USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=17 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 814 ASN : amide:sc= 0.849 K(o=0.85,f=-8.5!) USER MOD Set 1.2: A 816 ASN : amide:sc= 0 X(o=0.85,f=0.85) USER MOD Set 2.1: A 781 THR OG1 : rot -87:sc= 1.14 USER MOD Set 2.2: A 782 HIS : no HE2:sc= 0.714 K(o=1.9,f=-1.6!) USER MOD Set 3.1: A 720 TYR OH : rot 180:sc= 1.13 USER MOD Set 3.2: A 775 LYS NZ :NH3+ -100:sc= 1.15 (180deg=0) USER MOD Set 4.1: A 730 HIS : no HD1:sc= 0.592 K(o=1.3,f=-0.69) USER MOD Set 4.2: A 741 SER OG : rot 75:sc= 0.727 USER MOD Single : A 718 SER OG : rot 180:sc= 0 USER MOD Single : A 721 SER OG : rot 180:sc= 0 USER MOD Single : A 724 SER OG : rot 72:sc= 1.25 USER MOD Single : A 725 ASN : amide:sc=-0.00583 K(o=-0.0058,f=-1.1) USER MOD Single : A 733 LYS NZ :NH3+ -138:sc= 0.0424 (180deg=-2.33!) USER MOD Single : A 744 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 746 SER OG : rot 180:sc= 0.0299 USER MOD Single : A 750 ASN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 752 TYR OH : rot 30:sc= -0.196 USER MOD Single : A 754 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 758 SER OG : rot 180:sc= 0 USER MOD Single : A 762 SER OG : rot 92:sc= 1.29 USER MOD Single : A 768 ASN : amide:sc= -0.763 X(o=-0.76,f=-0.27) USER MOD Single : A 769 LYS NZ :NH3+ -144:sc= 1.23 (180deg=0.608) USER MOD Single : A 770 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 783 TYR OH : rot 180:sc= 0 USER MOD Single : A 785 HIS : no HD1:sc= -0.0885 X(o=-0.089,f=-0.17) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 817 TYR OH : rot 130:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -16.308 -0.934 -2.870 1.00 0.00 N ATOM 138 CA PHE A 717 -14.913 -0.705 -2.600 1.00 0.00 C ATOM 139 C PHE A 717 -14.514 -1.100 -1.195 1.00 0.00 C ATOM 140 O PHE A 717 -13.469 -0.665 -0.708 1.00 0.00 O ATOM 141 CB PHE A 717 -14.528 0.762 -2.883 1.00 0.00 C ATOM 142 CG PHE A 717 -15.198 1.796 -2.005 1.00 0.00 C ATOM 143 CD1 PHE A 717 -16.451 2.274 -2.315 1.00 0.00 C ATOM 144 CD2 PHE A 717 -14.556 2.305 -0.884 1.00 0.00 C ATOM 145 CE1 PHE A 717 -17.054 3.226 -1.543 1.00 0.00 C ATOM 146 CE2 PHE A 717 -15.162 3.264 -0.099 1.00 0.00 C ATOM 147 CZ PHE A 717 -16.416 3.728 -0.432 1.00 0.00 C ATOM 0 HA PHE A 717 -14.357 -1.352 -3.279 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -13.448 0.863 -2.773 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -14.765 0.987 -3.923 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -16.966 1.890 -3.183 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -13.571 1.946 -0.624 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -18.037 3.587 -1.806 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -14.655 3.650 0.773 1.00 0.00 H new ATOM 0 HZ PHE A 717 -16.895 4.481 0.176 1.00 0.00 H new ATOM 157 N SER A 718 -15.287 -1.961 -0.559 1.00 0.00 N ATOM 158 CA SER A 718 -14.950 -2.422 0.784 1.00 0.00 C ATOM 159 C SER A 718 -13.589 -3.132 0.770 1.00 0.00 C ATOM 160 O SER A 718 -12.811 -3.030 1.716 1.00 0.00 O ATOM 161 CB SER A 718 -16.045 -3.329 1.328 1.00 0.00 C ATOM 162 OG SER A 718 -17.299 -2.644 1.339 1.00 0.00 O ATOM 0 H SER A 718 -16.146 -2.355 -0.943 1.00 0.00 H new ATOM 0 HA SER A 718 -14.876 -1.561 1.448 1.00 0.00 H new ATOM 0 HB2 SER A 718 -16.120 -4.228 0.715 1.00 0.00 H new ATOM 0 HB3 SER A 718 -15.791 -3.652 2.338 1.00 0.00 H new ATOM 0 HG SER A 718 -17.994 -3.239 1.689 1.00 0.00 H new ATOM 168 N GLU A 719 -13.296 -3.778 -0.354 1.00 0.00 N ATOM 169 CA GLU A 719 -12.023 -4.427 -0.596 1.00 0.00 C ATOM 170 C GLU A 719 -10.917 -3.385 -0.535 1.00 0.00 C ATOM 171 O GLU A 719 -9.960 -3.515 0.220 1.00 0.00 O ATOM 172 CB GLU A 719 -12.008 -5.081 -1.993 1.00 0.00 C ATOM 173 CG GLU A 719 -12.998 -6.228 -2.231 1.00 0.00 C ATOM 174 CD GLU A 719 -14.460 -5.856 -2.067 1.00 0.00 C ATOM 175 OE1 GLU A 719 -14.864 -4.732 -2.446 1.00 0.00 O ATOM 176 OE2 GLU A 719 -15.225 -6.671 -1.520 1.00 0.00 O ATOM 0 H GLU A 719 -13.951 -3.864 -1.132 1.00 0.00 H new ATOM 0 HA GLU A 719 -11.870 -5.196 0.161 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -12.203 -4.305 -2.733 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -11.002 -5.456 -2.182 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -12.848 -6.615 -3.239 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -12.765 -7.039 -1.541 1.00 0.00 H new ATOM 183 N TYR A 720 -11.096 -2.316 -1.298 1.00 0.00 N ATOM 184 CA TYR A 720 -10.126 -1.230 -1.350 1.00 0.00 C ATOM 185 C TYR A 720 -10.005 -0.547 0.001 1.00 0.00 C ATOM 186 O TYR A 720 -8.933 -0.099 0.372 1.00 0.00 O ATOM 187 CB TYR A 720 -10.482 -0.201 -2.431 1.00 0.00 C ATOM 188 CG TYR A 720 -10.432 -0.743 -3.842 1.00 0.00 C ATOM 189 CD1 TYR A 720 -9.222 -0.878 -4.506 1.00 0.00 C ATOM 190 CD2 TYR A 720 -11.589 -1.110 -4.510 1.00 0.00 C ATOM 191 CE1 TYR A 720 -9.165 -1.368 -5.794 1.00 0.00 C ATOM 192 CE2 TYR A 720 -11.542 -1.601 -5.799 1.00 0.00 C ATOM 193 CZ TYR A 720 -10.327 -1.727 -6.435 1.00 0.00 C ATOM 194 OH TYR A 720 -10.274 -2.217 -7.717 1.00 0.00 O ATOM 0 H TYR A 720 -11.911 -2.177 -1.895 1.00 0.00 H new ATOM 0 HA TYR A 720 -9.164 -1.671 -1.610 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -11.484 0.183 -2.236 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -9.797 0.643 -2.353 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -8.308 -0.594 -4.006 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -12.543 -1.010 -4.014 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -8.214 -1.469 -6.296 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -12.453 -1.885 -6.306 1.00 0.00 H new ATOM 0 HH TYR A 720 -11.181 -2.424 -8.026 1.00 0.00 H new ATOM 204 N SER A 721 -11.101 -0.490 0.731 1.00 0.00 N ATOM 205 CA SER A 721 -11.120 0.096 2.045 1.00 0.00 C ATOM 206 C SER A 721 -10.284 -0.755 3.015 1.00 0.00 C ATOM 207 O SER A 721 -9.542 -0.215 3.826 1.00 0.00 O ATOM 208 CB SER A 721 -12.568 0.262 2.540 1.00 0.00 C ATOM 209 OG SER A 721 -12.625 0.969 3.770 1.00 0.00 O ATOM 0 H SER A 721 -12.004 -0.852 0.423 1.00 0.00 H new ATOM 0 HA SER A 721 -10.673 1.089 1.999 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.151 0.793 1.788 1.00 0.00 H new ATOM 0 HB3 SER A 721 -13.025 -0.720 2.663 1.00 0.00 H new ATOM 0 HG SER A 721 -13.559 1.057 4.054 1.00 0.00 H new ATOM 215 N ARG A 722 -10.374 -2.082 2.888 1.00 0.00 N ATOM 216 CA ARG A 722 -9.588 -2.995 3.723 1.00 0.00 C ATOM 217 C ARG A 722 -8.102 -2.839 3.434 1.00 0.00 C ATOM 218 O ARG A 722 -7.268 -2.869 4.340 1.00 0.00 O ATOM 219 CB ARG A 722 -10.028 -4.453 3.521 1.00 0.00 C ATOM 220 CG ARG A 722 -11.434 -4.758 4.017 1.00 0.00 C ATOM 221 CD ARG A 722 -11.534 -4.557 5.512 1.00 0.00 C ATOM 222 NE ARG A 722 -12.881 -4.792 6.030 1.00 0.00 N ATOM 223 CZ ARG A 722 -13.225 -4.644 7.311 1.00 0.00 C ATOM 224 NH1 ARG A 722 -12.304 -4.314 8.217 1.00 0.00 N ATOM 225 NH2 ARG A 722 -14.483 -4.835 7.684 1.00 0.00 N ATOM 0 H ARG A 722 -10.983 -2.548 2.215 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.768 -2.733 4.766 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -9.970 -4.694 2.460 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -9.324 -5.107 4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -12.151 -4.112 3.510 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -11.698 -5.785 3.766 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -10.836 -5.229 6.011 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -11.228 -3.540 5.758 1.00 0.00 H new ATOM 0 HE ARG A 722 -13.602 -5.087 5.372 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -11.335 -4.174 7.931 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -12.569 -4.201 9.196 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -15.186 -5.095 6.992 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -14.747 -4.722 8.663 1.00 0.00 H new ATOM 239 N ILE A 723 -7.780 -2.668 2.180 1.00 0.00 N ATOM 240 CA ILE A 723 -6.401 -2.430 1.773 1.00 0.00 C ATOM 241 C ILE A 723 -5.924 -1.039 2.223 1.00 0.00 C ATOM 242 O ILE A 723 -4.818 -0.888 2.739 1.00 0.00 O ATOM 243 CB ILE A 723 -6.199 -2.633 0.239 1.00 0.00 C ATOM 244 CG1 ILE A 723 -6.042 -4.118 -0.125 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.013 -1.845 -0.288 1.00 0.00 C ATOM 246 CD1 ILE A 723 -7.222 -5.019 0.180 1.00 0.00 C ATOM 0 H ILE A 723 -8.450 -2.687 1.411 1.00 0.00 H new ATOM 0 HA ILE A 723 -5.783 -3.175 2.274 1.00 0.00 H new ATOM 0 HB ILE A 723 -7.102 -2.253 -0.239 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -5.827 -4.187 -1.191 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -5.171 -4.508 0.401 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -4.910 -2.016 -1.360 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -5.171 -0.782 -0.104 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -4.105 -2.170 0.220 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -6.988 -6.040 -0.122 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -7.430 -4.996 1.250 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -8.097 -4.670 -0.368 1.00 0.00 H new ATOM 258 N SER A 724 -6.759 -0.045 2.032 1.00 0.00 N ATOM 259 CA SER A 724 -6.450 1.314 2.486 1.00 0.00 C ATOM 260 C SER A 724 -6.264 1.343 4.008 1.00 0.00 C ATOM 261 O SER A 724 -5.418 2.073 4.527 1.00 0.00 O ATOM 262 CB SER A 724 -7.545 2.297 2.058 1.00 0.00 C ATOM 263 OG SER A 724 -7.696 2.300 0.647 1.00 0.00 O ATOM 0 H SER A 724 -7.661 -0.140 1.566 1.00 0.00 H new ATOM 0 HA SER A 724 -5.516 1.624 2.017 1.00 0.00 H new ATOM 0 HB2 SER A 724 -8.489 2.024 2.529 1.00 0.00 H new ATOM 0 HB3 SER A 724 -7.295 3.300 2.404 1.00 0.00 H new ATOM 0 HG SER A 724 -8.126 1.467 0.362 1.00 0.00 H new ATOM 269 N ASN A 725 -7.042 0.518 4.706 1.00 0.00 N ATOM 270 CA ASN A 725 -6.947 0.377 6.152 1.00 0.00 C ATOM 271 C ASN A 725 -5.574 -0.184 6.499 1.00 0.00 C ATOM 272 O ASN A 725 -4.928 0.288 7.394 1.00 0.00 O ATOM 273 CB ASN A 725 -8.045 -0.557 6.668 1.00 0.00 C ATOM 274 CG ASN A 725 -8.203 -0.506 8.172 1.00 0.00 C ATOM 275 OD1 ASN A 725 -7.983 0.536 8.794 1.00 0.00 O ATOM 276 ND2 ASN A 725 -8.598 -1.600 8.758 1.00 0.00 N ATOM 0 H ASN A 725 -7.757 -0.072 4.281 1.00 0.00 H new ATOM 0 HA ASN A 725 -7.078 1.350 6.625 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -8.992 -0.290 6.199 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -7.817 -1.579 6.366 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -8.736 -1.616 9.768 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -8.769 -2.441 8.206 1.00 0.00 H new ATOM 283 N LEU A 726 -5.143 -1.180 5.740 1.00 0.00 N ATOM 284 CA LEU A 726 -3.801 -1.755 