USER MOD reduce.3.24.130724 H: found=0, std=0, add=372, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 374 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 230 TYR OH : rot 180:sc= -2.12! USER MOD Set 1.2: A 246 CYS SG : rot 24:sc= -1.41 USER MOD Set 2.1: A 185 HIS : no HD1:sc= -8.8! C(o=-15!,f=-31!) USER MOD Set 2.2: A 245 TYR OH : rot -150:sc= -6.06! USER MOD Single : A 184 ASN : amide:sc= 0.474 X(o=0.47,f=0) USER MOD Single : A 210 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 211 TYR OH : rot 180:sc= 0 USER MOD Single : A 216 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 225 ASN : amide:sc= -2.02 K(o=-2,f=-6.6!) USER MOD Single : A 226 THR OG1 : rot -83:sc= -0.518! USER MOD Single : A 229 THR OG1 : rot 180:sc= 0 USER MOD Single : A 232 SER OG : rot 180:sc= 0 USER MOD Single : A 235 GLN : amide:sc= -1.34 X(o=-1.3,f=-0.91) USER MOD Single : A 240 LYS NZ :NH3+ 151:sc= -0.291 (180deg=-0.667) USER MOD Single : A 244 ASN : amide:sc= -3.25 K(o=-3.2,f=-0.58) USER MOD Single : A 247 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 248 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 105 N ILE A 179 5.878 -1.107 -4.179 1.00 0.00 N ATOM 106 CA ILE A 179 5.277 -2.125 -3.269 1.00 0.00 C ATOM 107 C ILE A 179 5.998 -3.469 -3.427 1.00 0.00 C ATOM 108 O ILE A 179 6.053 -4.028 -4.504 1.00 0.00 O ATOM 109 CB ILE A 179 3.796 -2.215 -3.695 1.00 0.00 C ATOM 110 CG1 ILE A 179 2.923 -2.241 -2.441 1.00 0.00 C ATOM 111 CG2 ILE A 179 3.532 -3.482 -4.522 1.00 0.00 C ATOM 112 CD1 ILE A 179 1.456 -2.457 -2.820 1.00 0.00 C ATOM 0 HA ILE A 179 5.369 -1.856 -2.217 1.00 0.00 H new ATOM 0 HB ILE A 179 3.557 -1.349 -4.312 1.00 0.00 H new ATOM 0 HG12 ILE A 179 3.255 -3.038 -1.775 1.00 0.00 H new ATOM 0 HG13 ILE A 179 3.031 -1.304 -1.895 1.00 0.00 H new ATOM 0 HG21 ILE A 179 2.481 -3.518 -4.807 1.00 0.00 H new ATOM 0 HG22 ILE A 179 4.151 -3.467 -5.419 1.00 0.00 H new ATOM 0 HG23 ILE A 179 3.777 -4.362 -3.927 1.00 0.00 H new ATOM 0 HD11 ILE A 179 0.846 -2.473 -1.917 1.00 0.00 H new ATOM 0 HD12 ILE A 179 1.124 -1.645 -3.468 1.00 0.00 H new ATOM 0 HD13 ILE A 179 1.352 -3.406 -3.346 1.00 0.00 H new ATOM 124 N ASP A 180 6.537 -4.003 -2.364 1.00 0.00 N ATOM 125 CA ASP A 180 7.230 -5.315 -2.479 1.00 0.00 C ATOM 126 C ASP A 180 6.214 -6.441 -2.333 1.00 0.00 C ATOM 127 O ASP A 180 6.196 -7.377 -3.108 1.00 0.00 O ATOM 128 CB ASP A 180 8.242 -5.351 -1.332 1.00 0.00 C ATOM 129 CG ASP A 180 9.453 -6.188 -1.749 1.00 0.00 C ATOM 130 OD1 ASP A 180 9.307 -6.998 -2.651 1.00 0.00 O ATOM 131 OD2 ASP A 180 10.505 -6.006 -1.160 1.00 0.00 O ATOM 0 H ASP A 180 6.527 -3.591 -1.431 1.00 0.00 H new ATOM 0 HA ASP A 180 7.722 -5.439 -3.443 1.00 0.00 H new ATOM 0 HB2 ASP A 180 8.556 -4.339 -1.077 1.00 0.00 H new ATOM 0 HB3 ASP A 180 7.782 -5.776 -0.440 1.00 0.00 H new ATOM 136 N ILE A 181 5.367 -6.359 -1.345 1.00 0.00 N ATOM 137 CA ILE A 181 4.359 -7.435 -1.150 1.00 0.00 C ATOM 138 C ILE A 181 3.194 -6.953 -0.276 1.00 0.00 C ATOM 139 O ILE A 181 3.376 -6.225 0.676 1.00 0.00 O ATOM 140 CB ILE A 181 5.124 -8.531 -0.411 1.00 0.00 C ATOM 141 CG1 ILE A 181 6.075 -9.256 -1.366 1.00 0.00 C ATOM 142 CG2 ILE A 181 4.135 -9.539 0.181 1.00 0.00 C ATOM 143 CD1 ILE A 181 6.612 -10.511 -0.677 1.00 0.00 C ATOM 0 H ILE A 181 5.330 -5.597 -0.668 1.00 0.00 H new ATOM 0 HA ILE A 181 3.929 -7.763 -2.096 1.00 0.00 H new ATOM 0 HB ILE A 181 5.706 -8.072 0.388 1.00 0.00 H new ATOM 0 HG12 ILE A 181 5.553 -9.525 -2.285 1.00 0.00 H new ATOM 0 HG13 ILE A 181 6.898 -8.600 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 181 4.683 -10.320 0.708 1.00 0.00 H new ATOM 0 HG22 ILE A 181 3.470 -9.030 0.878 1.00 0.00 H new ATOM 0 HG23 ILE A 181 3.547 -9.986 -0.621 1.00 0.00 H new ATOM 0 HD11 ILE A 181 7.291 -11.034 -1.351 1.00 0.00 H new ATOM 0 HD12 ILE A 181 7.147 -10.228 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 181 5.781 -11.167 -0.418 1.00 0.00 H new ATOM 155 N VAL A 182 2.006 -7.389 -0.576 1.00 0.00 N ATOM 156 CA VAL A 182 0.833 -7.003 0.256 1.00 0.00 C ATOM 157 C VAL A 182 0.661 -8.050 1.362 1.00 0.00 C ATOM 158 O VAL A 182 0.078 -9.097 1.158 1.00 0.00 O ATOM 159 CB VAL A 182 -0.354 -7.008 -0.708 1.00 0.00 C ATOM 160 CG1 VAL A 182 -1.588 -6.444 -0.002 1.00 0.00 C ATOM 161 CG2 VAL A 182 -0.014 -6.137 -1.919 1.00 0.00 C ATOM 0 H VAL A 182 1.794 -7.999 -1.365 1.00 0.00 H new ATOM 0 HA VAL A 182 0.937 -6.030 0.737 1.00 0.00 H new ATOM 0 HB VAL A 182 -0.562 -8.027 -1.033 1.00 0.00 H new ATOM 0 HG11 VAL A 182 -2.434 -6.448 -0.689 1.00 0.00 H new ATOM 0 HG12 VAL A 182 -1.823 -7.059 0.866 1.00 0.00 H new ATOM 0 HG13 VAL A 182 -1.387 -5.422 0.321 1.00 0.00 H new ATOM 0 HG21 VAL A 182 -0.855 -6.134 -2.613 1.00 0.00 H new ATOM 0 HG22 VAL A 182 0.188 -5.118 -1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 182 0.868 -6.538 -2.419 1.00 0.00 H new ATOM 171 N ILE A 183 1.200 -7.787 2.523 1.00 0.00 N ATOM 172 CA ILE A 183 1.113 -8.776 3.641 1.00 0.00 C ATOM 173 C ILE A 183 -0.341 -9.088 4.000 1.00 0.00 C ATOM 174 O ILE A 183 -0.674 -10.203 4.351 1.00 0.00 O ATOM 175 CB ILE A 183 1.817 -8.103 4.820 1.00 0.00 C ATOM 176 CG1 ILE A 183 3.262 -7.777 4.439 1.00 0.00 C ATOM 177 CG2 ILE A 183 1.819 -9.046 6.023 1.00 0.00 C ATOM 178 CD1 ILE A 183 4.029 -9.072 4.164 1.00 0.00 C ATOM 0 H ILE A 183 1.699 -6.926 2.747 1.00 0.00 H new ATOM 0 HA ILE A 183 1.571 -9.727 3.368 1.00 0.00 H new ATOM 0 HB ILE A 183 1.288 -7.184 5.074 1.00 0.00 H new ATOM 0 HG12 ILE A 183 3.280 -7.138 3.556 1.00 0.00 H