USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=20 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 750 ASN : amide:sc= 1.82 K(o=2.6,f=-5.1!) USER MOD Set 1.2: A 754 LYS NZ :NH3+ 134:sc= 0.737 (180deg=-0.148) USER MOD Single : A 718 SER OG : rot 180:sc= 0 USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 721 SER OG : rot 78:sc= 0.123 USER MOD Single : A 724 SER OG : rot 180:sc= 0 USER MOD Single : A 725 ASN : amide:sc= -0.895 K(o=-0.9,f=-3.3!) USER MOD Single : A 730 HIS : no HD1:sc= -1.11 X(o=-1.1,f=-1) USER MOD Single : A 733 LYS NZ :NH3+ -163:sc= 1.28 (180deg=1.08) USER MOD Single : A 741 SER OG : rot 12:sc= 0.791 USER MOD Single : A 744 LYS NZ :NH3+ -171:sc= -0.0131 (180deg=-0.121) USER MOD Single : A 746 SER OG : rot 180:sc= 0.0536 USER MOD Single : A 752 TYR OH : rot -130:sc= -2.7! USER MOD Single : A 758 SER OG : rot 180:sc= 0.055 USER MOD Single : A 762 SER OG : rot 180:sc= 0 USER MOD Single : A 768 ASN : amide:sc= -1.22! C(o=-1.2!,f=-1.5!) USER MOD Single : A 769 LYS NZ :NH3+ -146:sc= 1.1 (180deg=0.0894) USER MOD Single : A 770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 LYS NZ :NH3+ 169:sc=-0.00486 (180deg=-0.12) USER MOD Single : A 778 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 781 THR OG1 : rot -79:sc= 1.23 USER MOD Single : A 782 HIS : no HE2:sc= 0.31 K(o=0.31,f=-1.1) USER MOD Single : A 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 785 HIS : no HD1:sc= -0.163 X(o=-0.16,f=-0.18) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 814 ASN : amide:sc= 0.46 K(o=0.46,f=-8.5!) USER MOD Single : A 816 ASN :FLIP amide:sc= -0.014 F(o=-0.93,f=-0.014) USER MOD Single : A 817 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -16.977 0.190 0.520 1.00 0.00 N ATOM 138 CA PHE A 717 -16.358 -1.075 0.133 1.00 0.00 C ATOM 139 C PHE A 717 -15.468 -1.595 1.243 1.00 0.00 C ATOM 140 O PHE A 717 -14.422 -1.001 1.541 1.00 0.00 O ATOM 141 CB PHE A 717 -15.512 -0.916 -1.135 1.00 0.00 C ATOM 142 CG PHE A 717 -16.226 -0.289 -2.293 1.00 0.00 C ATOM 143 CD1 PHE A 717 -17.210 -0.979 -2.985 1.00 0.00 C ATOM 144 CD2 PHE A 717 -15.911 0.998 -2.687 1.00 0.00 C ATOM 145 CE1 PHE A 717 -17.862 -0.389 -4.051 1.00 0.00 C ATOM 146 CE2 PHE A 717 -16.556 1.588 -3.743 1.00 0.00 C ATOM 147 CZ PHE A 717 -17.532 0.899 -4.429 1.00 0.00 C ATOM 0 HA PHE A 717 -17.165 -1.782 -0.059 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -14.636 -0.313 -0.897 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -15.150 -1.898 -1.439 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -17.469 -1.985 -2.689 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -15.147 1.546 -2.156 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -18.626 -0.932 -4.587 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -16.299 2.595 -4.038 1.00 0.00 H new ATOM 0 HZ PHE A 717 -18.039 1.365 -5.261 1.00 0.00 H new ATOM 157 N SER A 718 -15.860 -2.709 1.818 1.00 0.00 N ATOM 158 CA SER A 718 -15.145 -3.324 2.911 1.00 0.00 C ATOM 159 C SER A 718 -13.744 -3.745 2.473 1.00 0.00 C ATOM 160 O SER A 718 -12.807 -3.743 3.267 1.00 0.00 O ATOM 161 CB SER A 718 -15.951 -4.511 3.405 1.00 0.00 C ATOM 162 OG SER A 718 -17.272 -4.087 3.731 1.00 0.00 O ATOM 0 H SER A 718 -16.696 -3.220 1.535 1.00 0.00 H new ATOM 0 HA SER A 718 -15.022 -2.609 3.724 1.00 0.00 H new ATOM 0 HB2 SER A 718 -15.985 -5.285 2.638 1.00 0.00 H new ATOM 0 HB3 SER A 718 -15.472 -4.950 4.280 1.00 0.00 H new ATOM 0 HG SER A 718 -17.793 -4.854 4.048 1.00 0.00 H new ATOM 168 N GLU A 719 -13.619 -4.067 1.199 1.00 0.00 N ATOM 169 CA GLU A 719 -12.351 -4.440 0.601 1.00 0.00 C ATOM 170 C GLU A 719 -11.372 -3.289 0.719 1.00 0.00 C ATOM 171 O GLU A 719 -10.289 -3.438 1.274 1.00 0.00 O ATOM 172 CB GLU A 719 -12.528 -4.805 -0.887 1.00 0.00 C ATOM 173 CG GLU A 719 -13.326 -6.079 -1.173 1.00 0.00 C ATOM 174 CD GLU A 719 -14.758 -6.037 -0.700 1.00 0.00 C ATOM 175 OE1 GLU A 719 -15.634 -5.561 -1.445 1.00 0.00 O ATOM 176 OE2 GLU A 719 -15.027 -6.462 0.434 1.00 0.00 O ATOM 0 H GLU A 719 -14.401 -4.077 0.545 1.00 0.00 H new ATOM 0 HA GLU A 719 -11.968 -5.312 1.132 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -13.019 -3.972 -1.389 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -11.540 -4.910 -1.335 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -13.316 -6.266 -2.247 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -12.824 -6.922 -0.698 1.00 0.00 H new ATOM 183 N TYR A 720 -11.789 -2.129 0.259 1.00 0.00 N ATOM 184 CA TYR A 720 -10.940 -0.955 0.319 1.00 0.00 C ATOM 185 C TYR A 720 -10.691 -0.498 1.740 1.00 0.00 C ATOM 186 O TYR A 720 -9.562 -0.173 2.089 1.00 0.00 O ATOM 187 CB TYR A 720 -11.434 0.188 -0.575 1.00 0.00 C ATOM 188 CG TYR A 720 -11.140 -0.036 -2.046 1.00 0.00 C ATOM 189 CD1 TYR A 720 -9.839 0.080 -2.524 1.00 0.00 C ATOM 190 CD2 TYR A 720 -12.142 -0.351 -2.952 1.00 0.00 C ATOM 191 CE1 TYR A 720 -9.543 -0.113 -3.855 1.00 0.00 C ATOM 192 CE2 TYR A 720 -11.851 -0.546 -4.293 1.00 0.00 C ATOM 193 CZ TYR A 720 -10.546 -0.428 -4.736 1.00 0.00 C ATOM 194 OH TYR A 720 -10.249 -0.616 -6.070 1.00 0.00 O ATOM 0 H TYR A 720 -12.706 -1.972 -0.159 1.00 0.00 H new ATOM 0 HA TYR A 720 -9.977 -1.263 -0.088 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -12.509 0.308 -0.440 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -10.967 1.119 -0.255 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -9.044 0.327 -1.836 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -13.161 -0.445 -2.608 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -8.525 -0.017 -4.204 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -12.640 -0.789 -4.989 1.00 0.00 H new ATOM 0 HH TYR A 720 -11.069 -0.834 -6.560 1.00 0.00 H new ATOM 204 N SER A 721 -11.720 -0.512 2.562 1.00 0.00 N ATOM 205 CA SER A 721 -11.583 -0.135 3.954 1.00 0.00 C ATOM 206 C SER A 721 -10.596 -1.047 4.703 1.00 0.00 C ATOM 207 O SER A 721 -9.748 -0.562 5.445 1.00 0.00 O ATOM 208 CB SER A 721 -12.947 -0.125 4.627 1.00 0.00 C ATOM 209 OG SER A 721 -13.790 0.832 4.006 1.00 0.00 O ATOM 0 H SER A 721 -12.665 -0.782 2.289 1.00 0.00 H new ATOM 0 HA SER A 721 -11.167 0.872 3.992 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.399 -1.115 4.564 1.00 0.00 H new ATOM 0 HB3 SER A 721 -12.837 0.109 5.686 1.00 0.00 H new ATOM 0 HG SER A 721 -14.131 0.469 3.162 1.00 0.00 H new ATOM 215 N ARG A 722 -10.659 -2.351 4.456 1.00 0.00 N ATOM 216 CA ARG A 722 -9.777 -3.293 5.134 1.00 0.00 C ATOM 217 C ARG A 722 -8.312 -3.100 4.696 1.00 0.00 C ATOM 218 O ARG A 722 -7.384 -3.212 5.516 1.00 0.00 O ATOM 219 CB ARG A 722 -10.250 -4.742 4.918 1.00 0.00 C ATOM 220 CG ARG A 722 -9.409 -5.800 5.626 1.00 0.00 C ATOM 221 CD ARG A 722 -9.323 -5.559 7.131 1.00 0.00 C ATOM 222 NE ARG A 722 -10.630 -5.620 7.799 1.00 0.00 N ATOM 223 CZ ARG A 722 -10.918 -5.019 8.964 1.00 0.00 C ATOM 224 NH1 ARG A 722 -10.020 -4.254 9.561 1.00 0.00 N ATOM 225 NH2 ARG A 722 -12.102 -5.199 9.533 1.00 0.00 N ATOM 0 H ARG A 722 -11.308 -2.778 3.795 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.823 -3.089 6.204 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -11.281 -4.828 5.261 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -10.251 -4.954 3.849 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -9.838 -6.785 5.442 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -8.404 -5.805 5.203 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -8.660 -6.301 7.575 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -8.874 -4.582 7.312 1.00 0.00 H new ATOM 0 HE ARG A 722 -11.370 -6.156 7.346 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -9.103 -4.118 9.136 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -10.245 -3.800 10.446 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -12.798 -5.796 9.085 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -12.317 -4.741 10.418 1.00 0.00 H new ATOM 239 N ILE A 723 -8.102 -2.808 3.430 1.00 0.00 N ATOM 240 CA ILE A 723 -6.758 -2.537 2.940 1.00 0.00 C ATOM 241 C ILE A 723 -6.259 -1.174 3.462 1.00 0.00 C ATOM 242 O ILE A 723 -5.117 -1.037 3.896 1.00 0.00 O ATOM 243 CB ILE A 723 -6.659 -2.615 1.376 1.00 0.00 C ATOM 244 CG1 ILE A 723 -6.504 -4.061 0.881 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.523 -1.764 0.823 1.00 0.00 C ATOM 246 CD1 ILE A 723 -7.653 -5.004 1.167 1.00 0.00 C ATOM 0 H ILE A 723 -8.835 -2.751 2.723 1.00 0.00 H new ATOM 0 HA ILE A 723 -6.109 -3.321 3.330 1.00 0.00 H new ATOM 0 HB ILE A 723 -7.601 -2.215 1.001 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -6.344 -4.036 -0.197 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -5.602 -4.479 1.328 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -5.497 -1.853 -0.263 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -5.682 -0.721 1.098 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -4.575 -2.108 1.238 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -7.421 -5.991 0.768 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -7.806 -5.075 2.244 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -8.560 -4.626 0.696 1.00 0.00 H new ATOM 258 N SER A 724 -7.130 -0.192 3.427 1.00 0.00 N ATOM 259 CA SER A 724 -6.818 1.148 3.927 1.00 0.00 C ATOM 260 C SER A 724 -6.490 1.094 5.434 1.00 0.00 C ATOM 261 O SER A 724 -5.566 1.764 5.906 1.00 0.00 O ATOM 262 CB SER A 724 -7.992 2.115 3.649 1.00 0.00 C ATOM 263 OG SER A 724 -7.664 3.461 3.971 1.00 0.00 O ATOM 0 H SER A 724 -8.075 -0.288 3.054 1.00 0.00 H new ATOM 0 HA SER A 724 -5.940 1.523 3.401 1.00 0.00 H new ATOM 0 HB2 SER A 724 -8.272 2.052 2.597 1.00 0.00 H new ATOM 0 HB3 SER A 724 -8.861 1.805 4.229 1.00 0.00 H new ATOM 0 HG SER A 724 -8.431 4.040 3.779 1.00 0.00 H new ATOM 269 N ASN A 725 -7.236 0.270 6.169 1.00 0.00 N ATOM 270 CA ASN A 725 -7.015 0.064 7.603 1.00 0.00 C ATOM 271 C ASN A 725 -5.619 -0.503 7.825 1.00 0.00 C ATOM 272 O ASN A 725 -4.900 -0.078 8.723 1.00 0.00 O ATOM 273 CB ASN A 725 -8.056 -0.899 8.171 1.00 0.00 C ATOM 274 CG ASN A 725 -7.991 -1.044 9.683 1.00 0.00 C ATOM 275 OD1 ASN A 725 -8.245 -2.117 10.216 1.00 0.00 O ATOM 276 ND2 ASN A 725 -7.719 0.027 10.379 1.00 0.00 N ATOM 0 H ASN A 725 -8.011 -0.274 5.789 1.00 0.00 H new ATOM 0 HA ASN A 725 -7.109 1.022 8.115 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -9.051 -0.552 7.890 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -7.919 -1.879 7.714 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -7.714 -0.015 11.398 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -7.512 0.905 9.903 1.00 0.00 H new ATOM 283 N LEU A 726 -5.246 -1.450 6.968 1.00 0.00 