5.851 1.00 0.00 C ATOM 285 C LEU A 726 -2.733 -0.673 5.695 1.00 0.00 C ATOM 286 O LEU A 726 -1.811 -0.587 6.511 1.00 0.00 O ATOM 287 CB LEU A 726 -3.687 -2.944 4.825 1.00 0.00 C ATOM 288 CG LEU A 726 -2.318 -3.439 4.290 1.00 0.00 C ATOM 289 CD1 LEU A 726 -1.735 -2.547 3.222 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.350 -3.592 5.379 1.00 0.00 C ATOM 0 H LEU A 726 -5.717 -1.620 5.021 1.00 0.00 H new ATOM 0 HA LEU A 726 -3.627 -2.169 6.844 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -4.174 -3.804 5.285 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -4.283 -2.667 3.955 1.00 0.00 H new ATOM 0 HG LEU A 726 -2.516 -4.408 3.833 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -0.778 -2.952 2.893 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -2.419 -2.498 2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -1.586 -1.546 3.626 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.400 -3.940 4.975 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -1.204 -2.632 5.874 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.725 -4.318 6.100 1.00 0.00 H new ATOM 302 N ILE A 727 -2.889 0.167 4.695 1.00 0.00 N ATOM 303 CA ILE A 727 -1.952 1.246 4.447 1.00 0.00 C ATOM 304 C ILE A 727 -1.890 2.209 5.613 1.00 0.00 C ATOM 305 O ILE A 727 -0.800 2.502 6.128 1.00 0.00 O ATOM 306 CB ILE A 727 -2.247 1.981 3.095 1.00 0.00 C ATOM 307 CG1 ILE A 727 -1.763 1.131 1.917 1.00 0.00 C ATOM 308 CG2 ILE A 727 -1.641 3.387 3.040 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.263 0.858 1.952 1.00 0.00 C ATOM 0 H ILE A 727 -3.664 0.124 4.033 1.00 0.00 H new ATOM 0 HA ILE A 727 -0.964 0.796 4.349 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.327 2.109 3.026 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.299 0.182 1.917 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.012 1.638 0.985 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -1.877 3.848 2.081 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -2.055 3.993 3.846 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -0.559 3.322 3.154 1.00 0.00 H new ATOM 0 HD11 ILE A 727 0.017 0.251 1.091 1.00 0.00 H new ATOM 0 HD12 ILE A 727 0.280 1.803 1.922 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.012 0.325 2.869 1.00 0.00 H new ATOM 321 N VAL A 728 -3.041 2.648 6.067 1.00 0.00 N ATOM 322 CA VAL A 728 -3.080 3.581 7.149 1.00 0.00 C ATOM 323 C VAL A 728 -2.600 2.935 8.467 1.00 0.00 C ATOM 324 O VAL A 728 -1.854 3.552 9.202 1.00 0.00 O ATOM 325 CB VAL A 728 -4.468 4.299 7.288 1.00 0.00 C ATOM 326 CG1 VAL A 728 -5.592 3.336 7.552 1.00 0.00 C ATOM 327 CG2 VAL A 728 -4.444 5.359 8.350 1.00 0.00 C ATOM 0 H VAL A 728 -3.952 2.372 5.702 1.00 0.00 H new ATOM 0 HA VAL A 728 -2.373 4.375 6.910 1.00 0.00 H new ATOM 0 HB VAL A 728 -4.654 4.774 6.325 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -6.529 3.886 7.640 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -5.664 2.626 6.728 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -5.399 2.797 8.480 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -5.424 5.832 8.414 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.196 4.907 9.310 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -3.695 6.110 8.098 1.00 0.00 H new ATOM 337 N LEU A 729 -2.979 1.676 8.709 1.00 0.00 N ATOM 338 CA LEU A 729 -2.570 0.940 9.912 1.00 0.00 C ATOM 339 C LEU A 729 -1.074 0.729 9.979 1.00 0.00 C ATOM 340 O LEU A 729 -0.454 1.029 11.004 1.00 0.00 O ATOM 341 CB LEU A 729 -3.283 -0.403 10.013 1.00 0.00 C ATOM 342 CG LEU A 729 -4.743 -0.354 10.432 1.00 0.00 C ATOM 343 CD1 LEU A 729 -5.389 -1.695 10.180 1.00 0.00 C ATOM 344 CD2 LEU A 729 -4.853 -0.011 11.909 1.00 0.00 C ATOM 0 H LEU A 729 -3.576 1.139 8.080 1.00 0.00 H new ATOM 0 HA LEU A 729 -2.860 1.561 10.759 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -3.220 -0.899 9.044 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -2.742 -1.026 10.725 1.00 0.00 H new ATOM 0 HG LEU A 729 -5.251 0.413 9.848 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -6.436 -1.657 10.481 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -5.325 -1.936 9.119 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -4.873 -2.462 10.758 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -5.904 0.021 12.198 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -4.338 -0.770 12.498 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -4.396 0.962 12.092 1.00 0.00 H new ATOM 356 N HIS A 730 -0.493 0.230 8.892 1.00 0.00 N ATOM 357 CA HIS A 730 0.937 -0.034 8.856 1.00 0.00 C ATOM 358 C HIS A 730 1.689 1.253 9.098 1.00 0.00 C ATOM 359 O HIS A 730 2.490 1.347 10.019 1.00 0.00 O ATOM 360 CB HIS A 730 1.367 -0.654 7.509 1.00 0.00 C ATOM 361 CG HIS A 730 2.813 -1.117 7.477 1.00 0.00 C ATOM 362 ND1 HIS A 730 3.821 -0.516 6.736 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.400 -2.166 8.104 1.00 0.00 C ATOM 364 CE1 HIS A 730 4.948 -1.205 6.935 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.748 -2.216 7.758 1.00 0.00 N ATOM 0 H HIS A 730 -0.989 0.002 8.030 1.00 0.00 H new ATOM 0 HA HIS A 730 1.172 -0.754 9.639 1.00 0.00 H new ATOM 0 HB2 HIS A 730 0.719 -1.502 7.288 1.00 0.00 H new ATOM 0 HB3 HIS A 730 1.213 0.079 6.717 1.00 0.00 H new ATOM 0 HD2 HIS A 730 2.900 -2.855 8.768 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.898 -0.966 6.481 1.00 0.00 H new ATOM 0 HE2 HIS A 730 5.439 -2.895 8.076 1.00 0.00 H new ATOM 373 N LEU A 731 1.376 2.257 8.307 1.00 0.00 N ATOM 374 CA LEU A 731 2.038 3.532 8.413 1.00 0.00 C ATOM 375 C LEU A 731 1.857 4.174 9.797 1.00 0.00 C ATOM 376 O LEU A 731 2.846 4.589 10.384 1.00 0.00 O ATOM 377 CB LEU A 731 1.644 4.433 7.211 1.00 0.00 C ATOM 378 CG LEU A 731 2.161 5.905 7.107 1.00 0.00 C ATOM 379 CD1 LEU A 731 1.511 6.839 8.114 1.00 0.00 C ATOM 380 CD2 LEU A 731 3.674 5.970 7.217 1.00 0.00 C ATOM 0 H LEU A 731 0.662 2.210 7.580 1.00 0.00 H new ATOM 0 HA LEU A 731 3.116 3.386 8.344 1.00 0.00 H new ATOM 0 HB2 LEU A 731 1.965 3.917 6.306 1.00 0.00 H new ATOM 0 HB3 LEU A 731 0.555 4.474 7.186 1.00 0.00 H new ATOM 0 HG LEU A 731 1.867 6.255 6.118 1.00 0.00 H new ATOM 0 HD11 LEU A 731 1.913 7.845 7.990 1.00 0.00 H new ATOM 0 HD12 LEU A 731 0.433 6.856 7.951 1.00 0.00 H new ATOM 0 HD13 LEU A 731 1.720 6.487 9.124 1.00 0.00 H new ATOM 0 HD21 LEU A 731 4.000 7.007 7.141 1.00 0.00 H new ATOM 0 HD22 LEU A 731 3.987 5.561 8.178 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.123 5.388 6.412 1.00 0.00 H new ATOM 392 N ARG A 732 0.622 4.194 10.343 1.00 0.00 N ATOM 393 CA ARG A 732 0.389 4.835 11.660 1.00 0.00 C ATOM 394 C ARG A 732 1.195 4.176 12.769 1.00 0.00 C ATOM 395 O ARG A 732 1.676 4.855 13.684 1.00 0.00 O ATOM 396 CB ARG A 732 -1.103 4.934 12.058 1.00 0.00 C ATOM 397 CG ARG A 732 -1.829 3.615 12.190 1.00 0.00 C ATOM 398 CD ARG A 732 -3.254 3.785 12.701 1.00 0.00 C ATOM 399 NE ARG A 732 -4.017 4.806 11.962 1.00 0.00 N ATOM 400 CZ ARG A 732 -5.352 4.938 11.997 1.00 0.00 C ATOM 401 NH1 ARG A 732 -6.098 4.073 12.667 1.00 0.00 N ATOM 402 NH2 ARG A 732 -5.933 5.948 11.370 1.00 0.00 N ATOM 0 H ARG A 732 -0.207 3.788 9.910 1.00 0.00 H new ATOM 0 HA ARG A 732 0.743 5.858 11.535 1.00 0.00 H new ATOM 0 HB2 ARG A 732 -1.173 5.464 13.008 1.00 0.00 H new ATOM 0 HB3 ARG A 732 -1.620 5.541 11.315 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -1.851 3.117 11.221 1.00 0.00 H new ATOM 0 HG3 ARG A 732 -1.277 2.966 12.870 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -3.775 2.830 12.631 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -3.225 4.056 13.756 1.00 0.00 H new ATOM 0 HE ARG A 732 -3.492 5.460 11.381 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -5.659 3.297 13.163 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -7.112 4.182 12.687 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -5.366 6.626 10.860 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -6.948 6.049 11.396 1.00 0.00 H new ATOM 416 N LYS A 733 1.352 2.869 12.686 1.00 0.00 N ATOM 417 CA LYS A 733 2.148 2.157 13.652 1.00 0.00 C ATOM 418 C LYS A 733 3.611 2.457 13.444 1.00 0.00 C ATOM 419 O LYS A 733 4.294 2.912 14.351 1.00 0.00 O ATOM 420 CB LYS A 733 1.910 0.655 13.570 1.00 0.00 C ATOM 421 CG LYS A 733 0.529 0.215 14.016 1.00 0.00 C ATOM 422 CD LYS A 733 0.315 -1.302 13.890 1.00 0.00 C ATOM 423 CE LYS A 733 1.154 -2.163 14.871 1.00 0.00 C ATOM 424 NZ LYS A 733 2.622 -2.186 14.592 1.00 0.00 N ATOM 0 H LYS A 733 0.938 2.285 11.960 1.00 0.00 H new ATOM 0 HA LYS A 733 1.848 2.494 14.644 1.00 0.00 H new ATOM 0 HB2 LYS A 733 2.067 0.330 12.542 1.00 0.00 H new ATOM 0 HB3 LYS A 733 2.655 0.147 14.182 1.00 0.00 H new ATOM 0 HG2 LYS A 733 0.375 0.514 15.053 1.00 0.00 H new ATOM 0 HG3 LYS A 733 -0.222 0.734 13.420 1.00 0.00 H new ATOM 0 HD2 LYS A 733 -0.741 -1.520 14.050 1.00 0.00 H new ATOM 0 HD3 LYS A 733 0.552 -1.604 12.870 1.00 0.00 H new ATOM 0 HE2 LYS A 733 0.997 -1.791 15.883 1.00 0.00 H new ATOM 0 HE3 LYS A 733 0.778 -3.186 14.846 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 2.983 -3.154 14.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 2.795 -1.869 13.