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 Single : A 718 SER OG : rot 180:sc= 0.00474 USER MOD Single : A 720 TYR OH : rot 180:sc= 0.616 USER MOD Single : A 721 SER OG : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot 161:sc= 0.0756 USER MOD Single : A 725 ASN :FLIP amide:sc= -0.0706 F(o=-0.77,f=-0.071) USER MOD Single : A 730 HIS : no HE2:sc= -1.13 K(o=-1.1,f=-2.5!) USER MOD Single : A 733 LYS NZ :NH3+ -138:sc= 1.15 (180deg=0.901) USER MOD Single : A 741 SER OG : rot 180:sc= -0.336 USER MOD Single : A 744 LYS NZ :NH3+ -158:sc= -0.113 (180deg=-0.593) 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) USER MOD Single : A 752 TYR OH : rot -110:sc= -0.537 USER MOD Single : A 754 LYS NZ :NH3+ 169:sc= -0.024 (180deg=-0.196) USER MOD Single : A 758 SER OG : rot 180:sc= 0 USER MOD Single : A 762 SER OG : rot 180:sc= -0.267 USER MOD Single : A 768 ASN : amide:sc= -2.37! C(o=-2.4!,f=-6.7!) USER MOD Single : A 769 LYS NZ :NH3+ -161:sc= 1.14 (180deg=0.557) USER MOD Single : A 770 LYS NZ :NH3+ -161:sc= 1.3 (180deg=1.13) 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 -6:sc= 0.91 USER MOD Single : A 782 HIS : no HD1:sc= 0 X(o=0,f=-0.0064) USER MOD Single : A 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 785 HIS : no HD1:sc= -0.0397 X(o=-0.04,f=-0.019) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 814 ASN : amide:sc= -0.663 K(o=-0.66,f=-1.4) USER MOD Single : A 816 ASN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 817 TYR OH : rot 180:sc=0.000319 USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -18.010 -0.025 3.122 1.00 0.00 N ATOM 138 CA PHE A 717 -16.767 -0.355 2.482 1.00 0.00 C ATOM 139 C PHE A 717 -15.841 -1.023 3.460 1.00 0.00 C ATOM 140 O PHE A 717 -14.846 -0.439 3.898 1.00 0.00 O ATOM 141 CB PHE A 717 -16.106 0.869 1.834 1.00 0.00 C ATOM 142 CG PHE A 717 -16.767 1.338 0.568 1.00 0.00 C ATOM 143 CD1 PHE A 717 -17.956 2.042 0.598 1.00 0.00 C ATOM 144 CD2 PHE A 717 -16.190 1.061 -0.661 1.00 0.00 C ATOM 145 CE1 PHE A 717 -18.553 2.461 -0.571 1.00 0.00 C ATOM 146 CE2 PHE A 717 -16.784 1.478 -1.831 1.00 0.00 C ATOM 147 CZ PHE A 717 -17.968 2.180 -1.787 1.00 0.00 C ATOM 0 HA PHE A 717 -16.984 -1.054 1.674 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -16.104 1.688 2.553 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -15.064 0.632 1.619 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -18.421 2.266 1.547 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -15.262 0.511 -0.702 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -19.482 3.011 -0.534 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -16.322 1.255 -2.782 1.00 0.00 H new ATOM 0 HZ PHE A 717 -18.437 2.509 -2.703 1.00 0.00 H new ATOM 157 N SER A 718 -16.198 -2.231 3.824 1.00 0.00 N ATOM 158 CA SER A 718 -15.449 -3.012 4.760 1.00 0.00 C ATOM 159 C SER A 718 -14.087 -3.334 4.164 1.00 0.00 C ATOM 160 O SER A 718 -13.053 -3.191 4.816 1.00 0.00 O ATOM 161 CB SER A 718 -16.223 -4.302 5.035 1.00 0.00 C ATOM 162 OG SER A 718 -17.600 -4.011 5.290 1.00 0.00 O ATOM 0 H SER A 718 -17.031 -2.700 3.469 1.00 0.00 H new ATOM 0 HA SER A 718 -15.305 -2.464 5.691 1.00 0.00 H new ATOM 0 HB2 SER A 718 -16.139 -4.974 4.181 1.00 0.00 H new ATOM 0 HB3 SER A 718 -15.789 -4.819 5.891 1.00 0.00 H new ATOM 0 HG SER A 718 -18.084 -4.845 5.463 1.00 0.00 H new ATOM 168 N GLU A 719 -14.096 -3.662 2.884 1.00 0.00 N ATOM 169 CA GLU A 719 -12.915 -4.099 2.200 1.00 0.00 C ATOM 170 C GLU A 719 -11.953 -2.964 1.970 1.00 0.00 C ATOM 171 O GLU A 719 -10.773 -3.091 2.277 1.00 0.00 O ATOM 172 CB GLU A 719 -13.230 -4.858 0.885 1.00 0.00 C ATOM 173 CG GLU A 719 -13.989 -4.075 -0.205 1.00 0.00 C ATOM 174 CD GLU A 719 -15.410 -3.759 0.143 1.00 0.00 C ATOM 175 OE1 GLU A 719 -15.662 -2.712 0.739 1.00 0.00 O ATOM 176 OE2 GLU A 719 -16.301 -4.562 -0.167 1.00 0.00 O ATOM 0 H GLU A 719 -14.930 -3.629 2.298 1.00 0.00 H new ATOM 0 HA GLU A 719 -12.426 -4.816 2.859 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -12.289 -5.206 0.460 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -13.814 -5.744 1.136 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -13.459 -3.143 -0.402 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -13.973 -4.653 -1.129 1.00 0.00 H new ATOM 183 N TYR A 720 -12.460 -1.848 1.494 1.00 0.00 N ATOM 184 CA TYR A 720 -11.611 -0.712 1.209 1.00 0.00 C ATOM 185 C TYR A 720 -11.013 -0.175 2.498 1.00 0.00 C ATOM 186 O TYR A 720 -9.833 0.165 2.542 1.00 0.00 O ATOM 187 CB TYR A 720 -12.387 0.373 0.475 1.00 0.00 C ATOM 188 CG TYR A 720 -11.545 1.550 0.037 1.00 0.00 C ATOM 189 CD1 TYR A 720 -10.897 1.547 -1.187 1.00 0.00 C ATOM 190 CD2 TYR A 720 -11.414 2.672 0.840 1.00 0.00 C ATOM 191 CE1 TYR A 720 -10.152 2.629 -1.598 1.00 0.00 C ATOM 192 CE2 TYR A 720 -10.666 3.753 0.438 1.00 0.00 C ATOM 193 CZ TYR A 720 -10.040 3.731 -0.782 1.00 0.00 C ATOM 194 OH TYR A 720 -9.314 4.823 -1.211 1.00 0.00 O ATOM 0 H TYR A 720 -13.450 -1.703 1.297 1.00 0.00 H new ATOM 0 HA TYR A 720 -10.799 -1.036 0.558 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -12.862 -0.066 -0.403 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -13.186 0.734 1.123 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -10.977 0.682 -1.829 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -11.909 2.698 1.800 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -9.657 2.613 -2.558 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -10.572 4.616 1.080 1.00 0.00 H new ATOM 0 HH TYR A 720 -9.331 5.519 -0.521 1.00 0.00 H new ATOM 204 N SER A 721 -11.820 -0.170 3.559 1.00 0.00 N ATOM 205 CA SER A 721 -11.373 0.303 4.842 1.00 0.00 C ATOM 206 C SER A 721 -10.216 -0.569 5.341 1.00 0.00 C ATOM 207 O SER A 721 -9.288 -0.063 5.918 1.00 0.00 O ATOM 208 CB SER A 721 -12.540 0.331 5.855 1.00 0.00 C ATOM 209 OG SER A 721 -12.183 0.992 7.070 1.00 0.00 O ATOM 0 H SER A 721 -12.788 -0.492 3.541 1.00 0.00 H new ATOM 0 HA SER A 721 -11.012 1.326 4.738 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.396 0.835 5.407 1.00 0.00 H new ATOM 0 HB3 SER A 721 -12.851 -0.690 6.076 1.00 0.00 H new ATOM 0 HG SER A 721 -12.949 0.989 7.681 1.00 0.00 H new ATOM 215 N ARG A 722 -10.262 -1.878 5.054 1.00 0.00 N ATOM 216 CA ARG A 722 -9.182 -2.790 5.449 1.00 0.00 C ATOM 217 C ARG A 722 -7.883 -2.471 4.711 1.00 0.00 C ATOM 218 O ARG A 722 -6.798 -2.523 5.309 1.00 0.00 O ATOM 219 CB ARG A 722 -9.566 -4.259 5.237 1.00 0.00 C ATOM 220 CG ARG A 722 -10.728 -4.739 6.080 1.00 0.00 C ATOM 221 CD ARG A 722 -10.437 -4.649 7.570 1.00 0.00 C ATOM 222 NE ARG A 722 -9.322 -5.515 7.978 1.00 0.00 N ATOM 223 CZ ARG A 722 -9.417 -6.490 8.894 1.00 0.00 C ATOM 224 NH1 ARG A 722 -10.580 -6.746 9.484 1.00 0.00 N ATOM 225 NH2 ARG A 722 -8.346 -7.202 9.217 1.00 0.00 N ATOM 0 H ARG A 722 -11.030 -2.325 4.553 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.019 -2.637 6.516 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -9.812 -4.408 4.186 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -8.698 -4.882 5.452 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -11.612 -4.145 5.848 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -10.961 -5.771 5.819 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -10.205 -3.616 7.830 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -11.331 -4.925 8.129 1.00 0.00 H new ATOM 0 HE ARG A 722 -8.416 -5.365 7.535 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -11.406 -6.200 9.241 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -10.646 -7.489 10.180 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -7.450 -7.008 8.769 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -8.418 -7.944 9.914 1.00 0.00 H new ATOM 239 N ILE A 723 -7.988 -2.140 3.427 1.00 0.00 N ATOM 240 CA ILE A 723 -6.802 -1.748 2.653 1.00 0.00 C ATOM 241 C ILE A 723 -6.190 -0.440 3.218 1.00 0.00 C ATOM 242 O ILE A 723 -4.979 -0.364 3.525 1.00 0.00 O ATOM 243 CB ILE A 723 -7.083 -1.605 1.104 1.00 0.00 C ATOM 244 CG1 ILE A 723 -7.123 -2.968 0.387 1.00 0.00 C ATOM 245 CG2 ILE A 723 -6.059 -0.706 0.419 1.00 0.00 C ATOM 246 CD1 ILE A 723 -8.268 -3.877 0.740 1.00 0.00 C ATOM 0 H ILE A 723 -8.863 -2.133 2.903 1.00 0.00 H new ATOM 0 HA ILE A 723 -6.083 -2.560 2.761 1.00 0.00 H new ATOM 0 HB ILE A 723 -8.067 -1.144 1.026 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -7.149 -2.788 -0.688 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -6.192 -3.493 0.600 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -6.290 -0.636 -0.644 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -6.092 0.288 0.864 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -5.062 -1.127 0.547 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -8.186 -4.803 0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -8.239 -4.102 1.806 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -9.210 -3.386 0.499 1.00 0.00 H new ATOM 258 N SER A 724 -7.025 0.565 3.379 1.00 0.00 N ATOM 259 CA SER A 724 -6.594 1.843 3.927 1.00 0.00 C ATOM 260 C SER A 724 -6.103 1.681 5.380 1.00 0.00 C ATOM 261 O SER A 724 -5.177 2.383 5.826 1.00 0.00 O ATOM 262 CB SER A 724 -7.737 2.844 3.828 1.00 0.00 C ATOM 263 OG SER A 724 -8.199 2.919 2.483 1.00 0.00 O ATOM 0 H SER A 724 -8.015 0.525 3.137 1.00 0.00 H new ATOM 0 HA SER A 724 -5.751 2.220 3.348 1.00 0.00 H new ATOM 0 HB2 SER A 724 -8.553 2.544 4.486 1.00 0.00 H new ATOM 0 HB3 SER A 724 -7.402 3.826 4.162 1.00 0.00 H new ATOM 0 HG SER A 724 -9.101 3.301 2.468 1.00 0.00 H new ATOM 269 N ASN A 725 -6.699 0.727 6.091 1.00 0.00 N ATOM 270 CA ASN A 725 -6.317 0.397 7.461 1.00 0.00 C ATOM 271 C ASN A 725 -4.907 -0.158 7.465 1.00 0.00 C ATOM 272 O ASN A 725 -4.125 0.153 8.351 1.00 0.00 O ATOM 273 CB ASN A 725 -7.281 -0.627 8.062 1.00 0.00 C ATOM 274 CG ASN A 725 -7.100 -0.863 9.553 1.00 0.00 C ATOM 275 OD1 ASN A 725 -6.809 0.168 10.305 1.00 0.00 O flip ATOM 276 ND2 ASN A 725 -7.305 -1.976 10.032 1.00 0.00 N flip ATOM 0 H ASN A 725 -7.465 0.158 5.730 1.00 0.00 H new ATOM 0 HA ASN A 725 -6.360 1.302 8.067 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -8.303 -0.295 7.881 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -7.156 -1.575 7.539 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -7.530 -2.761 9.421 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -7.250 -2.115 11.041 1.00 0.00 H new ATOM 283 N LEU A 726 -4.577 -0.966 6.443 1.00 0.00 N ATOM 284 CA LEU A 726 -3.222 -1.470 6.262 1.00 0.00 C ATOM 285 C LEU A 726 -2.252 -0.323 6.183 1.00 0.00 C ATOM 286 O LEU A 726 -1.233 -0.335 6.847 1.00 0.00 O ATOM 287 CB LEU