USER MOD reduce.3.24.130724 H: found=0, std=0, add=695, rem=0, adj=16 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= 0.0645 K(o=0.8,f=-6.2!) USER MOD Set 1.2: A 816 ASN : amide:sc= 0.739 K(o=0.8,f=-0.62) USER MOD Set 2.1: A 720 TYR OH : rot -42:sc= 1.19 USER MOD Set 2.2: A 817 TYR OH : rot 150:sc= 1 USER MOD Single : A 718 SER OG : rot 180:sc= 0.0139 USER MOD Single : A 721 SER OG : rot -4:sc= 1.15 USER MOD Single : A 724 SER OG : rot 180:sc= 0 USER MOD Single : A 725 ASN : amide:sc= -0.0923 K(o=-0.092,f=-1.4!) USER MOD Single : A 730 HIS : no HD1:sc= -1.17 K(o=-1.2,f=-0.51) USER MOD Single : A 733 LYS NZ :NH3+ -170:sc= 1.18 (180deg=0.68) USER MOD Single : A 741 SER OG : rot 53:sc= 0.117 USER MOD Single : A 744 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 746 SER OG : rot 180:sc= 0 USER MOD Single : A 750 ASN : amide:sc= 0.765 K(o=0.77,f=-0.016) USER MOD Single : A 752 TYR OH : rot 0:sc= -0.798 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 180:sc= 0 USER MOD Single : A 768 ASN : amide:sc= -1.15 K(o=-1.2,f=0) USER MOD Single : A 769 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.035) USER MOD Single : A 770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0447) USER MOD Single : A 778 HIS : no HD1:sc= -0.0211 X(o=-0.021,f=-0.36) USER MOD Single : A 781 THR OG1 : rot -85:sc= 1.24 USER MOD Single : A 782 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= -0.102 X(o=-0.1,f=-0.1) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -16.070 3.533 2.094 1.00 0.00 N ATOM 138 CA PHE A 717 -15.480 2.583 1.165 1.00 0.00 C ATOM 139 C PHE A 717 -14.882 1.502 2.008 1.00 0.00 C ATOM 140 O PHE A 717 -13.714 1.588 2.391 1.00 0.00 O ATOM 141 CB PHE A 717 -14.359 3.168 0.280 1.00 0.00 C ATOM 142 CG PHE A 717 -14.759 3.685 -1.075 1.00 0.00 C ATOM 143 CD1 PHE A 717 -15.349 2.844 -2.005 1.00 0.00 C ATOM 144 CD2 PHE A 717 -14.482 4.983 -1.440 1.00 0.00 C ATOM 145 CE1 PHE A 717 -15.663 3.299 -3.271 1.00 0.00 C ATOM 146 CE2 PHE A 717 -14.800 5.448 -2.701 1.00 0.00 C ATOM 147 CZ PHE A 717 -15.388 4.605 -3.618 1.00 0.00 C ATOM 0 HA PHE A 717 -16.261 2.247 0.483 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -13.886 3.983 0.827 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -13.602 2.397 0.138 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -15.566 1.821 -1.737 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -14.010 5.647 -0.731 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -16.123 2.634 -3.987 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -14.588 6.473 -2.968 1.00 0.00 H new ATOM 0 HZ PHE A 717 -15.633 4.966 -4.606 1.00 0.00 H new ATOM 157 N SER A 718 -15.680 0.530 2.335 1.00 0.00 N ATOM 158 CA SER A 718 -15.320 -0.510 3.255 1.00 0.00 C ATOM 159 C SER A 718 -14.011 -1.224 2.891 1.00 0.00 C ATOM 160 O SER A 718 -13.113 -1.317 3.729 1.00 0.00 O ATOM 161 CB SER A 718 -16.469 -1.467 3.342 1.00 0.00 C ATOM 162 OG SER A 718 -17.658 -0.748 3.600 1.00 0.00 O ATOM 0 H SER A 718 -16.624 0.435 1.960 1.00 0.00 H new ATOM 0 HA SER A 718 -15.124 -0.060 4.228 1.00 0.00 H new ATOM 0 HB2 SER A 718 -16.563 -2.026 2.411 1.00 0.00 H new ATOM 0 HB3 SER A 718 -16.292 -2.195 4.134 1.00 0.00 H new ATOM 0 HG SER A 718 -18.412 -1.372 3.656 1.00 0.00 H new ATOM 168 N GLU A 719 -13.863 -1.650 1.648 1.00 0.00 N ATOM 169 CA GLU A 719 -12.647 -2.351 1.251 1.00 0.00 C ATOM 170 C GLU A 719 -11.467 -1.414 1.232 1.00 0.00 C ATOM 171 O GLU A 719 -10.390 -1.757 1.723 1.00 0.00 O ATOM 172 CB GLU A 719 -12.792 -3.054 -0.090 1.00 0.00 C ATOM 173 CG GLU A 719 -13.929 -4.056 -0.154 1.00 0.00 C ATOM 174 CD GLU A 719 -13.902 -5.099 0.954 1.00 0.00 C ATOM 175 OE1 GLU A 719 -13.041 -5.977 0.933 1.00 0.00 O ATOM 176 OE2 GLU A 719 -14.769 -5.057 1.856 1.00 0.00 O ATOM 0 H GLU A 719 -14.553 -1.528 0.907 1.00 0.00 H new ATOM 0 HA GLU A 719 -12.471 -3.122 2.001 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -12.942 -2.303 -0.866 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -11.858 -3.567 -0.320 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -14.876 -3.518 -0.109 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -13.897 -4.564 -1.118 1.00 0.00 H new ATOM 183 N TYR A 720 -11.674 -0.202 0.742 1.00 0.00 N ATOM 184 CA TYR A 720 -10.582 0.738 0.687 1.00 0.00 C ATOM 185 C TYR A 720 -10.125 1.111 2.086 1.00 0.00 C ATOM 186 O TYR A 720 -8.939 1.256 2.319 1.00 0.00 O ATOM 187 CB TYR A 720 -10.880 1.989 -0.150 1.00 0.00 C ATOM 188 CG TYR A 720 -9.685 2.909 -0.209 1.00 0.00 C ATOM 189 CD1 TYR A 720 -8.508 2.504 -0.833 1.00 0.00 C ATOM 190 CD2 TYR A 720 -9.707 4.149 0.403 1.00 0.00 C ATOM 191 CE1 TYR A 720 -7.398 3.318 -0.849 1.00 0.00 C ATOM 192 CE2 TYR A 720 -8.599 4.958 0.394 1.00 0.00 C ATOM 193 CZ TYR A 720 -7.449 4.539 -0.234 1.00 0.00 C ATOM 194 OH TYR A 720 -6.346 5.347 -0.238 1.00 0.00 O ATOM 0 H TYR A 720 -12.566 0.142 0.387 1.00 0.00 H new ATOM 0 HA TYR A 720 -9.770 0.227 0.170 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -11.164 1.694 -1.160 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -11.730 2.521 0.278 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -8.465 1.537 -1.312 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -10.608 4.485 0.894 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -6.494 2.995 -1.343 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -8.630 5.922 0.879 1.00 0.00 H new ATOM 0 HH TYR A 720 -5.545 4.808 -0.067 1.00 0.00 H new ATOM 204 N SER A 721 -11.058 1.224 3.023 1.00 0.00 N ATOM 205 CA SER A 721 -10.695 1.526 4.390 1.00 0.00 C ATOM 206 C SER A 721 -9.863 0.399 5.021 1.00 0.00 C ATOM 207 O SER A 721 -9.036 0.656 5.878 1.00 0.00 O ATOM 208 CB SER A 721 -11.922 1.912 5.247 1.00 0.00 C ATOM 209 OG SER A 721 -12.952 0.922 5.219 1.00 0.00 O ATOM 0 H SER A 721 -12.058 1.112 2.859 1.00 0.00 H new ATOM 0 HA SER A 721 -10.054 2.408 4.365 1.00 0.00 H new ATOM 0 HB2 SER A 721 -11.604 2.070 6.278 1.00 0.00 H new ATOM 0 HB3 SER A 721 -12.325 2.859 4.889 1.00 0.00 H new ATOM 0 HG SER A 721 -12.697 0.202 4.604 1.00 0.00 H new ATOM 215 N ARG A 722 -10.036 -0.843 4.529 1.00 0.00 N ATOM 216 CA ARG A 722 -9.265 -1.982 5.046 1.00 0.00 C ATOM 217 C ARG A 722 -7.814 -1.797 4.618 1.00 0.00 C ATOM 218 O ARG A 722 -6.875 -1.982 5.396 1.00 0.00 O ATOM 219 CB ARG A 722 -9.748 -3.326 4.464 1.00 0.00 C ATOM 220 CG ARG A 722 -11.239 -3.589 4.490 1.00 0.00 C ATOM 221 CD ARG A 722 -11.832 -3.656 5.879 1.00 0.00 C ATOM 222 NE ARG A 722 -13.276 -3.941 5.795 1.00 0.00 N ATOM 223 CZ ARG A 722 -14.126 -3.982 6.825 1.00 0.00 C ATOM 224 NH1 ARG A 722 -13.689 -3.799 8.065 1.00 0.00 N ATOM 225 NH2 ARG A 722 -15.411 -4.230 6.603 1.00 0.00 N ATOM 0 H ARG A 722 -10.693 -1.078 3.785 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.387 -2.009 6.129 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -9.411 -3.388 3.429 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -9.253 -4.129 5.009 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -11.745 -2.804 3.929 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -11.440 -4.529 3.976 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -11.333 -4.431 6.460 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -11.668 -2.712 6.400 1.00 0.00 H new ATOM 0 HE ARG A 722 -13.660 -4.123 4.868 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -12.699 -3.626 8.236 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -14.344 -3.832 8.846 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -15.743 -4.388 5.652 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -16.066 -4.263 7.384 1.00 0.00 H new ATOM 239 N ILE A 723 -7.645 -1.444 3.359 1.00 0.00 N ATOM 240 CA ILE A 723 -6.315 -1.193 2.798 1.00 0.00 C ATOM 241 C ILE A 723 -5.696 0.076 3.417 1.00 0.00 C ATOM 242 O ILE A 723 -4.513 0.102 3.769 1.00 0.00 O ATOM 243 CB ILE A 723 -6.335 -1.111 1.230 1.00 0.00 C ATOM 244 CG1 ILE A 723 -6.519 -2.501 0.574 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.074 -0.450 0.682 1.00 0.00 C ATOM 246 CD1 ILE A 723 -7.853 -3.200 0.802 1.00 0.00 C ATOM 0 H ILE A 723 -8.410 -1.322 2.696 1.00 0.00 H new ATOM 0 HA ILE A 723 -5.687 -2.045 3.057 1.00 0.00 H new ATOM 0 HB ILE A 723 -7.196 -0.494 0.973 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -6.373 -2.391 -0.501 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -5.727 -3.155 0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -5.126 -0.412 -0.406 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -4.993 0.563 1.077 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -4.200 -1.028 0.983 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -7.852 -4.162 0.290 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -8.003 -3.357 1.870 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -8.660 -2.581 0.409 1.00 0.00 H new ATOM 258 N SER A 724 -6.508 1.101 3.548 1.00 0.00 N ATOM 259 CA SER A 724 -6.110 2.353 4.199 1.00 0.00 C ATOM 260 C SER A 724 -5.622 2.076 5.629 1.00 0.00 C ATOM 261 O SER A 724 -4.612 2.655 6.070 1.00 0.00 O ATOM 262 CB SER A 724 -7.277 3.362 4.201 1.00 0.00 C ATOM 263 OG SER A 724 -6.923 4.601 4.817 1.00 0.00 O ATOM 0 H SER A 724 -7.470 1.101 3.208 1.00 0.00 H new ATOM 0 HA SER A 724 -5.288 2.793 3.634 1.00 0.00 H new ATOM 0 HB2 SER A 724 -7.596 3.547 3.175 1.00 0.00 H new ATOM 0 HB3 SER A 724 -8.128 2.928 4.726 1.00 0.00 H new ATOM 0 HG SER A 724 -7.691 5.209 4.794 1.00 0.00 H new ATOM 269 N ASN A 725 -6.328 1.180 6.340 1.00 0.00 N ATOM 270 CA ASN A 725 -5.911 0.762 7.670 1.00 0.00 C ATOM 271 C ASN A 725 -4.544 0.154 7.627 1.00 0.00 C ATOM 272 O ASN A 725 -3.701 0.500 8.438 1.00 0.00 O ATOM 273 CB ASN A 725 -6.894 -0.207 8.339 1.00 0.00 C ATOM 274 CG ASN A 725 -8.095 0.469 8.971 1.00 0.00 C ATOM 275 OD1 ASN A 725 -8.043 1.638 9.366 1.00 0.00 O ATOM 276 ND2 ASN A 725 -9.164 -0.255 9.108 1.00 0.00 N ATOM 0 H ASN A 725 -7.186 0.738 6.009 1.00 0.00 H new ATOM 0 HA ASN A 725 -5.894 1.665 8.280 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -7.243 -0.924 7.596 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -6.365 -0.774 9.105 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -9.993 0.139 9.553 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -9.175 -1.218 8.771 1.00 0.00 H new ATOM 283 N LEU A 726 -4.300 -0.710 6.639 1.00 0.00 N ATOM 284 CA LEU A 726 -2.997 -1.326 6.465 1.00 0.00 C ATOM 285 C LEU A 726 -1.897 -0.285 6.394 1.00 0.00 C ATOM 286 O LEU A 726 -0.911 -0.414 7.068 1.00 0.00 O ATOM 287 CB LEU A 726 -2.980 -2.296 5.236 1.00 0.00 C ATOM 288 CG LEU A 726 -1.599 -2.636 4.600 1.00 