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 3.111 -1.551 15.255 1.00 0.00 H new ATOM 438 N VAL A 734 4.071 2.272 12.223 1.00 0.00 N ATOM 439 CA VAL A 734 5.467 2.439 11.895 1.00 0.00 C ATOM 440 C VAL A 734 5.968 3.875 12.128 1.00 0.00 C ATOM 441 O VAL A 734 7.094 4.065 12.560 1.00 0.00 O ATOM 442 CB VAL A 734 5.781 1.986 10.453 1.00 0.00 C ATOM 443 CG1 VAL A 734 7.237 2.178 10.150 1.00 0.00 C ATOM 444 CG2 VAL A 734 5.401 0.536 10.249 1.00 0.00 C ATOM 0 H VAL A 734 3.486 2.002 11.433 1.00 0.00 H new ATOM 0 HA VAL A 734 6.009 1.790 12.583 1.00 0.00 H new ATOM 0 HB VAL A 734 5.192 2.599 9.771 1.00 0.00 H new ATOM 0 HG11 VAL A 734 7.442 1.854 9.130 1.00 0.00 H new ATOM 0 HG12 VAL A 734 7.495 3.232 10.255 1.00 0.00 H new ATOM 0 HG13 VAL A 734 7.834 1.588 10.845 1.00 0.00 H new ATOM 0 HG21 VAL A 734 5.632 0.240 9.226 1.00 0.00 H new ATOM 0 HG22 VAL A 734 5.963 -0.089 10.943 1.00 0.00 H new ATOM 0 HG23 VAL A 734 4.334 0.410 10.431 1.00 0.00 H new ATOM 454 N GLU A 735 5.144 4.871 11.872 1.00 0.00 N ATOM 455 CA GLU A 735 5.566 6.258 12.091 1.00 0.00 C ATOM 456 C GLU A 735 5.711 6.556 13.588 1.00 0.00 C ATOM 457 O GLU A 735 6.517 7.384 13.995 1.00 0.00 O ATOM 458 CB GLU A 735 4.614 7.265 11.428 1.00 0.00 C ATOM 459 CG GLU A 735 3.211 7.219 11.972 1.00 0.00 C ATOM 460 CD GLU A 735 2.296 8.272 11.390 1.00 0.00 C ATOM 461 OE1 GLU A 735 2.794 9.321 10.900 1.00 0.00 O ATOM 462 OE2 GLU A 735 1.053 8.092 11.455 1.00 0.00 O ATOM 0 H GLU A 735 4.194 4.760 11.518 1.00 0.00 H new ATOM 0 HA GLU A 735 6.541 6.373 11.617 1.00 0.00 H new ATOM 0 HB2 GLU A 735 5.013 8.271 11.561 1.00 0.00 H new ATOM 0 HB3 GLU A 735 4.585 7.073 10.356 1.00 0.00 H new ATOM 0 HG2 GLU A 735 2.787 6.234 11.776 1.00 0.00 H new ATOM 0 HG3 GLU A 735 3.247 7.340 13.055 1.00 0.00 H new ATOM 469 N GLU A 736 4.939 5.862 14.390 1.00 0.00 N ATOM 470 CA GLU A 736 4.948 6.046 15.819 1.00 0.00 C ATOM 471 C GLU A 736 6.078 5.217 16.447 1.00 0.00 C ATOM 472 O GLU A 736 6.747 5.651 17.387 1.00 0.00 O ATOM 473 CB GLU A 736 3.586 5.629 16.370 1.00 0.00 C ATOM 474 CG GLU A 736 3.351 5.954 17.826 1.00 0.00 C ATOM 475 CD GLU A 736 1.967 5.561 18.262 1.00 0.00 C ATOM 476 OE1 GLU A 736 0.985 6.181 17.800 1.00 0.00 O ATOM 477 OE2 GLU A 736 1.828 4.639 19.080 1.00 0.00 O ATOM 0 H GLU A 736 4.284 5.150 14.066 1.00 0.00 H new ATOM 0 HA GLU A 736 5.128 7.092 16.066 1.00 0.00 H new ATOM 0 HB2 GLU A 736 2.809 6.112 15.777 1.00 0.00 H new ATOM 0 HB3 GLU A 736 3.470 4.554 16.232 1.00 0.00 H new ATOM 0 HG2 GLU A 736 4.088 5.435 18.439 1.00 0.00 H new ATOM 0 HG3 GLU A 736 3.496 7.022 17.989 1.00 0.00 H new ATOM 484 N GLU A 737 6.282 4.036 15.908 1.00 0.00 N ATOM 485 CA GLU A 737 7.306 3.124 16.378 1.00 0.00 C ATOM 486 C GLU A 737 8.697 3.512 15.886 1.00 0.00 C ATOM 487 O GLU A 737 9.629 3.616 16.682 1.00 0.00 O ATOM 488 CB GLU A 737 6.972 1.688 15.959 1.00 0.00 C ATOM 489 CG GLU A 737 5.745 1.120 16.657 1.00 0.00 C ATOM 490 CD GLU A 737 5.315 -0.223 16.114 1.00 0.00 C ATOM 491 OE1 GLU A 737 6.074 -1.214 16.229 1.00 0.00 O ATOM 492 OE2 GLU A 737 4.207 -0.323 15.579 1.00 0.00 O ATOM 0 H GLU A 737 5.738 3.676 15.124 1.00 0.00 H new ATOM 0 HA GLU A 737 7.321 3.187 17.466 1.00 0.00 H new ATOM 0 HB2 GLU A 737 6.812 1.661 14.881 1.00 0.00 H new ATOM 0 HB3 GLU A 737 7.829 1.048 16.170 1.00 0.00 H new ATOM 0 HG2 GLU A 737 5.954 1.023 17.722 1.00 0.00 H new ATOM 0 HG3 GLU A 737 4.920 1.825 16.557 1.00 0.00 H new ATOM 499 N GLU A 738 8.831 3.758 14.599 1.00 0.00 N ATOM 500 CA GLU A 738 10.138 3.998 14.014 1.00 0.00 C ATOM 501 C GLU A 738 10.220 5.311 13.231 1.00 0.00 C ATOM 502 O GLU A 738 10.793 6.302 13.701 1.00 0.00 O ATOM 503 CB GLU A 738 10.507 2.873 13.051 1.00 0.00 C ATOM 504 CG GLU A 738 10.499 1.480 13.626 1.00 0.00 C ATOM 505 CD GLU A 738 10.800 0.472 12.564 1.00 0.00 C ATOM 506 OE1 GLU A 738 9.931 0.195 11.740 1.00 0.00 O ATOM 507 OE2 GLU A 738 11.945 -0.025 12.493 1.00 0.00 O ATOM 0 H GLU A 738 8.055 3.797 13.938 1.00 0.00 H new ATOM 0 HA GLU A 738 10.827 4.049 14.857 1.00 0.00 H new ATOM 0 HB2 GLU A 738 9.815 2.901 12.209 1.00 0.00 H new ATOM 0 HB3 GLU A 738 11.502 3.074 12.653 1.00 0.00 H new ATOM 0 HG2 GLU A 738 11.237 1.406 14.425 1.00 0.00 H new ATOM 0 HG3 GLU A 738 9.526 1.269 14.070 1.00 0.00 H new ATOM 514 N ASP A 739 9.614 5.323 12.045 1.00 0.00 N ATOM 515 CA ASP A 739 9.849 6.406 11.092 1.00 0.00 C ATOM 516 C ASP A 739 8.638 6.722 10.189 1.00 0.00 C ATOM 517 O ASP A 739 7.836 7.577 10.552 1.00 0.00 O ATOM 518 CB ASP A 739 11.124 6.098 10.293 1.00 0.00 C ATOM 519 CG ASP A 739 11.440 7.066 9.189 1.00 0.00 C ATOM 520 OD1 ASP A 739 11.619 8.279 9.461 1.00 0.00 O ATOM 521 OD2 ASP A 739 11.531 6.618 8.032 1.00 0.00 O ATOM 0 H ASP A 739 8.965 4.605 11.724 1.00 0.00 H new ATOM 0 HA ASP A 739 9.993 7.326 11.658 1.00 0.00 H new ATOM 0 HB2 ASP A 739 11.968 6.071 10.983 1.00 0.00 H new ATOM 0 HB3 ASP A 739 11.032 5.100 9.864 1.00 0.00 H new ATOM 526 N GLU A 740 8.485 6.019 9.041 1.00 0.00 N ATOM 527 CA GLU A 740 7.360 6.283 8.094 1.00 0.00 C ATOM 528 C GLU A 740 7.174 5.196 7.052 1.00 0.00 C ATOM 529 O GLU A 740 7.259 5.432 5.852 1.00 0.00 O ATOM 530 CB GLU A 740 7.408 7.689 7.460 1.00 0.00 C ATOM 531 CG GLU A 740 8.762 8.094 6.889 1.00 0.00 C ATOM 532 CD GLU A 740 8.741 9.457 6.255 1.00 0.00 C ATOM 533 OE1 GLU A 740 8.213 10.415 6.872 1.00 0.00 O ATOM 534 OE2 GLU A 740 9.267 9.616 5.134 1.00 0.00 O ATOM 0 H GLU A 740 9.114 5.273 8.745 1.00 0.00 H new ATOM 0 HA GLU A 740 6.468 6.259 8.720 1.00 0.00 H new ATOM 0 HB2 GLU A 740 6.666 7.737 6.663 1.00 0.00 H new ATOM 0 HB3 GLU A 740 7.115 8.421 8.213 1.00 0.00 H new ATOM 0 HG2 GLU A 740 9.506 8.080 7.685 1.00 0.00 H new ATOM 0 HG3 GLU A 740 9.074 7.358 6.148 1.00 0.00 H new ATOM 541 N SER A 741 6.901 4.006 7.551 1.00 0.00 N ATOM 542 CA SER A 741 6.676 2.781 6.794 1.00 0.00 C ATOM 543 C SER A 741 7.966 2.353 6.134 1.00 0.00 C ATOM 544 O SER A 741 8.644 1.452 6.617 1.00 0.00 O ATOM 545 CB SER A 741 5.513 2.928 5.771 1.00 0.00 C ATOM 546 OG SER A 741 5.186 1.684 5.155 1.00 0.00 O ATOM 0 H SER A 741 6.825 3.855 8.557 1.00 0.00 H new ATOM 0 HA SER A 741 6.363 1.998 7.485 1.00 0.00 H new ATOM 0 HB2 SER A 741 4.633 3.325 6.277 1.00 0.00 H new ATOM 0 HB3 SER A 741 5.793 3.650 5.004 1.00 0.00 H new ATOM 0 HG SER A 741 4.698 1.122 5.792 1.00 0.00 H new ATOM 552 N ALA A 742 8.353 3.136 5.159 1.00 0.00 N ATOM 553 CA ALA A 742 9.515 2.909 4.269 1.00 0.00 C ATOM 554 C ALA A 742 9.733 1.405 3.896 1.00 0.00 C ATOM 555 O ALA A 742 8.804 0.581 3.974 1.00 0.00 O ATOM 556 CB ALA A 742 10.760 3.516 4.917 1.00 0.00 C ATOM 0 H ALA A 742 7.856 3.998 4.935 1.00 0.00 H new ATOM 0 HA ALA A 742 9.311 3.405 3.320 1.00 0.00 H new ATOM 0 HB1 ALA A 742 11.622 3.355 4.270 1.00 0.00 H new ATOM 0 HB2 ALA A 742 10.610 4.586 5.062 1.00 0.00 H new ATOM 0 HB3 ALA A 742 10.936 3.041 5.882 1.00 0.00 H new ATOM 562 N LEU A 743 10.945 1.097 3.423 1.00 0.00 N ATOM 563 CA LEU A 743 11.406 -0.278 3.174 1.00 0.00 C ATOM 564 C LEU A 743 10.686 -0.980 1.990 1.00 0.00 C ATOM 565 O LEU A 743 10.141 -0.319 1.092 1.00 0.00 O ATOM 566 CB LEU A 743 11.399 -1.144 4.478 1.00 0.00 C ATOM 567 CG LEU A 743 12.488 -0.865 5.549 1.00 0.00 C ATOM 568 CD1 LEU A 743 13.881 -0.976 4.959 1.00 0.00 C ATOM 569 CD2 LEU A 743 12.300 0.474 6.244 1.00 0.00 C ATOM 0 H LEU A 743 11.645 1.804 3.198 1.00 0.00 H new ATOM 0 HA LEU A 743 12.444 -0.184 2.855 1.00 0.00 H new ATOM 0 HB2 LEU A 743 10.426 -1.023 4.953 1.00 0.00 H new ATOM 0 HB3 LEU A 743 11.482 -2.190 4.184 1.00 0.00 H new ATOM 0 HG LEU A 743 12.374 -1.635 6.312 1.00 0.00 H new ATOM 0 HD11 LEU A 743 14.621 -0.775 5.733 1.00 0.00 H new ATOM 0 HD12 LEU A 743 14.031 -1.982 4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 743 13.994 -0.251 4.153 1.00 0.00 H new ATOM 0 HD21 LEU A 743 13.090 0.615 6.982 1.00 0.00 H new ATOM 0 HD22 LEU A 743 12.345 1.276 5.507 1.00 0.00 H new ATOM 0 HD23 LEU A 743 11.331 0.492 6.742 1.00 0.00 H new ATOM 581 N LYS A 744 10.735 -2.310 1.978 1.00 0.00 N ATOM 582 CA LYS A 744 10.249 -3.117 0.878 1.00 0.00 C ATOM 583 C LYS A 744 8.716 -3.143 0.817 1.00 0.00 C ATOM 584 O LYS A 744 8.062 -3.774 1.638 1.00 0.00 O ATOM 585 CB LYS A 744 10.804 -4.550 1.010 1.00 0.00 C ATOM 586 CG LYS A 744 10.434 -5.504 -0.129 1.00 0.00 C ATOM 587 CD LYS A 744 11.055 -5.102 -1.466 1.00 0.00 C ATOM 588 CE LYS A 744 12.582 -5.201 -1.446 1.00 0.00 C ATOM 589 NZ LYS A 744 13.172 -4.842 -2.746 1.00 0.00 N ATOM 0 H LYS A 744 11.120 -2.859 2.747 1.00 0.00 H new ATOM 0 HA LYS A 744 10.599 -2.668 -0.051 1.00 0.00 H new ATOM 0 HB2 LYS A 744 11.891 -4.496 1.078 1.00 0.00 H new ATOM 0 HB3 LYS A 744 10.447 -4.975 1.948 1.00 0.00 H new ATOM 0 HG2 LYS A 744 10.759 -6.512 0.128 1.00 0.00 H new ATOM 0 HG3 LYS A 744 9.349 -5.535 -0.232 1.00 0.00 H new ATOM 0 HD2 LYS A 744 10.661 -5.743 -2.255 1.00 0.00 H new ATOM 0 HD3 LYS A 744 10.762 -4.081 -1.709 1.00 0.00 H new ATOM 0 HE2 LYS A 744 12.978 -4.543 -0.673 1.00 0.00 H new ATOM 0 HE3 LYS A 744 12.877 -6.217 -1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 14.207 -4.922 -2.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 12.814 -5.486 -3.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 12.912 -3.864 -2.987 1.00 0.00 H new ATOM 603 N ARG A 745 8.170 -2.474 -0.189 1.00 0.00 N ATOM 604 CA ARG A 745 6.714 -2.415 -0.430 1.00 0.00 C ATOM 605 C ARG A 745 6.062 -3.806 -0.507 1.00 0.00 C ATOM 606 O ARG A 745 4.940 -4.004 -0.039 1.00 0.00 O ATOM 607 CB ARG A 745 6.405 -1.624 -1.713 1.00 0.00 C ATOM 608 CG ARG A 745 7.146 -2.114 -2.961 1.00 0.00 C ATOM 609 CD ARG A 745 6.661 -1.388 -4.199 1.00 0.00 C ATOM 610 NE ARG A 745 7.472 -1.680 -5.395 1.00 0.00 N ATOM 611 CZ ARG A 745 6.966 -1.933 -6.616 1.00 0.00 C ATOM 612 NH1 ARG A 745 5.713 -2.366 -6.752 1.00 0.00 N ATOM 613 NH2 ARG A 745 7.739 -1.846 -7.682 1.00 0.00 N ATOM 0 H ARG A 745 8.718 -1.950 -0.871 1.00 0.00 H new ATOM 0 HA ARG A 745 6.283 -1.902 0.430 1.00 0.00 H new ATOM 0 HB2 ARG A 745 5.333 -1.670 -1.902 1.00 0.00 H new ATOM 0 HB3 ARG A 745 6.655 -0.576 -1.547 1.00 0.00 H new ATOM 0 HG2 ARG A 745 8.217 -1.955 -2.838 1.00 0.00 H new ATOM 0 HG3 ARG A 745 6.994 -3.187 -3.081 1.00 0.00 H new ATOM 0 HD2 ARG A 745 5.625 -1.665 -4.393 1.00 0.00 H new ATOM 0 HD3 ARG A 745 6.674 -0.314 -4.012 1.00 0.00 H new ATOM 0 HE ARG A 745 8.486 -1.691 -5.290 1.00 0.00 H new ATOM 0 HH11 ARG A 745 5.130 -2.508 -5.927 1.00 0.00 H new ATOM 0 HH12 ARG A 745 5.337 -2.555 -7.681 1.00 0.00 H new ATOM 0 HH21 ARG A 745 8.720 -1.587 -7.581 1.00 0.00 H new ATOM 0 HH22 ARG A 745 7.355 -2.038 -8.607 1.00 0.00 H new ATOM 627 N SER A 746 6.785 -4.757 -1.059 1.00 0.00 N ATOM 628 CA SER A 746 6.308 -6.106 -1.249 1.00 0.00 C ATOM 629 C SER A 746 6.025 -6.804 0.105 1.00 0.00 C ATOM 630 O SER A 746 5.128 -7.644 0.207 1.00 0.00 O ATOM 631 CB SER A 746 7.370 -6.844 -2.029 1.00 0.00 C ATOM 632 OG SER A 746 7.862 -5.998 -3.073 1.00 0.00 O ATOM 0 H SER A 746 7.737 -4.609 -1.393 1.00 0.00 H new ATOM 0 HA SER A 746 5.363 -6.101 -1.792 1.00 0.00 H new ATOM 0 HB2 SER A 746 8.185 -7.137 -1.368 1.00 0.00 H new ATOM 0 HB3 SER A 746 6.957 -7.760 -2.451 1.00 0.00 H new ATOM 0 HG SER A 746 8.553 -6.473 -3.581 1.00 0.00 H new ATOM 638 N GLU A 747 6.762 -6.401 1.144 1.00 0.00 N ATOM 639 CA GLU A 747 6.623 -6.952 2.479 1.00 0.00 C ATOM 640 C GLU A 747 5.256 -6.607 3.049 1.00 0.00 C ATOM 641 O GLU A 747 4.663 -7.405 3.769 1.00 0.00 O ATOM 642 CB GLU A 747 7.747 -6.437 3.386 1.00 0.00 C ATOM 643 CG GLU A 747 7.713 -6.962 4.815 1.00 0.00 C ATOM 644 CD GLU A 747 8.899 -6.501 5.617 1.00 0.00 C ATOM 645 OE1 GLU A 747 9.978 -7.125 5.505 1.00 0.00 O ATOM 646 OE2 GLU A 747 8.794 -5.500 6.355 1.00 0.00 O ATOM 0 H GLU A 747 7.476 -5.676 1.073 1.00 0.00 H new ATOM 0 HA GLU A 747 6.704 -8.038 2.426 1.00 0.00 H new ATOM 0 HB2 GLU A 747 8.705 -6.704 2.940 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.701 -5.348 3.414 1.00 0.00 H new ATOM 0 HG2 GLU A 747 6.796 -6.629 5.301 1.00 0.00 H new ATOM 0 HG3 GLU A 747 7.688 -8.052 4.800 1.00 0.00 H new ATOM 653 N LEU A 748 4.737 -5.442 2.673 1.00 0.00 