N ATOM 284 CA LEU A 726 -3.911 -2.043 6.937 1.00 0.00 C ATOM 285 C LEU A 726 -2.844 -0.964 6.819 1.00 0.00 C ATOM 286 O LEU A 726 -1.872 -0.995 7.542 1.00 0.00 O ATOM 287 CB LEU A 726 -3.879 -3.115 5.792 1.00 0.00 C ATOM 288 CG LEU A 726 -2.558 -3.550 5.109 1.00 0.00 C ATOM 289 CD1 LEU A 726 -2.039 -2.530 4.118 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.515 -3.854 6.105 1.00 0.00 C ATOM 0 H LEU A 726 -5.874 -1.834 6.262 1.00 0.00 H new ATOM 0 HA LEU A 726 -3.682 -2.556 7.871 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -4.336 -4.019 6.195 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -4.536 -2.750 5.002 1.00 0.00 H new ATOM 0 HG LEU A 726 -2.797 -4.455 4.550 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -1.112 -2.893 3.674 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -2.780 -2.374 3.334 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -1.850 -1.587 4.631 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.601 -4.156 5.594 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -1.318 -2.967 6.708 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.854 -4.664 6.751 1.00 0.00 H new ATOM 302 N ILE A 727 -3.060 -0.004 5.953 1.00 0.00 N ATOM 303 CA ILE A 727 -2.121 1.089 5.769 1.00 0.00 C ATOM 304 C ILE A 727 -1.927 1.868 7.053 1.00 0.00 C ATOM 305 O ILE A 727 -0.789 2.114 7.477 1.00 0.00 O ATOM 306 CB ILE A 727 -2.537 2.019 4.582 1.00 0.00 C ATOM 307 CG1 ILE A 727 -2.171 1.366 3.247 1.00 0.00 C ATOM 308 CG2 ILE A 727 -1.932 3.424 4.687 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.678 1.122 3.100 1.00 0.00 C ATOM 0 H ILE A 727 -3.886 0.047 5.356 1.00 0.00 H new ATOM 0 HA ILE A 727 -1.158 0.651 5.504 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.618 2.145 4.636 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.700 0.418 3.155 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.513 2.003 2.431 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -2.255 4.024 3.836 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -2.265 3.896 5.611 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -0.844 3.353 4.688 1.00 0.00 H new ATOM 0 HD11 ILE A 727 -0.479 0.657 2.134 1.00 0.00 H new ATOM 0 HD12 ILE A 727 -0.146 2.071 3.163 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.337 0.462 3.898 1.00 0.00 H new ATOM 321 N VAL A 728 -3.020 2.179 7.694 1.00 0.00 N ATOM 322 CA VAL A 728 -2.987 2.944 8.906 1.00 0.00 C ATOM 323 C VAL A 728 -2.324 2.129 10.043 1.00 0.00 C ATOM 324 O VAL A 728 -1.441 2.630 10.751 1.00 0.00 O ATOM 325 CB VAL A 728 -4.411 3.408 9.315 1.00 0.00 C ATOM 326 CG1 VAL A 728 -4.379 4.257 10.565 1.00 0.00 C ATOM 327 CG2 VAL A 728 -5.068 4.175 8.182 1.00 0.00 C ATOM 0 H VAL A 728 -3.956 1.909 7.390 1.00 0.00 H new ATOM 0 HA VAL A 728 -2.387 3.836 8.727 1.00 0.00 H new ATOM 0 HB VAL A 728 -4.999 2.515 9.528 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -5.393 4.564 10.822 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -3.955 3.679 11.387 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -3.766 5.141 10.389 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -6.065 4.492 8.487 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.467 5.051 7.939 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -5.144 3.533 7.304 1.00 0.00 H new ATOM 337 N LEU A 729 -2.737 0.869 10.178 1.00 0.00 N ATOM 338 CA LEU A 729 -2.193 -0.041 11.190 1.00 0.00 C ATOM 339 C LEU A 729 -0.714 -0.303 10.986 1.00 0.00 C ATOM 340 O LEU A 729 0.059 -0.295 11.937 1.00 0.00 O ATOM 341 CB LEU A 729 -2.946 -1.357 11.182 1.00 0.00 C ATOM 342 CG LEU A 729 -4.372 -1.311 11.701 1.00 0.00 C ATOM 343 CD1 LEU A 729 -5.082 -2.587 11.337 1.00 0.00 C ATOM 344 CD2 LEU A 729 -4.385 -1.131 13.212 1.00 0.00 C ATOM 0 H LEU A 729 -3.457 0.449 9.590 1.00 0.00 H new ATOM 0 HA LEU A 729 -2.319 0.448 12.156 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -2.964 -1.736 10.160 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -2.386 -2.077 11.779 1.00 0.00 H new ATOM 0 HG LEU A 729 -4.884 -0.464 11.245 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -6.106 -2.553 11.710 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -5.094 -2.700 10.253 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -4.561 -3.434 11.784 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -5.415 -1.100 13.566 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -3.865 -1.965 13.682 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -3.884 -0.198 13.472 1.00 0.00 H new ATOM 356 N HIS A 730 -0.332 -0.522 9.753 1.00 0.00 N ATOM 357 CA HIS A 730 1.049 -0.782 9.414 1.00 0.00 C ATOM 358 C HIS A 730 1.894 0.432 9.742 1.00 0.00 C ATOM 359 O HIS A 730 2.926 0.311 10.395 1.00 0.00 O ATOM 360 CB HIS A 730 1.175 -1.147 7.928 1.00 0.00 C ATOM 361 CG HIS A 730 2.559 -1.521 7.478 1.00 0.00 C ATOM 362 ND1 HIS A 730 3.272 -0.821 6.533 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.331 -2.581 7.815 1.00 0.00 C ATOM 364 CE1 HIS A 730 4.419 -1.462 6.325 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.508 -2.541 7.078 1.00 0.00 N ATOM 0 H HIS A 730 -0.967 -0.526 8.955 1.00 0.00 H new ATOM 0 HA HIS A 730 1.408 -1.627 10.002 1.00 0.00 H new ATOM 0 HB2 HIS A 730 0.504 -1.979 7.716 1.00 0.00 H new ATOM 0 HB3 HIS A 730 0.832 -0.301 7.332 1.00 0.00 H new ATOM 0 HD2 HIS A 730 3.073 -3.337 8.541 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.179 -1.140 5.629 1.00 0.00 H new ATOM 0 HE2 HIS A 730 5.280 -3.207 7.112 1.00 0.00 H new ATOM 373 N LEU A 731 1.430 1.606 9.317 1.00 0.00 N ATOM 374 CA LEU A 731 2.142 2.843 9.586 1.00 0.00 C ATOM 375 C LEU A 731 2.336 3.067 11.083 1.00 0.00 C ATOM 376 O LEU A 731 3.464 3.275 11.531 1.00 0.00 O ATOM 377 CB LEU A 731 1.442 4.045 8.949 1.00 0.00 C ATOM 378 CG LEU A 731 2.082 5.414 9.229 1.00 0.00 C ATOM 379 CD1 LEU A 731 3.534 5.445 8.761 1.00 0.00 C ATOM 380 CD2 LEU A 731 1.277 6.520 8.571 1.00 0.00 C ATOM 0 H LEU A 731 0.566 1.721 8.787 1.00 0.00 H new ATOM 0 HA LEU A 731 3.127 2.746 9.130 1.00 0.00 H new ATOM 0 HB2 LEU A 731 1.410 3.893 7.870 1.00 0.00 H new ATOM 0 HB3 LEU A 731 0.410 4.069 9.299 1.00 0.00 H new ATOM 0 HG LEU A 731 2.076 5.580 10.306 1.00 0.00 H new ATOM 0 HD11 LEU A 731 3.963 6.425 8.971 1.00 0.00 H new ATOM 0 HD12 LEU A 731 4.103 4.679 9.288 1.00 0.00 H new ATOM 0 HD13 LEU A 731 3.575 5.253 7.689 1.00 0.00 H new ATOM 0 HD21 LEU A 731 1.744 7.483 8.779 1.00 0.00 H new ATOM 0 HD22 LEU A 731 1.247 6.357 7.494 1.00 0.00 H new ATOM 0 HD23 LEU A 731 0.262 6.516 8.967 1.00 0.00 H new ATOM 392 N ARG A 732 1.258 2.947 11.857 1.00 0.00 N ATOM 393 CA ARG A 732 1.343 3.163 13.300 1.00 0.00 C ATOM 394 C ARG A 732 2.257 2.145 13.973 1.00 0.00 C ATOM 395 O ARG A 732 2.905 2.443 14.980 1.00 0.00 O ATOM 396 CB ARG A 732 -0.041 3.216 13.981 1.00 0.00 C ATOM 397 CG ARG A 732 -0.901 1.983 13.798 1.00 0.00 C ATOM 398 CD ARG A 732 -2.277 2.152 14.429 1.00 0.00 C ATOM 399 NE ARG A 732 -2.955 3.358 13.938 1.00 0.00 N ATOM 400 CZ ARG A 732 -4.210 3.721 14.232 1.00 0.00 C ATOM 401 NH1 ARG A 732 -4.992 2.937 14.954 1.00 0.00 N ATOM 402 NH2 ARG A 732 -4.671 4.882 13.789 1.00 0.00 N ATOM 0 H ARG A 732 0.328 2.705 11.515 1.00 0.00 H new ATOM 0 HA ARG A 732 1.791 4.148 13.432 1.00 0.00 H new ATOM 0 HB2 ARG A 732 0.104 3.382 15.048 1.00 0.00 H new ATOM 0 HB3 ARG A 732 -0.585 4.078 13.595 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -1.013 1.773 12.734 1.00 0.00 H new ATOM 0 HG3 ARG A 732 -0.401 1.122 14.242 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -2.888 1.276 14.210 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -2.176 2.207 15.513 1.00 0.00 H new ATOM 0 HE ARG A 732 -2.425 3.972 13.320 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -4.642 2.042 15.295 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -5.946 3.227 15.170 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -4.071 5.489 13.230 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -5.625 5.168 14.007 1.00 0.00 H new ATOM 416 N LYS A 733 2.304 0.944 13.442 1.00 0.00 N ATOM 417 CA LYS A 733 3.177 -0.064 13.980 1.00 0.00 C ATOM 418 C LYS A 733 4.654 0.217 13.626 1.00 0.00 C ATOM 419 O LYS A 733 5.541 0.142 14.482 1.00 0.00 O ATOM 420 CB LYS A 733 2.752 -1.473 13.546 1.00 0.00 C ATOM 421 CG LYS A 733 3.478 -2.587 14.288 1.00 0.00 C ATOM 422 CD LYS A 733 3.249 -2.469 15.790 1.00 0.00 C ATOM 423 CE LYS A 733 3.944 -3.561 16.570 1.00 0.00 C ATOM 424 NZ LYS A 733 3.769 -3.367 18.026 1.00 0.00 N ATOM 0 H LYS A 733 1.748 0.646 12.640 1.00 0.00 H new ATOM 0 HA LYS A 733 3.089 -0.021 15.066 1.00 0.00 H new ATOM 0 HB2 LYS A 733 1.679 -1.584 13.702 1.00 0.00 H new ATOM 0 HB3 LYS A 733 2.931 -1.584 12.477 1.00 0.00 H new ATOM 0 HG2 LYS A 733 3.125 -3.556 13.936 1.00 0.00 H new ATOM 0 HG3 LYS A 733 4.545 -2.539 14.073 1.00 0.00 H new ATOM 0 HD2 LYS A 733 3.606 -1.498 16.133 1.00 0.00 H new ATOM 0 HD3 LYS A 733 2.179 -2.505 15.995 1.00 0.00 H new ATOM 0 HE2 LYS A 733 3.544 -4.532 16.278 1.00 0.00 H new ATOM 0 HE3 LYS A 733 5.006 -3.568 16.326 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 4.472 -3.937 18.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 3.900 -2.362 18.