2.163 -18.823 6.361 1.00 0.00 O ATOM 0 H GLU A 757 -4.933 -14.586 6.048 1.00 0.00 H new ATOM 0 HA GLU A 757 -6.623 -16.125 4.366 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -4.972 -17.856 4.528 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -4.242 -16.297 4.200 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -3.497 -16.127 6.523 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -4.288 -17.642 6.909 1.00 0.00 H new ATOM 837 N SER A 758 -7.394 -16.415 7.336 1.00 0.00 N ATOM 838 CA SER A 758 -8.343 -16.990 8.253 1.00 0.00 C ATOM 839 C SER A 758 -9.763 -16.960 7.638 1.00 0.00 C ATOM 840 O SER A 758 -10.572 -17.854 7.876 1.00 0.00 O ATOM 841 CB SER A 758 -8.326 -16.170 9.538 1.00 0.00 C ATOM 842 OG SER A 758 -6.995 -16.024 10.015 1.00 0.00 O ATOM 0 H SER A 758 -7.064 -15.491 7.616 1.00 0.00 H new ATOM 0 HA SER A 758 -8.075 -18.026 8.460 1.00 0.00 H new ATOM 0 HB2 SER A 758 -8.764 -15.188 9.356 1.00 0.00 H new ATOM 0 HB3 SER A 758 -8.939 -16.657 10.296 1.00 0.00 H new ATOM 0 HG SER A 758 -6.591 -15.224 9.618 1.00 0.00 H new ATOM 848 N GLU A 759 -10.038 -15.948 6.813 1.00 0.00 N ATOM 849 CA GLU A 759 -11.372 -15.763 6.224 1.00 0.00 C ATOM 850 C GLU A 759 -11.398 -16.250 4.784 1.00 0.00 C ATOM 851 O GLU A 759 -12.419 -16.149 4.093 1.00 0.00 O ATOM 852 CB GLU A 759 -11.764 -14.284 6.243 1.00 0.00 C ATOM 853 CG GLU A 759 -10.831 -13.423 5.411 1.00 0.00 C ATOM 854 CD GLU A 759 -11.240 -12.006 5.321 1.00 0.00 C ATOM 855 OE1 GLU A 759 -11.047 -11.265 6.268 1.00 0.00 O ATOM 856 OE2 GLU A 759 -11.752 -11.585 4.262 1.00 0.00 O ATOM 0 H GLU A 759 -9.356 -15.242 6.535 1.00 0.00 H new ATOM 0 HA GLU A 759 -12.078 -16.342 6.819 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -12.782 -14.177 5.869 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -11.763 -13.925 7.272 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -9.829 -13.475 5.837 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.771 -13.838 4.405 1.00 0.00 H new ATOM 863 N ILE A 760 -10.287 -16.756 4.328 1.00 0.00 N ATOM 864 CA ILE A 760 -10.181 -17.177 2.963 1.00 0.00 C ATOM 865 C ILE A 760 -10.628 -18.601 2.838 1.00 0.00 C ATOM 866 O ILE A 760 -9.873 -19.531 3.098 1.00 0.00 O ATOM 867 CB ILE A 760 -8.746 -17.011 2.412 1.00 0.00 C ATOM 868 CG1 ILE A 760 -8.271 -15.555 2.561 1.00 0.00 C ATOM 869 CG2 ILE A 760 -8.633 -17.485 0.967 1.00 0.00 C ATOM 870 CD1 ILE A 760 -9.166 -14.530 1.895 1.00 0.00 C ATOM 0 H ILE A 760 -9.442 -16.886 4.884 1.00 0.00 H new ATOM 0 HA ILE A 760 -10.829 -16.536 2.365 1.00 0.00 H new ATOM 0 HB ILE A 760 -8.090 -17.646 3.007 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -8.196 -15.318 3.622 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -7.268 -15.469 2.143 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -7.609 -17.351 0.619 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -8.901 -18.540 0.908 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -9.308 -16.904 0.339 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -8.755 -13.532 2.051 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -9.223 -14.736 0.826 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -10.165 -14.583 2.328 1.00 0.00 H new ATOM 882 N ASP A 761 -11.866 -18.757 2.519 1.00 0.00 N ATOM 883 CA ASP A 761 -12.451 -20.067 2.316 1.00 0.00 C ATOM 884 C ASP A 761 -12.217 -20.515 0.890 1.00 0.00 C ATOM 885 O ASP A 761 -12.148 -21.706 0.599 1.00 0.00 O ATOM 886 CB ASP A 761 -13.956 -20.038 2.610 1.00 0.00 C ATOM 887 CG ASP A 761 -14.708 -19.082 1.711 1.00 0.00 C ATOM 888 OD1 ASP A 761 -14.752 -17.887 2.011 1.00 0.00 O ATOM 889 OD2 ASP A 761 -15.245 -19.510 0.674 1.00 0.00 O ATOM 0 H ASP A 761 -12.518 -17.984 2.387 1.00 0.00 H new ATOM 0 HA ASP A 761 -11.977 -20.770 3.001 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -14.365 -21.041 2.490 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -14.113 -19.752 3.650 1.00 0.00 H new ATOM 894 N SER A 762 -12.028 -19.560 0.019 1.00 0.00 N ATOM 895 CA SER A 762 -11.883 -19.808 -1.378 1.00 0.00 C ATOM 896 C SER A 762 -10.821 -18.880 -1.932 1.00 0.00 C ATOM 897 O SER A 762 -10.634 -17.779 -1.408 1.00 0.00 O ATOM 898 CB SER A 762 -13.217 -19.550 -2.080 1.00 0.00 C ATOM 899 OG SER A 762 -14.252 -20.400 -1.591 1.00 0.00 O ATOM 0 H SER A 762 -11.971 -18.573 0.272 1.00 0.00 H new ATOM 0 HA SER A 762 -11.587 -20.843 -1.546 1.00 0.00 H new ATOM 0 HB2 SER A 762 -13.506 -18.509 -1.938 1.00 0.00 H new ATOM 0 HB3 SER A 762 -13.098 -19.704 -3.152 1.00 0.00 H new ATOM 0 HG SER A 762 -14.543 -20.087 -0.709 1.00 0.00 H new ATOM 905 N GLU A 763 -10.145 -19.311 -2.976 1.00 0.00 N ATOM 906 CA GLU A 763 -9.102 -18.522 -3.621 1.00 0.00 C ATOM 907 C GLU A 763 -9.648 -17.180 -4.108 1.00 0.00 C ATOM 908 O GLU A 763 -8.959 -16.171 -4.029 1.00 0.00 O ATOM 909 CB GLU A 763 -8.496 -19.309 -4.774 1.00 0.00 C ATOM 910 CG GLU A 763 -7.462 -18.557 -5.574 1.00 0.00 C ATOM 911 CD GLU A 763 -6.995 -19.344 -6.749 1.00 0.00 C ATOM 912 OE1 GLU A 763 -7.776 -19.513 -7.705 1.00 0.00 O ATOM 913 OE2 GLU A 763 -5.853 -19.848 -6.733 1.00 0.00 O ATOM 0 H GLU A 763 -10.300 -20.222 -3.408 1.00 0.00 H new ATOM 0 HA GLU A 763 -8.323 -18.314 -2.888 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -8.040 -20.216 -4.377 