A 726 -3.120 -2.413 5.012 1.00 0.00 C ATOM 288 CG LEU A 726 -1.716 -2.592 4.346 1.00 0.00 C ATOM 289 CD1 LEU A 726 -1.647 -3.891 3.607 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.451 -1.487 3.333 1.00 0.00 C ATOM 0 H LEU A 726 -5.238 -1.280 5.733 1.00 0.00 H new ATOM 0 HA LEU A 726 -2.959 -2.077 7.129 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -3.479 -3.399 5.306 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -3.806 -2.038 4.252 1.00 0.00 H new ATOM 0 HG LEU A 726 -0.977 -2.561 5.147 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -0.663 -3.998 3.150 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -1.816 -4.714 4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -2.411 -3.909 2.830 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.469 -1.633 2.884 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -2.214 -1.516 2.555 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.480 -0.519 3.834 1.00 0.00 H new ATOM 302 N ILE A 727 -2.608 0.680 5.401 1.00 0.00 N ATOM 303 CA ILE A 727 -1.756 1.839 5.205 1.00 0.00 C ATOM 304 C ILE A 727 -1.446 2.548 6.508 1.00 0.00 C ATOM 305 O ILE A 727 -0.271 2.755 6.845 1.00 0.00 O ATOM 306 CB ILE A 727 -2.325 2.813 4.124 1.00 0.00 C ATOM 307 CG1 ILE A 727 -2.102 2.233 2.724 1.00 0.00 C ATOM 308 CG2 ILE A 727 -1.729 4.214 4.231 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.628 2.049 2.377 1.00 0.00 C ATOM 0 H ILE A 727 -3.489 0.715 4.888 1.00 0.00 H new ATOM 0 HA ILE A 727 -0.807 1.467 4.820 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.395 2.913 4.305 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.608 1.270 2.652 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.562 2.892 1.987 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -2.157 4.852 3.458 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -1.955 4.632 5.212 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -0.648 4.161 4.100 1.00 0.00 H new ATOM 0 HD11 ILE A 727 -0.540 1.635 1.373 1.00 0.00 H new ATOM 0 HD12 ILE A 727 -0.121 3.013 2.418 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.168 1.367 3.092 1.00 0.00 H new ATOM 321 N VAL A 728 -2.464 2.866 7.257 1.00 0.00 N ATOM 322 CA VAL A 728 -2.251 3.553 8.502 1.00 0.00 C ATOM 323 C VAL A 728 -1.563 2.663 9.544 1.00 0.00 C ATOM 324 O VAL A 728 -0.624 3.100 10.187 1.00 0.00 O ATOM 325 CB VAL A 728 -3.521 4.249 9.065 1.00 0.00 C ATOM 326 CG1 VAL A 728 -3.903 5.434 8.191 1.00 0.00 C ATOM 327 CG2 VAL A 728 -4.688 3.284 9.147 1.00 0.00 C ATOM 0 H VAL A 728 -3.438 2.664 7.033 1.00 0.00 H new ATOM 0 HA VAL A 728 -1.563 4.365 8.268 1.00 0.00 H new ATOM 0 HB VAL A 728 -3.289 4.597 10.072 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -4.794 5.913 8.596 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -3.083 6.151 8.172 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -4.106 5.088 7.178 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -5.561 3.802 9.545 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.915 2.902 8.152 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -4.428 2.454 9.804 1.00 0.00 H new ATOM 337 N LEU A 729 -1.987 1.400 9.650 1.00 0.00 N ATOM 338 CA LEU A 729 -1.381 0.442 10.586 1.00 0.00 C ATOM 339 C LEU A 729 0.077 0.202 10.297 1.00 0.00 C ATOM 340 O LEU A 729 0.909 0.267 11.201 1.00 0.00 O ATOM 341 CB LEU A 729 -2.100 -0.890 10.550 1.00 0.00 C ATOM 342 CG LEU A 729 -3.410 -0.968 11.292 1.00 0.00 C ATOM 343 CD1 LEU A 729 -4.131 -2.226 10.877 1.00 0.00 C ATOM 344 CD2 LEU A 729 -3.153 -0.998 12.790 1.00 0.00 C ATOM 0 H LEU A 729 -2.752 1.014 9.097 1.00 0.00 H new ATOM 0 HA LEU A 729 -1.475 0.891 11.575 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -2.282 -1.151 9.508 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -1.432 -1.649 10.957 1.00 0.00 H new ATOM 0 HG LEU A 729 -4.019 -0.096 11.055 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -5.081 -2.293 11.408 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -4.316 -2.202 9.803 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -3.518 -3.094 11.120 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -4.103 -1.054 13.321 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -2.547 -1.869 13.038 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -2.625 -0.092 13.087 1.00 0.00 H new ATOM 356 N HIS A 730 0.383 -0.067 9.047 1.00 0.00 N ATOM 357 CA HIS A 730 1.730 -0.377 8.640 1.00 0.00 C ATOM 358 C HIS A 730 2.642 0.799 8.885 1.00 0.00 C ATOM 359 O HIS A 730 3.674 0.650 9.513 1.00 0.00 O ATOM 360 CB HIS A 730 1.779 -0.841 7.169 1.00 0.00 C ATOM 361 CG HIS A 730 3.150 -1.195 6.662 1.00 0.00 C ATOM 362 ND1 HIS A 730 3.772 -2.407 6.882 1.00 0.00 N ATOM 363 CD2 HIS A 730 4.018 -0.463 5.927 1.00 0.00 C ATOM 364 CE1 HIS A 730 4.959 -2.372 6.291 1.00 0.00 C ATOM 365 NE2 HIS A 730 5.162 -1.211 5.693 1.00 0.00 N ATOM 0 H HIS A 730 -0.297 -0.076 8.287 1.00 0.00 H new ATOM 0 HA HIS A 730 2.087 -1.208 9.248 1.00 0.00 H new ATOM 0 HB2 HIS A 730 1.130 -1.709 7.055 1.00 0.00 H new ATOM 0 HB3 HIS A 730 1.368 -0.051 6.540 1.00 0.00 H new ATOM 0 HD1 HIS A 730 3.387 -3.192 7.407 1.00 0.00 H new ATOM 0 HD2 HIS A 730 3.847 0.545 5.578 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.668 -3.187 6.298 1.00 0.00 H new ATOM 373 N LEU A 731 2.258 1.971 8.438 1.00 0.00 N ATOM 374 CA LEU A 731 3.124 3.103 8.637 1.00 0.00 C ATOM 375 C LEU A 731 3.220 3.473 10.141 1.00 0.00 C ATOM 376 O LEU A 731 4.317 3.763 10.634 1.00 0.00 O ATOM 377 CB LEU A 731 2.711 4.288 7.735 1.00 0.00 C ATOM 378 CG LEU A 731 3.791 5.367 7.423 1.00 0.00 C ATOM 379 CD1 LEU A 731 4.126 6.235 8.624 1.00 0.00 C ATOM 380 CD2 LEU A 731 5.061 4.710 6.883 1.00 0.00 C ATOM 0 H LEU A 731 1.382 2.161 7.951 1.00 0.00 H new ATOM 0 HA LEU A 731 4.133 2.830 8.328 1.00 0.00 H new ATOM 0 HB2 LEU A 731 2.358 3.882 6.787 1.00 0.00 H new ATOM 0 HB3 LEU A 731 1.863 4.787 8.203 1.00 0.00 H new ATOM 0 HG LEU A 731 3.364 6.023 6.664 1.00 0.00 H new ATOM 0 HD11 LEU A 731 4.884 6.967 8.344 1.00 0.00 H new ATOM 0 HD12 LEU A 731 3.228 6.753 8.960 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.507 5.609 9.431 1.00 0.00 H new ATOM 0 HD21 LEU A 731 5.805 5.477 6.670 1.00 0.00 H new ATOM 0 HD22 LEU A 731 5.456 4.017 7.626 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.828 4.166 5.967 1.00 0.00 H new ATOM 392 N ARG A 732 2.102 3.394 10.885 1.00 0.00 N ATOM 393 CA ARG A 732 2.138 3.754 12.311 1.00 0.00 C ATOM 394 C ARG A 732 2.960 2.767 13.127 1.00 0.00 C ATOM 395 O ARG A 732 3.523 3.140 14.154 1.00 0.00 O ATOM 396 CB ARG A 732 0.744 3.959 12.947 1.00 0.00 C ATOM 397 CG ARG A 732 -0.073 2.702 13.182 1.00 0.00 C ATOM 398 CD ARG A 732 -1.448 3.035 13.757 1.00 0.00 C ATOM 399 NE ARG A 732 -1.361 3.711 15.078 1.00 0.00 N ATOM 400 CZ ARG A 732 -2.367 4.397 15.665 1.00 0.00 C ATOM 401 NH1 ARG A 732 -3.544 4.498 15.068 1.00 0.00 N ATOM 402 NH2 ARG A 732 -2.187 4.972 16.847 1.00 0.00 N ATOM 0 H ARG A 732 1.191 3.094 10.536 1.00 0.00 H new ATOM 0 HA ARG A 732 2.631 4.726 12.339 1.00 0.00 H new ATOM 0 HB2 ARG A 732 0.874 4.467 13.902 1.00 0.00 H new ATOM 0 HB3 ARG A 732 0.169 4.627 12.306 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -0.190 2.161 12.243 1.00 0.00 H new ATOM 0 HG3 ARG A 732 0.460 2.042 13.866 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -1.985 3.676 13.058 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -2.028 2.118 13.859 1.00 0.00 H new ATOM 0 HE ARG A 732 -0.475 3.653 15.580 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -3.695 4.057 14.161 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -4.300 5.017 15.515 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -1.285 4.898 17.318 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -2.950 5.488 17.285 1.00 0.00 H new ATOM 416 N LYS A 733 3.009 1.505 12.705 1.00 0.00 N ATOM 417 CA LYS A 733 3.843 0.542 13.399 1.00 0.00 C ATOM 418 C LYS A 733 5.305 0.833 13.093 1.00 0.00 C ATOM 419 O LYS A 733 6.114 0.924 13.990 1.00 0.00 O ATOM 420 CB LYS A 733 3.451 -0.931 13.092 1.00 0.00 C ATOM 421 CG LYS A 733 3.705 -1.420 11.674 1.00 0.00 C ATOM 422 CD LYS A 733 3.118 -2.810 11.414 1.00 0.00 C ATOM 423 CE LYS A 733 3.723 -3.893 12.308 1.00 0.00 C ATOM 424 NZ LYS A 733 5.188 -3.999 12.158 1.00 0.00 N ATOM 0 H LYS A 733 2.493 1.137 11.906 1.00 0.00 H new ATOM 0 HA LYS A 733 3.680 0.655 14.471 1.00 0.00 H new ATOM 0 HB2 LYS A 733 3.995 -1.579 13.779 1.00 0.00 H new ATOM 0 HB3 LYS A 733 2.390 -1.054 13.310 1.00 0.00 H new ATOM 0 HG2 LYS A 733 3.275 -0.711 10.967 1.00 0.00 H new ATOM 0 HG3 LYS A 733 4.779 -1.443 11.489 1.00 0.00 H new ATOM 0 HD2 LYS A 733 2.040 -2.778 11.571 1.00 0.00 H new ATOM 0 HD3 LYS A 733 3.280 -3.077 10.370 1.00 0.00 H new ATOM 0 HE2 LYS A 733 3.483 -3.676 13.349 1.00 0.00 H new ATOM 0 HE3 LYS A 733 3.266 -4.853 12.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 5.463 -5.002 12.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 5.480 -3.540 11.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 5.654 -3.530 12.961 1.00 0.00 H new ATOM 438 N VAL A 734 5.590 1.069 11.820 1.00 0.00 N ATOM 439 CA VAL A 734 6.928 1.388 11.340 1.00 0.00 C ATOM 440 C VAL A 734 7.562 2.553 12.110 1.00 0.00 C ATOM 441 O VAL A 734 8.680 2.418 12.630 1.00 0.00 O ATOM 442 CB VAL A 734 6.911 1.691 9.814 1.00 0.00 C ATOM 443 CG1 VAL A 734 8.195 2.339 9.380 1.00 0.00 C ATOM 444 CG2 VAL A 734 6.707 0.411 9.026 1.00 0.00 C ATOM 0 H VAL A 734 4.888 1.044 11.080 1.00 0.00 H new ATOM 0 HA VAL A 734 7.546 0.508 11.519 1.00 0.00 H new ATOM 0 HB VAL A 734 6.086 2.376 9.619 1.00 0.00 H new ATOM 0 HG11 VAL A 734 8.157 2.540 8.309 1.00 0.00 H new ATOM 0 HG12 VAL A 734 8.331 3.276 9.921 1.00 0.00 H new ATOM 0 HG13 VAL A 734 9.030 1.672 9.595 1.00 0.00 H new ATOM 0 HG21 VAL A 734 6.697 0.638 7.960 1.00 0.00 H new ATOM 0 HG22 VAL A 734 7.520 -0.283 9.242 1.00 0.00 H new ATOM 0 HG23 VAL A 734 5.757 -0.043 9.309 1.00 0.00 H new ATOM 454 N GLU A 735 6.852 3.665 12.208 1.00 0.00 N ATOM 455 CA GLU A 735 7.372 4.845 12.901 1.00 0.00 C ATOM 456 C GLU A 735 7.536 4.587 14.407 1.00 0.00 C ATOM 457 O GLU A 735 8.446 5.116 15.051 1.00 0.00 O ATOM 458 CB GLU A 735 6.469 6.065 12.655 1.00 0.00 C ATOM 459 CG GLU A 735 5.018 5.840 13.034 1.00 0.00 C ATOM 460 CD GLU A 735 4.175 7.079 12.951 1.00 0.00 C ATOM 461 OE1 GLU A 735 3.663 7.405 11.865 1.00 0.00 O ATOM 462 OE2 GLU A 735 3.993 7.743 13.987 1.00 0.00 O ATOM 0 H GLU A 735 5.916 3.781 11.820 1.00 0.00 H new ATOM 0 HA GLU A 735 8.359 5.058 12.491 1.00 0.00 H new ATOM 0 HB2 GLU A 735 6.856 6.912 13.222 1.00 0.00 H new ATOM 