N ATOM 654 CA LEU A 748 3.421 -5.007 3.123 1.00 0.00 C ATOM 655 C LEU A 748 2.349 -5.962 2.632 1.00 0.00 C ATOM 656 O LEU A 748 1.479 -6.352 3.395 1.00 0.00 O ATOM 657 CB LEU A 748 3.096 -3.552 2.711 1.00 0.00 C ATOM 658 CG LEU A 748 3.807 -2.411 3.484 1.00 0.00 C ATOM 659 CD1 LEU A 748 5.318 -2.428 3.297 1.00 0.00 C ATOM 660 CD2 LEU A 748 3.237 -1.060 3.080 1.00 0.00 C ATOM 0 H LEU A 748 5.210 -4.782 2.056 1.00 0.00 H new ATOM 0 HA LEU A 748 3.437 -5.023 4.213 1.00 0.00 H new ATOM 0 HB2 LEU A 748 3.335 -3.441 1.653 1.00 0.00 H new ATOM 0 HB3 LEU A 748 2.020 -3.407 2.812 1.00 0.00 H new ATOM 0 HG LEU A 748 3.617 -2.580 4.544 1.00 0.00 H new ATOM 0 HD11 LEU A 748 5.764 -1.608 3.860 1.00 0.00 H new ATOM 0 HD12 LEU A 748 5.719 -3.375 3.657 1.00 0.00 H new ATOM 0 HD13 LEU A 748 5.555 -2.313 2.239 1.00 0.00 H new ATOM 0 HD21 LEU A 748 3.747 -0.270 3.632 1.00 0.00 H new ATOM 0 HD22 LEU A 748 3.384 -0.908 2.011 1.00 0.00 H new ATOM 0 HD23 LEU A 748 2.171 -1.032 3.308 1.00 0.00 H new ATOM 672 N VAL A 749 2.450 -6.376 1.368 1.00 0.00 N ATOM 673 CA VAL A 749 1.513 -7.349 0.804 1.00 0.00 C ATOM 674 C VAL A 749 1.719 -8.670 1.503 1.00 0.00 C ATOM 675 O VAL A 749 0.770 -9.318 1.914 1.00 0.00 O ATOM 676 CB VAL A 749 1.751 -7.591 -0.712 1.00 0.00 C ATOM 677 CG1 VAL A 749 0.686 -8.517 -1.296 1.00 0.00 C ATOM 678 CG2 VAL A 749 1.800 -6.297 -1.472 1.00 0.00 C ATOM 0 H VAL A 749 3.167 -6.055 0.718 1.00 0.00 H new ATOM 0 HA VAL A 749 0.507 -6.952 0.942 1.00 0.00 H new ATOM 0 HB VAL A 749 2.720 -8.079 -0.815 1.00 0.00 H new ATOM 0 HG11 VAL A 749 0.878 -8.668 -2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 749 0.717 -9.477 -0.781 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -0.298 -8.067 -1.166 1.00 0.00 H new ATOM 0 HG21 VAL A 749 1.968 -6.502 -2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 749 0.855 -5.768 -1.351 1.00 0.00 H new ATOM 0 HG23 VAL A 749 2.613 -5.680 -1.089 1.00 0.00 H new ATOM 688 N ASN A 750 2.987 -9.011 1.664 1.00 0.00 N ATOM 689 CA ASN A 750 3.435 -10.272 2.254 1.00 0.00 C ATOM 690 C ASN A 750 2.750 -10.519 3.591 1.00 0.00 C ATOM 691 O ASN A 750 1.969 -11.471 3.736 1.00 0.00 O ATOM 692 CB ASN A 750 4.963 -10.235 2.459 1.00 0.00 C ATOM 693 CG ASN A 750 5.547 -11.583 2.857 1.00 0.00 C ATOM 694 OD1 ASN A 750 5.044 -12.635 2.463 1.00 0.00 O ATOM 695 ND2 ASN A 750 6.594 -11.562 3.646 1.00 0.00 N ATOM 0 H ASN A 750 3.758 -8.405 1.382 1.00 0.00 H new ATOM 0 HA ASN A 750 3.172 -11.082 1.574 1.00 0.00 H new ATOM 0 HB2 ASN A 750 5.439 -9.898 1.538 1.00 0.00 H new ATOM 0 HB3 ASN A 750 5.202 -9.501 3.229 1.00 0.00 H new ATOM 0 HD21 ASN A 750 7.019 -12.437 3.953 1.00 0.00 H new ATOM 0 HD22 ASN A 750 6.984 -10.671 3.952 1.00 0.00 H new ATOM 702 N TRP A 751 2.960 -9.616 4.540 1.00 0.00 N ATOM 703 CA TRP A 751 2.381 -9.788 5.851 1.00 0.00 C ATOM 704 C TRP A 751 0.864 -9.597 5.812 1.00 0.00 C ATOM 705 O TRP A 751 0.143 -10.163 6.641 1.00 0.00 O ATOM 706 CB TRP A 751 3.058 -8.929 6.959 1.00 0.00 C ATOM 707 CG TRP A 751 2.794 -7.451 6.905 1.00 0.00 C ATOM 708 CD1 TRP A 751 3.604 -6.485 6.401 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.630 -6.784 7.396 1.00 0.00 C ATOM 710 NE1 TRP A 751 3.009 -5.257 6.545 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.787 -5.425 7.140 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.462 -7.220 8.017 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.818 -4.500 7.482 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.491 -6.304 8.343 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.315 -4.962 8.075 1.00 0.00 C ATOM 0 H TRP A 751 3.520 -8.771 4.423 1.00 0.00 H new ATOM 0 HA TRP A 751 2.583 -10.820 6.139 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.729 -9.301 7.930 1.00 0.00 H new ATOM 0 HB3 TRP A 751 4.135 -9.087 6.905 1.00 0.00 H new ATOM 0 HD1 TRP A 751 4.572 -6.657 5.954 1.00 0.00 H new ATOM 0 HE1 TRP A 751 3.411 -4.365 6.256 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.315 -8.267 8.236 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 0.956 -3.447 7.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.402 -6.634 8.820 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -1.094 -4.263 8.342 1.00 0.00 H new ATOM 726 N TYR A 752 0.381 -8.785 4.859 1.00 0.00 N ATOM 727 CA TYR A 752 -1.046 -8.529 4.721 1.00 0.00 C ATOM 728 C TYR A 752 -1.767 -9.816 4.408 1.00 0.00 C ATOM 729 O TYR A 752 -2.783 -10.133 5.006 1.00 0.00 O ATOM 730 CB TYR A 752 -1.331 -7.508 3.615 1.00 0.00 C ATOM 731 CG TYR A 752 -2.789 -7.116 3.526 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.459 -6.674 4.658 1.00 0.00 C ATOM 733 CD2 TYR A 752 -3.499 -7.164 2.317 1.00 0.00 C ATOM 734 CE1 TYR A 752 -4.774 -6.299 4.605 1.00 0.00 C ATOM 735 CE2 TYR A 752 -4.810 -6.790 2.266 1.00 0.00 C ATOM 736 CZ TYR A 752 -5.448 -6.354 3.416 1.00 0.00 C ATOM 737 OH TYR A 752 -6.766 -5.972 3.375 1.00 0.00 O ATOM 0 H TYR A 752 0.963 -8.299 4.177 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.403 -8.119 5.665 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -0.732 -6.615 3.791 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.014 -7.921 2.658 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -2.932 -6.625 5.600 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -3.003 -7.500 1.418 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.278 -5.961 5.499 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -5.349 -6.834 1.331 1.00 0.00 H new ATOM 0 HH TYR A 752 -6.929 -5.287 4.056 1.00 0.00 H new ATOM 747 N LEU A 753 -1.208 -10.571 3.506 1.00 0.00 N ATOM 748 CA LEU A 753 -1.774 -11.836 3.107 1.00 0.00 C ATOM 749 C LEU A 753 -1.731 -12.785 4.268 1.00 0.00 C ATOM 750 O LEU A 753 -2.639 -13.570 4.474 1.00 0.00 O ATOM 751 CB LEU A 753 -0.999 -12.403 1.947 1.00 0.00 C ATOM 752 CG LEU A 753 -0.896 -11.502 0.733 1.00 0.00 C ATOM 753 CD1 LEU A 753 -0.001 -12.132 -0.292 1.00 0.00 C ATOM 754 CD2 LEU A 753 -2.274 -11.178 0.158 1.00 0.00 C ATOM 0 H LEU A 753 -0.343 -10.329 3.022 1.00 0.00 H new ATOM 0 HA LEU A 753 -2.809 -11.690 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 753 0.008 -12.643 2.287 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -1.465 -13.341 1.644 1.00 0.00 H new ATOM 0 HG LEU A 753 -0.455 -10.553 1.039 1.00 0.00 H new ATOM 0 HD11 LEU A 753 0.070 -11.480 -1.163 1.00 0.00 H new ATOM 0 HD12 LEU A 753 0.992 -12.279 0.133 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -0.413 -13.095 -0.592 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -2.162 -10.530 -0.711 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -2.771 -12.102 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -2.874 -10.671 0.914 1.00 0.00 H new ATOM 766 N LYS A 754 -0.671 -12.681 5.027 1.00 0.00 N ATOM 767 CA LYS A 754 -0.489 -13.474 6.241 1.00 0.00 C ATOM 768 C LYS A 754 -1.552 -13.151 7.304 1.00 0.00 C ATOM 769 O LYS A 754 -1.857 -13.977 8.162 1.00 0.00 O ATOM 770 CB LYS A 754 0.909 -13.265 6.820 1.00 0.00 C ATOM 771 CG LYS A 754 2.039 -13.616 5.876 1.00 0.00 C ATOM 772 CD LYS A 754 1.903 -15.022 5.371 1.00 0.00 C ATOM 773 CE LYS A 754 3.018 -15.379 4.401 1.00 0.00 C ATOM 774 NZ LYS A 754 2.988 -16.808 4.024 1.00 0.00 N ATOM 0 H LYS A 754 0.101 -12.044 4.830 1.00 0.00 H new ATOM 0 HA LYS A 754 -0.606 -14.520 5.959 1.00 0.00 H new ATOM 0 HB2 LYS A 754 1.013 -12.222 7.118 1.00 0.00 H new ATOM 0 HB3 LYS A 754 1.008 -13.866 7.724 1.00 0.00 H new ATOM 0 HG2 LYS A 754 2.043 -12.923 5.035 1.00 0.00 H new ATOM 0 HG3 LYS A 754 2.994 -13.501 6.388 1.00 0.00 H new ATOM 0 HD2 LYS A 754 1.917 -15.714 6.213 1.00 0.00 H new ATOM 0 HD3 LYS A 754 0.939 -15.140 4.877 1.00 0.00 H new ATOM 0 HE2 LYS A 754 2.929 -14.766 3.504 1.00 0.00 H new ATOM 0 HE3 LYS A 754 3.981 -15.144 4.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 3.764 -17.009 3.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 3.099 -17.394 4.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 2.079 -17.028 3.569 1.00 0.00 H new ATOM 788 N GLU A 755 -2.068 -11.945 7.293 1.00 0.00 N ATOM 789 CA GLU A 755 -3.127 -11.608 8.245 1.00 0.00 C ATOM 790 C GLU A 755 -4.486 -12.006 7.735 1.00 0.00 C ATOM 791 O GLU A 755 -5.253 -12.690 8.420 1.00 0.00 O ATOM 792 CB GLU A 755 -3.155 -10.149 8.748 1.00 0.00 C ATOM 793 CG GLU A 755 -3.442 -9.065 7.724 1.00 0.00 C ATOM 794 CD GLU A 755 -4.059 -7.833 8.348 1.00 0.00 C ATOM 795 OE1 GLU A 755 -3.339 -6.994 8.894 1.00 0.00 O ATOM 796 OE2 GLU A 755 -5.303 -7.699 8.322 1.00 0.00 O ATOM 0 H GLU A 755 -1.791 -11.194 6.661 1.00 0.00 H new ATOM 0 HA GLU A 755 -2.867 -12.203 9.121 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -3.906 -10.078 9.534 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -2.191 -9.932 9.208 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -2.515 -8.789 7.221 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -4.114 -9.458 6.961 1.00 0.00 H new ATOM 803 N ILE A 756 -4.769 -11.623 6.507 1.00 0.00 N ATOM 804 CA ILE A 756 -6.076 -11.826 5.930 1.00 0.00 C ATOM 805 C ILE A 756 -6.328 -13.254 5.589 1.00 0.00 C ATOM 806 O ILE A 756 -7.443 -13.624 5.279 1.00 0.00 O ATOM 807 CB ILE A 756 -6.358 -10.896 4.710 1.00 0.00 C ATOM 808 CG1 ILE A 756 -5.286 -11.007 3.603 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.506 -9.461 5.160 1.00 0.00 C ATOM 810 CD1 ILE A 756 -5.411 -12.207 2.675 1.00 0.00 C ATOM 0 H ILE A 756 -4.102 -11.165 5.886 1.00 0.00 H new ATOM 0 HA ILE A 756 -6.784 -11.543 6.709 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.296 -11.236 4.271 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -5.320 -10.100 2.999 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -4.305 -11.039 4.076 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -6.702 -8.827 4.295 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -7.336 -9.384 5.863 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.587 -9.136 5.647 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -4.608 -12.183 1.939 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -5.342 -13.126 3.257 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -6.373 -12.173 2.163 1.00 0.00 H new ATOM 822 N GLU A 757 -5.303 -14.070 5.687 1.00 0.00 N ATOM 823 CA GLU A 757 -5.437 -15.481 5.357 1.00 0.00 C ATOM 824 C GLU A 757 -6.420 -16.174 6.306 1.00 0.00 C ATOM 825 O GLU A 757 -7.049 -17.168 5.954 1.00 0.00 O ATOM 826 CB GLU A 757 -4.089 -16.183 5.356 1.00 0.00 C ATOM 827 CG GLU A 757 -3.412 -16.285 6.702 1.00 0.00 C ATOM 828 CD GLU A 757 -2.153 -17.096 6.622 1.00 0.00 C ATOM 829 OE1 GLU A 757 -1.115 -16.555 6.227 1.00 0.00 O ATOM 830 OE2 