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 2.812 -3.665 18.303 1.00 0.00 H new ATOM 438 N VAL A 734 4.917 0.579 12.381 1.00 0.00 N ATOM 439 CA VAL A 734 6.286 0.800 11.944 1.00 0.00 C ATOM 440 C VAL A 734 6.872 2.101 12.478 1.00 0.00 C ATOM 441 O VAL A 734 8.076 2.176 12.734 1.00 0.00 O ATOM 442 CB VAL A 734 6.502 0.663 10.417 1.00 0.00 C ATOM 443 CG1 VAL A 734 6.063 -0.711 9.938 1.00 0.00 C ATOM 444 CG2 VAL A 734 5.796 1.759 9.644 1.00 0.00 C ATOM 0 H VAL A 734 4.209 0.725 11.661 1.00 0.00 H new ATOM 0 HA VAL A 734 6.845 -0.021 12.393 1.00 0.00 H new ATOM 0 HB VAL A 734 7.569 0.773 10.225 1.00 0.00 H new ATOM 0 HG11 VAL A 734 6.222 -0.789 8.863 1.00 0.00 H new ATOM 0 HG12 VAL A 734 6.646 -1.478 10.448 1.00 0.00 H new ATOM 0 HG13 VAL A 734 5.005 -0.853 10.160 1.00 0.00 H new ATOM 0 HG21 VAL A 734 5.974 1.624 8.577 1.00 0.00 H new ATOM 0 HG22 VAL A 734 4.725 1.712 9.842 1.00 0.00 H new ATOM 0 HG23 VAL A 734 6.180 2.730 9.956 1.00 0.00 H new ATOM 454 N GLU A 735 6.036 3.131 12.646 1.00 0.00 N ATOM 455 CA GLU A 735 6.497 4.393 13.238 1.00 0.00 C ATOM 456 C GLU A 735 6.882 4.155 14.710 1.00 0.00 C ATOM 457 O GLU A 735 7.746 4.841 15.272 1.00 0.00 O ATOM 458 CB GLU A 735 5.425 5.503 13.138 1.00 0.00 C ATOM 459 CG GLU A 735 4.185 5.239 13.967 1.00 0.00 C ATOM 460 CD GLU A 735 3.188 6.368 13.938 1.00 0.00 C ATOM 461 OE1 GLU A 735 3.267 7.259 14.808 1.00 0.00 O ATOM 462 OE2 GLU A 735 2.292 6.375 13.083 1.00 0.00 O ATOM 0 H GLU A 735 5.050 3.118 12.385 1.00 0.00 H new ATOM 0 HA GLU A 735 7.367 4.734 12.677 1.00 0.00 H new ATOM 0 HB2 GLU A 735 5.866 6.449 13.453 1.00 0.00 H new ATOM 0 HB3 GLU A 735 5.134 5.619 12.094 1.00 0.00 H new ATOM 0 HG2 GLU A 735 3.703 4.331 13.605 1.00 0.00 H new ATOM 0 HG3 GLU A 735 4.481 5.053 14.999 1.00 0.00 H new ATOM 469 N GLU A 736 6.222 3.175 15.307 1.00 0.00 N ATOM 470 CA GLU A 736 6.457 2.761 16.670 1.00 0.00 C ATOM 471 C GLU A 736 7.806 2.047 16.760 1.00 0.00 C ATOM 472 O GLU A 736 8.664 2.417 17.550 1.00 0.00 O ATOM 473 CB GLU A 736 5.322 1.811 17.092 1.00 0.00 C ATOM 474 CG GLU A 736 5.390 1.267 18.508 1.00 0.00 C ATOM 475 CD GLU A 736 4.276 0.276 18.783 1.00 0.00 C ATOM 476 OE1 GLU A 736 3.108 0.691 18.911 1.00 0.00 O ATOM 477 OE2 GLU A 736 4.537 -0.947 18.866 1.00 0.00 O ATOM 0 H GLU A 736 5.492 2.636 14.841 1.00 0.00 H new ATOM 0 HA GLU A 736 6.476 3.626 17.333 1.00 0.00 H new ATOM 0 HB2 GLU A 736 4.374 2.336 16.973 1.00 0.00 H new ATOM 0 HB3 GLU A 736 5.308 0.967 16.402 1.00 0.00 H new ATOM 0 HG2 GLU A 736 6.354 0.784 18.666 1.00 0.00 H new ATOM 0 HG3 GLU A 736 5.327 2.092 19.218 1.00 0.00 H new ATOM 484 N GLU A 737 7.996 1.060 15.910 1.00 0.00 N ATOM 485 CA GLU A 737 9.189 0.237 15.954 1.00 0.00 C ATOM 486 C GLU A 737 10.409 0.884 15.284 1.00 0.00 C ATOM 487 O GLU A 737 11.390 1.183 15.944 1.00 0.00 O ATOM 488 CB GLU A 737 8.923 -1.125 15.321 1.00 0.00 C ATOM 489 CG GLU A 737 7.801 -1.912 15.974 1.00 0.00 C ATOM 490 CD GLU A 737 7.607 -3.246 15.318 1.00 0.00 C ATOM 491 OE1 GLU A 737 6.927 -3.310 14.287 1.00 0.00 O ATOM 492 OE2 GLU A 737 8.165 -4.256 15.803 1.00 0.00 O ATOM 0 H GLU A 737 7.336 0.806 15.175 1.00 0.00 H new ATOM 0 HA GLU A 737 9.431 0.122 17.010 1.00 0.00 H new ATOM 0 HB2 GLU A 737 8.684 -0.982 14.267 1.00 0.00 H new ATOM 0 HB3 GLU A 737 9.838 -1.716 15.363 1.00 0.00 H new ATOM 0 HG2 GLU A 737 8.024 -2.055 17.031 1.00 0.00 H new ATOM 0 HG3 GLU A 737 6.875 -1.340 15.918 1.00 0.00 H new ATOM 499 N GLU A 738 10.334 1.105 13.984 1.00 0.00 N ATOM 500 CA GLU A 738 11.503 1.535 13.216 1.00 0.00 C ATOM 501 C GLU A 738 11.597 3.044 13.085 1.00 0.00 C ATOM 502 O GLU A 738 12.697 3.590 12.997 1.00 0.00 O ATOM 503 CB GLU A 738 11.462 0.946 11.819 1.00 0.00 C ATOM 504 CG GLU A 738 11.360 -0.558 11.759 1.00 0.00 C ATOM 505 CD GLU A 738 11.364 -1.053 10.340 1.00 0.00 C ATOM 506 OE1 GLU A 738 12.458 -1.324 9.779 1.00 0.00 O ATOM 507 OE2 GLU A 738 10.286 -1.166 9.753 1.00 0.00 O ATOM 0 H GLU A 738 9.482 0.996 13.434 1.00 0.00 H new ATOM 0 HA GLU A 738 12.374 1.179 13.766 1.00 0.00 H new ATOM 0 HB2 GLU A 738 10.612 1.373 11.287 1.00 0.00 H new ATOM 0 HB3 GLU A 738 12.361 1.255 11.285 1.00 0.00 H new ATOM 0 HG2 GLU A 738 12.193 -1.002 12.303 1.00 0.00 H new ATOM 0 HG3 GLU A 738 10.446 -0.882 12.256 1.00 0.00 H new ATOM 514 N ASP A 739 10.432 3.700 12.972 1.00 0.00 N ATOM 515 CA ASP A 739 10.306 5.180 12.792 1.00 0.00 C ATOM 516 C ASP A 739 10.676 5.642 11.361 1.00 0.00 C ATOM 517 O ASP A 739 10.232 6.691 10.906 1.00 0.00 O ATOM 518 CB ASP A 739 11.089 5.976 13.865 1.00 0.00 C ATOM 519 CG ASP A 739 10.993 7.490 13.704 1.00 0.00 C ATOM 520 OD1 ASP A 739 10.013 8.102 14.193 1.00 0.00 O ATOM 521 OD2 ASP A 739 11.911 8.097 13.119 1.00 0.00 O ATOM 0 H ASP A 739 9.531 3.224 13.002 1.00 0.00 H new ATOM 0 HA ASP A 739 9.249 5.405 12.933 1.00 0.00 H new ATOM 0 HB2 ASP A 739 10.716 5.701 14.852 1.00 0.00 H new ATOM 0 HB3 ASP A 739 12.138 5.682 13.828 1.00 0.00 H new ATOM 526 N GLU A 740 11.452 4.826 10.646 1.00 0.00 N ATOM 527 CA GLU A 740 11.877 5.121 9.285 1.00 0.00 C ATOM 528 C GLU A 740 10.665 5.146 8.358 1.00 0.00 C ATOM 529 O GLU A 740 10.559 5.961 7.440 1.00 0.00 O ATOM 530 CB GLU A 740 12.900 4.068 8.852 1.00 0.00 C ATOM 531 CG GLU A 740 13.504 4.273 7.479 1.00 0.00 C ATOM 532 CD GLU A 740 14.413 5.480 7.390 1.00 0.00 C ATOM 533 OE1 GLU A 740 15.614 5.360 7.687 1.00 0.00 O ATOM 534 OE2 GLU A 740 13.956 6.564 7.010 1.00 0.00 O ATOM 0 H GLU A 740 11.803 3.937 11.001 1.00 0.00 H new ATOM 0 HA GLU A 740 12.346 6.103 9.235 1.00 0.00 H new ATOM 0 HB2 GLU A 740 13.706 4.047 9.585 1.00 0.00 H new ATOM 0 HB3 GLU A 740 12.421 3.089 8.877 1.00 0.00 H new ATOM 0 HG2 GLU A 740 14.069 3.382 7.203 1.00 0.00 H new ATOM 0 HG3 GLU A 740 12.701 4.379 6.750 1.00 0.00 H new ATOM 541 N SER A 741 9.777 4.251 8.645 1.00 0.00 N ATOM 542 CA SER A 741 8.469 4.058 7.987 1.00 0.00 C ATOM 543 C SER A 741 8.554 3.777 6.472 1.00 0.00 C ATOM 544 O SER A 741 7.550 3.828 5.769 1.00 0.00 O ATOM 545 CB SER A 741 7.473 5.206 8.327 1.00 0.00 C ATOM 546 OG SER A 741 7.996 6.494 8.024 1.00 0.00 O ATOM 0 H SER A 741 9.930 3.575 9.393 1.00 0.00 H new ATOM 0 HA SER A 741 8.065 3.139 8.413 1.00 0.00 H new ATOM 0 HB2 SER A 741 6.547 5.055 7.772 1.00 0.00 H new ATOM 0 HB3 SER A 741 7.221 5.161 9.386 1.00 0.00 H new ATOM 0 HG SER A 741 8.809 6.398 7.486 1.00 0.00 H new ATOM 552 N ALA A 742 9.732 3.414 6.002 1.00 0.00 N ATOM 553 CA ALA A 742 9.930 3.127 4.601 1.00 0.00 C ATOM 554 C ALA A 742 10.068 1.621 4.392 1.00 0.00 C ATOM 555 O ALA A 742 11.133 1.042 4.616 1.00 0.00 O ATOM 556 CB ALA A 742 11.135 3.886 4.068 1.00 0.00 C ATOM 0 H ALA A 742 10.569 3.311 6.577 1.00 0.00 H new ATOM 0 HA ALA A 742 9.060 3.464 4.037 1.00 0.00 H new ATOM 0 HB1 ALA A 742 11.270 3.658 3.011 1.00 0.00 H new ATOM 0 HB2 ALA A 742 10.974 4.957 4.191 1.00 0.00 H new ATOM 0 HB3 ALA A 742 12.026 3.588 4.620 1.00 0.00 H new ATOM 562 N LEU A 743 8.995 0.988 3.997 1.00 0.00 N ATOM 563 CA LEU A 743 8.952 -0.472 3.906 1.00 0.00 C ATOM 564 C LEU A 743 8.931 -0.994 2.481 1.00 0.00 C ATOM 565 O LEU A 743 9.022 -0.229 1.511 1.00 0.00 O ATOM 566 CB LEU A 743 7.775 -1.071 4.711 1.00 0.00 C ATOM 567 CG LEU A 743 7.877 -1.053 6.248 1.00 0.00 C ATOM 568 CD1 LEU A 743 9.156 -1.713 6.728 1.00 0.00 C ATOM 569 CD2 LEU A 743 7.733 0.346 6.812 1.00 0.00 C ATOM 0 H LEU A 743 8.127 1.452 3.729 1.00 0.00 H new ATOM 0 HA LEU A 743 9.888 -0.807 4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 743 6.869 -0.536 4.429 1.00 0.00 H new ATOM 0 HB3 LEU A 743 7.645 -2.106 4.395 1.00 0.00 H new ATOM 0 HG LEU A 743 7.040 -1.638 6.628 1.00 0.00 H new ATOM 0 HD11 LEU A 743 9.195 -1.682 7.817 1.00 0.00 H new ATOM 0 HD12 LEU A 743 9.178 -2.750 6.393 1.00 0.00 H new ATOM 0 HD13 LEU A 743 10.015 -1.181 6.319 1.00 0.00 H new ATOM 0 HD21 LEU A 743 7.811 0.310 7.899 1.00 0.00 H new ATOM 0 HD22 LEU A 743 8.522 0.983 6.412 1.00 0.00 H new ATOM 0 HD23 LEU A 743 6.762 0.753 6.532 1.00 0.00 H new ATOM 581 N LYS A 744 8.811 -2.313 2.373 1.00 0.00 N ATOM 582 CA LYS A 744 8.829 -3.011 1.115 1.00 0.00 C ATOM 583 C LYS A 744 7.410 -3.350 0.658 1.00 0.00 C ATOM 584 O LYS A 744 6.600 -3.836 1.450 1.00 0.00 O ATOM 585 CB LYS A 744 9.665 -4.296 1.245 1.00 0.00 C ATOM 586 CG LYS A 744 9.817 -5.097 -0.051 1.00 0.00 C ATOM 587 CD LYS A 744 10.630 -6.373 0.155 1.00 0.00 C ATOM 588 CE LYS A 744 12.048 -6.081 0.643 1.00 0.00 C ATOM 589 NZ LYS A 744 12.809 -5.234 -0.305 1.00 0.00 N ATOM 0 H LYS A 744 8.697 -2.928 3.179 1.00 0.00 H new ATOM 0 HA LYS A 744 9.280 -2.361 0.365 1.00 0.00 H new ATOM 0 HB2 LYS A 744 10.657 -4.032 1.611 1.00 0.00 H new ATOM 0 HB3 LYS A 744 9.207 -4.936 1.999 1.00 0.00 H new ATOM 0 HG2 LYS A 744 8.830 -5.354 -0.435 1.00 0.00 H new ATOM 0 HG3 LYS A 744 10.301 -4.477 -0.805 1.00 0.00 H new ATOM 0 HD2 LYS A 744 10.123 -7.012 0.878 1.00 0.00 H new ATOM 0 HD3 LYS A 744 10.677 -6.927 -0.782 1.00 0.00 H new ATOM 0 HE2 LYS A 744 12.001 -5.584 1.612 1.00 0.00 H new ATOM 0 HE3 LYS A 744 12.579 -7.021 0.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 13.805 -5.190 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 12.750 -5.642 -1.260 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 12.407 -4.275 -0.313 1.00 0.00 H new ATOM 603 N ARG A 745 7.145 -3.122 -0.626 1.00 0.00 N ATOM 604 CA ARG A 745 5.845 -3.402 -1.260 1.00 0.00 C ATOM 605 C ARG A 745 5.484 -4.868 -1.102 1.00 0.00 C ATOM 606 O ARG A 745 4.418 -5.205 -0.593 1.00 0.00 O ATOM 607 CB ARG A 745 5.908 -3.060 -2.759 1.00 0.00 C ATOM 608 CG ARG A 745 6.222 -1.608 -3.040 1.00 0.00 C ATOM 609 CD ARG A 745 6.441 -1.321 -4.524 1.00 0.00 C ATOM 610 NE ARG A 745 5.261 -1.569 -5.352 1.00 0.00 N ATOM 611 CZ ARG A 745 4.956 -0.889 -6.472 1.00 0.00 C ATOM 612 NH1 ARG A 745 5.714 0.145 -6.871 1.00 0.00 N ATOM 613 NH2 ARG A 745 3.894 -1.239 -7.192 1.00 0.00 N ATOM 0 H ARG A 745 7.833 -2.732 -1.271 1.00 0.00 H new ATOM 0 HA ARG A 745 5.086 -2.789 -0.773 1.00 0.00 H new ATOM 0 HB2 ARG A 745 6.665 -3.684 -3.233 1.00 0.00 H new ATOM 0 HB3 ARG A 745 4.953 -3.312 -3.220 1.00 0.00 H new ATOM 0 HG2 ARG A 745 5.405 -0.988 -2.672 1.00 0.00 H new ATOM 0 HG3 ARG A 745 7.115 -1.321 -2.484 1.00 0.00 H new ATOM 0 HD2 ARG A 745 6.745 -0.281 -4.643 1.00 0.00 H new ATOM 0 HD3 ARG A 745 7.264 -1.937 -4.886 1.00 0.00 H new ATOM 0 HE ARG A 745 4.624 -2.310 -5.059 1.00 0.00 H new ATOM 0 HH11 ARG A 745 6.529 0.421 -6.323 1.00 0.00 H new ATOM 0 HH12 ARG A 745 5.475 0.654 -7.722 1.00 0.00 H new ATOM 0 HH21 ARG A 745 3.312 -2.022 -6.895 1.00 0.00 H new ATOM 0 HH22 ARG A 745 3.662 -0.724 -8.041 1.00 0.00 H new ATOM 627 N SER A 746 6.408 -5.723 -1.502 1.00 0.00 N ATOM 628 CA SER A 746 6.231 -7.155 -1.463 1.00 0.00 C ATOM 629 C SER A 746 5.957 -7.643 -0.024 1.00 0.00 C ATOM 630 O SER A 746 5.053 -8.423 0.206 1.00 0.00 O ATOM 631 CB SER A 746 7.503 -7.787 -2.005 1.00 0.00 C ATOM 632 OG SER A 746 7.958 -7.058 -3.150 1.00 0.00 O ATOM 0 H SER A 746 7.315 -5.433 -1.868 1.00 0.00 H new ATOM 0 HA SER A 746 5.370 -7.442 -2.067 1.00 0.00 H new ATOM 0 HB2 SER A 746 8.274 -7.791 -1.235 1.00 0.00 H new ATOM 0 HB3 SER A 746 7.317 -8.827 -2.275 1.00 0.00 H new ATOM 0 HG SER A 746 8.779 -7.468 -3.494 1.00 0.00 H new ATOM 638 N GLU A 747 6.719 -7.110 0.926 1.00 0.00 N ATOM 639 CA GLU A 747 6.631 -7.500 2.327 1.00 0.00 C ATOM 640 C GLU A 747 5.296 -7.059 2.947 1.00 0.00 C ATOM 641 O GLU A 747 4.698 -7.791 3.731 1.00 0.00 O ATOM 642 CB GLU A 747 7.792 -6.889 3.102 1.00 0.00 C ATOM 643 CG GLU A 747 7.891 -7.354 4.534 1.00 0.00 C ATOM 644 CD GLU A 747 8.178 -8.833 4.643 1.00 0.00 C ATOM 645 OE1 GLU A 747 9.343 -9.234 4.498 1.00 0.00 O ATOM 646 OE2 GLU A 747 7.259 -9.613 4.884 1.00 0.00 O ATOM 0 H GLU A 747 7.419 -6.391 0.743 1.00 0.00 H new ATOM 0 HA GLU A 747 6.684 -8.587 2.383 1.00 0.00 H new ATOM 0 HB2 GLU A 747 8.723 -7.128 2.589 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.691 -5.804 3.090 1.00 0.00 H new ATOM 0 HG2 GLU A 747 8.679 -6.796 5.040 1.00 0.00 H new ATOM 0 HG3 GLU A 747 6.958 -7.129 5.051 1.00 0.00 H new ATOM 653 N