USER MOD reduce.3.24.130724 H: found=0, std=0, add=370, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 373 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 NoAdj-H: A 249 HIS HE2 : A 249 HIS NE2 : A 301 ZNZN :(H bumps) USER MOD Single : A 222 THR OG1 : rot -32:sc= 0.124 USER MOD Single : A 224 TYR OH : rot 180:sc= 0 USER MOD Single : A 228 GLN : amide:sc= -0.322 K(o=-0.32,f=-4.8!) USER MOD Single : A 231 SER OG : rot 180:sc= 0.403 USER MOD Single : A 235 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 242 ASN : amide:sc= 0.592 K(o=0.59,f=-5.1!) USER MOD Single : A 244 LYS NZ :NH3+ -174:sc=-0.00551 (180deg=-0.0634) USER MOD Single : A 245 TYR OH : rot 180:sc= 0 USER MOD Single : A 250 TYR OH : rot 130:sc= -0.0999 USER MOD Single : A 254 ASN : amide:sc= -0.469 X(o=-0.47,f=0) USER MOD Single : A 256 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0558) USER MOD Single : A 260 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00209) USER MOD Single : A 262 THR OG1 : rot 41:sc= 0.294 USER MOD Single : A 264 TYR OH : rot 180:sc= 0 USER MOD Single : A 269 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 222 0.266 0.262 -0.981 1.00 0.00 N ATOM 2 CA THR A 222 1.348 0.428 -1.974 1.00 0.00 C ATOM 3 C THR A 222 1.538 -0.880 -2.771 1.00 0.00 C ATOM 4 O THR A 222 2.493 -1.642 -2.550 1.00 0.00 O ATOM 5 CB THR A 222 2.687 0.899 -1.289 1.00 0.00 C ATOM 6 OG1 THR A 222 3.003 0.040 -0.183 1.00 0.00 O ATOM 7 CG2 THR A 222 2.601 2.353 -0.785 1.00 0.00 C ATOM 0 HA THR A 222 1.062 1.213 -2.675 1.00 0.00 H new ATOM 0 HB THR A 222 3.470 0.846 -2.046 1.00 0.00 H new ATOM 0 HG1 THR A 222 2.174 -0.281 0.229 1.00 0.00 H new ATOM 0 HG21 THR A 222 3.546 2.634 -0.321 1.00 0.00 H new ATOM 0 HG22 THR A 222 2.398 3.018 -1.625 1.00 0.00 H new ATOM 0 HG23 THR A 222 1.798 2.437 -0.053 1.00 0.00 H new ATOM 17 N LEU A 223 0.584 -1.145 -3.684 1.00 0.00 N ATOM 18 CA LEU A 223 0.556 -2.358 -4.518 1.00 0.00 C ATOM 19 C LEU A 223 0.850 -1.959 -5.973 1.00 0.00 C ATOM 20 O LEU A 223 -0.035 -1.461 -6.679 1.00 0.00 O ATOM 21 CB LEU A 223 -0.831 -3.059 -4.396 1.00 0.00 C ATOM 22 CG LEU A 223 -0.994 -4.404 -5.173 1.00 0.00 C ATOM 23 CD1 LEU A 223 -0.014 -5.471 -4.645 1.00 0.00 C ATOM 24 CD2 LEU A 223 -2.455 -4.911 -5.133 1.00 0.00 C ATOM 0 H LEU A 223 -0.197 -0.514 -3.864 1.00 0.00 H new ATOM 0 HA LEU A 223 1.314 -3.065 -4.181 1.00 0.00 H new ATOM 0 HB2 LEU A 223 -1.028 -3.247 -3.341 1.00 0.00 H new ATOM 0 HB3 LEU A 223 -1.597 -2.366 -4.745 1.00 0.00 H new ATOM 0 HG LEU A 223 -0.747 -4.213 -6.217 1.00 0.00 H new ATOM 0 HD11 LEU A 223 -0.149 -6.397 -5.204 1.00 0.00 H new ATOM 0 HD12 LEU A 223 1.010 -5.118 -4.770 1.00 0.00 H new ATOM 0 HD13 LEU A 223 -0.209 -5.653 -3.588 1.00 0.00 H new ATOM 0 HD21 LEU A 223 -2.530 -5.849 -5.684 1.00 0.00 H new ATOM 0 HD22 LEU A 223 -2.756 -5.073 -4.098 1.00 0.00 H new ATOM 0 HD23 LEU A 223 -3.110 -4.169 -5.589 1.00 0.00 H new ATOM 36 N TYR A 224 2.119 -2.137 -6.406 1.00 0.00 N ATOM 37 CA TYR A 224 2.593 -1.683 -7.729 1.00 0.00 C ATOM 38 C TYR A 224 3.457 -2.780 -8.356 1.00 0.00 C ATOM 39 O TYR A 224 4.349 -3.310 -7.684 1.00 0.00 O ATOM 40 CB TYR A 224 3.417 -0.364 -7.619 1.00 0.00 C ATOM 41 CG TYR A 224 2.698 0.756 -6.856 1.00 0.00 C ATOM 42 CD1 TYR A 224 1.515 1.322 -7.347 1.00 0.00 C ATOM 43 CD2 TYR A 224 3.171 1.215 -5.626 1.00 0.00 C ATOM 44 CE1 TYR A 224 0.840 2.300 -6.640 1.00 0.00 C ATOM 45 CE2 TYR A 224 2.494 2.188 -4.915 1.00 0.00 C ATOM 46 CZ TYR A 224 1.329 2.728 -5.427 1.00 0.00 C ATOM 47 OH TYR A 224 0.639 3.693 -4.718 1.00 0.00 O ATOM 0 H TYR A 224 2.839 -2.598 -5.849 1.00 0.00 H new ATOM 0 HA TYR A 224 1.724 -1.483 -8.356 1.00 0.00 H new ATOM 0 HB2 TYR A 224 4.364 -0.579 -7.123 1.00 0.00 H new ATOM 0 HB3 TYR A 224 3.656 -0.012 -8.622 1.00 0.00 H new ATOM 0 HD1 TYR A 224 1.122 0.988 -8.296 1.00 0.00 H new ATOM 0 HD2 TYR A 224 4.083 0.802 -5.222 1.00 0.00 H new ATOM 0 HE1 TYR A 224 -0.068 2.727 -7.039 1.00 0.00 H new ATOM 0 HE2 TYR A 224 2.874 2.525 -3.962 1.00 0.00 H new ATOM 0 HH TYR A 224 1.113 3.886 -3.882 1.00 0.00 H new ATOM 57 N CYS A 225 3.135 -3.139 -9.609 1.00 0.00 N ATOM 58 CA CYS A 225 3.929 -4.051 -10.470 1.00 0.00 C ATOM 59 C CYS A 225 3.131 -4.345 -11.750 1.00 0.00 C ATOM 60 O CYS A 225 1.937 -4.056 -11.811 1.00 0.00 O ATOM 61 CB CYS A 225 4.284 -5.383 -9.766 1.00 0.00 C ATOM 62 SG CYS A 225 5.344 -6.463 -10.751 1.00 0.00 S ATOM 0 H CYS A 225 2.292 -2.797 -10.071 1.00 0.00 H new ATOM 0 HA CYS A 225 4.870 -3.552 -10.700 1.00 0.00 H new ATOM 0 HB2 CYS A 225 4.781 -5.163 -8.821 1.00 0.00 H new ATOM 0 HB3 CYS A 225 3.363 -5.914 -9.525 1.00 0.00 H new ATOM 67 N PHE A 226 3.777 -4.930 -12.778 1.00 0.00 N ATOM 68 CA PHE A 226 3.072 -5.335 -14.020 1.00 0.00 C ATOM 69 C PHE A 226 2.109 -6.511 -13.735 1.00 0.00 C ATOM 70 O PHE A 226 1.007 -6.563 -14.281 1.00 0.00 O ATOM 71 CB PHE A 226 4.084 -5.716 -15.134 1.00 0.00 C ATOM 72 CG PHE A 226 3.478 -5.788 -16.537 1.00 0.00 C ATOM 73 CD1 PHE A 226 3.183 -4.618 -17.239 1.00 0.00 C ATOM 74 CD2 PHE A 226 3.202 -7.011 -17.151 1.00 0.00 C ATOM 75 CE1 PHE A 226 