0.00 C ATOM 289 CD1 LEU A 726 -1.661 -3.948 3.883 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.211 -1.580 3.579 1.00 0.00 C ATOM 0 H LEU A 726 -4.995 -0.995 5.949 1.00 0.00 H new ATOM 0 HA LEU A 726 -2.797 -1.935 7.347 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -3.448 -3.232 5.541 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -3.610 -1.863 4.459 1.00 0.00 H new ATOM 0 HG LEU A 726 -0.868 -2.676 5.408 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -0.688 -4.170 3.445 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -1.930 -4.735 4.587 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -2.411 -3.896 3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.244 -1.832 3.144 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -1.964 -1.541 2.792 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -1.146 -0.608 4.068 1.00 0.00 H new ATOM 302 N ILE A 727 -2.110 0.765 5.626 1.00 0.00 N ATOM 303 CA ILE A 727 -1.103 1.799 5.461 1.00 0.00 C ATOM 304 C ILE A 727 -0.764 2.487 6.770 1.00 0.00 C ATOM 305 O ILE A 727 0.420 2.548 7.162 1.00 0.00 O ATOM 306 CB ILE A 727 -1.482 2.824 4.345 1.00 0.00 C ATOM 307 CG1 ILE A 727 -1.264 2.203 2.958 1.00 0.00 C ATOM 308 CG2 ILE A 727 -0.716 4.141 4.478 1.00 0.00 C ATOM 309 CD1 ILE A 727 0.187 1.800 2.701 1.00 0.00 C ATOM 0 H ILE A 727 -2.972 0.926 5.105 1.00 0.00 H new ATOM 0 HA ILE A 727 -0.197 1.293 5.128 1.00 0.00 H new ATOM 0 HB ILE A 727 -2.539 3.062 4.467 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -1.902 1.325 2.856 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -1.577 2.915 2.195 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -1.016 4.819 3.679 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -0.940 4.596 5.443 1.00 0.00 H new ATOM 0 HG23 ILE A 727 0.354 3.948 4.408 1.00 0.00 H new ATOM 0 HD11 ILE A 727 0.273 1.368 1.704 1.00 0.00 H new ATOM 0 HD12 ILE A 727 0.827 2.679 2.772 1.00 0.00 H new ATOM 0 HD13 ILE A 727 0.497 1.065 3.443 1.00 0.00 H new ATOM 321 N VAL A 728 -1.771 2.942 7.468 1.00 0.00 N ATOM 322 CA VAL A 728 -1.529 3.655 8.693 1.00 0.00 C ATOM 323 C VAL A 728 -1.008 2.741 9.802 1.00 0.00 C ATOM 324 O VAL A 728 -0.054 3.094 10.490 1.00 0.00 O ATOM 325 CB VAL A 728 -2.741 4.506 9.170 1.00 0.00 C ATOM 326 CG1 VAL A 728 -3.018 5.622 8.182 1.00 0.00 C ATOM 327 CG2 VAL A 728 -3.992 3.654 9.357 1.00 0.00 C ATOM 0 H VAL A 728 -2.753 2.834 7.214 1.00 0.00 H new ATOM 0 HA VAL A 728 -0.738 4.368 8.458 1.00 0.00 H new ATOM 0 HB VAL A 728 -2.481 4.934 10.138 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -3.868 6.210 8.527 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -2.141 6.264 8.103 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -3.245 5.195 7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -4.816 4.285 9.691 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -4.256 3.183 8.410 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -3.799 2.884 10.104 1.00 0.00 H new ATOM 337 N LEU A 729 -1.595 1.554 9.916 1.00 0.00 N ATOM 338 CA LEU A 729 -1.238 0.583 10.946 1.00 0.00 C ATOM 339 C LEU A 729 0.147 0.001 10.722 1.00 0.00 C ATOM 340 O LEU A 729 0.925 -0.124 11.661 1.00 0.00 O ATOM 341 CB LEU A 729 -2.293 -0.518 11.012 1.00 0.00 C ATOM 342 CG LEU A 729 -3.677 -0.055 11.472 1.00 0.00 C ATOM 343 CD1 LEU A 729 -4.712 -1.112 11.168 1.00 0.00 C ATOM 344 CD2 LEU A 729 -3.675 0.249 12.958 1.00 0.00 C ATOM 0 H LEU A 729 -2.337 1.236 9.292 1.00 0.00 H new ATOM 0 HA LEU A 729 -1.210 1.103 11.904 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -2.387 -0.971 10.025 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -1.943 -1.297 11.689 1.00 0.00 H new ATOM 0 HG LEU A 729 -3.928 0.856 10.929 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -5.691 -0.769 11.501 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -4.738 -1.297 10.094 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -4.454 -2.034 11.689 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -4.669 0.576 13.264 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -3.402 -0.649 13.513 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -2.953 1.038 13.167 1.00 0.00 H new ATOM 356 N HIS A 730 0.460 -0.321 9.479 1.00 0.00 N ATOM 357 CA HIS A 730 1.765 -0.881 9.136 1.00 0.00 C ATOM 358 C HIS A 730 2.860 0.116 9.463 1.00 0.00 C ATOM 359 O HIS A 730 3.743 -0.180 10.245 1.00 0.00 O ATOM 360 CB HIS A 730 1.825 -1.267 7.646 1.00 0.00 C ATOM 361 CG HIS A 730 3.083 -1.957 7.192 1.00 0.00 C ATOM 362 ND1 HIS A 730 3.967 -1.424 6.273 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.557 -3.189 7.490 1.00 0.00 C ATOM 364 CE1 HIS A 730 4.917 -2.332 6.040 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.715 -3.427 6.757 1.00 0.00 N ATOM 0 H HIS A 730 -0.170 -0.206 8.685 1.00 0.00 H new ATOM 0 HA HIS A 730 1.916 -1.784 9.727 1.00 0.00 H new ATOM 0 HB2 HIS A 730 0.978 -1.917 7.425 1.00 0.00 H new ATOM 0 HB3 HIS A 730 1.696 -0.363 7.052 1.00 0.00 H new ATOM 0 HD2 HIS A 730 3.107 -3.879 8.188 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.742 -2.192 5.357 1.00 0.00 H new ATOM 0 HE2 HIS A 730 5.289 -4.270 6.769 1.00 0.00 H new ATOM 373 N LEU A 731 2.763 1.317 8.900 1.00 0.00 N ATOM 374 CA LEU A 731 3.790 2.332 9.098 1.00 0.00 C ATOM 375 C LEU A 731 4.018 2.659 10.588 1.00 0.00 C ATOM 376 O LEU A 731 5.167 2.671 11.035 1.00 0.00 O ATOM 377 CB LEU A 731 3.498 3.572 8.212 1.00 0.00 C ATOM 378 CG LEU A 731 4.489 4.776 8.213 1.00 0.00 C ATOM 379 CD1 LEU A 731 4.360 5.649 9.458 1.00 0.00 C ATOM 380 CD2 LEU A 731 5.928 4.294 8.044 1.00 0.00 C ATOM 0 H LEU A 731 1.987 1.609 8.306 1.00 0.00 H new ATOM 0 HA LEU A 731 4.746 1.928 8.765 1.00 0.00 H new ATOM 0 HB2 LEU A 731 3.411 3.223 7.183 1.00 0.00 H new ATOM 0 HB3 LEU A 731 2.520 3.956 8.502 1.00 0.00 H new ATOM 0 HG LEU A 731 4.220 5.400 7.361 1.00 0.00 H new ATOM 0 HD11 LEU A 731 5.075 6.470 9.402 1.00 0.00 H new ATOM 0 HD12 LEU A 731 3.349 6.051 9.517 1.00 0.00 H new ATOM 0 HD13 LEU A 731 4.565 5.050 10.345 1.00 0.00 H new ATOM 0 HD21 LEU A 731 6.602 5.151 8.048 1.00 0.00 H new ATOM 0 HD22 LEU A 731 6.187 3.626 8.865 1.00 0.00 H new ATOM 0 HD23 LEU A 731 6.024 3.761 7.098 1.00 0.00 H new ATOM 392 N ARG A 732 2.935 2.864 11.356 1.00 0.00 N ATOM 393 CA ARG A 732 3.074 3.185 12.792 1.00 0.00 C ATOM 394 C ARG A 732 3.759 2.054 13.558 1.00 0.00 C ATOM 395 O ARG A 732 4.583 2.301 14.437 1.00 0.00 O ATOM 396 CB ARG A 732 1.720 3.552 13.455 1.00 0.00 C ATOM 397 CG ARG A 732 0.636 2.491 13.311 1.00 0.00 C ATOM 398 CD ARG A 732 -0.643 2.841 14.055 1.00 0.00 C ATOM 399 NE ARG A 732 -0.469 2.725 15.499 1.00 0.00 N ATOM 400 CZ ARG A 732 -1.416 2.915 16.426 1.00 0.00 C ATOM 401 NH1 ARG A 732 -2.636 3.337 16.081 1.00 0.00 N ATOM 402 NH2 ARG A 732 -1.134 2.684 17.702 1.00 0.00 N ATOM 0 H ARG A 732 1.973 2.816 11.020 1.00 0.00 H new ATOM 0 HA ARG A 732 3.710 4.069 12.845 1.00 0.00 H new ATOM 0 HB2 ARG A 732 1.888 3.739 14.516 1.00 0.00 H new ATOM 0 HB3 ARG A 732 1.358 4.484 13.020 1.00 0.00 H new ATOM 0 HG2 ARG A 732 0.408 2.354 12.254 1.00 0.00 H new ATOM 0 HG3 ARG A 732 1.016 1.539 13.682 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -0.945 3.858 13.804 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -1.447 2.181 13.730 1.00 0.00 H new ATOM 0 HE ARG A 732 0.462 2.476 15.834 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -2.855 3.518 15.101 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -3.348 3.478 16.797 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -0.203 2.365 17.969 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -1.849 2.826 18.416 1.00 0.00 H new ATOM 416 N LYS A 733 3.445 0.832 13.189 1.00 0.00 N ATOM 417 CA LYS A 733 4.001 -0.339 13.831 1.00 0.00 C ATOM 418 C LYS A 733 5.476 -0.501 13.454 1.00 0.00 C ATOM 419 O LYS A 733 6.348 -0.665 14.320 1.00 0.00 O ATOM 420 CB LYS A 733 3.207 -1.569 13.399 1.00 0.00 C ATOM 421 CG LYS A 733 3.649 -2.868 14.026 1.00 0.00 C ATOM 422 CD LYS A 733 2.881 -4.036 13.445 1.00 0.00 C ATOM 423 CE LYS A 733 3.328 -5.356 14.046 1.00 0.00 C ATOM 424 NZ LYS A 733 4.777 -5.574 13.868 1.00 0.00 N ATOM 0 H LYS A 733 2.794 0.621 12.432 1.00 0.00 H new ATOM 0 HA LYS A 733 3.936 -0.225 14.913 1.00 0.00 H new ATOM 0 HB2 LYS A 733 2.156 -1.407 13.639 1.00 0.00 H new ATOM 0 HB3 LYS A 733 3.276 -1.665 12.315 1.00 0.00 H new ATOM 0 HG2 LYS A 733 4.717 -3.011 13.861 1.00 0.00 H new ATOM 0 HG3 LYS A 733 3.496 -2.827 15.104 1.00 0.00 H new ATOM 0 HD2 LYS A 733 1.815 -3.896 13.625 1.00 0.00 H new ATOM 0 HD3 LYS A 733 3.021 -4.062 12.364 1.00 0.00 H new ATOM 0 HE2 LYS A 733 3.085 -5.373 15.108 1.00 0.00 H new ATOM 0 HE3 LYS A 733 2.777 -6.173 13.580 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 5.017 -6.550 14.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 5.032 -5.415 12.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 5.304 -4.911 14.471 1.00 0.00 H new ATOM 438 N VAL A 734 5.740 -0.402 12.169 1.00 0.00 N ATOM 439 CA VAL A 734 7.059 -0.592 11.611 1.00 0.00 C ATOM 440 C VAL A 734 8.072 0.431 12.135 1.00 0.00 C ATOM 441 O VAL A 734 9.154 0.043 12.605 1.00 0.00 O ATOM 442 CB VAL A 734 7.012 -0.593 10.056 1.00 0.00 C ATOM 443 CG1 VAL A 734 8.389 -0.633 9.458 1.00 0.00 C ATOM 444 CG2 VAL A 734 6.222 -1.783 9.557 1.00 0.00 C ATOM 0 H VAL A 734 5.030 -0.183 11.471 1.00 0.00 H new ATOM 0 HA VAL A 734 7.405 -1.571 11.944 1.00 0.00 H new ATOM 0 HB VAL A 734 6.528 0.333 9.746 1.00 0.00 H new ATOM 0 HG11 VAL A 734 8.314 -0.633 8.371 1.00 0.00 H new ATOM 0 HG12 VAL A 734 8.952 0.242 9.783 1.00 0.00 H new ATOM 0 HG13 VAL A 734 8.902 -1.537 9.786 1.00 0.00 H new ATOM 0 HG21 VAL A 734 6.197 -1.772 8.467 1.00 0.00 H new ATOM 0 HG22 VAL A 734 6.695 -2.703 9.900 1.00 0.00 H new ATOM 0 HG23 VAL A 734 5.204 -1.732 9.944 1.00 0.00 H new ATOM 454 N GLU A 735 7.723 1.721 12.109 1.00 0.00 N ATOM 455 CA GLU A 735 8.658 2.754 12.566 1.00 0.00 C ATOM 456 C GLU A 735 8.946 2.631 14.061 1.00 0.00 C ATOM 457 O GLU A 735 10.029 2.988 14.521 1.00 0.00 O ATOM 458 CB GLU A 735 8.187 4.191 12.249 1.00 0.00 C ATOM 459 CG GLU A 735 6.869 4.591 12.894 1.00 0.00 C ATOM 460 CD GLU A 735 6.693 6.089 12.969 1.00 0.00 C ATOM 461 OE1 GLU A 735 6.349 6.730 11.963 1.00 0.00 O ATOM 462 OE2 GLU A 735 6.922 6.663 14.058 1.00 0.00 O ATOM 0 H GLU A 735 6.821 2.070 11.784 1.00 0.00 H new ATOM 0 HA GLU A 735 9.575 2.578 12.004 1.00 0.00 H new ATOM 0 HB2 GLU A 735 8.959 4.890 12.571 1.00 0.00 H new ATOM 0 HB3 GLU A 735 8.092 4.296 11.168 1.00 0.00 H new ATOM 0 HG2 GLU A 735 6.045 4.160 12.326 1.00 0.00 H new ATOM 0 HG3 