new ATOM 0 HG13 ILE A 183 3.744 -7.222 5.244 1.00 0.00 H new ATOM 0 HG21 ILE A 183 2.321 -8.564 6.862 1.00 0.00 H new ATOM 0 HG22 ILE A 183 0.792 -9.282 6.302 1.00 0.00 H new ATOM 0 HG23 ILE A 183 2.345 -9.965 5.764 1.00 0.00 H new ATOM 0 HD11 ILE A 183 5.058 -8.835 3.893 1.00 0.00 H new ATOM 0 HD12 ILE A 183 4.024 -9.695 5.058 1.00 0.00 H new ATOM 0 HD13 ILE A 183 3.553 -9.610 3.344 1.00 0.00 H new ATOM 190 N ASN A 184 -1.207 -8.121 3.926 1.00 0.00 N ATOM 191 CA ASN A 184 -2.632 -8.378 4.277 1.00 0.00 C ATOM 192 C ASN A 184 -3.465 -7.117 4.058 1.00 0.00 C ATOM 193 O ASN A 184 -3.009 -6.153 3.473 1.00 0.00 O ATOM 194 CB ASN A 184 -2.612 -8.750 5.760 1.00 0.00 C ATOM 195 CG ASN A 184 -3.516 -9.961 5.997 1.00 0.00 C ATOM 196 OD1 ASN A 184 -4.537 -9.854 6.647 1.00 0.00 O ATOM 197 ND2 ASN A 184 -3.183 -11.118 5.494 1.00 0.00 N ATOM 0 H ASN A 184 -0.993 -7.166 3.639 1.00 0.00 H new ATOM 0 HA ASN A 184 -3.073 -9.163 3.663 1.00 0.00 H new ATOM 0 HB2 ASN A 184 -1.593 -8.977 6.075 1.00 0.00 H new ATOM 0 HB3 ASN A 184 -2.951 -7.907 6.362 1.00 0.00 H new ATOM 0 HD21 ASN A 184 -3.780 -11.931 5.647 1.00 0.00 H new ATOM 0 HD22 ASN A 184 -2.326 -11.209 4.948 1.00 0.00 H new ATOM 204 N HIS A 185 -4.683 -7.110 4.526 1.00 0.00 N ATOM 205 CA HIS A 185 -5.537 -5.905 4.347 1.00 0.00 C ATOM 206 C HIS A 185 -6.776 -5.991 5.243 1.00 0.00 C ATOM 207 O HIS A 185 -6.973 -6.953 5.957 1.00 0.00 O ATOM 208 CB HIS A 185 -5.930 -5.911 2.864 1.00 0.00 C ATOM 209 CG HIS A 185 -7.087 -6.853 2.636 1.00 0.00 C ATOM 210 ND1 HIS A 185 -6.910 -8.211 2.437 1.00 0.00 N ATOM 211 CD2 HIS A 185 -8.441 -6.641 2.574 1.00 0.00 C ATOM 212 CE1 HIS A 185 -8.125 -8.760 2.264 1.00 0.00 C ATOM 213 NE2 HIS A 185 -9.096 -7.845 2.338 1.00 0.00 N ATOM 0 H HIS A 185 -5.122 -7.885 5.023 1.00 0.00 H new ATOM 0 HA HIS A 185 -5.019 -4.987 4.623 1.00 0.00 H new ATOM 0 HB2 HIS A 185 -6.204 -4.904 2.549 1.00 0.00 H new ATOM 0 HB3 HIS A 185 -5.078 -6.215 2.256 1.00 0.00 H new ATOM 0 HD2 HIS A 185 -8.926 -5.683 2.691 1.00 0.00 H new ATOM 0 HE1 HIS A 185 -8.295 -9.812 2.087 1.00 0.00 H new ATOM 0 HE2 HIS A 185 -10.100 -7.997 2.242 1.00 0.00 H new ATOM 221 N ARG A 186 -7.611 -4.991 5.203 1.00 0.00 N ATOM 222 CA ARG A 186 -8.844 -5.004 6.044 1.00 0.00 C ATOM 223 C ARG A 186 -9.522 -3.634 5.994 1.00 0.00 C ATOM 224 O ARG A 186 -9.003 -2.695 5.426 1.00 0.00 O ATOM 225 CB ARG A 186 -8.369 -5.314 7.467 1.00 0.00 C ATOM 226 CG ARG A 186 -7.089 -4.533 7.769 1.00 0.00 C ATOM 227 CD ARG A 186 -7.252 -3.781 9.093 1.00 0.00 C ATOM 228 NE ARG A 186 -7.160 -4.830 10.144 1.00 0.00 N ATOM 229 CZ ARG A 186 -5.993 -5.229 10.568 1.00 0.00 C ATOM 230 NH1 ARG A 186 -5.060 -4.354 10.829 1.00 0.00 N ATOM 231 NH2 ARG A 186 -5.757 -6.502 10.731 1.00 0.00 N ATOM 0 H ARG A 186 -7.494 -4.161 4.622 1.00 0.00 H new ATOM 0 HA ARG A 186 -9.569 -5.739 5.696 1.00 0.00 H new ATOM 0 HB2 ARG A 186 -9.145 -5.049 8.185 1.00 0.00 H new ATOM 0 HB3 ARG A 186 -8.187 -6.383 7.574 1.00 0.00 H new ATOM 0 HG2 ARG A 186 -6.240 -5.214 7.827 1.00 0.00 H new ATOM 0 HG3 ARG A 186 -6.880 -3.830 6.962 1.00 0.00 H new ATOM 0 HD2 ARG A 186 -6.474 -3.028 9.218 1.00 0.00 H new ATOM 0 HD3 ARG A 186 -8.209 -3.261 9.137 1.00 0.00 H new ATOM 0 HE ARG A 186 -8.010 -5.237 10.533 1.00 0.00 H new ATOM 0 HH11 ARG A 186 -5.244 -3.359 10.701 1.00 0.00 H new ATOM 0 HH12 ARG A 186 -4.147 -4.665 11.161 1.00 0.00 H new ATOM 0 HH21 ARG A 186 -6.486 -7.186 10.527 1.00 0.00 H new ATOM 0 HH22 ARG A 186 -4.844 -6.813 11.063 1.00 0.00 H new ATOM 612 N ASN A 210 -13.373 1.326 0.422 1.00 0.00 N ATOM 613 CA ASN A 210 -13.410 1.255 1.912 1.00 0.00 C ATOM 614 C ASN A 210 -12.524 0.114 2.418 1.00 0.00 C ATOM 615 O ASN A 210 -12.993 -0.810 3.053 1.00 0.00 O ATOM 616 CB ASN A 210 -14.876 0.986 2.253 1.00 0.00 C ATOM 617 CG ASN A 210 -15.632 2.311 2.337 1.00 0.00 C ATOM 618 OD1 ASN A 210 -16.336 2.681 1.418 1.00 0.00 O ATOM 619 ND2 ASN A 210 -15.516 3.047 3.407 1.00 0.00 N ATOM 0 HA ASN A 210 -13.039 2.168 2.377 1.00 0.00 H new ATOM 0 HB2 ASN A 210 -15.325 0.346 1.493 1.00 0.00 H new ATOM 0 HB3 ASN A 210 -14.948 0.454 3.201 1.00 0.00 H new ATOM 0 HD21 ASN A 210 -16.016 3.933 3.473 1.00 0.00 H new ATOM 0 HD22 ASN A 210 -14.925 2.736 4.178 1.00 0.00 H new ATOM 626 N TYR A 211 -11.248 0.164 2.142 1.00 0.00 N ATOM 627 CA TYR A 211 -10.349 -0.930 2.613 1.00 0.00 C ATOM 628 C TYR A 211 -8.879 -0.503 2.578 1.00 0.00 C ATOM 629 O TYR A 211 -8.423 0.120 1.640 1.00 0.00 O ATOM 630 CB TYR A 211 -10.571 -2.065 1.624 1.00 0.00 C ATOM 631 CG TYR A 211 -11.343 -3.179 2.284 1.00 0.00 C ATOM 632 CD1 TYR A 211 -10.669 -4.128 3.058 1.00 0.00 C ATOM 633 CD2 TYR A 211 -12.728 -3.270 2.112 1.00 0.00 C ATOM 634 CE1 TYR A 211 -11.378 -5.171 3.663 1.00 0.00 C ATOM 635 CE2 TYR A 211 -13.441 -4.312 2.719 1.00 0.00 C ATOM 636 CZ TYR A 211 -12.765 -5.264 3.494 1.00 0.00 C ATOM 637 OH TYR A 211 -13.466 -6.293 4.089 1.00 0.00 O ATOM 0 H TYR A 211 -10.792 0.909 1.615 1.00 0.00 H new ATOM 0 HA TYR A 211 -10.570 -1.208 3.644 1.00 0.00 H new ATOM 0 HB2 TYR A 211 -11.116 -1.699 0.754 1.00 0.00 H new ATOM 0 HB3 TYR A 211 -9.612 -2.439 1.265 1.00 0.00 H new ATOM 0 HD1 TYR A 211 -9.599 -4.056 3.189 1.00 0.00 H new ATOM 0 HD2 TYR A 211 -13.247 -2.538 1.512 1.00 0.00 H new ATOM 0 HE1 TYR A 211 -10.856 -5.904 4.260 1.00 0.00 H new ATOM 0 HE2 TYR A 211 -14.511 -4.382 2.590 1.00 0.00 H new ATOM 0 HH TYR A 211 -14.418 -6.209 3.872 1.00 0.00 H new ATOM 647 N GLU A 212 -8.126 -0.868 3.581 1.00 0.00 N ATOM 648 CA GLU A 212 -6.675 -0.523 3.596 1.00 0.00 C ATOM 649 C GLU A 212 -5.868 -1.785 3.272 1.00 0.00 C ATOM 650 O GLU A 212 -6.429 -2.843 3.063 1.00 0.00 O ATOM 651 CB GLU A 212 -6.387 -0.030 5.018 1.00 0.00 C ATOM 652 CG GLU A 212 -6.345 -1.218 5.981 1.00 0.00 C ATOM 653 CD GLU A 212 -5.840 -0.747 7.347 1.00 0.00 C ATOM 654 OE1 GLU A 212 -4.849 -0.038 7.378 1.00 0.00 O ATOM 655 OE2 GLU A 212 -6.455 -1.104 8.338 1.00 0.00 O ATOM 0 H GLU A 212 -8.454 -1.392 4.393 1.00 0.00 H new ATOM 0 HA GLU A 212 -6.407 0.238 2.863 1.00 0.00 H new ATOM 0 HB2 GLU A 212 -5.437 0.503 5.042 1.00 0.00 H new ATOM 0 HB3 GLU A 212 -7.156 0.676 5.331 1.00 0.00 H new ATOM 0 HG2 GLU A 212 -7.338 -1.656 6.079 1.00 0.00 H new ATOM 0 HG3 GLU A 212 -5.691 -1.996 5.588 1.00 0.00 H new ATOM 662 N PHE A 213 -4.568 -1.696 3.214 1.00 0.00 N ATOM 663 CA PHE A 213 -3.769 -2.916 2.884 1.00 0.00 C ATOM 664 C PHE A 213 -2.381 -2.864 3.528 1.00 0.00 C ATOM 665 O PHE A 213 -1.685 -1.871 3.437 1.00 0.00 O ATOM 666 CB PHE A 213 -3.615 -2.889 1.362 1.00 0.00 C ATOM 667 CG PHE A 213 -4.956 -3.063 0.692 1.00 0.00 C ATOM 668 CD1 PHE A 213 -5.758 -1.947 0.426 1.00 0.00 C ATOM 669 CD2 PHE A 213 -5.389 -4.341 0.323 1.00 0.00 C ATOM 670 CE1 PHE A 213 -6.995 -2.111 -0.209 1.00 0.00 C ATOM 671 CE2 PHE A 213 -6.623 -4.505 -0.312 1.00 0.00 C ATOM 672 CZ PHE A 213 -7.426 -3.391 -0.578 1.00 0.00 C ATOM 0 H PHE A 213 -4.028 -0.846 3.378 1.00 0.00 H new ATOM 0 HA PHE A 213 -4.260 -3.817 3.251 1.00 0.00 H new ATOM 0 HB2 PHE A 213 -3.167 -1.945 1.053 1.00 0.00 H new ATOM 0 HB3 PHE A 213 -2.938 -3.682 1.045 1.00 0.00 H new ATOM 0 HD1 PHE A 213 -5.423 -0.960 0.710 1.00 0.00 H new ATOM 0 HD2 PHE A 213 -4.769 -5.201 0.529 1.00 0.00 H new ATOM 0 HE1 PHE A 213 -7.616 -1.251 -0.414 1.00 0.00 H new ATOM 0 HE2 PHE A 213 -6.957 -5.492 -0.597 1.00 0.00 H new ATOM 0 HZ PHE A 213 -8.380 -3.518 -1.069 1.00 0.00 H new ATOM 682 N LEU A 214 -1.948 -3.937 4.139 1.00 0.00 N ATOM 683 CA LEU A 214 -0.580 -3.936 4.731 1.00 0.00 C ATOM 684 C LEU A 214 0.415 -4.026 3.587 1.00 0.00 C ATOM 685 O LEU A 214 0.447 -4.996 2.855 1.00 0.00 O ATOM 686 CB LEU A 214 -0.498 -5.182 5.613 1.00 0.00 C ATOM 687 CG LEU A 214 0.785 -5.167 6.461 1.00 0.00 C ATOM 688 CD1 LEU A 214 1.107 -3.751 6.945 1.00 0.00 C ATOM 689 CD2 LEU A 214 0.588 -6.085 7.668 1.00 0.00 C ATOM 0 H LEU A 214 -2.476 -4.802 4.252 1.00 0.00 H new ATOM 0 HA LEU A 214 -0.366 -3.042 5.317 1.00 0.00 H new ATOM 0 HB2 LEU A 214 -1.370 -5.229 6.265 1.00 0.00 H new ATOM 0 HB3 LEU A 214 -0.517 -6.076 4.990 1.00 0.00 H new ATOM 0 HG LEU A 214 1.617 -5.515 5.849 1.00 0.00 H new ATOM 0 HD11 LEU A 214 2.019 -3.769 7.542 1.00 0.00 H new ATOM 0 HD12 LEU A 214 1.249 -3.096 6.085 1.00 0.00 H new ATOM 0 HD13 LEU A 214 0.283 -3.378 7.553 1.00 0.00 H new ATOM 0 HD21 LEU A 214 1.491 -6.083 8.278 1.00 0.00 H new ATOM 0 HD22 LEU A 214 -0.252 -5.728 8.263 1.00 0.00 H new ATOM 0 HD23 LEU A 214 0.384 -7.099 7.324 1.00 0.00 H new ATOM 701 N ILE A 215 1.193 -3.012 3.393 1.00 0.00 N ATOM 702 CA ILE A 215 2.140 -3.038 2.256 1.00 0.00 C ATOM 703 C ILE A 215 3.569 -3.369 2.687 1.00 0.00 C ATOM 704 O ILE A 215 4.257 -2.548 3.259 1.00 0.00 O ATOM 705 CB ILE A 215 2.099 -1.625 1.700 1.00 0.00 C ATOM 706 CG1 ILE A 215 0.648 -1.157 1.540 1.00 0.00 C ATOM 707 CG2 ILE A 215 2.803 -1.611 0.353 1.00 0.00 C ATOM 708 CD1 ILE A 215 -0.174 -2.240 0.847 1.00 0.00 C ATOM 0 H ILE A 215 1.217 -2.169 3.967 1.00 0.00 H new ATOM 0 HA ILE A 215 1.858 -3.807 1.537 1.00 0.00 H new ATOM 0 HB ILE A 215 2.602 -0.946 2.389 1.00 0.00 H new ATOM 0 HG12 ILE A 215 0.220 -0.932 2.517 1.00 0.00 H new ATOM 0 HG13 ILE A 215 0.616 -0.236 0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 215 2.781 -0.602 -0.058 1.00 0.00 H new ATOM 0 HG22 ILE A 215 3.838 -1.929 0.480 1.00 0.00 H new ATOM 0 HG23 ILE A 215 2.295 -2.292 -0.330 1.00 0.00 H new ATOM 0 HD11 ILE A 215 -1.204 -1.900 0.737 1.00 0.00 H new ATOM 0 HD12 ILE A 215 0.248 -2.444 -0.137 1.00 0.00 H new ATOM 0 HD13 ILE A 215 -0.154 -3.151 1.446 1.00 0.00 H new ATOM 720 N LYS A 216 4.042 -4.544 2.374 1.00 0.00 N ATOM 721 CA LYS A 216 5.453 -4.876 2.724 1.00 0.00 C ATOM 722 C LYS A 216 6.379 -4.115 1.767 1.00 0.00 C ATOM 723 O LYS A 216 6.599 -4.531 0.647 1.00 0.00 O ATOM 724 CB LYS A 216 5.604 -6.387 2.520 1.00 0.00 C ATOM 725 CG LYS A 216 7.088 -6.758 2.565 1.00 0.00 C ATOM 726 CD LYS A 216 7.246 -8.268 2.378 1.00 0.00 C ATOM 727 CE LYS A 216 7.871 -8.876 3.636 1.00 0.00 C ATOM 728 NZ LYS A 216 9.214 -9.352 3.204 1.00 0.00 N ATOM 0 H LYS A 216 3.521 -5.280 1.897 1.00 0.00 H new ATOM 0 HA LYS A 216 5.705 -4.600 3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 216 5.059 -6.926 3.295 1.00 0.00 H new ATOM 0 HB3 LYS A 216 5.173 -6.681 1.563 1.00 0.00 H new ATOM 0 HG2 LYS A 216 7.630 -6.226 1.783 1.00 0.00 H new ATOM 0 HG3 LYS A 216 7.521 -6.452 3.517 1.00 0.00 H new ATOM 0 HD2 LYS A 216 6.275 -8.725 2.184 1.00 0.00 H new ATOM 0 HD3 LYS A 216 7.874 -8.474 1.511 1.00 0.00 H new ATOM 0 HE2 LYS A 216 7.951 -8.138 4.434 1.00 0.00 H new ATOM 0 HE3 LYS A 216 7.266 -9.697 4.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 216 9.706 -9.783 4.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 216 9.105 -10.058 2.