2.633 -4.672 -18.506 1.00 0.00 C ATOM 76 CE2 PHE A 226 2.651 -7.061 -18.418 1.00 0.00 C ATOM 77 CZ PHE A 226 2.369 -5.894 -19.095 1.00 0.00 C ATOM 0 H PHE A 226 4.777 -5.133 -12.778 1.00 0.00 H new ATOM 0 HA PHE A 226 2.487 -4.485 -14.372 1.00 0.00 H new ATOM 0 HB2 PHE A 226 4.894 -4.987 -15.138 1.00 0.00 H new ATOM 0 HB3 PHE A 226 4.526 -6.682 -14.892 1.00 0.00 H new ATOM 0 HD1 PHE A 226 3.387 -3.659 -16.787 1.00 0.00 H new ATOM 0 HD2 PHE A 226 3.422 -7.931 -16.629 1.00 0.00 H new ATOM 0 HE1 PHE A 226 2.409 -3.758 -19.036 1.00 0.00 H new ATOM 0 HE2 PHE A 226 2.441 -8.015 -18.878 1.00 0.00 H new ATOM 0 HZ PHE A 226 1.942 -5.935 -20.086 1.00 0.00 H new ATOM 87 N CYS A 227 2.545 -7.448 -12.866 1.00 0.00 N ATOM 88 CA CYS A 227 1.705 -8.595 -12.440 1.00 0.00 C ATOM 89 C CYS A 227 0.765 -8.190 -11.274 1.00 0.00 C ATOM 90 O CYS A 227 -0.147 -8.952 -10.933 1.00 0.00 O ATOM 91 CB CYS A 227 2.576 -9.812 -12.009 1.00 0.00 C ATOM 92 SG CYS A 227 3.275 -9.678 -10.328 1.00 0.00 S ATOM 0 H CYS A 227 3.474 -7.435 -12.444 1.00 0.00 H new ATOM 0 HA CYS A 227 1.103 -8.888 -13.300 1.00 0.00 H new ATOM 0 HB2 CYS A 227 1.970 -10.716 -12.067 1.00 0.00 H new ATOM 0 HB3 CYS A 227 3.393 -9.930 -12.721 1.00 0.00 H new ATOM 97 N GLN A 228 0.988 -6.974 -10.701 1.00 0.00 N ATOM 98 CA GLN A 228 0.290 -6.467 -9.487 1.00 0.00 C ATOM 99 C GLN A 228 0.286 -7.506 -8.341 1.00 0.00 C ATOM 100 O GLN A 228 -0.705 -8.203 -8.098 1.00 0.00 O ATOM 101 CB GLN A 228 -1.141 -5.963 -9.835 1.00 0.00 C ATOM 102 CG GLN A 228 -1.171 -4.836 -10.891 1.00 0.00 C ATOM 103 CD GLN A 228 -0.669 -3.464 -10.397 1.00 0.00 C ATOM 104 OE1 GLN A 228 0.107 -3.355 -9.444 1.00 0.00 O ATOM 105 NE2 GLN A 228 -1.040 -2.414 -11.113 1.00 0.00 N ATOM 0 H GLN A 228 1.667 -6.311 -11.075 1.00 0.00 H new ATOM 0 HA GLN A 228 0.854 -5.611 -9.116 1.00 0.00 H new ATOM 0 HB2 GLN A 228 -1.733 -6.803 -10.199 1.00 0.00 H new ATOM 0 HB3 GLN A 228 -1.621 -5.606 -8.924 1.00 0.00 H new ATOM 0 HG2 GLN A 228 -0.565 -5.142 -11.744 1.00 0.00 H new ATOM 0 HG3 GLN A 228 -2.194 -4.723 -11.251 1.00 0.00 H new ATOM 0 HE21 GLN A 228 -1.683 -2.532 -11.896 1.00 0.00 H new ATOM 0 HE22 GLN A 228 -0.683 -1.487 -10.882 1.00 0.00 H new ATOM 114 N ARG A 229 1.440 -7.607 -7.673 1.00 0.00 N ATOM 115 CA ARG A 229 1.706 -8.587 -6.602 1.00 0.00 C ATOM 116 C ARG A 229 2.411 -7.865 -5.457 1.00 0.00 C ATOM 117 O ARG A 229 3.126 -6.880 -5.697 1.00 0.00 O ATOM 118 CB ARG A 229 2.596 -9.743 -7.152 1.00 0.00 C ATOM 119 CG ARG A 229 3.084 -10.791 -6.121 1.00 0.00 C ATOM 120 CD ARG A 229 