0 HB3 GLU A 735 6.521 6.337 11.601 1.00 0.00 H new ATOM 0 HG2 GLU A 735 4.594 5.078 12.380 1.00 0.00 H new ATOM 0 HG3 GLU A 735 4.973 5.448 14.050 1.00 0.00 H new ATOM 469 N GLU A 736 6.680 3.749 14.940 1.00 0.00 N ATOM 470 CA GLU A 736 6.668 3.435 16.350 1.00 0.00 C ATOM 471 C GLU A 736 7.815 2.500 16.707 1.00 0.00 C ATOM 472 O GLU A 736 8.564 2.749 17.655 1.00 0.00 O ATOM 473 CB GLU A 736 5.335 2.782 16.694 1.00 0.00 C ATOM 474 CG GLU A 736 5.152 2.409 18.145 1.00 0.00 C ATOM 475 CD GLU A 736 3.835 1.730 18.377 1.00 0.00 C ATOM 476 OE1 GLU A 736 2.805 2.426 18.465 1.00 0.00 O ATOM 477 OE2 GLU A 736 3.800 0.489 18.460 1.00 0.00 O ATOM 0 H GLU A 736 5.964 3.260 14.402 1.00 0.00 H new ATOM 0 HA GLU A 736 6.794 4.353 16.924 1.00 0.00 H new ATOM 0 HB2 GLU A 736 4.532 3.461 16.407 1.00 0.00 H new ATOM 0 HB3 GLU A 736 5.223 1.883 16.088 1.00 0.00 H new ATOM 0 HG2 GLU A 736 5.962 1.750 18.457 1.00 0.00 H new ATOM 0 HG3 GLU A 736 5.214 3.305 18.763 1.00 0.00 H new ATOM 484 N GLU A 737 7.963 1.461 15.926 1.00 0.00 N ATOM 485 CA GLU A 737 8.941 0.428 16.178 1.00 0.00 C ATOM 486 C GLU A 737 10.344 0.918 15.856 1.00 0.00 C ATOM 487 O GLU A 737 11.258 0.781 16.672 1.00 0.00 O ATOM 488 CB GLU A 737 8.571 -0.827 15.390 1.00 0.00 C ATOM 489 CG GLU A 737 7.186 -1.358 15.774 1.00 0.00 C ATOM 490 CD GLU A 737 6.707 -2.503 14.924 1.00 0.00 C ATOM 491 OE1 GLU A 737 6.385 -2.293 13.749 1.00 0.00 O ATOM 492 OE2 GLU A 737 6.627 -3.645 15.426 1.00 0.00 O ATOM 0 H GLU A 737 7.403 1.304 15.088 1.00 0.00 H new ATOM 0 HA GLU A 737 8.937 0.175 17.238 1.00 0.00 H new ATOM 0 HB2 GLU A 737 8.591 -0.604 14.323 1.00 0.00 H new ATOM 0 HB3 GLU A 737 9.318 -1.600 15.568 1.00 0.00 H new ATOM 0 HG2 GLU A 737 7.208 -1.678 16.816 1.00 0.00 H new ATOM 0 HG3 GLU A 737 6.465 -0.543 15.706 1.00 0.00 H new ATOM 499 N GLU A 738 10.515 1.529 14.705 1.00 0.00 N ATOM 500 CA GLU A 738 11.807 2.053 14.356 1.00 0.00 C ATOM 501 C GLU A 738 11.744 3.534 13.953 1.00 0.00 C ATOM 502 O GLU A 738 12.088 4.403 14.766 1.00 0.00 O ATOM 503 CB GLU A 738 12.548 1.159 13.333 1.00 0.00 C ATOM 504 CG GLU A 738 11.820 0.868 12.040 1.00 0.00 C ATOM 505 CD GLU A 738 12.621 -0.033 11.146 1.00 0.00 C ATOM 506 OE1 GLU A 738 13.627 0.412 10.592 1.00 0.00 O ATOM 507 OE2 GLU A 738 12.249 -1.209 10.981 1.00 0.00 O ATOM 0 H GLU A 738 9.785 1.672 14.007 1.00 0.00 H new ATOM 0 HA GLU A 738 12.418 2.024 15.258 1.00 0.00 H new ATOM 0 HB2 GLU A 738 13.498 1.634 13.090 1.00 0.00 H new ATOM 0 HB3 GLU A 738 12.780 0.209 13.815 1.00 0.00 H new ATOM 0 HG2 GLU A 738 10.859 0.403 12.260 1.00 0.00 H new ATOM 0 HG3 GLU A 738 11.610 1.803 11.521 1.00 0.00 H new ATOM 514 N ASP A 739 11.220 3.812 12.758 1.00 0.00 N ATOM 515 CA ASP A 739 11.152 5.174 12.179 1.00 0.00 C ATOM 516 C ASP A 739 10.684 5.090 10.734 1.00 0.00 C ATOM 517 O ASP A 739 9.624 5.602 10.382 1.00 0.00 O ATOM 518 CB ASP A 739 12.518 5.897 12.218 1.00 0.00 C ATOM 519 CG ASP A 739 12.439 7.338 11.741 1.00 0.00 C ATOM 520 OD1 ASP A 739 11.651 8.119 12.311 1.00 0.00 O ATOM 521 OD2 ASP A 739 13.177 7.721 10.814 1.00 0.00 O ATOM 0 H ASP A 739 10.823 3.096 12.150 1.00 0.00 H new ATOM 0 HA ASP A 739 10.449 5.747 12.783 1.00 0.00 H new ATOM 0 HB2 ASP A 739 12.905 5.878 13.237 1.00 0.00 H new ATOM 0 HB3 ASP A 739 13.229 5.353 11.597 1.00 0.00 H new ATOM 526 N GLU A 740 11.473 4.419 9.904 1.00 0.00 N ATOM 527 CA GLU A 740 11.145 4.232 8.500 1.00 0.00 C ATOM 528 C GLU A 740 11.785 2.957 7.932 1.00 0.00 C ATOM 529 O GLU A 740 12.936 2.955 7.470 1.00 0.00 O ATOM 530 CB GLU A 740 11.501 5.467 7.651 1.00 0.00 C ATOM 531 CG GLU A 740 12.926 5.962 7.839 1.00 0.00 C ATOM 532 CD GLU A 740 13.306 7.026 6.853 1.00 0.00 C ATOM 533 OE1 GLU A 740 13.105 8.228 7.142 1.00 0.00 O ATOM 534 OE2 GLU A 740 13.828 6.689 5.767 1.00 0.00 O ATOM 0 H GLU A 740 12.355 3.991 10.186 1.00 0.00 H new ATOM 0 HA GLU A 740 10.063 4.108 8.445 1.00 0.00 H new ATOM 0 HB2 GLU A 740 11.347 5.227 6.599 1.00 0.00 H new ATOM 0 HB3 GLU A 740 10.812 6.275 7.898 1.00 0.00 H new ATOM 0 HG2 GLU A 740 13.040 6.353 8.850 1.00 0.00 H new ATOM 0 HG3 GLU A 740 13.613 5.122 7.743 1.00 0.00 H new ATOM 541 N SER A 741 11.065 1.873 8.048 1.00 0.00 N ATOM 542 CA SER A 741 11.483 0.590 7.534 1.00 0.00 C ATOM 543 C SER A 741 11.553 0.636 6.008 1.00 0.00 C ATOM 544 O SER A 741 12.583 0.313 5.423 1.00 0.00 O ATOM 545 CB SER A 741 10.448 -0.446 7.942 1.00 0.00 C ATOM 546 OG SER A 741 10.187 -0.401 9.331 1.00 0.00 O ATOM 0 H SER A 741 10.156 1.853 8.510 1.00 0.00 H new ATOM 0 HA SER A 741 12.466 0.338 7.932 1.00 0.00 H new ATOM 0 HB2 SER A 741 9.523 -0.274 7.392 1.00 0.00 H new ATOM 0 HB3 SER A 741 10.801 -1.441 7.669 1.00 0.00 H new ATOM 0 HG SER A 741 9.517 -1.078 9.560 1.00 0.00 H new ATOM 552 N ALA A 742 10.437 1.095 5.398 1.00 0.00 N ATOM 553 CA ALA A 742 10.246 1.137 3.946 1.00 0.00 C ATOM 554 C ALA A 742 10.260 -0.281 3.343 1.00 0.00 C ATOM 555 O ALA A 742 11.303 -0.940 3.258 1.00 0.00 O ATOM 556 CB ALA A 742 11.242 2.075 3.268 1.00 0.00 C ATOM 0 H ALA A 742 9.635 1.451 5.918 1.00 0.00 H new ATOM 0 HA ALA A 742 9.258 1.554 3.752 1.00 0.00 H new ATOM 0 HB1 ALA A 742 11.066 2.077 2.192 1.00 0.00 H new ATOM 0 HB2 ALA A 742 11.115 3.085 3.658 1.00 0.00 H new ATOM 0 HB3 ALA A 742 12.258 1.734 3.469 1.00 0.00 H new ATOM 562 N LEU A 743 9.100 -0.748 2.946 1.00 0.00 N ATOM 563 CA LEU A 743 8.952 -2.114 2.466 1.00 0.00 C ATOM 564 C LEU A 743 8.680 -2.159 0.989 1.00 0.00 C ATOM 565 O LEU A 743 8.484 -1.146 0.364 1.00 0.00 O ATOM 566 CB LEU A 743 7.878 -2.903 3.245 1.00 0.00 C ATOM 567 CG LEU A 743 8.245 -3.389 4.662 1.00 0.00 C ATOM 568 CD1 LEU A 743 9.487 -4.252 4.631 1.00 0.00 C ATOM 569 CD2 LEU A 743 8.424 -2.241 5.637 1.00 0.00 C ATOM 0 H LEU A 743 8.237 -0.204 2.944 1.00 0.00 H new ATOM 0 HA LEU A 743 9.908 -2.604 2.649 1.00 0.00 H new ATOM 0 HB2 LEU A 743 6.990 -2.276 3.323 1.00 0.00 H new ATOM 0 HB3 LEU A 743 7.602 -3.774 2.651 1.00 0.00 H new ATOM 0 HG LEU A 743 7.407 -3.989 5.016 1.00 0.00 H new ATOM 0 HD11 LEU A 743 9.726 -4.583 5.642 1.00 0.00 H new ATOM 0 HD12 LEU A 743 9.310 -5.121 3.997 1.00 0.00 H new ATOM 0 HD13 LEU A 743 10.321 -3.675 4.231 1.00 0.00 H new ATOM 0 HD21 LEU A 743 8.681 -2.635 6.620 1.00 0.00 H new ATOM 0 HD22 LEU A 743 9.224 -1.588 5.287 1.00 0.00 H new ATOM 0 HD23 LEU A 743 7.496 -1.674 5.705 1.00 0.00 H new ATOM 581 N LYS A 744 8.663 -3.334 0.450 1.00 0.00 N ATOM 582 CA LYS A 744 8.486 -3.519 -0.964 1.00 0.00 C ATOM 583 C LYS A 744 7.003 -3.504 -1.339 1.00 0.00 C ATOM 584 O LYS A 744 6.155 -3.957 -0.561 1.00 0.00 O ATOM 585 CB LYS A 744 9.180 -4.801 -1.381 1.00 0.00 C ATOM 586 CG LYS A 744 10.682 -4.750 -1.158 1.00 0.00 C ATOM 587 CD LYS A 744 11.344 -6.077 -1.459 1.00 0.00 C ATOM 588 CE LYS A 744 12.853 -5.935 -1.487 1.00 0.00 C ATOM 589 NZ LYS A 744 13.304 -5.041 -2.582 1.00 0.00 N ATOM 0 H LYS A 744 8.772 -4.201 0.976 1.00 0.00 H new ATOM 0 HA LYS A 744 8.941 -2.691 -1.507 1.00 0.00 H new ATOM 0 HB2 LYS A 744 8.761 -5.636 -0.820 1.00 0.00 H new ATOM 0 HB3 LYS A 744 8.979 -4.993 -2.435 1.00 0.00 H new ATOM 0 HG2 LYS A 744 11.117 -3.976 -1.791 1.00 0.00 H new ATOM 0 HG3 LYS A 744 10.886 -4.469 -0.125 1.00 0.00 H new ATOM 0 HD2 LYS A 744 11.058 -6.810 -0.705 1.00 0.00 H new ATOM 0 HD3 LYS A 744 10.992 -6.454 -2.419 1.00 0.00 H new ATOM 0 HE2 LYS A 744 13.198 -5.541 -0.531 1.00 0.00 H new ATOM 0 HE3 LYS A 744 13.308 -6.918 -1.610 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 14.297 -5.249 -2.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 12.713 -5.197 -3.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 13.219 -4.050 -2.278 1.00 0.00 H new ATOM 603 N ARG A 745 6.709 -2.996 -2.532 1.00 0.00 N ATOM 604 CA ARG A 745 5.333 -2.787 -3.010 1.00 0.00 C ATOM 605 C ARG A 745 4.531 -4.087 -3.055 1.00 0.00 C ATOM 606 O ARG A 745 3.444 -4.173 -2.482 1.00 0.00 O ATOM 607 CB ARG A 745 5.327 -2.130 -4.399 1.00 0.00 C ATOM 608 CG ARG A 745 6.009 -0.769 -4.471 1.00 0.00 C ATOM 609 CD ARG A 745 6.005 -0.233 -5.895 1.00 0.00 C ATOM 610 NE ARG A 745 6.790 1.011 -6.045 1.00 0.00 N ATOM 611 CZ ARG A 745 6.655 1.889 -7.065 1.00 0.00 C ATOM 612 NH1 ARG A 745 5.685 1.724 -7.969 1.00 0.00 N ATOM 613 NH2 ARG A 745 7.477 2.929 -7.172 1.00 0.00 N ATOM 0 H ARG A 745 7.421 -2.713 -3.205 1.00 0.00 H new ATOM 0 HA ARG A 745 4.854 -2.121 -2.293 1.00 0.00 H new ATOM 0 HB2 ARG A 745 5.816 -2.802 -5.104 1.00 0.00 H new ATOM 0 HB3 ARG A 745 4.294 -2.020 -4.728 1.00 0.00 H new ATOM 0 HG2 ARG A 745 5.498 -0.067 -3.813 1.00 0.00 H new ATOM 0 HG3 ARG A 745 7.035 -0.853 -4.113 1.00 0.00 H new ATOM 0 HD2 ARG A 745 6.407 -0.993 -6.565 1.00 0.00 H new ATOM 0 HD3 ARG A 745 4.977 -0.047 -6.205 1.00 0.00 H new ATOM 0 HE ARG A 745 7.483 1.222 -5.327 1.00 0.00 H new ATOM 0 HH11 ARG A 745 5.044 0.934 -7.891 1.00 0.00 H new ATOM 0 HH12 ARG A 745 5.585 2.388 -8.737 1.00 0.00 H new ATOM 0 HH21 ARG A 745 8.215 3.069 -6.482 1.00 0.00 H new ATOM 0 HH22 ARG A 745 7.369 3.587 -7.944 1.00 0.00 H new ATOM 627 N SER A 746 5.075 -5.094 -3.700 1.00 0.00 N ATOM 628 CA SER A 746 4.389 -6.357 -3.830 1.00 0.00 C ATOM 629 C SER A 746 4.391 -7.085 -2.485 1.00 0.00 C ATOM 630 O SER A 746 3.433 -7.760 -2.140 1.00 0.00 O ATOM 631 CB SER A 746 5.029 -7.208 -4.946 1.00 0.00 C ATOM 632 OG SER A 746 4.270 -8.378 -5.227 1.00 0.00 O ATOM 0 H SER A 746 5.993 -5.062 -4.143 1.00 0.00 H new ATOM 0 HA SER A 746 3.352 -6.180 -4.116 1.00 0.00 H new ATOM 0 HB2 SER A 746 5.120 -6.609 -5.852 1.00 0.00 H new ATOM 0 HB3 SER A 746 6.039 -7.493 -4.650 1.00 0.00 H new ATOM 0 HG SER A 746 4.708 -8.889 -5.940 1.00 0.00 H new ATOM 638 N GLU A 747 5.454 -6.888 -1.707 1.00 0.00 N ATOM 639 CA GLU A 747 5.586 -7.490 -0.387 1.00 0.00 C ATOM 640 C GLU A 747 4.495 -6.961 0.556 1.00 0.00 C ATOM 641 O GLU A 747 4.003 -7.690 1.412 1.00 0.00 O ATOM 642 CB GLU A 747 6.980 -7.226 0.175 1.00 0.00 C ATOM 643 CG GLU A 747 7.301 -7.976 1.449 1.00 0.00 C ATOM 644 CD GLU A 747 8.718 -7.749 1.894 1.00 0.00 C ATOM 645 OE1 GLU A 747 9.636 -8.412 1.355 1.00 0.00 O ATOM 646 OE2 GLU A 747 8.937 -6.933 2.806 1.00 0.00 O ATOM 0 H GLU A 747 6.247 -6.306 -1.977 1.00 0.00 H new ATOM 0 HA GLU A 747 5.456 -8.569 -0.475 1.00 0.00 H new ATOM 0 HB2 GLU A 747 7.718 -7.491 -0.582 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.085 -6.157 0.362 1.00 0.00 H new ATOM 0 HG2 GLU A 747 6.618 -7.660 2.238 1.00 0.00 H new ATOM 0 HG3 GLU A 747 7.136 -9.042 1.293 1.00 0.00 H new ATOM 653 N LEU A 748 4.113 -5.703 0.363 1.00 0.00 N ATOM 654 CA LEU A 748 3.029 -5.079 1.117 1.00 0.00 C ATOM 655 C LEU A 748 1.729 -5.869 0.888 1.00 0.00 C ATOM 656 O LEU