GLU A 735 6.818 4.172 13.899 1.00 0.00 H new ATOM 469 N GLU A 736 7.986 2.118 14.794 1.00 0.00 N ATOM 470 CA GLU A 736 8.092 1.997 16.224 1.00 0.00 C ATOM 471 C GLU A 736 8.957 0.798 16.612 1.00 0.00 C ATOM 472 O GLU A 736 9.787 0.888 17.522 1.00 0.00 O ATOM 473 CB GLU A 736 6.699 1.859 16.812 1.00 0.00 C ATOM 474 CG GLU A 736 6.637 1.856 18.322 1.00 0.00 C ATOM 475 CD GLU A 736 5.238 1.653 18.807 1.00 0.00 C ATOM 476 OE1 GLU A 736 4.492 2.655 18.973 1.00 0.00 O ATOM 477 OE2 GLU A 736 4.837 0.488 19.005 1.00 0.00 O ATOM 0 H GLU A 736 7.106 1.772 14.411 1.00 0.00 H new ATOM 0 HA GLU A 736 8.572 2.891 16.622 1.00 0.00 H new ATOM 0 HB2 GLU A 736 6.082 2.677 16.440 1.00 0.00 H new ATOM 0 HB3 GLU A 736 6.256 0.933 16.444 1.00 0.00 H new ATOM 0 HG2 GLU A 736 7.278 1.066 18.713 1.00 0.00 H new ATOM 0 HG3 GLU A 736 7.024 2.800 18.706 1.00 0.00 H new ATOM 484 N GLU A 737 8.764 -0.318 15.936 1.00 0.00 N ATOM 485 CA GLU A 737 9.509 -1.521 16.263 1.00 0.00 C ATOM 486 C GLU A 737 10.853 -1.612 15.569 1.00 0.00 C ATOM 487 O GLU A 737 11.903 -1.510 16.209 1.00 0.00 O ATOM 488 CB GLU A 737 8.712 -2.774 15.955 1.00 0.00 C ATOM 489 CG GLU A 737 7.523 -3.006 16.847 1.00 0.00 C ATOM 490 CD GLU A 737 6.888 -4.332 16.563 1.00 0.00 C ATOM 491 OE1 GLU A 737 7.468 -5.370 16.917 1.00 0.00 O ATOM 492 OE2 GLU A 737 5.798 -4.371 15.992 1.00 0.00 O ATOM 0 H GLU A 737 8.105 -0.418 15.164 1.00 0.00 H new ATOM 0 HA GLU A 737 9.692 -1.451 17.335 1.00 0.00 H new ATOM 0 HB2 GLU A 737 8.368 -2.723 14.922 1.00 0.00 H new ATOM 0 HB3 GLU A 737 9.376 -3.636 16.028 1.00 0.00 H new ATOM 0 HG2 GLU A 737 7.834 -2.964 17.891 1.00 0.00 H new ATOM 0 HG3 GLU A 737 6.793 -2.210 16.699 1.00 0.00 H new ATOM 499 N GLU A 738 10.820 -1.784 14.271 1.00 0.00 N ATOM 500 CA GLU A 738 12.016 -2.072 13.511 1.00 0.00 C ATOM 501 C GLU A 738 12.672 -0.820 12.938 1.00 0.00 C ATOM 502 O GLU A 738 13.804 -0.887 12.431 1.00 0.00 O ATOM 503 CB GLU A 738 11.713 -3.129 12.443 1.00 0.00 C ATOM 504 CG GLU A 738 10.575 -2.777 11.492 1.00 0.00 C ATOM 505 CD GLU A 738 10.170 -3.944 10.616 1.00 0.00 C ATOM 506 OE1 GLU A 738 10.879 -4.245 9.647 1.00 0.00 O ATOM 507 OE2 GLU A 738 9.151 -4.610 10.924 1.00 0.00 O ATOM 0 H GLU A 738 9.969 -1.729 13.711 1.00 0.00 H new ATOM 0 HA GLU A 738 12.759 -2.485 14.194 1.00 0.00 H new ATOM 0 HB2 GLU A 738 12.616 -3.301 11.857 1.00 0.00 H new ATOM 0 HB3 GLU A 738 11.473 -4.068 12.941 1.00 0.00 H new ATOM 0 HG2 GLU A 738 9.713 -2.444 12.070 1.00 0.00 H new ATOM 0 HG3 GLU A 738 10.878 -1.941 10.861 1.00 0.00 H new ATOM 514 N ASP A 739 11.951 0.307 13.004 1.00 0.00 N ATOM 515 CA ASP A 739 12.431 1.661 12.582 1.00 0.00 C ATOM 516 C ASP A 739 12.547 1.819 11.066 1.00 0.00 C ATOM 517 O ASP A 739 12.016 2.779 10.486 1.00 0.00 O ATOM 518 CB ASP A 739 13.751 2.064 13.275 1.00 0.00 C ATOM 519 CG ASP A 739 14.268 3.412 12.803 1.00 0.00 C ATOM 520 OD1 ASP A 739 13.680 4.443 13.165 1.00 0.00 O ATOM 521 OD2 ASP A 739 15.274 3.462 12.052 1.00 0.00 O ATOM 0 H ASP A 739 10.994 0.320 13.358 1.00 0.00 H new ATOM 0 HA ASP A 739 11.654 2.349 12.915 1.00 0.00 H new ATOM 0 HB2 ASP A 739 13.597 2.095 14.354 1.00 0.00 H new ATOM 0 HB3 ASP A 739 14.506 1.302 13.083 1.00 0.00 H new ATOM 526 N GLU A 740 13.207 0.872 10.442 1.00 0.00 N ATOM 527 CA GLU A 740 13.448 0.839 9.030 1.00 0.00 C ATOM 528 C GLU A 740 12.170 0.514 8.307 1.00 0.00 C ATOM 529 O GLU A 740 11.837 -0.646 8.059 1.00 0.00 O ATOM 530 CB GLU A 740 14.524 -0.177 8.693 1.00 0.00 C ATOM 531 CG GLU A 740 15.882 0.126 9.281 1.00 0.00 C ATOM 532 CD GLU A 740 16.864 -0.971 8.993 1.00 0.00 C ATOM 533 OE1 GLU A 740 17.083 -1.294 7.801 1.00 0.00 O ATOM 534 OE2 GLU A 740 17.450 -1.530 9.943 1.00 0.00 O ATOM 0 H GLU A 740 13.606 0.071 10.932 1.00 0.00 H new ATOM 0 HA GLU A 740 13.799 1.819 8.709 1.00 0.00 H new ATOM 0 HB2 GLU A 740 14.202 -1.158 9.043 1.00 0.00 H new ATOM 0 HB3 GLU A 740 14.618 -0.241 7.609 1.00 0.00 H new ATOM 0 HG2 GLU A 740 16.255 1.066 8.873 1.00 0.00 H new ATOM 0 HG3 GLU A 740 15.791 0.260 10.359 1.00 0.00 H new ATOM 541 N SER A 741 11.457 1.544 8.043 1.00 0.00 N ATOM 542 CA SER A 741 10.160 1.491 7.422 1.00 0.00 C ATOM 543 C SER A 741 10.225 1.147 5.932 1.00 0.00 C ATOM 544 O SER A 741 9.208 0.805 5.337 1.00 0.00 O ATOM 545 CB SER A 741 9.452 2.814 7.640 1.00 0.00 C ATOM 546 OG SER A 741 9.468 3.170 9.023 1.00 0.00 O ATOM 0 H SER A 741 11.762 2.494 8.257 1.00 0.00 H new ATOM 0 HA SER A 741 9.598 0.684 7.891 1.00 0.00 H new ATOM 0 HB2 SER A 741 9.937 3.594 7.053 1.00 0.00 H new ATOM 0 HB3 SER A 741 8.423 2.744 7.289 1.00 0.00 H new ATOM 0 HG SER A 741 10.390 3.148 9.356 1.00 0.00 H new ATOM 552 N ALA A 742 11.406 1.262 5.341 1.00 0.00 N ATOM 553 CA ALA A 742 11.597 0.934 3.944 1.00 0.00 C ATOM 554 C ALA A 742 11.576 -0.580 3.745 1.00 0.00 C ATOM 555 O ALA A 742 12.594 -1.262 3.902 1.00 0.00 O ATOM 556 CB ALA A 742 12.890 1.543 3.417 1.00 0.00 C ATOM 0 H ALA A 742 12.250 1.583 5.816 1.00 0.00 H new ATOM 0 HA ALA A 742 10.774 1.361 3.372 1.00 0.00 H new ATOM 0 HB1 ALA A 742 13.012 1.283 2.365 1.00 0.00 H new ATOM 0 HB2 ALA A 742 12.850 2.627 3.521 1.00 0.00 H new ATOM 0 HB3 ALA A 742 13.734 1.155 3.987 1.00 0.00 H new ATOM 562 N LEU A 743 10.417 -1.098 3.457 1.00 0.00 N ATOM 563 CA LEU A 743 10.226 -2.522 3.312 1.00 0.00 C ATOM 564 C LEU A 743 9.955 -2.897 1.863 1.00 0.00 C ATOM 565 O LEU A 743 10.079 -2.056 0.958 1.00 0.00 O ATOM 566 CB LEU A 743 9.118 -3.025 4.260 1.00 0.00 C ATOM 567 CG LEU A 743 9.424 -2.921 5.769 1.00 0.00 C ATOM 568 CD1 LEU A 743 8.266 -3.449 6.589 1.00 0.00 C ATOM 569 CD2 LEU A 743 10.691 -3.684 6.124 1.00 0.00 C ATOM 0 H LEU A 743 9.571 -0.547 3.314 1.00 0.00 H new ATOM 0 HA LEU A 743 11.151 -3.022 3.600 1.00 0.00 H new ATOM 0 HB2 LEU A 743 8.207 -2.463 4.054 1.00 0.00 H new ATOM 0 HB3 LEU A 743 8.909 -4.068 4.022 1.00 0.00 H new ATOM 0 HG LEU A 743 9.574 -1.867 6.002 1.00 0.00 H new ATOM 0 HD11 LEU A 743 8.503 -3.366 7.650 1.00 0.00 H new ATOM 0 HD12 LEU A 743 7.371 -2.867 6.371 1.00 0.00 H new ATOM 0 HD13 LEU A 743 8.089 -4.495 6.338 1.00 0.00 H new ATOM 0 HD21 LEU A 743 10.883 -3.594 7.193 1.00 0.00 H new ATOM 0 HD22 LEU A 743 10.567 -4.736 5.865 1.00 0.00 H new ATOM 0 HD23 LEU A 743 11.533 -3.270 5.568 1.00 0.00 H new ATOM 581 N LYS A 744 9.616 -4.142 1.636 1.00 0.00 N ATOM 582 CA LYS A 744 9.421 -4.641 0.301 1.00 0.00 C ATOM 583 C LYS A 744 7.948 -4.663 -0.113 1.00 0.00 C ATOM 584 O LYS A 744 7.049 -4.633 0.730 1.00 0.00 O ATOM 585 CB LYS A 744 10.070 -6.014 0.152 1.00 0.00 C ATOM 586 CG LYS A 744 11.594 -6.020 0.379 1.00 0.00 C ATOM 587 CD LYS A 744 12.324 -5.053 -0.557 1.00 0.00 C ATOM 588 CE LYS A 744 12.017 -5.359 -2.008 1.00 0.00 C ATOM 589 NZ LYS A 744 12.634 -4.399 -2.922 1.00 0.00 N ATOM 0 H LYS A 744 9.468 -4.835 2.370 1.00 0.00 H new ATOM 0 HA LYS A 744 9.912 -3.948 -0.383 1.00 0.00 H new ATOM 0 HB2 LYS A 744 9.606 -6.702 0.859 1.00 0.00 H new ATOM 0 HB3 LYS A 744 9.861 -6.396 -0.847 1.00 0.00 H new ATOM 0 HG2 LYS A 744 11.806 -5.751 1.414 1.00 0.00 H new ATOM 0 HG3 LYS A 744 11.978 -7.029 0.227 1.00 0.00 H new ATOM 0 HD2 LYS A 744 12.029 -4.029 -0.328 1.00 0.00 H new ATOM 0 HD3 LYS A 744 13.399 -5.121 -0.388 1.00 0.00 H new ATOM 0 HE2 LYS A 744 12.369 -6.362 -2.247 1.00 0.00 H new ATOM 0 HE3 LYS A 744 10.937 -5.356 -2.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 12.395 -4.650 -3.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 12.280 -3.444 -2.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 13.667 -4.419 -2.801 1.00 0.00 H new ATOM 603 N ARG A 745 7.725 -4.756 -1.420 1.00 0.00 N ATOM 604 CA ARG A 745 6.390 -4.666 -2.030 1.00 0.00 C ATOM 605 C ARG A 745 5.570 -5.906 -1.753 1.00 0.00 C ATOM 606 O ARG A 745 4.502 -5.838 -1.136 1.00 0.00 O ATOM 607 CB ARG A 745 6.535 -4.497 -3.542 1.00 0.00 C ATOM 608 CG ARG A 745 7.329 -3.276 -3.944 1.00 0.00 C ATOM 609 CD ARG A 745 7.772 -3.324 -5.393 1.00 0.00 C ATOM 610 NE ARG A 745 6.669 -3.396 -6.345 1.00 0.00 N ATOM 611 CZ ARG A 745 6.831 -3.455 -7.671 1.00 0.00 C ATOM 612 NH1 ARG A 745 8.052 -3.523 -8.190 1.00 0.00 N ATOM 613 NH2 ARG A 745 5.777 -3.463 -8.477 1.00 0.00 N ATOM 0 H ARG A 745 8.472 -4.898 -2.100 1.00 0.00 H new ATOM 0 HA ARG A 745 5.877 -3.808 -1.594 1.00 0.00 H new ATOM 0 HB2 ARG A 745 7.017 -5.384 -3.953 1.00 0.00 H new ATOM 0 HB3 ARG A 745 5.543 -4.437 -3.989 1.00 0.00 H new ATOM 0 HG2 ARG A 745 6.725 -2.384 -3.781 1.00 0.00 H new ATOM 0 HG3 ARG A 745 8.206 -3.189 -3.302 1.00 0.00 H new ATOM 0 HD2 ARG A 745 8.369 -2.438 -5.610 1.00 0.00 H new ATOM 0 HD3 ARG A 745 8.420 -4.189 -5.536 1.00 0.00 H new ATOM 0 HE ARG A 745 5.718 -3.402 -5.977 1.00 0.00 H new ATOM 0 HH11 ARG A 745 8.867 -3.530 -7.577 1.00 0.00 H new ATOM 0 HH12 ARG A 745 8.174 -3.568 -9.202 1.00 0.00 H new ATOM 0 HH21 ARG A 745 4.836 -3.424 -8.086 1.00 0.00 H new ATOM 0 HH22 ARG A 745 5.908 -3.508 -9.488 1.00 0.00 H new ATOM 627 N SER A 746 6.091 -7.038 -2.190 1.00 0.00 N ATOM 628 CA SER A 746 5.407 -8.298 -2.077 1.00 0.00 C ATOM 629 C SER A 746 5.107 -8.656 -0.612 1.00 0.00 C ATOM 630 O SER A 746 4.046 -9.169 -0.321 1.00 0.00 O ATOM 631 CB SER A 746 6.227 -9.372 -2.784 1.00 0.00 C ATOM 632 OG SER A 746 6.530 -8.949 -4.123 1.00 0.00 O ATOM 0 H SER A 746 7.007 -7.102 -2.635 1.00 0.00 H new ATOM 0 HA SER A 746 4.435 -8.226 -2.565 1.00 0.00 H new ATOM 0 HB2 SER A 746 7.149 -9.559 -2.234 1.00 0.00 H new ATOM 0 HB3 SER A 746 5.673 -10.310 -2.806 1.00 0.00 H new ATOM 0 HG SER A 746 7.058 -9.641 -4.573 1.00 0.00 H new ATOM 638 N GLU A 747 6.032 -8.319 0.298 1.00 0.00 N ATOM 639 CA GLU A 747 5.862 -8.554 1.738 1.00 0.00 C ATOM 640 C GLU A 747 4.579 -7.912 2.275 1.00 0.00 C ATOM 641 O GLU A 747 3.839 -8.541 3.029 1.00 0.00 O ATOM 642 CB GLU A 747 7.055 -8.007 2.523 1.00 0.00 C ATOM 643 CG GLU A 747 6.910 -8.162 4.036 1.00 0.00 C ATOM 644 CD GLU A 747 6.884 -9.603 4.479 1.00 0.00 C ATOM 645 OE1 GLU A 747 7.968 -10.200 4.637 1.00 0.00 O ATOM 646 OE2 GLU A 747 5.794 -10.173 4.673 1.00 0.00 O ATOM 0 H GLU A 747 6.918 -7.876 0.056 1.00 0.00 H new ATOM 0 HA GLU A 747 5.795 -9.634 1.872 1.00 0.00 H new ATOM 0 HB2 GLU A 747 7.960 -8.520 2.198 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.184 -6.951 2.284 1.00 0.00 H new ATOM 0 HG2 GLU A 747 7.737 -7.650 4.529 1.00 0.00 H new ATOM 0 HG3 GLU A 747 5.992 -7.671 4.360 1.00 0.00 H new ATOM 653 N LEU A 748 4.317 -6.680 1.860 1.00 0.00 N ATOM 654 CA LEU A 748 3.163 -5.928 2.338 1.00 0.00 C ATOM 655 C LEU A 748 1.873 -6.693 2.037 1.00 0.00 C ATOM 656 O LEU A 748 1.036 -6.936 2.923 1.00 0.00 O ATOM 657 CB LEU A 748 3.146 -4.540 