4.050 -11.814 -6.747 1.00 0.00 C ATOM 121 NE ARG A 229 4.560 -12.786 -5.767 1.00 0.00 N ATOM 122 CZ ARG A 229 4.330 -14.115 -5.786 1.00 0.00 C ATOM 123 NH1 ARG A 229 3.515 -14.649 -6.688 1.00 0.00 N ATOM 124 NH2 ARG A 229 4.907 -14.893 -4.887 1.00 0.00 N ATOM 0 H ARG A 229 2.236 -6.998 -7.862 1.00 0.00 H new ATOM 0 HA ARG A 229 0.773 -9.020 -6.243 1.00 0.00 H new ATOM 0 HB2 ARG A 229 2.037 -10.264 -7.929 1.00 0.00 H new ATOM 0 HB3 ARG A 229 3.471 -9.302 -7.630 1.00 0.00 H new ATOM 0 HG2 ARG A 229 3.581 -10.282 -5.295 1.00 0.00 H new ATOM 0 HG3 ARG A 229 2.224 -11.314 -5.702 1.00 0.00 H new ATOM 0 HD2 ARG A 229 3.539 -12.347 -7.549 1.00 0.00 H new ATOM 0 HD3 ARG A 229 4.889 -11.286 -7.199 1.00 0.00 H new ATOM 0 HE ARG A 229 5.137 -12.424 -5.008 1.00 0.00 H new ATOM 0 HH11 ARG A 229 3.055 -14.053 -7.376 1.00 0.00 H new ATOM 0 HH12 ARG A 229 3.349 -15.655 -6.693 1.00 0.00 H new ATOM 0 HH21 ARG A 229 5.523 -14.488 -4.182 1.00 0.00 H new ATOM 0 HH22 ARG A 229 4.736 -15.898 -4.898 1.00 0.00 H new ATOM 138 N VAL A 230 2.194 -8.334 -4.219 1.00 0.00 N ATOM 139 CA VAL A 230 2.856 -7.769 -3.033 1.00 0.00 C ATOM 140 C VAL A 230 4.357 -8.119 -3.030 1.00 0.00 C ATOM 141 O VAL A 230 4.801 -9.059 -3.710 1.00 0.00 O ATOM 142 CB VAL A 230 2.196 -8.259 -1.686 1.00 0.00 C ATOM 143 CG1 VAL A 230 0.695 -7.878 -1.623 1.00 0.00 C ATOM 144 CG2 VAL A 230 2.413 -9.779 -1.469 1.00 0.00 C ATOM 0 H VAL A 230 1.562 -9.107 -4.012 1.00 0.00 H new ATOM 0 HA VAL A 230 2.732 -6.688 -3.091 1.00 0.00 H new ATOM 0 HB VAL A 230 2.696 -7.743 -0.866 1.00 0.00 H new ATOM 0 HG11 VAL A 230 0.270 -8.230 -0.683 1.00 0.00 H new ATOM 0 HG12 VAL A 230 0.592 -6.795 -1.685 1.00 0.00 H new ATOM 0 HG13 VAL A 230 0.167 -8.341 -2.456 1.00 0.00 H new ATOM 0 HG21 VAL A 230 1.946 -10.083 -0.532 1.00 0.00 H new ATOM 0 HG22 VAL A 230 1.965 -10.332 -2.294 1.00 0.00 H new ATOM 0 HG23 VAL A 230 3.481 -9.992 -1.428 1.00 0.00 H new ATOM 154 N SER A 231 5.124 -7.348 -2.267 1.00 0.00 N ATOM 155 CA SER A 231 6.555 -7.569 -2.086 1.00 0.00 C ATOM 156 C SER A 231 6.809 -7.959 -0.619 1.00 0.00 C ATOM 157 O SER A 231 6.513 -7.189 0.295 1.00 0.00 O ATOM 158 CB SER A 231 7.309 -6.299 -2.486 1.00 0.00 C ATOM 159 OG SER A 231 7.030 -5.935 -3.834 1.00 0.00 O ATOM 0 H SER A 231 4.767 -6.544 -1.751 1.00 0.00 H new ATOM 0 HA SER A 231 6.915 -8.380 -2.719 1.00 0.00 H new ATOM 0 HB2 SER A 231 7.029 -5.482 -1.821 1.00 0.00 H new ATOM 0 HB3 SER A 231 8.381 -6.456 -2.364 1.00 0.00 H new ATOM 0 HG SER A 231 7.524 -5.120 -4.062 1.00 0.00 H new ATOM 165 N