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 Single : A 718 SER OG : rot 180:sc= 0.0249 USER MOD Single : A 720 TYR OH : rot 180:sc= 0 USER MOD Single : A 721 SER OG : rot 65:sc= 0.11 USER MOD Single : A 724 SER OG : rot -60:sc= 1.14 USER MOD Single : A 725 ASN : amide:sc= -2.08! K(o=-2.1!,f=-0.22) USER MOD Single : A 730 HIS : no HD1:sc= -0.897 K(o=-0.9,f=-0.1) USER MOD Single : A 733 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 741 SER OG : rot -170:sc= -0.785 USER MOD Single : A 744 LYS NZ :NH3+ 146:sc= -0.95! (180deg=-2.5!) USER MOD Single : A 746 SER OG : rot 180:sc= 0 USER MOD Single : A 750 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 752 TYR OH : rot 36:sc= -0.617 USER MOD Single : A 754 LYS NZ :NH3+ 169:sc= -0.0259 (180deg=-0.177) USER MOD Single : A 758 SER OG : rot 180:sc= 0.0422 USER MOD Single : A 762 SER OG : rot 78:sc= 1.25 USER MOD Single : A 768 ASN : amide:sc= -0.146 K(o=-0.15,f=0.4) USER MOD Single : A 769 LYS NZ :NH3+ -177:sc= 1.08 (180deg=1.03) USER MOD Single : A 770 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 775 LYS NZ :NH3+ -167:sc= 1.26 (180deg=1.14) USER MOD Single : A 778 HIS : no HD1:sc= -0.841 X(o=-0.84,f=-0.84) USER MOD Single : A 781 THR OG1 : rot -23:sc= 0.214 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= -0.078 X(o=-0.078,f=-0.09) USER MOD Single : A 810 TYR OH : rot 180:sc= 0 USER MOD Single : A 814 ASN : amide:sc= -0.473 K(o=-0.47,f=-6.4!) USER MOD Single : A 816 ASN : amide:sc= -0.666 K(o=-0.67,f=0) USER MOD Single : A 817 TYR OH : rot 45:sc= -0.757! USER MOD ----------------------------------------------------------------- ATOM 137 N PHE A 717 -16.482 2.653 0.840 1.00 0.00 N ATOM 138 CA PHE A 717 -15.106 2.336 1.070 1.00 0.00 C ATOM 139 C PHE A 717 -14.956 1.155 2.002 1.00 0.00 C ATOM 140 O PHE A 717 -13.921 0.983 2.583 1.00 0.00 O ATOM 141 CB PHE A 717 -14.363 3.575 1.618 1.00 0.00 C ATOM 142 CG PHE A 717 -15.030 4.265 2.793 1.00 0.00 C ATOM 143 CD1 PHE A 717 -14.824 3.831 4.090 1.00 0.00 C ATOM 144 CD2 PHE A 717 -15.852 5.358 2.589 1.00 0.00 C ATOM 145 CE1 PHE A 717 -15.426 4.468 5.155 1.00 0.00 C ATOM 146 CE2 PHE A 717 -16.455 6.000 3.647 1.00 0.00 C ATOM 147 CZ PHE A 717 -16.243 5.556 4.934 1.00 0.00 C ATOM 0 HA PHE A 717 -14.658 2.051 0.118 1.00 0.00 H new ATOM 0 HB2 PHE A 717 -13.359 3.273 1.917 1.00 0.00 H new ATOM 0 HB3 PHE A 717 -14.251 4.298 0.810 1.00 0.00 H new ATOM 0 HD1 PHE A 717 -14.183 2.981 4.271 1.00 0.00 H new ATOM 0 HD2 PHE A 717 -16.024 5.714 1.584 1.00 0.00 H new ATOM 0 HE1 PHE A 717 -15.257 4.115 6.161 1.00 0.00 H new ATOM 0 HE2 PHE A 717 -17.094 6.852 3.468 1.00 0.00 H new ATOM 0 HZ PHE A 717 -16.715 6.058 5.766 1.00 0.00 H new ATOM 157 N SER A 718 -15.973 0.318 2.064 1.00 0.00 N ATOM 158 CA SER A 718 -16.002 -0.855 2.942 1.00 0.00 C ATOM 159 C SER A 718 -14.750 -1.752 2.745 1.00 0.00 C ATOM 160 O SER A 718 -14.141 -2.230 3.711 1.00 0.00 O ATOM 161 CB SER A 718 -17.265 -1.640 2.621 1.00 0.00 C ATOM 162 OG SER A 718 -18.390 -0.763 2.608 1.00 0.00 O ATOM 0 H SER A 718 -16.817 0.427 1.502 1.00 0.00 H new ATOM 0 HA SER A 718 -15.997 -0.529 3.982 1.00 0.00 H new ATOM 0 HB2 SER A 718 -17.163 -2.130 1.653 1.00 0.00 H new ATOM 0 HB3 SER A 718 -17.414 -2.426 3.362 1.00 0.00 H new ATOM 0 HG SER A 718 -19.200 -1.273 2.399 1.00 0.00 H new ATOM 168 N GLU A 719 -14.363 -1.937 1.500 1.00 0.00 N ATOM 169 CA GLU A 719 -13.194 -2.741 1.152 1.00 0.00 C ATOM 170 C GLU A 719 -11.960 -1.950 1.478 1.00 0.00 C ATOM 171 O GLU A 719 -11.004 -2.458 2.071 1.00 0.00 O ATOM 172 CB GLU A 719 -13.230 -3.030 -0.333 1.00 0.00 C ATOM 173 CG GLU A 719 -14.526 -3.656 -0.800 1.00 0.00 C ATOM 174 CD GLU A 719 -14.724 -3.487 -2.275 1.00 0.00 C ATOM 175 OE1 GLU A 719 -15.084 -2.364 -2.704 1.00 0.00 O ATOM 176 OE2 GLU A 719 -14.551 -4.445 -3.029 1.00 0.00 O ATOM 0 H GLU A 719 -14.846 -1.537 0.695 1.00 0.00 H new ATOM 0 HA GLU A 719 -13.192 -3.678 1.708 1.00 0.00 H new ATOM 0 HB2 GLU A 719 -13.068 -2.101 -0.879 1.00 0.00 H new ATOM 0 HB3 GLU A 719 -12.404 -3.695 -0.585 1.00 0.00 H new ATOM 0 HG2 GLU A 719 -14.527 -4.717 -0.552 1.00 0.00 H new ATOM 0 HG3 GLU A 719 -15.362 -3.203 -0.267 1.00 0.00 H new ATOM 183 N TYR A 720 -12.017 -0.688 1.147 1.00 0.00 N ATOM 184 CA TYR A 720 -10.921 0.209 1.353 1.00 0.00 C ATOM 185 C TYR A 720 -10.602 0.412 2.821 1.00 0.00 C ATOM 186 O TYR A 720 -9.479 0.647 3.142 1.00 0.00 O ATOM 187 CB TYR A 720 -11.116 1.530 0.603 1.00 0.00 C ATOM 188 CG TYR A 720 -10.901 1.396 -0.894 1.00 0.00 C ATOM 189 CD1 TYR A 720 -11.833 0.768 -1.708 1.00 0.00 C ATOM 190 CD2 TYR A 720 -9.744 1.882 -1.486 1.00 0.00 C ATOM 191 CE1 TYR A 720 -11.619 0.629 -3.065 1.00 0.00 C ATOM 192 CE2 TYR A 720 -9.527 1.754 -2.842 1.00 0.00 C ATOM 193 CZ TYR A 720 -10.462 1.123 -3.626 1.00 0.00 C ATOM 194 OH TYR A 720 -10.232 0.983 -4.978 1.00 0.00 O ATOM 0 H TYR A 720 -12.836 -0.253 0.722 1.00 0.00 H new ATOM 0 HA TYR A 720 -10.041 -0.268 0.921 1.00 0.00 H new ATOM 0 HB2 TYR A 720 -12.124 1.902 0.788 1.00 0.00 H new ATOM 0 HB3 TYR A 720 -10.424 2.273 0.999 1.00 0.00 H new ATOM 0 HD1 TYR A 720 -12.742 0.381 -1.272 1.00 0.00 H new ATOM 0 HD2 TYR A 720 -9.000 2.369 -0.874 1.00 0.00 H new ATOM 0 HE1 TYR A 720 -12.355 0.136 -3.683 1.00 0.00 H new ATOM 0 HE2 TYR A 720 -8.625 2.149 -3.286 1.00 0.00 H new ATOM 0 HH TYR A 720 -9.370 1.389 -5.207 1.00 0.00 H new ATOM 204 N SER A 721 -11.586 0.301 3.697 1.00 0.00 N ATOM 205 CA SER A 721 -11.369 0.386 5.137 1.00 0.00 C ATOM 206 C SER A 721 -10.419 -0.720 5.618 1.00 0.00 C ATOM 207 O SER A 721 -9.432 -0.453 6.292 1.00 0.00 O ATOM 208 CB SER A 721 -12.709 0.281 5.866 1.00 0.00 C ATOM 209 OG SER A 721 -13.589 1.297 5.442 1.00 0.00 O ATOM 0 H SER A 721 -12.560 0.149 3.433 1.00 0.00 H new ATOM 0 HA SER A 721 -10.908 1.348 5.361 1.00 0.00 H new ATOM 0 HB2 SER A 721 -13.155 -0.695 5.677 1.00 0.00 H new ATOM 0 HB3 SER A 721 -12.550 0.356 6.942 1.00 0.00 H new ATOM 0 HG SER A 721 -13.803 1.170 4.494 1.00 0.00 H new ATOM 215 N ARG A 722 -10.693 -1.944 5.198 1.00 0.00 N ATOM 216 CA ARG A 722 -9.904 -3.103 5.605 1.00 0.00 C ATOM 217 C ARG A 722 -8.469 -2.964 5.059 1.00 0.00 C ATOM 218 O ARG A 722 -7.463 -3.191 5.768 1.00 0.00 O ATOM 219 CB ARG A 722 -10.579 -4.374 5.058 1.00 0.00 C ATOM 220 CG ARG A 722 -10.055 -5.700 5.606 1.00 0.00 C ATOM 221 CD ARG A 722 -10.310 -5.843 7.105 1.00 0.00 C ATOM 222 NE ARG A 722 -11.725 -5.603 7.460 1.00 0.00 N ATOM 223 CZ ARG A 722 -12.567 -6.493 8.015 1.00 0.00 C ATOM 224 NH1 ARG A 722 -12.201 -7.754 8.192 1.00 0.00 N ATOM 225 NH2 ARG A 722 -13.782 -6.102 8.393 1.00 0.00 N ATOM 0 H ARG A 722 -11.464 -2.165 4.568 1.00 0.00 H new ATOM 0 HA ARG A 722 -9.851 -3.167 6.692 1.00 0.00 H new ATOM 0 HB2 ARG A 722 -11.647 -4.313 5.268 1.00 0.00 H new ATOM 0 HB3 ARG A 722 -10.468 -4.382 3.974 1.00 0.00 H new ATOM 0 HG2 ARG A 722 -10.533 -6.525 5.077 1.00 0.00 H new ATOM 0 HG3 ARG A 722 -8.985 -5.774 5.412 1.00 0.00 H new ATOM 0 HD2 ARG A 722 -10.022 -6.844 7.426 1.00 0.00 H new ATOM 0 HD3 ARG A 722 -9.678 -5.140 7.647 1.00 0.00 H new ATOM 0 HE ARG A 722 -12.098 -4.674 7.265 1.00 0.00 H new ATOM 0 HH11 ARG A 722 -11.271 -8.060 7.906 1.00 0.00 H new ATOM 0 HH12 ARG A 722 -12.849 -8.419 8.614 1.00 0.00 H new ATOM 0 HH21 ARG A 722 -14.070 -5.132 8.261 1.00 0.00 H new ATOM 0 HH22 ARG A 722 -14.425 -6.772 8.814 1.00 0.00 H new ATOM 239 N ILE A 723 -8.376 -2.566 3.813 1.00 0.00 N ATOM 240 CA ILE A 723 -7.075 -2.378 3.176 1.00 0.00 C ATOM 241 C ILE A 723 -6.308 -1.161 3.746 1.00 0.00 C ATOM 242 O ILE A 723 -5.120 -1.262 4.059 1.00 0.00 O ATOM 243 CB ILE A 723 -7.175 -2.314 1.622 1.00 0.00 C ATOM 244 CG1 ILE A 723 -7.376 -3.701 0.996 1.00 0.00 C ATOM 245 CG2 ILE A 723 -5.952 -1.670 1.014 1.00 0.00 C ATOM 246 CD1 ILE A 723 -8.665 -4.419 1.334 1.00 0.00 C ATOM 0 H ILE A 723 -9.176 -2.364 3.214 1.00 0.00 H new ATOM 0 HA ILE A 723 -6.492 -3.266 3.421 1.00 0.00 H new ATOM 0 HB ILE A 723 -8.051 -1.703 1.402 1.00 0.00 H new ATOM 0 HG12 ILE A 723 -7.319 -3.597 -0.087 1.00 0.00 H new ATOM 0 HG13 ILE A 723 -6.543 -4.335 1.300 1.00 0.00 H new ATOM 0 HG21 ILE A 723 -6.057 -1.642 -0.071 1.00 0.00 H new ATOM 0 HG22 ILE A 723 -5.849 -0.654 1.395 1.00 0.00 H new ATOM 0 HG23 ILE A 723 -5.067 -2.248 1.279 1.00 0.00 H new ATOM 0 HD11 ILE A 723 -8.686 -5.386 0.831 1.00 0.00 H new ATOM 0 HD12 ILE A 723 -8.726 -4.569 2.412 1.00 0.00 H new ATOM 0 HD13 ILE A 723 -9.513 -3.820 1.003 1.00 0.00 H new ATOM 258 N SER A 724 -6.983 -0.041 3.889 1.00 0.00 N ATOM 259 CA SER A 724 -6.358 1.162 4.459 1.00 0.00 C ATOM 260 C SER A 724 -5.905 0.905 5.886 1.00 0.00 C ATOM 261 O SER A 724 -4.887 1.451 6.324 1.00 0.00 O ATOM 262 CB SER A 724 -7.268 2.401 4.380 1.00 0.00 C ATOM 263 OG SER A 724 -8.495 2.184 5.046 1.00 0.00 O ATOM 0 H SER A 724 -7.961 0.075 3.624 1.00 0.00 H new ATOM 0 HA SER A 724 -5.483 1.384 3.849 1.00 0.00 H new ATOM 0 HB2 SER A 724 -6.759 3.257 4.823 1.00 0.00 H new ATOM 0 HB3 SER A 724 -7.458 2.648 3.336 1.00 0.00 H new ATOM 0 HG SER A 724 -8.964 1.431 4.630 1.00 0.00 H new ATOM 269 N ASN A 725 -6.659 0.058 6.609 1.00 0.00 N ATOM 270 CA ASN A 725 -6.250 -0.389 7.930 1.00 0.00 C ATOM 271 C ASN A 725 -4.931 -1.055 7.869 1.00 0.00 C ATOM 272 O ASN A 725 -4.087 -0.763 8.689 1.00 0.00 O ATOM 273 CB ASN A 725 -7.261 -1.294 8.624 1.00 0.00 C ATOM 274 CG ASN A 725 -8.312 -0.546 9.419 1.00 0.00 C ATOM 275 OD1 ASN A 725 -9.441 -1.017 9.555 1.00 0.00 O ATOM 276 ND2 ASN A 725 -7.944 0.583 9.987 1.00 0.00 N ATOM 0 H ASN A 725 -7.550 -0.323 6.292 1.00 0.00 H new ATOM 0 HA ASN A 725 -6.185 0.514 8.537 1.00 0.00 H new ATOM 0 HB2 ASN A 725 -7.757 -1.910 7.874 1.00 0.00 H new ATOM 0 HB3 ASN A 725 -6.729 -1.972 9.292 1.00 0.00 H new ATOM 0 HD21 ASN A 725 -8.605 1.102 10.565 1.00 0.00 H new ATOM 0 HD22 ASN A 725 -6.998 0.939 9.849 1.00 0.00 H new ATOM 283 N LEU A 726 -4.723 -1.933 6.871 1.00 0.00 N ATOM 284 CA LEU A 726 -3.402 -2.520 6.684 1.00 0.00 C ATOM 285 C LEU A 726 -2.358 -1.440 6.576 1.00 0.00 C ATOM 286 O LEU A 726 -1.394 -1.483 7.268 1.00 0.00 O ATOM 287 CB LEU A 726 -3.322 -3.485 5.466 1.00 0.00 C ATOM 288 CG LEU A 726 -1.929 -3.572 4.762 1.00 0.00 C ATOM 289 CD1 LEU A 726 -1.618 -4.945 4.297 1.00 0.00 C ATOM 290 CD2 LEU A 726 -1.902 -2.668 3.564 1.00 0.00 C ATOM 0 H LEU A 726 -5.433 -2.239 6.206 1.00 0.00 H new ATOM 0 HA LEU A 726 -3.205 -3.128 7.567 1.00 0.00 H new ATOM 0 HB2 LEU A 726 -3.604 -4.484 5.798 1.00 0.00 H new ATOM 0 HB3 LEU A 726 -4.062 -3.173 4.729 1.00 0.00 H new ATOM 0 HG LEU A 726 -1.187 -3.272 5.502 1.00 0.00 H new ATOM 0 HD11 LEU A 726 -0.640 -4.953 3.815 1.00 0.00 H new ATOM 0 HD12 LEU A 726 -1.608 -5.624 5.149 1.00 0.00 H new ATOM 0 HD13 LEU A 726 -2.377 -5.268 3.584 1.00 0.00 H new ATOM 0 HD21 LEU A 726 -0.928 -2.735 3.080 1.00 0.00 H new ATOM 0 HD22 LEU A 726 -2.678 -2.972 2.862 1.00 0.00 H new ATOM 0 HD23 LEU A 726 -2.080 -1.640 3.880 1.00 0.00 H new ATOM 302 N ILE A 727 -2.618 -0.443 5.756 1.00 0.00 N ATOM 303 CA ILE A 727 -1.674 0.632 5.524 1.00 0.00 C ATOM 304 C ILE A 727 -1.354 1.416 6.789 1.00 0.00 C ATOM 305 O ILE A 727 -0.181 1.608 7.118 1.00 0.00 O ATOM 306 CB ILE A 727 -2.137 1.577 4.374 1.00 0.00 C ATOM 307 CG1 ILE A 727 -1.992 0.891 3.021 1.00 0.00 C ATOM 308 CG2 ILE A 727 -1.357 2.876 4.374 1.00 0.00 C ATOM 309 CD1 ILE A 727 -0.544 0.568 2.679 1.00 0.00 C ATOM 0 H ILE A 727 -3.488 -0.354 5.232 1.00 0.00 H new ATOM 0 HA ILE A 727 -0.747 0.155 5.206 1.00 0.00 H new ATOM 0 HB ILE A 727 -3.188 1.808 4.548 1.00 0.00 H new ATOM 0 HG12 ILE A 727 -2.575 -0.030 3.021 1.00 0.00 H new ATOM 0 HG13 ILE A 727 -2.410 1.533 2.246 1.00 0.00 H new ATOM 0 HG21 ILE A 727 -1.706 3.510 3.559 1.00 0.00 H new ATOM 0 HG22 ILE A 727 -1.506 3.390 5.323 1.00 0.00 H new ATOM 0 HG23 ILE A 727 -0.296 2.664 4.239 1.00 0.00 H new ATOM 0 HD11 ILE A 727 -0.500 0.081 1.705 1.00 0.00 H new ATOM 0 HD12 ILE A 727 0.037 1.490 2.650 1.00 0.00 H new ATOM 0 HD13 ILE A 727 -0.131 -0.098 3.437 1.00 0.00 H new ATOM 321 N VAL A 728 -2.369 1.831 7.499 1.00 0.00 N ATOM 322 CA VAL A 728 -2.156 2.619 8.688 1.00 0.00 C ATOM 323 C VAL A 728 -1.521 1.777 9.820 1.00 0.00 C ATOM 324 O VAL A 728 -0.594 2.231 10.496 1.00 0.00 O ATOM 325 CB VAL A 728 -3.450 3.378 9.149 1.00 0.00 C ATOM 326 CG1 VAL A 728 -4.610 2.438 9.378 1.00 0.00 C ATOM 327 CG2 VAL A 728 -3.203 4.204 10.389 1.00 0.00 C ATOM 0 H VAL A 728 -3.346 1.639 7.279 1.00 0.00 H new ATOM 0 HA VAL A 728 -1.437 3.396 8.431 1.00 0.00 H new ATOM 0 HB VAL A 728 -3.715 4.050 8.333 1.00 0.00 H new ATOM 0 HG11 VAL A 728 -5.483 3.008 9.696 1.00 0.00 H new ATOM 0 HG12 VAL A 728 -4.839 1.910 8.452 1.00 0.00 H new ATOM 0 HG13 VAL A 728 -4.347 1.717 10.152 1.00 0.00 H new ATOM 0 HG21 VAL A 728 -4.123 4.714 10.676 1.00 0.00 H new ATOM 0 HG22 VAL A 728 -2.880 3.553 11.202 1.00 0.00 H new ATOM 0 HG23 VAL A 728 -2.427 4.942 10.186 1.00 0.00 H new ATOM 337 N LEU A 729 -1.980 0.535 9.969 1.00 0.00 N ATOM 338 CA LEU A 729 -1.448 -0.376 10.980 1.00 0.00 C ATOM 339 C LEU A 729 -0.017 -0.758 10.647 1.00 0.00 C ATOM 340 O LEU A 729 0.830 -0.852 11.532 1.00 0.00 O ATOM 341 CB LEU A 729 -2.338 -1.605 11.106 1.00 0.00 C ATOM 342 CG LEU A 729 -3.735 -1.333 11.675 1.00 0.00 C ATOM 343 CD1 LEU A 729 -4.650 -2.491 11.395 1.00 0.00 C ATOM 344 CD2 LEU A 729 -3.670 -1.076 13.172 1.00 0.00 C ATOM 0 H LEU A 729 -2.724 0.135 9.398 1.00 0.00 H new ATOM 0 HA LEU A 729 -1.441 0.131 11.945 1.00 0.00 H new ATOM 0 HB2 LEU A 729 -2.445 -2.061 10.122 1.00 0.00 H new ATOM 0 HB3 LEU A 729 -1.838 -2.335 11.743 1.00 0.00 H new ATOM 0 HG LEU A 729 -4.130 -0.442 11.187 1.00 0.00 H new ATOM 0 HD11 LEU A 729 -5.638 -2.282 11.806 1.00 0.00 H new ATOM 0 HD12 LEU A 729 -4.729 -2.640 10.318 1.00 0.00 H new ATOM 0 HD13 LEU A 729 -4.248 -3.392 11.858 1.00 0.00 H new ATOM 0 HD21 LEU A 729 -4.674 -0.886 13.552 1.00 0.00 H new ATOM 0 HD22 LEU A 729 -3.251 -1.949 13.673 1.00 0.00 H new ATOM 0 HD23 LEU A 729 -3.038 -0.209 13.365 1.00 0.00 H new ATOM 356 N HIS A 730 0.238 -0.954 9.367 1.00 0.00 N ATOM 357 CA HIS A 730 1.575 -1.209 8.848 1.00 0.00 C ATOM 358 C HIS A 730 2.469 -0.039 9.180 1.00 0.00 C ATOM 359 O HIS A 730 3.431 -0.197 9.886 1.00 0.00 O ATOM 360 CB HIS A 730 1.497 -1.440 7.313 1.00 0.00 C ATOM 361 CG HIS A 730 2.781 -1.430 6.529 1.00 0.00 C ATOM 362 ND1 HIS A 730 3.601 -2.515 6.365 1.00 0.00 N ATOM 363 CD2 HIS A 730 3.329 -0.431 5.789 1.00 0.00 C ATOM 364 CE1 HIS A 730 4.592 -2.163 5.545 1.00 0.00 C ATOM 365 NE2 HIS A 730 4.474 -0.899 5.164 1.00 0.00 N ATOM 0 H HIS A 730 -0.484 -0.941 8.647 1.00 0.00 H new ATOM 0 HA HIS A 730 1.995 -2.104 9.307 1.00 0.00 H new ATOM 0 HB2 HIS A 730 1.011 -2.401 7.145 1.00 0.00 H new ATOM 0 HB3 HIS A 730 0.844 -0.675 6.893 1.00 0.00 H new ATOM 0 HD2 HIS A 730 2.934 0.570 5.702 1.00 0.00 H new ATOM 0 HE1 HIS A 730 5.388 -2.823 5.232 1.00 0.00 H new ATOM 0 HE2 HIS A 730 5.095 -0.380 4.542 1.00 0.00 H new ATOM 373 N LEU A 731 2.082 1.141 8.740 1.00 0.00 N ATOM 374 CA LEU A 731 2.864 2.352 8.955 1.00 0.00 C ATOM 375 C LEU A 731 3.209 2.576 10.438 1.00 0.00 C ATOM 376 O LEU A 731 4.384 2.731 10.765 1.00 0.00 O ATOM 377 CB LEU A 731 2.150 3.549 8.265 1.00 0.00 C ATOM 378 CG LEU A 731 2.660 5.013 8.450 1.00 0.00 C ATOM 379 CD1 LEU A 731 2.337 5.582 9.822 1.00 0.00 C ATOM 380 CD2 LEU A 731 4.143 5.128 8.160 1.00 0.00 C ATOM 0 H LEU A 731 1.216 1.293 8.222 1.00 0.00 H new ATOM 0 HA LEU A 731 3.841 2.245 8.483 1.00 0.00 H new ATOM 0 HB2 LEU A 731 2.151 3.345 7.194 1.00 0.00 H new ATOM 0 HB3 LEU A 731 1.110 3.531 8.592 1.00 0.00 H new ATOM 0 HG LEU A 731 2.118 5.614 7.719 1.00 0.00 H new ATOM 0 HD11 LEU A 731 2.716 6.602 9.891 1.00 0.00 H new ATOM 0 HD12 LEU A 731 1.257 5.585 9.969 1.00 0.00 H new ATOM 0 HD13 LEU A 731 2.806 4.967 10.590 1.00 0.00 H new ATOM 0 HD21 LEU A 731 4.462 6.161 8.299 1.00 0.00 H new ATOM 0 HD22 LEU A 731 4.698 4.482 8.840 1.00 0.00 H new ATOM 0 HD23 LEU A 731 4.337 4.824 7.132 1.00 0.00 H new ATOM 392 N ARG A 732 2.218 2.504 11.327 1.00 0.00 N ATOM 393 CA ARG A 732 2.468 2.723 12.762 1.00 0.00 C ATOM 394 C ARG A 732 3.379 1.641 13.365 1.00 0.00 C ATOM 395 O ARG A 732 4.168 1.913 14.276 1.00 0.00 O ATOM 396 CB ARG A 732 1.162 2.833 13.561 1.00 0.00 C ATOM 397 CG ARG A 732 0.256 1.636 13.415 1.00 0.00 C ATOM 398 CD ARG A 732 -0.991 1.755 14.245 1.00 0.00 C ATOM 399 NE ARG A 732 -0.714 1.650 15.678 1.00 0.00 N ATOM 400 CZ ARG A 732 -1.631 1.343 16.599 1.00 0.00 C ATOM 401 NH1 ARG A 732 -2.928 1.329 16.272 1.00 0.00 N ATOM 402 NH2 ARG A 732 -1.257 1.093 17.849 1.00 0.00 N ATOM 0 H ARG A 732 1.247 2.299 11.090 1.00 0.00 H new ATOM 0 HA ARG A 732 2.991 3.676 12.837 1.00 0.00 H new ATOM 0 HB2 ARG A 732 1.403 2.968 14.615 1.00 0.00 H new ATOM 0 HB3 ARG A 732 0.624 3.725 13.240 1.00 0.00 H new ATOM 0 HG2 ARG A 732 -0.019 1.518 12.367 1.00 0.00 H new ATOM 0 HG3 ARG A 732 0.798 0.736 13.706 1.00 0.00 H new ATOM 0 HD2 ARG A 732 -1.473 2.711 14.039 1.00 0.00 H new ATOM 0 HD3 ARG A 732 -1.694 0.975 13.955 1.00 0.00 H new ATOM 0 HE ARG A 732 0.241 1.822 15.994 1.00 0.00 H new ATOM 0 HH11 ARG A 732 -3.216 1.553 15.320 1.00 0.00 H new ATOM 0 HH12 ARG A 732 -3.629 1.095 16.975 1.00 0.00 H new ATOM 0 HH21 ARG A 732 -0.270 1.136 18.104 1.00 0.00 H new ATOM 0 HH22 ARG A 732 -1.956 0.858 18.553 1.00 0.00 H new ATOM 416 N LYS A 733 3.255 0.425 12.870 1.00 0.00 N ATOM 417 CA LYS A 733 4.070 -0.692 13.323 1.00 0.00 C ATOM 418 C LYS A 733 5.496 -0.549 12.804 1.00 0.00 C ATOM 419 O LYS A 733 6.475 -0.710 13.538 1.00 0.00 O ATOM 420 CB LYS A 733 3.430 -1.998 12.857 1.00 0.00 C ATOM 421 CG LYS A 733 4.112 -3.271 13.326 1.00 0.00 C ATOM 422 CD LYS A 733 3.319 -4.509 12.901 1.00 0.00 C ATOM 423 CE LYS A 733 1.915 -4.522 13.518 1.00 0.00 C ATOM 424 NZ LYS A 733 1.135 -5.713 13.136 1.00 0.00 N ATOM 0 H LYS A 733 2.585 0.180 12.140 1.00 0.00 H new ATOM 0 HA LYS A 733 4.120 -0.699 14.412 1.00 0.00 H new ATOM 0 HB2 LYS A 733 2.395 -2.016 13.198 1.00 0.00 H new ATOM 0 HB3 LYS A 733 3.407 -2.001 11.767 1.00 0.00 H new ATOM 0 HG2 LYS A 733 5.119 -3.321 12.913 1.00 0.00 H new ATOM 0 HG3 LYS A 733 4.213 -3.255 14.411 1.00 0.00 H new ATOM 0 HD2 LYS A 733 3.239 -4.535 11.814 1.00 0.00 H new ATOM 0 HD3 LYS A 733 3.857 -5.407 13.203 1.00 0.00 H new ATOM 0 HE2 LYS A 733 2.000 -4.482 14.604 1.00 0.00 H new ATOM 0 HE3 LYS A 733 1.378 -3.626 13.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 733 0.196 -5.670 13.580 1.00 0.00 H new ATOM 0 HZ2 LYS A 733 1.028 -5.741 12.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 733 1.630 -6.570 13.456 1.00 0.00 H new ATOM 438 N VAL A 734 5.597 -0.189 11.556 1.00 0.00 N ATOM 439 CA VAL A 734 6.855 -0.053 10.889 1.00 0.00 C ATOM 440 C VAL A 734 7.661 1.143 11.433 1.00 0.00 C ATOM 441 O VAL A 734 8.868 1.020 11.670 1.00 0.00 O ATOM 442 CB VAL A 734 6.657 0.016 9.351 1.00 0.00 C ATOM 443 CG1 VAL A 734 7.948 0.219 8.647 1.00 0.00 C ATOM 444 CG2 VAL A 734 6.014 -1.257 8.842 1.00 0.00 C ATOM 0 H VAL A 734 4.792 0.021 10.966 1.00 0.00 H new ATOM 0 HA VAL A 734 7.449 -0.943 11.099 1.00 0.00 H new ATOM 0 HB VAL A 734 6.006 0.866 9.146 1.00 0.00 H new ATOM 0 HG11 VAL A 734 7.773 0.263 7.572 1.00 0.00 H new ATOM 0 HG12 VAL A 734 8.401 1.153 8.979 1.00 0.00 H new ATOM 0 HG13 VAL A 734 8.619 -0.610 8.872 1.00 0.00 H new ATOM 0 HG21 VAL A 734 5.883 -1.192 7.762 1.00 0.00 H new ATOM 0 HG22 VAL A 734 6.653 -2.107 9.079 1.00 0.00 H new ATOM 0 HG23 VAL A 734 5.043 -1.390 9.318 1.00 0.00 H new ATOM 454 N GLU A 735 6.997 2.279 11.685 1.00 0.00 N ATOM 455 CA GLU A 735 7.687 3.441 12.270 1.00 0.00 C ATOM 456 C GLU A 735 8.140 3.137 13.697 1.00 0.00 C ATOM 457 O GLU A 735 9.155 3.657 14.158 1.00 0.00 O ATOM 458 CB GLU A 735 6.835 4.722 12.250 1.00 0.00 C ATOM 459 CG GLU A 735 5.506 4.599 12.967 1.00 0.00 C ATOM 460 CD GLU A 735 4.772 5.914 13.122 1.00 0.00 C ATOM 461 OE1 GLU A 735 4.667 6.674 12.139 1.00 0.00 O ATOM 462 OE2 GLU A 735 4.258 6.189 14.248 1.00 0.00 O ATOM 0 H GLU A 735 6.004 2.420 11.499 1.00 0.00 H new ATOM 0 HA GLU A 735 8.558 3.628 11.642 1.00 0.00 H new ATOM 0 HB2 GLU A 735 7.406 5.531 12.705 1.00 0.00 H new ATOM 0 HB3 GLU A 735 6.650 5.005 11.214 1.00 0.00 H new ATOM 