GLU A 757 -2.199 -18.313 6.911 1.00 0.00 O ATOM 0 H GLU A 757 -4.371 -13.789 5.990 1.00 0.00 H new ATOM 0 HA GLU A 757 -5.840 -15.547 4.346 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -4.222 -17.189 4.958 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -3.424 -15.655 4.673 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -3.180 -15.286 7.071 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -4.094 -16.739 7.420 1.00 0.00 H new ATOM 837 N SER A 758 -6.583 -15.599 7.479 1.00 0.00 N ATOM 838 CA SER A 758 -7.472 -16.118 8.475 1.00 0.00 C ATOM 839 C SER A 758 -8.945 -15.792 8.134 1.00 0.00 C ATOM 840 O SER A 758 -9.854 -16.504 8.558 1.00 0.00 O ATOM 841 CB SER A 758 -7.077 -15.551 9.846 1.00 0.00 C ATOM 842 OG SER A 758 -7.889 -16.050 10.892 1.00 0.00 O ATOM 0 H SER A 758 -6.093 -14.750 7.762 1.00 0.00 H new ATOM 0 HA SER A 758 -7.386 -17.204 8.501 1.00 0.00 H new ATOM 0 HB2 SER A 758 -6.035 -15.796 10.051 1.00 0.00 H new ATOM 0 HB3 SER A 758 -7.150 -14.464 9.821 1.00 0.00 H new ATOM 0 HG SER A 758 -7.599 -15.663 11.744 1.00 0.00 H new ATOM 848 N GLU A 759 -9.185 -14.749 7.335 1.00 0.00 N ATOM 849 CA GLU A 759 -10.564 -14.366 7.017 1.00 0.00 C ATOM 850 C GLU A 759 -10.993 -14.966 5.691 1.00 0.00 C ATOM 851 O GLU A 759 -12.149 -14.861 5.300 1.00 0.00 O ATOM 852 CB GLU A 759 -10.766 -12.826 6.999 1.00 0.00 C ATOM 853 CG GLU A 759 -9.964 -12.082 5.937 1.00 0.00 C ATOM 854 CD GLU A 759 -10.273 -10.602 5.879 1.00 0.00 C ATOM 855 OE1 GLU A 759 -9.740 -9.832 6.717 1.00 0.00 O ATOM 856 OE2 GLU A 759 -11.041 -10.172 4.979 1.00 0.00 O ATOM 0 H GLU A 759 -8.465 -14.168 6.906 1.00 0.00 H new ATOM 0 HA GLU A 759 -11.193 -14.765 7.813 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -11.825 -12.616 6.847 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -10.500 -12.429 7.978 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -8.901 -12.216 6.135 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.165 -12.526 4.962 1.00 0.00 H new ATOM 863 N ILE A 760 -10.057 -15.602 5.012 1.00 0.00 N ATOM 864 CA ILE A 760 -10.314 -16.179 3.704 1.00 0.00 C ATOM 865 C ILE A 760 -11.235 -17.382 3.815 1.00 0.00 C ATOM 866 O ILE A 760 -10.862 -18.417 4.360 1.00 0.00 O ATOM 867 CB ILE A 760 -8.995 -16.600 2.994 1.00 0.00 C ATOM 868 CG1 ILE A 760 -8.052 -15.406 2.819 1.00 0.00 C ATOM 869 CG2 ILE A 760 -9.256 -17.284 1.664 1.00 0.00 C ATOM 870 CD1 ILE A 760 -8.652 -14.233 2.066 1.00 0.00 C ATOM 0 H ILE A 760 -9.103 -15.733 5.348 1.00 0.00 H new ATOM 0 HA ILE A 760 -10.799 -15.408 3.105 1.00 0.00 H new ATOM 0 HB ILE A 760 -8.505 -17.327 3.642 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -7.733 -15.064 3.804 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -7.158 -15.740 2.293 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -8.307 -17.560 1.204 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -9.855 -18.180 1.827 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -9.794 -16.603 1.004 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -7.914 -13.434 1.990 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -8.945 -14.554 1.066 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -9.529 -13.867 2.601 1.00 0.00 H new ATOM 882 N ASP A 761 -12.438 -17.216 3.335 1.00 0.00 N ATOM 883 CA ASP A 761 -13.410 -18.299 3.301 1.00 0.00 C ATOM 884 C ASP A 761 -13.167 -19.204 2.107 1.00 0.00 C ATOM 885 O ASP A 761 -13.304 -20.419 2.197 1.00 0.00 O ATOM 886 CB ASP A 761 -14.831 -17.734 3.230 1.00 0.00 C ATOM 887 CG ASP A 761 -15.872 -18.789 2.902 1.00 0.00 C ATOM 888 OD1 ASP A 761 -16.341 -19.496 3.814 1.00 0.00 O ATOM 889 OD2 ASP A 761 -16.237 -18.918 1.714 1.00 0.00 O ATOM 0 H ASP A 761 -12.781 -16.333 2.955 1.00 0.00 H new ATOM 0 HA ASP A 761 -13.297 -18.882 4.215 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -15.080 -17.270 4.184 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -14.867 -16.949 2.475 1.00 0.00 H new ATOM 894 N SER A 762 -12.760 -18.605 1.015 1.00 0.00 N ATOM 895 CA SER A 762 -12.610 -19.277 -0.236 1.00 0.00 C ATOM 896 C SER A 762 -11.480 -18.648 -1.015 1.00 0.00 C ATOM 897 O SER A 762 -11.155 -17.479 -0.797 1.00 0.00 O ATOM 898 CB SER A 762 -13.920 -19.191 -1.018 1.00 0.00 C ATOM 899 OG SER A 762 -14.961 -19.944 -0.395 1.00 0.00 O ATOM 0 H SER A 762 -12.520 -17.614 0.979 1.00 0.00 H new ATOM 0 HA SER A 762 -12.372 -20.327 -0.067 1.00 0.00 H new ATOM 0 HB2 SER A 762 -14.226 -18.148 -1.101 1.00 0.00 H new ATOM 0 HB3 SER A 762 -13.763 -19.559 -2.032 1.00 0.00 H new ATOM 0 HG SER A 762 -15.462 -19.365 0.217 1.00 0.00 H new ATOM 905 N GLU A 763 -10.900 -19.421 -1.919 1.00 0.00 N ATOM 906 CA GLU A 763 -9.768 -19.029 -2.751 1.00 0.00 C ATOM 907 C GLU A 763 -10.009 -17.686 -3.449 1.00 0.00 C ATOM 908 O GLU A 763 -9.093 -16.866 -3.544 1.00 0.00 O ATOM 909 CB GLU A 763 -9.499 -20.136 -3.771 1.00 0.00 C ATOM 910 CG GLU A 763 -8.350 -19.874 -4.714 1.00 0.00 C ATOM 911 CD GLU A 763 -8.215 -20.955 -5.745 1.00 0.00 C ATOM 912 OE1 GLU A 763 -8.995 -20.968 -6.707 1.00 0.00 O ATOM 913 OE2 GLU A 763 -7.321 -21.813 -5.619 1.00 0.00 O ATOM 0 H GLU A 763 -11.214 -20.374 -2.102 1.00 0.00 H new ATOM 0 HA GLU A 763 -8.894 -18.895 -2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -9.303 -21.064 -3.234 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -10.403 -20.293 -4.360 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -8.499 -18.915 -5.211 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -7.424 -19.797 -4.145 1.00 0.00 H new ATOM 920 N GLU A 764 -11.252 -17.446 -3.866 1.00 0.00 N ATOM 921 CA GLU A 764 -11.618 -16.190 -4.532 1.00 0.00 C ATOM 922 C GLU A 764 -11.320 -14.971 -3.673 1.00 0.00 C ATOM 923 O GLU A 764 -10.898 -13.942 -4.187 1.00 0.00 O ATOM 924 CB GLU A 764 -13.075 -16.170 -4.965 1.00 0.00 C ATOM 925 CG GLU A 764 -13.386 -17.092 -6.119 1.00 0.00 C ATOM 926 CD GLU A 764 -14.779 -16.920 -6.647 1.00 0.00 C ATOM 927 OE1 GLU A 764 -15.712 -17.557 -6.117 1.00 0.00 O ATOM 928 OE2 GLU A 764 -14.966 -16.158 -7.627 1.00 0.00 O ATOM 0 H GLU A 764 -12.024 -18.103 -3.756 1.00 0.00 H new ATOM 0 HA GLU A 764 -10.994 -16.140 -5.424 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -13.700 -16.445 -4.115 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -13.346 -15.152 -5.244 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -12.673 -16.911 -6.924 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -13.250 -18.125 -5.799 1.00 0.00 H new ATOM 935 N GLU A 765 -11.513 -15.108 -2.379 1.00 0.00 N ATOM 936 CA GLU A 765 -11.243 -14.036 -1.428 1.00 0.00 C ATOM 937 C GLU A 765 -9.762 -13.723 -1.391 1.00 0.00 C ATOM 938 O GLU A 765 -9.356 -12.557 -1.368 1.00 0.00 O ATOM 939 CB GLU A 765 -11.715 -14.423 -0.025 1.00 0.00 C ATOM 940 CG GLU A 765 -13.199 -14.651 0.080 1.00 0.00 C ATOM 941 CD GLU A 765 -13.967 -13.457 -0.393 1.00 0.00 C ATOM 942 OE1 GLU A 765 -14.014 -12.442 0.321 1.00 0.00 O ATOM 943 OE2 GLU A 765 -14.503 -13.498 -1.509 1.00 0.00 O ATOM 0 H GLU A 765 -11.862 -15.965 -1.950 1.00 0.00 H new ATOM 0 HA GLU A 765 -11.791 -13.152 -1.755 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -11.196 -15.330 0.285 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -11.428 -13.637 0.674 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -13.478 -15.523 -0.511 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -13.463 -14.870 1.115 1.00 0.00 H new ATOM 950 N LEU A 766 -8.962 -14.772 -1.414 1.00 0.00 N ATOM 951 CA LEU A 766 -7.524 -14.644 -1.376 1.00 0.00 C ATOM 952 C LEU A 766 -7.043 -13.968 -2.647 1.00 0.00 C ATOM 953 O LEU A 766 -6.318 -12.974 -2.595 1.00 0.00 O ATOM 954 CB LEU A 766 -6.872 -16.026 -1.218 1.00 0.00 C ATOM 955 CG LEU A 766 -5.339 -16.054 -1.143 1.00 0.00 C ATOM 956 CD1 LEU A 766 -4.833 -15.314 0.091 1.00 0.00 C ATOM 957 CD2 LEU A 766 -4.834 -17.486 -1.153 1.00 0.00 C ATOM 0 H LEU A 766 -9.294 -15.735 -1.460 1.00 0.00 H new ATOM 0 HA LEU A 766 -7.238 -14.033 -0.520 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -7.267 -16.488 -0.313 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -7.184 -16.649 -2.056 1.00 0.00 H new ATOM 0 HG LEU A 766 -4.949 -15.541 -2.022 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -3.744 -15.351 0.116 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -5.160 -14.275 0.052 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -5.233 -15.786 0.988 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -3.745 -17.488 -1.099 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -5.241 -18.021 -0.295 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -5.153 -17.978 -2.072 1.00 0.00 H new ATOM 969 N ILE A 767 -7.499 -14.493 -3.777 1.00 0.00 N ATOM 970 CA ILE A 767 -7.152 -13.965 -5.094 1.00 0.00 C ATOM 971 C ILE A 767 -7.551 -12.496 -5.198 1.00 0.00 C ATOM 972 O ILE A 767 -6.762 -11.657 -5.651 1.00 0.00 O ATOM 973 CB ILE A 767 -7.845 -14.771 -6.225 1.00 0.00 C ATOM 974 CG1 ILE A 767 -7.417 -16.242 -6.164 1.00 0.00 C ATOM 975 CG2 ILE A 767 -7.515 -14.176 -7.591 1.00 0.00 C ATOM 976 CD1 ILE A 767 -8.087 -17.125 -7.195 1.00 0.00 C ATOM 0 H ILE A 767 -8.122 -15.300 -3.808 1.00 0.00 H new ATOM 0 HA ILE A 767 -6.073 -14.059 -5.214 1.00 0.00 H new ATOM 0 HB ILE A 767 -8.924 -14.713 -6.080 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -6.337 -16.301 -6.298 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -7.636 -16.632 -5.170 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -8.011 -14.756 -8.370 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -7.861 -13.143 -7.631 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -6.437 -14.203 -7.749 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -7.730 -18.149 -7.084 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -9.167 -17.100 -7.049 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -7.847 -16.763 -8.195 1.00 0.00 H new ATOM 988 N ASN A 768 -8.758 -12.188 -4.738 1.00 0.00 N ATOM 989 CA ASN A 768 -9.257 -10.837 -4.746 1.00 0.00 C ATOM 990 C ASN A 768 -8.373 -9.925 -3.921 1.00 0.00 C ATOM 991 O ASN A 768 -7.922 -8.904 -4.410 1.00 0.00 O ATOM 992 CB ASN A 768 -10.705 -10.771 -4.240 1.00 0.00 C ATOM 993 CG ASN A 768 -11.143 -9.354 -3.959 1.00 0.00 C ATOM 994 OD1 ASN A 768 -11.630 -8.649 -4.839 1.00 0.00 O ATOM 995 ND2 ASN A 768 -10.985 -8.939 -2.721 1.00 0.00 N ATOM 0 H ASN A 768 -9.409 -12.872 -4.352 1.00 0.00 H new ATOM 0 HA ASN A 768 -9.242 -10.493 -5.780 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -11.369 -11.215 -4.982 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -10.799 -11.366 -3.332 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -11.272 -7.996 -2.459 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -10.576 -9.560 -2.023 1.00 0.00 H new ATOM 1002 N LYS A 769 -8.102 -10.325 -2.686 1.00 0.00 N ATOM 1003 CA LYS A 769 -7.319 -9.523 -1.757 1.00 0.00 C ATOM 1004 C LYS A 769 -5.957 -9.195 -2.377 1.00 0.00 C ATOM 1005 O LYS A 769 -5.539 -8.037 -2.398 1.00 0.00 O ATOM 1006 CB LYS A 769 -7.112 -10.301 -0.466 1.00 0.00 C ATOM 1007 CG LYS A 769 -6.726 -9.436 0.715 1.00 0.00 C ATOM 1008 CD LYS A 769 -7.928 -8.691 1.317 1.00 0.00 C ATOM 1009 CE LYS A 769 -8.878 -9.654 2.037 1.00 0.00 C ATOM 1010 NZ LYS A 769 -10.029 -8.964 2.655 1.00 0.00 N ATOM 0 H LYS A 769 -8.419 -11.215 -2.300 1.00 0.00 H new ATOM 0 HA LYS A 769 -7.852 -8.596 -1.545 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -8.029 -10.839 -0.226 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -6.336 -11.050 -0.625 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -6.267 -10.059 1.483 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -5.974 -8.712 0.401 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -7.575 -7.934 2.017 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -8.467 -8.168 0.527 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -9.243 -10.396 1.327 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -8.327 -10.194 2.