PHE A 232 7.335 -9.172 -0.422 1.00 0.00 N ATOM 166 CA PHE A 232 7.417 -9.842 0.895 1.00 0.00 C ATOM 167 C PHE A 232 8.886 -9.959 1.338 1.00 0.00 C ATOM 168 O PHE A 232 9.470 -11.051 1.388 1.00 0.00 O ATOM 169 CB PHE A 232 6.678 -11.223 0.823 1.00 0.00 C ATOM 170 CG PHE A 232 6.862 -11.966 -0.513 1.00 0.00 C ATOM 171 CD1 PHE A 232 7.953 -12.811 -0.736 1.00 0.00 C ATOM 172 CD2 PHE A 232 5.958 -11.775 -1.562 1.00 0.00 C ATOM 173 CE1 PHE A 232 8.123 -13.439 -1.956 1.00 0.00 C ATOM 174 CE2 PHE A 232 6.137 -12.400 -2.778 1.00 0.00 C ATOM 175 CZ PHE A 232 7.219 -13.231 -2.976 1.00 0.00 C ATOM 0 H PHE A 232 7.724 -9.731 -1.181 1.00 0.00 H new ATOM 0 HA PHE A 232 6.913 -9.249 1.658 1.00 0.00 H new ATOM 0 HB2 PHE A 232 7.038 -11.858 1.632 1.00 0.00 H new ATOM 0 HB3 PHE A 232 5.613 -11.063 0.993 1.00 0.00 H new ATOM 0 HD1 PHE A 232 8.671 -12.975 0.054 1.00 0.00 H new ATOM 0 HD2 PHE A 232 5.106 -11.128 -1.418 1.00 0.00 H new ATOM 0 HE1 PHE A 232 8.967 -14.095 -2.111 1.00 0.00 H new ATOM 0 HE2 PHE A 232 5.428 -12.238 -3.577 1.00 0.00 H new ATOM 0 HZ PHE A 232 7.358 -13.719 -3.929 1.00 0.00 H new ATOM 185 N GLY A 233 9.494 -8.791 1.602 1.00 0.00 N ATOM 186 CA GLY A 233 10.891 -8.687 2.055 1.00 0.00 C ATOM 187 C GLY A 233 11.899 -8.648 0.913 1.00 0.00 C ATOM 188 O GLY A 233 13.027 -8.162 1.082 1.00 0.00 O ATOM 0 H GLY A 233 9.028 -7.888 1.507 1.00 0.00 H new ATOM 0 HA2 GLY A 233 11.003 -7.786 2.659 1.00 0.00 H new ATOM 0 HA3 GLY A 233 11.119 -9.534 2.702 1.00 0.00 H new ATOM 192 N GLU A 234 11.489 -9.149 -0.255 1.00 0.00 N ATOM 193 CA GLU A 234 12.242 -9.021 -1.503 1.00 0.00 C ATOM 194 C GLU A 234 11.529 -8.000 -2.385 1.00 0.00 C ATOM 195 O GLU A 234 10.521 -8.322 -3.024 1.00 0.00 O ATOM 196 CB GLU A 234 12.386 -10.393 -2.226 1.00 0.00 C ATOM 197 CG GLU A 234 13.343 -11.385 -1.530 1.00 0.00 C ATOM 198 CD GLU A 234 14.801 -10.887 -1.463 1.00 0.00 C ATOM 199 OE1 GLU A 234 15.522 -10.989 -2.483 1.00 0.00 O ATOM 200 OE2 GLU A 234 15.233 -10.381 -0.399 1.00 0.00 O ATOM 0 H GLU A 234 10.613 -9.661 -0.361 1.00 0.00 H new ATOM 0 HA GLU A 234 13.255 -8.680 -1.288 1.00 0.00 H new ATOM 0 HB2 GLU A 234 11.401 -10.853 -2.306 1.00 0.00 H new ATOM 0 HB3 GLU A 234 12.739 -10.219 -3.242 1.00 0.00 H new ATOM 0 HG2 GLU A 234 12.985 -11.574 -0.518 1.00 0.00 H new ATOM 0 HG3 GLU A 234 13.316 -12.337 -2.061 1.00 0.00 H new ATOM 207 N MET A 235 12.037 -6.758 -2.377 1.00 0.00 N ATOM 208 CA MET A 235 11.488 -5.663 -3.186 1.00 0.00 C ATOM 209 C MET A 235 12.610 -4.773 -3.732 1.00 0.00 C ATOM 210 O MET A 235 