0 HG2 GLU A 735 4.872 3.902 12.420 1.00 0.00 H new ATOM 0 HG3 GLU A 735 5.675 4.169 13.954 1.00 0.00 H new ATOM 469 N GLU A 736 7.402 2.267 14.368 1.00 0.00 N ATOM 470 CA GLU A 736 7.725 1.877 15.719 1.00 0.00 C ATOM 471 C GLU A 736 9.011 1.050 15.733 1.00 0.00 C ATOM 472 O GLU A 736 9.905 1.299 16.530 1.00 0.00 O ATOM 473 CB GLU A 736 6.577 1.071 16.332 1.00 0.00 C ATOM 474 CG GLU A 736 6.795 0.671 17.783 1.00 0.00 C ATOM 475 CD GLU A 736 6.758 1.833 18.742 1.00 0.00 C ATOM 476 OE1 GLU A 736 7.662 2.676 18.724 1.00 0.00 O ATOM 477 OE2 GLU A 736 5.814 1.898 19.563 1.00 0.00 O ATOM 0 H GLU A 736 6.569 1.817 13.989 1.00 0.00 H new ATOM 0 HA GLU A 736 7.875 2.778 16.314 1.00 0.00 H new ATOM 0 HB2 GLU A 736 5.660 1.657 16.263 1.00 0.00 H new ATOM 0 HB3 GLU A 736 6.424 0.170 15.738 1.00 0.00 H new ATOM 0 HG2 GLU A 736 6.031 -0.051 18.071 1.00 0.00 H new ATOM 0 HG3 GLU A 736 7.758 0.168 17.872 1.00 0.00 H new ATOM 484 N GLU A 737 9.114 0.087 14.831 1.00 0.00 N ATOM 485 CA GLU A 737 10.285 -0.764 14.809 1.00 0.00 C ATOM 486 C GLU A 737 11.435 -0.194 13.969 1.00 0.00 C ATOM 487 O GLU A 737 12.445 0.252 14.522 1.00 0.00 O ATOM 488 CB GLU A 737 9.943 -2.196 14.395 1.00 0.00 C ATOM 489 CG GLU A 737 9.024 -2.903 15.377 1.00 0.00 C ATOM 490 CD GLU A 737 8.845 -4.361 15.065 1.00 0.00 C ATOM 491 OE1 GLU A 737 9.729 -5.169 15.418 1.00 0.00 O ATOM 492 OE2 GLU A 737 7.812 -4.744 14.487 1.00 0.00 O ATOM 0 H GLU A 737 8.414 -0.120 14.119 1.00 0.00 H new ATOM 0 HA GLU A 737 10.647 -0.794 15.837 1.00 0.00 H new ATOM 0 HB2 GLU A 737 9.470 -2.180 13.413 1.00 0.00 H new ATOM 0 HB3 GLU A 737 10.865 -2.768 14.295 1.00 0.00 H new ATOM 0 HG2 GLU A 737 9.428 -2.799 16.384 1.00 0.00 H new ATOM 0 HG3 GLU A 737 8.050 -2.413 15.372 1.00 0.00 H new ATOM 499 N GLU A 738 11.272 -0.134 12.660 1.00 0.00 N ATOM 500 CA GLU A 738 12.377 0.281 11.803 1.00 0.00 C ATOM 501 C GLU A 738 12.365 1.765 11.459 1.00 0.00 C ATOM 502 O GLU A 738 13.197 2.234 10.685 1.00 0.00 O ATOM 503 CB GLU A 738 12.532 -0.616 10.585 1.00 0.00 C ATOM 504 CG GLU A 738 11.314 -0.743 9.706 1.00 0.00 C ATOM 505 CD GLU A 738 11.561 -1.735 8.612 1.00 0.00 C ATOM 506 OE1 GLU A 738 12.219 -1.395 7.627 1.00 0.00 O ATOM 507 OE2 GLU A 738 11.165 -2.906 8.762 1.00 0.00 O ATOM 0 H GLU A 738 10.406 -0.361 12.171 1.00 0.00 H new ATOM 0 HA GLU A 738 13.279 0.145 12.400 1.00 0.00 H new ATOM 0 HB2 GLU A 738 13.356 -0.237 9.980 1.00 0.00 H new ATOM 0 HB3 GLU A 738 12.818 -1.612 10.924 1.00 0.00 H new ATOM 0 HG2 GLU A 738 10.458 -1.056 10.303 1.00 0.00 H new ATOM 0 HG3 GLU A 738 11.065 0.227 9.276 1.00 0.00 H new ATOM 514 N ASP A 739 11.394 2.481 12.019 1.00 0.00 N ATOM 515 CA ASP A 739 11.375 3.966 12.031 1.00 0.00 C ATOM 516 C ASP A 739 11.040 4.626 10.665 1.00 0.00 C ATOM 517 O ASP A 739 10.934 5.842 10.570 1.00 0.00 O ATOM 518 CB ASP A 739 12.718 4.475 12.620 1.00 0.00 C ATOM 519 CG ASP A 739 12.836 5.966 12.831 1.00 0.00 C ATOM 520 OD1 ASP A 739 13.282 6.679 11.919 1.00 0.00 O ATOM 521 OD2 ASP A 739 12.560 6.443 13.943 1.00 0.00 O ATOM 0 H ASP A 739 10.589 2.059 12.482 1.00 0.00 H new ATOM 0 HA ASP A 739 10.546 4.276 12.667 1.00 0.00 H new ATOM 0 HB2 ASP A 739 12.880 3.980 13.578 1.00 0.00 H new ATOM 0 HB3 ASP A 739 13.524 4.159 11.957 1.00 0.00 H new ATOM 526 N GLU A 740 10.842 3.845 9.628 1.00 0.00 N ATOM 527 CA GLU A 740 10.526 4.351 8.367 1.00 0.00 C ATOM 528 C GLU A 740 9.769 3.271 7.647 1.00 0.00 C ATOM 529 O GLU A 740 10.174 2.126 7.674 1.00 0.00 O ATOM 530 CB GLU A 740 11.792 4.689 7.606 1.00 0.00 C ATOM 531 CG GLU A 740 11.511 5.435 6.346 1.00 0.00 C ATOM 532 CD GLU A 740 10.910 6.795 6.629 1.00 0.00 C ATOM 533 OE1 GLU A 740 11.665 7.748 6.843 1.00 0.00 O ATOM 534 OE2 GLU A 740 9.672 6.924 6.701 1.00 0.00 O ATOM 0 H GLU A 740 10.903 2.828 9.666 1.00 0.00 H new ATOM 0 HA GLU A 740 9.933 5.262 8.449 1.00 0.00 H new ATOM 0 HB2 GLU A 740 12.447 5.286 8.241 1.00 0.00 H new ATOM 0 HB3 GLU A 740 12.328 3.770 7.370 1.00 0.00 H new ATOM 0 HG2 GLU A 740 12.434 5.555 5.779 1.00 0.00 H new ATOM 0 HG3 GLU A 740 10.828 4.856 5.724 1.00 0.00 H new ATOM 541 N SER A 741 8.701 3.643 7.022 1.00 0.00 N ATOM 542 CA SER A 741 7.794 2.731 6.311 1.00 0.00 C ATOM 543 C SER A 741 8.336 2.201 4.972 1.00 0.00 C ATOM 544 O SER A 741 7.551 1.721 4.123 1.00 0.00 O ATOM 545 CB SER A 741 6.448 3.412 6.097 1.00 0.00 C ATOM 546 OG SER A 741 6.589 4.678 5.459 1.00 0.00 O ATOM 0 H SER A 741 8.404 4.618 6.976 1.00 0.00 H new ATOM 0 HA SER A 741 7.690 1.854 6.950 1.00 0.00 H new ATOM 0 HB2 SER A 741 5.808 2.770 5.492 1.00 0.00 H new ATOM 0 HB3 SER A 741 5.951 3.543 7.058 1.00 0.00 H new ATOM 0 HG SER A 741 5.732 5.152 5.480 1.00 0.00 H new ATOM 552 N ALA A 742 9.647 2.206 4.818 1.00 0.00 N ATOM 553 CA ALA A 742 10.284 1.801 3.591 1.00 0.00 C ATOM 554 C ALA A 742 10.331 0.281 3.458 1.00 0.00 C ATOM 555 O ALA A 742 11.286 -0.369 3.865 1.00 0.00 O ATOM 556 CB ALA A 742 11.665 2.417 3.473 1.00 0.00 C ATOM 0 H ALA A 742 10.298 2.494 5.548 1.00 0.00 H new ATOM 0 HA ALA A 742 9.682 2.173 2.762 1.00 0.00 H new ATOM 0 HB1 ALA A 742 12.127 2.098 2.539 1.00 0.00 H new ATOM 0 HB2 ALA A 742 11.581 3.504 3.483 1.00 0.00 H new ATOM 0 HB3 ALA A 742 12.281 2.093 4.312 1.00 0.00 H new ATOM 562 N LEU A 743 9.278 -0.258 2.917 1.00 0.00 N ATOM 563 CA LEU A 743 9.119 -1.681 2.711 1.00 0.00 C ATOM 564 C LEU A 743 8.587 -1.933 1.331 1.00 0.00 C ATOM 565 O LEU A 743 8.087 -1.008 0.668 1.00 0.00 O ATOM 566 CB LEU A 743 8.225 -2.329 3.781 1.00 0.00 C ATOM 567 CG LEU A 743 8.890 -2.584 5.140 1.00 0.00 C ATOM 568 CD1 LEU A 743 7.879 -3.071 6.149 1.00 0.00 C ATOM 569 CD2 LEU A 743 9.987 -3.619 4.994 1.00 0.00 C ATOM 0 H LEU A 743 8.480 0.289 2.595 1.00 0.00 H new ATOM 0 HA LEU A 743 10.099 -2.149 2.808 1.00 0.00 H new ATOM 0 HB2 LEU A 743 7.356 -1.690 3.937 1.00 0.00 H new ATOM 0 HB3 LEU A 743 7.857 -3.279 3.394 1.00 0.00 H new ATOM 0 HG LEU A 743 9.315 -1.644 5.491 1.00 0.00 H new ATOM 0 HD11 LEU A 743 8.373 -3.245 7.105 1.00 0.00 H new ATOM 0 HD12 LEU A 743 7.100 -2.319 6.275 1.00 0.00 H new ATOM 0 HD13 LEU A 743 7.432 -4.001 5.797 1.00 0.00 H new ATOM 0 HD21 LEU A 743 10.454 -3.794 5.963 1.00 0.00 H new ATOM 0 HD22 LEU A 743 9.561 -4.551 4.623 1.00 0.00 H new ATOM 0 HD23 LEU A 743 10.737 -3.258 4.290 1.00 0.00 H new ATOM 581 N LYS A 744 8.648 -3.150 0.902 1.00 0.00 N ATOM 582 CA LYS A 744 8.318 -3.463 -0.451 1.00 0.00 C ATOM 583 C LYS A 744 6.859 -3.911 -0.577 1.00 0.00 C ATOM 584 O LYS A 744 6.325 -4.608 0.286 1.00 0.00 O ATOM 585 CB LYS A 744 9.339 -4.446 -0.993 1.00 0.00 C ATOM 586 CG LYS A 744 10.770 -3.886 -0.877 1.00 0.00 C ATOM 587 CD LYS A 744 11.870 -4.850 -1.325 1.00 0.00 C ATOM 588 CE LYS A 744 12.121 -6.022 -0.350 1.00 0.00 C ATOM 589 NZ LYS A 744 10.958 -6.914 -0.157 1.00 0.00 N ATOM 0 H LYS A 744 8.925 -3.949 1.472 1.00 0.00 H new ATOM 0 HA LYS A 744 8.378 -2.574 -1.078 1.00 0.00 H new ATOM 0 HB2 LYS A 744 9.268 -5.386 -0.446 1.00 0.00 H new ATOM 0 HB3 LYS A 744 9.116 -4.667 -2.037 1.00 0.00 H new ATOM 0 HG2 LYS A 744 10.839 -2.975 -1.472 1.00 0.00 H new ATOM 0 HG3 LYS A 744 10.953 -3.604 0.160 1.00 0.00 H new ATOM 0 HD2 LYS A 744 11.607 -5.255 -2.302 1.00 0.00 H new ATOM 0 HD3 LYS A 744 12.798 -4.292 -1.451 1.00 0.00 H new ATOM 0 HE2 LYS A 744 12.960 -6.613 -0.719 1.00 0.00 H new ATOM 0 HE3 LYS A 744 12.418 -5.617 0.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 744 11.289 -7.890 -0.015 1.00 0.00 H new ATOM 0 HZ2 LYS A 744 10.419 -6.606 0.677 1.00 0.00 H new ATOM 0 HZ3 LYS A 744 10.347 -6.875 -0.998 1.00 0.00 H new ATOM 603 N ARG A 745 6.211 -3.454 -1.620 1.00 0.00 N ATOM 604 CA ARG A 745 4.768 -3.601 -1.761 1.00 0.00 C ATOM 605 C ARG A 745 4.186 -4.964 -2.151 1.00 0.00 C ATOM 606 O ARG A 745 3.090 -5.290 -1.698 1.00 0.00 O ATOM 607 CB ARG A 745 4.112 -2.408 -2.448 1.00 0.00 C ATOM 608 CG ARG A 745 3.551 -1.373 -1.452 1.00 0.00 C ATOM 609 CD ARG A 745 4.582 -0.900 -0.408 1.00 0.00 C ATOM 610 NE ARG A 745 3.958 -0.056 0.638 1.00 0.00 N ATOM 611 CZ ARG A 745 4.594 0.457 1.721 1.00 0.00 C ATOM 612 NH1 ARG A 745 5.897 0.293 1.881 1.00 0.00 N ATOM 613 NH2 ARG A 745 3.908 1.151 2.631 1.00 0.00 N ATOM 0 H ARG A 745 6.660 -2.970 -2.398 1.00 0.00 H new ATOM 0 HA ARG A 745 4.458 -3.590 -0.716 1.00 0.00 H new ATOM 0 HB2 ARG A 745 4.842 -1.922 -3.096 1.00 0.00 H new ATOM 0 HB3 ARG A 745 3.304 -2.763 -3.088 1.00 0.00 H new ATOM 0 HG2 ARG A 745 3.185 -0.509 -2.006 1.00 0.00 H new ATOM 0 HG3 ARG A 745 2.695 -1.806 -0.935 1.00 0.00 H new ATOM 0 HD2 ARG A 745 5.052 -1.766 0.057 1.00 0.00 H new ATOM 0 HD3 ARG A 745 5.372 -0.337 -0.906 1.00 0.00 H new ATOM 0 HE ARG A 745 2.966 0.157 0.535 1.00 0.00 H new ATOM 0 HH11 ARG A 745 6.435 -0.224 1.186 1.00 0.00 H new ATOM 0 HH12 ARG A 745 6.363 0.684 2.700 1.00 0.00 H new ATOM 0 HH21 ARG A 745 2.905 1.296 2.512 1.00 0.00 H new ATOM 0 HH22 ARG A 745 4.386 1.537 3.445 1.00 0.00 H new ATOM 627 N SER A 746 4.871 -5.766 -2.941 1.00 0.00 N ATOM 628 CA SER A 746 4.348 -7.103 -3.264 1.00 0.00 C ATOM 629 C SER A 746 4.384 -7.947 -1.979 1.00 0.00 C ATOM 630 O SER A 746 3.500 -8.765 -1.703 1.00 0.00 O ATOM 631 CB SER A 746 5.203 -7.749 -4.352 1.00 0.00 C ATOM 632 OG SER A 746 5.414 -6.842 -5.424 1.00 0.00 O ATOM 0 H SER A 746 5.769 -5.536 -3.368 1.00 0.00 H new ATOM 0 HA SER A 746 3.326 -7.034 -3.637 1.00 0.00 H new ATOM 0 HB2 SER A 746 6.162 -8.057 -3.934 1.00 0.00 H new ATOM 0 HB3 SER A 746 4.712 -8.650 -4.721 1.00 0.00 H new ATOM 0 HG SER A 746 5.965 -7.271 -6.112 1.00 0.00 H new ATOM 638 N GLU A 747 5.410 -7.684 -1.210 1.00 0.00 N ATOM 639 CA GLU A 747 5.648 -8.219 0.107 1.00 0.00 C ATOM 640 C GLU A 747 4.534 -7.784 1.076 1.00 0.00 C ATOM 641 O GLU A 747 4.078 -8.571 1.911 1.00 0.00 O ATOM 642 CB GLU A 747 7.012 -7.699 0.532 1.00 0.00 C ATOM 643 CG GLU A 747 7.406 -7.896 1.960 1.00 0.00 C ATOM 644 CD GLU A 747 8.824 -7.452 2.159 1.00 0.00 C ATOM 645 OE1 GLU A 747 9.177 -6.314 1.755 1.00 0.00 O ATOM 646 OE2 GLU A 747 9.630 -8.249 2.668 1.00 0.00 O ATOM 0 H GLU A 747 6.150 -7.048 -1.507 1.00 0.00 H new ATOM 0 HA GLU A 747 5.639 -9.309 