A 748 1.028 -6.245 1.839 1.00 0.00 O ATOM 657 CB LEU A 748 2.862 -3.613 0.671 1.00 0.00 C ATOM 658 CG LEU A 748 1.841 -2.756 1.435 1.00 0.00 C ATOM 659 CD1 LEU A 748 2.245 -2.604 2.891 1.00 0.00 C ATOM 660 CD2 LEU A 748 1.703 -1.392 0.781 1.00 0.00 C ATOM 0 H LEU A 748 4.547 -5.085 -0.322 1.00 0.00 H new ATOM 0 HA LEU A 748 3.264 -5.090 2.181 1.00 0.00 H new ATOM 0 HB2 LEU A 748 3.834 -3.125 0.745 1.00 0.00 H new ATOM 0 HB3 LEU A 748 2.583 -3.611 -0.383 1.00 0.00 H new ATOM 0 HG LEU A 748 0.876 -3.262 1.399 1.00 0.00 H new ATOM 0 HD11 LEU A 748 1.507 -1.993 3.411 1.00 0.00 H new ATOM 0 HD12 LEU A 748 2.297 -3.587 3.359 1.00 0.00 H new ATOM 0 HD13 LEU A 748 3.221 -2.122 2.949 1.00 0.00 H new ATOM 0 HD21 LEU A 748 0.976 -0.796 1.333 1.00 0.00 H new ATOM 0 HD22 LEU A 748 2.668 -0.886 0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 748 1.365 -1.514 -0.248 1.00 0.00 H new ATOM 672 N VAL A 749 1.447 -6.163 -0.379 1.00 0.00 N ATOM 673 CA VAL A 749 0.277 -6.954 -0.749 1.00 0.00 C ATOM 674 C VAL A 749 0.444 -8.359 -0.204 1.00 0.00 C ATOM 675 O VAL A 749 -0.475 -8.942 0.357 1.00 0.00 O ATOM 676 CB VAL A 749 0.122 -7.077 -2.284 1.00 0.00 C ATOM 677 CG1 VAL A 749 -1.140 -7.845 -2.639 1.00 0.00 C ATOM 678 CG2 VAL A 749 0.133 -5.728 -2.959 1.00 0.00 C ATOM 0 H VAL A 749 2.017 -5.863 -1.170 1.00 0.00 H new ATOM 0 HA VAL A 749 -0.600 -6.452 -0.340 1.00 0.00 H new ATOM 0 HB VAL A 749 0.983 -7.634 -2.654 1.00 0.00 H new ATOM 0 HG11 VAL A 749 -1.228 -7.919 -3.723 1.00 0.00 H new ATOM 0 HG12 VAL A 749 -1.090 -8.846 -2.210 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -2.009 -7.322 -2.239 1.00 0.00 H new ATOM 0 HG21 VAL A 749 0.022 -5.859 -4.035 1.00 0.00 H new ATOM 0 HG22 VAL A 749 -0.692 -5.125 -2.580 1.00 0.00 H new ATOM 0 HG23 VAL A 749 1.077 -5.224 -2.750 1.00 0.00 H new ATOM 688 N ASN A 750 1.646 -8.853 -0.360 1.00 0.00 N ATOM 689 CA ASN A 750 2.047 -10.191 0.030 1.00 0.00 C ATOM 690 C ASN A 750 1.711 -10.476 1.481 1.00 0.00 C ATOM 691 O ASN A 750 1.008 -11.445 1.775 1.00 0.00 O ATOM 692 CB ASN A 750 3.545 -10.380 -0.222 1.00 0.00 C ATOM 693 CG ASN A 750 4.041 -11.761 0.123 1.00 0.00 C ATOM 694 OD1 ASN A 750 3.966 -12.674 -0.692 1.00 0.00 O ATOM 695 ND2 ASN A 750 4.597 -11.916 1.296 1.00 0.00 N ATOM 0 H ASN A 750 2.406 -8.317 -0.778 1.00 0.00 H new ATOM 0 HA ASN A 750 1.488 -10.902 -0.579 1.00 0.00 H new ATOM 0 HB2 ASN A 750 3.758 -10.177 -1.272 1.00 0.00 H new ATOM 0 HB3 ASN A 750 4.100 -9.646 0.363 1.00 0.00 H new ATOM 0 HD21 ASN A 750 4.987 -12.821 1.560 1.00 0.00 H new ATOM 0 HD22 ASN A 750 4.640 -11.132 1.947 1.00 0.00 H new ATOM 702 N TRP A 751 2.169 -9.622 2.398 1.00 0.00 N ATOM 703 CA TRP A 751 1.875 -9.864 3.792 1.00 0.00 C ATOM 704 C TRP A 751 0.406 -9.622 4.074 1.00 0.00 C ATOM 705 O TRP A 751 -0.179 -10.292 4.910 1.00 0.00 O ATOM 706 CB TRP A 751 2.802 -9.093 4.788 1.00 0.00 C ATOM 707 CG TRP A 751 2.659 -7.591 4.862 1.00 0.00 C ATOM 708 CD1 TRP A 751 3.476 -6.662 4.299 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.656 -6.850 5.588 1.00 0.00 C ATOM 710 NE1 TRP A 751 3.038 -5.400 4.609 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.921 -5.491 5.396 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.559 -7.216 6.371 1.00 0.00 C ATOM 713 CZ2 TRP A 751 1.121 -4.491 5.953 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.229 -6.230 6.920 1.00 0.00 C ATOM 715 CH2 TRP A 751 0.055 -4.884 6.712 1.00 0.00 C ATOM 0 H TRP A 751 2.724 -8.789 2.202 1.00 0.00 H new ATOM 0 HA TRP A 751 2.097 -10.916 3.974 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.630 -9.496 5.786 1.00 0.00 H new ATOM 0 HB3 TRP A 751 3.836 -9.319 4.527 1.00 0.00 H new ATOM 0 HD1 TRP A 751 4.343 -6.885 3.696 1.00 0.00 H new ATOM 0 HE1 TRP A 751 3.475 -4.531 4.302 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.332 -8.258 6.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 1.337 -3.445 5.790 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.082 -6.506 7.522 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -0.580 -4.134 7.160 1.00 0.00 H new ATOM 726 N TYR A 752 -0.205 -8.701 3.311 1.00 0.00 N ATOM 727 CA TYR A 752 -1.612 -8.361 3.490 1.00 0.00 C ATOM 728 C TYR A 752 -2.470 -9.593 3.277 1.00 0.00 C ATOM 729 O TYR A 752 -3.319 -9.934 4.116 1.00 0.00 O ATOM 730 CB TYR A 752 -2.038 -7.251 2.514 1.00 0.00 C ATOM 731 CG TYR A 752 -3.457 -6.761 2.739 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.864 -6.351 4.005 1.00 0.00 C ATOM 733 CD2 TYR A 752 -4.400 -6.725 1.705 1.00 0.00 C ATOM 734 CE1 TYR A 752 -5.141 -5.919 4.237 1.00 0.00 C ATOM 735 CE2 TYR A 752 -5.681 -6.297 1.943 1.00 0.00 C ATOM 736 CZ TYR A 752 -6.044 -5.894 3.212 1.00 0.00 C ATOM 737 OH TYR A 752 -7.324 -5.482 3.453 1.00 0.00 O ATOM 0 H TYR A 752 0.260 -8.182 2.566 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.750 -7.994 4.507 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -1.352 -6.410 2.610 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.947 -7.621 1.493 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -3.157 -6.374 4.821 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -4.116 -7.037 0.711 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.434 -5.599 5.226 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -6.403 -6.275 1.140 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.932 -6.248 3.388 1.00 0.00 H new ATOM 747 N LEU A 753 -2.202 -10.271 2.180 1.00 0.00 N ATOM 748 CA LEU A 753 -2.904 -11.476 1.806 1.00 0.00 C ATOM 749 C LEU A 753 -2.702 -12.540 2.865 1.00 0.00 C ATOM 750 O LEU A 753 -3.650 -13.131 3.327 1.00 0.00 O ATOM 751 CB LEU A 753 -2.393 -11.979 0.464 1.00 0.00 C ATOM 752 CG LEU A 753 -2.452 -10.980 -0.693 1.00 0.00 C ATOM 753 CD1 LEU A 753 -1.790 -11.559 -1.917 1.00 0.00 C ATOM 754 CD2 LEU A 753 -3.886 -10.547 -0.995 1.00 0.00 C ATOM 0 H LEU A 753 -1.480 -9.994 1.515 1.00 0.00 H new ATOM 0 HA LEU A 753 -3.968 -11.255 1.721 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -1.359 -12.300 0.589 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -2.969 -12.861 0.186 1.00 0.00 H new ATOM 0 HG LEU A 753 -1.906 -10.086 -0.392 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -1.839 -10.838 -2.733 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -0.747 -11.785 -1.694 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -2.304 -12.474 -2.210 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -3.885 -9.838 -1.823 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -4.480 -11.420 -1.266 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -4.317 -10.074 -0.112 1.00 0.00 H new ATOM 766 N LYS A 754 -1.459 -12.718 3.283 1.00 0.00 N ATOM 767 CA LYS A 754 -1.094 -13.714 4.309 1.00 0.00 C ATOM 768 C LYS A 754 -1.767 -13.458 5.672 1.00 0.00 C ATOM 769 O LYS A 754 -1.928 -14.378 6.486 1.00 0.00 O ATOM 770 CB LYS A 754 0.431 -13.799 4.476 1.00 0.00 C ATOM 771 CG LYS A 754 1.145 -14.811 3.567 1.00 0.00 C ATOM 772 CD LYS A 754 0.929 -14.557 2.087 1.00 0.00 C ATOM 773 CE LYS A 754 1.680 -15.569 1.238 1.00 0.00 C ATOM 774 NZ LYS A 754 1.229 -16.964 1.479 1.00 0.00 N ATOM 0 H LYS A 754 -0.667 -12.183 2.928 1.00 0.00 H new ATOM 0 HA LYS A 754 -1.470 -14.671 3.946 1.00 0.00 H new ATOM 0 HB2 LYS A 754 0.854 -12.811 4.292 1.00 0.00 H new ATOM 0 HB3 LYS A 754 0.651 -14.052 5.513 1.00 0.00 H new ATOM 0 HG2 LYS A 754 2.214 -14.786 3.779 1.00 0.00 H new ATOM 0 HG3 LYS A 754 0.795 -15.814 3.810 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -0.136 -14.606 1.859 1.00 0.00 H new ATOM 0 HD3 LYS A 754 1.262 -13.550 1.836 1.00 0.00 H new ATOM 0 HE2 LYS A 754 1.546 -15.325 0.184 1.00 0.00 H new ATOM 0 HE3 LYS A 754 2.747 -15.494 1.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 1.632 -17.590 0.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 1.548 -17.274 2.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 0.191 -17.006 1.434 1.00 0.00 H new ATOM 788 N GLU A 755 -2.144 -12.232 5.916 1.00 0.00 N ATOM 789 CA GLU A 755 -2.806 -11.863 7.160 1.00 0.00 C ATOM 790 C GLU A 755 -4.284 -12.154 7.081 1.00 0.00 C ATOM 791 O GLU A 755 -4.856 -12.846 7.924 1.00 0.00 O ATOM 792 CB GLU A 755 -2.620 -10.374 7.462 1.00 0.00 C ATOM 793 CG GLU A 755 -1.209 -9.948 7.802 1.00 0.00 C ATOM 794 CD GLU A 755 -0.710 -10.565 9.069 1.00 0.00 C ATOM 795 OE1 GLU A 755 -1.164 -10.145 10.168 1.00 0.00 O ATOM 796 OE2 GLU A 755 0.140 -11.479 9.005 1.00 0.00 O ATOM 0 H GLU A 755 -2.007 -11.456 5.268 1.00 0.00 H new ATOM 0 HA GLU A 755 -2.353 -12.454 7.956 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -2.955 -9.801 6.597 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -3.272 -10.106 8.294 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -0.544 -10.221 6.983 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -1.173 -8.862 7.893 1.00 0.00 H new ATOM 803 N ILE A 756 -4.898 -11.640 6.052 1.00 0.00 N ATOM 804 CA ILE A 756 -6.328 -11.723 5.920 1.00 0.00 C ATOM 805 C ILE A 756 -6.787 -13.060 5.375 1.00 0.00 C ATOM 806 O ILE A 756 -7.950 -13.380 5.482 1.00 0.00 O ATOM 807 CB ILE A 756 -6.899 -10.587 5.039 1.00 0.00 C ATOM 808 CG1 ILE A 756 -6.310 -10.666 3.619 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.622 -9.226 5.684 1.00 0.00 C ATOM 810 CD1 ILE A 756 -6.816 -9.612 2.673 1.00 0.00 C ATOM 0 H ILE A 756 -4.428 -11.156 5.287 1.00 0.00 H new ATOM 0 HA ILE A 756 -6.717 -11.614 6.932 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.980 -10.706 4.960 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -5.225 -10.586 3.685 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -6.533 -11.648 3.201 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -7.029 -8.435 5.054 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -7.093 -9.186 6.666 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.546 -9.087 5.792 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -6.348 -9.744 1.697 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -7.898 -9.703 2.572 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -6.569 -8.624 3.063 1.00 0.00 H new ATOM 822 N GLU A 757 -5.873 -13.854 4.821 1.00 0.00 N ATOM 823 CA GLU A 757 -6.247 -15.128 4.196 1.00 0.00 C ATOM 824 C GLU A 757 -6.969 -16.060 5.163 1.00 0.00 C ATOM 825 O GLU A 757 -7.860 -16.797 4.771 1.00 0.00 O ATOM 826 CB GLU A 757 -5.054 -15.835 3.555 1.00 0.00 C ATOM 827 CG GLU A 757 -4.024 -16.393 4.515 1.00 0.00 C ATOM 828 CD GLU A 757 -3.002 -17.202 3.786 1.00 0.00 C ATOM 829 OE1 GLU A 757 -3.331 -18.301 3.324 1.00 0.00 O ATOM 830 OE2 GLU A 757 -1.853 -16.756 3.631 1.00 0.00 O ATOM 0 H GLU A 757 -4.875 -13.643 4.790 1.00 0.00 H new ATOM 0 HA GLU A 757 -6.946 -14.872 3.400 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -5.429 -16.652 2.938 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -4.556 -15.133 2.886 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -3.536 -15.576 5.047 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -4.517 -17.012 5.265 1.00 0.00 H new ATOM 837 N SER A 758 -6.639 -15.952 6.424 1.00 0.00 N ATOM 838 CA SER A 758 -7.214 -16.786 7.444 1.00 0.00 C ATOM 839 C SER A 758 -8.662 -16.362 7.818 1.00 0.00 C ATOM 840 O SER A 758 -9.333 -17.031 8.617 1.00 0.00 O ATOM 841 CB SER A 758 -6.281 -16.783 8.631 1.00 0.00 C ATOM 842 OG SER A 758 -4.976 -17.161 8.204 1.00 0.00 O ATOM 0 H SER A 758 -5.958 -15.277 6.773 1.00 0.00 H new ATOM 0 HA SER A 758 -7.317 -17.803 7.066 1.00 0.00 H new ATOM 0 HB2 SER A 758 -6.255 -15.793 9.085 1.00 0.00 H new ATOM 0 HB3 SER A 758 -6.641 -17.474 9.393 1.00 0.00 H new ATOM 0 HG SER A 758 -4.367 -17.158 8.972 1.00 0.00 H new ATOM 848 N GLU A 759 -9.134 -15.265 7.238 1.00 0.00 N ATOM 849 CA GLU A 759 -10.515 -14.832 7.408 1.00 0.00 C ATOM 850 C GLU A 759 -11.182 -14.715 6.031 1.00 0.00 C ATOM 851 O GLU A 759 -12.320 -14.262 5.898 1.00 0.00 O ATOM 852 CB GLU A 759 -10.608 -13.503 8.193 1.00 0.00 C ATOM 853 CG GLU A 759 -9.864 -12.342 7.561 1.00 0.00 C ATOM 854 CD GLU A 759 -10.012 -11.060 8.323 1.00 0.00 C ATOM 855 OE1 GLU A 759 -9.275 -10.855 9.307 1.00 0.00 O ATOM 856 OE2 GLU A 759 -10.843 -10.223 7.936 1.00 0.00 O ATOM 0 H GLU A 759 -8.575 -14.655 6.641 1.00 0.00 H new ATOM 0 HA GLU A 759 -11.044 -15.579 8.000 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -11.658 -13.231 8.297 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -10.219 -13.662 9.199 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -8.806 -12.594 7.488 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.228 -12.196 6.544 1.00 0.00 H new ATOM 863 N ILE A 760 -10.462 -15.151 5.005 1.00 0.00 N ATOM 864 CA ILE A 760 -10.969 -15.131 3.649 1.00 0.00 C ATOM 865 C ILE A 760 -11.835 -16.355 3.446 1.00 0.00 C ATOM 866 O ILE A 760 -11.342 -17.467 3.213 1.00 0.00 O ATOM 867 CB ILE A 760 -9.820 -15.093 2.588 1.00 0.00 C ATOM 868 CG1 ILE A 760 -8.995 -13.801 2.681 1.00 0.00 C ATOM 869 CG2 ILE A 760 -10.326 -15.300 1.179 1.00 0.00 C ATOM 870 CD1 ILE A 760 -9.766 -12.525 2.421 1.00 0.00 C ATOM 0 H ILE A 760 -9.517 -15.525 5.094 1.00 0.00 H new ATOM 0 HA ILE A 760 -11.553 -14.221 3.508 1.00 0.00 H new ATOM 0 HB ILE A 760 -9.165 -15.931 2.826 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -8.551 -13.743 3.675 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -8.173 -13.862 1.968 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -9.488 -15.264 0.483 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -10.816 -16.271 1.107 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -11.039 -14.514 0.929 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -9.096 -11.670 2.510 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -10.187 -12.553 1.416 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -10.572 -12.432 3.149 1.00 0.00 H new ATOM 882 N ASP A 761 -13.109 -16.160 3.606 1.00 0.00 N ATOM 883 CA ASP A 761 -14.068 -17.239 3.478 1.00 0.00 C ATOM 884 C ASP A 761 -14.350 -17.579 2.033 1.00 0.00 C ATOM 885 O ASP A 761 -14.640 -18.725 1.707 1.00 0.00 O ATOM 886 CB ASP A 761 -15.373 -16.896 4.205 1.00 0.00 C ATOM 887 CG ASP A 761 -16.469 -17.924 3.979 1.00 0.00 C ATOM 888 OD1 ASP A 761 -16.407 -19.032 4.572 1.00 0.00 O ATOM 889 OD2 ASP A 761 -17.424 -17.633 3.223 1.00 0.00 O ATOM 0 H ASP A 761 -13.522 -15.254 3.829 1.00 0.00 H new ATOM 0 HA ASP A 761 -13.623 -18.118 3.944 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -15.176 -16.813 5.274 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -15.723 -15.920 3.869 1.00 0.00 H new ATOM 894 N SER A 762 -14.175 -16.633 1.163 1.00 0.00 N ATOM 895 CA SER A 762 -14.563 -16.831 -0.199 1.00 0.00 C ATOM 896 C SER A 762 -13.442 -16.454 -1.145 1.00 0.00 C ATOM 897 O SER A 762 -12.571 -15.658 -0.798 1.00 0.00 O ATOM 898 CB SER A 762 -15.791 -15.973 -0.479 1.00 0.00 C ATOM 899 OG SER A 762 -15.524 -14.607 -0.222 1.00 0.00 O ATOM 0 H SER A 762 -13.768 -15.721 1.370 1.00 0.00 H new ATOM 0 HA SER A 762 -14.791 -17.885 -0.359 1.00 0.00 H new ATOM 0 HB2 SER A 762 -16.098 -16.098 -1.517 1.00 0.00 H new ATOM 0 HB3 SER A 762 -16.622 -16.308 0.141 1.00 0.00 H new ATOM 0 HG SER A 762 -16.326 -14.076 -0.410 1.00 0.00 H new ATOM 905 N GLU A 763 -13.472 -17.006 -2.340 1.00 0.00 N ATOM 906 CA GLU A 763 -12.515 -16.661 -3.370 1.00 0.00 C ATOM 907 C GLU A 763 -12.755 -15.207 -3.769 1.00 0.00 C ATOM 908 O GLU A 763 -11.820 -14.463 -4.086 1.00 0.00 O ATOM 909 CB GLU A 763 -12.707 -17.574 -4.575 1.00 0.00 C ATOM 910 CG GLU A 763 -11.724 -17.341 -5.708 1.00 0.00 C ATOM 911 CD GLU A 763 -12.042 -18.182 -6.902 1.00 0.00 C ATOM 912 OE1 GLU A 763 -11.572 -19.336 -6.984 1.00 0.00 O ATOM 913 OE2 GLU A 763 -12.792 -17.727 -7.777 1.00 0.00 O ATOM 0 H GLU A 763 -14.159 -17.705 -2.624 1.00 0.00 H new ATOM 0 HA GLU A 763 -11.496 -16.785 -3.003 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -12.623 -18.610 -4.246 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -13.719 -17.442 -4.957 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -11.739 -16.288 -5.991 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -10.714 -17.565 -5.365 1.00 0.00 H new ATOM 920 N GLU A 764 -14.024 -14.810 -3.695 1.00 0.00 N ATOM 921 CA GLU A 764 -14.455 -13.463 -3.990 1.00 0.00 C ATOM 922 C GLU A 764 -13.747 -12.460 -3.096 1.00 0.00 C ATOM 923 O GLU A 764 -13.296 -11.422 -3.571 1.00 0.00 O ATOM 924 CB GLU A 764 -15.966 -13.344 -3.852 1.00 0.00 C ATOM 925 CG GLU A 764 -16.714 -14.225 -4.833 1.00 0.00 C ATOM 926 CD GLU A 764 -18.199 -14.002 -4.823 1.00 0.00 C ATOM 927 OE1 GLU A 764 -18.662 -12.995 -5.397 1.00 0.00 O ATOM 928 OE2 GLU A 764 -18.937 -14.849 -4.292 1.00 0.00 O ATOM 0 H GLU A 764 -14.786 -15.431 -3.423 1.00 0.00 H new ATOM 0 HA GLU A 764 -14.188 -13.237 -5.022 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -16.256 -13.611 -2.836 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -16.260 -12.306 -4.005 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -16.333 -14.042 -5.838 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -16.509 -15.270 -4.600 1.00 0.00 H new ATOM 935 N GLU A 765 -13.654 -12.782 -1.809 1.00 0.00 N ATOM 936 CA GLU A 765 -12.898 -11.991 -0.849 1.00 0.00 C ATOM 937 C GLU A 765 -11.473 -11.779 -1.303 1.00 0.00 C ATOM 938 O GLU A 765 -11.011 -10.650 -1.388 1.00 0.00 O ATOM 939 CB GLU A 765 -12.867 -12.688 0.498 1.00 0.00 C ATOM 940 CG GLU A 765 -14.033 -12.408 1.378 1.00 0.00 C ATOM 941 CD GLU A 765 -14.033 -10.985 1.833 1.00 0.00 C ATOM 942 OE1 GLU A 765 -13.007 -10.515 2.361 1.00 0.00 O ATOM 943 OE2 GLU A 765 -15.047 -10.295 1.677 1.00 0.00 O ATOM 0 H GLU A 765 -14.104 -13.603 -1.403 1.00 0.00 H new ATOM 0 HA GLU A 765 -13.396 -11.025 -0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -12.806 -13.764 0.332 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -11.957 -12.394 1.021 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -14.957 -12.622 0.841 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -14.007 -13.070 2.244 1.00 0.00 H new ATOM 950 N LEU A 766 -10.803 -12.869 -1.618 1.00 0.00 N ATOM 951 CA LEU A 766 -9.389 -12.838 -1.988 1.00 0.00 C ATOM 952 C LEU A 766 -9.164 -11.998 -3.244 1.00 0.00 C ATOM 953 O LEU A 766 -8.322 -11.088 -3.249 1.00 0.00 O ATOM 954 CB LEU A 766 -8.853 -14.262 -2.189 1.00 0.00 C ATOM 955 CG LEU A 766 -7.337 -14.402 -2.398 1.00 0.00 C ATOM 956 CD1 LEU A 766 -6.565 -13.899 -1.177 1.00 0.00 C ATOM 957 CD2 LEU A 766 -6.978 -15.847 -2.696 1.00 0.00 C ATOM 0 H LEU A 766 -11.215 -13.802 -1.627 1.00 0.00 H new ATOM 0 HA LEU A 766 -8.839 -12.372 -1.170 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -9.134 -14.858 -1.321 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -9.358 -14.698 -3.051 1.00 0.00 H new ATOM 0 HG LEU A 766 -7.053 -13.787 -3.252 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -5.495 -14.010 -1.352 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -6.798 -12.848 -1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -6.851 -14.480 -0.301 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -5.901 -15.932 -2.842 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -7.282 -16.477 -1.860 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -7.493 -16.171 -3.600 1.00 0.00 H new ATOM 969 N ILE A 767 -9.940 -12.285 -4.287 1.00 0.00 N ATOM 970 CA ILE A 767 -9.845 -11.564 -5.555 1.00 0.00 C ATOM 971 C ILE A 767 -10.130 -10.073 -5.345 1.00 0.00 C ATOM 972 O ILE A 767 -9.398 -9.204 -5.846 1.00 0.00 O ATOM 973 CB ILE A 767 -10.830 -12.144 -6.620 1.00 0.00 C ATOM 974 CG1 ILE A 767 -10.503 -13.621 -6.903 1.00 0.00 C ATOM 975 CG2 ILE A 767 -10.789 -11.326 -7.917 1.00 0.00 C ATOM 976 CD1 ILE A 767 -11.428 -14.282 -7.912 1.00 0.00 C ATOM 0 H ILE A 767 -10.648 -13.019 -4.278 1.00 0.00 H new ATOM 0 HA ILE A 767 -8.828 -11.689 -5.927 1.00 0.00 H new ATOM 0 HB ILE A 767 -11.840 -12.080 -6.216 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -9.478 -13.691 -7.266 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -10.548 -14.177 -5.967 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -11.485 -11.754 -8.639 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -11.073 -10.295 -7.706 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -9.780 -11.347 -8.329 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -11.129 -15.320 -8.054 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -12.453 -14.247 -7.543 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -11.366 -13.753 -8.863 1.00 0.00 H new ATOM 988 N ASN A 768 -11.166 -9.785 -4.574 1.00 0.00 N ATOM 989 CA ASN A 768 -11.550 -8.425 -4.292 1.00 0.00 C ATOM 990 C ASN A 768 -10.489 -7.689 -3.486 1.00 0.00 C ATOM 991 O ASN A 768 -10.119 -6.563 -3.819 1.00 0.00 O ATOM 992 CB ASN A 768 -12.904 -8.351 -3.579 1.00 0.00 C ATOM 993 CG ASN A 768 -13.158 -6.963 -3.049 1.00 0.00 C ATOM 994 OD1 ASN A 768 -13.674 -6.097 -3.746 1.00 0.00 O ATOM 995 ND2 ASN A 768 -12.819 -6.757 -1.809 1.00 0.00 N ATOM 0 H ASN A 768 -11.757 -10.488 -4.131 1.00 0.00 H new ATOM 0 HA ASN A 768 -11.646 -7.928 -5.257 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -13.699 -8.632 -4.270 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -12.927 -9.068 -2.758 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -12.981 -5.845 -1.381 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -12.392 -7.507 -1.266 1.00 0.00 H new ATOM 1002 N LYS A 769 -10.015 -8.314 -2.425 1.00 0.00 N ATOM 1003 CA LYS A 769 -9.017 -7.698 -1.579 1.00 0.00 C ATOM 1004 C LYS A 769 -7.763 -7.394 -2.376 1.00 0.00 C ATOM 1005 O LYS A 769 -7.209 -6.301 -2.255 1.00 0.00 O ATOM 1006 CB LYS A 769 -8.686 -8.560 -0.350 1.00 0.00 C ATOM 1007 CG LYS A 769 -9.791 -8.646 0.721 1.00 0.00 C ATOM 1008 CD LYS A 769 -10.061 -7.292 1.377 1.00 0.00 C ATOM 1009 CE LYS A 769 -10.932 -7.419 2.636 1.00 0.00 C ATOM 1010 NZ LYS A 769 -12.271 -8.019 2.390 1.00 0.00 N ATOM 0 H LYS A 769 -10.306 -9.246 -2.131 1.00 0.00 H new ATOM 0 HA LYS A 769 -9.436 -6.762 -1.209 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -8.454 -9.570 -0.689 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -7.783 -8.165 0.116 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -10.709 -9.017 0.265 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -9.500 -9.367 1.485 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -9.113 -6.822 1.639 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -10.555 -6.635 0.661 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -10.403 -8.026 3.371 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -11.064 -6.430 3.075 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -12.907 -7.785 3.