13.459 -4.270 -2.979 1.00 0.00 O ATOM 211 CB MET A 235 10.443 -4.826 -2.395 1.00 0.00 C ATOM 212 CG MET A 235 10.914 -4.167 -1.097 1.00 0.00 C ATOM 213 SD MET A 235 9.579 -3.214 -0.330 1.00 0.00 S ATOM 214 CE MET A 235 10.367 -2.542 1.130 1.00 0.00 C ATOM 0 H MET A 235 12.840 -6.486 -1.809 1.00 0.00 H new ATOM 0 HA MET A 235 10.966 -6.111 -4.032 1.00 0.00 H new ATOM 0 HB2 MET A 235 10.068 -4.043 -3.054 1.00 0.00 H new ATOM 0 HB3 MET A 235 9.600 -5.475 -2.158 1.00 0.00 H new ATOM 0 HG2 MET A 235 11.265 -4.931 -0.404 1.00 0.00 H new ATOM 0 HG3 MET A 235 11.760 -3.512 -1.304 1.00 0.00 H new ATOM 0 HE1 MET A 235 9.650 -1.938 1.685 1.00 0.00 H new ATOM 0 HE2 MET A 235 10.720 -3.358 1.761 1.00 0.00 H new ATOM 0 HE3 MET A 235 11.212 -1.921 0.834 1.00 0.00 H new ATOM 224 N VAL A 236 12.637 -4.638 -5.060 1.00 0.00 N ATOM 225 CA VAL A 236 13.529 -3.722 -5.752 1.00 0.00 C ATOM 226 C VAL A 236 12.744 -2.450 -6.130 1.00 0.00 C ATOM 227 O VAL A 236 11.679 -2.515 -6.761 1.00 0.00 O ATOM 228 CB VAL A 236 14.197 -4.411 -7.006 1.00 0.00 C ATOM 229 CG1 VAL A 236 13.156 -5.001 -7.986 1.00 0.00 C ATOM 230 CG2 VAL A 236 15.153 -3.436 -7.719 1.00 0.00 C ATOM 0 H VAL A 236 12.032 -5.170 -5.686 1.00 0.00 H new ATOM 0 HA VAL A 236 14.349 -3.439 -5.092 1.00 0.00 H new ATOM 0 HB VAL A 236 14.780 -5.254 -6.635 1.00 0.00 H new ATOM 0 HG11 VAL A 236 13.670 -5.462 -8.829 1.00 0.00 H new ATOM 0 HG12 VAL A 236 12.557 -5.752 -7.472 1.00 0.00 H new ATOM 0 HG13 VAL A 236 12.506 -4.205 -8.349 1.00 0.00 H new ATOM 0 HG21 VAL A 236 15.602 -3.931 -8.580 1.00 0.00 H new ATOM 0 HG22 VAL A 236 14.597 -2.560 -8.054 1.00 0.00 H new ATOM 0 HG23 VAL A 236 15.937 -3.126 -7.029 1.00 0.00 H new ATOM 240 N ALA A 237 13.262 -1.296 -5.692 1.00 0.00 N ATOM 241 CA ALA A 237 12.638 0.010 -5.935 1.00 0.00 C ATOM 242 C ALA A 237 13.180 0.626 -7.230 1.00 0.00 C ATOM 243 O ALA A 237 14.335 0.392 -7.613 1.00 0.00 O ATOM 244 CB ALA A 237 12.875 0.942 -4.733 1.00 0.00 C ATOM 0 H ALA A 237 14.129 -1.242 -5.157 1.00 0.00 H new ATOM 0 HA ALA A 237 11.563 -0.125 -6.052 1.00 0.00 H new ATOM 0 HB1 ALA A 237 12.408 1.908 -4.924 1.00 0.00 H new ATOM 0 HB2 ALA A 237 12.439 0.499 -3.838 1.00 0.00 H new ATOM 0 HB3 ALA A 237 13.946 1.080 -4.585 1.00 0.00 H new ATOM 250 N CYS A 238 12.328 1.394 -7.910 1.00 0.00 N ATOM 251 CA CYS A 238 12.705 2.167 -9.098 1.00 0.00 C ATOM 252 C CYS A 238 12.743 3.652 -8.753 1.00 0.00 C ATOM 253 O CYS A 238 12.082 4.091 -7.806 1.00 0.00 O ATOM 254 CB CYS A 238 11.757 1.922 -10.290 1.00 0.00 C ATOM 255 SG CYS A 