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 216 9.770 -8.548 2.849 1.00 0.00 H new ATOM 742 N TRP A 217 6.907 -2.996 2.180 1.00 0.00 N ATOM 743 CA TRP A 217 7.801 -2.222 1.269 1.00 0.00 C ATOM 744 C TRP A 217 9.225 -2.783 1.326 1.00 0.00 C ATOM 745 O TRP A 217 9.630 -3.371 2.309 1.00 0.00 O ATOM 746 CB TRP A 217 7.778 -0.787 1.796 1.00 0.00 C ATOM 747 CG TRP A 217 6.369 -0.291 1.872 1.00 0.00 C ATOM 748 CD1 TRP A 217 5.577 -0.375 2.965 1.00 0.00 C ATOM 749 CD2 TRP A 217 5.571 0.363 0.839 1.00 0.00 C ATOM 750 NE1 TRP A 217 4.353 0.198 2.678 1.00 0.00 N ATOM 751 CE2 TRP A 217 4.294 0.659 1.378 1.00 0.00 C ATOM 752 CE3 TRP A 217 5.825 0.726 -0.498 1.00 0.00 C ATOM 753 CZ2 TRP A 217 3.305 1.291 0.617 1.00 0.00 C ATOM 754 CZ3 TRP A 217 4.832 1.360 -1.264 1.00 0.00 C ATOM 755 CH2 TRP A 217 3.576 1.642 -0.707 1.00 0.00 C ATOM 0 H TRP A 217 6.761 -2.585 3.102 1.00 0.00 H new ATOM 0 HA TRP A 217 7.471 -2.278 0.232 1.00 0.00 H new ATOM 0 HB2 TRP A 217 8.240 -0.746 2.782 1.00 0.00 H new ATOM 0 HB3 TRP A 217 8.364 -0.142 1.142 1.00 0.00 H new ATOM 0 HD1 TRP A 217 5.856 -0.818 3.909 1.00 0.00 H new ATOM 0 HE1 TRP A 217 3.586 0.272 3.346 1.00 0.00 H new ATOM 0 HE3 TRP A 217 6.789 0.516 -0.937 1.00 0.00 H new ATOM 0 HZ2 TRP A 217 2.339 1.506 1.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 217 5.037 1.632 -2.289 1.00 0.00 H new ATOM 0 HH2 TRP A 217 2.819 2.131 -1.302 1.00 0.00 H new ATOM 871 N ASN A 225 7.156 -3.236 6.814 1.00 0.00 N ATOM 872 CA ASN A 225 5.737 -3.303 6.355 1.00 0.00 C ATOM 873 C ASN A 225 4.908 -2.201 7.014 1.00 0.00 C ATOM 874 O ASN A 225 5.199 -1.754 8.105 1.00 0.00 O ATOM 875 CB ASN A 225 5.247 -4.682 6.798 1.00 0.00 C ATOM 876 CG ASN A 225 6.262 -5.746 6.374 1.00 0.00 C ATOM 877 OD1 ASN A 225 7.002 -5.554 5.430 1.00 0.00 O ATOM 878 ND2 ASN A 225 6.328 -6.869 7.037 1.00 0.00 N ATOM 0 HA ASN A 225 5.645 -3.161 5.278 1.00 0.00 H new ATOM 0 HB2 ASN A 225 5.114 -4.702 7.880 1.00 0.00 H new ATOM 0 HB3 ASN A 225 4.275 -4.894 6.353 1.00 0.00 H new ATOM 0 HD21 ASN A 225 7.001 -7.585 6.762 1.00 0.00 H new ATOM 0 HD22 ASN A 225 5.707 -7.030 7.830 1.00 0.00 H new ATOM 885 N THR A 226 3.872 -1.767 6.356 1.00 0.00 N ATOM 886 CA THR A 226 3.009 -0.700 6.929 1.00 0.00 C ATOM 887 C THR A 226 1.607 -0.806 6.333 1.00 0.00 C ATOM 888 O THR A 226 1.406 -1.428 5.307 1.00 0.00 O ATOM 889 CB THR A 226 3.673 0.616 6.524 1.00 0.00 C ATOM 890 OG1 THR A 226 4.077 0.542 5.162 1.00 0.00 O ATOM 891 CG2 THR A 226 4.893 0.869 7.413 1.00 0.00 C ATOM 0 H THR A 226 3.584 -2.108 5.439 1.00 0.00 H new ATOM 0 HA THR A 226 2.908 -0.777 8.012 1.00 0.00 H new ATOM 0 HB THR A 226 2.964 1.435 6.646 1.00 0.00 H new ATOM 0 HG1 THR A 226 4.946 0.093 5.103 1.00 0.00 H new ATOM 0 HG21 THR A 226 5.366 1.807 7.124 1.00 0.00 H new ATOM 0 HG22 THR A 226 4.578 0.928 8.455 1.00 0.00 H new ATOM 0 HG23 THR A 226 5.605 0.052 7.295 1.00 0.00 H new ATOM 899 N TRP A 227 0.632 -0.218 6.963 1.00 0.00 N ATOM 900 CA TRP A 227 -0.751 -0.306 6.421 1.00 0.00 C ATOM 901 C TRP A 227 -1.110 0.966 5.656 1.00 0.00 C ATOM 902 O TRP A 227 -1.480 1.970 6.230 1.00 0.00 O ATOM 903 CB TRP A 227 -1.640 -0.489 7.649 1.00 0.00 C ATOM 904 CG TRP A 227 -1.561 -1.918 8.071 1.00 0.00 C ATOM 905 CD1 TRP A 227 -0.577 -2.452 8.834 1.00 0.00 C ATOM 906 CD2 TRP A 227 -2.468 -3.011 7.750 1.00 0.00 C ATOM 907 NE1 TRP A 227 -0.825 -3.802 9.000 1.00 0.00 N ATOM 908 CE2 TRP A 227 -1.982 -4.192 8.354 1.00 0.00 C ATOM 909 CE3 TRP A 227 -3.658 -3.090 7.002 1.00 0.00 C ATOM 910 CZ2 TRP A 227 -2.646 -5.408 8.218 1.00 0.00 C ATOM 911 CZ3 TRP A 227 -4.330 -4.316 6.866 1.00 0.00 C ATOM 912 CH2 TRP A 227 -3.821 -5.472 7.474 1.00 0.00 C ATOM 0 H TRP A 227 0.731 0.317 7.826 1.00 0.00 H new ATOM 0 HA TRP A 227 -0.870 -1.126 5.712 1.00 0.00 H new ATOM 0 HB2 TRP A 227 -1.312 0.165 8.457 1.00 0.00 H new ATOM 0 HB3 TRP A 227 -2.670 -0.217 7.417 1.00 0.00 H new ATOM 0 HD1 TRP A 227 0.263 -1.912 9.245 1.00 0.00 H new ATOM 0 HE1 TRP A 227 -0.227 -4.433 9.534 1.00 0.00 H new ATOM 0 HE3 TRP A 227 -4.056 -2.204 6.530 1.00 0.00 H new ATOM 0 HZ2 TRP A 227 -2.252 -6.297 8.687 1.00 0.00 H new ATOM 0 HZ3 TRP A 227 -5.243 -4.368 6.291 1.00 0.00 H new ATOM 0 HH2 TRP A 227 -4.341 -6.413 7.365 1.00 0.00 H new ATOM 923 N GLU A 228 -0.997 0.923 4.356 1.00 0.00 N ATOM 924 CA GLU A 228 -1.325 2.120 3.537 1.00 0.00 C ATOM 925 C GLU A 228 -2.690 1.947 2.869 1.00 0.00 C ATOM 926 O GLU A 228 -3.418 1.016 3.149 1.00 0.00 O ATOM 927 CB GLU A 228 -0.221 2.198 2.483 1.00 0.00 C ATOM 928 CG GLU A 228 1.119 2.474 3.168 1.00 0.00 C ATOM 929 CD GLU A 228 0.980 3.680 4.099 1.00 0.00 C ATOM 930 OE1 GLU A 228 0.195 4.560 3.785 1.00 0.00 O ATOM 931 OE2 GLU A 228 1.662 3.703 5.111 1.00 0.00 O ATOM 0 H GLU A 228 -0.691 0.107 3.826 1.00 0.00 H new ATOM 0 HA GLU A 228 -1.378 3.027 4.139 1.00 0.00 H new ATOM 0 HB2 GLU A 228 -0.170 1.264 1.924 1.00 0.00 H new ATOM 0 HB3 GLU A 228 -0.444 2.987 1.765 1.00 0.00 H new ATOM 0 HG2 GLU A 228 1.436 1.599 3.735 1.00 0.00 H new ATOM 0 HG3 GLU A 228 1.889 2.666 2.420 1.00 0.00 H new ATOM 938 N THR A 229 -3.037 2.837 1.985 1.00 0.00 N ATOM 939 CA THR A 229 -4.345 2.733 1.289 1.00 0.00 C ATOM 940 C THR A 229 -4.164 3.127 -0.171 1.00 0.00 C ATOM 941 O THR A 229 -3.235 3.828 -0.519 1.00 0.00 O ATOM 942 CB THR A 229 -5.262 3.720 2.012 1.00 0.00 C ATOM 943 OG1 THR A 229 -4.489 4.802 2.511 1.00 0.00 O ATOM 944 CG2 THR A 229 -5.957 3.010 3.172 1.00 0.00 C ATOM 0 H THR A 229 -2.466 3.637 1.713 1.00 0.00 H new ATOM 0 HA THR A 229 -4.759 1.725 1.307 1.00 0.00 H new ATOM 0 HB THR A 229 -6.012 4.099 1.318 1.00 0.00 H new ATOM 0 HG1 THR A 229 -5.075 5.437 2.973 1.00 0.00 H new ATOM 0 HG21 THR A 229 -6.611 3.712 3.689 1.00 0.00 H new ATOM 0 HG22 THR A 229 -6.548 2.179 2.788 1.00 0.00 H new ATOM 0 HG23 THR A 229 -5.208 2.632 3.868 