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -9.297 -19.622 -5.444 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -7.883 -17.611 -5.914 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -6.612 -18.317 -4.936 1.00 0.00 H new ATOM 920 N GLU A 764 -10.897 -17.175 -4.564 1.00 0.00 N ATOM 921 CA GLU A 764 -11.555 -15.948 -5.019 1.00 0.00 C ATOM 922 C GLU A 764 -11.529 -14.847 -3.953 1.00 0.00 C ATOM 923 O GLU A 764 -11.280 -13.686 -4.263 1.00 0.00 O ATOM 924 CB GLU A 764 -12.982 -16.226 -5.459 1.00 0.00 C ATOM 925 CG GLU A 764 -13.084 -17.065 -6.719 1.00 0.00 C ATOM 926 CD GLU A 764 -14.501 -17.226 -7.198 1.00 0.00 C ATOM 927 OE1 GLU A 764 -15.061 -16.256 -7.733 1.00 0.00 O ATOM 928 OE2 GLU A 764 -15.080 -18.317 -7.060 1.00 0.00 O ATOM 0 H GLU A 764 -11.479 -18.010 -4.630 1.00 0.00 H new ATOM 0 HA GLU A 764 -10.988 -15.586 -5.877 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -13.508 -16.735 -4.652 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -13.493 -15.277 -5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -12.489 -16.603 -7.507 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -12.655 -18.049 -6.531 1.00 0.00 H new ATOM 935 N GLU A 765 -11.728 -15.238 -2.708 1.00 0.00 N ATOM 936 CA GLU A 765 -11.723 -14.309 -1.570 1.00 0.00 C ATOM 937 C GLU A 765 -10.337 -13.689 -1.423 1.00 0.00 C ATOM 938 O GLU A 765 -10.187 -12.482 -1.154 1.00 0.00 O ATOM 939 CB GLU A 765 -12.071 -15.061 -0.280 1.00 0.00 C ATOM 940 CG GLU A 765 -13.319 -15.916 -0.373 1.00 0.00 C ATOM 941 CD GLU A 765 -14.553 -15.130 -0.706 1.00 0.00 C ATOM 942 OE1 GLU A 765 -14.783 -14.851 -1.894 1.00 0.00 O ATOM 943 OE2 GLU A 765 -15.328 -14.802 0.218 1.00 0.00 O ATOM 0 H GLU A 765 -11.899 -16.209 -2.446 1.00 0.00 H new ATOM 0 HA GLU A 765 -12.462 -13.528 -1.748 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -11.229 -15.697 -0.006 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -12.200 -14.337 0.525 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -13.170 -16.684 -1.132 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -13.470 -16.431 0.576 1.00 0.00 H new ATOM 950 N LEU A 766 -9.328 -14.524 -1.623 1.00 0.00 N ATOM 951 CA LEU A 766 -7.944 -14.112 -1.527 1.00 0.00 C ATOM 952 C LEU A 766 -7.629 -13.155 -2.659 1.00 0.00 C ATOM 953 O LEU A 766 -7.008 -12.124 -2.448 1.00 0.00 O ATOM 954 CB LEU A 766 -7.017 -15.337 -1.575 1.00 0.00 C ATOM 955 CG LEU A 766 -5.518 -15.081 -1.360 1.00 0.00 C ATOM 956 CD1 LEU A 766 -5.266 -14.503 0.023 1.00 0.00 C ATOM 957 CD2 LEU A 766 -4.731 -16.368 -1.545 1.00 0.00 C ATOM 0 H LEU A 766 -9.451 -15.509 -1.857 1.00 0.00 H new ATOM 0 HA LEU A 766 -7.780 -13.605 -0.576 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -7.352 -16.046 -0.818 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -7.143 -15.821 -2.544 1.00 0.00 H new ATOM 0 HG LEU A 766 -5.183 -14.356 -2.102 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -4.198 -14.329 0.156 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -5.803 -13.560 0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -5.616 -15.205 0.780 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -3.670 -16.171 -1.390 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -5.072 -17.110 -0.823 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -4.886 -16.747 -2.555 1.00 0.00 H new ATOM 969 N ILE A 767 -8.092 -13.502 -3.855 1.00 0.00 N ATOM 970 CA ILE A 767 -7.911 -12.669 -5.040 1.00 0.00 C ATOM 971 C ILE A 767 -8.575 -11.305 -4.840 1.00 0.00 C ATOM 972 O ILE A 767 -7.982 -10.289 -5.146 1.00 0.00 O ATOM 973 CB ILE A 767 -8.458 -13.357 -6.324 1.00 0.00 C ATOM 974 CG1 ILE A 767 -7.706 -14.670 -6.570 1.00 0.00 C ATOM 975 CG2 ILE A 767 -8.331 -12.432 -7.543 1.00 0.00 C ATOM 976 CD1 ILE A 767 -8.221 -15.466 -7.744 1.00 0.00 C ATOM 0 H ILE A 767 -8.603 -14.367 -4.031 1.00 0.00 H new ATOM 0 HA ILE A 767 -6.839 -12.526 -5.178 1.00 0.00 H new ATOM 0 HB ILE A 767 -9.516 -13.572 -6.176 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -6.651 -14.447 -6.731 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -7.768 -15.285 -5.672 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -8.721 -12.938 -8.426 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -8.900 -11.519 -7.368 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -7.282 -12.181 -7.702 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -7.635 -16.379 -7.849 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -9.267 -15.723 -7.579 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -8.133 -14.872 -8.653 1.00 0.00 H new ATOM 988 N ASN A 768 -9.783 -11.306 -4.290 1.00 0.00 N ATOM 989 CA ASN A 768 -10.516 -10.077 -3.973 1.00 0.00 C ATOM 990 C ASN A 768 -9.686 -9.147 -3.100 1.00 0.00 C ATOM 991 O ASN A 768 -9.422 -7.998 -3.462 1.00 0.00 O ATOM 992 CB ASN A 768 -11.845 -10.428 -3.259 1.00 0.00 C ATOM 993 CG ASN A 768 -12.460 -9.266 -2.469 1.00 0.00 C ATOM 994 OD1 ASN A 768 -13.239 -8.466 -2.992 1.00 0.00 O ATOM 995 ND2 ASN A 768 -12.118 -9.192 -1.199 1.00 0.00 N ATOM 0 H ASN A 768 -10.287 -12.159 -4.049 1.00 0.00 H new ATOM 0 HA ASN A 768 -10.730 -9.559 -4.908 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -12.565 -10.768 -4.003 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -11.670 -11.262 -2.580 