LEU A 748 4.847 -5.861 2.586 1.00 0.00 N ATOM 654 CA LEU A 748 3.571 -5.328 3.067 1.00 0.00 C ATOM 655 C LEU A 748 2.444 -6.277 2.702 1.00 0.00 C ATOM 656 O LEU A 748 1.667 -6.717 3.563 1.00 0.00 O ATOM 657 CB LEU A 748 3.315 -3.939 2.458 1.00 0.00 C ATOM 658 CG LEU A 748 1.961 -3.288 2.777 1.00 0.00 C ATOM 659 CD1 LEU A 748 1.786 -3.097 4.269 1.00 0.00 C ATOM 660 CD2 LEU A 748 1.824 -1.963 2.049 1.00 0.00 C ATOM 0 H LEU A 748 5.350 -5.235 1.957 1.00 0.00 H new ATOM 0 HA LEU A 748 3.613 -5.231 4.152 1.00 0.00 H new ATOM 0 HB2 LEU A 748 4.104 -3.268 2.797 1.00 0.00 H new ATOM 0 HB3 LEU A 748 3.408 -4.019 1.375 1.00 0.00 H new ATOM 0 HG LEU A 748 1.174 -3.958 2.430 1.00 0.00 H new ATOM 0 HD11 LEU A 748 0.819 -2.634 4.466 1.00 0.00 H new ATOM 0 HD12 LEU A 748 1.833 -4.065 4.768 1.00 0.00 H new ATOM 0 HD13 LEU A 748 2.580 -2.454 4.649 1.00 0.00 H new ATOM 0 HD21 LEU A 748 0.859 -1.516 2.286 1.00 0.00 H new ATOM 0 HD22 LEU A 748 2.623 -1.291 2.363 1.00 0.00 H new ATOM 0 HD23 LEU A 748 1.892 -2.130 0.974 1.00 0.00 H new ATOM 672 N VAL A 749 2.400 -6.630 1.435 1.00 0.00 N ATOM 673 CA VAL A 749 1.397 -7.534 0.931 1.00 0.00 C ATOM 674 C VAL A 749 1.583 -8.906 1.568 1.00 0.00 C ATOM 675 O VAL A 749 0.616 -9.548 1.956 1.00 0.00 O ATOM 676 CB VAL A 749 1.479 -7.671 -0.614 1.00 0.00 C ATOM 677 CG1 VAL A 749 0.362 -8.541 -1.139 1.00 0.00 C ATOM 678 CG2 VAL A 749 1.429 -6.315 -1.278 1.00 0.00 C ATOM 0 H VAL A 749 3.058 -6.298 0.730 1.00 0.00 H new ATOM 0 HA VAL A 749 0.418 -7.128 1.186 1.00 0.00 H new ATOM 0 HB VAL A 749 2.432 -8.144 -0.853 1.00 0.00 H new ATOM 0 HG11 VAL A 749 0.442 -8.621 -2.223 1.00 0.00 H new ATOM 0 HG12 VAL A 749 0.435 -9.534 -0.696 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -0.599 -8.097 -0.878 1.00 0.00 H new ATOM 0 HG21 VAL A 749 1.488 -6.437 -2.360 1.00 0.00 H new ATOM 0 HG22 VAL A 749 0.494 -5.818 -1.019 1.00 0.00 H new ATOM 0 HG23 VAL A 749 2.269 -5.711 -0.935 1.00 0.00 H new ATOM 688 N ASN A 750 2.843 -9.285 1.737 1.00 0.00 N ATOM 689 CA ASN A 750 3.237 -10.590 2.266 1.00 0.00 C ATOM 690 C ASN A 750 2.590 -10.857 3.606 1.00 0.00 C ATOM 691 O ASN A 750 1.764 -11.772 3.729 1.00 0.00 O ATOM 692 CB ASN A 750 4.765 -10.656 2.440 1.00 0.00 C ATOM 693 CG ASN A 750 5.243 -11.992 2.987 1.00 0.00 C ATOM 694 OD1 ASN A 750 4.659 -13.045 2.713 1.00 0.00 O ATOM 695 ND2 ASN A 750 6.265 -11.961 3.791 1.00 0.00 N ATOM 0 H ASN A 750 3.636 -8.686 1.507 1.00 0.00 H new ATOM 0 HA ASN A 750 2.906 -11.344 1.552 1.00 0.00 H new ATOM 0 HB2 ASN A 750 5.243 -10.471 1.478 1.00 0.00 H new ATOM 0 HB3 ASN A 750 5.083 -9.859 3.112 1.00 0.00 H new ATOM 0 HD21 ASN A 750 6.606 -12.823 4.216 1.00 0.00 H new ATOM 0 HD22 ASN A 750 6.725 -11.074 3.997 1.00 0.00 H new ATOM 702 N TRP A 751 2.888 -10.011 4.592 1.00 0.00 N ATOM 703 CA TRP A 751 2.372 -10.249 5.919 1.00 0.00 C ATOM 704 C TRP A 751 0.872 -10.039 5.945 1.00 0.00 C ATOM 705 O TRP A 751 0.169 -10.698 6.703 1.00 0.00 O ATOM 706 CB TRP A 751 3.093 -9.415 7.032 1.00 0.00 C ATOM 707 CG TRP A 751 2.786 -7.935 7.057 1.00 0.00 C ATOM 708 CD1 TRP A 751 3.530 -6.923 6.530 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.639 -7.310 7.665 1.00 0.00 C ATOM 710 NE1 TRP A 751 2.915 -5.717 6.771 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.748 -5.938 7.458 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.529 -7.798 8.359 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.787 -5.046 7.915 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.427 -6.914 8.804 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.292 -5.552 8.580 1.00 0.00 C ATOM 0 H TRP A 751 3.469 -9.179 4.492 1.00 0.00 H new ATOM 0 HA TRP A 751 2.587 -11.291 6.158 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.829 -9.837 8.002 1.00 0.00 H new ATOM 0 HB3 TRP A 751 4.169 -9.540 6.912 1.00 0.00 H new ATOM 0 HD1 TRP A 751 4.464 -7.049 6.002 1.00 0.00 H new ATOM 0 HE1 TRP A 751 3.270 -4.804 6.485 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.423 -8.857 8.544 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 0.890 -3.984 7.749 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.292 -7.285 9.334 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -1.056 -4.878 8.939 1.00 0.00 H new ATOM 726 N TYR A 752 0.378 -9.145 5.073 1.00 0.00 N ATOM 727 CA TYR A 752 -1.034 -8.828 5.029 1.00 0.00 C ATOM 728 C TYR A 752 -1.844 -10.072 4.728 1.00 0.00 C ATOM 729 O TYR A 752 -2.807 -10.384 5.436 1.00 0.00 O ATOM 730 CB TYR A 752 -1.321 -7.737 3.991 1.00 0.00 C ATOM 731 CG TYR A 752 -2.758 -7.265 3.996 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.373 -6.898 5.188 1.00 0.00 C ATOM 733 CD2 TYR A 752 -3.509 -7.194 2.823 1.00 0.00 C ATOM 734 CE1 TYR A 752 -4.676 -6.474 5.218 1.00 0.00 C ATOM 735 CE2 TYR A 752 -4.815 -6.767 2.851 1.00 0.00 C ATOM 736 CZ TYR A 752 -5.393 -6.409 4.054 1.00 0.00 C ATOM 737 OH TYR A 752 -6.689 -5.977 4.091 1.00 0.00 O ATOM 0 H TYR A 752 0.946 -8.637 4.395 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.327 -8.448 6.008 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -0.666 -6.886 4.179 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.074 -8.116 2.999 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -2.812 -6.948 6.110 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -3.060 -7.478 1.883 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.134 -6.193 6.155 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -5.387 -6.711 1.937 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.259 -6.612 3.609 1.00 0.00 H new ATOM 747 N LEU A 753 -1.410 -10.802 3.722 1.00 0.00 N ATOM 748 CA LEU A 753 -2.075 -12.016 3.301 1.00 0.00 C ATOM 749 C LEU A 753 -2.001 -13.047 4.413 1.00 0.00 C ATOM 750 O LEU A 753 -2.990 -13.658 4.763 1.00 0.00 O ATOM 751 CB LEU A 753 -1.401 -12.551 2.050 1.00 0.00 C ATOM 752 CG LEU A 753 -1.259 -11.553 0.905 1.00 0.00 C ATOM 753 CD1 LEU A 753 -0.441 -12.143 -0.207 1.00 0.00 C ATOM 754 CD2 LEU A 753 -2.614 -11.057 0.401 1.00 0.00 C ATOM 0 H LEU A 753 -0.583 -10.569 3.172 1.00 0.00 H new ATOM 0 HA LEU A 753 -3.122 -11.805 3.082 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -0.409 -12.913 2.319 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -1.968 -13.411 1.692 1.00 0.00 H new ATOM 0 HG LEU A 753 -0.734 -10.680 1.292 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -0.350 -11.418 -1.016 1.00 0.00 H new ATOM 0 HD12 LEU A 753 0.551 -12.397 0.166 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -0.930 -13.043 -0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -2.462 -10.349 -0.414 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -3.201 -11.903 0.042 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -3.147 -10.565 1.215 1.00 0.00 H new ATOM 766 N LYS A 754 -0.826 -13.153 5.009 1.00 0.00 N ATOM 767 CA LYS A 754 -0.543 -14.105 6.104 1.00 0.00 C ATOM 768 C LYS A 754 -1.475 -13.909 7.306 1.00 0.00 C ATOM 769 O LYS A 754 -1.822 -14.863 8.032 1.00 0.00 O ATOM 770 CB LYS A 754 0.892 -13.914 6.573 1.00 0.00 C ATOM 771 CG LYS A 754 1.943 -14.156 5.519 1.00 0.00 C ATOM 772 CD LYS A 754 1.895 -15.564 5.007 1.00 0.00 C ATOM 773 CE LYS A 754 2.910 -15.790 3.888 1.00 0.00 C ATOM 774 NZ LYS A 754 4.308 -15.474 4.295 1.00 0.00 N ATOM 0 H LYS A 754 -0.022 -12.579 4.753 1.00 0.00 H new ATOM 0 HA LYS A 754 -0.704 -15.109 5.711 1.00 0.00 H new ATOM 0 HB2 LYS A 754 1.003 -12.897 6.949 1.00 0.00 H new ATOM 0 HB3 LYS A 754 1.077 -14.586 7.411 1.00 0.00 H new ATOM 0 HG2 LYS A 754 1.796 -13.462 4.692 1.00 0.00 H new ATOM 0 HG3 LYS A 754 2.930 -13.952 5.935 1.00 0.00 H new ATOM 0 HD2 LYS A 754 2.094 -16.256 5.825 1.00 0.00 H new ATOM 0 HD3 LYS A 754 0.893 -15.784 4.640 1.00 0.00 H new ATOM 0 HE2 LYS A 754 2.858 -16.829 3.563 1.00 0.00 H new ATOM 0 HE3 LYS A 754 2.640 -15.174 3.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 4.941 -16.237 3.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 4.603 -14.578 3.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 4.357 -15.385 5.330 1.00 0.00 H new ATOM 788 N GLU A 755 -1.854 -12.700 7.521 1.00 0.00 N ATOM 789 CA GLU A 755 -2.694 -12.351 8.654 1.00 0.00 C ATOM 790 C GLU A 755 -4.162 -12.584 8.368 1.00 0.00 C ATOM 791 O GLU A 755 -4.888 -13.117 9.201 1.00 0.00 O ATOM 792 CB GLU A 755 -2.471 -10.905 9.101 1.00 0.00 C ATOM 793 CG GLU A 755 -1.069 -10.618 9.609 1.00 0.00 C ATOM 794 CD GLU A 755 -0.669 -11.492 10.762 1.00 0.00 C ATOM 795 OE1 GLU A 755 -1.169 -11.278 11.887 1.00 0.00 O ATOM 796 OE2 GLU A 755 0.144 -12.420 10.568 1.00 0.00 O ATOM 0 H GLU A 755 -1.600 -11.911 6.927 1.00 0.00 H new ATOM 0 HA GLU A 755 -2.398 -13.014 9.467 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -2.685 -10.241 8.263 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -3.186 -10.666 9.888 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -0.359 -10.755 8.794 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -1.006 -9.573 9.914 1.00 0.00 H new ATOM 803 N ILE A 756 -4.595 -12.214 7.194 1.00 0.00 N ATOM 804 CA ILE A 756 -6.011 -12.296 6.855 1.00 0.00 C ATOM 805 C ILE A 756 -6.398 -13.653 6.283 1.00 0.00 C ATOM 806 O ILE A 756 -7.581 -13.956 6.154 1.00 0.00 O ATOM 807 CB ILE A 756 -6.422 -11.188 5.862 1.00 0.00 C ATOM 808 CG1 ILE A 756 -5.621 -11.324 4.554 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.229 -9.810 6.497 1.00 0.00 C ATOM 810 CD1 ILE A 756 -5.888 -10.247 3.541 1.00 0.00 C ATOM 0 H ILE A 756 -3.999 -11.852 6.450 1.00 0.00 H new ATOM 0 HA ILE A 756 -6.548 -12.156 7.793 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.479 -11.298 5.620 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -4.558 -11.324 4.793 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -5.846 -12.291 4.104 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -6.522 -9.038 5.786 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -6.846 -9.732 7.392 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.181 -9.677 6.766 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -5.281 -10.424 2.653 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -6.943 -10.258 3.267 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -5.634 -9.276 3.967 1.00 0.00 H new ATOM 822 N GLU A 757 -5.406 -14.481 5.973 1.00 0.00 N ATOM 823 CA GLU A 757 -5.644 -15.780 5.334 1.00 0.00 C ATOM 824 C GLU A 757 -6.509 -16.726 6.182 1.00 0.00 C ATOM 825 O GLU A 757 -7.111 -17.662 5.655 1.00 0.00 O ATOM 826 CB GLU A 757 -4.336 -16.455 4.940 1.00 0.00 C ATOM 827 CG GLU A 757 -3.471 -16.934 6.094 1.00 0.00 C ATOM 828 CD GLU A 757 -2.268 -17.688 5.600 1.00 0.00 C ATOM 829 OE1 GLU A 757 -2.432 -18.810 5.090 1.00 0.00 O ATOM 830 OE2 GLU A 757 -1.132 -17.189 5.705 1.00 0.00 O ATOM 0 H GLU A 757 -4.423 -14.278 6.153 1.00 0.00 H new ATOM 0 HA GLU A 757 -6.213 -15.565 4.429 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -4.566 -17.309 4.303 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -3.754 -15.756 4.339 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -3.148 -16.079 6.688 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -4.060 -17.575 6.751 1.00 0.00 H new ATOM 837 N SER A 758 -6.603 -16.441 7.466 1.00 0.00 N ATOM 838 CA SER A 758 -7.355 -17.241 8.398 1.00 0.00 C ATOM 839 C SER A 758 -8.869 -17.211 8.107 1.00 0.00 C ATOM 840 O SER A 758 -9.574 -18.197 8.338 1.00 0.00 O ATOM 841 CB SER A 758 -7.053 -16.735 9.797 1.00 0.00 C ATOM 842 OG SER A 758 -7.109 -15.309 9.821 1.00 0.00 O ATOM 0 H SER A 758 -6.150 -15.633 7.893 1.00 0.00 H new ATOM 0 HA SER A 758 -7.055 -18.284 8.300 1.00 0.00 H new ATOM 0 HB2 SER A 758 -7.771 -17.148 10.505 1.00 0.00 H new ATOM 0 HB3 SER A 758 -6.066 -17.074 10.110 1.00 0.00 H new ATOM 0 HG SER A 758 -6.915 -14.989 10.727 1.00 0.00 H new ATOM 848 N GLU A 759 -9.354 -16.102 7.555 1.00 0.00 N ATOM 849 CA GLU A 759 -10.791 -15.960 7.297 1.00 0.00 C ATOM 850 C GLU A 759 -11.113 -16.321 5.856 1.00 0.00 C ATOM 851 O GLU A 759 -12.287 -16.431 5.467 1.00 0.00 O ATOM 852 CB GLU A 759 -11.276 -14.529 7.585 1.00 0.00 C ATOM 853 CG GLU A 759 -10.661 -13.474 6.678 1.00 0.00 C ATOM 854 CD GLU A 759 -11.207 -12.097 6.919 1.00 0.00 C ATOM 855 OE1 GLU A 759 -10.715 -11.404 7.826 1.00 0.00 O ATOM 856 OE2 GLU A 759 -12.126 -11.667 6.190 1.00 0.00 O ATOM 0 H GLU A 759 -8.788 -15.299 7.280 1.00 0.00 H new ATOM 0 HA GLU A 759 -11.310 -16.644 7.968 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -12.360 -14.496 7.481 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -11.048 -14.280 8.621 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -9.581 -13.461 6.827 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.836 -13.751 5.638 1.00 0.00 H new ATOM 863 N ILE A 760 -10.082 -16.521 5.082 1.00 0.00 N ATOM 864 CA ILE A 760 -10.217 -16.773 3.674 1.00 0.00 C ATOM 865 C ILE A 760 -10.706 -18.190 3.436 1.00 0.00 C ATOM 866 O ILE A 760 -9.989 -19.164 3.667 1.00 0.00 O ATOM 867 CB ILE A 760 -8.879 -16.555 2.937 1.00 0.00 C ATOM 868 CG1 ILE A 760 -8.329 -15.134 3.163 1.00 0.00 C ATOM 869 CG2 ILE A 760 -8.995 -16.869 1.462 1.00 0.00 C ATOM 870 CD1 ILE A 760 -9.217 -14.020 2.655 1.00 0.00 C ATOM 0 H ILE A 760 -9.117 -16.514 5.413 1.00 0.00 H new ATOM 0 HA ILE A 760 -10.948 -16.067 3.279 1.00 0.00 H new ATOM 0 HB ILE A 760 -8.162 -17.256 3.366 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -8.164 -14.989 4.231 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -7.357 -15.055 2.677 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -8.033 -16.703 0.978 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -9.291 -17.910 1.334 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -9.745 -16.220 1.010 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -8.747 -13.058 2.859 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -9.363 -14.132 1.581 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -10.182 -14.066 3.159 1.00 0.00 H new ATOM 882 N ASP A 761 -11.937 -18.290 3.026 1.00 0.00 N ATOM 883 CA ASP A 761 -12.535 -19.577 2.705 1.00 0.00 C ATOM 884 C ASP A 761 -12.348 -19.885 1.241 1.00 0.00 C ATOM 885 O ASP A 761 -12.214 -21.046 0.841 1.00 0.00 O ATOM 886 CB ASP A 761 -14.035 -19.567 3.011 1.00 0.00 C ATOM 887 CG ASP A 761 -14.712 -20.885 2.672 1.00 0.00 C ATOM 888 OD1 ASP A 761 -15.161 -21.082 1.513 1.00 0.00 O ATOM 889 OD2 ASP A 761 -14.826 -21.745 3.555 1.00 0.00 O ATOM 0 H ASP A 761 -12.561 -17.493 2.901 1.00 0.00 H new ATOM 0 HA ASP A 761 -12.043 -20.336 3.313 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -14.184 -19.348 4.068 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -14.511 -18.764 2.449 1.00 0.00 H new ATOM 894 N SER A 762 -12.279 -18.849 0.446 1.00 0.00 N ATOM 895 CA SER A 762 -12.288 -19.003 -0.978 1.00 0.00 C ATOM 896 C SER A 762 -11.049 -18.368 -1.576 1.00 0.00 C ATOM 897 O SER A 762 -10.639 -17.286 -1.138 1.00 0.00 O ATOM 898 CB SER A 762 -13.543 -18.319 -1.529 1.00 0.00 C ATOM 899 OG SER A 762 -14.715 -18.779 -0.862 1.00 0.00 O ATOM 0 H SER A 762 -12.216 -17.883 0.768 1.00 0.00 H new ATOM 0 HA SER A 762 -12.293 -20.061 -1.239 1.00 0.00 H new ATOM 0 HB2 SER A 762 -13.454 -17.239 -1.410 1.00 0.00 H new ATOM 0 HB3 SER A 762 -13.628 -18.516 -2.598 1.00 0.00 H new ATOM 0 HG SER A 762 -15.501 -18.325 -1.232 1.00 0.00 H new ATOM 905 N GLU A 763 -10.464 -19.022 -2.571 1.00 0.00 N ATOM 906 CA GLU A 763 -9.285 -18.515 -3.272 1.00 0.00 C ATOM 907 C GLU A 763 -9.584 -17.137 -3.862 1.00 0.00 C ATOM 908 O GLU A 763 -8.732 -16.260 -3.858 1.00 0.00 O ATOM 909 CB GLU A 763 -8.843 -19.494 -4.374 1.00 0.00 C ATOM 910 CG GLU A 763 -7.610 -19.046 -5.152 1.00 0.00 C ATOM 911 CD GLU A 763 -7.211 -20.015 -6.236 1.00 0.00 C ATOM 912 OE1 GLU A 763 -7.814 -19.987 -7.332 1.00 0.00 O ATOM 913 OE2 GLU A 763 -6.279 -20.826 -6.017 1.00 0.00 O ATOM 0 H GLU A 763 -10.793 -19.923 -2.918 1.00 0.00 H new ATOM 0 HA GLU A 763 -8.466 -18.422 -2.559 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -8.640 -20.465 -3.922 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -9.668 -19.634 -5.072 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -7.804 -18.071 -5.598 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -6.777 -18.920 -4.460 1.00 0.00 H new ATOM 920 N GLU A 764 -10.829 -16.953 -4.318 1.00 0.00 N ATOM 921 CA GLU A 764 -11.292 -15.678 -4.863 1.00 0.00 C ATOM 922 C GLU A 764 -11.050 -14.519 -3.897 1.00 0.00 C ATOM 923 O GLU A 764 -10.601 -13.463 -4.309 1.00 0.00 O ATOM 924 CB GLU A 764 -12.764 -15.740 -5.211 1.00 0.00 C ATOM 925 CG GLU A 764 -13.103 -16.683 -6.342 1.00 0.00 C ATOM 926 CD GLU A 764 -14.558 -16.613 -6.700 1.00 0.00 C ATOM 927 OE1 GLU A 764 -14.973 -15.617 -7.337 1.00 0.00 O ATOM 928 OE2 GLU A 764 -15.320 -17.527 -6.330 1.00 0.00 O ATOM 0 H GLU A 764 -11.540 -17.684 -4.318 1.00 0.00 H new ATOM 0 HA GLU A 764 -10.712 -15.497 -5.768 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -13.321 -16.042 -4.324 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -13.104 -14.739 -5.476 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -12.500 -16.436 -7.216 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -12.847 -17.703 -6.056 1.00 0.00 H new ATOM 935 N GLU A 765 -11.341 -14.738 -2.620 1.00 0.00 N ATOM 936 CA GLU A 765 -11.131 -13.764 -1.582 1.00 0.00 C ATOM 937 C GLU A 765 -9.668 -13.430 -1.435 1.00 0.00 C ATOM 938 O GLU A 765 -9.298 -12.271 -1.311 1.00 0.00 O ATOM 939 CB GLU A 765 -11.624 -14.353 -0.311 1.00 0.00 C ATOM 940 CG GLU A 765 -12.698 -13.575 0.320 1.00 0.00 C ATOM 941 CD GLU A 765 -12.221 -12.234 0.880 1.00 0.00 C ATOM 942 OE1 GLU A 765 -12.134 -11.235 0.131 1.00 0.00 O ATOM 943 OE2 GLU A 765 -11.926 -12.154 2.085 1.00 0.00 O ATOM 0 H GLU A 765 -11.736 -15.616 -2.282 1.00 0.00 H new ATOM 0 HA GLU A 765 -11.662 -12.845 -1.832 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -11.984 -15.364 -0.504 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -10.791 -14.439 0.387 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -13.486 -13.396 -0.411 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -13.138 -14.162 1.126 1.00 0.00 H new ATOM 950 N LEU A 766 -8.856 -14.458 -1.435 1.00 0.00 N ATOM 951 CA LEU A 766 -7.405 -14.304 -1.346 1.00 0.00 C ATOM 952 C LEU A 766 -6.908 -13.480 -2.527 1.00 0.00 C ATOM 953 O LEU A 766 -6.103 -12.563 -2.362 1.00 0.00 O ATOM 954 CB LEU A 766 -6.711 -15.668 -1.337 1.00 0.00 C ATOM 955 CG LEU A 766 -5.193 -15.658 -1.122 1.00 0.00 C ATOM 956 CD1 LEU A 766 -4.834 -15.061 0.237 1.00 0.00 C ATOM 957 CD2 LEU A 766 -4.632 -17.061 -1.254 1.00 0.00 C ATOM 0 H LEU A 766 -9.170 -15.427 -1.496 1.00 0.00 H new ATOM 0 HA LEU A 766 -7.166 -13.792 -0.414 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -7.163 -16.276 -0.554 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -6.919 -16.163 -2.285 1.00 0.00 H new ATOM 0 HG LEU A 766 -4.745 -15.030 -1.892 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -3.751 -15.067 0.362 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -5.200 -14.036 0.292 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -5.294 -15.654 1.028 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -3.553 -17.038 -1.099 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -5.092 -17.709 -0.508 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -4.847 -17.446 -2.251 1.00 0.00 H new ATOM 969 N ILE A 767 -7.414 -13.809 -3.713 1.00 0.00 N ATOM 970 CA ILE A 767 -7.095 -13.083 -4.928 1.00 0.00 C ATOM 971 C ILE A 767 -7.549 -11.638 -4.785 1.00 0.00 C ATOM 972 O ILE A 767 -6.777 -10.730 -5.018 1.00 0.00 O ATOM 973 CB ILE A 767 -7.760 -13.729 -6.182 1.00 0.00 C ATOM 974 CG1 ILE A 767 -7.241 -15.160 -6.382 1.00 0.00 C ATOM 975 CG2 ILE A 767 -7.496 -12.888 -7.432 1.00 0.00 C ATOM 976 CD1 ILE A 767 -7.913 -15.910 -7.515 1.00 0.00 C ATOM 0 H ILE A 767 -8.057 -14.588 -3.853 1.00 0.00 H new ATOM 0 HA ILE A 767 -6.016 -13.123 -5.073 1.00 0.00 H new ATOM 0 HB ILE A 767 -8.837 -13.766 -6.017 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -6.168 -15.123 -6.571 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -7.382 -15.719 -5.457 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -7.970 -13.358 -8.294 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -7.908 -11.889 -7.292 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -6.422 -12.817 -7.602 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -7.490 -16.912 -7.590 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -8.983 -15.982 -7.320 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -7.750 -15.377 -8.451 1.00 0.00 H new ATOM 988 N ASN A 768 -8.785 -11.455 -4.339 1.00 0.00 N ATOM 989 CA ASN A 768 -9.371 -10.139 -4.115 1.00 0.00 C ATOM 990 C ASN A 768 -8.522 -9.299 -3.193 1.00 0.00 C ATOM 991 O ASN A 768 -8.083 -8.231 -3.575 1.00 0.00 O ATOM 992 CB ASN A 768 -10.818 -10.258 -3.580 1.00 0.00 C ATOM 993 CG ASN A 768 -11.305 -8.982 -2.914 1.00 0.00 C ATOM 994 OD1 ASN A 768 -11.785 -8.060 -3.566 1.00 0.00 O ATOM 995 ND2 ASN A 768 -11.258 -8.960 -1.599 1.00 0.00 N ATOM 0 H ASN A 768 -9.417 -12.225 -4.120 1.00 0.00 H new ATOM 0 HA ASN A 768 -9.406 -9.631 -5.079 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -11.486 -10.510 -4.404 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -10.870 -11.079 -2.865 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -11.628 -8.158 -1.089 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -10.851 -9.745 -1.090 1.00 0.00 H new ATOM 1002 N LYS A 769 -8.254 -9.814 -2.002 1.00 0.00 N ATOM 1003 CA LYS A 769 -7.456 -9.109 -1.015 1.00 0.00 C ATOM 1004 C LYS A 769 -6.090 -8.744 -1.587 1.00 0.00 C ATOM 1005 O LYS A 769 -5.644 -7.605 -1.458 1.00 0.00 O ATOM 1006 CB LYS A 769 -7.283 -9.960 0.243 1.00 0.00 C ATOM 1007 CG LYS A 769 -8.531 -10.115 1.126 1.00 0.00 C ATOM 1008 CD LYS A 769 -8.948 -8.785 1.772 1.00 0.00 C ATOM 1009 CE LYS A 769 -9.974 -8.996 2.898 1.00 0.00 C ATOM 1010 NZ LYS A 769 -11.237 -9.622 2.439 1.00 0.00 N ATOM 0 H LYS A 769 -8.583 -10.729 -1.695 1.00 0.00 H new ATOM 0 HA LYS A 769 -7.981 -8.191 -0.750 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -6.948 -10.953 -0.057 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -6.487 -9.524 0.846 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -9.355 -10.500 0.525 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -8.334 -10.851 1.906 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -8.067 -8.283 2.172 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -9.372 -8.128 1.012 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -9.529 -9.621 3.672 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -10.201 -8.034 3.