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -10.273 -9.430 3.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -9.781 -7.971 2.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -10.845 -9.005 2.011 1.00 0.00 H new ATOM 1024 N LYS A 770 -5.314 -10.227 -2.924 1.00 0.00 N ATOM 1025 CA LYS A 770 -4.018 -10.117 -3.585 1.00 0.00 C ATOM 1026 C LYS A 770 -4.056 -9.150 -4.761 1.00 0.00 C ATOM 1027 O LYS A 770 -3.195 -8.278 -4.883 1.00 0.00 O ATOM 1028 CB LYS A 770 -3.546 -11.493 -4.066 1.00 0.00 C ATOM 1029 CG LYS A 770 -3.272 -12.477 -2.942 1.00 0.00 C ATOM 1030 CD LYS A 770 -2.985 -13.880 -3.451 1.00 0.00 C ATOM 1031 CE LYS A 770 -1.764 -13.932 -4.355 1.00 0.00 C ATOM 1032 NZ LYS A 770 -1.464 -15.317 -4.762 1.00 0.00 N ATOM 0 H LYS A 770 -5.687 -11.176 -2.919 1.00 0.00 H new ATOM 0 HA LYS A 770 -3.315 -9.724 -2.850 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -4.302 -11.914 -4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -2.638 -11.369 -4.656 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -2.423 -12.126 -2.356 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -4.131 -12.506 -2.272 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -2.834 -14.547 -2.602 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -3.853 -14.250 -3.996 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -1.936 -13.319 -5.240 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -0.905 -13.508 -3.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -0.626 -15.324 -5.378 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -1.277 -15.894 -3.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -2.277 -15.711 -5.278 1.00 0.00 H new ATOM 1046 N ARG A 771 -5.054 -9.280 -5.611 1.00 0.00 N ATOM 1047 CA ARG A 771 -5.126 -8.428 -6.779 1.00 0.00 C ATOM 1048 C ARG A 771 -5.527 -6.993 -6.407 1.00 0.00 C ATOM 1049 O ARG A 771 -5.112 -6.043 -7.072 1.00 0.00 O ATOM 1050 CB ARG A 771 -6.025 -9.020 -7.883 1.00 0.00 C ATOM 1051 CG ARG A 771 -7.502 -9.087 -7.554 1.00 0.00 C ATOM 1052 CD ARG A 771 -8.288 -9.833 -8.626 1.00 0.00 C ATOM 1053 NE ARG A 771 -8.126 -9.246 -9.970 1.00 0.00 N ATOM 1054 CZ ARG A 771 -9.065 -9.238 -10.923 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -10.288 -9.676 -10.669 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -8.774 -8.777 -12.138 1.00 0.00 N ATOM 0 H ARG A 771 -5.813 -9.955 -5.518 1.00 0.00 H new ATOM 0 HA ARG A 771 -4.122 -8.380 -7.200 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -5.899 -8.426 -8.788 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -5.675 -10.027 -8.111 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -7.638 -9.583 -6.593 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -7.897 -8.077 -7.451 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -7.965 -10.874 -8.648 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -9.345 -9.833 -8.360 1.00 0.00 H new ATOM 0 HE ARG A 771 -7.229 -8.813 -10.189 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -10.522 -10.024 -9.739 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -10.996 -9.665 -11.403 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -7.836 -8.431 -12.341 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -9.489 -8.770 -12.866 1.00 0.00 H new ATOM 1070 N ILE A 772 -6.306 -6.836 -5.333 1.00 0.00 N ATOM 1071 CA ILE A 772 -6.700 -5.512 -4.853 1.00 0.00 C ATOM 1072 C ILE A 772 -5.500 -4.769 -4.288 1.00 0.00 C ATOM 1073 O ILE A 772 -5.229 -3.644 -4.703 1.00 0.00 O ATOM 1074 CB ILE A 772 -7.846 -5.555 -3.789 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -9.144 -6.119 -4.390 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -8.107 -4.163 -3.194 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -9.740 -5.284 -5.504 1.00 0.00 C ATOM 0 H ILE A 772 -6.675 -7.610 -4.781 1.00 0.00 H new ATOM 0 HA ILE A 772 -7.091 -4.980 -5.720 1.00 0.00 H new ATOM 0 HB ILE A 772 -7.517 -6.218 -2.989 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -8.947 -7.121 -4.771 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -9.883 -6.220 -3.595 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -8.909 -4.226 -2.458 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -7.200 -3.797 -2.712 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -8.398 -3.476 -3.989 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -10.652 -5.758 -5.866 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -9.974 -4.288 -5.127 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -9.024 -5.203 -6.321 1.00 0.00 H new ATOM 1089 N ILE A 773 -4.763 -5.411 -3.373 1.00 0.00 N ATOM 1090 CA ILE A 773 -3.587 -4.779 -2.762 1.00 0.00 C ATOM 1091 C ILE A 773 -2.560 -4.410 -3.846 1.00 0.00 C ATOM 1092 O ILE A 773 -1.991 -3.321 -3.835 1.00 0.00 O ATOM 1093 CB ILE A 773 -2.948 -5.658 -1.608 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -1.729 -4.980 -0.970 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -2.583 -7.049 -2.070 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.044 -3.696 -0.253 1.00 0.00 C ATOM 0 H ILE A 773 -4.957 -6.356 -3.042 1.00 0.00 H new ATOM 0 HA ILE A 773 -3.920 -3.861 -2.278 1.00 0.00 H new ATOM 0 HB ILE A 773 -3.725 -5.751 -0.850 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -1.269 -5.673 -0.266 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -0.991 -4.778 -1.747 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -2.150 -7.606 -1.239 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -3.478 -7.561 -2.424 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -1.858 -6.984 -2.881 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.129 -3.281 0.169 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -2.475 -2.983 -0.956 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -2.757 -3.892 0.548 1.00 0.00 H new ATOM 1108 N GLU A 774 -2.403 -5.301 -4.810 1.00 0.00 N ATOM 1109 CA GLU A 774 -1.527 -5.094 -5.940 1.00 0.00 C ATOM 1110 C GLU A 774 -1.983 -3.888 -6.776 1.00 0.00 C ATOM 1111 O GLU A 774 -1.172 -3.031 -7.118 1.00 0.00 O ATOM 1112 CB GLU A 774 -1.494 -6.358 -6.782 1.00 0.00 C ATOM 1113 CG GLU A 774 -0.620 -6.291 -8.009 1.00 0.00 C ATOM 1114 CD GLU A 774 -0.567 -7.612 -8.699 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -1.485 -7.921 -9.485 1.00 0.00 O ATOM 1116 OE2 GLU A 774 0.374 -8.388 -8.432 1.00 0.00 O ATOM 0 H GLU A 774 -2.888 -6.198 -4.826 1.00 0.00 H new ATOM 0 HA GLU A 774 -0.522 -4.877 -5.579 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -1.152 -7.183 -6.157 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -2.512 -6.595 -7.093 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -1.004 -5.534 -8.693 1.00 0.00 H new ATOM 0 HG3 GLU A 774 0.387 -5.983 -7.727 1.00 0.00 H new ATOM 1123 N LYS A 775 -3.285 -3.814 -7.077 1.00 0.00 N ATOM 1124 CA LYS A 775 -3.820 -2.688 -7.853 1.00 0.00 C ATOM 1125 C LYS A 775 -3.648 -1.378 -7.123 1.00 0.00 C ATOM 1126 O LYS A 775 -3.336 -0.369 -7.736 1.00 0.00 O ATOM 1127 CB LYS A 775 -5.291 -2.874 -8.249 1.00 0.00 C ATOM 1128 CG LYS A 775 -5.526 -3.880 -9.367 1.00 0.00 C ATOM 1129 CD LYS A 775 -6.999 -3.932 -9.777 1.00 0.00 C ATOM 1130 CE LYS A 775 -7.891 -4.500 -8.680 1.00 0.00 C ATOM 1131 NZ LYS A 775 -9.321 -4.423 -9.045 1.00 0.00 N ATOM 0 H LYS A 775 -3.979 -4.509 -6.800 1.00 0.00 H new ATOM 0 HA LYS A 775 -3.235 -2.663 -8.772 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -5.853 -3.190 -7.370 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -5.695 -1.909 -8.556 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -4.916 -3.614 -10.231 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -5.203 -4.869 -9.041 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -7.337 -2.928 -10.032 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -7.101 -4.541 -10.675 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -7.619 -5.538 -8.491 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -7.722 -3.952 -7.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -9.755 -3.603 -8.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -9.411 -4.320 -10.