1.00 0.00 H new ATOM 952 N TYR A 230 -5.024 2.680 -1.034 1.00 0.00 N ATOM 953 CA TYR A 230 -4.867 3.033 -2.470 1.00 0.00 C ATOM 954 C TYR A 230 -4.545 4.520 -2.619 1.00 0.00 C ATOM 955 O TYR A 230 -3.747 4.914 -3.447 1.00 0.00 O ATOM 956 CB TYR A 230 -6.219 2.721 -3.114 1.00 0.00 C ATOM 957 CG TYR A 230 -6.235 1.299 -3.614 1.00 0.00 C ATOM 958 CD1 TYR A 230 -5.726 0.271 -2.815 1.00 0.00 C ATOM 959 CD2 TYR A 230 -6.767 1.010 -4.876 1.00 0.00 C ATOM 960 CE1 TYR A 230 -5.749 -1.050 -3.278 1.00 0.00 C ATOM 961 CE2 TYR A 230 -6.790 -0.309 -5.339 1.00 0.00 C ATOM 962 CZ TYR A 230 -6.282 -1.340 -4.541 1.00 0.00 C ATOM 963 OH TYR A 230 -6.305 -2.641 -4.999 1.00 0.00 O ATOM 0 H TYR A 230 -5.825 2.089 -0.812 1.00 0.00 H new ATOM 0 HA TYR A 230 -4.053 2.478 -2.937 1.00 0.00 H new ATOM 0 HB2 TYR A 230 -7.019 2.870 -2.389 1.00 0.00 H new ATOM 0 HB3 TYR A 230 -6.405 3.408 -3.940 1.00 0.00 H new ATOM 0 HD1 TYR A 230 -5.315 0.496 -1.842 1.00 0.00 H new ATOM 0 HD2 TYR A 230 -7.160 1.806 -5.492 1.00 0.00 H new ATOM 0 HE1 TYR A 230 -5.356 -1.845 -2.662 1.00 0.00 H new ATOM 0 HE2 TYR A 230 -7.200 -0.532 -6.313 1.00 0.00 H new ATOM 0 HH TYR A 230 -6.709 -2.666 -5.892 1.00 0.00 H new ATOM 973 N GLU A 231 -5.165 5.348 -1.827 1.00 0.00 N ATOM 974 CA GLU A 231 -4.902 6.814 -1.923 1.00 0.00 C ATOM 975 C GLU A 231 -3.454 7.118 -1.535 1.00 0.00 C ATOM 976 O GLU A 231 -2.979 8.226 -1.689 1.00 0.00 O ATOM 977 CB GLU A 231 -5.870 7.458 -0.930 1.00 0.00 C ATOM 978 CG GLU A 231 -6.301 8.829 -1.458 1.00 0.00 C ATOM 979 CD GLU A 231 -5.705 9.933 -0.580 1.00 0.00 C ATOM 980 OE1 GLU A 231 -5.237 9.615 0.501 1.00 0.00 O ATOM 981 OE2 GLU A 231 -5.728 11.076 -1.005 1.00 0.00 O ATOM 0 H GLU A 231 -5.843 5.075 -1.116 1.00 0.00 H new ATOM 0 HA GLU A 231 -5.046 7.193 -2.935 1.00 0.00 H new ATOM 0 HB2 GLU A 231 -6.742 6.820 -0.789 1.00 0.00 H new ATOM 0 HB3 GLU A 231 -5.392 7.565 0.044 1.00 0.00 H new ATOM 0 HG2 GLU A 231 -5.969 8.953 -2.489 1.00 0.00 H new ATOM 0 HG3 GLU A 231 -7.389 8.902 -1.462 1.00 0.00 H new ATOM 988 N SER A 232 -2.747 6.142 -1.034 1.00 0.00 N ATOM 989 CA SER A 232 -1.328 6.379 -0.639 1.00 0.00 C ATOM 990 C SER A 232 -0.409 5.363 -1.325 1.00 0.00 C ATOM 991 O SER A 232 0.788 5.556 -1.416 1.00 0.00 O ATOM 992 CB SER A 232 -1.303 6.193 0.877 1.00 0.00 C ATOM 993 OG SER A 232 -0.409 7.137 1.450 1.00 0.00 O ATOM 0 H SER A 232 -3.089 5.193 -0.881 1.00 0.00 H new ATOM 0 HA SER A 232 -0.977 7.368 -0.932 1.00 0.00 H new ATOM 0 HB2 SER A 232 -2.304 6.326 1.288 1.00 0.00 H new ATOM 0 HB3 SER A 232 -0.989 5.179 1.126 1.00 0.00 H new ATOM 0 HG SER A 232 -0.391 7.022 2.423 1.00 0.00 H new ATOM 999 N ILE A 233 -0.960 4.283 -1.810 1.00 0.00 N ATOM 1000 CA ILE A 233 -0.121 3.255 -2.493 1.00 0.00 C ATOM 1001 C ILE A 233 -0.617 3.066 -3.934 1.00 0.00 C ATOM 1002 O ILE A 233 -0.183 2.178 -4.641 1.00 0.00 O ATOM 1003 CB ILE A 233 -0.252 1.952 -1.652 1.00 0.00 C ATOM 1004 CG1 ILE A 233 -0.523 0.741 -2.555 1.00 0.00 C ATOM 1005 CG2 ILE A 233 -1.384 2.061 -0.624 1.00 0.00 C ATOM 1006 CD1 ILE A 233 -0.858 -0.477 -1.692 1.00 0.00 C ATOM 0 H ILE A 233 -1.956 4.068 -1.763 1.00 0.00 H new ATOM 0 HA ILE A 233 0.927 3.548 -2.557 1.00 0.00 H new ATOM 0 HB ILE A 233 0.695 1.816 -1.130 1.00 0.00 H new ATOM 0 HG12 ILE A 233 -1.349 0.957 -3.233 1.00 0.00 H new ATOM 0 HG13 ILE A 233 0.350 0.533 -3.173 1.00 0.00 H new ATOM 0 HG21 ILE A 233 -1.448 1.134 -0.054 1.00 0.00 H new ATOM 0 HG22 ILE A 233 -1.182 2.891 0.053 1.00 0.00 H new ATOM 0 HG23 ILE A 233 -2.328 2.236 -1.140 1.00 0.00 H new ATOM 0 HD11 ILE A 233 -1.050 -1.336 -2.334 1.00 0.00 H new ATOM 0 HD12 ILE A 233 -0.019 -0.698 -1.032 1.00 0.00 H new ATOM 0 HD13 ILE A 233 -1.744 -0.266 -1.093 1.00 0.00 H new ATOM 1018 N GLY A 234 -1.522 3.896 -4.373 1.00 0.00 N ATOM 1019 CA GLY A 234 -2.041 3.762 -5.762 1.00 0.00 C ATOM 1020 C GLY A 234 -1.173 4.584 -6.717 1.00 0.00 C ATOM 1021 O GLY A 234 -1.664 5.421 -7.448 1.00 0.00 O ATOM 0 H GLY A 234 -1.924 4.660 -3.830 1.00 0.00 H new ATOM 0 HA2 GLY A 234 -2.038 2.714 -6.062 1.00 0.00 H new ATOM 0 HA3 GLY A 234 -3.075 4.104 -5.809 1.00 0.00 H new ATOM 1025 N GLN A 235 0.113 4.352 -6.723 1.00 0.00 N ATOM 1026 CA GLN A 235 1.003 5.125 -7.637 1.00 0.00 C ATOM 1027 C GLN A 235 2.467 4.725 -7.432 1.00 0.00 C ATOM 1028 O GLN A 235 3.361 5.544 -7.513 1.00 0.00 O ATOM 1029 CB GLN A 235 0.788 6.589 -7.250 1.00 0.00 C ATOM 1030 CG GLN A 235 0.865 6.736 -5.728 1.00 0.00 C ATOM 1031 CD GLN A 235 2.076 7.594 -5.359 1.00 0.00 C ATOM 1032 OE1 GLN A 235 2.340 8.597 -5.991 1.00 0.00 O ATOM 1033 NE2 GLN A 235 2.828 7.242 -4.352 1.00 0.00 N ATOM 0 H GLN A 235 0.584 3.663 -6.137 1.00 0.00 H new ATOM 0 HA GLN A 235 0.773 4.938 -8.686 1.00 0.00 H new ATOM 0 HB2 GLN A 235 1.543 7.215 -7.724 1.00 0.00 H new ATOM 0 HB3 GLN A 235 -0.182 6.932 -7.610 1.00 0.00 H new ATOM 0 HG2 GLN A 235 -0.048 7.195 -5.350 1.00 0.00 H new ATOM 0 HG3 GLN A 235 0.945 5.754 -5.261 1.00 0.00 H new ATOM 0 HE21 GLN A 235 2.607 6.400 -3.821 1.00 0.00 H new ATOM 0 HE22 GLN A 235 3.636 7.809 -4.096 1.00 0.00 H new ATOM 1042 N VAL A 236 2.717 3.473 -7.168 1.00 0.00 N ATOM 1043 CA VAL A 236 4.123 3.015 -6.956 1.00 0.00 C ATOM 1044 C VAL A 236 4.211 1.505 -7.183 1.00 0.00 C ATOM 1045 O VAL A 236 4.818 0.788 -6.412 1.00 0.00 O ATOM 1046 CB VAL A 236 4.428 3.348 -5.495 1.00 0.00 C ATOM 1047 CG1 VAL A 236 4.510 4.865 -5.319 1.00 0.00 C ATOM 1048 CG2 VAL A 236 3.311 2.791 -4.606 1.00 0.00 C ATOM 0 H VAL A 236 2.008 2.744 -7.089 1.00 0.00 H new ATOM 0 HA