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -12.501 -8.453 -0.610 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -11.470 -9.874 -0.805 1.00 0.00 H new ATOM 1002 N LYS A 769 -9.215 -9.675 -1.986 1.00 0.00 N ATOM 1003 CA LYS A 769 -8.521 -8.871 -1.016 1.00 0.00 C ATOM 1004 C LYS A 769 -7.128 -8.503 -1.528 1.00 0.00 C ATOM 1005 O LYS A 769 -6.614 -7.427 -1.224 1.00 0.00 O ATOM 1006 CB LYS A 769 -8.469 -9.603 0.325 1.00 0.00 C ATOM 1007 CG LYS A 769 -8.436 -8.665 1.528 1.00 0.00 C ATOM 1008 CD LYS A 769 -9.780 -7.970 1.775 1.00 0.00 C ATOM 1009 CE LYS A 769 -10.820 -8.918 2.363 1.00 0.00 C ATOM 1010 NZ LYS A 769 -10.482 -9.329 3.745 1.00 0.00 N ATOM 0 H LYS A 769 -9.304 -10.660 -1.736 1.00 0.00 H new ATOM 0 HA LYS A 769 -9.063 -7.938 -0.861 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -9.337 -10.257 0.407 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -7.586 -10.242 0.348 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -8.156 -9.231 2.417 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -7.665 -7.910 1.374 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -9.633 -7.129 2.453 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -10.153 -7.561 0.836 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -11.796 -8.433 2.358 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -10.901 -9.803 1.732 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -11.270 -9.875 4.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -9.624 -9.917 3.732 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -10.314 -8.484 4.327 1.00 0.00 H new ATOM 1024 N LYS A 770 -6.558 -9.379 -2.353 1.00 0.00 N ATOM 1025 CA LYS A 770 -5.262 -9.140 -2.968 1.00 0.00 C ATOM 1026 C LYS A 770 -5.376 -8.017 -3.998 1.00 0.00 C ATOM 1027 O LYS A 770 -4.545 -7.120 -4.053 1.00 0.00 O ATOM 1028 CB LYS A 770 -4.759 -10.395 -3.686 1.00 0.00 C ATOM 1029 CG LYS A 770 -3.322 -10.284 -4.187 1.00 0.00 C ATOM 1030 CD LYS A 770 -2.975 -11.388 -5.177 1.00 0.00 C ATOM 1031 CE LYS A 770 -3.193 -12.781 -4.614 1.00 0.00 C ATOM 1032 NZ LYS A 770 -2.848 -13.819 -5.606 1.00 0.00 N ATOM 0 H LYS A 770 -6.983 -10.270 -2.611 1.00 0.00 H new ATOM 0 HA LYS A 770 -4.563 -8.867 -2.178 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -4.833 -11.245 -3.007 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -5.414 -10.605 -4.532 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -3.178 -9.313 -4.661 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -2.638 -10.329 -3.339 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -3.581 -11.266 -6.075 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -1.933 -11.283 -5.479 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -2.585 -12.913 -3.719 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -4.234 -12.895 -4.312 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -3.007 -14.760 -5.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -3.446 -13.705 -6.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -1.848 -13.723 -5.875 1.00 0.00 H new ATOM 1046 N ARG A 771 -6.429 -8.068 -4.789 1.00 0.00 N ATOM 1047 CA ARG A 771 -6.639 -7.109 -5.855 1.00 0.00 C ATOM 1048 C ARG A 771 -6.864 -5.716 -5.279 1.00 0.00 C ATOM 1049 O ARG A 771 -6.448 -4.711 -5.864 1.00 0.00 O ATOM 1050 CB ARG A 771 -7.823 -7.536 -6.728 1.00 0.00 C ATOM 1051 CG ARG A 771 -7.955 -6.779 -8.044 1.00 0.00 C ATOM 1052 CD ARG A 771 -6.713 -6.968 -8.909 1.00 0.00 C ATOM 1053 NE ARG A 771 -6.899 -6.446 -10.266 1.00 0.00 N ATOM 1054 CZ ARG A 771 -5.955 -6.434 -11.218 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -4.677 -6.676 -10.918 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -6.291 -6.118 -12.462 1.00 0.00 N ATOM 0 H ARG A 771 -7.162 -8.774 -4.711 1.00 0.00 H new ATOM 0 HA ARG A 771 -5.747 -7.078 -6.480 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -7.730 -8.600 -6.945 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -8.742 -7.406 -6.157 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -8.835 -7.130 -8.583 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -8.106 -5.718 -7.844 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -5.866 -6.465 -8.441 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -6.466 -8.028 -8.960 1.00 0.00 H new ATOM 0 HE ARG A 771 -7.814 -6.064 -10.504 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -4.408 -6.873 -9.954 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -3.970 -6.664 -11.653 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -7.259 -5.887 -12.686 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -5.581 -6.106 -13.194 1.00 0.00 H new ATOM 1070 N ILE A 772 -7.503 -5.655 -4.125 1.00 0.00 N ATOM 1071 CA ILE A 772 -7.731 -4.384 -3.479 1.00 0.00 C ATOM 1072 C ILE A 772 -6.434 -3.855 -2.866 1.00 0.00 C ATOM 1073 O ILE A 772 -6.097 -2.678 -3.047 1.00 0.00 O ATOM 1074 CB ILE A 772 -8.852 -4.442 -2.403 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -10.187 -4.918 -3.016 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -9.028 -3.073 -1.735 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -10.724 -4.040 -4.135 1.00 0.00 C ATOM 0 H ILE A 772 -7.869 -6.464 -3.623 1.00 0.00 H new ATOM 0 HA ILE A 772 -8.073 -3.698 -4.254 1.00 0.00 H new ATOM 0 HB ILE A 772 -8.552 -5.164 -1.644 