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -12.664 -7.640 1.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -12.180 -9.052 2.314 1.00 0.00 H new ATOM 1024 N LYS A 770 -7.343 -8.344 -3.227 1.00 0.00 N ATOM 1025 CA LYS A 770 -6.197 -8.163 -4.038 1.00 0.00 C ATOM 1026 C LYS A 770 -6.372 -7.018 -5.040 1.00 0.00 C ATOM 1027 O LYS A 770 -5.548 -6.127 -5.080 1.00 0.00 O ATOM 1028 CB LYS A 770 -5.861 -9.434 -4.762 1.00 0.00 C ATOM 1029 CG LYS A 770 -4.461 -9.421 -5.277 1.00 0.00 C ATOM 1030 CD LYS A 770 -4.107 -10.713 -5.929 1.00 0.00 C ATOM 1031 CE LYS A 770 -2.633 -10.932 -5.819 1.00 0.00 C ATOM 1032 NZ LYS A 770 -1.825 -9.881 -6.497 1.00 0.00 N ATOM 0 H LYS A 770 -7.807 -9.244 -3.349 1.00 0.00 H new ATOM 0 HA LYS A 770 -5.374 -7.896 -3.375 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -5.994 -10.282 -4.090 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -6.553 -9.574 -5.592 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -4.343 -8.607 -5.992 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -3.772 -9.226 -4.455 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -4.645 -11.533 -5.454 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -4.407 -10.700 -6.977 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -2.357 -10.969 -4.765 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -2.385 -11.903 -6.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -0.863 -10.238 -6.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -2.268 -9.634 -7.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -1.778 -9.036 -5.893 1.00 0.00 H new ATOM 1046 N ARG A 771 -7.468 -7.030 -5.819 1.00 0.00 N ATOM 1047 CA ARG A 771 -7.682 -5.995 -6.861 1.00 0.00 C ATOM 1048 C ARG A 771 -7.637 -4.584 -6.259 1.00 0.00 C ATOM 1049 O ARG A 771 -7.116 -3.654 -6.872 1.00 0.00 O ATOM 1050 CB ARG A 771 -9.016 -6.195 -7.628 1.00 0.00 C ATOM 1051 CG ARG A 771 -10.255 -5.969 -6.776 1.00 0.00 C ATOM 1052 CD ARG A 771 -11.551 -6.107 -7.542 1.00 0.00 C ATOM 1053 NE ARG A 771 -12.708 -5.872 -6.664 1.00 0.00 N ATOM 1054 CZ ARG A 771 -13.977 -5.665 -7.062 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -14.295 -5.652 -8.350 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -14.915 -5.479 -6.151 1.00 0.00 N ATOM 0 H ARG A 771 -8.209 -7.728 -5.754 1.00 0.00 H new ATOM 0 HA ARG A 771 -6.866 -6.106 -7.575 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -9.041 -5.512 -8.477 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -9.044 -7.207 -8.031 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -10.253 -6.681 -5.951 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -10.207 -4.973 -6.337 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -11.567 -5.397 -8.369 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -11.616 -7.104 -7.977 1.00 0.00 H new ATOM 0 HE ARG A 771 -12.532 -5.865 -5.659 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -13.573 -5.800 -9.055 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -15.261 -5.494 -8.635 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -14.674 -5.493 -5.160 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -15.881 -5.321 -6.438 1.00 0.00 H new ATOM 1070 N ILE A 772 -8.150 -4.447 -5.045 1.00 0.00 N ATOM 1071 CA ILE A 772 -8.176 -3.177 -4.383 1.00 0.00 C ATOM 1072 C ILE A 772 -6.797 -2.810 -3.877 1.00 0.00 C ATOM 1073 O ILE A 772 -6.324 -1.730 -4.167 1.00 0.00 O ATOM 1074 CB ILE A 772 -9.227 -3.112 -3.236 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -10.635 -3.318 -3.810 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -9.148 -1.769 -2.491 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -11.737 -3.231 -2.783 1.00 0.00 C ATOM 0 H ILE A 772 -8.553 -5.213 -4.506 1.00 0.00 H new ATOM 0 HA ILE A 772 -8.486 -2.442 -5.126 1.00 0.00 H new ATOM 0 HB ILE A 772 -9.009 -3.907 -2.522 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -10.814 -2.571 -4.583 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -10.680 -4.294 -4.293 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.893 -1.750 -1.695 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -8.154 -1.650 -2.061 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -9.342 -0.954 -3.188 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -12.700 -3.388 -3.269 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -11.586 -3.996 -2.022 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -11.722 -2.246 -2.316 1.00 0.00 H new ATOM 1089 N ILE A 773 -6.126 -3.730 -3.173 1.00 0.00 N ATOM 1090 CA ILE A 773 -4.804 -3.430 -2.629 1.00 0.00 C ATOM 1091 C ILE A 773 -3.814 -3.073 -3.763 1.00 0.00 C ATOM 1092 O ILE A 773 -3.082 -2.097 -3.649 1.00 0.00 O ATOM 1093 CB ILE A 773 -4.247 -4.561 -1.675 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -2.927 -4.159 -1.004 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -4.076 -5.870 -2.385 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -3.049 -2.996 -0.042 1.00 0.00 C ATOM 0 H ILE A 773 -6.471 -4.669 -2.972 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.915 -2.553 -1.991 1.00 0.00 H new ATOM 0 HB ILE A 773 -5.002 -4.687 -0.899 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -2.528 -5.020 -0.467 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -2.203 -3.902 -1.777 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -3.691 -6.614 -1.688 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -5.039 -6.201 -2.775 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -3.374 -5.748 -3.209 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -2.072 -2.776 0.389 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -3.416 -2.119 -0.576 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.747 -3.254 0.755 1.00 0.00 H new ATOM 1108 N GLU A 774 -3.878 -3.814 -4.885 1.00 0.00 N ATOM 1109 CA GLU A 774 -3.036 -3.529 -6.058 1.00 0.00 C ATOM 1110 C GLU A 774 -3.345 -2.119 -6.580 1.00 0.00 C ATOM 1111 O GLU A 774 -2.455 -1.266 -6.683 1.00 0.00 O ATOM 1112 CB GLU A 774 -3.327 -4.497 -7.212 1.00 0.00 C ATOM 1113 CG GLU A 774 -3.203 -5.988 -6.931 1.00 0.00 C ATOM 1114 CD GLU A 774 -1.805 -6.485 -6.663 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -0.879 -6.170 -7.443 1.00 0.00 O ATOM 1116 OE2 GLU A 774 -1.628 -7.303 -5.750 1.00 0.00 O ATOM 0 H GLU A 774 -4.503 -4.612 -5.002 1.00 0.00 H new ATOM 0 HA GLU A 774 -1.998 -3.630 -5.740 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -4.341 -4.305 -7.564 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -2.653 -4.253 -8.033 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -3.827 -6.231 -6.071 1.00 0.00 H new ATOM 0 HG3 GLU A 774 -3.607 -6.535 -7.783 1.00 0.00 H new ATOM 1123 N LYS A 775 -4.633 -1.868 -6.876 1.00 0.00 N ATOM 1124 CA LYS A 775 -5.053 -0.586 -7.456 1.00 0.00 C ATOM 1125 C LYS A 775 -4.833 0.589 -6.520 1.00 0.00 C ATOM 1126 O LYS A 775 -4.562 1.695 -6.971 1.00 0.00 O ATOM 1127 CB LYS A 775 -6.498 -0.608 -7.971 1.00 0.00 C ATOM 1128 CG LYS A 775 -6.699 -1.435 -9.233 1.00 0.00 C ATOM 1129 CD LYS A 775 -8.136 -1.345 -9.724 1.00 0.00 C ATOM 1130 CE LYS A 775 -8.324 -2.061 -11.053 1.00 0.00 C ATOM 1131 NZ LYS A 775 -9.713 -1.956 -11.545 1.00 0.00 N ATOM 0 H LYS A 775 -5.393 -2.531 -6.724 1.00 0.00 H new ATOM 0 HA LYS A 775 -4.401 -0.441 -8.318 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -7.145 -1.000 -7.187 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -6.818 0.416 -8.166 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -6.023 -1.085 -10.013 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -6.444 -2.476 -9.034 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -8.803 -1.780 -8.979 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -8.418 -0.298 -9.832 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -7.644 -1.638 -11.792 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -8.058 -3.112 -10.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -9.799 -2.457 -12.452 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -10.360 -2.383 -10.