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -12.033 -9.244 2.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -11.384 -9.410 1.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -11.182 -10.652 2.571 1.00 0.00 H new ATOM 1024 N LYS A 770 -5.472 -9.707 -2.273 1.00 0.00 N ATOM 1025 CA LYS A 770 -4.162 -9.531 -2.880 1.00 0.00 C ATOM 1026 C LYS A 770 -4.192 -8.486 -3.996 1.00 0.00 C ATOM 1027 O LYS A 770 -3.297 -7.661 -4.101 1.00 0.00 O ATOM 1028 CB LYS A 770 -3.630 -10.876 -3.408 1.00 0.00 C ATOM 1029 CG LYS A 770 -2.269 -10.806 -4.098 1.00 0.00 C ATOM 1030 CD LYS A 770 -1.810 -12.174 -4.609 1.00 0.00 C ATOM 1031 CE LYS A 770 -1.540 -13.154 -3.466 1.00 0.00 C ATOM 1032 NZ LYS A 770 -1.070 -14.468 -3.952 1.00 0.00 N ATOM 0 H LYS A 770 -5.872 -10.633 -2.421 1.00 0.00 H new ATOM 0 HA LYS A 770 -3.485 -9.165 -2.108 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -3.562 -11.575 -2.575 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -4.356 -11.286 -4.110 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -2.322 -10.107 -4.933 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -1.529 -10.414 -3.400 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -2.572 -12.588 -5.269 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -0.905 -12.053 -5.204 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -0.793 -12.729 -2.795 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -2.451 -13.289 -2.884 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -0.901 -15.098 -3.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -1.792 -14.888 -4.571 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -0.186 -14.345 -4.485 1.00 0.00 H new ATOM 1046 N ARG A 771 -5.220 -8.514 -4.801 1.00 0.00 N ATOM 1047 CA ARG A 771 -5.332 -7.587 -5.906 1.00 0.00 C ATOM 1048 C ARG A 771 -5.680 -6.198 -5.433 1.00 0.00 C ATOM 1049 O ARG A 771 -5.176 -5.229 -5.970 1.00 0.00 O ATOM 1050 CB ARG A 771 -6.319 -8.074 -6.960 1.00 0.00 C ATOM 1051 CG ARG A 771 -5.895 -9.357 -7.660 1.00 0.00 C ATOM 1052 CD ARG A 771 -4.571 -9.194 -8.394 1.00 0.00 C ATOM 1053 NE ARG A 771 -4.160 -10.434 -9.048 1.00 0.00 N ATOM 1054 CZ ARG A 771 -2.912 -10.721 -9.430 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -1.923 -9.831 -9.280 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -2.653 -11.897 -9.975 1.00 0.00 N ATOM 0 H ARG A 771 -5.997 -9.169 -4.716 1.00 0.00 H new ATOM 0 HA ARG A 771 -4.351 -7.539 -6.379 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -7.289 -8.233 -6.489 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -6.452 -7.292 -7.707 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -5.807 -10.158 -6.926 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -6.668 -9.656 -8.368 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -4.662 -8.403 -9.138 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -3.800 -8.881 -7.689 1.00 0.00 H new ATOM 0 HE ARG A 771 -4.880 -11.134 -9.227 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -2.117 -8.918 -8.869 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -0.976 -10.066 -9.577 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -3.403 -12.577 -10.101 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -1.703 -12.125 -10.270 1.00 0.00 H new ATOM 1070 N ILE A 772 -6.519 -6.099 -4.415 1.00 0.00 N ATOM 1071 CA ILE A 772 -6.880 -4.805 -3.863 1.00 0.00 C ATOM 1072 C ILE A 772 -5.657 -4.137 -3.264 1.00 0.00 C ATOM 1073 O ILE A 772 -5.358 -2.995 -3.597 1.00 0.00 O ATOM 1074 CB ILE A 772 -8.014 -4.888 -2.795 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -9.303 -5.465 -3.405 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -8.298 -3.506 -2.187 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -9.890 -4.639 -4.533 1.00 0.00 C ATOM 0 H ILE A 772 -6.961 -6.896 -3.956 1.00 0.00 H new ATOM 0 HA ILE A 772 -7.268 -4.210 -4.690 1.00 0.00 H new ATOM 0 HB ILE A 772 -7.672 -5.555 -2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -9.096 -6.469 -3.776 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -10.050 -5.564 -2.617 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.092 -3.591 -1.445 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -7.395 -3.126 -1.709 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -8.609 -2.819 -2.974 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -10.796 -5.120 -4.903 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -10.133 -3.642 -4.166 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -9.164 -4.561 -5.343 1.00 0.00 H new ATOM 1089 N ILE A 773 -4.916 -4.870 -2.428 1.00 0.00 N ATOM 1090 CA ILE A 773 -3.724 -4.313 -1.801 1.00 0.00 C ATOM 1091 C ILE A 773 -2.682 -3.925 -2.869 1.00 0.00 C ATOM 1092 O ILE A 773 -2.095 -2.844 -2.809 1.00 0.00 O ATOM 1093 CB ILE A 773 -3.112 -5.259 -0.690 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -1.906 -4.632 -0.005 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -2.732 -6.614 -1.224 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.224 -3.359 0.733 1.00 0.00 C ATOM 0 H ILE A 773 -5.120 -5.837 -2.175 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.029 -3.407 -1.277 1.00 0.00 H new ATOM 0 HB ILE A 773 -3.907 -5.391 0.044 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -1.482 -5.352 0.695 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -1.140 -4.426 -0.753 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -2.318 -7.220 -0.418 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -3.616 -7.106 -1.630 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -1.987 -6.499 -2.011 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.317 -2.970 1.195 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -2.619 -2.622 0.034 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -2.966 -3.562 1.505 1.00 0.00 H new ATOM 1108 N GLU A 774 -2.537 -4.772 -3.877 1.00 0.00 N ATOM 1109 CA GLU A 774 -1.624 -4.534 -4.974 1.00 0.00 C ATOM 1110 C GLU A 774 -2.051 -3.287 -5.772 1.00 0.00 C ATOM 1111 O GLU A 774 -1.219 -2.411 -6.078 1.00 0.00 O ATOM 1112 CB GLU A 774 -1.572 -5.777 -5.863 1.00 0.00 C ATOM 1113 CG GLU A 774 -0.668 -5.663 -7.060 1.00 0.00 C ATOM 1114 CD GLU A 774 -0.627 -6.929 -7.869 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -1.610 -7.230 -8.588 1.00 0.00 O ATOM 1116 OE2 GLU A 774 0.399 -7.620 -7.844 1.00 0.00 O ATOM 0 H GLU A 774 -3.055 -5.648 -3.953 1.00 0.00 H new ATOM 0 HA GLU A 774 -0.625 -4.342 -4.584 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -1.246 -6.624 -5.259 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -2.581 -6.001 -6.208 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -1.008 -4.842 -7.692 1.00 0.00 H new ATOM 0 HG3 GLU A 774 0.340 -5.414 -6.728 1.00 0.00 H new ATOM 1123 N LYS A 775 -3.345 -3.195 -6.070 1.00 0.00 N ATOM 1124 CA LYS A 775 -3.901 -2.068 -6.799 1.00 0.00 C ATOM 1125 C LYS A 775 -3.780 -0.782 -6.004 1.00 0.00 C ATOM 1126 O LYS A 775 -3.513 0.258 -6.568 1.00 0.00 O ATOM 1127 CB LYS A 775 -5.369 -2.327 -7.229 1.00 0.00 C ATOM 1128 CG LYS A 775 -6.074 -1.128 -7.898 1.00 0.00 C ATOM 1129 CD LYS A 775 -5.331 -0.618 -9.145 1.00 0.00 C ATOM 1130 CE LYS A 775 -5.361 -1.609 -10.298 1.00 0.00 C ATOM 1131 NZ LYS A 775 -6.722 -1.826 -10.810 1.00 0.00 N ATOM 0 H LYS A 775 -4.034 -3.902 -5.811 1.00 0.00 H new ATOM 0 HA LYS A 775 -3.313 -1.953 -7.709 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -5.386 -3.171 -7.919 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -5.942 -2.622 -6.350 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -7.087 -1.418 -8.178 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -6.163 -0.316 -7.176 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -5.778 0.322 -9.469 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -4.295 -0.405 -8.883 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -4.725 -1.244 -11.105 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -4.943 -2.560 -9.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -6.676 -2.356 -11.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -7.273 -2.368 -10.