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -10.054 -5.930 -3.399 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -10.935 -4.972 -2.225 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.817 -3.133 -0.985 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -8.094 -2.779 -1.257 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -9.299 -2.333 -2.488 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -11.663 -4.453 -4.503 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -10.894 -3.032 -3.757 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -10.000 -4.005 -4.949 1.00 0.00 H new ATOM 1089 N ILE A 773 -5.679 -4.727 -2.187 1.00 0.00 N ATOM 1090 CA ILE A 773 -4.436 -4.300 -1.552 1.00 0.00 C ATOM 1091 C ILE A 773 -3.425 -3.806 -2.598 1.00 0.00 C ATOM 1092 O ILE A 773 -2.819 -2.752 -2.418 1.00 0.00 O ATOM 1093 CB ILE A 773 -3.812 -5.386 -0.569 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -2.573 -4.871 0.161 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -3.469 -6.668 -1.267 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.841 -3.705 1.079 1.00 0.00 C ATOM 0 H ILE A 773 -5.905 -5.714 -2.067 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.692 -3.458 -0.909 1.00 0.00 H new ATOM 0 HB ILE A 773 -4.595 -5.585 0.162 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -2.142 -5.686 0.742 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -1.826 -4.575 -0.576 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -3.048 -7.372 -0.549 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -4.370 -7.095 -1.707 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -2.740 -6.471 -2.053 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.912 -3.399 1.559 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -3.243 -2.872 0.502 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.563 -4.000 1.841 1.00 0.00 H new ATOM 1108 N GLU A 774 -3.315 -4.510 -3.729 1.00 0.00 N ATOM 1109 CA GLU A 774 -2.398 -4.085 -4.778 1.00 0.00 C ATOM 1110 C GLU A 774 -2.885 -2.794 -5.441 1.00 0.00 C ATOM 1111 O GLU A 774 -2.076 -1.953 -5.814 1.00 0.00 O ATOM 1112 CB GLU A 774 -2.144 -5.186 -5.820 1.00 0.00 C ATOM 1113 CG GLU A 774 -3.369 -5.633 -6.595 1.00 0.00 C ATOM 1114 CD GLU A 774 -3.053 -6.692 -7.609 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -3.032 -7.881 -7.268 1.00 0.00 O ATOM 1116 OE2 GLU A 774 -2.792 -6.352 -8.785 1.00 0.00 O ATOM 0 H GLU A 774 -3.840 -5.360 -3.935 1.00 0.00 H new ATOM 0 HA GLU A 774 -1.440 -3.883 -4.299 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -1.396 -4.829 -6.528 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -1.717 -6.052 -5.314 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -4.117 -6.013 -5.899 1.00 0.00 H new ATOM 0 HG3 GLU A 774 -3.810 -4.773 -7.098 1.00 0.00 H new ATOM 1123 N LYS A 775 -4.214 -2.633 -5.553 1.00 0.00 N ATOM 1124 CA LYS A 775 -4.812 -1.421 -6.131 1.00 0.00 C ATOM 1125 C LYS A 775 -4.442 -0.202 -5.289 1.00 0.00 C ATOM 1126 O LYS A 775 -4.025 0.833 -5.813 1.00 0.00 O ATOM 1127 CB LYS A 775 -6.346 -1.542 -6.185 1.00 0.00 C ATOM 1128 CG LYS A 775 -7.037 -0.311 -6.760 1.00 0.00 C ATOM 1129 CD LYS A 775 -8.556 -0.361 -6.616 1.00 0.00 C ATOM 1130 CE LYS A 775 -9.192 -1.500 -7.402 1.00 0.00 C ATOM 1131 NZ LYS A 775 -10.671 -1.427 -7.363 1.00 0.00 N ATOM 0 H LYS A 775 -4.895 -3.329 -5.250 1.00 0.00 H new ATOM 0 HA LYS A 775 -4.426 -1.304 -7.143 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -6.612 -2.411 -6.786 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -6.723 -1.723 -5.178 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -6.659 0.580 -6.258 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -6.780 -0.216 -7.815 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -8.812 -0.467 -5.562 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -8.979 0.586 -6.953 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -8.852 -1.463 -8.437 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -8.863 -2.455 -6.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -11.072 -2.217 -7.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -10.996 -1.487 -6.377 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -10.985 -0.526 -7.777 1.00 0.00 H new ATOM 1145 N VAL A 776 -4.587 -0.347 -3.992 1.00 0.00 N ATOM 1146 CA VAL A 776 -4.295 0.709 -3.042 1.00 0.00 C ATOM 1147 C VAL A 776 -2.805 1.056 -3.039 1.00 0.00 C ATOM 1148 O VAL A 776 -2.439 2.245 -3.043 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.806 0.318 -1.632 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -4.306 1.264 -0.543 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -6.328 0.289 -1.639 1.00 0.00 C ATOM 0 H VAL A 776 -4.915 -1.210 -3.559 1.00 0.00 H new ATOM 0 HA VAL A 776 -4.825 1.611 -3.349 1.00 0.00 H new ATOM 0 HB VAL A 776 -4.409 -0.670 -1.399 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -4.694 0.943 0.424 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -3.216 1.249 -0.520 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -4.650 2.276 -0.754 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -6.691 0.014 -0.649 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -6.709 1.275 -1.905 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -6.675 -0.443 -2.369 1.00 