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -9.804 -5.292 -8.740 1.00 0.00 H new ATOM 1145 N VAL A 776 -3.831 -1.403 -5.817 1.00 0.00 N ATOM 1146 CA VAL A 776 -3.661 -0.211 -5.017 1.00 0.00 C ATOM 1147 C VAL A 776 -2.209 0.250 -5.044 1.00 0.00 C ATOM 1148 O VAL A 776 -1.946 1.409 -5.272 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.179 -0.395 -3.565 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -3.877 0.831 -2.704 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -5.677 -0.644 -3.589 1.00 0.00 C ATOM 0 H VAL A 776 -4.097 -2.235 -5.290 1.00 0.00 H new ATOM 0 HA VAL A 776 -4.275 0.572 -5.462 1.00 0.00 H new ATOM 0 HB VAL A 776 -3.665 -1.250 -3.127 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -4.253 0.668 -1.694 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -2.800 0.994 -2.668 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -4.362 1.707 -3.135 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -6.041 -0.773 -2.570 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -6.180 0.207 -4.049 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -5.887 -1.545 -4.166 1.00 0.00 H new ATOM 1161 N ILE A 777 -1.275 -0.675 -4.880 1.00 0.00 N ATOM 1162 CA ILE A 777 0.149 -0.338 -4.933 1.00 0.00 C ATOM 1163 C ILE A 777 0.537 0.151 -6.336 1.00 0.00 C ATOM 1164 O ILE A 777 1.294 1.123 -6.485 1.00 0.00 O ATOM 1165 CB ILE A 777 1.036 -1.536 -4.505 1.00 0.00 C ATOM 1166 CG1 ILE A 777 0.736 -1.889 -3.049 1.00 0.00 C ATOM 1167 CG2 ILE A 777 2.528 -1.215 -4.686 1.00 0.00 C ATOM 1168 CD1 ILE A 777 1.440 -3.123 -2.563 1.00 0.00 C ATOM 0 H ILE A 777 -1.471 -1.661 -4.710 1.00 0.00 H new ATOM 0 HA ILE A 777 0.324 0.470 -4.223 1.00 0.00 H new ATOM 0 HB ILE A 777 0.805 -2.390 -5.142 1.00 0.00 H new ATOM 0 HG12 ILE A 777 1.020 -1.048 -2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -0.339 -2.027 -2.933 1.00 0.00 H new ATOM 0 HG21 ILE A 777 3.125 -2.073 -4.378 1.00 0.00 H new ATOM 0 HG22 ILE A 777 2.728 -0.992 -5.734 1.00 0.00 H new ATOM 0 HG23 ILE A 777 2.791 -0.352 -4.075 1.00 0.00 H new ATOM 0 HD11 ILE A 777 1.176 -3.306 -1.522 1.00 0.00 H new ATOM 0 HD12 ILE A 777 1.138 -3.977 -3.170 1.00 0.00 H new ATOM 0 HD13 ILE A 777 2.518 -2.983 -2.644 1.00 0.00 H new ATOM 1180 N HIS A 778 -0.003 -0.498 -7.352 1.00 0.00 N ATOM 1181 CA HIS A 778 0.226 -0.093 -8.729 1.00 0.00 C ATOM 1182 C HIS A 778 -0.326 1.316 -8.971 1.00 0.00 C ATOM 1183 O HIS A 778 0.297 2.131 -9.656 1.00 0.00 O ATOM 1184 CB HIS A 778 -0.390 -1.117 -9.721 1.00 0.00 C ATOM 1185 CG HIS A 778 -0.369 -0.671 -11.162 1.00 0.00 C ATOM 1186 ND1 HIS A 778 0.781 -0.500 -11.899 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -1.391 -0.277 -11.962 1.00 0.00 C ATOM 1188 CE1 HIS A 778 0.437 -0.002 -13.092 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -0.878 0.148 -13.183 1.00 0.00 N ATOM 0 H HIS A 778 -0.607 -1.313 -7.249 1.00 0.00 H new ATOM 0 HA HIS A 778 1.301 -0.071 -8.906 1.00 0.00 H new ATOM 0 HB2 HIS A 778 0.151 -2.059 -9.636 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -1.421 -1.314 -9.428 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -2.437 -0.291 -11.694 1.00 0.00 H new ATOM 0 HE1 HIS A 778 1.137 0.245 -13.877 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -1.404 0.502 -13.982 1.00 0.00 H new ATOM 1197 N ARG A 779 -1.465 1.598 -8.388 1.00 0.00 N ATOM 1198 CA ARG A 779 -2.095 2.875 -8.555 1.00 0.00 C ATOM 1199 C ARG A 779 -1.297 3.944 -7.803 1.00 0.00 C ATOM 1200 O ARG A 779 -0.969 4.995 -8.354 1.00 0.00 O ATOM 1201 CB ARG A 779 -3.514 2.845 -8.022 1.00 0.00 C ATOM 1202 CG ARG A 779 -4.388 3.934 -8.588 1.00 0.00 C ATOM 1203 CD ARG A 779 -5.660 4.080 -7.807 1.00 0.00 C ATOM 1204 NE ARG A 779 -5.446 4.840 -6.577 1.00 0.00 N ATOM 1205 CZ ARG A 779 -6.357 5.062 -5.637 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -7.549 4.457 -5.699 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -6.078 5.898 -4.650 1.00 0.00 N ATOM 0 H ARG A 779 -1.976 0.950 -7.788 1.00 0.00 H new ATOM 0 HA ARG A 779 -2.122 3.111 -9.619 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -3.959 1.877 -8.250 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -3.489 2.937 -6.936 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -3.845 4.879 -8.580 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -4.623 3.710 -9.629 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -6.410 4.580 -8.420 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -6.054 3.094 -7.563 1.00 0.00 H new ATOM 0 HE ARG A 779 -4.517 5.234 -6.428 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -7.760 3.823 -6.470 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -8.247 4.630 -4.975 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -5.171 6.364 -4.617 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -6.770 6.077 -3.922 1.00 0.00 H new ATOM 1221 N LEU A 780 -0.966 3.620 -6.563 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.220 4.459 -5.626 1.00 0.00 C ATOM 1223 C LEU A 780 1.064 4.983 -6.268 1.00 0.00 C ATOM 1224 O LEU A 780 1.360 6.197 -6.237 1.00 0.00 O ATOM 1225 CB LEU A 780 0.088 3.585 -4.367 1.00 0.00 C ATOM 1226 CG LEU A 780 0.807 4.197 -3.141 1.00 0.00 C ATOM 1227 CD1 LEU A 780 0.656 3.257 -1.959 1.00 0.00 C ATOM 1228 CD2 LEU A 780 2.287 4.380 -3.395 1.00 0.00 C ATOM 0 H LEU A 780 -1.222 2.719 -6.158 1.00 0.00 H new ATOM 0 HA LEU A 780 -0.804 5.335 -5.343 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -0.862 3.183 -4.015 1.00 0.00 H new ATOM 0 HB3 LEU A 780 0.688 2.739 -4.702 1.00 0.00 H new ATOM 0 HG LEU A 780 0.356 5.170 -2.944 1.00 0.00 H new ATOM 0 HD11 LEU A 780 1.160 3.681 -1.090 1.00 0.00 H new ATOM 0 HD12 LEU A 780 -0.402 3.122 -1.734 1.00 0.00 H new ATOM 0 HD13 LEU A 780 1.101 2.292 -2.202 1.00 0.00 H new ATOM 0 HD21 LEU A 780 2.757 4.812 -2.512 1.00 0.00 H new ATOM 0 HD22 LEU A 780 2.741 3.413 -3.612 1.00 0.00 H new ATOM 0 HD23 LEU A 780 2.431 5.047 -4.245 1.00 0.00 H new ATOM 1240 N THR A 781 1.786 4.077 -6.874 1.00 0.00 N ATOM 1241 CA THR A 781 3.078 4.357 -7.446 1.00 0.00 C ATOM 1242 C THR A 781 2.989 5.177 -8.751 1.00 0.00 C ATOM 1243 O THR A 781 3.926 5.896 -9.099 1.00 0.00 O ATOM 1244 CB THR A 781 3.835 3.020 -7.699 1.00 0.00 C ATOM 1245 OG1 THR A 781 2.966 2.108 -8.395 1.00 0.00 O ATOM 1246 CG2 THR A 781 4.269 2.365 -6.388 1.00 0.00 C ATOM 0 H THR A 781 1.488 3.108 -6.986 1.00 0.00 H new ATOM 0 HA THR A 781 3.627 4.969 -6.730 1.00 0.00 H new ATOM 0 HB THR A 781 4.723 3.244 -8.290 1.00 0.00 H new ATOM 0 HG1 THR A 781 2.431 1.606 -7.745 1.00 0.00 H new ATOM 0 HG21 THR A 781 4.794 1.434 -6.603 1.00 0.00 H new ATOM 0 HG22 THR A 781 4.932 3.039 -5.846 1.00 0.00 H new ATOM 0 HG23 THR A 781 3.390 2.153 -5.779 1.00 0.00 H new ATOM 1254 N HIS A 782 1.857 5.105 -9.432 1.00 0.00 N ATOM 1255 CA HIS A 782 1.732 5.725 -10.749 1.00 0.00 C ATOM 1256 C HIS A 782 0.797 6.929 -10.791 1.00 0.00 C ATOM 1257 O HIS A 782 1.152 7.974 -11.328 1.00 0.00 O ATOM 1258 CB HIS A 782 1.298 4.685 -11.796 1.00 0.00 C ATOM 1259 CG HIS A 782 2.344 3.657 -12.102 1.00 0.00 C ATOM 1260 ND1 HIS A 782 2.555 2.527 -11.352 1.00 0.00 N ATOM 1261 CD2 HIS A 782 3.253 3.616 -13.096 1.00 0.00 C ATOM 1262 CE1 HIS A 782 3.564 1.849 -11.892 1.00 0.00 C ATOM 1263 NE2 HIS A 782 4.030 2.468 -12.962 1.00 0.00 N ATOM 0 H HIS A 782 1.017 4.629 -9.102 1.00 0.00 H new ATOM 0 HA HIS A 782 2.725 6.106 -10.986 1.00 0.00 H new ATOM 0 HB2 HIS A 782 0.400 4.180 -11.441 1.00 0.00 H new ATOM 0 HB3 HIS A 782 1.030 5.202 -12.718 1.00 0.00 H new ATOM 0 HD1 HIS A 782 2.028 2.254 -10.522 1.00 0.00 H new ATOM 0 HD2 HIS A 782 3.362 4.357 -13.874 1.00 0.00 H new ATOM 0 HE1 HIS A 782 3.951 0.917 -11.507 1.00 0.00 H new ATOM 1271 N TYR A 783 -0.374 6.799 -10.230 1.00 0.00 N ATOM 1272 CA TYR A 783 -1.398 7.827 -10.354 1.00 0.00 C ATOM 1273 C TYR A 783 -1.378 8.729 -9.147 1.00 0.00 C ATOM 1274 O TYR A 783 -1.170 9.938 -9.273 1.00 0.00 O ATOM 1275 CB TYR A 783 -2.795 7.194 -10.492 1.00 0.00 C ATOM 1276 CG TYR A 783 -2.918 6.157 -11.590 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -2.425 4.886 -11.395 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -3.538 6.437 -12.798 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -2.529 3.914 -12.347 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -3.647 5.461 -13.774 1.00 0.00 C ATOM 1281 CZ TYR A 783 -3.136 4.202 -13.536 1.00 0.00 C ATOM 1282 OH TYR A 783 -3.244 3.221 -14.492 1.00 0.00 O ATOM 0 H TYR A 783 -0.654 5.989 -9.677 1.00 0.00 H new ATOM 0 HA TYR A 783 -1.183 8.410 -11.250 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -3.064 6.731 -9.543 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -3.521 7.986 -10.677 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -1.941 4.651 -10.459 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -3.939 7.423 -12.979 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -2.135 2.926 -12.162 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -4.129 5.684 -14.715 1.00 0.00 H new ATOM 0 HH TYR A 783 -3.701 3.581 -15.280 1.00 0.00 H new ATOM 1292 N ASP A 784 -1.570 8.123 -7.978 1.00 0.00 N ATOM 1293 CA ASP A 784 -1.643 8.843 -6.690 1.00 0.00 C ATOM 1294 C ASP A 784 -0.432 9.725 -6.486 1.00 0.00 C ATOM 1295 O ASP A 784 -0.561 10.932 -6.221 1.00 0.00 O ATOM 1296 CB ASP A 784 -1.723 7.863 -5.511 1.00 0.00 C ATOM 1297 CG ASP A 784 -2.972 7.012 -5.484 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -3.129 6.141 -6.356 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -3.791 7.169 -4.567 1.00 0.00 O ATOM 0 H ASP A 784 -1.681 7.113 -7.887 1.00 0.00 H new ATOM 0 HA ASP A 784 -2.544 9.455 -6.725 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -0.853 7.207 -5.541 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -1.664 8.428 -4.581 1.00 0.00 H new ATOM 1304 N HIS A 785 0.751 9.108 -6.619 1.00 0.00 N ATOM 1305 CA HIS A 785 2.054 9.771 -6.441 1.00 0.00 C ATOM 1306 C HIS A 785 2.236 10.120 -4.956 1.00 0.00 C ATOM 1307 O HIS A 785 2.976 11.018 -4.569 1.00 0.00 O ATOM 1308 CB HIS A 785 2.199 11.013 -7.366 1.00 0.00 C ATOM 1309 CG HIS A 785 3.598 11.579 -7.459 1.00 0.00 C ATOM 1310 ND1 HIS A 785 4.012 12.727 -6.820 1.00 0.00 N ATOM 1311 CD2 HIS A 785 4.674 11.133 -8.153 1.00 0.00 C ATOM 1312 CE1 HIS A 785 5.292 12.942 -7.134 1.00 0.00 C ATOM 1313 NE2 HIS A 785 5.745 11.999 -7.945 1.00 0.00 N ATOM 0 H HIS A 785 0.832 8.119 -6.857 1.00 0.00 H new ATOM 0 HA HIS A 785 2.851 9.089 -6.738 1.00 0.00 H new ATOM 0 HB2 HIS A 785 1.865 10.742 -8.368 1.00 0.00 H new ATOM 0 HB3 HIS A 785 1.530 11.795 -7.007 1.00 0.00 H new ATOM 0 HD2 HIS A 785 4.697 10.247 -8.770 1.00 0.00 H new ATOM 0 HE1 HIS A 785 5.879 13.774 -6.774 1.00 0.00 H new ATOM 0 HE2 HIS A 785 6.684 11.922 -8.336 1.00 0.00 H new ATOM 1321 N VAL A 786 1.592 9.334 -4.123 1.00 0.00 N ATOM 1322 CA VAL A 786 1.711 9.474 -2.679 1.00 0.00 C ATOM 1323 C VAL A 786 2.897 8.646 -2.184 1.00 0.00 C ATOM 1324 O VAL A 786 3.079 8.428 -0.994 1.00 0.00 O ATOM 1325 CB VAL A 786 0.415 9.048 -1.950 1.00 0.00 C ATOM 1326 CG1 VAL A 786 -0.736 9.975 -2.311 1.00 0.00 C ATOM 1327 CG2 VAL A 786 0.061 7.609 -2.271 1.00 0.00 C ATOM 0 H VAL A 786 0.972 8.581 -4.420 1.00 0.00 H new ATOM 0 HA VAL A 786 1.877 10.527 -2.452 1.00 0.00 H new ATOM 0 HB VAL A 786 0.592 9.123 -0.877 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -1.637 9.657 -1.787 1.00 0.00 H new ATOM 0 HG12 VAL A 786 -0.487 10.995 -2.018 1.00 0.00 H new ATOM 0 HG13 VAL A 786 -0.909 9.938 -3.387 1.00 0.00 H new ATOM 0 HG21 VAL A 786 -0.854 7.334 -1.746 1.00 0.00 H new ATOM 0 HG22 VAL A 786 -0.091 7.503 -3.345 1.00 0.00 H new ATOM 0 HG23 VAL A 786 0.873 6.955 -1.953 1.00 0.00 H new ATOM 1337 N LEU A 787 3.669 8.190 -3.133 1.00 0.00 N ATOM 1338 CA LEU A 787 