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -9.959 -0.954 -11.678 1.00 0.00 H new ATOM 1145 N VAL A 776 -4.946 0.360 -5.233 1.00 0.00 N ATOM 1146 CA VAL A 776 -4.696 1.401 -4.261 1.00 0.00 C ATOM 1147 C VAL A 776 -3.213 1.756 -4.222 1.00 0.00 C ATOM 1148 O VAL A 776 -2.868 2.930 -4.216 1.00 0.00 O ATOM 1149 CB VAL A 776 -5.247 1.047 -2.850 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -4.757 2.034 -1.803 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -6.772 1.056 -2.873 1.00 0.00 C ATOM 0 H VAL A 776 -5.210 -0.540 -4.833 1.00 0.00 H new ATOM 0 HA VAL A 776 -5.246 2.285 -4.583 1.00 0.00 H new ATOM 0 HB VAL A 776 -4.883 0.054 -2.587 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -5.159 1.760 -0.828 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -3.668 2.013 -1.765 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -5.092 3.038 -2.064 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -7.152 0.807 -1.882 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -7.126 2.046 -3.159 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -7.129 0.321 -3.594 1.00 0.00 H new ATOM 1161 N ILE A 777 -2.342 0.749 -4.249 1.00 0.00 N ATOM 1162 CA ILE A 777 -0.899 1.000 -4.279 1.00 0.00 C ATOM 1163 C ILE A 777 -0.539 1.702 -5.585 1.00 0.00 C ATOM 1164 O ILE A 777 0.246 2.657 -5.599 1.00 0.00 O ATOM 1165 CB ILE A 777 -0.074 -0.303 -4.124 1.00 0.00 C ATOM 1166 CG1 ILE A 777 -0.391 -0.954 -2.779 1.00 0.00 C ATOM 1167 CG2 ILE A 777 1.430 -0.011 -4.226 1.00 0.00 C ATOM 1168 CD1 ILE A 777 0.191 -2.330 -2.622 1.00 0.00 C ATOM 0 H ILE A 777 -2.604 -0.237 -4.251 1.00 0.00 H new ATOM 0 HA ILE A 777 -0.649 1.637 -3.430 1.00 0.00 H new ATOM 0 HB ILE A 777 -0.345 -0.985 -4.930 1.00 0.00 H new ATOM 0 HG12 ILE A 777 -0.014 -0.316 -1.979 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -1.473 -1.011 -2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 777 1.989 -0.940 -4.114 1.00 0.00 H new ATOM 0 HG22 ILE A 777 1.650 0.430 -5.198 1.00 0.00 H new ATOM 0 HG23 ILE A 777 1.720 0.684 -3.438 1.00 0.00 H new ATOM 0 HD11 ILE A 777 -0.076 -2.728 -1.643 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -0.205 -2.983 -3.400 1.00 0.00 H new ATOM 0 HD13 ILE A 777 1.276 -2.278 -2.709 1.00 0.00 H new ATOM 1180 N HIS A 778 -1.150 1.249 -6.673 1.00 0.00 N ATOM 1181 CA HIS A 778 -0.985 1.892 -7.962 1.00 0.00 C ATOM 1182 C HIS A 778 -1.413 3.357 -7.883 1.00 0.00 C ATOM 1183 O HIS A 778 -0.636 4.242 -8.245 1.00 0.00 O ATOM 1184 CB HIS A 778 -1.751 1.139 -9.079 1.00 0.00 C ATOM 1185 CG HIS A 778 -1.820 1.878 -10.403 1.00 0.00 C ATOM 1186 ND1 HIS A 778 -0.748 2.074 -11.252 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -2.874 2.502 -10.988 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -1.172 2.796 -12.293 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -2.461 3.079 -12.182 1.00 0.00 N ATOM 0 H HIS A 778 -1.765 0.436 -6.684 1.00 0.00 H new ATOM 0 HA HIS A 778 0.073 1.857 -8.224 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -1.274 0.173 -9.241 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -2.766 0.940 -8.735 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -3.876 2.543 -10.588 1.00 0.00 H new ATOM 0 HE1 HIS A 778 -0.546 3.108 -13.116 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -3.033 3.611 -12.838 1.00 0.00 H new ATOM 1197 N ARG A 779 -2.614 3.605 -7.352 1.00 0.00 N ATOM 1198 CA ARG A 779 -3.150 4.960 -7.250 1.00 0.00 C ATOM 1199 C ARG A 779 -2.215 5.817 -6.405 1.00 0.00 C ATOM 1200 O ARG A 779 -1.861 6.931 -6.790 1.00 0.00 O ATOM 1201 CB ARG A 779 -4.544 4.971 -6.626 1.00 0.00 C ATOM 1202 CG ARG A 779 -5.274 6.302 -6.771 1.00 0.00 C ATOM 1203 CD ARG A 779 -6.367 6.466 -5.729 1.00 0.00 C ATOM 1204 NE ARG A 779 -5.774 6.739 -4.424 1.00 0.00 N ATOM 1205 CZ ARG A 779 -6.242 6.373 -3.237 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -7.457 5.822 -3.112 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -5.524 6.654 -2.171 1.00 0.00 N ATOM 0 H ARG A 779 -3.233 2.881 -6.986 1.00 0.00 H new ATOM 0 HA ARG A 779 -3.227 5.365 -8.259 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -5.144 4.186 -7.087 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -4.460 4.727 -5.567 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -4.559 7.120 -6.679 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -5.710 6.370 -7.768 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -7.033 7.281 -6.013 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -6.973 5.562 -5.680 1.00 0.00 H new ATOM 0 HE ARG A 779 -4.903 7.270 -4.424 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -8.039 5.678 -3.937 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -7.800 5.547 -2.192 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -4.633 7.141 -2.270 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -5.858 6.385 -1.246 1.00 0.00 H new ATOM 1221 N LEU A 780 -1.790 5.243 -5.288 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.869 5.847 -4.337 1.00 0.00 C ATOM 1223 C LEU A 780 0.400 6.336 -5.028 1.00 0.00 C ATOM 1224 O LEU A 780 0.826 7.485 -4.845 1.00 0.00 O ATOM 1225 CB LEU A 780 -0.502 4.799 -3.273 1.00 0.00 C ATOM 1226 CG LEU A 780 0.546 5.192 -2.241 1.00 0.00 C ATOM 1227 CD1 LEU A 780 0.060 6.345 -1.409 1.00 0.00 C ATOM 1228 CD2 LEU A 780 0.902 4.006 -1.364 1.00 0.00 C ATOM 0 H LEU A 780 -2.089 4.308 -5.009 1.00 0.00 H new ATOM 0 HA LEU A 780 -1.354 6.708 -3.877 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -1.413 4.524 -2.741 1.00 0.00 H new ATOM 0 HB3 LEU A 780 -0.151 3.904 -3.787 1.00 0.00 H new ATOM 0 HG LEU A 780 1.447 5.508 -2.767 1.00 0.00 H new ATOM 0 HD11 LEU A 780 0.822 6.612 -0.677 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -0.139 7.201 -2.054 1.00 0.00 H new ATOM 0 HD13 LEU A 780 -0.856 6.060 -0.892 1.00 0.00 H new ATOM 0 HD21 LEU A 780 1.652 4.306 -0.633 1.00 0.00 H new ATOM 0 HD22 LEU A 780 0.009 3.656 -0.845 1.00 0.00 H new ATOM 0 HD23 LEU A 780 1.300 3.202 -1.983 1.00 0.00 H new ATOM 1240 N THR A 781 0.980 5.478 -5.831 1.00 0.00 N ATOM 1241 CA THR A 781 2.219 5.784 -6.498 1.00 0.00 C ATOM 1242 C THR A 781 2.025 6.722 -7.707 1.00 0.00 C ATOM 1243 O THR A 781 2.941 7.450 -8.091 1.00 0.00 O ATOM 1244 CB THR A 781 2.937 4.471 -6.955 1.00 0.00 C ATOM 1245 OG1 THR A 781 2.077 3.701 -7.843 1.00 0.00 O ATOM 1246 CG2 THR A 781 3.299 3.598 -5.751 1.00 0.00 C ATOM 0 H THR A 781 0.607 4.552 -6.039 1.00 0.00 H new ATOM 0 HA THR A 781 2.842 6.308 -5.774 1.00 0.00 H new ATOM 0 HB THR A 781 3.847 4.762 -7.480 1.00 0.00 H new ATOM 0 HG1 THR A 781 1.191 4.119 -7.884 1.00 0.00 H new ATOM 0 HG21 THR A 781 3.797 2.692 -6.095 1.00 0.00 H new ATOM 0 HG22 THR A 781 3.967 4.150 -5.089 1.00 0.00 H new ATOM 0 HG23 THR A 781 2.392 3.330 -5.210 1.00 0.00 H new ATOM 1254 N HIS A 782 0.826 6.744 -8.257 1.00 0.00 N ATOM 1255 CA HIS A 782 0.611 7.421 -9.522 1.00 0.00 C ATOM 1256 C HIS A 782 -0.151 8.747 -9.372 1.00 0.00 C ATOM 1257 O HIS A 782 0.350 9.799 -9.755 1.00 0.00 O ATOM 1258 CB HIS A 782 -0.140 6.486 -10.480 1.00 0.00 C ATOM 1259 CG HIS A 782 -0.015 6.849 -11.924 1.00 0.00 C ATOM 1260 ND1 HIS A 782 -0.770 7.806 -12.559 1.00 0.00 N ATOM 1261 CD2 HIS A 782 0.817 6.349 -12.864 1.00 0.00 C ATOM 1262 CE1 HIS A 782 -0.386 7.851 -13.832 1.00 0.00 C ATOM 1263 NE2 HIS A 782 0.579 6.984 -14.071 1.00 0.00 N ATOM 0 H HIS A 782 -0.004 6.308 -7.855 1.00 0.00 H new ATOM 0 HA HIS A 782 1.592 7.670 -9.927 1.00 0.00 H new ATOM 0 HB2 HIS A 782 0.230 5.470 -10.340 1.00 0.00 H new ATOM 0 HB3 HIS A 782 -1.196 6.481 -10.210 1.00 0.00 H new ATOM 0 HD2 HIS A 782 1.552 5.575 -12.700 1.00 0.00 H new ATOM 0 HE1 HIS A 782 -0.810 8.512 -14.574 1.00 0.00 H new ATOM 0 HE2 HIS A 782 1.051 6.816 -14.959 1.00 0.00 H new ATOM 1271 N TYR A 783 -1.339 8.690 -8.806 1.00 0.00 N ATOM 1272 CA TYR A 783 -2.208 9.860 -8.724 1.00 0.00 C ATOM 1273 C TYR A 783 -1.916 10.641 -7.466 1.00 0.00 C ATOM 1274 O TYR A 783 -1.626 11.834 -7.527 1.00 0.00 O ATOM 1275 CB TYR A 783 -3.695 9.454 -8.731 1.00 0.00 C ATOM 1276 CG TYR A 783 -4.156 8.680 -9.950 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -3.913 7.328 -10.055 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -4.853 9.298 -10.974 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -4.336 6.599 -11.136 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -5.286 8.579 -12.072 1.00 0.00 C ATOM 1281 CZ TYR A 783 -5.025 7.230 -12.148 1.00 0.00 C ATOM 1282 OH TYR A 783 -5.451 6.510 -13.245 1.00 0.00 O ATOM 0 H TYR A 783 -1.732 7.844 -8.392 1.00 0.00 H new ATOM 0 HA TYR A 783 -2.009 10.479 -9.599 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -3.893 8.852 -7.844 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -4.300 10.357 -8.645 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -3.374 6.829 -9.263 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -5.061 10.356 -10.914 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -4.131 5.540 -11.194 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -5.826 9.073 -12.866 1.00 0.00 H new ATOM 0 HH TYR A 783 -5.922 7.106 -13.865 1.00 0.00 H new ATOM 1292 N ASP A 784 -2.006 9.948 -6.330 1.00 0.00 N ATOM 1293 CA ASP A 784 -1.759 10.523 -5.000 1.00 0.00 C ATOM 1294 C ASP A 784 -0.396 11.172 -4.990 1.00 0.00 C ATOM 1295 O ASP A 784 -0.262 12.380 -4.772 1.00 0.00 O ATOM 1296 CB ASP A 784 -1.751 9.419 -3.903 1.00 0.00 C ATOM 1297 CG ASP A 784 -3.031 8.605 -3.771 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -3.727 8.392 -4.779 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -3.347 8.145 -2.656 1.00 0.00 O ATOM 0 H ASP A 784 -2.255 8.959 -6.304 1.00 0.00 H new ATOM 0 HA ASP A 784 -2.552 11.242 -4.793 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -0.928 8.735 -4.109 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -1.542 9.890 -2.942 1.00 0.00 H new ATOM 1304 N HIS A 785 0.607 10.329 -5.247 1.00 0.00 N ATOM 1305 CA HIS A 785 2.025 10.679 -5.286 1.00 0.00 C ATOM 1306 C HIS A 785 2.489 11.118 -3.891 1.00 0.00 C ATOM 1307 O HIS A 785 3.492 11.794 -3.723 1.00 0.00 O ATOM 1308 CB HIS A 785 2.341 11.732 -6.383 1.00 0.00 C ATOM 1309 CG HIS A 785 3.812 11.795 -6.770 1.00 0.00 C ATOM 1310 ND1 HIS A 785 4.617 12.901 -6.615 1.00 0.00 N ATOM 1311 CD2 HIS A 785 4.599 10.846 -7.343 1.00 0.00 C ATOM 1312 CE1 HIS A 785 5.835 12.600 -7.086 1.00 0.00 C ATOM 1313 NE2 HIS A 785 5.878 11.356 -7.543 1.00 0.00 N ATOM 0 H HIS A 785 0.444 9.341 -5.442 1.00 0.00 H new ATOM 0 HA HIS A 785 2.594 9.792 -5.567 1.00 0.00 H new ATOM 0 HB2 HIS A 785 1.751 11.506 -7.271 1.00 0.00 H new ATOM 0 HB3 HIS A 785 2.025 12.714 -6.032 1.00 0.00 H new ATOM 0 HD2 HIS A 785 4.280 9.848 -7.603 1.00 0.00 H new ATOM 0 HE1 HIS A 785 6.673 13.282 -7.093 1.00 0.00 H new ATOM 0 HE2 HIS A 785 6.678 10.875 -7.954 1.00 0.00 H new ATOM 1321 N VAL A 786 1.787 10.611 -2.888 1.00 0.00 N ATOM 1322 CA VAL A 786 2.084 10.896 -1.487 1.00 0.00 C ATOM 1323 C VAL A 786 3.015 9.779 -0.934 1.00 0.00 C ATOM 1324 O VAL A 786 3.141 9.541 0.276 1.00 0.00 O ATOM 1325 CB VAL A 786 0.746 11.018 -0.666 1.00 0.00 C ATOM 1326 CG1 VAL A 786 -0.006 9.703 -0.570 1.00 0.00 C ATOM 1327 CG2 VAL A 786 0.966 11.634 0.704 1.00 0.00 C ATOM 0 H VAL A 786 0.991 9.987 -3.021 1.00 0.00 H new ATOM 0 HA VAL A 786 2.603 11.850 -1.393 1.00 0.00 H new ATOM 0 HB VAL A 786 0.112 11.702 -1.230 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -0.920 9.848 0.007 1.00 0.00 H new ATOM 0 HG12 VAL A 786 -0.260 9.355 -1.571 1.00 0.00 H new ATOM 0 HG13 VAL A 786 0.621 8.960 -0.076 1.00 0.00 H new ATOM 0 HG21 VAL A 786 0.014 11.697 1.232 1.00 0.00 H new ATOM 0 HG22 VAL A 786 1.657 11.014 1.275 1.00 0.00 H new ATOM 0 HG23 VAL A 786 1.385 12.634 0.590 1.00 0.00 H new ATOM 1337 N LEU A 787 3.676 