1.682 1.00 0.00 C ATOM 658 CG LEU A 748 2.063 -3.568 2.154 1.00 0.00 C ATOM 659 CD1 LEU A 748 2.222 -3.272 3.637 1.00 0.00 C ATOM 660 CD2 LEU A 748 2.120 -2.283 1.343 1.00 0.00 C ATOM 0 H LEU A 748 4.894 -6.176 1.187 1.00 0.00 H new ATOM 0 HA LEU A 748 3.234 -5.801 3.418 1.00 0.00 H new ATOM 0 HB2 LEU A 748 4.117 -4.074 1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 748 3.037 -4.674 0.606 1.00 0.00 H new ATOM 0 HG LEU A 748 1.088 -4.032 2.001 1.00 0.00 H new ATOM 0 HD11 LEU A 748 1.443 -2.579 3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 748 2.137 -4.199 4.204 1.00 0.00 H new ATOM 0 HD13 LEU A 748 3.200 -2.826 3.816 1.00 0.00 H new ATOM 0 HD21 LEU A 748 1.344 -1.600 1.689 1.00 0.00 H new ATOM 0 HD22 LEU A 748 3.097 -1.816 1.469 1.00 0.00 H new ATOM 0 HD23 LEU A 748 1.960 -2.510 0.289 1.00 0.00 H new ATOM 672 N VAL A 749 1.756 -7.121 0.802 1.00 0.00 N ATOM 673 CA VAL A 749 0.611 -7.879 0.360 1.00 0.00 C ATOM 674 C VAL A 749 0.635 -9.252 1.033 1.00 0.00 C ATOM 675 O VAL A 749 -0.378 -9.730 1.507 1.00 0.00 O ATOM 676 CB VAL A 749 0.612 -8.054 -1.183 1.00 0.00 C ATOM 677 CG1 VAL A 749 -0.676 -8.700 -1.663 1.00 0.00 C ATOM 678 CG2 VAL A 749 0.825 -6.726 -1.875 1.00 0.00 C ATOM 0 H VAL A 749 2.452 -6.953 0.076 1.00 0.00 H new ATOM 0 HA VAL A 749 -0.294 -7.337 0.636 1.00 0.00 H new ATOM 0 HB VAL A 749 1.440 -8.715 -1.440 1.00 0.00 H new ATOM 0 HG11 VAL A 749 -0.646 -8.810 -2.747 1.00 0.00 H new ATOM 0 HG12 VAL A 749 -0.784 -9.682 -1.202 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -1.523 -8.073 -1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 749 0.822 -6.874 -2.955 1.00 0.00 H new ATOM 0 HG22 VAL A 749 0.024 -6.040 -1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 749 1.783 -6.306 -1.569 1.00 0.00 H new ATOM 688 N ASN A 750 1.827 -9.812 1.135 1.00 0.00 N ATOM 689 CA ASN A 750 2.085 -11.132 1.712 1.00 0.00 C ATOM 690 C ASN A 750 1.468 -11.277 3.093 1.00 0.00 C ATOM 691 O ASN A 750 0.607 -12.160 3.315 1.00 0.00 O ATOM 692 CB ASN A 750 3.613 -11.385 1.747 1.00 0.00 C ATOM 693 CG ASN A 750 4.037 -12.623 2.506 1.00 0.00 C ATOM 694 OD1 ASN A 750 4.025 -13.724 1.974 1.00 0.00 O ATOM 695 ND2 ASN A 750 4.545 -12.435 3.695 1.00 0.00 N ATOM 0 H ASN A 750 2.676 -9.349 0.809 1.00 0.00 H new ATOM 0 HA ASN A 750 1.612 -11.886 1.083 1.00 0.00 H new ATOM 0 HB2 ASN A 750 3.977 -11.462 0.723 1.00 0.00 H new ATOM 0 HB3 ASN A 750 4.100 -10.518 2.194 1.00 0.00 H new ATOM 0 HD21 ASN A 750 4.947 -13.220 4.208 1.00 0.00 H new ATOM 0 HD22 ASN A 750 4.539 -11.504 4.111 1.00 0.00 H new ATOM 702 N TRP A 751 1.836 -10.393 4.009 1.00 0.00 N ATOM 703 CA TRP A 751 1.301 -10.499 5.349 1.00 0.00 C ATOM 704 C TRP A 751 -0.165 -10.093 5.371 1.00 0.00 C ATOM 705 O TRP A 751 -0.943 -10.639 6.147 1.00 0.00 O ATOM 706 CB TRP A 751 2.126 -9.724 6.421 1.00 0.00 C ATOM 707 CG TRP A 751 2.080 -8.216 6.347 1.00 0.00 C ATOM 708 CD1 TRP A 751 2.982 -7.397 5.752 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.082 -7.352 6.926 1.00 0.00 C ATOM 710 NE1 TRP A 751 2.602 -6.088 5.904 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.438 -6.038 6.619 1.00 0.00 C ATOM 712 CE3 TRP A 751 -0.082 -7.575 7.667 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.675 -4.944 7.021 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.838 -6.494 8.068 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.457 -5.192 7.745 1.00 0.00 C ATOM 0 H TRP A 751 2.482 -9.619 3.853 1.00 0.00 H new ATOM 0 HA TRP A 751 1.382 -11.549 5.630 1.00 0.00 H new ATOM 0 HB2 TRP A 751 1.775 -10.028 7.407 1.00 0.00 H new ATOM 0 HB3 TRP A 751 3.167 -10.038 6.343 1.00 0.00 H new ATOM 0 HD1 TRP A 751 3.870 -7.727 5.234 1.00 0.00 H new ATOM 0 HE1 TRP A 751 3.108 -5.280 5.541 1.00 0.00 H new ATOM 0 HE3 TRP A 751 -0.385 -8.580 7.922 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 0.968 -3.935 6.769 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.739 -6.658 8.641 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -1.068 -4.364 8.073 1.00 0.00 H new ATOM 726 N TYR A 752 -0.547 -9.177 4.466 1.00 0.00 N ATOM 727 CA TYR A 752 -1.918 -8.683 4.414 1.00 0.00 C ATOM 728 C TYR A 752 -2.859 -9.824 4.137 1.00 0.00 C ATOM 729 O TYR A 752 -3.877 -9.984 4.808 1.00 0.00 O ATOM 730 CB TYR A 752 -2.082 -7.608 3.334 1.00 0.00 C ATOM 731 CG TYR A 752 -3.415 -6.887 3.387 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.852 -6.330 4.586 1.00 0.00 C ATOM 733 CD2 TYR A 752 -4.227 -6.721 2.251 1.00 0.00 C ATOM 734 CE1 TYR A 752 -5.031 -5.644 4.666 1.00 0.00 C ATOM 735 CE2 TYR A 752 -5.404 -6.040 2.339 1.00 0.00 C ATOM 736 CZ TYR A 752 -5.804 -5.499 3.549 1.00 0.00 C ATOM 737 OH TYR A 752 -6.978 -4.805 3.637 1.00 0.00 O ATOM 0 H TYR A 752 0.076 -8.770 3.768 1.00 0.00 H new ATOM 0 HA TYR A 752 -2.153 -8.235 5.380 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -1.280 -6.877 3.437 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.968 -8.071 2.354 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -3.246 -6.443 5.473 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -3.916 -7.136 1.303 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.350 -5.219 5.606 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -6.026 -5.922 1.464 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.101 -4.485 4.555 1.00 0.00 H new ATOM 747 N LEU A 753 -2.482 -10.635 3.182 1.00 0.00 N ATOM 748 CA LEU A 753 -3.268 -11.765 2.777 1.00 0.00 C ATOM 749 C LEU A 753 -3.366 -12.767 3.906 1.00 0.00 C ATOM 750 O LEU A 753 -4.447 -13.207 4.253 1.00 0.00 O ATOM 751 CB LEU A 753 -2.667 -12.390 1.547 1.00 0.00 C ATOM 752 CG LEU A 753 -2.452 -11.426 0.389 1.00 0.00 C ATOM 753 CD1 LEU A 753 -1.808 -12.127 -0.761 1.00 0.00 C ATOM 754 CD2 LEU A 753 -3.739 -10.707 -0.023 1.00 0.00 C ATOM 0 H LEU A 753 -1.612 -10.526 2.661 1.00 0.00 H new ATOM 0 HA LEU A 753 -4.278 -11.433 2.535 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -1.709 -12.837 1.813 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -3.315 -13.200 1.213 1.00 0.00 H new ATOM 0 HG LEU A 753 -1.773 -10.645 0.732 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -1.662 -11.423 -1.580 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -0.843 -12.527 -0.449 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -2.449 -12.944 -1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -3.529 -10.032 -0.853 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -4.483 -11.441 -0.332 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -4.123 -10.135 0.822 1.00 0.00 H new ATOM 766 N LYS A 754 -2.236 -13.059 4.523 1.00 0.00 N ATOM 767 CA LYS A 754 -2.194 -13.981 5.678 1.00 0.00 C ATOM 768 C LYS A 754 -3.121 -13.526 6.823 1.00 0.00 C ATOM 769 O LYS A 754 -3.731 -14.348 7.514 1.00 0.00 O ATOM 770 CB LYS A 754 -0.757 -14.141 6.184 1.00 0.00 C ATOM 771 CG LYS A 754 0.106 -15.259 5.537 1.00 0.00 C ATOM 772 CD LYS A 754 0.233 -15.193 4.008 1.00 0.00 C ATOM 773 CE LYS A 754 -0.949 -15.842 3.289 1.00 0.00 C ATOM 774 NZ LYS A 754 -0.763 -15.893 1.824 1.00 0.00 N ATOM 0 H LYS A 754 -1.328 -12.679 4.255 1.00 0.00 H new ATOM 0 HA LYS A 754 -2.560 -14.948 5.332 1.00 0.00 H new ATOM 0 HB2 LYS A 754 -0.241 -13.191 6.041 1.00 0.00 H new ATOM 0 HB3 LYS A 754 -0.796 -14.324 7.258 1.00 0.00 H new ATOM 0 HG2 LYS A 754 1.106 -15.219 5.969 1.00 0.00 H new ATOM 0 HG3 LYS A 754 -0.320 -16.225 5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 754 0.313 -14.151 3.699 1.00 0.00 H new ATOM 0 HD3 LYS A 754 1.155 -15.688 3.702 1.00 0.00 H new ATOM 0 HE2 LYS A 754 -1.090 -16.854 3.669 1.00 0.00 H new ATOM 0 HE3 LYS A 754 -1.858 -15.286 3.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 -1.592 -16.342 1.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 -0.655 -14.927 1.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 0.089 -16.446 1.601 1.00 0.00 H new ATOM 788 N GLU A 755 -3.239 -12.232 6.993 1.00 0.00 N ATOM 789 CA GLU A 755 -4.083 -11.667 8.045 1.00 0.00 C ATOM 790 C GLU A 755 -5.558 -11.647 7.640 1.00 0.00 C ATOM 791 O GLU A 755 -6.434 -11.977 8.446 1.00 0.00 O ATOM 792 CB GLU A 755 -3.627 -10.257 8.427 1.00 0.00 C ATOM 793 CG GLU A 755 -2.204 -10.178 8.968 1.00 0.00 C ATOM 794 CD GLU A 755 -1.997 -10.904 10.276 1.00 0.00 C ATOM 795 OE1 GLU A 755 -2.120 -12.143 10.326 1.00 0.00 O ATOM 796 OE2 GLU A 755 -1.636 -10.254 11.268 1.00 0.00 O ATOM 0 H GLU A 755 -2.762 -11.537 6.418 1.00 0.00 H new ATOM 0 HA GLU A 755 -3.978 -12.316 8.915 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -3.705 -9.614 7.551 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -4.310 -9.859 9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -1.521 -10.590 8.225 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -1.936 -9.130 9.101 1.00 0.00 H new ATOM 803 N ILE A 756 -5.839 -11.282 6.391 1.00 0.00 N ATOM 804 CA ILE A 756 -7.227 -11.195 5.922 1.00 0.00 C ATOM 805 C ILE A 756 -7.835 -12.569 5.766 1.00 0.00 C ATOM 806 O ILE A 756 -9.042 -12.717 5.810 1.00 0.00 O ATOM 807 CB ILE A 756 -7.389 -10.447 4.572 1.00 0.00 C ATOM 808 CG1 ILE A 756 -6.653 -11.217 3.480 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.891 -9.013 4.690 1.00 0.00 C ATOM 810 CD1 ILE A 756 -6.767 -10.663 2.094 1.00 0.00 C ATOM 0 H ILE A 756 -5.137 -11.044 5.691 1.00 0.00 H new ATOM 0 HA ILE A 756 -7.744 -10.622 6.692 1.00 0.00 H new ATOM 0 HB ILE A 756 -8.444 -10.395 4.305 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -5.597 -11.264 3.745 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -7.025 -12.241 3.472 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -7.013 -8.506 3.733 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -7.466 -8.490 5.454 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.837 -9.016 4.967 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -6.205 -11.292 1.404 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -7.815 -10.643 1.795 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -6.364 -9.650 2.073 1.00 0.00 H new ATOM 822 N GLU A 757 -6.995 -13.586 5.601 1.00 0.00 N ATOM 823 CA GLU A 757 -7.463 -14.959 5.435 1.00 0.00 C ATOM 824 C GLU A 757 -8.227 -15.492 6.647 1.00 0.00 C ATOM 825 O GLU A 757 -8.845 -16.549 6.588 1.00 0.00 O ATOM 826 CB GLU A 757 -6.352 -15.888 4.956 1.00 0.00 C ATOM 827 CG GLU A 757 -6.055 -15.706 3.472 1.00 0.00 C ATOM 828 CD GLU A 757 -4.969 -16.607 2.958 1.00 0.00 C ATOM 829 OE1 GLU A 757 -5.175 -17.831 2.903 1.00 0.00 O ATOM 830 OE2 GLU A 757 -3.895 -16.114 2.565 1.00 0.00 O ATOM 0 H GLU A 757 -5.980 -13.484 5.579 1.00 0.00 H new ATOM 0 HA GLU A 757 -8.204 -14.936 4.636 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -5.447 -15.698 5.533 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -6.638 -16.923 5.144 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -6.966 -15.889 2.903 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -5.770 -14.669 3.292 1.00 0.00 H new ATOM 837 N SER A 758 -8.229 -14.722 7.709 1.00 0.00 N ATOM 838 CA SER A 758 -9.006 -15.008 8.879 1.00 0.00 C ATOM 839 C SER A 758 -10.515 -14.749 8.583 1.00 0.00 C ATOM 840 O SER A 758 -11.394 -15.371 9.183 1.00 0.00 O ATOM 841 CB SER A 758 -8.518 -14.107 10.025 1.00 0.00 C ATOM 842 OG SER A 758 -9.204 -14.367 11.239 1.00 0.00 O ATOM 0 H SER A 758 -7.679 -13.866 7.780 1.00 0.00 H new ATOM 0 HA SER A 758 -8.887 -16.053 9.165 1.00 0.00 H new ATOM 0 HB2 SER A 758 -7.449 -14.258 10.174 1.00 0.00 H new ATOM 0 HB3 SER A 758 -8.657 -13.062 9.748 1.00 0.00 H new ATOM 0 HG SER A 758 -8.863 -13.775 11.941 1.00 0.00 H new ATOM 848 N GLU A 759 -10.800 -13.847 7.640 1.00 0.00 N ATOM 849 CA GLU A 759 -12.181 -13.486 7.311 1.00 0.00 C ATOM 850 C GLU A 759 -12.559 -13.947 5.889 1.00 0.00 C ATOM 851 O GLU A 759 -13.708 -13.783 5.447 1.00 0.00 O ATOM 852 CB GLU A 759 -12.388 -11.961 7.445 1.00 0.00 C ATOM 853 CG GLU A 759 -11.540 -11.139 6.481 1.00 0.00 C ATOM 854 CD GLU A 759 -11.767 -9.656 6.583 1.00 0.00 C ATOM 855 OE1 GLU A 759 -12.731 -9.158 5.997 1.00 0.00 O ATOM 856 OE2 GLU A 759 -10.955 -8.950 7.224 1.00 0.00 O ATOM 0 H GLU A 759 -10.094 -13.354 7.092 1.00 0.00 H new ATOM 0 HA GLU A 759 -12.834 -13.998 8.018 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -13.440 -11.730 7.277 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -12.155 -11.660 8.466 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -10.487 -11.349 6.669 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -11.752 -11.460 5.461 1.00 0.00 H new ATOM 863 N ILE A 760 -11.605 -14.524 5.180 1.00 0.00 N ATOM 864 CA ILE A 760 -11.839 -14.950 3.807 1.00 0.00 C ATOM 865 C ILE A 760 -12.557 -16.284 3.787 1.00 0.00 C ATOM 866 O ILE A 760 -11.990 -17.311 4.178 1.00 0.00 O ATOM 867 CB ILE A 760 -10.517 -15.069 2.989 1.00 0.00 C ATOM 868 CG1 ILE A 760 -9.742 -13.743 2.969 1.00 0.00 C ATOM 869 CG2 ILE A 760 -10.781 -15.559 1.571 1.00 0.00 C ATOM 870 CD1 ILE A 760 -10.505 -12.565 2.411 1.00 0.00 C ATOM 0 H ILE A 760 -10.664 -14.709 5.528 1.00 0.00 H new ATOM 0 HA ILE A 760 -12.456 -14.183 3.340 1.00 0.00 H new ATOM 0 HB ILE A 760 -9.897 -15.811 3.492 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -9.431 -13.506 3.987 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -8.834 -13.879 2.382 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -9.838 -15.630 1.029 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -11.254 -16.540 1.607 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -11.441 -14.857 1.060 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -9.874 -11.677 2.439 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -10.793 -12.773 1.381 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -11.399 -12.394 3.010 1.00 0.00 H new ATOM 882 N ASP A 761 -13.799 -16.260 3.373 1.00 0.00 N ATOM 883 CA ASP A 761 -14.600 -17.485 3.272 1.00 0.00 C ATOM 884 C ASP A 761 -14.785 -17.868 1.806 1.00 0.00 C ATOM 885 O ASP A 761 -15.134 -18.998 1.470 1.00 0.00 O ATOM 886 CB ASP A 761 -15.962 -17.296 3.959 1.00 0.00 C ATOM 887 CG ASP A 761 -16.796 -18.560 3.989 1.00 0.00 C ATOM 888 OD1 ASP A 761 -16.508 -19.444 4.816 1.00 0.00 O ATOM 889 OD2 ASP A 761 -17.746 -18.697 3.188 1.00 0.00 O ATOM 0 H ASP A 761 -14.291 -15.410 3.097 1.00 0.00 H new ATOM 0 HA ASP A 761 -14.073 -18.293 3.780 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -15.802 -16.950 4.980 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -16.517 -16.514 3.441 1.00 0.00 H new ATOM 894 N SER A 762 -14.477 -16.945 0.940 1.00 0.00 N ATOM 895 CA SER A 762 -14.659 -17.138 -0.471 1.00 0.00 C ATOM 896 C SER A 762 -13.478 -16.551 -1.209 1.00 0.00 C ATOM 897 O SER A 762 -12.884 -15.566 -0.738 1.00 0.00 O ATOM 898 CB SER A 762 -15.975 -16.465 -0.928 1.00 0.00 C ATOM 899 OG SER A 762 -16.185 -16.604 -2.329 1.00 0.00 O ATOM 0 H SER A 762 -14.092 -16.035 1.193 1.00 0.00 H new ATOM 0 HA SER A 762 -14.723 -18.203 -0.692 1.00 0.00 H new ATOM 0 HB2 SER A 762 -16.814 -16.906 -0.390 1.00 0.00 H new ATOM 0 HB3 SER A 762 -15.951 -15.407 -0.668 1.00 0.00 H new ATOM 0 HG SER A 762 -17.026 -16.168 -2.579 1.00 0.00 H new ATOM 905 N GLU A 763 -13.147 -17.127 -2.366 1.00 0.00 N ATOM 906 CA GLU A 763 -12.043 -16.642 -3.182 1.00 0.00 C ATOM 907 C GLU A 763 -12.322 -15.208 -3.643 1.00 0.00 C ATOM 908 O GLU A 763 -11.406 -14.413 -3.806 1.00 0.00 O ATOM 909 CB GLU A 763 -11.787 -17.576 -4.376 1.00 0.00 C ATOM 910 CG GLU A 763 -10.608 -17.151 -5.232 1.00 0.00 C ATOM 911 CD GLU A 763 -10.286 -18.107 -6.350 1.00 0.00 C ATOM 912 OE1 GLU A 763 -10.965 -18.086 -7.378 1.00 0.00 O ATOM 913 OE2 GLU A 763 -9.299 -18.870 -6.225 1.00 0.00 O ATOM 0 H GLU A 763 -13.633 -17.934 -2.757 1.00 0.00 H new ATOM 0 HA GLU A 763 -11.137 -16.637 -2.576 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -11.613 -18.586 -4.006 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -12.682 -17.614 -4.997 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -10.816 -16.169 -5.656 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -9.730 -17.044 -4.595 1.00 0.00 H new ATOM 920 N GLU A 764 -13.608 -14.885 -3.772 1.00 0.00 N ATOM 921 CA GLU A 764 -14.076 -13.547 -4.134 1.00 0.00 C ATOM 922 C GLU A 764 -13.500 -12.481 -3.215 1.00 0.00 C ATOM 923 O GLU A 764 -13.014 -11.456 -3.676 1.00 0.00 O ATOM 924 CB GLU A 764 -15.591 -13.513 -4.061 1.00 0.00 C ATOM 925 CG GLU A 764 -16.272 -14.133 -5.252 1.00 0.00 C ATOM 926 CD GLU A 764 -16.201 -13.227 -6.449 1.00 0.00 C ATOM 927 OE1 GLU A 764 -15.225 -13.289 -7.221 1.00 0.00 O ATOM 928 OE2 GLU A 764 -17.122 -12.410 -6.618 1.00 0.00 O ATOM 0 H GLU A 764 -14.364 -15.554 -3.626 1.00 0.00 H new ATOM 0 HA GLU A 764 -13.738 -13.332 -5.148 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -15.913 -14.033 -3.159 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -15.917 -12.477 -3.966 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -15.802 -15.088 -5.487 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -17.314 -14.341 -5.011 1.00 0.00 H new ATOM 935 N GLU A 765 -13.522 -12.752 -1.920 1.00 0.00 N ATOM 936 CA GLU A 765 -13.022 -11.810 -0.939 1.00 0.00 C ATOM 937 C GLU A 765 -11.530 -11.651 -1.074 1.00 0.00 C ATOM 938 O GLU A 765 -10.996 -10.542 -0.962 1.00 0.00 O ATOM 939 CB GLU A 765 -13.352 -12.263 0.475 1.00 0.00 C ATOM 940 CG GLU A 765 -14.820 -12.391 0.763 1.00 0.00 C ATOM 941 CD GLU A 765 -15.576 -11.134 0.431 1.00 0.00 C ATOM 942 OE1 GLU A 765 -15.242 -10.048 0.951 1.00 0.00 O ATOM 943 OE2 GLU A 765 -16.542 -11.207 -0.333 1.00 0.00 O ATOM 0 H GLU A 765 -13.883 -13.621 -1.525 1.00 0.00 H new ATOM 0 HA GLU A 765 -13.509 -10.853 -1.124 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -12.874 -13.226 0.655 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -12.917 -11.555 1.180 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -15.230 -13.222 0.189 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -14.962 -12.631 1.817 1.00 0.00 H new ATOM 950 N LEU A 766 -10.863 -12.756 -1.343 1.00 0.00 N ATOM 951 CA LEU A 766 -9.432 -12.771 -1.485 1.00 0.00 C ATOM 952 C LEU A 766 -9.032 -11.962 -2.715 1.00 0.00 C ATOM 953 O LEU A 766 -8.272 -11.011 -2.599 1.00 0.00 O ATOM 954 CB LEU A 766 -8.918 -14.217 -1.569 1.00 0.00 C ATOM 955 CG LEU A 766 -7.396 -14.413 -1.568 1.00 0.00 C ATOM 956 CD1 LEU A 766 -6.775 -13.859 -0.289 1.00 0.00 C ATOM 957 CD2 LEU A 766 -7.059 -15.889 -1.715 1.00 0.00 C ATOM 0 H LEU A 766 -11.305 -13.667 -1.468 1.00 0.00 H new ATOM 0 HA LEU A 766 -8.974 -12.311 -0.609 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -9.332 -14.774 -0.729 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -9.318 -14.667 -2.478 1.00 0.00 H new ATOM 0 HG LEU A 766 -6.981 -13.865 -2.414 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -5.696 -14.010 -0.313 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -6.990 -12.793 -0.212 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -7.195 -14.377 0.573 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -5.977 -16.017 -1.713 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -7.492 -16.446 -0.884 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -7.467 -16.264 -2.654 1.00 0.00 H new ATOM 969 N ILE A 767 -9.619 -12.301 -3.865 1.00 0.00 N ATOM 970 CA ILE A 767 -9.338 -11.621 -5.140 1.00 0.00 C ATOM 971 C ILE A 767 -9.627 -10.128 -5.038 1.00 0.00 C ATOM 972 O ILE A 767 -8.814 -9.304 -5.453 1.00 0.00 O ATOM 973 CB ILE A 767 -10.155 -12.238 -6.310 1.00 0.00 C ATOM 974 CG1 ILE A 767 -9.740 -13.692 -6.528 1.00 0.00 C ATOM 975 CG2 ILE A 767 -9.988 -11.429 -7.603 1.00 0.00 C ATOM 976 CD1 ILE A 767 -10.525 -14.394 -7.605 1.00 0.00 C ATOM 0 H ILE A 767 -10.303 -13.054 -3.943 1.00 0.00 H new ATOM 0 HA ILE A 767 -8.278 -11.762 -5.351 1.00 0.00 H new ATOM 0 HB ILE A 767 -11.210 -12.206 -6.039 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -8.681 -13.723 -6.785 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -9.857 -14.238 -5.592 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -10.573 -11.890 -8.399 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -10.336 -10.409 -7.441 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -8.936 -11.413 -7.889 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -10.173 -15.421 -7.701 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -11.583 -14.396 -7.342 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -10.388 -13.874 -8.553 1.00 0.00 H new ATOM 988 N ASN A 768 -10.771 -9.794 -4.463 1.00 0.00 N ATOM 989 CA ASN A 768 -11.162 -8.412 -4.256 1.00 0.00 C ATOM 990 C ASN A 768 -10.116 -7.664 -3.447 1.00 0.00 C ATOM 991 O ASN A 768 -9.634 -6.612 -3.860 1.00 0.00 O ATOM 992 CB ASN A 768 -12.529 -8.344 -3.550 1.00 0.00 C ATOM 993 CG ASN A 768 -12.824 -6.977 -2.969 1.00 0.00 C ATOM 994 OD1 ASN A 768 -13.363 -6.094 -3.643 1.00 0.00 O ATOM 995 ND2 ASN A 768 -12.495 -6.810 -1.712 1.00 0.00 N ATOM 0 H ASN A 768 -11.453 -10.474 -4.127 1.00 0.00 H new ATOM 0 HA ASN A 768 -11.243 -7.933 -5.232 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -13.313 -8.608 -4.260 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -12.558 -9.086 -2.752 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -12.683 -5.920 -1.250 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -12.051 -7.570 -1.196 1.00 0.00 H new ATOM 1002 N LYS A 769 -9.736 -8.243 -2.324 1.00 0.00 N ATOM 1003 CA LYS A 769 -8.806 -7.629 -1.405 1.00 0.00 C ATOM 1004 C LYS A 769 -7.435 -7.476 -2.056 1.00 0.00 C ATOM 1005 O LYS A 769 -6.793 -6.435 -1.914 1.00 0.00 O ATOM 1006 CB LYS A 769 -8.732 -8.472 -0.143 1.00 0.00 C ATOM 1007 CG LYS A 769 -8.087 -7.786 1.047 1.00 0.00 C ATOM 1008 CD LYS A 769 -8.845 -6.541 1.502 1.00 0.00 C ATOM 1009 CE LYS A 769 -10.292 -6.828 1.860 1.00 0.00 C ATOM 1010 NZ LYS A 769 -10.443 -7.865 2.903 1.00 0.00 N ATOM 0 H LYS A 769 -10.068 -9.160 -2.025 1.00 0.00 H new ATOM 0 HA LYS A 769 -9.151 -6.629 -1.141 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -9.742 -8.775 0.134 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -8.176 -9.383 -0.364 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -8.026 -8.491 1.876 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -7.065 -7.508 0.789 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -8.341 -6.111 2.367 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -8.814 -5.793 0.710 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -10.764 -5.907 2.203 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -10.825 -7.144 0.