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -7.181 -0.908 -10.976 1.00 0.00 H new ATOM 1145 N VAL A 776 -3.961 -0.853 -4.704 1.00 0.00 N ATOM 1146 CA VAL A 776 -3.816 0.321 -3.857 1.00 0.00 C ATOM 1147 C VAL A 776 -2.377 0.833 -3.872 1.00 0.00 C ATOM 1148 O VAL A 776 -2.156 2.027 -4.042 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.320 0.073 -2.408 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -3.966 1.235 -1.480 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -5.829 -0.125 -2.415 1.00 0.00 C ATOM 0 H VAL A 776 -4.209 -1.708 -4.206 1.00 0.00 H new ATOM 0 HA VAL A 776 -4.454 1.099 -4.276 1.00 0.00 H new ATOM 0 HB VAL A 776 -3.826 -0.823 -2.034 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -4.335 1.024 -0.476 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -2.884 1.360 -1.450 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -4.427 2.150 -1.851 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -6.178 -0.299 -1.397 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -6.311 0.766 -2.817 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -6.080 -0.985 -3.036 1.00 0.00 H new ATOM 1161 N ILE A 777 -1.407 -0.079 -3.756 1.00 0.00 N ATOM 1162 CA ILE A 777 0.013 0.299 -3.809 1.00 0.00 C ATOM 1163 C ILE A 777 0.330 0.957 -5.171 1.00 0.00 C ATOM 1164 O ILE A 777 1.041 1.984 -5.248 1.00 0.00 O ATOM 1165 CB ILE A 777 0.950 -0.929 -3.577 1.00 0.00 C ATOM 1166 CG1 ILE A 777 0.653 -1.578 -2.212 1.00 0.00 C ATOM 1167 CG2 ILE A 777 2.416 -0.496 -3.638 1.00 0.00 C ATOM 1168 CD1 ILE A 777 1.416 -2.867 -1.950 1.00 0.00 C ATOM 0 H ILE A 777 -1.574 -1.077 -3.626 1.00 0.00 H new ATOM 0 HA ILE A 777 0.198 1.011 -3.005 1.00 0.00 H new ATOM 0 HB ILE A 777 0.763 -1.660 -4.364 1.00 0.00 H new ATOM 0 HG12 ILE A 777 0.890 -0.863 -1.424 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -0.416 -1.783 -2.145 1.00 0.00 H new ATOM 0 HG21 ILE A 777 3.058 -1.362 -3.475 1.00 0.00 H new ATOM 0 HG22 ILE A 777 2.628 -0.066 -4.617 1.00 0.00 H new ATOM 0 HG23 ILE A 777 2.608 0.249 -2.866 1.00 0.00 H new ATOM 0 HD11 ILE A 777 1.147 -3.256 -0.968 1.00 0.00 H new ATOM 0 HD12 ILE A 777 1.161 -3.602 -2.713 1.00 0.00 H new ATOM 0 HD13 ILE A 777 2.487 -2.668 -1.981 1.00 0.00 H new ATOM 1180 N HIS A 778 -0.227 0.380 -6.231 1.00 0.00 N ATOM 1181 CA HIS A 778 -0.101 0.931 -7.575 1.00 0.00 C ATOM 1182 C HIS A 778 -0.759 2.308 -7.652 1.00 0.00 C ATOM 1183 O HIS A 778 -0.141 3.262 -8.077 1.00 0.00 O ATOM 1184 CB HIS A 778 -0.700 -0.038 -8.632 1.00 0.00 C ATOM 1185 CG HIS A 778 -0.893 0.560 -10.014 1.00 0.00 C ATOM 1186 ND1 HIS A 778 0.128 0.873 -10.884 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -2.040 0.935 -10.640 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -0.416 1.419 -11.981 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -1.732 1.474 -11.880 1.00 0.00 N ATOM 0 H HIS A 778 -0.776 -0.478 -6.183 1.00 0.00 H new ATOM 0 HA HIS A 778 0.959 1.049 -7.800 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -0.048 -0.907 -8.717 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -1.664 -0.396 -8.270 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -3.036 0.830 -10.235 1.00 0.00 H new ATOM 0 HE1 HIS A 778 0.147 1.768 -12.834 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -2.387 1.838 -12.572 1.00 0.00 H new ATOM 1197 N ARG A 779 -1.990 2.392 -7.196 1.00 0.00 N ATOM 1198 CA ARG A 779 -2.766 3.619 -7.234 1.00 0.00 C ATOM 1199 C ARG A 779 -2.049 4.749 -6.499 1.00 0.00 C ATOM 1200 O ARG A 779 -1.861 5.851 -7.040 1.00 0.00 O ATOM 1201 CB ARG A 779 -4.140 3.401 -6.601 1.00 0.00 C ATOM 1202 CG ARG A 779 -4.887 4.690 -6.389 1.00 0.00 C ATOM 1203 CD ARG A 779 -6.053 4.530 -5.460 1.00 0.00 C ATOM 1204 NE ARG A 779 -6.343 5.804 -4.840 1.00 0.00 N ATOM 1205 CZ ARG A 779 -7.341 6.072 -4.037 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -8.325 5.195 -3.874 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -7.371 7.241 -3.410 1.00 0.00 N ATOM 0 H ARG A 779 -2.488 1.603 -6.783 1.00 0.00 H new ATOM 0 HA ARG A 779 -2.885 3.900 -8.280 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -4.730 2.743 -7.239 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -4.019 2.893 -5.644 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -4.206 5.439 -5.986 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -5.240 5.064 -7.350 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -6.924 4.172 -6.008 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -5.827 3.784 -4.698 1.00 0.00 H new ATOM 0 HE ARG A 779 -5.705 6.572 -5.050 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -8.305 4.307 -4.376 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -9.100 5.409 -3.247 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -6.622 7.918 -3.557 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -8.143 7.463 -2.781 1.00 0.00 H new ATOM 1221 N LEU A 780 -1.649 4.457 -5.290 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.976 5.373 -4.421 1.00 0.00 C ATOM 1223 C LEU A 780 0.302 5.964 -5.065 1.00 0.00 C ATOM 1224 O LEU A 780 0.602 7.153 -4.889 1.00 0.00 O ATOM 1225 CB LEU A 780 -0.697 4.641 -3.107 1.00 0.00 C ATOM 1226 CG LEU A 780 0.006 5.399 -2.011 1.00 0.00 C ATOM 1227 CD1 LEU A 780 -0.695 6.710 -1.731 1.00 0.00 C ATOM 1228 CD2 LEU A 780 0.063 4.554 -0.749 1.00 0.00 C ATOM 0 H LEU A 780 -1.791 3.538 -4.872 1.00 0.00 H new ATOM 0 HA LEU A 780 -1.608 6.240 -4.228 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -1.650 4.289 -2.712 1.00 0.00 H new ATOM 0 HB3 LEU A 780 -0.102 3.757 -3.337 1.00 0.00 H new ATOM 0 HG LEU A 780 1.022 5.618 -2.339 1.00 0.00 H new ATOM 0 HD11 LEU A 780 -0.170 7.241 -0.936 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -0.699 7.321 -2.634 1.00 0.00 H new ATOM 0 HD13 LEU A 780 -1.721 6.515 -1.421 1.00 0.00 H new ATOM 0 HD21 LEU A 780 0.573 5.110 0.038 1.00 0.00 H new ATOM 0 HD22 LEU A 780 -0.950 4.314 -0.426 1.00 0.00 H new ATOM 0 HD23 LEU A 780 0.607 3.632 -0.953 1.00 0.00 H new ATOM 1240 N THR A 781 0.999 5.172 -5.854 1.00 0.00 N ATOM 1241 CA THR A 781 2.212 5.630 -6.510 1.00 0.00 C ATOM 1242 C THR A 781 1.950 6.171 -7.928 1.00 0.00 C ATOM 1243 O THR A 781 2.862 6.694 -8.575 1.00 0.00 O ATOM 1244 CB THR A 781 3.272 4.497 -6.591 1.00 0.00 C ATOM 1245 OG1 THR A 781 2.668 3.267 -7.047 1.00 0.00 O ATOM 1246 CG2 THR A 781 3.933 4.262 -5.261 1.00 0.00 C ATOM 0 H THR A 781 0.747 4.205 -6.058 1.00 0.00 H new ATOM 0 HA THR A 781 2.592 6.446 -5.896 1.00 0.00 H new ATOM 0 HB THR A 781 4.031 4.817 -7.304 1.00 0.00 H new ATOM 0 HG1 THR A 781 2.190 2.842 -6.304 1.00 0.00 H new ATOM 0 HG21 THR A 781 4.668 3.463 -5.356 1.00 0.00 H new ATOM 0 HG22 THR A 781 4.430 5.176 -4.935 1.00 0.00 H new ATOM 0 HG23 THR A 781 3.180 3.977 -4.526 1.00 0.00 H new ATOM 1254 N HIS A 782 0.723 6.076 -8.400 1.00 0.00 N ATOM 1255 CA HIS A 782 0.460 6.400 -9.797 1.00 0.00 C ATOM 1256 C HIS A 782 -0.554 7.530 -9.962 1.00 0.00 C ATOM 1257 O HIS A 782 -0.466 8.313 -10.901 1.00 0.00 O ATOM 1258 CB HIS A 782 -0.010 5.136 -10.529 1.00 0.00 C ATOM 1259 CG HIS A 782 -0.010 5.224 -12.026 1.00 0.00 C ATOM 1260 ND1 HIS A 782 -1.122 5.025 -12.811 1.00 0.00 N ATOM 1261 CD2 HIS A 782 1.018 5.432 -12.881 1.00 0.00 C ATOM 1262 CE1 HIS A 782 -0.745 5.114 -14.086 1.00 0.00 C ATOM 1263 NE2 HIS A 782 0.549 5.358 -14.186 1.00 0.00 N ATOM 0 H HIS A 782 -0.091 5.786 -7.858 1.00 0.00 H new ATOM 0 HA HIS A 782 1.390 6.760 -10.236 1.00 0.00 H new ATOM 0 HB2 HIS A 782 0.629 4.305 -10.231 1.00 0.00 H new ATOM 0 HB3 HIS A 782 -1.020 4.898 -10.196 1.00 0.00 H new ATOM 0 HD1 HIS A 782 -2.068 4.842 -12.476 1.00 0.00 H new ATOM 0 HD2 HIS A 782 2.041 5.625 -12.594 1.00 0.00 H new ATOM 0 HE1 HIS A 782 -1.411 5.001 -14.928 1.00 0.00 H new ATOM 1271 N TYR A 783 -1.509 7.610 -9.068 1.00 0.00 N ATOM 1272 CA TYR A 783 -2.546 8.627 -9.162 1.00 0.00 C ATOM 1273 C TYR A 783 -2.443 9.626 -8.029 1.00 0.00 C ATOM 1274 O TYR A 783 -2.371 10.840 -8.250 1.00 0.00 O ATOM 1275 CB TYR A 783 -3.944 7.996 -9.126 1.00 0.00 C ATOM 1276 CG TYR A 783 -4.260 7.050 -10.257 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -3.878 5.723 -10.197 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -4.960 7.479 -11.372 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -4.177 4.846 -11.211 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -5.273 6.609 -12.392 1.00 0.00 C ATOM 1281 CZ TYR A 783 -4.877 5.294 -12.306 1.00 0.00 C ATOM 1282 OH TYR A 783 -5.197 4.417 -13.311 1.00 0.00 O ATOM 0 H TYR A 783 -1.596 6.987 -8.265 1.00 0.00 H new ATOM 0 HA TYR A 783 -2.397 9.139 -10.113 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -4.057 7.459 -8.184 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -4.684 8.796 -9.127 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -3.333 5.368 -9.335 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -5.265 8.513 -11.443 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -3.865 3.814 -11.149 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -5.825 6.956 -13.253 1.00 0.00 H new ATOM 0 HH TYR A 783 -5.693 4.889 -14.012 1.00 0.00 H new ATOM 1292 N ASP A 784 -2.443 9.112 -6.820 1.00 0.00 N ATOM 1293 CA ASP A 784 -2.476 9.945 -5.617 1.00 0.00 C ATOM 1294 C ASP A 784 -1.155 10.646 -5.358 1.00 0.00 C ATOM 1295 O ASP A 784 -1.139 11.848 -5.079 1.00 0.00 O ATOM 1296 CB ASP A 784 -2.929 9.129 -4.396 1.00 0.00 C ATOM 1297 CG ASP A 784 -4.360 8.621 -4.539 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -4.581 7.694 -5.336 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -5.293 9.161 -3.887 1.00 0.00 O ATOM 0 H ASP A 784 -2.420 8.110 -6.632 1.00 0.00 H new ATOM 0 HA ASP A 784 -3.212 10.730 -5.793 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -2.257 8.282 -4.258 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -2.852 9.746 -3.501 1.00 0.00 H new ATOM 1304 N HIS A 785 -0.047 9.890 -5.431 1.00 0.00 N ATOM 1305 CA HIS A 785 1.327 10.436 -5.265 1.00 0.00 C ATOM 1306 C HIS A 785 1.565 11.010 -3.871 1.00 0.00 C ATOM 1307 O HIS A 785 2.435 11.862 -3.679 1.00 0.00 O ATOM 1308 CB HIS A 785 1.665 11.494 -6.337 1.00 0.00 C ATOM 1309 CG HIS A 785 1.906 10.947 -7.709 1.00 0.00 C ATOM 1310 ND1 HIS A 785 3.138 10.934 -8.320 1.00 0.00 N ATOM 1311 CD2 HIS A 785 1.045 10.425 -8.603 1.00 0.00 C ATOM 1312 CE1 HIS A 785 2.995 10.423 -9.538 1.00 0.00 C ATOM 1313 NE2 HIS A 785 1.736 10.093 -9.764 1.00 0.00 N ATOM 0 H HIS A 785 -0.069 8.885 -5.606 1.00 0.00 H new ATOM 0 HA HIS A 785 1.998 9.587 -5.396 1.00 0.00 H new ATOM 0 HB2 HIS A 785 0.848 12.213 -6.387 1.00 0.00 H new ATOM 0 HB3 HIS A 785 2.552 12.041 -6.019 1.00 0.00 H new ATOM 0 HD2 HIS A 785 -0.014 10.286 -8.444 1.00 0.00 H new ATOM 0 HE1 HIS A 785 3.799 10.295 -10.247 1.00 0.00 H new ATOM 0 HE2 HIS A 785 1.350 9.680 -10.613 1.00 0.00 H new ATOM 1321 N VAL A 786 0.835 10.516 -2.897 1.00 0.00 N ATOM 1322 CA VAL A 786 0.999 10.984 -1.528 1.00 0.00 C ATOM 1323 C VAL A 786 1.921 9.998 -0.750 1.00 0.00 C ATOM 1324 O VAL A 786 2.080 10.060 0.477 1.00 0.00 O ATOM 1325 CB VAL A 786 -0.396 11.203 -0.826 1.00 0.00 C ATOM 1326 CG1 VAL A 786 -1.145 9.910 -0.579 1.00 0.00 C ATOM 1327 CG2 VAL A 786 -0.284 12.033 0.446 1.00 0.00 C ATOM 0 H VAL A 786 0.125 9.794 -3.020 1.00 0.00 H new ATOM 0 HA VAL A 786 1.484 11.960 -1.533 1.00 0.00 H new ATOM 0 HB VAL A 786 -0.991 11.777 -1.536 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -2.097 10.128 -0.094 1.00 0.00 H new ATOM 0 HG12 VAL A 786 -1.329 9.409 -1.529 1.00 0.00 H new ATOM 0 HG13 VAL A 786 -0.550 9.262 0.064 1.00 0.00 H new ATOM 0 HG21 VAL A 786 -1.272 12.154 0.890 1.00 0.00 H new ATOM 0 HG22 VAL A 786 0.372 11.527 1.154 1.00 0.00 H new ATOM 0 HG23 VAL A 786 0.128 13.013 0.206 1.00 0.00 H new ATOM 1337 N LEU