0.00 H new ATOM 1161 N ILE A 777 -1.959 0.033 -3.071 1.00 0.00 N ATOM 1162 CA ILE A 777 -0.513 0.234 -3.149 1.00 0.00 C ATOM 1163 C ILE A 777 -0.158 0.935 -4.470 1.00 0.00 C ATOM 1164 O ILE A 777 0.640 1.875 -4.494 1.00 0.00 O ATOM 1165 CB ILE A 777 0.267 -1.112 -3.025 1.00 0.00 C ATOM 1166 CG1 ILE A 777 0.011 -1.756 -1.649 1.00 0.00 C ATOM 1167 CG2 ILE A 777 1.762 -0.884 -3.238 1.00 0.00 C ATOM 1168 CD1 ILE A 777 0.624 -3.136 -1.472 1.00 0.00 C ATOM 0 H ILE A 777 -2.247 -0.945 -3.044 1.00 0.00 H new ATOM 0 HA ILE A 777 -0.215 0.862 -2.310 1.00 0.00 H new ATOM 0 HB ILE A 777 -0.092 -1.792 -3.797 1.00 0.00 H new ATOM 0 HG12 ILE A 777 0.404 -1.096 -0.875 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -1.065 -1.828 -1.491 1.00 0.00 H new ATOM 0 HG21 ILE A 777 2.291 -1.833 -3.148 1.00 0.00 H new ATOM 0 HG22 ILE A 777 1.929 -0.468 -4.232 1.00 0.00 H new ATOM 0 HG23 ILE A 777 2.135 -0.188 -2.486 1.00 0.00 H new ATOM 0 HD11 ILE A 777 0.393 -3.512 -0.475 1.00 0.00 H new ATOM 0 HD12 ILE A 777 0.214 -3.815 -2.219 1.00 0.00 H new ATOM 0 HD13 ILE A 777 1.705 -3.072 -1.594 1.00 0.00 H new ATOM 1180 N HIS A 778 -0.787 0.496 -5.549 1.00 0.00 N ATOM 1181 CA HIS A 778 -0.594 1.109 -6.848 1.00 0.00 C ATOM 1182 C HIS A 778 -1.003 2.577 -6.831 1.00 0.00 C ATOM 1183 O HIS A 778 -0.236 3.440 -7.276 1.00 0.00 O ATOM 1184 CB HIS A 778 -1.353 0.335 -7.957 1.00 0.00 C ATOM 1185 CG HIS A 778 -1.396 1.044 -9.293 1.00 0.00 C ATOM 1186 ND1 HIS A 778 -0.298 1.249 -10.097 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -2.435 1.648 -9.916 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -0.692 1.964 -11.158 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -1.985 2.229 -11.095 1.00 0.00 N ATOM 0 H HIS A 778 -1.439 -0.288 -5.547 1.00 0.00 H new ATOM 0 HA HIS A 778 0.470 1.060 -7.078 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -0.883 -0.639 -8.091 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -2.374 0.153 -7.623 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -3.452 1.674 -9.554 1.00 0.00 H new ATOM 0 HE1 HIS A 778 -0.040 2.282 -11.958 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -2.539 2.753 -11.773 1.00 0.00 H new ATOM 1197 N ARG A 779 -2.181 2.865 -6.281 1.00 0.00 N ATOM 1198 CA ARG A 779 -2.700 4.227 -6.289 1.00 0.00 C ATOM 1199 C ARG A 779 -1.763 5.133 -5.499 1.00 0.00 C ATOM 1200 O ARG A 779 -1.439 6.252 -5.927 1.00 0.00 O ATOM 1201 CB ARG A 779 -4.103 4.309 -5.709 1.00 0.00 C ATOM 1202 CG ARG A 779 -4.848 5.552 -6.163 1.00 0.00 C ATOM 1203 CD ARG A 779 -6.056 5.842 -5.311 1.00 0.00 C ATOM 1204 NE ARG A 779 -5.658 6.436 -4.038 1.00 0.00 N ATOM 1205 CZ ARG A 779 -6.330 6.394 -2.911 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -7.396 5.604 -2.791 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -5.903 7.113 -1.882 1.00 0.00 N ATOM 0 H ARG A 779 -2.787 2.180 -5.829 1.00 0.00 H new ATOM 0 HA ARG A 779 -2.755 4.555 -7.327 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -4.667 3.424 -6.003 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -4.044 4.302 -4.621 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -4.173 6.407 -6.134 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -5.160 5.427 -7.200 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -6.727 6.519 -5.840 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -6.610 4.921 -5.131 1.00 0.00 H new ATOM 0 HE ARG A 779 -4.768 6.934 -4.023 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -7.694 5.027 -3.578 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -7.914 5.576 -1.913 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -5.065 7.687 -1.974 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -6.413 7.092 -0.999 1.00 0.00 H new ATOM 1221 N LEU A 780 -1.288 4.594 -4.388 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.315 5.223 -3.511 1.00 0.00 C ATOM 1223 C LEU A 780 0.903 5.699 -4.290 1.00 0.00 C ATOM 1224 O LEU A 780 1.300 6.875 -4.211 1.00 0.00 O ATOM 1225 CB LEU A 780 0.117 4.184 -2.453 1.00 0.00 C ATOM 1226 CG LEU A 780 1.379 4.471 -1.637 1.00 0.00 C ATOM 1227 CD1 LEU A 780 1.254 5.757 -0.872 1.00 0.00 C ATOM 1228 CD2 LEU A 780 1.664 3.317 -0.695 1.00 0.00 C ATOM 0 H LEU A 780 -1.580 3.673 -4.061 1.00 0.00 H new ATOM 0 HA LEU A 780 -0.766 6.095 -3.038 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -0.710 4.055 -1.755 1.00 0.00 H new ATOM 0 HB3 LEU A 780 0.257 3.230 -2.960 1.00 0.00 H new ATOM 0 HG LEU A 780 2.214 4.578 -2.329 1.00 0.00 H new ATOM 0 HD11 LEU A 780 2.167 5.932 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU A 780 1.097 6.581 -1.568 1.00 0.00 H new ATOM 0 HD13 LEU A 780 0.407 5.693 -0.189 1.00 0.00 H new ATOM 0 HD21 LEU A 780 2.564 3.531 -0.119 1.00 0.00 H new ATOM 0 HD22 LEU A 780 0.822 3.185 -0.016 1.00 0.00 H new ATOM 0 HD23 LEU A 780 1.811 2.404 -1.272 1.00 0.00 H new ATOM 1240 N THR A 781 1.454 4.807 -5.062 1.00 0.00 N ATOM 1241 CA THR A 781 2.678 5.062 -5.771 1.00 0.00 C ATOM 1242 C THR A 781 2.466 5.891 -7.052 1.00 0.00 C ATOM 1243 O THR A 781 3.389 6.535 -7.539 1.00 0.00 O ATOM 1244 CB THR A 781 3.373 3.718 -6.133 1.00 0.00 C ATOM 1245 OG1 THR A 781 2.472 2.892 -6.915 1.00 0.00 O ATOM 1246 CG2 THR A 781 3.767 2.942 -4.878 1.00 0.00 C ATOM 0 H THR A 781 1.066 3.877 -5.219 1.00 0.00 