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -11.446 -7.954 3.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -10.098 -8.776 2.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -9.891 -7.596 3.743 1.00 0.00 H new ATOM 1024 N LYS A 770 -7.024 -8.501 -2.804 1.00 0.00 N ATOM 1025 CA LYS A 770 -5.761 -8.486 -3.531 1.00 0.00 C ATOM 1026 C LYS A 770 -5.771 -7.413 -4.599 1.00 0.00 C ATOM 1027 O LYS A 770 -4.801 -6.684 -4.762 1.00 0.00 O ATOM 1028 CB LYS A 770 -5.480 -9.842 -4.176 1.00 0.00 C ATOM 1029 CG LYS A 770 -5.269 -10.968 -3.183 1.00 0.00 C ATOM 1030 CD LYS A 770 -5.075 -12.307 -3.869 1.00 0.00 C ATOM 1031 CE LYS A 770 -3.835 -12.318 -4.743 1.00 0.00 C ATOM 1032 NZ LYS A 770 -3.661 -13.606 -5.421 1.00 0.00 N ATOM 0 H LYS A 770 -7.559 -9.362 -2.921 1.00 0.00 H new ATOM 0 HA LYS A 770 -4.972 -8.269 -2.811 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -6.312 -10.100 -4.831 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -4.594 -9.756 -4.805 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -4.398 -10.748 -2.566 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -6.127 -11.025 -2.513 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -4.997 -13.093 -3.117 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -5.950 -12.534 -4.477 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -3.906 -11.523 -5.485 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -2.957 -12.107 -4.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -2.804 -13.576 -6.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -3.568 -14.362 -4.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -4.487 -13.796 -6.023 1.00 0.00 H new ATOM 1046 N ARG A 771 -6.876 -7.312 -5.311 1.00 0.00 N ATOM 1047 CA ARG A 771 -7.030 -6.322 -6.356 1.00 0.00 C ATOM 1048 C ARG A 771 -6.936 -4.913 -5.787 1.00 0.00 C ATOM 1049 O ARG A 771 -6.250 -4.063 -6.345 1.00 0.00 O ATOM 1050 CB ARG A 771 -8.358 -6.508 -7.088 1.00 0.00 C ATOM 1051 CG ARG A 771 -8.601 -5.498 -8.198 1.00 0.00 C ATOM 1052 CD ARG A 771 -9.928 -5.734 -8.881 1.00 0.00 C ATOM 1053 NE ARG A 771 -9.983 -7.050 -9.534 1.00 0.00 N ATOM 1054 CZ ARG A 771 -11.079 -7.810 -9.628 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -12.221 -7.412 -9.082 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -11.027 -8.969 -10.271 1.00 0.00 N ATOM 0 H ARG A 771 -7.690 -7.913 -5.181 1.00 0.00 H new ATOM 0 HA ARG A 771 -6.218 -6.461 -7.070 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -8.390 -7.512 -7.511 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -9.171 -6.441 -6.366 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -8.577 -4.489 -7.785 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -7.797 -5.561 -8.931 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -10.732 -5.659 -8.148 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -10.098 -4.954 -9.623 1.00 0.00 H new ATOM 0 HE ARG A 771 -9.122 -7.410 -9.946 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -12.266 -6.521 -8.587 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -13.053 -7.997 -9.157 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -10.152 -9.279 -10.693 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -11.862 -9.550 -10.344 1.00 0.00 H new ATOM 1070 N ILE A 772 -7.598 -4.685 -4.657 1.00 0.00 N ATOM 1071 CA ILE A 772 -7.590 -3.374 -4.035 1.00 0.00 C ATOM 1072 C ILE A 772 -6.188 -3.039 -3.565 1.00 0.00 C ATOM 1073 O ILE A 772 -5.649 -2.017 -3.956 1.00 0.00 O ATOM 1074 CB ILE A 772 -8.581 -3.235 -2.830 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -10.022 -3.635 -3.215 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -8.570 -1.788 -2.293 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -10.673 -2.768 -4.274 1.00 0.00 C ATOM 0 H ILE A 772 -8.143 -5.389 -4.159 1.00 0.00 H new ATOM 0 HA ILE A 772 -7.927 -2.675 -4.801 1.00 0.00 H new ATOM 0 HB ILE A 772 -8.241 -3.919 -2.052 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -10.013 -4.666 -3.568 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -10.641 -3.610 -2.318 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.263 -1.705 -1.456 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -7.565 -1.532 -1.959 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -8.874 -1.104 -3.085 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -11.681 -3.132 -4.473 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -10.722 -1.738 -3.921 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -10.085 -2.810 -5.191 1.00 0.00 H new ATOM 1089 N ILE A 773 -5.575 -3.935 -2.779 1.00 0.00 N ATOM 1090 CA ILE A 773 -4.247 -3.670 -2.236 1.00 0.00 C ATOM 1091 C ILE A 773 -3.215 -3.450 -3.357 1.00 0.00 C ATOM 1092 O ILE A 773 -2.446 -2.498 -3.311 1.00 0.00 O ATOM 1093 CB ILE A 773 -3.756 -4.763 -1.198 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -2.417 -4.373 -0.558 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -3.645 -6.142 -1.812 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.479 -3.104 0.260 1.00 0.00 C ATOM 0 H ILE A 773 -5.975 -4.835 -2.511 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.336 -2.743 -1.669 1.00 0.00 H new ATOM 0 HB ILE A 773 -4.522 -4.802 -0.423 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -2.078 -5.189 0.080 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -1.671 -4.252 -1.343 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -3.305 -6.850 -1.057 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -4.620 -6.452 -2.188 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -2.930 -6.118 -2.634 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.495 -2.893 0.680 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -2.786 -2.275 -0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.200 -3.227 1.068 1.00 0.00 H new ATOM 1108 N GLU A 774 -3.276 -4.270 -4.393 1.00 0.00 N ATOM 1109 CA GLU A 774 -2.334 -4.181 -5.486 1.00 0.00 C ATOM 1110 C GLU A 774 -2.567 -2.909 -6.319 1.00 0.00 C ATOM 1111 O GLU A 774 -1.609 -2.211 -6.676 1.00 0.00 O ATOM 1112 CB GLU A 774 -2.379 -5.457 -6.334 1.00 0.00 C ATOM 1113 CG GLU A 774 -1.360 -5.520 -7.452 1.00 0.00 C ATOM 1114 CD GLU A 774 -1.331 -6.869 -8.120 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -2.196 -7.151 -8.985 1.00 0.00 O ATOM 1116 OE2 GLU A 774 -0.437 -7.682 -7.797 1.00 0.00 O ATOM 0 H GLU A 774 -3.973 -5.007 -4.496 1.00 0.00 H new ATOM 0 HA GLU A 774 -1.327 -4.100 -5.076 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -2.231 -6.316 -5.679 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -3.375 -5.553 -6.765 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -1.589 -4.754 -8.193 1.00 0.00 H new ATOM 0 HG3 GLU A 774 -0.371 -5.293 -7.053 1.00 0.00 H new ATOM 1123 N LYS A 775 -3.835 -2.571 -6.585 1.00 0.00 N ATOM 1124 CA LYS A 775 -4.139 -1.347 -7.332 1.00 0.00 C ATOM 1125 C LYS A 775 -3.762 -0.116 -6.509 1.00 0.00 C ATOM 1126 O LYS A 775 -3.290 0.889 -7.055 1.00 0.00 O ATOM 1127 CB LYS A 775 -5.622 -1.295 -7.785 1.00 0.00 C ATOM 1128 CG LYS A 775 -6.041 0.002 -8.516 1.00 0.00 C ATOM 1129 CD LYS A 775 -5.219 0.275 -9.794 1.00 0.00 C ATOM 1130 CE LYS A 775 -5.490 -0.730 -10.914 1.00 0.00 C ATOM 1131 NZ LYS A 775 -6.871 -0.629 -11.445 1.00 0.00 N ATOM 0 H LYS A 775 -4.650 -3.115 -6.301 1.00 0.00 H new ATOM 0 HA LYS A 775 -3.536 -1.352 -8.240 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -5.814 -2.142 -8.443 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -6.258 -1.421 -6.909 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -7.097 -0.062 -8.778 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -5.932 0.846 -7.835 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -5.443 1.279 -10.154 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -4.158 0.255 -9.546 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -4.780 -0.566 -11.724 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -5.321 -1.740 -10.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -6.964 -1.232 -12.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -7.546 -0.942 -10.