A 787 2.556 9.119 -1.510 1.00 0.00 N ATOM 1338 CA LEU A 787 3.493 8.152 -0.982 1.00 0.00 C ATOM 1339 C LEU A 787 4.883 8.582 -1.407 1.00 0.00 C ATOM 1340 O LEU A 787 5.118 8.877 -2.591 1.00 0.00 O ATOM 1341 CB LEU A 787 3.173 6.768 -1.545 1.00 0.00 C ATOM 1342 CG LEU A 787 3.961 5.563 -1.015 1.00 0.00 C ATOM 1343 CD1 LEU A 787 3.635 5.293 0.427 1.00 0.00 C ATOM 1344 CD2 LEU A 787 3.656 4.339 -1.833 1.00 0.00 C ATOM 0 H LEU A 787 2.431 9.060 -2.521 1.00 0.00 H new ATOM 0 HA LEU A 787 3.429 8.102 0.105 1.00 0.00 H new ATOM 0 HB2 LEU A 787 2.115 6.575 -1.370 1.00 0.00 H new ATOM 0 HB3 LEU A 787 3.315 6.808 -2.625 1.00 0.00 H new ATOM 0 HG LEU A 787 5.022 5.800 -1.095 1.00 0.00 H new ATOM 0 HD11 LEU A 787 4.208 4.434 0.775 1.00 0.00 H new ATOM 0 HD12 LEU A 787 3.890 6.166 1.027 1.00 0.00 H new ATOM 0 HD13 LEU A 787 2.570 5.083 0.526 1.00 0.00 H new ATOM 0 HD21 LEU A 787 4.222 3.492 -1.445 1.00 0.00 H new ATOM 0 HD22 LEU A 787 2.590 4.120 -1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 787 3.935 4.517 -2.872 1.00 0.00 H new ATOM 1356 N ILE A 788 5.776 8.611 -0.471 1.00 0.00 N ATOM 1357 CA ILE A 788 7.105 9.055 -0.686 1.00 0.00 C ATOM 1358 C ILE A 788 7.934 7.812 -0.917 1.00 0.00 C ATOM 1359 O ILE A 788 7.681 6.770 -0.301 1.00 0.00 O ATOM 1360 CB ILE A 788 7.678 9.864 0.548 1.00 0.00 C ATOM 1361 CG1 ILE A 788 6.793 11.072 0.939 1.00 0.00 C ATOM 1362 CG2 ILE A 788 9.102 10.338 0.296 1.00 0.00 C ATOM 1363 CD1 ILE A 788 5.534 10.725 1.727 1.00 0.00 C ATOM 0 H ILE A 788 5.591 8.317 0.488 1.00 0.00 H new ATOM 0 HA ILE A 788 7.135 9.737 -1.536 1.00 0.00 H new ATOM 0 HB ILE A 788 7.676 9.164 1.383 1.00 0.00 H new ATOM 0 HG12 ILE A 788 7.392 11.765 1.529 1.00 0.00 H new ATOM 0 HG13 ILE A 788 6.500 11.597 0.030 1.00 0.00 H new ATOM 0 HG21 ILE A 788 9.461 10.889 1.165 1.00 0.00 H new ATOM 0 HG22 ILE A 788 9.747 9.477 0.121 1.00 0.00 H new ATOM 0 HG23 ILE A 788 9.120 10.988 -0.579 1.00 0.00 H new ATOM 0 HD11 ILE A 788 4.983 11.638 1.953 1.00 0.00 H new ATOM 0 HD12 ILE A 788 4.906 10.059 1.135 1.00 0.00 H new ATOM 0 HD13 ILE A 788 5.812 10.230 2.657 1.00 0.00 H new ATOM 1375 N GLU A 789 8.868 7.886 -1.798 1.00 0.00 N ATOM 1376 CA GLU A 789 9.666 6.749 -2.113 1.00 0.00 C ATOM 1377 C GLU A 789 11.127 7.050 -1.933 1.00 0.00 C ATOM 1378 O GLU A 789 11.621 8.104 -2.337 1.00 0.00 O ATOM 1379 CB GLU A 789 9.376 6.276 -3.535 1.00 0.00 C ATOM 1380 CG GLU A 789 9.548 7.354 -4.577 1.00 0.00 C ATOM 1381 CD GLU A 789 9.190 6.887 -5.953 1.00 0.00 C ATOM 1382 OE1 GLU A 789 8.009 7.025 -6.341 1.00 0.00 O ATOM 1383 OE2 GLU A 789 10.069 6.397 -6.679 1.00 0.00 O ATOM 0 H GLU A 789 9.102 8.731 -2.320 1.00 0.00 H new ATOM 0 HA GLU A 789 9.407 5.945 -1.424 1.00 0.00 H new ATOM 0 HB2 GLU A 789 10.037 5.443 -3.774 1.00 0.00 H new ATOM 0 HB3 GLU A 789 8.355 5.897 -3.582 1.00 0.00 H new ATOM 0 HG2 GLU A 789 8.926 8.210 -4.315 1.00 0.00 H new ATOM 0 HG3 GLU A 789 10.582 7.698 -4.572 1.00 0.00 H new ATOM 1666 N TYR A 810 11.852 1.942 -1.203 1.00 0.00 N ATOM 1667 CA TYR A 810 11.354 1.888 0.144 1.00 0.00 C ATOM 1668 C TYR A 810 10.263 2.928 0.248 1.00 0.00 C ATOM 1669 O TYR A 810 10.516 4.124 0.063 1.00 0.00 O ATOM 1670 CB TYR A 810 12.479 2.158 1.162 1.00 0.00 C ATOM 1671 CG TYR A 810 13.544 1.067 1.299 1.00 0.00 C ATOM 1672 CD1 TYR A 810 14.045 0.379 0.197 1.00 0.00 C ATOM 1673 CD2 TYR A 810 14.066 0.754 2.547 1.00 0.00 C ATOM 1674 CE1 TYR A 810 15.020 -0.584 0.337 1.00 0.00 C ATOM 1675 CE2 TYR A 810 15.042 -0.211 2.692 1.00 0.00 C ATOM 1676 CZ TYR A 810 15.513 -0.878 1.584 1.00 0.00 C ATOM 1677 OH TYR A 810 16.496 -1.835 1.721 1.00 0.00 O ATOM 0 HA TYR A 810 10.964 0.896 0.373 1.00 0.00 H new ATOM 0 HB2 TYR A 810 12.975 3.088 0.885 1.00 0.00 H new ATOM 0 HB3 TYR A 810 12.025 2.318 2.140 1.00 0.00 H new ATOM 0 HD1 TYR A 810 13.662 0.605 -0.787 1.00 0.00 H new ATOM 0 HD2 TYR A 810 13.702 1.275 3.420 1.00 0.00 H new ATOM 0 HE1 TYR A 810 15.395 -1.106 -0.531 1.00 0.00 H new ATOM 0 HE2 TYR A 810 15.435 -0.442 3.671 1.00 0.00 H new ATOM 0 HH TYR A 810 16.737 -1.924 2.667 1.00 0.00 H new ATOM 1687 N LEU A 811 9.064 2.489 0.490 1.00 0.00 N ATOM 1688 CA LEU A 811 7.920 3.376 0.473 1.00 0.00 C ATOM 1689 C LEU A 811 7.537 3.834 1.844 1.00 0.00 C ATOM 1690 O LEU A 811 7.466 3.040 2.784 1.00 0.00 O ATOM 1691 CB LEU A 811 6.690 2.746 -0.218 1.00 0.00 C ATOM 1692 CG LEU A 811 6.761 2.493 -1.735 1.00 0.00 C ATOM 1693 CD1 LEU A 811 7.157 3.746 -2.486 1.00 0.00 C ATOM 1694 CD2 LEU A 811 7.678 1.353 -2.072 1.00 0.00 C ATOM 0 H LEU A 811 8.843 1.516 0.704 1.00 0.00 H new ATOM 0 HA LEU A 811 8.237 4.241 -0.110 1.00 0.00 H new ATOM 0 HB2 LEU A 811 6.485 1.793 0.270 1.00 0.00 H new ATOM 0 HB3 LEU A 811 5.833 3.392 -0.027 1.00 0.00 H new ATOM 0 HG LEU A 811 5.758 2.210 -2.056 1.00 0.00 H new ATOM 0 HD11 LEU A 811 7.198 3.532 -3.554 1.00 0.00 H new ATOM 0 HD12 LEU A 811 6.422 4.529 -2.300 1.00 0.00 H new ATOM 0 HD13 LEU A 811 8.137 4.080 -2.145 1.00 0.00 H new ATOM 0 HD21 LEU A 811 7.698 1.209 -3.152 1.00 0.00 H new ATOM 0 HD22 LEU A 811 8.684 1.578 -1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 811 7.319 0.443 -1.592 1.00 0.00 H new ATOM 1706 N VAL A 812 7.271 5.101 1.941 1.00 0.00 N ATOM 1707 CA VAL A 812 6.848 5.735 3.158 1.00 0.00 C ATOM 1708 C VAL A 812 5.656 6.617 2.837 1.00 0.00 C ATOM 1709 O VAL A 812 5.644 7.290 1.824 1.00 0.00 O ATOM 1710 CB VAL A 812 8.029 6.525 3.847 1.00 0.00 C ATOM 1711 CG1 VAL A 812 8.960 7.149 2.823 1.00 0.00 C ATOM 1712 CG2 VAL A 812 7.524 7.596 4.810 1.00 0.00 C ATOM 0 H VAL A 812 7.344 5.744 1.153 1.00 0.00 H new ATOM 0 HA VAL A 812 6.547 4.984 3.888 1.00 0.00 H new ATOM 0 HB VAL A 812 8.589 5.789 4.424 1.00 0.00 H new ATOM 0 HG11 VAL A 812 9.759 7.684 3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 812 9.390 6.367 2.198 1.00 0.00 H new ATOM 0 HG13 VAL A 812 8.400 7.845 2.199 1.00 0.00 H new ATOM 0 HG21 VAL A 812 8.373 8.112 5.259 1.00 0.00 H new ATOM 0 HG22 VAL A 812 6.910 8.314 4.266 1.00 0.00 H new ATOM 0 HG23 VAL A 812 6.928 7.129 5.594 1.00 0.00 H new ATOM 1722 N VAL A 813 4.663 6.615 3.676 1.00 0.00 N ATOM 1723 CA VAL A 813 3.436 7.306 3.357 1.00 0.00 C ATOM 1724 C VAL A 813 3.229 8.490 4.280 1.00 0.00 C ATOM 1725 O VAL A 813 3.795 8.542 5.383 1.00 0.00 O ATOM 1726 CB VAL A 813 2.204 6.319 3.409 1.00 0.00 C ATOM 1727 CG1 VAL A 813 1.921 5.818 4.816 1.00 0.00 C ATOM 1728 CG2 VAL A 813 0.944 6.907 2.754 1.00 0.00 C ATOM 0 H VAL A 813 4.672 6.148 4.583 1.00 0.00 H new ATOM 0 HA VAL A 813 3.515 7.686 2.339 1.00 0.00 H new ATOM 0 HB VAL A 813 2.493 5.453 2.813 1.00 0.00 H new ATOM 0 HG11 VAL A 813 1.065 5.143 4.797 1.00 0.00 H new ATOM 0 HG12 VAL A 813 2.794 5.286 5.195 1.00 0.00 H new ATOM 0 HG13 VAL A 813 1.701 6.665 5.466 1.00 0.00 H new ATOM 0 HG21 VAL A 813 0.130 6.185 2.819 1.00 0.00 H new ATOM 0 HG22 VAL A 813 0.659 7.823 3.271 1.00 0.00 H new ATOM 0 HG23 VAL A 813 1.149 7.130 1.707 1.00 0.00 H new ATOM 1738 N ASN A 814 2.499 9.459 3.796 1.00 0.00 N ATOM 1739 CA ASN A 814 2.092 10.587 4.590 1.00 0.00 C ATOM 1740 C ASN A 814 1.032 10.080 5.547 1.00 0.00 C ATOM 1741 O ASN A 814 0.153 9.320 5.126 1.00 0.00 O ATOM 1742 CB ASN A 814 1.490 11.670 3.660 1.00 0.00 C ATOM 1743 CG ASN A 814 1.151 13.010 4.323 1.00 0.00 C ATOM 1744 OD1 ASN A 814 0.756 13.084 5.477 1.00 0.00 O ATOM 1745 ND2 ASN A 814 1.322 14.079 3.584 1.00 0.00 N ATOM 0 H ASN A 814 2.167 9.488 2.832 1.00 0.00 H new ATOM 0 HA ASN A 814 2.930 11.024 5.132 1.00 0.00 H new ATOM 0 HB2 ASN A 814 2.194 11.856 2.849 1.00 0.00 H new ATOM 0 HB3 ASN A 814 0.582 11.270 3.209 1.00 0.00 H new ATOM 0 HD21 ASN A 814 1.124 15.002 3.969 1.00 0.00 H new ATOM 0 HD22 ASN A 814 1.653 13.987 2.624 1.00 0.00 H new ATOM 1752 N PRO A 815 1.111 10.436 6.846 1.00 0.00 N ATOM 1753 CA PRO A 815 0.093 10.060 7.843 1.00 0.00 C ATOM 1754 C PRO A 815 -1.315 10.514 7.430 1.00 0.00 C ATOM 1755 O PRO A 815 -2.321 9.999 7.925 1.00 0.00 O ATOM 1756 CB PRO A 815 0.534 10.816 9.102 1.00 0.00 C ATOM 1757 CG PRO A 815 2.000 10.993 8.937 1.00 0.00 C ATOM 1758 CD PRO A 815 2.228 11.184 7.468 1.00 0.00 C ATOM 0 HA PRO A 815 0.029 8.980 7.972 1.00 0.00 H new ATOM 0 HB2 PRO A 815 0.026 11.776 9.186 1.00 0.00 H new ATOM 0 HB3 PRO A 815 0.302 10.252 10.005 1.00 0.00 H new ATOM 0 HG2 PRO A 815 2.356 11.854 9.503 1.00 0.00 H new ATOM 0 HG3 PRO A 815 2.543 10.123 9.307 1.00 0.00 H new ATOM 0 HD2 PRO A 815 2.208 12.238 7.192 1.00 0.00 H new ATOM 0 HD3 PRO A 815 3.196 10.792 7.157 1.00 0.00 H new ATOM 1766 N ASN A 816 -1.383 11.457 6.514 1.00 0.00 N ATOM 1767 CA ASN A 816 -2.644 11.951 6.039 1.00 0.00 C ATOM 1768 C ASN A 816 -3.064 11.214 4.788 1.00 0.00 C ATOM 1769 O ASN A 816 -2.815 11.656 3.669 1.00 0.00 O ATOM 1770 CB ASN A 816 -2.627 13.468 5.815 1.00 0.00 C ATOM 1771 CG ASN A 816 -2.447 14.282 7.098 1.00 0.00 C ATOM 1772 OD1 ASN A 816 -2.990 13.817 8.200 1.00 0.00 O flip ATOM 1773 ND2 ASN A 816 -1.843 15.351 7.082 1.00 0.00 N flip ATOM 0 H ASN A 816 -0.568 11.896 6.085 1.00 0.00 H new ATOM 0 HA ASN A 816 -3.384 11.761 6.816 1.00 0.00 H new ATOM 0 HB2 ASN A 816 -1.821 13.714 5.124 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -3.560 13.765 5.336 1.00 0.00 H new ATOM 0 HD21 ASN A 816 -1.430 15.691 6.213 1.00 0.00 H new ATOM 0 HD22 ASN A 816 -1.754 15.899 7.937 1.00 0.00 H new ATOM 1780 N TYR A 817 -3.621 10.050 4.988 1.00 0.00 N ATOM 1781 CA TYR A 817 -4.096 9.218 3.904 1.00 0.00 C ATOM 1782 C TYR A 817 -5.630 9.153 3.927 1.00 0.00 C ATOM 1783 O TYR A 817 -6.259 9.321 4.987 1.00 0.00 O ATOM 1784 CB TYR A 817 -3.457 7.815 4.005 1.00 0.00 C ATOM 1785 CG TYR A 817 -3.826 6.846 2.890 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -3.333 7.012 1.597 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -4.652 5.755 3.139 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -3.662 6.117 0.588 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -4.982 4.865 2.138 1.00 0.00 C ATOM 1790 CZ TYR A 817 -4.484 5.051 0.866 1.00 0.00 C ATOM 1791 OH TYR A 817 -4.815 4.172 -0.129 1.00 0.00 O ATOM 0 H TYR A 817 -3.761 9.645 5.914 1.00 0.00 H new ATOM 0 HA TYR A 817 -3.800 9.650 2.948 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -2.373 7.929 4.020 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -3.744 7.371 4.958 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -2.686 7.848 1.377 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -5.042 5.602 4.134 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -3.274 6.258 -0.410 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -5.628 4.026 2.350 1.00 0.00 H new ATOM 0 HH TYR A 817 -5.402 3.475 0.232 1.00 0.00 H new