VAL A 236 4.826 3.491 -7.640 1.00 0.00 H new ATOM 0 HB VAL A 236 5.381 2.901 -5.212 1.00 0.00 H new ATOM 0 HG11 VAL A 236 4.727 5.099 -4.277 1.00 0.00 H new ATOM 0 HG12 VAL A 236 5.302 5.263 -5.953 1.00 0.00 H new ATOM 0 HG13 VAL A 236 3.559 5.316 -5.601 1.00 0.00 H new ATOM 0 HG21 VAL A 236 3.524 3.026 -3.563 1.00 0.00 H new ATOM 0 HG22 VAL A 236 2.360 3.240 -4.892 1.00 0.00 H new ATOM 0 HG23 VAL A 236 3.253 1.710 -4.729 1.00 0.00 H new ATOM 1058 N ARG A 237 3.585 1.011 -8.219 1.00 0.00 N ATOM 1059 CA ARG A 237 3.606 -0.461 -8.479 1.00 0.00 C ATOM 1060 C ARG A 237 2.754 -1.180 -7.425 1.00 0.00 C ATOM 1061 O ARG A 237 2.630 -2.394 -7.422 1.00 0.00 O ATOM 1062 CB ARG A 237 5.077 -0.877 -8.360 1.00 0.00 C ATOM 1063 CG ARG A 237 5.307 -2.181 -9.126 1.00 0.00 C ATOM 1064 CD ARG A 237 5.956 -3.210 -8.197 1.00 0.00 C ATOM 1065 NE ARG A 237 6.594 -4.201 -9.107 1.00 0.00 N ATOM 1066 CZ ARG A 237 7.873 -4.125 -9.358 1.00 0.00 C ATOM 1067 NH1 ARG A 237 8.302 -3.387 -10.345 1.00 0.00 N ATOM 1068 NH2 ARG A 237 8.722 -4.788 -8.622 1.00 0.00 N ATOM 0 H ARG A 237 3.060 1.563 -8.897 1.00 0.00 H new ATOM 0 HA ARG A 237 3.199 -0.716 -9.458 1.00 0.00 H new ATOM 0 HB2 ARG A 237 5.720 -0.092 -8.758 1.00 0.00 H new ATOM 0 HB3 ARG A 237 5.344 -1.008 -7.311 1.00 0.00 H new ATOM 0 HG2 ARG A 237 4.360 -2.564 -9.506 1.00 0.00 H new ATOM 0 HG3 ARG A 237 5.947 -2.000 -9.990 1.00 0.00 H new ATOM 0 HD2 ARG A 237 6.693 -2.743 -7.543 1.00 0.00 H new ATOM 0 HD3 ARG A 237 5.215 -3.684 -7.554 1.00 0.00 H new ATOM 0 HE ARG A 237 6.033 -4.938 -9.534 1.00 0.00 H new ATOM 0 HH11 ARG A 237 7.638 -2.869 -10.921 1.00 0.00 H new ATOM 0 HH12 ARG A 237 9.301 -3.328 -10.541 1.00 0.00 H new ATOM 0 HH21 ARG A 237 8.386 -5.365 -7.851 1.00 0.00 H new ATOM 0 HH22 ARG A 237 9.721 -4.729 -8.818 1.00 0.00 H new ATOM 1082 N GLY A 238 2.162 -0.433 -6.529 1.00 0.00 N ATOM 1083 CA GLY A 238 1.323 -1.055 -5.477 1.00 0.00 C ATOM 1084 C GLY A 238 0.069 -1.640 -6.109 1.00 0.00 C ATOM 1085 O GLY A 238 -0.152 -2.831 -6.074 1.00 0.00 O ATOM 0 H GLY A 238 2.227 0.584 -6.486 1.00 0.00 H new ATOM 0 HA2 GLY A 238 1.884 -1.837 -4.965 1.00 0.00 H new ATOM 0 HA3 GLY A 238 1.052 -0.313 -4.726 1.00 0.00 H new ATOM 1089 N LEU A 239 -0.754 -0.814 -6.688 1.00 0.00 N ATOM 1090 CA LEU A 239 -1.997 -1.332 -7.321 1.00 0.00 C ATOM 1091 C LEU A 239 -1.704 -2.619 -8.087 1.00 0.00 C ATOM 1092 O LEU A 239 -2.531 -3.498 -8.166 1.00 0.00 O ATOM 1093 CB LEU A 239 -2.452 -0.224 -8.271 1.00 0.00 C ATOM 1094 CG LEU A 239 -3.185 0.856 -7.477 1.00 0.00 C ATOM 1095 CD1 LEU A 239 -3.237 2.145 -8.298 1.00 0.00 C ATOM 1096 CD2 LEU A 239 -4.610 0.389 -7.173 1.00 0.00 C ATOM 0 H LEU A 239 -0.621 0.195 -6.751 1.00 0.00 H new ATOM 0 HA LEU A 239 -2.765 -1.574 -6.586 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -1.592 0.207 -8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -3.108 -0.635 -9.039 1.00 0.00 H new ATOM 0 HG LEU A 239 -2.656 1.040 -6.542 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -3.760 2.916 -7.732 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -2.222 2.479 -8.515 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -3.766 1.960 -9.233 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -5.132 1.160 -6.607 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -5.139 0.204 -8.108 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -4.575 -0.530 -6.588 1.00 0.00 H new ATOM 1108 N LYS A 240 -0.533 -2.748 -8.646 1.00 0.00 N ATOM 1109 CA LYS A 240 -0.214 -3.998 -9.390 1.00 0.00 C ATOM 1110 C LYS A 240 -0.171 -5.177 -8.418 1.00 0.00 C ATOM 1111 O LYS A 240 -0.944 -6.108 -8.529 1.00 0.00 O ATOM 1112 CB LYS A 240 1.159 -3.765 -10.013 1.00 0.00 C ATOM 1113 CG LYS A 240 1.259 -4.552 -11.321 1.00 0.00 C ATOM 1114 CD LYS A 240 2.238 -5.716 -11.146 1.00 0.00 C ATOM 1115 CE LYS A 240 3.674 -5.196 -11.242 1.00 0.00 C ATOM 1116 NZ LYS A 240 4.526 -6.340 -10.813 1.00 0.00 N ATOM 0 H LYS A 240 0.210 -2.050 -8.621 1.00 0.00 H new ATOM 0 HA LYS A 240 -0.960 -4.229 -10.150 1.00 0.00 H new ATOM 0 HB2 LYS A 240 1.310 -2.702 -10.202 1.00 0.00 H new ATOM 0 HB3 LYS A 240 1.942 -4.081 -9.324 1.00 0.00 H new ATOM 0 HG2 LYS A 240 0.277 -4.929 -11.606 1.00 0.00 H new ATOM 0 HG3 LYS A 240 1.595 -3.898 -12.126 1.00 0.00 H new ATOM 0 HD2 LYS A 240 2.078 -6.197 -10.181 1.00 0.00 H new ATOM 0 HD3 LYS A 240 2.062 -6.471 -11.912 1.00 0.00 H new ATOM 0 HE2 LYS A 240 3.914 -4.884 -12.258 1.00 0.00 H new ATOM 0 HE3 LYS A 240 3.824 -4.329 -10.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 240 5.451 -6.280 -11.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 240 4.660 -6.306 -9.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 240 4.063 -7.234 -11.072 1.00 0.00 H new ATOM 1130 N ARG A 241 0.711 -5.142 -7.455 1.00 0.00 N ATOM 1131 CA ARG A 241 0.763 -6.268 -6.478 1.00 0.00 C ATOM 1132 C ARG A 241 -0.474 -6.196 -5.584 1.00 0.00 C ATOM 1133 O ARG A 241 -0.956 -7.191 -5.081 1.00 0.00 O ATOM 1134 CB ARG A 241 2.039 -6.052 -5.665 1.00 0.00 C ATOM 1135 CG ARG A 241 3.197 -5.734 -6.613 1.00 0.00 C ATOM 1136 CD ARG A 241 4.454 -6.471 -6.147 1.00 0.00 C ATOM 1137 NE ARG A 241 5.322 -6.544 -7.355 1.00 0.00 N ATOM 1138 CZ ARG A 241 5.638 -7.704 -7.862 1.00 0.00 C ATOM 1139 NH1 ARG A 241 4.717 -8.449 -8.408 1.00 0.00 N ATOM 1140 NH2 ARG A 241 6.875 -8.119 -7.820 1.00 0.00 N ATOM 0 H ARG A 241 1.388 -4.395 -7.303 1.00 0.00 H new ATOM 0 HA ARG A 241 0.773 -7.247 -6.957 1.00 0.00 H new ATOM 0 HB2 ARG A 241 1.899 -5.235 -4.957 1.00 0.00 