0.112 1.00 0.00 H new ATOM 0 HB2 GLU A 747 7.765 -8.176 -0.095 1.00 0.00 H new ATOM 0 HB3 GLU A 747 7.048 -6.631 0.316 1.00 0.00 H new ATOM 0 HG2 GLU A 747 6.742 -7.328 2.612 1.00 0.00 H new ATOM 0 HG3 GLU A 747 7.302 -8.946 2.235 1.00 0.00 H new ATOM 653 N LEU A 748 4.099 -6.542 0.934 1.00 0.00 N ATOM 654 CA LEU A 748 2.987 -5.997 1.707 1.00 0.00 C ATOM 655 C LEU A 748 1.721 -6.819 1.439 1.00 0.00 C ATOM 656 O LEU A 748 1.030 -7.245 2.369 1.00 0.00 O ATOM 657 CB LEU A 748 2.753 -4.531 1.313 1.00 0.00 C ATOM 658 CG LEU A 748 1.608 -3.795 2.011 1.00 0.00 C ATOM 659 CD1 LEU A 748 1.894 -3.614 3.485 1.00 0.00 C ATOM 660 CD2 LEU A 748 1.347 -2.459 1.342 1.00 0.00 C ATOM 0 H LEU A 748 4.508 -5.878 0.277 1.00 0.00 H new ATOM 0 HA LEU A 748 3.226 -6.047 2.769 1.00 0.00 H new ATOM 0 HB2 LEU A 748 3.674 -3.979 1.501 1.00 0.00 H new ATOM 0 HB3 LEU A 748 2.573 -4.494 0.239 1.00 0.00 H new ATOM 0 HG LEU A 748 0.709 -4.405 1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 748 1.063 -3.088 3.955 1.00 0.00 H new ATOM 0 HD12 LEU A 748 2.017 -4.590 3.954 1.00 0.00 H new ATOM 0 HD13 LEU A 748 2.808 -3.033 3.610 1.00 0.00 H new ATOM 0 HD21 LEU A 748 0.529 -1.950 1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 748 2.246 -1.844 1.394 1.00 0.00 H new ATOM 0 HD23 LEU A 748 1.078 -2.621 0.298 1.00 0.00 H new ATOM 672 N VAL A 749 1.451 -7.058 0.158 1.00 0.00 N ATOM 673 CA VAL A 749 0.301 -7.857 -0.266 1.00 0.00 C ATOM 674 C VAL A 749 0.443 -9.273 0.270 1.00 0.00 C ATOM 675 O VAL A 749 -0.517 -9.865 0.756 1.00 0.00 O ATOM 676 CB VAL A 749 0.198 -7.930 -1.816 1.00 0.00 C ATOM 677 CG1 VAL A 749 -1.032 -8.701 -2.251 1.00 0.00 C ATOM 678 CG2 VAL A 749 0.182 -6.554 -2.424 1.00 0.00 C ATOM 0 H VAL A 749 2.019 -6.706 -0.613 1.00 0.00 H new ATOM 0 HA VAL A 749 -0.597 -7.380 0.126 1.00 0.00 H new ATOM 0 HB VAL A 749 1.082 -8.459 -2.173 1.00 0.00 H new ATOM 0 HG11 VAL A 749 -1.075 -8.734 -3.340 1.00 0.00 H new ATOM 0 HG12 VAL A 749 -0.982 -9.717 -1.859 1.00 0.00 H new ATOM 0 HG13 VAL A 749 -1.925 -8.208 -1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 749 0.109 -6.636 -3.508 1.00 0.00 H new ATOM 0 HG22 VAL A 749 -0.675 -5.998 -2.044 1.00 0.00 H new ATOM 0 HG23 VAL A 749 1.100 -6.029 -2.161 1.00 0.00 H new ATOM 688 N ASN A 750 1.666 -9.766 0.212 1.00 0.00 N ATOM 689 CA ASN A 750 2.032 -11.119 0.629 1.00 0.00 C ATOM 690 C ASN A 750 1.582 -11.381 2.056 1.00 0.00 C ATOM 691 O ASN A 750 0.705 -12.242 2.302 1.00 0.00 O ATOM 692 CB ASN A 750 3.566 -11.300 0.495 1.00 0.00 C ATOM 693 CG ASN A 750 4.066 -12.697 0.860 1.00 0.00 C ATOM 694 OD1 ASN A 750 3.358 -13.690 0.716 1.00 0.00 O ATOM 695 ND2 ASN A 750 5.302 -12.782 1.315 1.00 0.00 N ATOM 0 H ASN A 750 2.459 -9.226 -0.135 1.00 0.00 H new ATOM 0 HA ASN A 750 1.530 -11.841 -0.015 1.00 0.00 H new ATOM 0 HB2 ASN A 750 3.858 -11.078 -0.531 1.00 0.00 H new ATOM 0 HB3 ASN A 750 4.064 -10.570 1.133 1.00 0.00 H new ATOM 0 HD21 ASN A 750 5.694 -13.691 1.558 1.00 0.00 H new ATOM 0 HD22 ASN A 750 5.865 -11.938 1.423 1.00 0.00 H new ATOM 702 N TRP A 751 2.088 -10.593 2.995 1.00 0.00 N ATOM 703 CA TRP A 751 1.731 -10.835 4.367 1.00 0.00 C ATOM 704 C TRP A 751 0.259 -10.565 4.593 1.00 0.00 C ATOM 705 O TRP A 751 -0.361 -11.253 5.362 1.00 0.00 O ATOM 706 CB TRP A 751 2.626 -10.099 5.405 1.00 0.00 C ATOM 707 CG TRP A 751 2.489 -8.599 5.491 1.00 0.00 C ATOM 708 CD1 TRP A 751 3.310 -7.669 4.932 1.00 0.00 C ATOM 709 CD2 TRP A 751 1.485 -7.860 6.214 1.00 0.00 C ATOM 710 NE1 TRP A 751 2.880 -6.408 5.257 1.00 0.00 N ATOM 711 CE2 TRP A 751 1.760 -6.499 6.038 1.00 0.00 C ATOM 712 CE3 TRP A 751 0.377 -8.228 6.991 1.00 0.00 C ATOM 713 CZ2 TRP A 751 0.972 -5.498 6.608 1.00 0.00 C ATOM 714 CZ3 TRP A 751 -0.403 -7.240 7.550 1.00 0.00 C ATOM 715 CH2 TRP A 751 -0.104 -5.891 7.358 1.00 0.00 C ATOM 0 H TRP A 751 2.723 -9.811 2.833 1.00 0.00 H new ATOM 0 HA TRP A 751 1.923 -11.893 4.544 1.00 0.00 H new ATOM 0 HB2 TRP A 751 2.413 -10.515 6.390 1.00 0.00 H new ATOM 0 HB3 TRP A 751 3.667 -10.331 5.179 1.00 0.00 H new ATOM 0 HD1 TRP A 751 4.173 -7.891 4.322 1.00 0.00 H new ATOM 0 HE1 TRP A 751 3.325 -5.539 4.963 1.00 0.00 H new ATOM 0 HE3 TRP A 751 0.139 -9.270 7.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 751 1.202 -4.453 6.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 751 -1.260 -7.514 8.147 1.00 0.00 H new ATOM 0 HH2 TRP A 751 -0.735 -5.140 7.811 1.00 0.00 H new ATOM 726 N TYR A 752 -0.306 -9.616 3.826 1.00 0.00 N ATOM 727 CA TYR A 752 -1.709 -9.226 3.970 1.00 0.00 C ATOM 728 C TYR A 752 -2.606 -10.401 3.731 1.00 0.00 C ATOM 729 O TYR A 752 -3.445 -10.716 4.554 1.00 0.00 O ATOM 730 CB TYR A 752 -2.086 -8.107 2.993 1.00 0.00 C ATOM 731 CG TYR A 752 -3.499 -7.557 3.197 1.00 0.00 C ATOM 732 CD1 TYR A 752 -3.912 -7.131 4.458 1.00 0.00 C ATOM 733 CD2 TYR A 752 -4.399 -7.425 2.136 1.00 0.00 C ATOM 734 CE1 TYR A 752 -5.156 -6.597 4.662 1.00 0.00 C ATOM 735 CE2 TYR A 752 -5.656 -6.894 2.341 1.00 0.00 C ATOM 736 CZ TYR A 752 -6.025 -6.478 3.613 1.00 0.00 C ATOM 737 OH TYR A 752 -7.260 -5.932 3.832 1.00 0.00 O ATOM 0 H TYR A 752 0.195 -9.106 3.098 1.00 0.00 H new ATOM 0 HA TYR A 752 -1.838 -8.861 4.989 1.00 0.00 H new ATOM 0 HB2 TYR A 752 -1.371 -7.291 3.096 1.00 0.00 H new ATOM 0 HB3 TYR A 752 -1.996 -8.482 1.974 1.00 0.00 H new ATOM 0 HD1 TYR A 752 -3.235 -7.224 5.294 1.00 0.00 H new ATOM 0 HD2 TYR A 752 -4.108 -7.742 1.145 1.00 0.00 H new ATOM 0 HE1 TYR A 752 -5.450 -6.271 5.649 1.00 0.00 H new ATOM 0 HE2 TYR A 752 -6.348 -6.803 1.517 1.00 0.00 H new ATOM 0 HH TYR A 752 -7.188 -5.215 4.496 1.00 0.00 H new ATOM 747 N LEU A 753 -2.387 -11.066 2.627 1.00 0.00 N ATOM 748 CA LEU A 753 -3.185 -12.207 2.227 1.00 0.00 C ATOM 749 C LEU A 753 -3.061 -13.316 3.242 1.00 0.00 C ATOM 750 O LEU A 753 -4.037 -13.950 3.601 1.00 0.00 O ATOM 751 CB LEU A 753 -2.695 -12.724 0.897 1.00 0.00 C ATOM 752 CG LEU A 753 -2.646 -11.722 -0.239 1.00 0.00 C ATOM 753 CD1 LEU A 753 -1.968 -12.355 -1.413 1.00 0.00 C ATOM 754 CD2 LEU A 753 -4.040 -11.212 -0.607 1.00 0.00 C ATOM 0 H LEU A 753 -1.643 -10.832 1.970 1.00 0.00 H new ATOM 0 HA LEU A 753 -4.226 -11.892 2.154 1.00 0.00 H new ATOM 0 HB2 LEU A 753 -1.694 -13.131 1.037 1.00 0.00 H new ATOM 0 HB3 LEU A 753 -3.337 -13.552 0.595 1.00 0.00 H new ATOM 0 HG LEU A 753 -2.076 -10.850 0.081 1.00 0.00 H new ATOM 0 HD11 LEU A 753 -1.927 -11.643 -2.237 1.00 0.00 H new ATOM 0 HD12 LEU A 753 -0.955 -12.647 -1.135 1.00 0.00 H new ATOM 0 HD13 LEU A 753 -2.527 -13.238 -1.724 1.00 0.00 H new ATOM 0 HD21 LEU A 753 -3.961 -10.496 -1.425 1.00 0.00 H new ATOM 0 HD22 LEU A 753 -4.664 -12.050 -0.917 1.00 0.00 H new ATOM 0 HD23 LEU A 753 -4.490 -10.726 0.259 1.00 0.00 H new ATOM 766 N LYS A 754 -1.861 -13.480 3.756 1.00 0.00 N ATOM 767 CA LYS A 754 -1.560 -14.593 4.673 1.00 0.00 C ATOM 768 C LYS A 754 -2.151 -14.323 6.034 1.00 0.00 C ATOM 769 O LYS A 754 -2.521 -15.227 6.792 1.00 0.00 O ATOM 770 CB LYS A 754 -0.043 -14.839 4.749 1.00 0.00 C ATOM 771 CG LYS A 754 0.525 -15.725 3.622 1.00 0.00 C ATOM 772 CD LYS A 754 0.184 -15.199 2.235 1.00 0.00 C ATOM 773 CE LYS A 754 0.754 -16.058 1.133 1.00 0.00 C ATOM 774 NZ LYS A 754 0.260 -17.446 1.193 1.00 0.00 N ATOM 0 H LYS A 754 -1.070 -12.866 3.564 1.00 0.00 H new ATOM 0 HA LYS A 754 -2.018 -15.503 4.286 1.00 0.00 H new ATOM 0 HB2 LYS A 754 0.469 -13.877 4.728 1.00 0.00 H new ATOM 0 HB3 LYS A 754 0.188 -15.302 5.708 1.00 0.00 H new ATOM 0 HG2 LYS A 754 1.608 -15.789 3.726 1.00 0.00 H new ATOM 0 HG3 LYS A 754 0.134 -16.737 3.729 1.00 0.00 H new ATOM 0 HD2 LYS A 754 -0.899 -15.147 2.126 1.00 0.00 H new ATOM 0 HD3 LYS A 754 0.564 -14.183 2.132 1.00 0.00 H new ATOM 0 HE2 LYS A 754 0.496 -15.624 0.167 1.00 0.00 H new ATOM 0 HE3 LYS A 754 1.842 -16.059 1.202 1.00 0.00 H new ATOM 0 HZ1 LYS A 754 0.525 -17.947 0.321 1.00 0.00 H new ATOM 0 HZ2 LYS A 754 0.681 -17.929 2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 754 -0.776 -17.442 1.289 1.00 0.00 H new ATOM 788 N GLU A 755 -2.243 -13.083 6.305 1.00 0.00 N ATOM 789 CA GLU A 755 -2.785 -12.543 7.492 1.00 0.00 C ATOM 790 C GLU A 755 -4.316 -12.643 7.482 1.00 0.00 C ATOM 791 O GLU A 755 -4.910 -13.214 8.384 1.00 0.00 O ATOM 792 CB GLU A 755 -2.333 -11.095 7.540 1.00 0.00 C ATOM 793 CG GLU A 755 -3.011 -10.235 8.519 1.00 0.00 C ATOM 794 CD GLU A 755 -2.635 -10.518 9.963 1.00 0.00 C ATOM 795 OE1 GLU A 755 -2.905 -11.632 10.467 1.00 0.00 O ATOM 796 OE2 GLU A 755 -2.042 -9.635 10.604 1.00 0.00 O ATOM 0 H GLU A 755 -1.919 -12.363 5.659 1.00 0.00 H new ATOM 0 HA GLU A 755 -2.444 -13.089 8.371 1.00 0.00 H new ATOM 0 HB2 GLU A 755 -1.264 -11.077 7.751 1.00 0.00 H new ATOM 0 HB3 GLU A 755 -2.470 -10.661 6.550 1.00 0.00 H new ATOM 0 HG2 GLU A 755 -2.780 -9.194 8.293 1.00 0.00 H new ATOM 0 HG3 GLU A 755 -4.089 -10.354 8.406 1.00 0.00 H new ATOM 803 N ILE A 756 -4.929 -12.141 6.419 1.00 0.00 N ATOM 804 CA ILE A 756 -6.387 -12.066 6.325 1.00 0.00 C ATOM 805 C ILE A 756 -7.035 -13.404 6.083 1.00 0.00 C ATOM 806 O ILE A 756 -8.245 -13.504 6.125 1.00 0.00 O ATOM 807 CB ILE A 756 -6.871 -11.067 5.259 1.00 0.00 C ATOM 808 CG1 ILE A 756 -6.320 -11.452 3.880 1.00 0.00 C ATOM 809 CG2 ILE A 756 -6.488 -9.650 5.655 1.00 0.00 C ATOM 810 CD1 ILE A 756 -6.707 -10.523 2.766 1.00 0.00 C ATOM 0 H ILE A 756 -4.438 -11.776 5.602 1.00 0.00 H new ATOM 0 HA ILE A 756 -6.700 -11.705 7.305 1.00 0.00 H new ATOM 0 HB ILE A 756 -7.958 -11.105 5.195 1.00 0.00 H new ATOM 0 HG12 ILE A 756 -5.232 -11.494 3.938 1.00 0.00 H new ATOM 0 HG13 ILE A 756 -6.665 -12.456 3.634 1.00 0.00 H new ATOM 0 HG21 ILE A 756 -6.836 -8.953 4.893 1.00 0.00 H new ATOM 0 HG22 ILE A 756 -6.949 -9.402 6.611 1.00 0.00 H new ATOM 0 HG23 ILE A 756 -5.404 -9.578 5.745 1.00 0.00 H new ATOM 0 HD11 ILE A 756 -6.272 -10.875 1.831 1.00 0.00 H new ATOM 0 HD12 ILE A 756 -7.793 -10.497 2.674 1.00 0.00 H new ATOM 0 HD13 ILE A 756 -6.337 -9.521 2.983 1.00 0.00 H new ATOM 822 N GLU A 757 -6.233 -14.431 5.826 1.00 0.00 N ATOM 823 CA GLU A 757 -6.717 -15.820 5.672 1.00 0.00 C ATOM 824 C GLU A 757 -7.688 -16.232 6.809 1.00 0.00 C