H new ATOM 0 HA THR A 781 3.311 5.649 -5.105 1.00 0.00 H new ATOM 0 HB THR A 781 4.271 3.955 -6.704 1.00 0.00 H new ATOM 0 HG1 THR A 781 1.618 3.359 -7.031 1.00 0.00 H new ATOM 0 HG21 THR A 781 4.250 2.008 -5.165 1.00 0.00 H new ATOM 0 HG22 THR A 781 4.457 3.540 -4.282 1.00 0.00 H new ATOM 0 HG23 THR A 781 2.875 2.724 -4.290 1.00 0.00 H new ATOM 1254 N HIS A 782 1.251 5.906 -7.569 1.00 0.00 N ATOM 1255 CA HIS A 782 1.020 6.497 -8.879 1.00 0.00 C ATOM 1256 C HIS A 782 0.288 7.840 -8.810 1.00 0.00 C ATOM 1257 O HIS A 782 0.619 8.761 -9.540 1.00 0.00 O ATOM 1258 CB HIS A 782 0.237 5.509 -9.759 1.00 0.00 C ATOM 1259 CG HIS A 782 0.200 5.850 -11.226 1.00 0.00 C ATOM 1260 ND1 HIS A 782 -0.832 6.521 -11.847 1.00 0.00 N ATOM 1261 CD2 HIS A 782 1.089 5.555 -12.204 1.00 0.00 C ATOM 1262 CE1 HIS A 782 -0.550 6.606 -13.148 1.00 0.00 C ATOM 1263 NE2 HIS A 782 0.611 6.034 -13.420 1.00 0.00 N ATOM 0 H HIS A 782 0.422 5.524 -7.114 1.00 0.00 H new ATOM 0 HA HIS A 782 1.997 6.699 -9.318 1.00 0.00 H new ATOM 0 HB2 HIS A 782 0.675 4.518 -9.643 1.00 0.00 H new ATOM 0 HB3 HIS A 782 -0.787 5.450 -9.390 1.00 0.00 H new ATOM 0 HD1 HIS A 782 -1.667 6.889 -11.391 1.00 0.00 H new ATOM 0 HD2 HIS A 782 2.022 5.030 -12.062 1.00 0.00 H new ATOM 0 HE1 HIS A 782 -1.186 7.079 -13.882 1.00 0.00 H new ATOM 1271 N TYR A 783 -0.694 7.951 -7.949 1.00 0.00 N ATOM 1272 CA TYR A 783 -1.517 9.158 -7.916 1.00 0.00 C ATOM 1273 C TYR A 783 -1.260 9.968 -6.658 1.00 0.00 C ATOM 1274 O TYR A 783 -0.915 11.152 -6.729 1.00 0.00 O ATOM 1275 CB TYR A 783 -3.008 8.802 -7.970 1.00 0.00 C ATOM 1276 CG TYR A 783 -3.453 7.973 -9.159 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -3.375 6.599 -9.117 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -3.981 8.564 -10.297 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -3.798 5.817 -10.164 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -4.418 7.790 -11.359 1.00 0.00 C ATOM 1281 CZ TYR A 783 -4.321 6.416 -11.283 1.00 0.00 C ATOM 1282 OH TYR A 783 -4.761 5.636 -12.324 1.00 0.00 O ATOM 0 H TYR A 783 -0.949 7.237 -7.267 1.00 0.00 H new ATOM 0 HA TYR A 783 -1.246 9.752 -8.789 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -3.265 8.261 -7.059 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -3.582 9.728 -7.963 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -2.970 6.123 -8.236 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -4.052 9.640 -10.356 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -3.720 4.741 -10.107 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -4.832 8.258 -12.240 1.00 0.00 H new ATOM 0 HH TYR A 783 -5.104 6.210 -13.041 1.00 0.00 H new ATOM 1292 N ASP A 784 -1.444 9.318 -5.511 1.00 0.00 N ATOM 1293 CA ASP A 784 -1.330 9.945 -4.175 1.00 0.00 C ATOM 1294 C ASP A 784 -0.009 10.630 -3.969 1.00 0.00 C ATOM 1295 O ASP A 784 0.035 11.748 -3.464 1.00 0.00 O ATOM 1296 CB ASP A 784 -1.552 8.917 -3.061 1.00 0.00 C ATOM 1297 CG ASP A 784 -2.964 8.394 -3.017 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -3.437 7.865 -4.039 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -3.619 8.492 -1.971 1.00 0.00 O ATOM 0 H ASP A 784 -1.680 8.327 -5.472 1.00 0.00 H new ATOM 0 HA ASP A 784 -2.111 10.704 -4.129 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -0.865 8.082 -3.202 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -1.308 9.371 -2.101 1.00 0.00 H new ATOM 1304 N HIS A 785 1.068 9.935 -4.327 1.00 0.00 N ATOM 1305 CA HIS A 785 2.440 10.462 -4.247 1.00 0.00 C ATOM 1306 C HIS A 785 2.843 10.676 -2.765 1.00 0.00 C ATOM 1307 O HIS A 785 3.770 11.400 -2.441 1.00 0.00 O ATOM 1308 CB HIS A 785 2.582 11.767 -5.100 1.00 0.00 C ATOM 1309 CG HIS A 785 4.004 12.179 -5.414 1.00 0.00 C ATOM 1310 ND1 HIS A 785 4.681 11.782 -6.546 1.00 0.00 N ATOM 1311 CD2 HIS A 785 4.868 12.957 -4.719 1.00 0.00 C ATOM 1312 CE1 HIS A 785 5.904 12.308 -6.506 1.00 0.00 C ATOM 1313 NE2 HIS A 785 6.075 13.037 -5.410 1.00 0.00 N ATOM 0 H HIS A 785 1.019 8.981 -4.685 1.00 0.00 H new ATOM 0 HA HIS A 785 3.131 9.733 -4.671 1.00 0.00 H new ATOM 0 HB2 HIS A 785 2.045 11.629 -6.038 1.00 0.00 H new ATOM 0 HB3 HIS A 785 2.093 12.584 -4.570 1.00 0.00 H new ATOM 0 HD2 HIS A 785 4.655 13.440 -3.777 1.00 0.00 H new ATOM 0 HE1 HIS A 785 6.658 12.161 -7.266 1.00 0.00 H new ATOM 0 HE2 HIS A 785 6.913 13.548 -5.132 1.00 0.00 H new ATOM 1321 N VAL A 786 2.175 9.970 -1.874 1.00 0.00 N ATOM 1322 CA VAL A 786 2.492 10.063 -0.453 1.00 0.00 C ATOM 1323 C VAL A 786 3.424 8.924 -0.053 1.00 0.00 C ATOM 1324 O VAL A 786 3.570 8.592 1.124 1.00 0.00 O ATOM 1325 CB VAL A 786 1.221 10.084 0.458 1.00 0.00 C ATOM 1326 CG1 VAL A 786 0.360 11.292 0.168 1.00 0.00 C ATOM 1327 CG2 VAL A 786 0.403 8.828 0.312 1.00 0.00 C ATOM 0 H VAL A 786 1.415 9.329 -2.101 1.00 0.00 H new ATOM 0 HA VAL A 786 2.994 11.018 -0.298 1.00 0.00 H new ATOM 0 HB VAL A 786 1.575 10.141 1.487 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -0.516 11.279 0.817 1.00 0.00 H new ATOM 0 HG12 VAL A 786 0.934 12.200 0.352 1.00 0.00 H new ATOM 0 HG13 VAL A 786 0.040 11.269 -0.874 1.00 0.00 H new ATOM 0 HG21 VAL A 786 -0.470 8.885 0.962 1.00 0.00 H new ATOM 0 HG22 VAL A 786 0.078 8.724 -0.723 1.00 0.00 H new ATOM 0 HG23 VAL A 786 1.008 7.965 0.591 1.00 0.00 H new ATOM 1337 N LEU A 787 