H new ATOM 0 HB3 ARG A 241 2.267 -6.944 -5.081 1.00 0.00 H new ATOM 0 HG2 ARG A 241 2.942 -6.034 -7.629 1.00 0.00 H new ATOM 0 HG3 ARG A 241 3.379 -4.660 -6.634 1.00 0.00 H new ATOM 0 HD2 ARG A 241 4.949 -5.936 -5.336 1.00 0.00 H new ATOM 0 HD3 ARG A 241 4.213 -7.466 -5.772 1.00 0.00 H new ATOM 0 HE ARG A 241 5.669 -5.687 -7.786 1.00 0.00 H new ATOM 0 HH11 ARG A 241 3.750 -8.125 -8.438 1.00 0.00 H new ATOM 0 HH12 ARG A 241 4.963 -9.356 -8.805 1.00 0.00 H new ATOM 0 HH21 ARG A 241 7.594 -7.537 -7.391 1.00 0.00 H new ATOM 0 HH22 ARG A 241 7.122 -9.026 -8.216 1.00 0.00 H new ATOM 1154 N LEU A 242 -1.002 -5.015 -5.413 1.00 0.00 N ATOM 1155 CA LEU A 242 -2.226 -4.849 -4.586 1.00 0.00 C ATOM 1156 C LEU A 242 -3.414 -5.394 -5.371 1.00 0.00 C ATOM 1157 O LEU A 242 -4.343 -5.948 -4.819 1.00 0.00 O ATOM 1158 CB LEU A 242 -2.355 -3.335 -4.394 1.00 0.00 C ATOM 1159 CG LEU A 242 -3.087 -3.026 -3.087 1.00 0.00 C ATOM 1160 CD1 LEU A 242 -4.331 -3.904 -2.977 1.00 0.00 C ATOM 1161 CD2 LEU A 242 -2.162 -3.298 -1.899 1.00 0.00 C ATOM 0 H LEU A 242 -0.634 -4.153 -5.815 1.00 0.00 H new ATOM 0 HA LEU A 242 -2.186 -5.373 -3.631 1.00 0.00 H new ATOM 0 HB2 LEU A 242 -1.366 -2.878 -4.382 1.00 0.00 H new ATOM 0 HB3 LEU A 242 -2.897 -2.900 -5.234 1.00 0.00 H new ATOM 0 HG LEU A 242 -3.382 -1.977 -3.080 1.00 0.00 H new ATOM 0 HD11 LEU A 242 -4.851 -3.683 -2.045 1.00 0.00 H new ATOM 0 HD12 LEU A 242 -4.993 -3.704 -3.819 1.00 0.00 H new ATOM 0 HD13 LEU A 242 -4.038 -4.954 -2.988 1.00 0.00 H new ATOM 0 HD21 LEU A 242 -2.688 -3.076 -0.970 1.00 0.00 H new ATOM 0 HD22 LEU A 242 -1.861 -4.346 -1.905 1.00 0.00 H new ATOM 0 HD23 LEU A 242 -1.277 -2.666 -1.975 1.00 0.00 H new ATOM 1173 N ASP A 243 -3.375 -5.254 -6.669 1.00 0.00 N ATOM 1174 CA ASP A 243 -4.491 -5.783 -7.504 1.00 0.00 C ATOM 1175 C ASP A 243 -4.486 -7.306 -7.429 1.00 0.00 C ATOM 1176 O ASP A 243 -5.482 -7.928 -7.115 1.00 0.00 O ATOM 1177 CB ASP A 243 -4.200 -5.316 -8.932 1.00 0.00 C ATOM 1178 CG ASP A 243 -4.838 -3.944 -9.163 1.00 0.00 C ATOM 1179 OD1 ASP A 243 -5.188 -3.303 -8.186 1.00 0.00 O ATOM 1180 OD2 ASP A 243 -4.967 -3.560 -10.313 1.00 0.00 O ATOM 0 H ASP A 243 -2.622 -4.798 -7.185 1.00 0.00 H new ATOM 0 HA ASP A 243 -5.467 -5.432 -7.169 1.00 0.00 H new ATOM 0 HB2 ASP A 243 -3.124 -5.260 -9.095 1.00 0.00 H new ATOM 0 HB3 ASP A 243 -4.594 -6.037 -9.649 1.00 0.00 H new ATOM 1185 N ASN A 244 -3.362 -7.914 -7.700 1.00 0.00 N ATOM 1186 CA ASN A 244 -3.292 -9.398 -7.627 1.00 0.00 C ATOM 1187 C ASN A 244 -3.519 -9.849 -6.183 1.00 0.00 C ATOM 1188 O ASN A 244 -3.899 -10.975 -5.928 1.00 0.00 O ATOM 1189 CB ASN A 244 -1.878 -9.754 -8.089 1.00 0.00 C ATOM 1190 CG ASN A 244 -1.628 -11.246 -7.859 1.00 0.00 C ATOM 1191 OD1 ASN A 244 -0.503 -11.662 -7.670 1.00 0.00 O ATOM 1192 ND2 ASN A 244 -2.637 -12.073 -7.868 1.00 0.00 N ATOM 0 H ASN A 244 -2.495 -7.448 -7.967 1.00 0.00 H new ATOM 0 HA ASN A 244 -4.048 -9.886 -8.242 1.00 0.00 H new ATOM 0 HB2 ASN A 244 -1.757 -9.512 -9.145 1.00 0.00 H new ATOM 0 HB3 ASN A 244 -1.145 -9.162 -7.541 1.00 0.00 H new ATOM 0 HD21 ASN A 244 -2.481 -13.070 -7.716 1.00 0.00 H new ATOM 0 HD22 ASN A 244 -3.582 -11.723 -8.027 1.00 0.00 H new ATOM 1199 N TYR A 245 -3.308 -8.974 -5.234 1.00 0.00 N ATOM 1200 CA TYR A 245 -3.533 -9.350 -3.817 1.00 0.00 C ATOM 1201 C TYR A 245 -5.028 -9.304 -3.532 1.00 0.00 C ATOM 1202 O TYR A 245 -5.564 -10.109 -2.797 1.00 0.00 O ATOM 1203 CB TYR A 245 -2.805 -8.290 -2.991 1.00 0.00 C ATOM 1204 CG TYR A 245 -3.266 -8.393 -1.560 1.00 0.00 C ATOM 1205 CD1 TYR A 245 -2.607 -9.253 -0.677 1.00 0.00 C ATOM 1206 CD2 TYR A 245 -4.363 -7.641 -1.121 1.00 0.00 C ATOM 1207 CE1 TYR A 245 -3.044 -9.364 0.646 1.00 0.00 C ATOM 1208 CE2 TYR A 245 -4.799 -7.750 0.203 1.00 0.00 C ATOM 1209 CZ TYR A 245 -4.138 -8.613 1.086 1.00 0.00 C ATOM 1210 OH TYR A 245 -4.568 -8.727 2.391 1.00 0.00 O ATOM 0 H TYR A 245 -2.990 -8.017 -5.384 1.00 0.00 H new ATOM 0 HA TYR A 245 -3.171 -10.351 -3.584 1.00 0.00 H new ATOM 0 HB2 TYR A 245 -1.727 -8.438 -3.052 1.00 0.00 H new ATOM 0 HB3 TYR A 245 -3.013 -7.295 -3.385 1.00 0.00 H new ATOM 0 HD1 TYR A 245 -1.761 -9.831 -1.017 1.00 0.00 H new ATOM 0 HD2 TYR A 245 -4.872 -6.977 -1.805 1.00 0.00 H new ATOM 0 HE1 TYR A 245 -2.537 -10.030 1.328 1.00 0.00 H new ATOM 0 HE2 TYR A 245 -5.644 -7.170 0.544 1.00 0.00 H new ATOM 0 HH TYR A 245 -5.534 -8.565 2.433 1.00 0.00 H new ATOM 1220 N CYS A 246 -5.705 -8.360 -4.122 1.00 0.00 N ATOM 1221 CA CYS A 246 -7.165 -8.248 -3.907 1.00 0.00 C ATOM 1222 C CYS A 246 -7.870 -9.397 -4.620 1.00 0.00 C ATOM 1223 O CYS A 246 -8.890 -9.878 -4.181 1.00 0.00 O ATOM 1224 CB CYS A 246 -7.560 -6.909 -4.524 1.00 0.00 C ATOM 1225 SG CYS A 246 -7.433 -5.605 -3.275 1.00 0.00 S ATOM 0 H CYS A 246 -5.304 -7.660 -4.746 1.00 0.00 H new ATOM 0 HA CYS A 246 -7.440 -8.298 -2.853 1.00 0.00 H new ATOM 0 HB2 CYS A 246 -6.911 -6.681 -5.370 1.00 0.00 H new ATOM 0 HB3 CYS A 246 -8.579 -6.960 -4.909 1.00 0.00 H new ATOM 0 HG CYS A 246 -6.589 -5.966 -2.355 1.00 0.00 H new ATOM 1231 N LYS A 247 -7.326 -9.847 -5.715 1.00 0.00 N ATOM 1232 CA LYS A 247 -7.966 -10.973 -6.445 1.00 0.00 C ATOM 1233 C LYS A 247 -7.571 -12.296 -5.787 1.00 0.00 C ATOM 1234 O LYS A 247 -8.265 -13.288 -5.888 1.00 0.00 O ATOM 1235 CB LYS A 247 -7.437 -10.870 -7.885 1.00 0.00 C ATOM 1236 CG LYS A 247 -6.095 -11.600 -8.022 1.00 0.00 C ATOM 1237 CD LYS A 247 -5.704 -11.667 -9.501 1.00 0.00 C ATOM 1238 CE LYS A 247 -6.023 -13.060 -10.051 1.00 0.00 C ATOM 1239 NZ LYS A 247 -6.325 -12.845 -11.494 1.00 0.00 N ATOM 0 H LYS A 247 -6.469 -9.485 -6.134 1.00 0.00 H new ATOM 0 HA LYS A 247 -9.055 -10.930 -6.429 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -8.163 -11.299 -8.576 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -7.317 -9.822 -8.160 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -5.325 -11.079 -7.454 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -6.171 -12.606 -7.608 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -6.246 -10.908 -10.066 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -4.642 -11.453 -9.617 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -5.180 -13.738 -9.921 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -6.872 -13.504 -9.