ATOM 825 O GLU A 757 -8.563 -17.081 6.612 1.00 0.00 O ATOM 826 CB GLU A 757 -5.525 -16.770 5.613 1.00 0.00 C ATOM 827 CG GLU A 757 -4.846 -16.879 4.257 1.00 0.00 C ATOM 828 CD GLU A 757 -5.566 -17.783 3.260 1.00 0.00 C ATOM 829 OE1 GLU A 757 -6.734 -18.196 3.503 1.00 0.00 O ATOM 830 OE2 GLU A 757 -4.929 -18.161 2.235 1.00 0.00 O ATOM 0 H GLU A 757 -5.223 -14.335 5.716 1.00 0.00 H new ATOM 0 HA GLU A 757 -7.280 -15.879 4.741 1.00 0.00 H new ATOM 0 HB2 GLU A 757 -4.786 -16.445 6.346 1.00 0.00 H new ATOM 0 HB3 GLU A 757 -5.858 -17.763 5.915 1.00 0.00 H new ATOM 0 HG2 GLU A 757 -4.759 -15.881 3.827 1.00 0.00 H new ATOM 0 HG3 GLU A 757 -3.832 -17.253 4.401 1.00 0.00 H new ATOM 837 N SER A 758 -7.550 -15.588 7.962 1.00 0.00 N ATOM 838 CA SER A 758 -8.401 -15.801 9.104 1.00 0.00 C ATOM 839 C SER A 758 -9.850 -15.294 8.859 1.00 0.00 C ATOM 840 O SER A 758 -10.829 -15.955 9.248 1.00 0.00 O ATOM 841 CB SER A 758 -7.763 -15.089 10.293 1.00 0.00 C ATOM 842 OG SER A 758 -7.350 -13.774 9.915 1.00 0.00 O ATOM 0 H SER A 758 -6.824 -14.890 8.122 1.00 0.00 H new ATOM 0 HA SER A 758 -8.489 -16.870 9.299 1.00 0.00 H new ATOM 0 HB2 SER A 758 -8.474 -15.032 11.117 1.00 0.00 H new ATOM 0 HB3 SER A 758 -6.906 -15.659 10.651 1.00 0.00 H new ATOM 0 HG SER A 758 -6.943 -13.325 10.685 1.00 0.00 H new ATOM 848 N GLU A 759 -9.980 -14.159 8.178 1.00 0.00 N ATOM 849 CA GLU A 759 -11.285 -13.539 7.929 1.00 0.00 C ATOM 850 C GLU A 759 -11.840 -13.956 6.586 1.00 0.00 C ATOM 851 O GLU A 759 -13.040 -13.784 6.313 1.00 0.00 O ATOM 852 CB GLU A 759 -11.207 -12.004 8.006 1.00 0.00 C ATOM 853 CG GLU A 759 -10.185 -11.369 7.071 1.00 0.00 C ATOM 854 CD GLU A 759 -10.201 -9.867 7.110 1.00 0.00 C ATOM 855 OE1 GLU A 759 -9.891 -9.283 8.178 1.00 0.00 O ATOM 856 OE2 GLU A 759 -10.531 -9.235 6.086 1.00 0.00 O ATOM 0 H GLU A 759 -9.193 -13.644 7.784 1.00 0.00 H new ATOM 0 HA GLU A 759 -11.957 -13.889 8.712 1.00 0.00 H new ATOM 0 HB2 GLU A 759 -12.191 -11.592 7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 759 -10.969 -11.717 9.030 1.00 0.00 H new ATOM 0 HG2 GLU A 759 -9.189 -11.722 7.338 1.00 0.00 H new ATOM 0 HG3 GLU A 759 -10.379 -11.702 6.051 1.00 0.00 H new ATOM 863 N ILE A 760 -10.969 -14.479 5.748 1.00 0.00 N ATOM 864 CA ILE A 760 -11.343 -14.948 4.434 1.00 0.00 C ATOM 865 C ILE A 760 -12.320 -16.106 4.550 1.00 0.00 C ATOM 866 O ILE A 760 -11.988 -17.189 5.038 1.00 0.00 O ATOM 867 CB ILE A 760 -10.098 -15.350 3.589 1.00 0.00 C ATOM 868 CG1 ILE A 760 -9.165 -14.156 3.357 1.00 0.00 C ATOM 869 CG2 ILE A 760 -10.468 -16.000 2.279 1.00 0.00 C ATOM 870 CD1 ILE A 760 -9.830 -12.935 2.753 1.00 0.00 C ATOM 0 H ILE A 760 -9.978 -14.590 5.962 1.00 0.00 H new ATOM 0 HA ILE A 760 -11.833 -14.127 3.911 1.00 0.00 H new ATOM 0 HB ILE A 760 -9.562 -16.096 4.176 1.00 0.00 H new ATOM 0 HG12 ILE A 760 -8.716 -13.874 4.309 1.00 0.00 H new ATOM 0 HG13 ILE A 760 -8.352 -14.470 2.702 1.00 0.00 H new ATOM 0 HG21 ILE A 760 -9.561 -16.259 1.732 1.00 0.00 H new ATOM 0 HG22 ILE A 760 -11.046 -16.904 2.472 1.00 0.00 H new ATOM 0 HG23 ILE A 760 -11.065 -15.308 1.685 1.00 0.00 H new ATOM 0 HD11 ILE A 760 -9.091 -12.144 2.626 1.00 0.00 H new ATOM 0 HD12 ILE A 760 -10.254 -13.194 1.783 1.00 0.00 H new ATOM 0 HD13 ILE A 760 -10.624 -12.588 3.415 1.00 0.00 H new ATOM 882 N ASP A 761 -13.533 -15.822 4.171 1.00 0.00 N ATOM 883 CA ASP A 761 -14.627 -16.772 4.188 1.00 0.00 C ATOM 884 C ASP A 761 -14.528 -17.748 3.032 1.00 0.00 C ATOM 885 O ASP A 761 -14.864 -18.924 3.158 1.00 0.00 O ATOM 886 CB ASP A 761 -15.943 -15.999 4.093 1.00 0.00 C ATOM 887 CG ASP A 761 -17.142 -16.870 3.843 1.00 0.00 C ATOM 888 OD1 ASP A 761 -17.479 -17.095 2.673 1.00 0.00 O ATOM 889 OD2 ASP A 761 -17.783 -17.326 4.807 1.00 0.00 O ATOM 0 H ASP A 761 -13.804 -14.899 3.831 1.00 0.00 H new ATOM 0 HA ASP A 761 -14.582 -17.345 5.114 1.00 0.00 H new ATOM 0 HB2 ASP A 761 -16.095 -15.444 5.019 1.00 0.00 H new ATOM 0 HB3 ASP A 761 -15.865 -15.265 3.291 1.00 0.00 H new ATOM 894 N SER A 762 -14.072 -17.248 1.917 1.00 0.00 N ATOM 895 CA SER A 762 -13.994 -17.984 0.698 1.00 0.00 C ATOM 896 C SER A 762 -12.881 -17.391 -0.128 1.00 0.00 C ATOM 897 O SER A 762 -12.517 -16.240 0.097 1.00 0.00 O ATOM 898 CB SER A 762 -15.309 -17.829 -0.057 1.00 0.00 C ATOM 899 OG SER A 762 -16.410 -18.377 0.656 1.00 0.00 O ATOM 0 H SER A 762 -13.736 -16.288 1.835 1.00 0.00 H new ATOM 0 HA SER A 762 -13.807 -19.040 0.895 1.00 0.00 H new ATOM 0 HB2 SER A 762 -15.493 -16.772 -0.248 1.00 0.00 H new ATOM 0 HB3 SER A 762 -15.228 -18.319 -1.027 1.00 0.00 H new ATOM 0 HG SER A 762 -16.684 -17.756 1.363 1.00 0.00 H new ATOM 905 N GLU A 763 -12.372 -18.141 -1.094 1.00 0.00 N ATOM 906 CA GLU A 763 -11.298 -17.677 -1.978 1.00 0.00 C ATOM 907 C GLU A 763 -11.704 -16.379 -2.675 1.00 0.00 C ATOM 908 O GLU A 763 -10.872 -15.520 -2.918 1.00 0.00 O ATOM 909 CB GLU A 763 -10.956 -18.750 -3.008 1.00 0.00 C ATOM 910 CG GLU A 763 -9.853 -18.370 -3.984 1.00 0.00 C ATOM 911 CD GLU A 763 -9.625 -19.428 -5.020 1.00 0.00 C ATOM 912 OE1 GLU A 763 -10.427 -19.526 -5.968 1.00 0.00 O ATOM 913 OE2 GLU A 763 -8.663 -20.207 -4.889 1.00 0.00 O ATOM 0 H GLU A 763 -12.688 -19.090 -1.292 1.00 0.00 H new ATOM 0 HA GLU A 763 -10.412 -17.482 -1.374 1.00 0.00 H new ATOM 0 HB2 GLU A 763 -10.659 -19.657 -2.482 1.00 0.00 H new ATOM 0 HB3 GLU A 763 -11.856 -18.990 -3.574 1.00 0.00 H new ATOM 0 HG2 GLU A 763 -10.112 -17.432 -4.476 1.00 0.00 H new ATOM 0 HG3 GLU A 763 -8.928 -18.197 -3.434 1.00 0.00 H new ATOM 920 N GLU A 764 -13.004 -16.240 -2.948 1.00 0.00 N ATOM 921 CA GLU A 764 -13.570 -15.021 -3.545 1.00 0.00 C ATOM 922 C GLU A 764 -13.175 -13.785 -2.729 1.00 0.00 C ATOM 923 O GLU A 764 -12.771 -12.773 -3.284 1.00 0.00 O ATOM 924 CB GLU A 764 -15.083 -15.123 -3.606 1.00 0.00 C ATOM 925 CG GLU A 764 -15.602 -16.256 -4.464 1.00 0.00 C ATOM 926 CD GLU A 764 -17.101 -16.312 -4.466 1.00 0.00 C ATOM 927 OE1 GLU A 764 -17.684 -16.989 -3.593 1.00 0.00 O ATOM 928 OE2 GLU A 764 -17.729 -15.677 -5.330 1.00 0.00 O ATOM 0 H GLU A 764 -13.695 -16.967 -2.763 1.00 0.00 H new ATOM 0 HA GLU A 764 -13.172 -14.920 -4.555 1.00 0.00 H new ATOM 0 HB2 GLU A 764 -15.467 -15.246 -2.593 1.00 0.00 H new ATOM 0 HB3 GLU A 764 -15.483 -14.183 -3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 764 -15.242 -16.133 -5.485 1.00 0.00 H new ATOM 0 HG3 GLU A 764 -15.203 -17.202 -4.097 1.00 0.00 H new ATOM 935 N GLU A 765 -13.247 -13.915 -1.410 1.00 0.00 N ATOM 936 CA GLU A 765 -12.859 -12.860 -0.484 1.00 0.00 C ATOM 937 C GLU A 765 -11.383 -12.529 -0.640 1.00 0.00 C ATOM 938 O GLU A 765 -11.005 -11.367 -0.709 1.00 0.00 O ATOM 939 CB GLU A 765 -13.118 -13.298 0.956 1.00 0.00 C ATOM 940 CG GLU A 765 -14.573 -13.423 1.332 1.00 0.00 C ATOM 941 CD GLU A 765 -15.262 -12.092 1.314 1.00 0.00 C ATOM 942 OE1 GLU A 765 -15.038 -11.292 2.253 1.00 0.00 O ATOM 943 OE2 GLU A 765 -16.018 -11.808 0.374 1.00 0.00 O ATOM 0 H GLU A 765 -13.579 -14.763 -0.950 1.00 0.00 H new ATOM 0 HA GLU A 765 -13.455 -11.976 -0.712 1.00 0.00 H new ATOM 0 HB2 GLU A 765 -12.632 -14.260 1.120 1.00 0.00 H new ATOM 0 HB3 GLU A 765 -12.645 -12.582 1.628 1.00 0.00 H new ATOM 0 HG2 GLU A 765 -15.072 -14.101 0.640 1.00 0.00 H new ATOM 0 HG3 GLU A 765 -14.656 -13.864 2.326 1.00 0.00 H new ATOM 950 N LEU A 766 -10.564 -13.569 -0.729 1.00 0.00 N ATOM 951 CA LEU A 766 -9.116 -13.417 -0.843 1.00 0.00 C ATOM 952 C LEU A 766 -8.778 -12.721 -2.158 1.00 0.00 C ATOM 953 O LEU A 766 -7.964 -11.804 -2.190 1.00 0.00 O ATOM 954 CB LEU A 766 -8.427 -14.791 -0.765 1.00 0.00 C ATOM 955 CG LEU A 766 -6.892 -14.794 -0.686 1.00 0.00 C ATOM 956 CD1 LEU A 766 -6.407 -14.181 0.626 1.00 0.00 C ATOM 957 CD2 LEU A 766 -6.358 -16.205 -0.836 1.00 0.00 C ATOM 0 H LEU A 766 -10.881 -14.538 -0.724 1.00 0.00 H new ATOM 0 HA LEU A 766 -8.752 -12.807 -0.016 1.00 0.00 H new ATOM 0 HB2 LEU A 766 -8.813 -15.315 0.109 1.00 0.00 H new ATOM 0 HB3 LEU A 766 -8.723 -15.369 -1.640 1.00 0.00 H new ATOM 0 HG LEU A 766 -6.512 -14.184 -1.506 1.00 0.00 H new ATOM 0 HD11 LEU A 766 -5.317 -14.197 0.654 1.00 0.00 H new ATOM 0 HD12 LEU A 766 -6.757 -13.151 0.698 1.00 0.00 H new ATOM 0 HD13 LEU A 766 -6.800 -14.757 1.464 1.00 0.00 H new ATOM 0 HD21 LEU A 766 -5.270 -16.190 -0.778 1.00 0.00 H new ATOM 0 HD22 LEU A 766 -6.756 -16.831 -0.037 1.00 0.00 H new ATOM 0 HD23 LEU A 766 -6.664 -16.609 -1.801 1.00 0.00 H new ATOM 969 N ILE A 767 -9.454 -13.146 -3.217 1.00 0.00 N ATOM 970 CA ILE A 767 -9.306 -12.570 -4.547 1.00 0.00 C ATOM 971 C ILE A 767 -9.729 -11.105 -4.538 1.00 0.00 C ATOM 972 O ILE A 767 -9.040 -10.245 -5.089 1.00 0.00 O ATOM 973 CB ILE A 767 -10.147 -13.363 -5.592 1.00 0.00 C ATOM 974 CG1 ILE A 767 -9.607 -14.795 -5.735 1.00 0.00 C ATOM 975 CG2 ILE A 767 -10.177 -12.650 -6.945 1.00 0.00 C ATOM 976 CD1 ILE A 767 -10.415 -15.674 -6.668 1.00 0.00 C ATOM 0 H ILE A 767 -10.129 -13.910 -3.176 1.00 0.00 H new ATOM 0 HA ILE A 767 -8.256 -12.635 -4.831 1.00 0.00 H new ATOM 0 HB ILE A 767 -11.174 -13.414 -5.230 1.00 0.00 H new ATOM 0 HG12 ILE A 767 -8.580 -14.749 -6.096 1.00 0.00 H new ATOM 0 HG13 ILE A 767 -9.578 -15.260 -4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 767 -10.772 -13.231 -7.649 1.00 0.00 H new ATOM 0 HG22 ILE A 767 -10.620 -11.661 -6.825 1.00 0.00 H new ATOM 0 HG23 ILE A 767 -9.161 -12.549 -7.326 1.00 0.00 H new ATOM 0 HD11 ILE A 767 -9.967 -16.667 -6.712 1.00 0.00 H new ATOM 0 HD12 ILE A 767 -11.437 -15.754 -6.298 1.00 0.00 H new ATOM 0 HD13 ILE A 767 -10.423 -15.235 -7.666 1.00 0.00 H new ATOM 988 N ASN A 768 -10.845 -10.828 -3.891 1.00 0.00 N ATOM 989 CA ASN A 768 -11.343 -9.477 -3.756 1.00 0.00 C ATOM 990 C ASN A 768 -10.338 -8.599 -3.028 1.00 0.00 C ATOM 991 O ASN A 768 -9.976 -7.524 -3.505 1.00 0.00 O ATOM 992 CB ASN A 768 -12.684 -9.470 -3.015 1.00 0.00 C ATOM 993 CG ASN A 768 -13.078 -8.076 -2.595 1.00 0.00 C ATOM 994 OD1 ASN A 768 -13.704 -7.351 -3.342 1.00 0.00 O ATOM 995 ND2 ASN A 768 -12.744 -7.721 -1.378 1.00 0.00 N ATOM 0 H ASN A 768 -11.430 -11.535 -3.445 1.00 0.00 H new ATOM 0 HA ASN A 768 -11.493 -9.072 -4.757 1.00 0.00 H new ATOM 0 HB2 ASN A 768 -13.458 -9.890 -3.658 1.00 0.00 H new ATOM 0 HB3 ASN A 768 -12.618 -10.111 -2.136 1.00 0.00 H new ATOM 0 HD21 ASN A 768 -13.011 -6.803 -1.023 1.00 0.00 H new ATOM 0 HD22 ASN A 768 -12.218 -8.363 -0.786 1.00 0.00 H new ATOM 1002 N LYS A 769 -9.879 -9.073 -1.884 1.00 0.00 N ATOM 1003 CA LYS A 769 -8.914 -8.350 -1.078 1.00 0.00 C ATOM 1004 C LYS A 769 -7.619 -8.108 -1.885 1.00 0.00 C ATOM 1005 O LYS A 769 -7.067 -7.012 -1.853 1.00 0.00 O ATOM 1006 CB LYS A 769 -8.639 -9.112 0.234 1.00 0.00 C ATOM 1007 CG LYS A 769 -9.844 -9.169 1.198 1.00 0.00 C ATOM 1008 CD LYS A 769 -10.073 -7.833 1.894 1.00 0.00 C ATOM 1009 CE LYS A 769 -11.407 -7.776 2.656 1.00 0.00 C ATOM 1010 NZ LYS A 769 -11.585 -8.834 3.699 1.00 0.00 N ATOM 0 H LYS A 769 -10.165 -9.969 -1.488 1.00 0.00 H new ATOM 0 HA LYS A 769 -9.324 -7.375 -0.813 1.00 0.00 H new ATOM 0 HB2 LYS A 769 -8.333 -10.130 -0.008 1.00 0.00 H new ATOM 0 HB3 LYS A 769 -7.800 -8.640 0.746 1.00 0.00 H new ATOM 0 HG2 LYS A 769 -10.740 -9.449 0.644 1.00 0.00 H new ATOM 0 HG3 LYS A 769 -9.676 -9.944 1.945 1.00 0.00 H new ATOM 0 HD2 LYS A 769 -9.255 -7.647 2.590 1.00 0.00 H new ATOM 0 HD3 LYS A 769 -10.049 -7.034 1.153 1.00 0.00 H new ATOM 0 HE2 LYS A 769 -11.495 -6.799 3.132 1.00 0.00 H new ATOM 0 HE3 LYS A 769 -12.223 -7.855 1.937 1.00 0.00 H new ATOM 0 HZ1 LYS A 769 -12.531 -8.748 4.