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -7.073 0.358 -11.702 1.00 0.00 H new ATOM 1145 N VAL A 776 -3.937 -0.199 -5.203 1.00 0.00 N ATOM 1146 CA VAL A 776 -3.553 0.888 -4.325 1.00 0.00 C ATOM 1147 C VAL A 776 -2.038 1.052 -4.304 1.00 0.00 C ATOM 1148 O VAL A 776 -1.556 2.164 -4.362 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.138 0.751 -2.885 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -3.585 1.830 -1.957 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -5.655 0.866 -2.930 1.00 0.00 C ATOM 0 H VAL A 776 -4.342 -1.006 -4.729 1.00 0.00 H new ATOM 0 HA VAL A 776 -3.993 1.796 -4.736 1.00 0.00 H new ATOM 0 HB VAL A 776 -3.847 -0.226 -2.498 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -4.012 1.707 -0.962 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -2.500 1.740 -1.900 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -3.848 2.814 -2.346 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -6.057 0.769 -1.922 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -5.934 1.836 -3.341 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -6.061 0.075 -3.560 1.00 0.00 H new ATOM 1161 N ILE A 777 -1.296 -0.054 -4.269 1.00 0.00 N ATOM 1162 CA ILE A 777 0.170 0.013 -4.322 1.00 0.00 C ATOM 1163 C ILE A 777 0.620 0.627 -5.653 1.00 0.00 C ATOM 1164 O ILE A 777 1.526 1.472 -5.685 1.00 0.00 O ATOM 1165 CB ILE A 777 0.843 -1.372 -4.094 1.00 0.00 C ATOM 1166 CG1 ILE A 777 0.503 -1.892 -2.691 1.00 0.00 C ATOM 1167 CG2 ILE A 777 2.365 -1.277 -4.266 1.00 0.00 C ATOM 1168 CD1 ILE A 777 1.007 -3.287 -2.411 1.00 0.00 C ATOM 0 H ILE A 777 -1.677 -0.998 -4.205 1.00 0.00 H new ATOM 0 HA ILE A 777 0.496 0.653 -3.502 1.00 0.00 H new ATOM 0 HB ILE A 777 0.459 -2.068 -4.839 1.00 0.00 H new ATOM 0 HG12 ILE A 777 0.923 -1.210 -1.951 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -0.579 -1.876 -2.562 1.00 0.00 H new ATOM 0 HG21 ILE A 777 2.812 -2.258 -4.102 1.00 0.00 H new ATOM 0 HG22 ILE A 777 2.597 -0.937 -5.276 1.00 0.00 H new ATOM 0 HG23 ILE A 777 2.769 -0.568 -3.543 1.00 0.00 H new ATOM 0 HD11 ILE A 777 0.725 -3.579 -1.399 1.00 0.00 H new ATOM 0 HD12 ILE A 777 0.567 -3.983 -3.126 1.00 0.00 H new ATOM 0 HD13 ILE A 777 2.093 -3.307 -2.506 1.00 0.00 H new ATOM 1180 N HIS A 778 -0.035 0.225 -6.737 1.00 0.00 N ATOM 1181 CA HIS A 778 0.206 0.806 -8.061 1.00 0.00 C ATOM 1182 C HIS A 778 -0.065 2.320 -8.041 1.00 0.00 C ATOM 1183 O HIS A 778 0.729 3.104 -8.536 1.00 0.00 O ATOM 1184 CB HIS A 778 -0.656 0.084 -9.129 1.00 0.00 C ATOM 1185 CG HIS A 778 -0.700 0.746 -10.489 1.00 0.00 C ATOM 1186 ND1 HIS A 778 0.329 0.736 -11.407 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -1.697 1.457 -11.060 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -0.065 1.426 -12.480 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -1.298 1.888 -12.320 1.00 0.00 N ATOM 0 H HIS A 778 -0.744 -0.508 -6.728 1.00 0.00 H new ATOM 0 HA HIS A 778 1.253 0.663 -8.327 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -0.277 -0.931 -9.251 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -1.675 0.001 -8.752 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -2.656 1.659 -10.607 1.00 0.00 H new ATOM 0 HE1 HIS A 778 0.539 1.587 -13.361 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -1.840 2.443 -12.982 1.00 0.00 H new ATOM 1197 N ARG A 779 -1.175 2.711 -7.439 1.00 0.00 N ATOM 1198 CA ARG A 779 -1.527 4.119 -7.310 1.00 0.00 C ATOM 1199 C ARG A 779 -0.462 4.855 -6.484 1.00 0.00 C ATOM 1200 O ARG A 779 0.063 5.901 -6.883 1.00 0.00 O ATOM 1201 CB ARG A 779 -2.877 4.257 -6.617 1.00 0.00 C ATOM 1202 CG ARG A 779 -3.297 5.693 -6.393 1.00 0.00 C ATOM 1203 CD ARG A 779 -4.456 5.793 -5.428 1.00 0.00 C ATOM 1204 NE ARG A 779 -5.676 5.184 -5.948 1.00 0.00 N ATOM 1205 CZ ARG A 779 -6.797 5.039 -5.249 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -6.809 5.322 -3.966 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -7.907 4.608 -5.841 1.00 0.00 N ATOM 0 H ARG A 779 -1.854 2.070 -7.028 1.00 0.00 H new ATOM 0 HA ARG A 779 -1.581 4.556 -8.307 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -3.637 3.754 -7.215 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -2.837 3.744 -5.656 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -2.452 6.263 -6.007 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -3.577 6.143 -7.346 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -4.185 5.309 -4.490 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -4.646 6.842 -5.202 1.00 0.00 H new ATOM 0 HE ARG A 779 -5.668 4.848 -6.911 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -5.959 5.652 -3.509 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -7.668 5.212 -3.427 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -7.901 4.387 -6.837 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -8.764 4.499 -5.299 1.00 0.00 H new ATOM 1221 N LEU A 780 -0.143 4.261 -5.369 1.00 0.00 N ATOM 1222 CA LEU A 780 0.809 4.748 -4.398 1.00 0.00 C ATOM 1223 C LEU A 780 2.182 5.010 -5.033 1.00 0.00 C ATOM 1224 O LEU A 780 2.804 6.041 -4.773 1.00 0.00 O ATOM 1225 CB LEU A 780 0.903 3.698 -3.282 1.00 0.00 C ATOM 1226 CG LEU A 780 1.820 3.972 -2.109 1.00 0.00 C ATOM 1227 CD1 LEU A 780 1.408 5.232 -1.389 1.00 0.00 C ATOM 1228 CD2 LEU A 780 1.808 2.790 -1.155 1.00 0.00 C ATOM 0 H LEU A 780 -0.562 3.373 -5.093 1.00 0.00 H new ATOM 0 HA LEU A 780 0.476 5.704 -3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -0.101 3.542 -2.888 1.00 0.00 H new ATOM 0 HB3 LEU A 780 1.217 2.758 -3.736 1.00 0.00 H new ATOM 0 HG LEU A 780 2.833 4.113 -2.486 1.00 0.00 H new ATOM 0 HD11 LEU A 780 2.081 5.408 -0.550 1.00 0.00 H new ATOM 0 HD12 LEU A 780 1.456 6.076 -2.077 1.00 0.00 H new ATOM 0 HD13 LEU A 780 0.388 5.123 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 780 2.470 2.995 -0.314 1.00 0.00 H new ATOM 0 HD22 LEU A 780 0.794 2.629 -0.788 1.00 0.00 H new ATOM 0 HD23 LEU A 780 2.151 1.897 -1.678 1.00 0.00 H new ATOM 1240 N THR A 781 2.615 4.116 -5.900 1.00 0.00 N ATOM 1241 CA THR A 781 3.921 4.230 -6.533 1.00 0.00 C ATOM 1242 C THR A 781 3.882 4.979 -7.872 1.00 0.00 C ATOM 1243 O THR A 781 4.929 5.198 -8.490 1.00 0.00 O ATOM 1244 CB THR A 781 4.556 2.830 -6.753 1.00 0.00 C ATOM 1245 OG1 THR A 781 3.587 1.921 -7.313 1.00 0.00 O ATOM 1246 CG2 THR A 781 5.099 2.260 -5.464 1.00 0.00 C ATOM 0 H THR A 781 2.080 3.296 -6.186 1.00 0.00 H new ATOM 0 HA THR A 781 4.531 4.814 -5.845 1.00 0.00 H new ATOM 0 HB THR A 781 5.385 2.952 -7.450 1.00 0.00 H new ATOM 0 HG1 THR A 781 3.061 1.518 -6.591 1.00 0.00 H new ATOM 0 HG21 THR A 781 5.536 1.280 -5.655 1.00 0.00 H new ATOM 0 HG22 THR A 781 5.864 2.927 -5.065 1.00 0.00 H new ATOM 0 HG23 THR A 781 4.290 2.162 -4.740 1.00 0.00 H new ATOM 1254 N HIS A 782 2.715 5.415 -8.305 1.00 0.00 N ATOM 1255 CA HIS A 782 2.636 5.991 -9.639 1.00 0.00 C ATOM 1256 C HIS A 782 1.825 7.283 -9.692 1.00 0.00 C ATOM 1257 O HIS A 782 2.319 8.309 -10.164 1.00 0.00 O ATOM 1258 CB HIS A 782 2.108 4.934 -10.636 1.00 0.00 C ATOM 1259 CG HIS A 782 2.043 5.383 -12.061 1.00 0.00 C ATOM 1260 ND1 HIS A 782 3.138 5.774 -12.784 1.00 0.00 N ATOM 1261 CD2 HIS A 782 0.980 5.511 -12.890 1.00 0.00 C ATOM 1262 CE1 HIS A 782 2.733 6.122 -13.993 1.00 0.00 C ATOM 1263 NE2 HIS A 782 1.423 5.980 -14.120 1.00 0.00 N ATOM 0 H HIS A 782 1.840 5.386 -7.781 1.00 0.00 H new ATOM 0 HA HIS A 782 3.646 6.279 -9.932 1.00 0.00 H new ATOM 0 HB2 HIS A 782 2.746 4.052 -10.578 1.00 0.00 H new ATOM 0 HB3 HIS A 782 1.110 4.627 -10.322 1.00 0.00 H new ATOM 0 HD2 HIS A 782 -0.045 5.285 -12.636 1.00 0.00 H new ATOM 0 HE1 HIS A 782 3.387 6.477 -14.776 1.00 0.00 H new ATOM 0 HE2 HIS A 782 0.858 6.174 -14.947 1.00 0.00 H new ATOM 1271 N TYR A 783 0.612 7.229 -9.204 1.00 0.00 N ATOM 1272 CA TYR A 783 -0.311 8.370 -9.242 1.00 0.00 C ATOM 1273 C TYR A 783 0.084 9.413 -8.224 1.00 0.00 C ATOM 1274 O TYR A 783 0.192 10.599 -8.524 1.00 0.00 O ATOM 1275 CB TYR A 783 -1.744 7.933 -8.893 1.00 0.00 C ATOM 1276 CG TYR A 783 -2.463 7.034 -9.878 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -1.928 5.826 -10.296 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -3.710 7.397 -10.363 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -2.608 5.011 -11.166 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -4.400 6.586 -11.228 1.00 0.00 C ATOM 1281 CZ TYR A 783 -3.848 5.394 -11.626 1.00 0.00 C ATOM 1282 OH TYR A 783 -4.538 4.577 -12.490 1.00 0.00 O ATOM 0 H TYR A 783 0.221 6.396 -8.764 1.00 0.00 H new ATOM 0 HA TYR A 783 -0.266 8.774 -10.253 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -1.714 7.421 -7.931 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -2.346 8.832 -8.757 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -0.959 5.520 -9.931 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -4.146 8.335 -10.054 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -2.174 4.076 -11.488 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -5.372 6.884 -11.594 1.00 0.00 H new ATOM 0 HH TYR A 783 -5.396 4.992 -12.718 1.00 0.00 H new ATOM 1292 N ASP A 784 0.266 8.968 -7.015 1.00 0.00 N ATOM 1293 CA ASP A 784 0.508 9.873 -5.910 1.00 0.00 C ATOM 1294 C ASP A 784 1.956 10.026 -5.599 1.00 0.00 C ATOM 1295 O ASP A 784 2.419 11.137 -5.339 1.00 0.00 O ATOM 1296 CB ASP A 784 -0.281 9.441 -4.690 1.00 0.00 C ATOM 1297 CG ASP A 784 -1.756 9.557 -4.944 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -2.280 10.692 -4.923 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -2.396 8.541 -5.234 1.00 0.00 O ATOM 0 H ASP A 784 0.253 7.980 -6.760 1.00 0.00 H new ATOM 0 HA ASP A 784 0.160 10.859 -6.217 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -0.031 8.411 -4.435 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -0.005 10.058 -3.835 1.00 0.00 H new ATOM 1304 N HIS A 785 2.668 8.908 -5.584 1.00 0.00 N ATOM 1305 CA HIS A 785 4.113 8.882 -5.364 1.00 0.00 C ATOM 1306 C HIS A 785 4.458 9.412 -3.946 1.00 0.00 C ATOM 1307 O HIS A 785 5.537 9.942 -3.693 1.00 0.00 O ATOM 1308 CB HIS A 785 4.835 9.675 -6.491 1.00 0.00 C ATOM 1309 CG HIS A 785 6.322 9.481 -6.545 1.00 0.00 C ATOM 1310 ND1 HIS A 785 7.236 10.506 -6.512 1.00 0.00 N ATOM 1311 CD2 HIS A 785 7.040 8.347 -6.680 1.00 0.00 C ATOM 1312 CE1 HIS A 785 8.450 9.979 -6.628 1.00 0.00 C ATOM 1313 NE2 HIS A 785 8.390 8.662 -6.733 1.00 0.00 N ATOM 0 H HIS A 785 2.259 7.984 -5.725 1.00 0.00 H new ATOM 0 HA HIS A 785 4.471 7.853 -5.409 1.00 0.00 H new ATOM 0 HB2 HIS A 785 4.410 9.383 -7.451 1.00 0.00 H new ATOM 0 HB3 HIS A 785 4.626 10.737 -6.360 1.00 0.00 H new ATOM 0 HD2 HIS A 785 6.628 7.350 -6.738 1.00 0.00 H new ATOM 0 HE1 HIS A 785 9.366 10.551 -6.636 1.00 0.00 H new ATOM 0 HE2 HIS A 785 9.172 8.014 -6.832 1.00 0.00 H new ATOM 1321 N VAL A 786 3.544 9.198 -3.002 1.00 0.00 N ATOM 1322 CA VAL A 786 3.782 9.594 -1.603 1.00 0.00 C ATOM 1323 C VAL A 786 4.604 8.525 -0.894 1.00 0.00 C ATOM 1324 O VAL A 786 4.872 8.603 0.301 1.00 0.00 O ATOM 1325 CB VAL A 786 2.468 9.858 -0.797 1.00 0.00 C ATOM 1326 CG1 VAL A 786 1.663 10.979 -1.402 1.00 0.00 C ATOM 1327 CG2 VAL A 786 1.615 8.610 -0.671 1.00 0.00 C ATOM 0 H VAL A 786 2.639 8.758 -3.170 1.00 0.00 H new ATOM 0 HA VAL A 786 4.326 10.538 -1.640 1.00 0.00 H new ATOM 0 HB VAL A 786 2.776 10.156 0.205 1.00 0.00 H new ATOM 0 HG11 VAL A 786 0.757 11.134 -0.816 1.00 0.00 H new ATOM 0 HG12 VAL A 786 2.256 11.894 -1.403 1.00 0.00 H new ATOM 0 HG13 VAL A 786 1.393 10.721 -2.426 1.00 0.00 H new ATOM 0 HG21 VAL A 786 0.713 8.841 -0.104 1.00 0.00 H new ATOM 0 HG22 VAL A 786 1.338 8.257 -1.664 1.00 0.00 H new ATOM 0 HG23 VAL A 786 2.180 7.834 -0.154 1.00 0.00 H new ATOM 1337 N LEU A 787 4.990 7.536 -1.649 1.00 0.00 N ATOM 1338 CA LEU A 787 5.775 6.470 -1.154 1.00 0.00 C ATOM 1339 C LEU