9.120 -1.856 1.00 0.00 N ATOM 1338 CA LEU A 787 4.599 8.058 -1.546 1.00 0.00 C ATOM 1339 C LEU A 787 6.001 8.628 -1.405 1.00 0.00 C ATOM 1340 O LEU A 787 6.312 9.695 -1.942 1.00 0.00 O ATOM 1341 CB LEU A 787 4.657 6.996 -2.678 1.00 0.00 C ATOM 1342 CG LEU A 787 5.447 7.392 -3.971 1.00 0.00 C ATOM 1343 CD1 LEU A 787 5.708 6.192 -4.842 1.00 0.00 C ATOM 1344 CD2 LEU A 787 4.711 8.431 -4.784 1.00 0.00 C ATOM 0 H LEU A 787 3.586 9.310 -2.854 1.00 0.00 H new ATOM 0 HA LEU A 787 4.253 7.593 -0.623 1.00 0.00 H new ATOM 0 HB2 LEU A 787 5.103 6.088 -2.271 1.00 0.00 H new ATOM 0 HB3 LEU A 787 3.635 6.748 -2.965 1.00 0.00 H new ATOM 0 HG LEU A 787 6.395 7.811 -3.634 1.00 0.00 H new ATOM 0 HD11 LEU A 787 6.258 6.500 -5.731 1.00 0.00 H new ATOM 0 HD12 LEU A 787 6.296 5.461 -4.287 1.00 0.00 H new ATOM 0 HD13 LEU A 787 4.759 5.745 -5.139 1.00 0.00 H new ATOM 0 HD21 LEU A 787 5.293 8.678 -5.672 1.00 0.00 H new ATOM 0 HD22 LEU A 787 3.740 8.037 -5.084 1.00 0.00 H new ATOM 0 HD23 LEU A 787 4.568 9.329 -4.183 1.00 0.00 H new ATOM 1356 N ILE A 788 6.817 7.934 -0.690 1.00 0.00 N ATOM 1357 CA ILE A 788 8.210 8.200 -0.618 1.00 0.00 C ATOM 1358 C ILE A 788 8.852 6.881 -0.985 1.00 0.00 C ATOM 1359 O ILE A 788 8.542 5.857 -0.383 1.00 0.00 O ATOM 1360 CB ILE A 788 8.708 8.632 0.819 1.00 0.00 C ATOM 1361 CG1 ILE A 788 8.007 9.894 1.353 1.00 0.00 C ATOM 1362 CG2 ILE A 788 10.217 8.829 0.857 1.00 0.00 C ATOM 1363 CD1 ILE A 788 6.616 9.652 1.899 1.00 0.00 C ATOM 0 H ILE A 788 6.523 7.140 -0.121 1.00 0.00 H new ATOM 0 HA ILE A 788 8.466 9.034 -1.271 1.00 0.00 H new ATOM 0 HB ILE A 788 8.438 7.805 1.476 1.00 0.00 H new ATOM 0 HG12 ILE A 788 8.622 10.331 2.140 1.00 0.00 H new ATOM 0 HG13 ILE A 788 7.946 10.629 0.550 1.00 0.00 H new ATOM 0 HG21 ILE A 788 10.520 9.125 1.861 1.00 0.00 H new ATOM 0 HG22 ILE A 788 10.713 7.896 0.589 1.00 0.00 H new ATOM 0 HG23 ILE A 788 10.500 9.607 0.148 1.00 0.00 H new ATOM 0 HD11 ILE A 788 6.196 10.593 2.254 1.00 0.00 H new ATOM 0 HD12 ILE A 788 5.982 9.245 1.111 1.00 0.00 H new ATOM 0 HD13 ILE A 788 6.668 8.943 2.726 1.00 0.00 H new ATOM 1375 N GLU A 789 9.645 6.851 -1.995 1.00 0.00 N ATOM 1376 CA GLU A 789 10.269 5.614 -2.350 1.00 0.00 C ATOM 1377 C GLU A 789 11.758 5.761 -2.328 1.00 0.00 C ATOM 1378 O GLU A 789 12.301 6.761 -2.806 1.00 0.00 O ATOM 1379 CB GLU A 789 9.747 5.047 -3.686 1.00 0.00 C ATOM 1380 CG GLU A 789 10.009 5.895 -4.918 1.00 0.00 C ATOM 1381 CD GLU A 789 9.442 5.260 -6.161 1.00 0.00 C ATOM 1382 OE1 GLU A 789 9.915 4.174 -6.563 1.00 0.00 O ATOM 1383 OE2 GLU A 789 8.491 5.804 -6.739 1.00 0.00 O ATOM 0 H GLU A 789 9.879 7.649 -2.585 1.00 0.00 H new ATOM 0 HA GLU A 789 9.995 4.873 -1.599 1.00 0.00 H new ATOM 0 HB2 GLU A 789 10.197 4.067 -3.842 1.00 0.00 H new ATOM 0 HB3 GLU A 789 8.672 4.894 -3.597 1.00 0.00 H new ATOM 0 HG2 GLU A 789 9.569 6.883 -4.781 1.00 0.00 H new ATOM 0 HG3 GLU A 789 11.083 6.039 -5.040 1.00 0.00 H new ATOM 1666 N TYR A 810 12.134 0.563 -2.110 1.00 0.00 N ATOM 1667 CA TYR A 810 11.388 0.477 -0.884 1.00 0.00 C ATOM 1668 C TYR A 810 10.358 1.579 -0.867 1.00 0.00 C ATOM 1669 O TYR A 810 10.653 2.711 -1.250 1.00 0.00 O ATOM 1670 CB TYR A 810 12.315 0.596 0.320 1.00 0.00 C ATOM 1671 CG TYR A 810 13.433 -0.416 0.337 1.00 0.00 C ATOM 1672 CD1 TYR A 810 13.166 -1.768 0.473 1.00 0.00 C ATOM 1673 CD2 TYR A 810 14.757 -0.017 0.218 1.00 0.00 C ATOM 1674 CE1 TYR A 810 14.183 -2.691 0.484 1.00 0.00 C ATOM 1675 CE2 TYR A 810 15.780 -0.934 0.232 1.00 0.00 C ATOM 1676 CZ TYR A 810 15.488 -2.269 0.362 1.00 0.00 C ATOM 1677 OH TYR A 810 16.506 -3.197 0.366 1.00 0.00 O ATOM 0 HA TYR A 810 10.892 -0.492 -0.826 1.00 0.00 H new ATOM 0 HB2 TYR A 810 12.745 1.597 0.337 1.00 0.00 H new ATOM 0 HB3 TYR A 810 11.726 0.487 1.231 1.00 0.00 H new ATOM 0 HD1 TYR A 810 12.144 -2.101 0.572 1.00 0.00 H new ATOM 0 HD2 TYR A 810 14.987 1.033 0.113 1.00 0.00 H new ATOM 0 HE1 TYR A 810 13.960 -3.743 0.588 1.00 0.00 H new ATOM 0 HE2 TYR A 810 16.805 -0.607 0.141 1.00 0.00 H new ATOM 0 HH TYR A 810 17.367 -2.739 0.270 1.00 0.00 H new ATOM 1687 N LEU A 811 9.178 1.253 -0.444 1.00 0.00 N ATOM 1688 CA LEU A 811 8.065 2.150 -0.457 1.00 0.00 C ATOM 1689 C LEU A 811 7.673 2.506 0.980 1.00 0.00 C ATOM 1690 O LEU A 811 7.606 1.639 1.868 1.00 0.00 O ATOM 1691 CB LEU A 811 6.891 1.459 -1.229 1.00 0.00 C ATOM 1692 CG LEU A 811 5.650 2.296 -1.659 1.00 0.00 C ATOM 1693 CD1 LEU A 811 4.781 2.735 -0.487 1.00 0.00 C ATOM 1694 CD2 LEU A 811 6.076 3.491 -2.487 1.00 0.00 C ATOM 0 H LEU A 811 8.955 0.331 -0.070 1.00 0.00 H new ATOM 0 HA LEU A 811 8.318 3.082 -0.963 1.00 0.00 H new ATOM 0 HB2 LEU A 811 7.312 1.014 -2.131 1.00 0.00 H new ATOM 0 HB3 LEU A 811 6.531 0.639 -0.607 1.00 0.00 H new ATOM 0 HG LEU A 811 5.030 1.638 -2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 811 3.935 3.313 -0.858 1.00 0.00 H new ATOM 0 HD12 LEU A 811 4.415 1.856 0.044 1.00 0.00 H new ATOM 0 HD13 LEU A 811 5.371 3.350 0.193 1.00 0.00 H new ATOM 0 HD21 LEU A 811 5.196 4.064 -2.778 1.00 0.00 H new ATOM 0 HD22 LEU A 811 6.742 4.123 -1.899 1.00 0.00 H new ATOM 0 HD23 LEU A 811 6.597 3.147 -3.380 1.00 0.00 H new ATOM 1706 N VAL A 812 7.480 3.770 1.193 1.00 0.00 N ATOM 1707 CA VAL A 812 7.000 4.330 2.427 1.00 0.00 C ATOM 1708 C VAL A 812 6.000 5.447 2.070 1.00 0.00 C ATOM 1709 O VAL A 812 6.081 6.006 0.992 1.00 0.00 O ATOM 1710 CB VAL A 812 8.197 4.799 3.364 1.00 0.00 C ATOM 1711 CG1 VAL A 812 9.335 5.416 2.582 1.00 0.00 C ATOM 1712 CG2 VAL A 812 7.749 5.747 4.465 1.00 0.00 C ATOM 0 H VAL A 812 7.660 4.477 0.480 1.00 0.00 H new ATOM 0 HA VAL A 812 6.480 3.580 3.023 1.00 0.00 H new ATOM 0 HB VAL A 812 8.562 3.887 3.837 1.00 0.00 H new ATOM 0 HG11 VAL A 812 10.126 5.719 3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 812 9.728 4.686 1.875 1.00 0.00 H new ATOM 0 HG13 VAL A 812 8.972 6.288 2.039 1.00 0.00 H new ATOM 0 HG21 VAL A 812 8.609 6.032 5.071 1.00 0.00 H new ATOM 0 HG22 VAL A 812 7.307 6.638 4.020 1.00 0.00 H new ATOM 0 HG23 VAL A 812 7.010 5.251 5.094 1.00 0.00 H new ATOM 1722 N VAL A 813 5.030 5.700 2.909 1.00 0.00 N ATOM 1723 CA VAL A 813 3.999 6.674 2.599 1.00 0.00 C ATOM 1724 C VAL A 813 3.889 7.698 3.729 1.00 0.00 C ATOM 1725 O VAL A 813 4.262 7.398 4.867 1.00 0.00 O ATOM 1726 CB VAL A 813 2.625 5.951 2.360 1.00 0.00 C ATOM 1727 CG1 VAL A 813 2.173 5.176 3.592 1.00 0.00 C ATOM 1728 CG2 VAL A 813 1.539 6.915 1.898 1.00 0.00 C ATOM 0 H VAL A 813 4.926 5.247 3.817 1.00 0.00 H new ATOM 0 HA VAL A 813 4.269 7.201 1.684 1.00 0.00 H new ATOM 0 HB VAL A 813 2.790 5.235 1.555 1.00 0.00 H new ATOM 0 HG11 VAL A 813 1.219 4.690 3.387 1.00 0.00 H new ATOM 0 HG12 VAL A 813 2.919 4.421 3.841 1.00 0.00 H new ATOM 0 HG13 VAL A 813 2.058 5.862 4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 813 0.608 6.369 1.746 1.00 0.00 H new ATOM 0 HG22 VAL A 813 1.389 7.684 2.656 1.00 0.00 H new ATOM 0 HG23 VAL A 813 1.842 7.383 0.961 1.00 0.00 H new ATOM 1738 N ASN A 814 3.448 8.912 3.411 1.00 0.00 N ATOM 1739 CA ASN A 814 3.207 9.909 4.439 1.00 0.00 C ATOM 1740 C ASN A 814 2.016 9.473 5.275 1.00 0.00 C ATOM 1741 O ASN A 814 1.035 8.962 4.724 1.00 0.00 O ATOM 1742 CB ASN A 814 2.896 11.304 3.858 1.00 0.00 C ATOM 1743 CG ASN A 814 4.045 11.963 3.117 1.00 0.00 C ATOM 1744 OD1 ASN A 814 4.201 11.800 1.915 1.00 0.00 O ATOM 1745 ND2 ASN A 814 4.842 12.730 3.817 1.00 0.00 N ATOM 0 H ASN A 814 3.253 9.223 2.459 1.00 0.00 H new ATOM 0 HA ASN A 814 4.118 9.986 5.033 1.00 0.00 H new ATOM 0 HB2 ASN A 814 2.048 11.217 3.179 1.00 0.00 H new ATOM 0 HB3 ASN A 814 2.586 11.959 4.672 1.00 0.00 H new ATOM 0 HD21 ASN A 814 5.618 13.211 3.361 1.00 0.00 H new ATOM 0 HD22 ASN A 814 4.687 12.847 4.818 1.00 0.00 H new ATOM 1752 N PRO A 815 2.080 9.659 6.614 1.00 0.00 N ATOM 1753 CA PRO A 815 0.980 9.309 7.536 1.00 0.00 C ATOM 1754 C PRO A 815 -0.354 9.971 7.171 1.00 0.00 C ATOM 1755 O PRO A 815 -1.407 9.497 7.579 1.00 0.00 O ATOM 1756 CB PRO A 815 1.459 9.852 8.883 1.00 0.00 C ATOM 1757 CG PRO A 815 2.937 9.865 8.782 1.00 0.00 C ATOM 1758 CD PRO A 815 3.253 10.170 7.349 1.00 0.00 C ATOM 0 HA PRO A 815 0.783 8.237 7.516 1.00 0.00 H new ATOM 0 HB2 PRO A 815 1.066 10.852 9.069 1.00 0.00 H new ATOM 0 HB3 PRO A 815 1.124 9.220 9.706 1.00 0.00 H new ATOM 0 HG2 PRO A 815 3.366 10.617 9.444 1.00 0.00 H new ATOM 0 HG3 PRO A 815 3.356 8.903 9.077 1.00 0.00 H new ATOM 0 HD2 PRO A 815 3.391 11.239 7.189 1.00 0.00 H new ATOM 0 HD3 PRO A 815 4.171 9.678 7.028 1.00 0.00 H new ATOM 1766 N ASN A 816 -0.287 11.070 6.418 1.00 0.00 N ATOM 1767 CA ASN A 816 -1.475 11.808 5.986 1.00 0.00 C ATOM 1768 C ASN A 816 -2.375 10.921 5.128 1.00 0.00 C ATOM 1769 O ASN A 816 -3.388 10.406 5.622 1.00 0.00 O ATOM 1770 CB ASN A 816 -1.082 13.093 5.226 1.00 0.00 C ATOM 1771 CG ASN A 816 -2.283 13.881 4.713 1.00 0.00 C ATOM 1772 OD1 ASN A 816 -2.742 13.684 3.591 1.00 0.00 O ATOM 1773 ND2 ASN A 816 -2.793 14.760 5.517 1.00 0.00 N ATOM 0 H ASN A 816 0.591 11.473 6.091 1.00 0.00 H new ATOM 0 HA ASN A 816 -2.033 12.104 6.874 1.00 0.00 H new ATOM 0 HB2 ASN A 816 -0.492 13.731 5.885 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -0.443 12.828 4.383 1.00 0.00 H new ATOM 0 HD21 ASN A 816 -3.599 15.312 5.224 1.00 0.00 H new ATOM 0 HD22 ASN A 816 -2.388 14.900 6.443 1.00 0.00 H new ATOM 1780 N TYR A 817 -1.987 10.729 3.857 1.00 0.00 N ATOM 1781 CA TYR A 817 -2.689 9.851 2.913 1.00 0.00 C ATOM 1782 C TYR A 817 -4.147 10.334 2.603 1.00 0.00 C ATOM 1783 O TYR A 817 -4.736 11.138 3.334 1.00 0.00 O ATOM 1784 CB TYR A 817 -2.630 8.383 3.426 1.00 0.00 C ATOM 1785 CG TYR A 817 -3.256 7.359 2.521 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -2.777 7.161 1.234 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -4.324 6.585 2.952 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -3.343 6.232 0.404 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -4.897 5.649 2.127 1.00 0.00 C ATOM 1790 CZ TYR A 817 -4.405 5.477 0.854 1.00 0.00 C ATOM 1791 OH TYR A 817 -4.986 4.561 0.025 1.00 0.00 O ATOM 0 H TYR A 817 -1.168 11.185 3.454 1.00 0.00 H new ATOM 0 HA TYR A 817 -2.175 9.897 1.953 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -1.586 8.113 3.585 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -3.123 8.335 4.397 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -1.943 7.750 0.881 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -4.710 6.721 3.951 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -2.961 6.091 -0.596 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -5.727 5.052 2.475 1.00 0.00 H new ATOM 0 HH TYR A 817 -5.719 4.113 0.496 1.00 0.00 H new