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -6.554 -13.756 -11.940 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -7.136 -12.201 -11.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -5.496 -12.428 -11.964 1.00 0.00 H new ATOM 1253 N GLN A 248 -6.463 -12.306 -5.101 1.00 0.00 N ATOM 1254 CA GLN A 248 -6.019 -13.551 -4.418 1.00 0.00 C ATOM 1255 C GLN A 248 -6.528 -13.552 -2.976 1.00 0.00 C ATOM 1256 O GLN A 248 -6.431 -14.539 -2.273 1.00 0.00 O ATOM 1257 CB GLN A 248 -4.490 -13.495 -4.444 1.00 0.00 C ATOM 1258 CG GLN A 248 -3.928 -14.920 -4.427 1.00 0.00 C ATOM 1259 CD GLN A 248 -2.439 -14.887 -4.778 1.00 0.00 C ATOM 1260 OE1 GLN A 248 -2.002 -15.563 -5.689 1.00 0.00 O ATOM 1261 NE2 GLN A 248 -1.634 -14.125 -4.089 1.00 0.00 N ATOM 0 H GLN A 248 -5.845 -11.503 -4.984 1.00 0.00 H new ATOM 0 HA GLN A 248 -6.399 -14.452 -4.900 1.00 0.00 H new ATOM 0 HB2 GLN A 248 -4.150 -12.969 -5.336 1.00 0.00 H new ATOM 0 HB3 GLN A 248 -4.121 -12.936 -3.584 1.00 0.00 H new ATOM 0 HG2 GLN A 248 -4.070 -15.367 -3.443 1.00 0.00 H new ATOM 0 HG3 GLN A 248 -4.467 -15.543 -5.141 1.00 0.00 H new ATOM 0 HE21 GLN A 248 -1.999 -13.557 -3.324 1.00 0.00 H new ATOM 0 HE22 GLN A 248 -0.640 -14.097 -4.315 1.00 0.00 H new ATOM 1270 N PHE A 249 -7.061 -12.447 -2.527 1.00 0.00 N ATOM 1271 CA PHE A 249 -7.563 -12.382 -1.127 1.00 0.00 C ATOM 1272 C PHE A 249 -8.932 -11.692 -1.054 1.00 0.00 C ATOM 1273 O PHE A 249 -9.634 -11.811 -0.070 1.00 0.00 O ATOM 1274 CB PHE A 249 -6.512 -11.566 -0.377 1.00 0.00 C ATOM 1275 CG PHE A 249 -5.221 -12.344 -0.324 1.00 0.00 C ATOM 1276 CD1 PHE A 249 -5.169 -13.567 0.354 1.00 0.00 C ATOM 1277 CD2 PHE A 249 -4.075 -11.843 -0.954 1.00 0.00 C ATOM 1278 CE1 PHE A 249 -3.972 -14.291 0.403 1.00 0.00 C ATOM 1279 CE2 PHE A 249 -2.878 -12.567 -0.906 1.00 0.00 C ATOM 1280 CZ PHE A 249 -2.826 -13.791 -0.227 1.00 0.00 C ATOM 0 H PHE A 249 -7.170 -11.590 -3.069 1.00 0.00 H new ATOM 0 HA PHE A 249 -7.704 -13.376 -0.702 1.00 0.00 H new ATOM 0 HB2 PHE A 249 -6.353 -10.610 -0.876 1.00 0.00 H new ATOM 0 HB3 PHE A 249 -6.859 -11.345 0.633 1.00 0.00 H new ATOM 0 HD1 PHE A 249 -6.053 -13.953 0.840 1.00 0.00 H new ATOM 0 HD2 PHE A 249 -4.115 -10.899 -1.477 1.00 0.00 H new ATOM 0 HE1 PHE A 249 -3.932 -15.235 0.927 1.00 0.00 H new ATOM 0 HE2 PHE A 249 -1.994 -12.182 -1.393 1.00 0.00 H new ATOM 0 HZ PHE A 249 -1.902 -14.349 -0.189 1.00 0.00 H new ATOM 1290 N ILE A 250 -9.326 -10.970 -2.071 1.00 0.00 N ATOM 1291 CA ILE A 250 -10.652 -10.286 -2.011 1.00 0.00 C ATOM 1292 C ILE A 250 -11.526 -10.698 -3.207 1.00 0.00 C ATOM 1293 O ILE A 250 -12.735 -10.639 -3.146 1.00 0.00 O ATOM 1294 CB ILE A 250 -10.325 -8.783 -2.036 1.00 0.00 C ATOM 1295 CG1 ILE A 250 -10.113 -8.289 -0.606 1.00 0.00 C ATOM 1296 CG2 ILE A 250 -11.476 -7.993 -2.659 1.00 0.00 C ATOM 1297 CD1 ILE A 250 -8.677 -7.786 -0.445 1.00 0.00 C ATOM 0 H ILE A 250 -8.795 -10.825 -2.930 1.00 0.00 H new ATOM 0 HA ILE A 250 -11.220 -10.554 -1.120 1.00 0.00 H new ATOM 0 HB ILE A 250 -9.423 -8.634 -2.630 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -10.817 -7.489 -0.379 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -10.308 -9.095 0.101 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -11.226 -6.932 -2.668 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -11.641 -8.335 -3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -12.382 -8.147 -2.073 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -8.527 -7.434 0.576 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -7.981 -8.599 -0.654 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -8.498 -6.967 -1.141 1.00 0.00 H new ATOM 1309 N ILE A 251 -10.933 -11.113 -4.289 1.00 0.00 N ATOM 1310 CA ILE A 251 -11.751 -11.519 -5.468 1.00 0.00 C ATOM 1311 C ILE A 251 -11.193 -12.809 -6.074 1.00 0.00 C ATOM 1312 O ILE A 251 -10.762 -13.700 -5.370 1.00 0.00 O ATOM 1313 CB ILE A 251 -11.635 -10.362 -6.470 1.00 0.00 C ATOM 1314 CG1 ILE A 251 -11.544 -9.023 -5.728 1.00 0.00 C ATOM 1315 CG2 ILE A 251 -12.872 -10.346 -7.370 1.00 0.00 C ATOM 1316 CD1 ILE A 251 -11.317 -7.896 -6.738 1.00 0.00 C ATOM 0 H ILE A 251 -9.923 -11.189 -4.410 1.00 0.00 H new ATOM 0 HA ILE A 251 -12.789 -11.711 -5.197 1.00 0.00 H new ATOM 0 HB ILE A 251 -10.735 -10.504 -7.068 1.00 0.00 H new ATOM 0 HG12 ILE A 251 -12.460 -8.843 -5.166 1.00 0.00 H new ATOM 0 HG13 ILE A 251 -10.727 -9.049 -5.006 1.00 0.00 H new ATOM 0 HG21 ILE A 251 -12.793 -9.525 -8.083 1.00 0.00 H new ATOM 0 HG22 ILE A 251 -12.941 -11.290 -7.910 1.00 0.00 H new ATOM 0 HG23 ILE A 251 -13.765 -10.211 -6.759 1.00 0.00 H new ATOM 0 HD11 ILE A 251 -11.252 -6.944 -6.212 1.00 0.00 H new ATOM 0 HD12 ILE A 251 -10.389 -8.075 -7.280 1.00 0.00 H new ATOM 0 HD13 ILE A 251 -12.148 -7.866 -7.442 1.00 0.00 H new