4.864 7.437 -2.905 1.00 0.00 C ATOM 1339 C LEU A 787 6.046 8.385 -2.825 1.00 0.00 C ATOM 1340 O LEU A 787 6.176 9.286 -3.655 1.00 0.00 O ATOM 1341 CB LEU A 787 5.092 6.525 -4.094 1.00 0.00 C ATOM 1342 CG LEU A 787 6.262 5.567 -3.998 1.00 0.00 C ATOM 1343 CD1 LEU A 787 5.972 4.446 -3.020 1.00 0.00 C ATOM 1344 CD2 LEU A 787 6.620 5.045 -5.366 1.00 0.00 C ATOM 0 H LEU A 787 3.472 8.341 -4.122 1.00 0.00 H new ATOM 0 HA LEU A 787 4.766 6.867 -1.981 1.00 0.00 H new ATOM 0 HB2 LEU A 787 4.186 5.941 -4.255 1.00 0.00 H new ATOM 0 HB3 LEU A 787 5.232 7.146 -4.979 1.00 0.00 H new ATOM 0 HG LEU A 787 7.126 6.107 -3.610 1.00 0.00 H new ATOM 0 HD11 LEU A 787 6.829 3.774 -2.972 1.00 0.00 H new ATOM 0 HD12 LEU A 787 5.784 4.865 -2.032 1.00 0.00 H new ATOM 0 HD13 LEU A 787 5.095 3.891 -3.352 1.00 0.00 H new ATOM 0 HD21 LEU A 787 7.462 4.358 -5.284 1.00 0.00 H new ATOM 0 HD22 LEU A 787 5.764 4.521 -5.791 1.00 0.00 H new ATOM 0 HD23 LEU A 787 6.893 5.878 -6.013 1.00 0.00 H new ATOM 1356 N ILE A 788 6.876 8.196 -1.847 1.00 0.00 N ATOM 1357 CA ILE A 788 8.093 8.957 -1.720 1.00 0.00 C ATOM 1358 C ILE A 788 9.245 7.972 -1.859 1.00 0.00 C ATOM 1359 O ILE A 788 9.215 6.902 -1.251 1.00 0.00 O ATOM 1360 CB ILE A 788 8.226 9.746 -0.351 1.00 0.00 C ATOM 1361 CG1 ILE A 788 7.048 10.717 -0.089 1.00 0.00 C ATOM 1362 CG2 ILE A 788 9.540 10.516 -0.286 1.00 0.00 C ATOM 1363 CD1 ILE A 788 5.753 10.065 0.364 1.00 0.00 C ATOM 0 H ILE A 788 6.733 7.508 -1.108 1.00 0.00 H new ATOM 0 HA ILE A 788 8.097 9.724 -2.494 1.00 0.00 H new ATOM 0 HB ILE A 788 8.205 8.986 0.430 1.00 0.00 H new ATOM 0 HG12 ILE A 788 7.356 11.438 0.668 1.00 0.00 H new ATOM 0 HG13 ILE A 788 6.852 11.278 -1.003 1.00 0.00 H new ATOM 0 HG21 ILE A 788 9.604 11.047 0.664 1.00 0.00 H new ATOM 0 HG22 ILE A 788 10.374 9.819 -0.369 1.00 0.00 H new ATOM 0 HG23 ILE A 788 9.583 11.233 -1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 788 4.994 10.832 0.519 1.00 0.00 H new ATOM 0 HD12 ILE A 788 5.411 9.366 -0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 788 5.923 9.529 1.298 1.00 0.00 H new ATOM 1375 N GLU A 789 10.206 8.304 -2.683 1.00 0.00 N ATOM 1376 CA GLU A 789 11.357 7.454 -2.932 1.00 0.00 C ATOM 1377 C GLU A 789 12.585 8.345 -3.161 1.00 0.00 C ATOM 1378 O GLU A 789 12.428 9.483 -3.607 1.00 0.00 O ATOM 1379 CB GLU A 789 11.079 6.534 -4.138 1.00 0.00 C ATOM 1380 CG GLU A 789 10.675 7.249 -5.428 1.00 0.00 C ATOM 1381 CD GLU A 789 10.510 6.300 -6.604 1.00 0.00 C ATOM 1382 OE1 GLU A 789 9.467 5.636 -6.716 1.00 0.00 O ATOM 1383 OE2 GLU A 789 11.418 6.224 -7.461 1.00 0.00 O ATOM 0 H GLU A 789 10.218 9.179 -3.208 1.00 0.00 H new ATOM 0 HA GLU A 789 11.552 6.811 -2.074 1.00 0.00 H new ATOM 0 HB2 GLU A 789 11.972 5.942 -4.335 1.00 0.00 H new ATOM 0 HB3 GLU A 789 10.287 5.836 -3.866 1.00 0.00 H new ATOM 0 HG2 GLU A 789 9.739 7.782 -5.264 1.00 0.00 H new ATOM 0 HG3 GLU A 789 11.429 7.997 -5.674 1.00 0.00 H new ATOM 1666 N TYR A 810 13.673 3.471 0.352 1.00 0.00 N ATOM 1667 CA TYR A 810 12.978 2.569 -0.527 1.00 0.00 C ATOM 1668 C TYR A 810 11.629 3.163 -0.930 1.00 0.00 C ATOM 1669 O TYR A 810 11.578 4.152 -1.653 1.00 0.00 O ATOM 1670 CB TYR A 810 12.804 1.154 0.063 1.00 0.00 C ATOM 1671 CG TYR A 810 14.055 0.324 0.299 1.00 0.00 C ATOM 1672 CD1 TYR A 810 15.188 0.843 0.918 1.00 0.00 C ATOM 1673 CD2 TYR A 810 14.072 -1.011 -0.069 1.00 0.00 C ATOM 1674 CE1 TYR A 810 16.292 0.053 1.154 1.00 0.00 C ATOM 1675 CE2 TYR A 810 15.168 -1.801 0.158 1.00 0.00 C ATOM 1676 CZ TYR A 810 16.276 -1.267 0.766 1.00 0.00 C ATOM 1677 OH TYR A 810 17.363 -2.068 1.009 1.00 0.00 O ATOM 0 HA TYR A 810 13.601 2.449 -1.414 1.00 0.00 H new ATOM 0 HB2 TYR A 810 12.282 1.250 1.015 1.00 0.00 H new ATOM 0 HB3 TYR A 810 12.150 0.592 -0.604 1.00 0.00 H new ATOM 0 HD1 TYR A 810 15.202 1.880 1.218 1.00 0.00 H new ATOM 0 HD2 TYR A 810 13.202 -1.439 -0.545 1.00 0.00 H new ATOM 0 HE1 TYR A 810 17.163 0.467 1.640 1.00 0.00 H new ATOM 0 HE2 TYR A 810 15.160 -2.839 -0.140 1.00 0.00 H new ATOM 0 HH TYR A 810 17.186 -2.971 0.672 1.00 0.00 H new ATOM 1687 N LEU A 811 10.550 2.629 -0.407 1.00 0.00 N ATOM 1688 CA LEU A 811 9.246 3.105 -0.783 1.00 0.00 C ATOM 1689 C LEU A 811 8.503 3.587 0.408 1.00 0.00 C ATOM 1690 O LEU A 811 8.291 2.853 1.362 1.00 0.00 O ATOM 1691 CB LEU A 811 8.415 2.048 -1.533 1.00 0.00 C ATOM 1692 CG LEU A 811 8.935 1.578 -2.900 1.00 0.00 C ATOM 1693 CD1 LEU A 811 9.375 2.748 -3.765 1.00 0.00 C ATOM 1694 CD2 LEU A 811 10.028 0.535 -2.765 1.00 0.00 C ATOM 0 H LEU A 811 10.552 1.870 0.275 1.00 0.00 H new ATOM 0 HA LEU A 811 9.406 3.934 -1.473 1.00 0.00 H new ATOM 0 HB2 LEU A 811 8.323 1.173 -0.889 1.00 0.00 H new ATOM 0 HB3 LEU A 811 7.411 2.447 -1.674 1.00 0.00 H new ATOM 0 HG LEU A 811 8.101 1.096 -3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 811 9.736 2.376 -4.724 1.00 0.00 H new ATOM 0 HD12 LEU A 811 8.530 3.416 -3.930 1.00 0.00 H new ATOM 0 HD13 LEU A 811 10.175 3.292 -3.262 1.00 0.00 H new ATOM 0 HD21 LEU A 811 10.366 0.232 -3.756 1.00 0.00 H new ATOM 0 HD22 LEU A 811 10.866 0.956 -2.209 1.00 0.00 H new ATOM 0 HD23 LEU A 811 9.639 -0.333 -2.233 1.00 0.00 H new ATOM 1706 N VAL A 812 8.107 4.808 0.357 1.00 0.00 N ATOM 1707 CA VAL A 812 7.411 5.405 1.450 1.00 0.00 C ATOM 1708 C VAL A 812 6.028 5.806 0.982 1.00 0.00 C ATOM 1709 O VAL A 812 5.869 6.256 -0.152 1.00 0.00 O ATOM 1710 CB VAL A 812 8.149 6.666 1.958 1.00 0.00 C ATOM 1711 CG1 VAL A 812 7.504 7.253 3.202 1.00 0.00 C ATOM 1712 CG2 VAL A 812 9.628 6.413 2.172 1.00 0.00 C ATOM 0 H VAL A 812 8.254 5.425 -0.442 1.00 0.00 H new ATOM 0 HA VAL A 812 7.355 4.683 2.265 1.00 0.00 H new ATOM 0 HB VAL A 812 8.056 7.411 1.168 1.00 0.00 H new ATOM 0 HG11 VAL A 812 8.060 8.136 3.518 1.00 0.00 H new ATOM 0 HG12 VAL A 812 6.474 7.533 2.980 1.00 0.00 H new ATOM 0 HG13 VAL A 812 7.515 6.512 4.002 1.00 0.00 H new ATOM 0 HG21 VAL A 812 10.105 7.326 2.529 1.00 0.00 H new ATOM 0 HG22 VAL A 812 9.759 5.622 2.911 1.00 0.00 H new ATOM 0 HG23 VAL A 812 10.085 6.109 1.230 1.00 0.00 H new ATOM 1722 N VAL A 813 5.046 5.654 1.829 1.00 0.00 N ATOM 1723 CA VAL A 813 3.700 6.032 1.498 1.00 0.00 C ATOM 1724 C VAL A 813 3.258 7.207 2.373 1.00 0.00 C ATOM 1725 O VAL A 813 3.565 7.250 3.570 1.00 0.00 O ATOM 1726 CB VAL A 813 2.711 4.824 1.607 1.00 0.00 C ATOM 1727 CG1 VAL A 813 2.670 4.238 3.021 1.00 0.00 C ATOM 1728 CG2 VAL A 813 1.313 5.210 1.134 1.00 0.00 C ATOM 0 H VAL A 813 5.157 5.266 2.766 1.00 0.00 H new ATOM 0 HA VAL A 813 3.681 6.351 0.456 1.00 0.00 H new ATOM 0 HB VAL A 813 3.089 4.044 0.946 1.00 0.00 H new ATOM 0 HG11 VAL A 813 1.970 3.403 3.048 1.00 0.00 H new ATOM 0 HG12 VAL A 813 3.664 3.888 3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 813 2.346 5.006 3.724 1.00 0.00 H new ATOM 0 HG21 VAL A 813 0.649 4.350 1.222 1.00 0.00 H new ATOM 0 HG22 VAL A 813 0.933 6.026 1.749 1.00 0.00 H new ATOM 0 HG23 VAL A 813 1.357 5.530 0.093 1.00 0.00 H new ATOM 1738 N ASN A 814 2.630 8.178 1.748 1.00 0.00 N ATOM 1739 CA ASN A 814 2.107 9.360 2.419 1.00 0.00 C ATOM 1740 C ASN A 814 0.976 8.947 3.355 1.00 0.00 C ATOM 1741 O ASN A 814 0.102 8.171 2.955 1.00 0.00 O ATOM 1742 CB ASN A 814 1.560 10.349 1.355 1.00 0.00 C ATOM 1743 CG ASN A 814 1.146 11.728 1.872 1.00 0.00 C ATOM 1744 OD1 ASN A 814 0.704 11.897 2.991 1.00 0.00 O ATOM 1745 ND2 ASN A 814 1.325 12.734 1.056 1.00 0.00 N ATOM 0 H ASN A 814 2.463 8.174 0.742 1.00 0.00 H new ATOM 0 HA ASN A 814 2.899 9.840 2.993 1.00 0.00 H new ATOM 0 HB2 ASN A 814 2.322 10.484 0.588 1.00 0.00 H new ATOM 0 HB3 ASN A 814 0.698 9.890 0.871 1.00 0.00 H new ATOM 0 HD21 ASN A 814 1.092 13.681 1.355 1.00 0.00 H new ATOM 0 HD22 ASN A 814 1.697 12.572 0.120 1.00 0.00 H new ATOM 1752 N PRO A 815 0.985 9.432 4.618 1.00 0.00 N ATOM 1753 CA PRO A 815 -0.095 9.176 5.573 1.00 0.00 C ATOM 1754 C PRO A 815 -1.478 9.625 5.056 1.00 0.00 C ATOM 1755 O PRO A 815 -2.513 9.154 5.548 1.00 0.00 O ATOM 1756 CB PRO A 815 0.289 10.011 6.814 1.00 0.00 C ATOM 1757 CG PRO A 815 1.396 10.908 6.373 1.00 0.00 C ATOM 1758 CD PRO A 815 2.079 10.209 5.238 1.00 0.00 C ATOM 0 HA PRO A 815 -0.191 8.108 5.768 1.00 0.00 H new ATOM 0 HB2 PRO A 815 -0.562 10.588 7.175 1.00 0.00 H new ATOM 0 HB3 PRO A 815 0.609 9.368 7.634 1.00 0.00 H new ATOM 0 HG2 PRO A 815 1.009 11.876 6.056 1.00 0.00 H new ATOM 0 HG3 PRO A 815 2.093 11.095 7.190 1.00 0.00 H new ATOM 0 HD2 PRO A 815 2.520 10.916 4.535 1.00 0.00 H new ATOM 0 HD3 PRO A 815 2.884 9.563 5.588 1.00 0.00 H new ATOM 1766 N ASN A 816 -1.499 10.509 4.067 1.00 0.00 N ATOM 1767 CA ASN A 816 -2.743 11.014 3.537 1.00 0.00 C ATOM 1768 C ASN A 816 -3.031 10.409 2.193 1.00 0.00 C ATOM 1769 O ASN A 816 -2.628 10.940 1.148 1.00 0.00 O ATOM 1770 CB ASN A 816 -2.781 12.543 3.447 1.00 0.00 C ATOM 1771 CG ASN A 816 -2.670 13.225 4.789 1.00 0.00 C ATOM 1772 OD1 ASN A 816 -1.578 13.587 5.227 1.00 0.00 O ATOM 1773 ND2 ASN A 816 -3.779 13.381 5.462 1.00 0.00 N ATOM 0 H ASN A 816 -0.664 10.887 3.620 1.00 0.00 H new ATOM 0 HA ASN A 816 -3.519 10.719 4.243 1.00 0.00 H new ATOM 0 HB2 ASN A 816 -1.967 12.882 2.807 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -3.711 12.848 2.968 1.00 0.00 H new ATOM 0 HD21 ASN A 816 -3.759 13.816 6.384 1.00 0.00 H new ATOM 0 HD22 ASN A 816 -4.665 13.068 5.065 1.00 0.00 H new ATOM 1780 N TYR A 817 -3.679 9.285 2.221 1.00 0.00 N ATOM 1781 CA TYR A 817 -4.043 8.572 1.017 1.00 0.00 C ATOM 1782 C TYR A 817 -5.456 9.023 0.600 1.00 0.00 C ATOM 1783 O TYR A 817 -6.175 9.630 1.402 1.00 0.00 O ATOM 1784 CB TYR A 817 -3.989 7.048 1.272 1.00 0.00 C ATOM 1785 CG TYR A 817 -3.813 6.219 0.012 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -4.896 5.780 -0.736 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -2.546 5.899 -0.436 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -4.713 5.049 -1.890 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -2.361 5.176 -1.589 1.00 0.00 C ATOM 1790 CZ TYR A 817 -3.441 4.751 -2.310 1.00 0.00 C ATOM 1791 OH TYR A 817 -3.247 4.054 -3.479 1.00 0.00 O ATOM 0 H TYR A 817 -3.976 8.826 3.082 1.00 0.00 H new ATOM 0 HA TYR A 817 -3.344 8.794 0.211 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -3.167 6.833 1.955 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -4.907 6.740 1.772 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -5.898 6.015 -0.409 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -1.686 6.223 0.131 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -5.566 4.713 -2.461 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -1.362 4.943 -1.926 1.00 0.00 H new ATOM 0 HH TYR A 817 -2.590 4.523 -4.034 1.00 0.00 H new