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 769 -11.486 -9.772 3.262 1.00 0.00 H new ATOM 0 HZ3 LYS A 769 -10.862 -8.718 4.438 1.00 0.00 H new ATOM 1024 N LYS A 770 -7.189 -9.133 -2.641 1.00 0.00 N ATOM 1025 CA LYS A 770 -6.052 -9.097 -3.525 1.00 0.00 C ATOM 1026 C LYS A 770 -6.230 -8.016 -4.609 1.00 0.00 C ATOM 1027 O LYS A 770 -5.285 -7.307 -4.961 1.00 0.00 O ATOM 1028 CB LYS A 770 -5.970 -10.475 -4.164 1.00 0.00 C ATOM 1029 CG LYS A 770 -4.870 -10.706 -5.143 1.00 0.00 C ATOM 1030 CD LYS A 770 -3.525 -10.825 -4.484 1.00 0.00 C ATOM 1031 CE LYS A 770 -2.551 -11.232 -5.530 1.00 0.00 C ATOM 1032 NZ LYS A 770 -1.180 -11.481 -5.021 1.00 0.00 N ATOM 0 H LYS A 770 -7.657 -10.040 -2.640 1.00 0.00 H new ATOM 0 HA LYS A 770 -5.141 -8.851 -2.979 1.00 0.00 H new ATOM 0 HB2 LYS A 770 -5.873 -11.212 -3.367 1.00 0.00 H new ATOM 0 HB3 LYS A 770 -6.917 -10.671 -4.667 1.00 0.00 H new ATOM 0 HG2 LYS A 770 -5.076 -11.616 -5.707 1.00 0.00 H new ATOM 0 HG3 LYS A 770 -4.848 -9.885 -5.859 1.00 0.00 H new ATOM 0 HD2 LYS A 770 -3.232 -9.876 -4.036 1.00 0.00 H new ATOM 0 HD3 LYS A 770 -3.555 -11.561 -3.681 1.00 0.00 H new ATOM 0 HE2 LYS A 770 -2.915 -12.136 -6.017 1.00 0.00 H new ATOM 0 HE3 LYS A 770 -2.508 -10.454 -6.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 770 -0.562 -11.760 -5.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 770 -0.810 -10.614 -4.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 770 -1.205 -12.244 -4.315 1.00 0.00 H new ATOM 1046 N ARG A 771 -7.427 -7.921 -5.132 1.00 0.00 N ATOM 1047 CA ARG A 771 -7.770 -6.941 -6.145 1.00 0.00 C ATOM 1048 C ARG A 771 -7.642 -5.529 -5.575 1.00 0.00 C ATOM 1049 O ARG A 771 -7.005 -4.656 -6.168 1.00 0.00 O ATOM 1050 CB ARG A 771 -9.204 -7.176 -6.617 1.00 0.00 C ATOM 1051 CG ARG A 771 -9.671 -6.237 -7.707 1.00 0.00 C ATOM 1052 CD ARG A 771 -11.146 -6.428 -7.990 1.00 0.00 C ATOM 1053 NE ARG A 771 -11.597 -5.585 -9.091 1.00 0.00 N ATOM 1054 CZ ARG A 771 -12.827 -5.080 -9.228 1.00 0.00 C ATOM 1055 NH1 ARG A 771 -13.727 -5.206 -8.255 1.00 0.00 N ATOM 1056 NH2 ARG A 771 -13.147 -4.410 -10.324 1.00 0.00 N ATOM 0 H ARG A 771 -8.203 -8.527 -4.866 1.00 0.00 H new ATOM 0 HA ARG A 771 -7.087 -7.046 -6.988 1.00 0.00 H new ATOM 0 HB2 ARG A 771 -9.290 -8.201 -6.977 1.00 0.00 H new ATOM 0 HB3 ARG A 771 -9.874 -7.081 -5.762 1.00 0.00 H new ATOM 0 HG2 ARG A 771 -9.485 -5.205 -7.408 1.00 0.00 H new ATOM 0 HG3 ARG A 771 -9.096 -6.414 -8.616 1.00 0.00 H new ATOM 0 HD2 ARG A 771 -11.338 -7.474 -8.230 1.00 0.00 H new ATOM 0 HD3 ARG A 771 -11.722 -6.196 -7.094 1.00 0.00 H new ATOM 0 HE ARG A 771 -10.917 -5.362 -9.818 1.00 0.00 H new ATOM 0 HH11 ARG A 771 -13.481 -5.692 -7.393 1.00 0.00 H new ATOM 0 HH12 ARG A 771 -14.662 -4.816 -8.372 1.00 0.00 H new ATOM 0 HH21 ARG A 771 -12.455 -4.280 -11.062 1.00 0.00 H new ATOM 0 HH22 ARG A 771 -14.085 -4.024 -10.430 1.00 0.00 H new ATOM 1070 N ILE A 772 -8.217 -5.338 -4.409 1.00 0.00 N ATOM 1071 CA ILE A 772 -8.243 -4.046 -3.757 1.00 0.00 C ATOM 1072 C ILE A 772 -6.849 -3.614 -3.346 1.00 0.00 C ATOM 1073 O ILE A 772 -6.443 -2.491 -3.637 1.00 0.00 O ATOM 1074 CB ILE A 772 -9.166 -4.050 -2.517 1.00 0.00 C ATOM 1075 CG1 ILE A 772 -10.594 -4.461 -2.904 1.00 0.00 C ATOM 1076 CG2 ILE A 772 -9.184 -2.662 -1.847 1.00 0.00 C ATOM 1077 CD1 ILE A 772 -11.255 -3.543 -3.917 1.00 0.00 C ATOM 0 H ILE A 772 -8.682 -6.078 -3.883 1.00 0.00 H new ATOM 0 HA ILE A 772 -8.639 -3.335 -4.482 1.00 0.00 H new ATOM 0 HB ILE A 772 -8.772 -4.778 -1.808 1.00 0.00 H new ATOM 0 HG12 ILE A 772 -10.571 -5.473 -3.308 1.00 0.00 H new ATOM 0 HG13 ILE A 772 -11.208 -4.491 -2.004 1.00 0.00 H new ATOM 0 HG21 ILE A 772 -9.840 -2.687 -0.977 1.00 0.00 H new ATOM 0 HG22 ILE A 772 -8.174 -2.396 -1.534 1.00 0.00 H new ATOM 0 HG23 ILE A 772 -9.551 -1.920 -2.556 1.00 0.00 H new ATOM 0 HD11 ILE A 772 -12.260 -3.905 -4.135 1.00 0.00 H new ATOM 0 HD12 ILE A 772 -11.313 -2.534 -3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 772 -10.667 -3.531 -4.835 1.00 0.00 H new ATOM 1089 N ILE A 773 -6.108 -4.510 -2.702 1.00 0.00 N ATOM 1090 CA ILE A 773 -4.765 -4.187 -2.245 1.00 0.00 C ATOM 1091 C ILE A 773 -3.862 -3.826 -3.443 1.00 0.00 C ATOM 1092 O ILE A 773 -3.056 -2.904 -3.366 1.00 0.00 O ATOM 1093 CB ILE A 773 -4.138 -5.322 -1.348 1.00 0.00 C ATOM 1094 CG1 ILE A 773 -2.794 -4.902 -0.752 1.00 0.00 C ATOM 1095 CG2 ILE A 773 -3.981 -6.620 -2.096 1.00 0.00 C ATOM 1096 CD1 ILE A 773 -2.884 -3.746 0.213 1.00 0.00 C ATOM 0 H ILE A 773 -6.414 -5.459 -2.487 1.00 0.00 H new ATOM 0 HA ILE A 773 -4.839 -3.311 -1.600 1.00 0.00 H new ATOM 0 HB ILE A 773 -4.844 -5.482 -0.533 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -2.353 -5.757 -0.239 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -2.117 -4.633 -1.563 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -3.545 -7.370 -1.436 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -4.957 -6.962 -2.440 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -3.327 -6.468 -2.954 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -1.889 -3.509 0.591 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -3.294 -2.876 -0.299 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.534 -4.017 1.045 1.00 0.00 H new ATOM 1108 N GLU A 774 -4.072 -4.504 -4.569 1.00 0.00 N ATOM 1109 CA GLU A 774 -3.332 -4.202 -5.775 1.00 0.00 C ATOM 1110 C GLU A 774 -3.677 -2.805 -6.252 1.00 0.00 C ATOM 1111 O GLU A 774 -2.791 -2.005 -6.565 1.00 0.00 O ATOM 1112 CB GLU A 774 -3.657 -5.193 -6.891 1.00 0.00 C ATOM 1113 CG GLU A 774 -2.864 -4.943 -8.172 1.00 0.00 C ATOM 1114 CD GLU A 774 -3.283 -5.833 -9.301 1.00 0.00 C ATOM 1115 OE1 GLU A 774 -3.121 -7.064 -9.187 1.00 0.00 O ATOM 1116 OE2 GLU A 774 -3.799 -5.320 -10.333 1.00 0.00 O ATOM 0 H GLU A 774 -4.748 -5.262 -4.664 1.00 0.00 H new ATOM 0 HA GLU A 774 -2.270 -4.273 -5.539 1.00 0.00 H new ATOM 0 HB2 GLU A 774 -3.455 -6.205 -6.539 1.00 0.00 H new ATOM 0 HB3 GLU A 774 -4.722 -5.140 -7.115 1.00 0.00 H new ATOM 0 HG2 GLU A 774 -2.987 -3.902 -8.472 1.00 0.00 H new ATOM 0 HG3 GLU A 774 -1.803 -5.094 -7.972 1.00 0.00 H new ATOM 1123 N LYS A 775 -4.962 -2.493 -6.275 1.00 0.00 N ATOM 1124 CA LYS A 775 -5.380 -1.219 -6.807 1.00 0.00 C ATOM 1125 C LYS A 775 -5.061 -0.058 -5.902 1.00 0.00 C ATOM 1126 O LYS A 775 -4.888 1.054 -6.380 1.00 0.00 O ATOM 1127 CB LYS A 775 -6.825 -1.192 -7.284 1.00 0.00 C ATOM 1128 CG LYS A 775 -7.135 -2.219 -8.363 1.00 0.00 C ATOM 1129 CD LYS A 775 -6.081 -2.246 -9.469 1.00 0.00 C ATOM 1130 CE LYS A 775 -6.454 -3.248 -10.547 1.00 0.00 C ATOM 1131 NZ LYS A 775 -5.362 -3.456 -11.509 1.00 0.00 N ATOM 0 H LYS A 775 -5.715 -3.093 -5.938 1.00 0.00 H new ATOM 0 HA LYS A 775 -4.770 -1.090 -7.701 1.00 0.00 H new ATOM 0 HB2 LYS A 775 -7.482 -1.364 -6.432 1.00 0.00 H new ATOM 0 HB3 LYS A 775 -7.053 -0.197 -7.666 1.00 0.00 H new ATOM 0 HG2 LYS A 775 -7.205 -3.207 -7.909 1.00 0.00 H new ATOM 0 HG3 LYS A 775 -8.109 -1.999 -8.800 1.00 0.00 H new ATOM 0 HD2 LYS A 775 -5.983 -1.253 -9.908 1.00 0.00 H new ATOM 0 HD3 LYS A 775 -5.110 -2.505 -9.046 1.00 0.00 H new ATOM 0 HE2 LYS A 775 -6.714 -4.199 -10.083 1.00 0.00 H new ATOM 0 HE3 LYS A 775 -7.341 -2.898 -11.076 1.00 0.00 H new ATOM 0 HZ1 LYS A 775 -5.724 -3.967 -12.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 775 -4.982 -2.535 -11.