4.071 8.350 -1.046 1.00 0.00 N ATOM 1338 CA LEU A 787 5.005 7.279 -0.834 1.00 0.00 C ATOM 1339 C LEU A 787 6.391 7.863 -0.640 1.00 0.00 C ATOM 1340 O LEU A 787 6.721 8.907 -1.218 1.00 0.00 O ATOM 1341 CB LEU A 787 5.067 6.326 -2.060 1.00 0.00 C ATOM 1342 CG LEU A 787 5.776 6.865 -3.347 1.00 0.00 C ATOM 1343 CD1 LEU A 787 6.136 5.739 -4.289 1.00 0.00 C ATOM 1344 CD2 LEU A 787 4.917 7.884 -4.090 1.00 0.00 C ATOM 0 H LEU A 787 3.959 8.619 -2.024 1.00 0.00 H new ATOM 0 HA LEU A 787 4.676 6.719 0.041 1.00 0.00 H new ATOM 0 HB2 LEU A 787 5.574 5.412 -1.752 1.00 0.00 H new ATOM 0 HB3 LEU A 787 4.047 6.050 -2.326 1.00 0.00 H new ATOM 0 HG LEU A 787 6.687 7.359 -3.010 1.00 0.00 H new ATOM 0 HD11 LEU A 787 6.627 6.147 -5.173 1.00 0.00 H new ATOM 0 HD12 LEU A 787 6.811 5.046 -3.787 1.00 0.00 H new ATOM 0 HD13 LEU A 787 5.230 5.211 -4.588 1.00 0.00 H new ATOM 0 HD21 LEU A 787 5.449 8.231 -4.976 1.00 0.00 H new ATOM 0 HD22 LEU A 787 3.978 7.419 -4.389 1.00 0.00 H new ATOM 0 HD23 LEU A 787 4.710 8.731 -3.436 1.00 0.00 H new ATOM 1356 N ILE A 788 7.168 7.246 0.186 1.00 0.00 N ATOM 1357 CA ILE A 788 8.543 7.599 0.312 1.00 0.00 C ATOM 1358 C ILE A 788 9.312 6.436 -0.248 1.00 0.00 C ATOM 1359 O ILE A 788 9.148 5.309 0.224 1.00 0.00 O ATOM 1360 CB ILE A 788 8.964 7.767 1.779 1.00 0.00 C ATOM 1361 CG1 ILE A 788 7.892 8.512 2.557 1.00 0.00 C ATOM 1362 CG2 ILE A 788 10.294 8.524 1.846 1.00 0.00 C ATOM 1363 CD1 ILE A 788 8.070 8.439 4.050 1.00 0.00 C ATOM 0 H ILE A 788 6.868 6.483 0.793 1.00 0.00 H new ATOM 0 HA ILE A 788 8.728 8.543 -0.200 1.00 0.00 H new ATOM 0 HB ILE A 788 9.089 6.782 2.229 1.00 0.00 H new ATOM 0 HG12 ILE A 788 7.893 9.558 2.250 1.00 0.00 H new ATOM 0 HG13 ILE A 788 6.916 8.104 2.296 1.00 0.00 H new ATOM 0 HG21 ILE A 788 10.593 8.643 2.887 1.00 0.00 H new ATOM 0 HG22 ILE A 788 11.060 7.962 1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 788 10.177 9.506 1.387 1.00 0.00 H new ATOM 0 HD11 ILE A 788 7.269 8.993 4.539 1.00 0.00 H new ATOM 0 HD12 ILE A 788 8.039 7.397 4.370 1.00 0.00 H new ATOM 0 HD13 ILE A 788 9.031 8.874 4.323 1.00 0.00 H new ATOM 1375 N GLU A 789 10.069 6.660 -1.260 1.00 0.00 N ATOM 1376 CA GLU A 789 10.868 5.609 -1.800 1.00 0.00 C ATOM 1377 C GLU A 789 12.321 5.841 -1.518 1.00 0.00 C ATOM 1378 O GLU A 789 12.959 6.733 -2.060 1.00 0.00 O ATOM 1379 CB GLU A 789 10.509 5.231 -3.260 1.00 0.00 C ATOM 1380 CG GLU A 789 10.285 6.377 -4.234 1.00 0.00 C ATOM 1381 CD GLU A 789 11.540 7.096 -4.667 1.00 0.00 C ATOM 1382 OE1 GLU A 789 12.302 6.543 -5.504 1.00 0.00 O ATOM 1383 OE2 GLU A 789 11.768 8.238 -4.227 1.00 0.00 O ATOM 0 H GLU A 789 10.156 7.559 -1.734 1.00 0.00 H new ATOM 0 HA GLU A 789 10.616 4.691 -1.269 1.00 0.00 H new ATOM 0 HB2 GLU A 789 11.308 4.603 -3.654 1.00 0.00 H new ATOM 0 HB3 GLU A 789 9.605 4.622 -3.240 1.00 0.00 H new ATOM 0 HG2 GLU A 789 9.782 5.989 -5.120 1.00 0.00 H new ATOM 0 HG3 GLU A 789 9.610 7.099 -3.774 1.00 0.00 H new ATOM 1666 N TYR A 810 12.689 0.713 -1.265 1.00 0.00 N ATOM 1667 CA TYR A 810 11.922 0.542 -0.072 1.00 0.00 C ATOM 1668 C TYR A 810 10.785 1.512 -0.076 1.00 0.00 C ATOM 1669 O TYR A 810 10.988 2.724 -0.214 1.00 0.00 O ATOM 1670 CB TYR A 810 12.758 0.682 1.182 1.00 0.00 C ATOM 1671 CG TYR A 810 13.755 -0.435 1.375 1.00 0.00 C ATOM 1672 CD1 TYR A 810 13.371 -1.637 1.956 1.00 0.00 C ATOM 1673 CD2 TYR A 810 15.074 -0.295 0.975 1.00 0.00 C ATOM 1674 CE1 TYR A 810 14.274 -2.664 2.133 1.00 0.00 C ATOM 1675 CE2 TYR A 810 15.981 -1.319 1.149 1.00 0.00 C ATOM 1676 CZ TYR A 810 15.578 -2.497 1.728 1.00 0.00 C ATOM 1677 OH TYR A 810 16.486 -3.519 1.899 1.00 0.00 O ATOM 0 HA TYR A 810 11.534 -0.476 -0.061 1.00 0.00 H new ATOM 0 HB2 TYR A 810 13.292 1.632 1.148 1.00 0.00 H new ATOM 0 HB3 TYR A 810 12.096 0.720 2.047 1.00 0.00 H new ATOM 0 HD1 TYR A 810 12.348 -1.769 2.275 1.00 0.00 H new ATOM 0 HD2 TYR A 810 15.397 0.630 0.520 1.00 0.00 H new ATOM 0 HE1 TYR A 810 13.960 -3.593 2.586 1.00 0.00 H new ATOM 0 HE2 TYR A 810 17.006 -1.195 0.831 1.00 0.00 H new ATOM 0 HH TYR A 810 17.361 -3.239 1.559 1.00 0.00 H new ATOM 1687 N LEU A 811 9.616 0.982 0.071 1.00 0.00 N ATOM 1688 CA LEU A 811 8.410 1.733 -0.006 1.00 0.00 C ATOM 1689 C LEU A 811 7.935 2.076 1.384 1.00 0.00 C ATOM 1690 O LEU A 811 7.763 1.207 2.233 1.00 0.00 O ATOM 1691 CB LEU A 811 7.337 0.923 -0.745 1.00 0.00 C ATOM 1692 CG LEU A 811 5.989 1.617 -0.953 1.00 0.00 C ATOM 1693 CD1 LEU A 811 6.149 2.843 -1.830 1.00 0.00 C ATOM 1694 CD2 LEU A 811 4.979 0.655 -1.552 1.00 0.00 C ATOM 0 H LEU A 811 9.471 -0.011 0.253 1.00 0.00 H new ATOM 0 HA LEU A 811 8.596 2.656 -0.556 1.00 0.00 H new ATOM 0 HB2 LEU A 811 7.732 0.642 -1.721 1.00 0.00 H new ATOM 0 HB3 LEU A 811 7.165 -0.001 -0.193 1.00 0.00 H new ATOM 0 HG LEU A 811 5.616 1.940 0.019 1.00 0.00 H new ATOM 0 HD11 LEU A 811 5.179 3.322 -1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 811 6.836 3.543 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 811 6.546 2.547 -2.801 1.00 0.00 H new ATOM 0 HD21 LEU A 811 4.027 1.167 -1.692 1.00 0.00 H new ATOM 0 HD22 LEU A 811 5.344 0.297 -2.515 1.00 0.00 H new ATOM 0 HD23 LEU A 811 4.840 -0.192 -0.880 1.00 0.00 H new ATOM 1706 N VAL A 812 7.782 3.323 1.634 1.00 0.00 N ATOM 1707 CA VAL A 812 7.269 3.793 2.885 1.00 0.00 C ATOM 1708 C VAL A 812 6.045 