A 787 7.222 6.793 -1.448 1.00 0.00 C ATOM 1340 O LEU A 787 7.589 7.126 -2.588 1.00 0.00 O ATOM 1341 CB LEU A 787 5.352 5.173 -1.825 1.00 0.00 C ATOM 1342 CG LEU A 787 5.881 3.871 -1.222 1.00 0.00 C ATOM 1343 CD1 LEU A 787 5.431 3.717 0.208 1.00 0.00 C ATOM 1344 CD2 LEU A 787 5.391 2.700 -2.019 1.00 0.00 C ATOM 0 H LEU A 787 4.758 7.458 -2.639 1.00 0.00 H new ATOM 0 HA LEU A 787 5.640 6.345 -0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 787 4.263 5.130 -1.821 1.00 0.00 H new ATOM 0 HB3 LEU A 787 5.665 5.214 -2.868 1.00 0.00 H new ATOM 0 HG LEU A 787 6.970 3.907 -1.248 1.00 0.00 H new ATOM 0 HD11 LEU A 787 5.821 2.783 0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 787 5.805 4.553 0.799 1.00 0.00 H new ATOM 0 HD13 LEU A 787 4.342 3.703 0.247 1.00 0.00 H new ATOM 0 HD21 LEU A 787 5.773 1.777 -1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 787 4.301 2.683 -2.008 1.00 0.00 H new ATOM 0 HD23 LEU A 787 5.742 2.787 -3.047 1.00 0.00 H new ATOM 1356 N ILE A 788 8.015 6.712 -0.444 1.00 0.00 N ATOM 1357 CA ILE A 788 9.381 7.047 -0.504 1.00 0.00 C ATOM 1358 C ILE A 788 10.124 5.802 -0.875 1.00 0.00 C ATOM 1359 O ILE A 788 10.064 4.801 -0.156 1.00 0.00 O ATOM 1360 CB ILE A 788 9.860 7.504 0.886 1.00 0.00 C ATOM 1361 CG1 ILE A 788 8.997 8.659 1.415 1.00 0.00 C ATOM 1362 CG2 ILE A 788 11.340 7.893 0.864 1.00 0.00 C ATOM 1363 CD1 ILE A 788 9.230 8.963 2.881 1.00 0.00 C ATOM 0 H ILE A 788 7.713 6.397 0.478 1.00 0.00 H new ATOM 0 HA ILE A 788 9.549 7.847 -1.225 1.00 0.00 H new ATOM 0 HB ILE A 788 9.748 6.660 1.567 1.00 0.00 H new ATOM 0 HG12 ILE A 788 9.203 9.555 0.829 1.00 0.00 H new ATOM 0 HG13 ILE A 788 7.945 8.415 1.265 1.00 0.00 H new ATOM 0 HG21 ILE A 788 11.647 8.211 1.860 1.00 0.00 H new ATOM 0 HG22 ILE A 788 11.937 7.035 0.557 1.00 0.00 H new ATOM 0 HG23 ILE A 788 11.491 8.711 0.159 1.00 0.00 H new ATOM 0 HD11 ILE A 788 8.588 9.789 3.188 1.00 0.00 H new ATOM 0 HD12 ILE A 788 8.996 8.081 3.477 1.00 0.00 H new ATOM 0 HD13 ILE A 788 10.274 9.238 3.034 1.00 0.00 H new ATOM 1375 N GLU A 789 10.755 5.822 -1.991 1.00 0.00 N ATOM 1376 CA GLU A 789 11.537 4.711 -2.392 1.00 0.00 C ATOM 1377 C GLU A 789 12.988 5.040 -2.255 1.00 0.00 C ATOM 1378 O GLU A 789 13.425 6.149 -2.603 1.00 0.00 O ATOM 1379 CB GLU A 789 11.204 4.239 -3.805 1.00 0.00 C ATOM 1380 CG GLU A 789 11.274 5.297 -4.873 1.00 0.00 C ATOM 1381 CD GLU A 789 11.076 4.706 -6.240 1.00 0.00 C ATOM 1382 OE1 GLU A 789 9.944 4.326 -6.568 1.00 0.00 O ATOM 1383 OE2 GLU A 789 12.058 4.587 -7.013 1.00 0.00 O ATOM 0 H GLU A 789 10.745 6.602 -2.648 1.00 0.00 H new ATOM 0 HA GLU A 789 11.296 3.878 -1.732 1.00 0.00 H new ATOM 0 HB2 GLU A 789 11.888 3.433 -4.071 1.00 0.00 H new ATOM 0 HB3 GLU A 789 10.199 3.817 -3.801 1.00 0.00 H new ATOM 0 HG2 GLU A 789 10.512 6.054 -4.688 1.00 0.00 H new ATOM 0 HG3 GLU A 789 12.240 5.799 -4.828 1.00 0.00 H new ATOM 1666 N TYR A 810 13.246 -0.087 -1.850 1.00 0.00 N ATOM 1667 CA TYR A 810 12.774 -0.292 -0.518 1.00 0.00 C ATOM 1668 C TYR A 810 11.812 0.852 -0.255 1.00 0.00 C ATOM 1669 O TYR A 810 12.168 2.018 -0.454 1.00 0.00 O ATOM 1670 CB TYR A 810 13.964 -0.294 0.456 1.00 0.00 C ATOM 1671 CG TYR A 810 15.039 -1.344 0.126 1.00 0.00 C ATOM 1672 CD1 TYR A 810 16.018 -1.094 -0.842 1.00 0.00 C ATOM 1673 CD2 TYR A 810 15.077 -2.568 0.780 1.00 0.00 C ATOM 1674 CE1 TYR A 810 16.990 -2.027 -1.144 1.00 0.00 C ATOM 1675 CE2 TYR A 810 16.055 -3.510 0.479 1.00 0.00 C ATOM 1676 CZ TYR A 810 17.008 -3.231 -0.484 1.00 0.00 C ATOM 1677 OH TYR A 810 17.982 -4.170 -0.788 1.00 0.00 O ATOM 0 HA TYR A 810 12.271 -1.250 -0.383 1.00 0.00 H new ATOM 0 HB2 TYR A 810 14.423 0.694 0.455 1.00 0.00 H new ATOM 0 HB3 TYR A 810 13.594 -0.472 1.466 1.00 0.00 H new ATOM 0 HD1 TYR A 810 16.013 -0.149 -1.365 1.00 0.00 H new ATOM 0 HD2 TYR A 810 14.336 -2.792 1.533 1.00 0.00 H new ATOM 0 HE1 TYR A 810 17.734 -1.811 -1.897 1.00 0.00 H new ATOM 0 HE2 TYR A 810 16.070 -4.458 0.996 1.00 0.00 H new ATOM 0 HH TYR A 810 17.854 -4.966 -0.231 1.00 0.00 H new ATOM 1687 N LEU A 811 10.609 0.527 0.131 1.00 0.00 N ATOM 1688 CA LEU A 811 9.526 1.492 0.164 1.00 0.00 C ATOM 1689 C LEU A 811 9.092 1.869 1.564 1.00 0.00 C ATOM 1690 O LEU A 811 8.849 1.011 2.403 1.00 0.00 O ATOM 1691 CB LEU A 811 8.339 0.913 -0.590 1.00 0.00 C ATOM 1692 CG LEU A 811 8.603 0.530 -2.045 1.00 0.00 C ATOM 1693 CD1 LEU A 811 7.395 -0.148 -2.640 1.00 0.00 C ATOM 1694 CD2 LEU A 811 8.960 1.755 -2.852 1.00 0.00 C ATOM 0 H LEU A 811 10.344 -0.411 0.433 1.00 0.00 H new ATOM 0 HA LEU A 811 9.894 2.406 -0.302 1.00 0.00 H new ATOM 0 HB2 LEU A 811 7.990 0.028 -0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 811 7.527 1.640 -0.566 1.00 0.00 H new ATOM 0 HG LEU A 811 9.441 -0.166 -2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 811 7.601 -0.414 -3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 811 7.168 -1.050 -2.072 1.00 0.00 H new ATOM 0 HD13 LEU A 811 6.542 0.529 -2.602 1.00 0.00 H new ATOM 0 HD21 LEU A 811 9.146 1.468 -3.887 1.00 0.00 H new ATOM 0 HD22 LEU A 811 8.136 2.468 -2.816 1.00 0.00 H new ATOM 0 HD23 LEU A 811 9.857 2.216 -2.437 1.00 0.00 H new ATOM 1706 N VAL A 812 8.977 3.153 1.791 1.00 0.00 N ATOM 1707 CA VAL A 812 8.503 3.702 3.044 1.00 0.00 C ATOM 1708 C VAL A 812 7.462 4.786 2.776 1.00 0.00 C ATOM 1709 O VAL A 812 7.608 5.549 1.862 1.00 0.00 O ATOM 1710 CB VAL A 812 9.691 4.200 3.964 1.00 0.00 C ATOM 1711 CG1 VAL A 812 10.812 4.850 3.167 1.00 0.00 C ATOM 1712 CG2 VAL A 812 9.213 5.190 5.013 1.00 0.00 C ATOM 0 H VAL A 812 9.214 3.863 1.098 1.00 0.00 H new ATOM 0 HA VAL A 812 8.016 2.908 3.610 1.00 0.00 H new ATOM 0 HB VAL A 812 10.076 3.304 4.450 1.00 0.00 H new ATOM 0 HG11 VAL A 812 11.601 5.173 3.846 1.00 0.00 H new ATOM 0 HG12 VAL A 812 11.218 4.130 2.456 1.00 0.00 H new ATOM 0 HG13 VAL A 812 10.422 5.713 2.627 1.00 0.00 H new ATOM 0 HG21 VAL A 812 10.057 5.508 5.624 1.00 0.00 H new ATOM 0 HG22 VAL A 812 8.774 6.058 4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 812 8.464 4.715 5.647 1.00 0.00 H new ATOM 1722 N VAL A 813 6.402 4.827 3.548 1.00 0.00 N ATOM 1723 CA VAL A 813 5.349 5.805 3.314 1.00 0.00 C ATOM 1724 C VAL A 813 5.274 6.766 4.495 1.00 0.00 C ATOM 1725 O VAL A 813 5.768 6.457 5.582 1.00 0.00 O ATOM 1726 CB VAL A 813 3.957 5.107 3.059 1.00 0.00 C ATOM 1727 CG1 VAL A 813 3.420 4.409 4.303 1.00 0.00 C ATOM 1728 CG2 VAL A 813 2.919 6.067 2.444 1.00 0.00 C ATOM 0 H VAL A 813 6.240 4.203 4.339 1.00 0.00 H new ATOM 0 HA VAL A 813 5.591 6.368 2.413 1.00 0.00 H new ATOM 0 HB VAL A 813 4.141 4.329 2.317 1.00 0.00 H new ATOM 0 HG11 VAL A 813 2.461 3.945 4.074 1.00 0.00 H new ATOM 0 HG12 VAL A 813 4.126 3.643 4.624 1.00 0.00 H new ATOM 0 HG13 VAL A 813 3.289 5.139 5.102 1.00 0.00 H new ATOM 0 HG21 VAL A 813 1.980 5.536 2.289 1.00 0.00 H new ATOM 0 HG22 VAL A 813 2.754 6.906 3.120 1.00 0.00 H new ATOM 0 HG23 VAL A 813 3.288 6.438 1.488 1.00 0.00 H new ATOM 1738 N ASN A 814 4.710 7.920 4.267 1.00 0.00 N ATOM 1739 CA ASN A 814 4.538 8.921 5.302 1.00 0.00 C ATOM 1740 C ASN A 814 3.064 8.981 5.698 1.00 0.00 C ATOM 1741 O ASN A 814 2.199 8.555 4.923 1.00 0.00 O ATOM 1742 CB ASN A 814 5.016 10.309 4.822 1.00 0.00 C ATOM 1743 CG ASN A 814 4.328 10.781 3.566 1.00 0.00 C ATOM 1744 OD1 ASN A 814 3.271 11.374 3.623 1.00 0.00 O ATOM 1745 ND2 ASN A 814 4.943 10.568 2.439 1.00 0.00 N ATOM 0 H ASN A 814 4.352 8.201 3.354 1.00 0.00 H new ATOM 0 HA ASN A 814 5.143 8.642 6.165 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.846 11.037 5.615 1.00 0.00 H new ATOM 0 HB3 ASN A 814 6.091 10.273 4.646 1.00 0.00 H new ATOM 0 HD21 ASN A 814 4.537 10.904 1.565 1.00 0.00 H new ATOM 0 HD22 ASN A 814 5.831 10.065 2.429 1.00 0.00 H new ATOM 1752 N PRO A 815 2.733 9.518 6.892 1.00 0.00 N ATOM 1753 CA PRO A 815 1.351 9.586 7.371 1.00 0.00 C ATOM 1754 C PRO A 815 0.503 10.680 6.686 1.00 0.00 C ATOM 1755 O PRO A 815 -0.656 10.901 7.062 1.00 0.00 O ATOM 1756 CB PRO A 815 1.494 9.889 8.876 1.00 0.00 C ATOM 1757 CG PRO A 815 2.951 9.764 9.178 1.00 0.00 C ATOM 1758 CD PRO A 815 3.664 10.056 7.898 1.00 0.00 C ATOM 0 HA PRO A 815 0.824 8.658 7.149 1.00 0.00 H new ATOM 0 HB2 PRO A 815 1.130 10.890 9.110 1.00 0.00 H new ATOM 0 HB3 PRO A 815 0.909 9.190 9.473 1.00 0.00 H new ATOM 0 HG2 PRO A 815 3.249 10.464 9.959 1.00 0.00 H new ATOM 0 HG3 PRO A 815 3.190 8.763 9.538 1.00 0.00 H new ATOM 0 HD2 PRO A 815 3.837 11.124 7.763 1.00 0.00 H new ATOM 0 HD3 PRO A 815 4.637 9.568 7.854 1.00 0.00 H new ATOM 1766 N ASN A 816 1.049 11.339 5.661 1.00 0.00 N ATOM 1767 CA ASN A 816 0.293 12.407 4.943 1.00 0.00 C ATOM 1768 C ASN A 816 -0.488 11.779 3.794 1.00 0.00 C ATOM 1769 O ASN A 816 -0.912 12.453 2.851 1.00 0.00 O ATOM 1770 CB ASN A 816 1.218 13.506 4.371 1.00 0.00 C ATOM 1771 CG ASN A 816 2.180 14.099 5.377 1.00 0.00 C ATOM 1772 OD1 ASN A 816 1.861 15.040 6.106 1.00 0.00 O ATOM 1773 ND2 ASN A 816 3.381 13.591 5.387 1.00 0.00 N ATOM 0 H ASN A 816 1.989 11.169 5.304 1.00 0.00 H new ATOM 0 HA ASN A 816 -0.374 12.876 5.666 1.00 0.00 H new ATOM 0 HB2 ASN A 816 1.790 13.088 3.543 1.00 0.00 H new ATOM 0 HB3 ASN A 816 0.601 14.306 3.961 1.00 0.00 H new ATOM 0 HD21 ASN A 816 4.091 13.973 6.012 1.00 0.00 H new ATOM 0 HD22 ASN A 816 3.610 12.812 4.770 1.00 0.00 H new ATOM 1780 N TYR A 817 -0.671 10.481 3.906 1.00 0.00 N ATOM 1781 CA TYR A 817 -1.372 9.656 2.952 1.00 0.00 C ATOM 1782 C TYR A 817 -2.815 10.148 2.729 1.00 0.00 C ATOM 1783 O TYR A 817 -3.498 10.616 3.664 1.00 0.00 O ATOM 1784 CB TYR A 817 -1.339 8.208 3.457 1.00 0.00 C ATOM 1785 CG TYR A 817 -2.007 7.190 2.567 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -1.447 6.825 1.348 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -3.183 6.571 2.964 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -2.049 5.874 0.550 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -3.790 5.625 2.173 1.00 0.00 C ATOM 1790 CZ TYR A 817 -3.222 5.279 0.971 1.00 0.00 C ATOM 1791 OH TYR A 817 -3.830 4.337 0.192 1.00 0.00 O ATOM 0 H TYR A 817 -0.318 9.950 4.702 1.00 0.00 H new ATOM 0 HA TYR A 817 -0.879 9.717 1.982 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -0.298 7.915 3.596 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -1.814 8.174 4.438 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -0.529 7.292 1.022 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -3.629 6.837 3.911 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -1.607 5.597 -0.396 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -4.708 5.156 2.495 1.00 0.00 H new ATOM 0 HH TYR A 817 -4.310 3.701 0.762 1.00 0.00 H new