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 775 -4.607 -4.014 -11.062 1.00 0.00 H new ATOM 1145 N VAL A 776 -4.965 -0.288 -4.606 1.00 0.00 N ATOM 1146 CA VAL A 776 -4.566 0.793 -3.731 1.00 0.00 C ATOM 1147 C VAL A 776 -3.090 1.103 -3.933 1.00 0.00 C ATOM 1148 O VAL A 776 -2.694 2.263 -3.891 1.00 0.00 O ATOM 1149 CB VAL A 776 -4.886 0.574 -2.226 1.00 0.00 C ATOM 1150 CG1 VAL A 776 -6.361 0.321 -2.011 1.00 0.00 C ATOM 1151 CG2 VAL A 776 -4.037 -0.519 -1.609 1.00 0.00 C ATOM 0 H VAL A 776 -5.151 -1.181 -4.150 1.00 0.00 H new ATOM 0 HA VAL A 776 -5.177 1.649 -4.020 1.00 0.00 H new ATOM 0 HB VAL A 776 -4.627 1.498 -1.708 1.00 0.00 H new ATOM 0 HG11 VAL A 776 -6.553 0.172 -0.949 1.00 0.00 H new ATOM 0 HG12 VAL A 776 -6.933 1.178 -2.366 1.00 0.00 H new ATOM 0 HG13 VAL A 776 -6.662 -0.570 -2.563 1.00 0.00 H new ATOM 0 HG21 VAL A 776 -4.299 -0.633 -0.557 1.00 0.00 H new ATOM 0 HG22 VAL A 776 -4.217 -1.458 -2.132 1.00 0.00 H new ATOM 0 HG23 VAL A 776 -2.983 -0.253 -1.694 1.00 0.00 H new ATOM 1161 N ILE A 777 -2.288 0.065 -4.197 1.00 0.00 N ATOM 1162 CA ILE A 777 -0.871 0.245 -4.501 1.00 0.00 C ATOM 1163 C ILE A 777 -0.744 0.960 -5.843 1.00 0.00 C ATOM 1164 O ILE A 777 0.042 1.900 -5.993 1.00 0.00 O ATOM 1165 CB ILE A 777 -0.117 -1.115 -4.542 1.00 0.00 C ATOM 1166 CG1 ILE A 777 -0.179 -1.784 -3.164 1.00 0.00 C ATOM 1167 CG2 ILE A 777 1.341 -0.923 -4.978 1.00 0.00 C ATOM 1168 CD1 ILE A 777 0.362 -3.195 -3.140 1.00 0.00 C ATOM 0 H ILE A 777 -2.600 -0.906 -4.205 1.00 0.00 H new ATOM 0 HA ILE A 777 -0.416 0.843 -3.712 1.00 0.00 H new ATOM 0 HB ILE A 777 -0.603 -1.759 -5.275 1.00 0.00 H new ATOM 0 HG12 ILE A 777 0.382 -1.179 -2.452 1.00 0.00 H new ATOM 0 HG13 ILE A 777 -1.215 -1.797 -2.824 1.00 0.00 H new ATOM 0 HG21 ILE A 777 1.845 -1.889 -4.998 1.00 0.00 H new ATOM 0 HG22 ILE A 777 1.368 -0.479 -5.973 1.00 0.00 H new ATOM 0 HG23 ILE A 777 1.848 -0.264 -4.273 1.00 0.00 H new ATOM 0 HD11 ILE A 777 0.283 -3.598 -2.130 1.00 0.00 H new ATOM 0 HD12 ILE A 777 -0.214 -3.817 -3.825 1.00 0.00 H new ATOM 0 HD13 ILE A 777 1.408 -3.189 -3.447 1.00 0.00 H new ATOM 1180 N HIS A 778 -1.559 0.532 -6.789 1.00 0.00 N ATOM 1181 CA HIS A 778 -1.638 1.147 -8.100 1.00 0.00 C ATOM 1182 C HIS A 778 -2.026 2.628 -7.966 1.00 0.00 C ATOM 1183 O HIS A 778 -1.418 3.495 -8.572 1.00 0.00 O ATOM 1184 CB HIS A 778 -2.649 0.358 -8.951 1.00 0.00 C ATOM 1185 CG HIS A 778 -2.986 0.925 -10.295 1.00 0.00 C ATOM 1186 ND1 HIS A 778 -2.073 1.160 -11.305 1.00 0.00 N ATOM 1187 CD2 HIS A 778 -4.192 1.278 -10.787 1.00 0.00 C ATOM 1188 CE1 HIS A 778 -2.738 1.633 -12.358 1.00 0.00 C ATOM 1189 NE2 HIS A 778 -4.038 1.725 -12.100 1.00 0.00 N ATOM 0 H HIS A 778 -2.190 -0.260 -6.667 1.00 0.00 H new ATOM 0 HA HIS A 778 -0.668 1.116 -8.597 1.00 0.00 H new ATOM 0 HB2 HIS A 778 -2.259 -0.650 -9.095 1.00 0.00 H new ATOM 0 HB3 HIS A 778 -3.573 0.263 -8.381 1.00 0.00 H new ATOM 0 HD2 HIS A 778 -5.127 1.223 -10.250 1.00 0.00 H new ATOM 0 HE1 HIS A 778 -2.281 1.906 -13.298 1.00 0.00 H new ATOM 0 HE2 HIS A 778 -4.770 2.054 -12.730 1.00 0.00 H new ATOM 1197 N ARG A 779 -3.010 2.910 -7.137 1.00 0.00 N ATOM 1198 CA ARG A 779 -3.427 4.275 -6.891 1.00 0.00 C ATOM 1199 C ARG A 779 -2.299 5.062 -6.225 1.00 0.00 C ATOM 1200 O ARG A 779 -1.990 6.181 -6.626 1.00 0.00 O ATOM 1201 CB ARG A 779 -4.698 4.309 -6.045 1.00 0.00 C ATOM 1202 CG ARG A 779 -5.215 5.714 -5.760 1.00 0.00 C ATOM 1203 CD ARG A 779 -6.482 5.682 -4.927 1.00 0.00 C ATOM 1204 NE ARG A 779 -7.559 4.944 -5.599 1.00 0.00 N ATOM 1205 CZ ARG A 779 -8.782 4.750 -5.105 1.00 0.00 C ATOM 1206 NH1 ARG A 779 -9.131 5.258 -3.916 1.00 0.00 N ATOM 1207 NH2 ARG A 779 -9.663 4.057 -5.801 1.00 0.00 N ATOM 0 H ARG A 779 -3.538 2.208 -6.620 1.00 0.00 H new ATOM 0 HA ARG A 779 -3.653 4.747 -7.847 1.00 0.00 H new ATOM 0 HB2 ARG A 779 -5.477 3.743 -6.555 1.00 0.00 H new ATOM 0 HB3 ARG A 779 -4.506 3.805 -5.098 1.00 0.00 H new ATOM 0 HG2 ARG A 779 -4.449 6.286 -5.237 1.00 0.00 H new ATOM 0 HG3 ARG A 779 -5.410 6.229 -6.701 1.00 0.00 H new ATOM 0 HD2 ARG A 779 -6.271 5.219 -3.963 1.00 0.00 H new ATOM 0 HD3 ARG A 779 -6.811 6.702 -4.726 1.00 0.00 H new ATOM 0 HE ARG A 779 -7.355 4.548 -6.517 1.00 0.00 H new ATOM 0 HH11 ARG A 779 -8.458 5.801 -3.376 1.00 0.00 H new ATOM 0 HH12 ARG A 779 -10.070 5.102 -3.550 1.00 0.00 H new ATOM 0 HH21 ARG A 779 -9.407 3.674 -6.711 1.00 0.00 H new ATOM 0 HH22 ARG A 779 -10.601 3.905 -5.429 1.00 0.00 H new ATOM 1221 N LEU A 780 -1.675 4.432 -5.260 1.00 0.00 N ATOM 1222 CA LEU A 780 -0.558 4.967 -4.498 1.00 0.00 C ATOM 1223 C LEU A 780 0.566 5.476 -5.410 1.00 0.00 C ATOM 1224 O LEU A 780 0.896 6.671 -5.397 1.00 0.00 O ATOM 1225 CB LEU A 780 -0.030 3.842 -3.585 1.00 0.00 C ATOM 1226 CG LEU A 780 1.246 4.083 -2.792 1.00 0.00 C ATOM 1227 CD1 LEU A 780 1.052 5.164 -1.760 1.00 0.00 C ATOM 1228 CD2 LEU A 780 1.705 2.794 -2.142 1.00 0.00 C ATOM 0 H LEU A 780 -1.938 3.491 -4.967 1.00 0.00 H new ATOM 0 HA LEU A 780 -0.900 5.820 -3.912 1.00 0.00 H new ATOM 0 HB2 LEU A 780 -0.819 3.595 -2.875 1.00 0.00 H new ATOM 0 HB3 LEU A 780 0.128 2.960 -4.205 1.00 0.00 H new ATOM 0 HG LEU A 780 2.019 4.423 -3.481 1.00 0.00 H new ATOM 0 HD11 LEU A 780 1.981 5.313 -1.210 1.00 0.00 H new ATOM 0 HD12 LEU A 780 0.770 6.093 -2.255 1.00 0.00 H new ATOM 0 HD13 LEU A 780 0.264 4.869 -1.067 1.00 0.00 H new ATOM 0 HD21 LEU A 780 2.619 2.977 -1.577 1.00 0.00 H new ATOM 0 HD22 LEU A 780 0.929 2.429 -1.469 1.00 0.00 H new ATOM 0 HD23 LEU A 780 1.898 2.047 -2.912 1.00 0.00 H new ATOM 1240 N THR A 781 1.088 4.595 -6.241 1.00 0.00 N ATOM 1241 CA THR A 781 2.262 4.903 -7.034 1.00 0.00 C ATOM 1242 C THR A 781 1.925 5.542 -8.403 1.00 0.00 C ATOM 1243 O THR A 781 2.815 6.002 -9.119 1.00 0.00 O ATOM 1244 CB THR A 781 3.177 3.631 -7.196 1.00 0.00 C ATOM 1245 OG1 THR A 781 4.433 3.953 -7.818 1.00 0.00 O ATOM 1246 CG2 THR A 781 2.477 2.544 -7.998 1.00 0.00 C ATOM 0 H THR A 781 0.716 3.656 -6.385 1.00 0.00 H new ATOM 0 HA THR A 781 2.820 5.661 -6.484 1.00 0.00 H new ATOM 0 HB THR A 781 3.374 3.259 -6.190 1.00 0.00 H new ATOM 0 HG1 THR A 781 4.337 4.775 -8.343 1.00 0.00 H new ATOM 0 HG21 THR A 781 3.135 1.680 -8.092 1.00 0.00 H new ATOM 0 HG22 THR A 781 1.560 2.248 -7.488 1.00 0.00 H new ATOM 0 HG23 THR A 781 2.233 2.924 -8.990 1.00 0.00 H new ATOM 1254 N HIS A 782 0.658 5.622 -8.746 1.00 0.00 N ATOM 1255 CA HIS A 782 0.309 6.137 -10.069 1.00 0.00 C ATOM 1256 C HIS A 782 -0.590 7.373 -9.991 1.00 0.00 C ATOM 1257 O HIS A 782 -0.294 8.401 -10.601 1.00 0.00 O ATOM 1258 CB HIS A 782 -0.321 5.010 -10.928 1.00 0.00 C ATOM 1259 CG HIS A 782 -0.687 5.374 -12.344 1.00 0.00 C ATOM 1260 ND1 HIS A 782 0.128 5.146 -13.434 1.00 0.00 N ATOM 1261 CD2 HIS A 782 -1.826 5.914 -12.841 1.00 0.00 C ATOM 1262 CE1 HIS A 782 -0.521 5.544 -14.530 1.00 0.00 C ATOM 1263 NE2 HIS A 782 -1.719 6.020 -14.224 1.00 0.00 N ATOM 0 H HIS A 782 -0.129 5.350 -8.157 1.00 0.00 H new ATOM 0 HA HIS A 782 1.226 6.467 -10.557 1.00 0.00 H new ATOM 0 HB2 HIS A 782 0.377 4.173 -10.959 1.00 0.00 H new ATOM 0 HB3 HIS A 782 -1.220 4.657 -10.423 1.00 0.00 H new ATOM 0 HD2 HIS A 782 -2.682 6.215 -12.256 1.00 0.00 H new ATOM 0 HE1 HIS A 782 -0.123 5.486 -15.532 1.00 0.00 H new ATOM 0 HE2 HIS A 782 -2.418 6.388 -14.869 1.00 0.00 H new ATOM 1271 N TYR A 783 -1.653 7.282 -9.229 1.00 0.00 N ATOM 1272 CA TYR A 783 -2.640 8.362 -9.150 1.00 0.00 C ATOM 1273 C TYR A 783 -2.214 9.404 -8.133 1.00 0.00 C ATOM 1274 O TYR A 783 -2.104 10.588 -8.433 1.00 0.00 O ATOM 1275 CB TYR A 783 -4.009 7.845 -8.644 1.00 0.00 C ATOM 1276 CG TYR A 783 -4.742 6.761 -9.421 1.00 0.00 C ATOM 1277 CD1 TYR A 783 -4.115 5.603 -9.850 1.00 0.00 C ATOM 1278 CD2 TYR A 783 -6.110 6.871 -9.630 1.00 0.00 C ATOM 1279 CE1 TYR A 783 -4.821 4.595 -10.458 1.00 0.00 C ATOM 1280 CE2 TYR A 783 -6.820 5.872 -10.255 1.00 0.00 C ATOM 1281 CZ TYR A 783 -6.172 4.732 -10.660 1.00 0.00 C ATOM 1282 OH TYR A 783 -6.884 3.711 -11.247 1.00 0.00 O ATOM 0 H TYR A 783 -1.868 6.472 -8.648 1.00 0.00 H new ATOM 0 HA TYR A 783 -2.715 8.772 -10.157 1.00 0.00 H new ATOM 0 HB2 TYR A 783 -3.862 7.475 -7.629 1.00 0.00 H new ATOM 0 HB3 TYR A 783 -4.676 8.704 -8.576 1.00 0.00 H new ATOM 0 HD1 TYR A 783 -3.051 5.491 -9.703 1.00 0.00 H new ATOM 0 HD2 TYR A 783 -6.627 7.758 -9.295 1.00 0.00 H new ATOM 0 HE1 TYR A 783 -4.315 3.696 -10.777 1.00 0.00 H new ATOM 0 HE2 TYR A 783 -7.880 5.984 -10.426 1.00 0.00 H new ATOM 0 HH TYR A 783 -7.827 3.968 -11.316 1.00 0.00 H new ATOM 1292 N ASP A 784 -1.962 8.927 -6.931 1.00 0.00 N ATOM 1293 CA ASP A 784 -1.842 9.785 -5.764 1.00 0.00 C ATOM 1294 C ASP A 784 -0.455 10.408 -5.597 1.00 0.00 C ATOM 1295 O ASP A 784 -0.347 11.558 -5.159 1.00 0.00 O ATOM 1296 CB ASP A 784 -2.283 9.009 -4.520 1.00 0.00 C ATOM 1297 CG ASP A 784 -2.788 9.913 -3.417 1.00 0.00 C ATOM 1298 OD1 ASP A 784 -3.336 10.987 -3.732 1.00 0.00 O ATOM 1299 OD2 ASP A 784 -2.729 9.543 -2.244 1.00 0.00 O ATOM 0 H ASP A 784 -1.834 7.935 -6.733 1.00 0.00 H new ATOM 0 HA ASP A 784 -2.505 10.638 -5.911 1.00 0.00 H new ATOM 0 HB2 ASP A 784 -3.068 8.305 -4.795 1.00 0.00 H new ATOM 0 HB3 ASP A 784 -1.444 8.421 -4.147 1.00 0.00 H new ATOM 1304 N HIS A 785 0.603 9.634 -5.923 1.00 0.00 N ATOM 1305 CA HIS A 785 2.015 10.123 -5.911 1.00 0.00 C ATOM 1306 C HIS A 785 2.460 10.470 -4.462 1.00 0.00 C ATOM 1307 O HIS A 785 3.372 11.258 -4.208 1.00 0.00 O ATOM 1308 CB HIS A 785 2.161 11.333 -6.875 1.00 0.00 C ATOM 1309 CG HIS A 785 3.576 11.746 -7.174 1.00 0.00 C ATOM 1310 ND1 HIS A 785 4.070 13.010 -6.957 1.00 0.00 N ATOM 1311 CD2 HIS A 785 4.586 11.043 -7.729 1.00 0.00 C ATOM 1312 CE1 HIS A 785 5.328 13.044 -7.376 1.00 0.00 C ATOM 1313 NE2 HIS A 785 5.699 11.868 -7.860 1.00 0.00 N ATOM 0 H HIS A 785 0.512 8.657 -6.202 1.00 0.00 H new ATOM 0 HA HIS A 785 2.676 9.333 -6.266 1.00 0.00 H new ATOM 0 HB2 HIS A 785 1.664 11.091 -7.814 1.00 0.00 H new ATOM 0 HB3 HIS A 785 1.634 12.185 -6.446 1.00 0.00 H new ATOM 0 HD2 HIS A 785 4.538 10.005 -8.024 1.00 0.00 H new ATOM 0 HE1 HIS A 785 5.965 13.915 -7.329 1.00 0.00 H new ATOM 0 HE2 HIS A 785 6.609 11.619 -8.247 1.00 0.00 H new ATOM 1321 N VAL A 786 1.855 9.786 -3.536 1.00 0.00 N ATOM 1322 CA VAL A 786 2.080 9.987 -2.112 1.00 0.00 C ATOM 1323 C VAL A 786 3.096 8.932 -1.589 1.00 0.00 C ATOM 1324 O VAL A 786 3.292 8.726 -0.378 1.00 0.00 O ATOM 1325 CB VAL A 786 0.710 9.878 -1.399 1.00 0.00 C ATOM 1326 CG1 VAL A 786 0.140 8.505 -1.592 1.00 0.00 C ATOM 1327 CG2 VAL A 786 0.765 10.257 0.079 1.00 0.00 C ATOM 0 H VAL A 786 1.175 9.054 -3.741 1.00 0.00 H new ATOM 0 HA VAL A 786 2.508 10.969 -1.911 1.00 0.00 H new ATOM 0 HB VAL A 786 0.048 10.609 -1.863 1.00 0.00 H new ATOM 0 HG11 VAL A 786 -0.824 8.437 -1.087 1.00 0.00 H new ATOM 0 HG12 VAL A 786 0.006 8.313 -2.657 1.00 0.00 H new ATOM 0 HG13 VAL A 786 0.822 7.766 -1.173 1.00 0.00 H new ATOM 0 HG21 VAL A 786 -0.228 10.158 0.517 1.00 0.00 H new ATOM 0 HG22 VAL A 786 1.458 9.596 0.599 1.00 0.00 H new ATOM 0 HG23 VAL A 786 1.104 11.288 0.178 1.00 0.00 H new ATOM 1337 N LEU A 787 3.752 8.302 -2.521 1.00 0.00 N ATOM 1338 CA LEU A 787 4.723 7.287 -2.231 1.00 0.00 C ATOM 1339 C LEU A 787 6.097 7.836 -2.501 1.00 0.00 C ATOM 1340 O LEU A 787 6.285 8.626 -3.437 1.00 0.00 O ATOM 1341 CB LEU A 787 4.456 5.984 -3.065 1.00 0.00 C ATOM 1342 CG LEU A 787 4.733 5.954 -4.621 1.00 0.00 C ATOM 1343 CD1 LEU A 787 4.196 7.165 -5.377 1.00 0.00 C ATOM 1344 CD2 LEU A 787 6.197 5.686 -4.956 1.00 0.00 C ATOM 0 H LEU A 787 3.626 8.482 -3.517 1.00 0.00 H new ATOM 0 HA LEU A 787 4.646 7.008 -1.180 1.00 0.00 H new ATOM 0 HB2 LEU A 787 5.051 5.188 -2.617 1.00 0.00 H new ATOM 0 HB3 LEU A 787 3.409 5.719 -2.920 1.00 0.00 H new ATOM 0 HG LEU A 787 4.155 5.102 -4.981 1.00 0.00 H new ATOM 0 HD11 LEU A 787 4.429 7.065 -6.437 1.00 0.00 H new ATOM 0 HD12 LEU A 787 3.116 7.225 -5.247 1.00 0.00 H new ATOM 0 HD13 LEU A 787 4.660 8.072 -4.988 1.00 0.00 H new ATOM 0 HD21 LEU A 787 6.327 5.677 -6.038 1.00 0.00 H new ATOM 0 HD22 LEU A 787 6.819 6.469 -4.523 1.00 0.00 H new ATOM 0 HD23 LEU A 787 6.493 4.720 -4.547 1.00 0.00 H new ATOM 1356 N ILE A 788 7.028 7.474 -1.700 1.00 0.00 N ATOM 1357 CA ILE A 788 8.372 7.860 -1.932 1.00 0.00 C ATOM 1358 C ILE A 788 9.140 6.582 -2.195 1.00 0.00 C ATOM 1359 O ILE A 788 9.170 5.686 -1.351 1.00 0.00 O ATOM 1360 CB ILE A 788 9.024 8.644 -0.733 1.00 0.00 C ATOM 1361 CG1 ILE A 788 8.207 9.886 -0.292 1.00 0.00 C ATOM 1362 CG2 ILE A 788 10.440 9.069 -1.080 1.00 0.00 C ATOM 1363 CD1 ILE A 788 6.961 9.587 0.532 1.00 0.00 C ATOM 0 H ILE A 788 6.883 6.904 -0.867 1.00 0.00 H new ATOM 0 HA ILE A 788 8.402 8.552 -2.774 1.00 0.00 H new ATOM 0 HB ILE A 788 9.034 7.950 0.108 1.00 0.00 H new ATOM 0 HG12 ILE A 788 8.857 10.541 0.288 1.00 0.00 H new ATOM 0 HG13 ILE A 788 7.909 10.439 -1.183 1.00 0.00 H new ATOM 0 HG21 ILE A 788 10.874 9.610 -0.239 1.00 0.00 H new ATOM 0 HG22 ILE A 788 11.043 8.186 -1.294 1.00 0.00 H new ATOM 0 HG23 ILE A 788 10.421 9.717 -1.957 1.00 0.00 H new ATOM 0 HD11 ILE A 788 6.462 10.521 0.789 1.00 0.00 H new ATOM 0 HD12 ILE A 788 6.283 8.961 -0.048 1.00 0.00 H new ATOM 0 HD13 ILE A 788 7.245 9.064 1.445 1.00 0.00 H new ATOM 1375 N GLU A 789 9.682 6.451 -3.364 1.00 0.00 N ATOM 1376 CA GLU A 789 10.421 5.268 -3.697 1.00 0.00 C ATOM 1377 C GLU A 789 11.895 5.522 -3.583 1.00 0.00 C ATOM 1378 O GLU A 789 12.463 6.335 -4.317 1.00 0.00 O ATOM 1379 CB GLU A 789 10.033 4.688 -5.067 1.00 0.00 C ATOM 1380 CG GLU A 789 10.040 5.658 -6.230 1.00 0.00 C ATOM 1381 CD GLU A 789 9.752 4.960 -7.530 1.00 0.00 C ATOM 1382 OE1 GLU A 789 8.579 4.615 -7.798 1.00 0.00 O ATOM 1383 OE2 GLU A 789 10.703 4.719 -8.307 1.00 0.00 O ATOM 0 H GLU A 789 9.628 7.148 -4.107 1.00 0.00 H new ATOM 0 HA GLU A 789 10.153 4.500 -2.971 1.00 0.00 H new ATOM 0 HB2 GLU A 789 10.716 3.870 -5.299 1.00 0.00 H new ATOM 0 HB3 GLU A 789 9.035 4.257 -4.986 1.00 0.00 H new ATOM 0 HG2 GLU A 789 9.296 6.436 -6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 789 11.010 6.152 -6.288 1.00 0.00 H new ATOM 1666 N TYR A 810 12.321 0.455 -2.500 1.00 0.00 N ATOM 1667 CA TYR A 810 11.808 0.423 -1.173 1.00 0.00 C ATOM 1668 C TYR A 810 10.851 1.571 -1.041 1.00 0.00 C ATOM 1669 O TYR A 810 11.245 2.740 -1.141 1.00 0.00 O ATOM 1670 CB TYR A 810 12.960 0.526 -0.172 1.00 0.00 C ATOM 1671 CG TYR A 810 14.034 -0.537 -0.384 1.00 0.00 C ATOM 1672 CD1 TYR A 810 15.102 -0.310 -1.254 1.00 0.00 C ATOM 1673 CD2 TYR A 810 13.980 -1.757 0.272 1.00 0.00 C ATOM 1674 CE1 TYR A 810 16.074 -1.262 -1.462 1.00 0.00 C ATOM 1675 CE2 TYR A 810 14.956 -2.718 0.067 1.00 0.00 C ATOM 1676 CZ TYR A 810 16.001 -2.461 -0.801 1.00 0.00 C ATOM 1677 OH TYR A 810 16.976 -3.423 -1.020 1.00 0.00 O ATOM 0 HA TYR A 810 11.288 -0.512 -0.965 1.00 0.00 H new ATOM 0 HB2 TYR A 810 13.414 1.514 -0.250 1.00 0.00 H new ATOM 0 HB3 TYR A 810 12.564 0.437 0.839 1.00 0.00 H new ATOM 0 HD1 TYR A 810 15.167 0.634 -1.775 1.00 0.00 H new ATOM 0 HD2 TYR A 810 13.166 -1.961 0.952 1.00 0.00 H new ATOM 0 HE1 TYR A 810 16.890 -1.066 -2.142 1.00 0.00 H new ATOM 0 HE2 TYR A 810 14.901 -3.665 0.583 1.00 0.00 H new ATOM 0 HH TYR A 810 16.782 -4.215 -0.476 1.00 0.00 H new ATOM 1687 N LEU A 811 9.607 1.251 -0.884 1.00 0.00 N ATOM 1688 CA LEU A 811 8.584 2.250 -0.870 1.00 0.00 C ATOM 1689 C LEU A 811 8.292 2.697 0.518 1.00 0.00 C ATOM 1690 O LEU A 811 8.089 1.889 1.401 1.00 0.00 O ATOM 1691 CB LEU A 811 7.304 1.717 -1.499 1.00 0.00 C ATOM 1692 CG LEU A 811 7.423 1.194 -2.923 1.00 0.00 C ATOM 1693 CD1 LEU A 811 6.075 0.764 -3.446 1.00 0.00 C ATOM 1694 CD2 LEU A 811 8.023 2.236 -3.821 1.00 0.00 C ATOM 0 H LEU A 811 9.271 0.296 -0.762 1.00 0.00 H new ATOM 0 HA LEU A 811 8.949 3.098 -1.449 1.00 0.00 H new ATOM 0 HB2 LEU A 811 6.922 0.913 -0.870 1.00 0.00 H new ATOM 0 HB3 LEU A 811 6.559 2.513 -1.487 1.00 0.00 H new ATOM 0 HG LEU A 811 8.082 0.326 -2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 811 6.182 0.393 -4.465 1.00 0.00 H new ATOM 0 HD12 LEU A 811 5.674 -0.027 -2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 811 5.394 1.615 -3.439 1.00 0.00 H new ATOM 0 HD21 LEU A 811 8.100 1.842 -4.835 1.00 0.00 H new ATOM 0 HD22 LEU A 811 7.390 3.123 -3.823 1.00 0.00 H new ATOM 0 HD23 LEU A 811 9.016 2.500 -3.458 1.00 0.00 H new ATOM 1706 N VAL A 812 8.293 3.957 0.701 1.00 0.00 N ATOM 1707 CA VAL A 812 7.895 4.565 1.935 1.00 0.00 C ATOM 1708 C VAL A 812 6.660 5.424 1.668 1.00 0.00 C ATOM 1709 O VAL A 812 6.529 5.995 0.579 1.00 0.00 O ATOM 1710 CB VAL A 812 9.085 5.316 2.665 1.00 0.00 C ATOM 1711 CG1 VAL A 812 10.094 5.861 1.683 1.00 0.00 C ATOM 1712 CG2 VAL A 812 8.597 6.437 3.565 1.00 0.00 C ATOM 0 H VAL A 812 8.576 4.626 -0.015 1.00 0.00 H new ATOM 0 HA VAL A 812 7.618 3.798 2.658 1.00 0.00 H new ATOM 0 HB VAL A 812 9.570 4.564 3.288 1.00 0.00 H new ATOM 0 HG11 VAL A 812 10.892 6.368 2.225 1.00 0.00 H new ATOM 0 HG12 VAL A 812 10.515 5.041 1.101 1.00 0.00 H new ATOM 0 HG13 VAL A 812 9.605 6.568 1.013 1.00 0.00 H new ATOM 0 HG21 VAL A 812 9.451 6.919 4.041 1.00 0.00 H new ATOM 0 HG22 VAL A 812 8.052 7.170 2.970 1.00 0.00 H new ATOM 0 HG23 VAL A 812 7.938 6.028 4.331 1.00 0.00 H new ATOM 1722 N VAL A 813 5.743 5.471 2.606 1.00 0.00 N ATOM 1723 CA VAL A 813 4.476 6.120 2.365 1.00 0.00 C ATOM 1724 C VAL A 813 4.301 7.378 3.221 1.00 0.00 C ATOM 1725 O VAL A 813 4.710 7.423 4.382 1.00 0.00 O ATOM 1726 CB VAL A 813 3.276 5.121 2.570 1.00 0.00 C ATOM 1727 CG1 VAL A 813 3.176 4.622 4.011 1.00 0.00 C ATOM 1728 CG2 VAL A 813 1.955 5.723 2.104 1.00 0.00 C ATOM 0 H VAL A 813 5.849 5.070 3.538 1.00 0.00 H new ATOM 0 HA VAL A 813 4.474 6.440 1.323 1.00 0.00 H new ATOM 0 HB VAL A 813 3.486 4.254 1.944 1.00 0.00 H new ATOM 0 HG11 VAL A 813 2.333 3.936 4.101 1.00 0.00 H new ATOM 0 HG12 VAL A 813 4.096 4.104 4.281 1.00 0.00 H new ATOM 0 HG13 VAL A 813 3.027 5.470 4.680 1.00 0.00 H new ATOM 0 HG21 VAL A 813 1.152 5.004 2.262 1.00 0.00 H new ATOM 0 HG22 VAL A 813 1.747 6.629 2.673 1.00 0.00 H new ATOM 0 HG23 VAL A 813 2.020 5.967 1.044 1.00 0.00 H new ATOM 1738 N ASN A 814 3.736 8.396 2.615 1.00 0.00 N ATOM 1739 CA ASN A 814 3.401 9.633 3.296 1.00 0.00 C ATOM 1740 C ASN A 814 2.008 9.510 3.895 1.00 0.00 C ATOM 1741 O ASN A 814 1.077 9.043 3.217 1.00 0.00 O ATOM 1742 CB ASN A 814 3.492 10.814 2.295 1.00 0.00 C ATOM 1743 CG ASN A 814 2.876 12.143 2.732 1.00 0.00 C ATOM 1744 OD1 ASN A 814 2.772 12.466 3.901 1.00 0.00 O ATOM 1745 ND2 ASN A 814 2.497 12.934 1.774 1.00 0.00 N ATOM 0 H ASN A 814 3.492 8.392 1.625 1.00 0.00 H new ATOM 0 HA ASN A 814 4.104 9.826 4.106 1.00 0.00 H new ATOM 0 HB2 ASN A 814 4.544 10.986 2.069 1.00 0.00 H new ATOM 0 HB3 ASN A 814 3.012 10.508 1.365 1.00 0.00 H new ATOM 0 HD21 ASN A 814 2.102 13.848 1.994 1.00 0.00 H new ATOM 0 HD22 ASN A 814 2.594 12.641 0.802 1.00 0.00 H new ATOM 1752 N PRO A 815 1.832 9.906 5.179 1.00 0.00 N ATOM 1753 CA PRO A 815 0.539 9.851 5.890 1.00 0.00 C ATOM 1754 C PRO A 815 -0.620 10.656 5.240 1.00 0.00 C ATOM 1755 O PRO A 815 -1.700 10.757 5.815 1.00 0.00 O ATOM 1756 CB PRO A 815 0.856 10.407 7.284 1.00 0.00 C ATOM 1757 CG PRO A 815 2.140 11.136 7.124 1.00 0.00 C ATOM 1758 CD PRO A 815 2.906 10.384 6.084 1.00 0.00 C ATOM 0 HA PRO A 815 0.164 8.828 5.880 1.00 0.00 H new ATOM 0 HB2 PRO A 815 0.066 11.072 7.633 1.00 0.00 H new ATOM 0 HB3 PRO A 815 0.946 9.606 8.018 1.00 0.00 H new ATOM 0 HG2 PRO A 815 1.969 12.167 6.815 1.00 0.00 H new ATOM 0 HG3 PRO A 815 2.689 11.172 8.065 1.00 0.00 H new ATOM 0 HD2 PRO A 815 3.620 11.023 5.565 1.00 0.00 H new ATOM 0 HD3 PRO A 815 3.472 9.558 6.515 1.00 0.00 H new ATOM 1766 N ASN A 816 -0.404 11.233 4.070 1.00 0.00 N ATOM 1767 CA ASN A 816 -1.513 11.900 3.355 1.00 0.00 C ATOM 1768 C ASN A 816 -2.399 10.864 2.679 1.00 0.00 C ATOM 1769 O ASN A 816 -3.587 11.088 2.463 1.00 0.00 O ATOM 1770 CB ASN A 816 -1.015 12.891 2.289 1.00 0.00 C ATOM 1771 CG ASN A 816 -0.520 14.231 2.811 1.00 0.00 C ATOM 1772 OD1 ASN A 816 -0.610 15.233 2.109 1.00 0.00 O ATOM 1773 ND2 ASN A 816 -0.008 14.278 4.014 1.00 0.00 N ATOM 0 H ASN A 816 0.498 11.262 3.594 1.00 0.00 H new ATOM 0 HA ASN A 816 -2.076 12.458 4.103 1.00 0.00 H new ATOM 0 HB2 ASN A 816 -0.207 12.419 1.731 1.00 0.00 H new ATOM 0 HB3 ASN A 816 -1.825 13.074 1.583 1.00 0.00 H new ATOM 0 HD21 ASN A 816 0.329 15.164 4.391 1.00 0.00 H new ATOM 0 HD22 ASN A 816 0.054 13.429 4.575 1.00 0.00 H new ATOM 1780 N TYR A 817 -1.809 9.716 2.410 1.00 0.00 N ATOM 1781 CA TYR A 817 -2.433 8.639 1.652 1.00 0.00 C ATOM 1782 C TYR A 817 -3.551 7.940 2.382 1.00 0.00 C ATOM 1783 O TYR A 817 -4.668 7.816 1.888 1.00 0.00 O ATOM 1784 CB TYR A 817 -1.360 7.625 1.287 1.00 0.00 C ATOM 1785 CG TYR A 817 -1.849 6.379 0.600 1.00 0.00 C ATOM 1786 CD1 TYR A 817 -2.432 6.422 -0.659 1.00 0.00 C ATOM 1787 CD2 TYR A 817 -1.712 5.155 1.215 1.00 0.00 C ATOM 1788 CE1 TYR A 817 -2.866 5.276 -1.278 1.00 0.00 C ATOM 1789 CE2 TYR A 817 -2.139 4.006 0.602 1.00 0.00 C ATOM 1790 CZ TYR A 817 -2.713 4.070 -0.642 1.00 0.00 C ATOM 1791 OH TYR A 817 -3.140 2.925 -1.245 1.00 0.00 O ATOM 0 H TYR A 817 -0.861 9.497 2.717 1.00 0.00 H new ATOM 0 HA TYR A 817 -2.885 9.091 0.769 1.00 0.00 H new ATOM 0 HB2 TYR A 817 -0.630 8.112 0.640 1.00 0.00 H new ATOM 0 HB3 TYR A 817 -0.836 7.334 2.197 1.00 0.00 H new ATOM 0 HD1 TYR A 817 -2.546 7.372 -1.160 1.00 0.00 H new ATOM 0 HD2 TYR A 817 -1.261 5.099 2.195 1.00 0.00 H new ATOM 0 HE1 TYR A 817 -3.323 5.323 -2.255 1.00 0.00 H new ATOM 0 HE2 TYR A 817 -2.024 3.053 1.097 1.00 0.00 H new ATOM 0 HH TYR A 817 -2.858 2.925 -2.184 1.00 0.00 H new