4.636 2.540 1.00 0.00 C ATOM 1709 O VAL A 812 5.975 5.169 1.435 1.00 0.00 O ATOM 1710 CB VAL A 812 8.312 4.690 3.608 1.00 0.00 C ATOM 1711 CG1 VAL A 812 8.016 4.843 5.069 1.00 0.00 C ATOM 1712 CG2 VAL A 812 9.751 4.246 3.375 1.00 0.00 C ATOM 0 H VAL A 812 8.010 4.064 0.972 1.00 0.00 H new ATOM 0 HA VAL A 812 7.032 2.959 3.546 1.00 0.00 H new ATOM 0 HB VAL A 812 8.215 5.674 3.150 1.00 0.00 H new ATOM 0 HG11 VAL A 812 8.773 5.478 5.529 1.00 0.00 H new ATOM 0 HG12 VAL A 812 7.034 5.299 5.195 1.00 0.00 H new ATOM 0 HG13 VAL A 812 8.025 3.863 5.547 1.00 0.00 H new ATOM 0 HG21 VAL A 812 10.429 4.914 3.907 1.00 0.00 H new ATOM 0 HG22 VAL A 812 9.882 3.228 3.743 1.00 0.00 H new ATOM 0 HG23 VAL A 812 9.973 4.278 2.308 1.00 0.00 H new ATOM 1722 N VAL A 813 5.098 4.745 3.422 1.00 0.00 N ATOM 1723 CA VAL A 813 3.914 5.525 3.140 1.00 0.00 C ATOM 1724 C VAL A 813 3.715 6.586 4.208 1.00 0.00 C ATOM 1725 O VAL A 813 3.976 6.348 5.370 1.00 0.00 O ATOM 1726 CB VAL A 813 2.629 4.622 3.002 1.00 0.00 C ATOM 1727 CG1 VAL A 813 2.382 3.791 4.260 1.00 0.00 C ATOM 1728 CG2 VAL A 813 1.386 5.455 2.652 1.00 0.00 C ATOM 0 H VAL A 813 5.114 4.308 4.343 1.00 0.00 H new ATOM 0 HA VAL A 813 4.065 6.016 2.178 1.00 0.00 H new ATOM 0 HB VAL A 813 2.817 3.933 2.178 1.00 0.00 H new ATOM 0 HG11 VAL A 813 1.488 3.183 4.125 1.00 0.00 H new ATOM 0 HG12 VAL A 813 3.239 3.142 4.441 1.00 0.00 H new ATOM 0 HG13 VAL A 813 2.243 4.455 5.113 1.00 0.00 H new ATOM 0 HG21 VAL A 813 0.520 4.798 2.565 1.00 0.00 H new ATOM 0 HG22 VAL A 813 1.207 6.189 3.437 1.00 0.00 H new ATOM 0 HG23 VAL A 813 1.548 5.969 1.705 1.00 0.00 H new ATOM 1738 N ASN A 814 3.348 7.759 3.793 1.00 0.00 N ATOM 1739 CA ASN A 814 2.992 8.817 4.707 1.00 0.00 C ATOM 1740 C ASN A 814 1.506 8.705 5.037 1.00 0.00 C ATOM 1741 O ASN A 814 0.691 8.428 4.144 1.00 0.00 O ATOM 1742 CB ASN A 814 3.326 10.199 4.103 1.00 0.00 C ATOM 1743 CG ASN A 814 4.808 10.534 4.163 1.00 0.00 C ATOM 1744 OD1 ASN A 814 5.502 10.162 5.108 1.00 0.00 O ATOM 1745 ND2 ASN A 814 5.312 11.214 3.157 1.00 0.00 N ATOM 0 H ASN A 814 3.284 8.017 2.808 1.00 0.00 H new ATOM 0 HA ASN A 814 3.572 8.717 5.625 1.00 0.00 H new ATOM 0 HB2 ASN A 814 2.996 10.224 3.065 1.00 0.00 H new ATOM 0 HB3 ASN A 814 2.764 10.967 4.635 1.00 0.00 H new ATOM 0 HD21 ASN A 814 6.305 11.447 3.146 1.00 0.00 H new ATOM 0 HD22 ASN A 814 4.710 11.508 2.388 1.00 0.00 H new ATOM 1752 N PRO A 815 1.109 8.958 6.310 1.00 0.00 N ATOM 1753 CA PRO A 815 -0.305 8.803 6.793 1.00 0.00 C ATOM 1754 C PRO A 815 -1.240 9.872 6.219 1.00 0.00 C ATOM 1755 O PRO A 815 -2.423 9.957 6.560 1.00 0.00 O ATOM 1756 CB PRO A 815 -0.171 8.980 8.301 1.00 0.00 C ATOM 1757 CG PRO A 815 1.020 9.852 8.462 1.00 0.00 C ATOM 1758 CD PRO A 815 1.992 9.423 7.399 1.00 0.00 C ATOM 0 HA PRO A 815 -0.740 7.851 6.489 1.00 0.00 H new ATOM 0 HB2 PRO A 815 -1.062 9.440 8.729 1.00 0.00 H new ATOM 0 HB3 PRO A 815 -0.034 8.023 8.804 1.00 0.00 H new ATOM 0 HG2 PRO A 815 0.753 10.903 8.346 1.00 0.00 H new ATOM 0 HG3 PRO A 815 1.454 9.741 9.456 1.00 0.00 H new ATOM 0 HD2 PRO A 815 2.629 10.247 7.078 1.00 0.00 H new ATOM 0 HD3 PRO A 815 2.651 8.629 7.751 1.00 0.00 H new ATOM 1766 N ASN A 816 -0.670 10.670 5.363 1.00 0.00 N ATOM 1767 CA ASN A 816 -1.322 11.729 4.613 1.00 0.00 C ATOM 1768 C ASN A 816 -2.386 11.129 3.731 1.00 0.00 C ATOM 1769 O ASN A 816 -3.391 11.778 3.425 1.00 0.00 O ATOM 1770 CB ASN A 816 -0.299 12.365 3.676 1.00 0.00 C ATOM 1771 CG ASN A 816 0.943 12.914 4.343 1.00 0.00 C ATOM 1772 OD1 ASN A 816 1.384 12.457 5.395 1.00 0.00 O ATOM 1773 ND2 ASN A 816 1.538 13.841 3.702 1.00 0.00 N ATOM 0 H ASN A 816 0.325 10.602 5.150 1.00 0.00 H new ATOM 0 HA ASN A 816 -1.743 12.454 5.310 1.00 0.00 H new ATOM 0 HB2 ASN A 816 0.004 11.621 2.939 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -0.785 13.174 3.131 1.00 0.00 H new ATOM 0 HD21 ASN A 816 2.411 14.229 4.059 1.00 0.00 H new ATOM 0 HD22 ASN A 816 1.141 14.195 2.832 1.00 0.00 H new ATOM 1780 N TYR A 817 -2.090 9.891 3.305 1.00 0.00 N ATOM 1781 CA TYR A 817 -2.907 9.044 2.412 1.00 0.00 C ATOM 1782 C TYR A 817 -4.400 9.279 2.599 1.00 0.00 C ATOM 1783 O TYR A 817 -4.962 9.103 3.691 1.00 0.00 O ATOM 1784 CB TYR A 817 -2.569 7.571 2.633 1.00 0.00 C ATOM 1785 CG TYR A 817 -3.038 6.661 1.520 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -2.251 6.481 0.407 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -4.244 5.981 1.582 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -2.630 5.659 -0.617 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -4.639 5.147 0.553 1.00 0.00 C ATOM 1790 CZ TYR A 817 -3.817 4.991 -0.549 1.00 0.00 C ATOM 1791 OH TYR A 817 -4.202 4.179 -1.591 1.00 0.00 O ATOM 0 H TYR A 817 -1.228 9.426 3.588 1.00 0.00 H new ATOM 0 HA TYR A 817 -2.665 9.322 1.386 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -1.489 7.469 2.742 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -3.017 7.242 3.571 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -1.308 7.003 0.340 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -4.883 6.104 2.444 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -1.990 5.539 -1.479 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -5.581 4.622 0.609 1.00 0.00 H new ATOM 0 HH TYR A 817 -3.437 3.643 -1.888 1.00 0.00 H new