238 12.116 2.999 -11.722 1.00 0.00 S ATOM 0 H CYS A 238 11.347 1.499 -7.651 1.00 0.00 H new ATOM 0 HA CYS A 238 13.695 1.830 -9.406 1.00 0.00 H new ATOM 0 HB2 CYS A 238 11.833 0.879 -10.599 1.00 0.00 H new ATOM 0 HB3 CYS A 238 10.728 2.085 -9.968 1.00 0.00 H new ATOM 260 N ASP A 239 13.566 4.411 -9.493 1.00 0.00 N ATOM 261 CA ASP A 239 13.643 5.881 -9.384 1.00 0.00 C ATOM 262 C ASP A 239 13.243 6.507 -10.725 1.00 0.00 C ATOM 263 O ASP A 239 14.053 6.590 -11.648 1.00 0.00 O ATOM 264 CB ASP A 239 15.074 6.312 -8.976 1.00 0.00 C ATOM 265 CG ASP A 239 15.475 5.759 -7.604 1.00 0.00 C ATOM 266 OD1 ASP A 239 15.838 4.564 -7.520 1.00 0.00 O ATOM 267 OD2 ASP A 239 15.416 6.501 -6.601 1.00 0.00 O ATOM 0 H ASP A 239 14.202 4.022 -10.189 1.00 0.00 H new ATOM 0 HA ASP A 239 12.956 6.229 -8.613 1.00 0.00 H new ATOM 0 HB2 ASP A 239 15.784 5.966 -9.727 1.00 0.00 H new ATOM 0 HB3 ASP A 239 15.133 7.400 -8.959 1.00 0.00 H new ATOM 272 N GLY A 240 11.957 6.849 -10.843 1.00 0.00 N ATOM 273 CA GLY A 240 11.421 7.596 -11.982 1.00 0.00 C ATOM 274 C GLY A 240 10.327 8.559 -11.527 1.00 0.00 C ATOM 275 O GLY A 240 9.381 8.103 -10.879 1.00 0.00 O ATOM 0 H GLY A 240 11.253 6.613 -10.144 1.00 0.00 H new ATOM 0 HA2 GLY A 240 12.222 8.152 -12.469 1.00 0.00 H new ATOM 0 HA3 GLY A 240 11.019 6.903 -12.721 1.00 0.00 H new ATOM 279 N PRO A 241 10.400 9.895 -11.847 1.00 0.00 N ATOM 280 CA PRO A 241 9.335 10.864 -11.472 1.00 0.00 C ATOM 281 C PRO A 241 7.974 10.446 -12.067 1.00 0.00 C ATOM 282 O PRO A 241 6.970 10.338 -11.361 1.00 0.00 O ATOM 283 CB PRO A 241 9.835 12.210 -12.061 1.00 0.00 C ATOM 284 CG PRO A 241 11.314 12.020 -12.233 1.00 0.00 C ATOM 285 CD PRO A 241 11.500 10.563 -12.588 1.00 0.00 C ATOM 0 HA PRO A 241 9.170 10.922 -10.396 1.00 0.00 H new ATOM 0 HB2 PRO A 241 9.350 12.431 -13.012 1.00 0.00 H new ATOM 0 HB3 PRO A 241 9.617 13.042 -11.391 1.00 0.00 H new ATOM 0 HG2 PRO A 241 11.703 12.667 -13.019 1.00 0.00 H new ATOM 0 HG3 PRO A 241 11.850 12.272 -11.318 1.00 0.00 H new ATOM 0 HD2 PRO A 241 11.422 10.396 -13.662 1.00 0.00 H new ATOM 0 HD3 PRO A 241 12.478 10.194 -12.278 1.00 0.00 H new ATOM 293 N ASN A 242 7.998 10.176 -13.377 1.00 0.00 N ATOM 294 CA ASN A 242 6.881 9.593 -14.128 1.00 0.00 C ATOM 295 C ASN A 242 7.060 8.058 -14.189 1.00 0.00 C ATOM 296 O ASN A 242 7.723 7.522 -15.083 1.00 0.00 O ATOM 297 CB ASN A 242 6.758 10.246 -15.551 1.00 0.00 C ATOM 298 CG ASN A 242 8.064 10.300 -16.384 1.00 0.00 C ATOM 299 OD1 ASN A 242 9.170 10.399 -15.848 1.00 0.00 O ATOM 300 ND2 ASN A 242 7.946 10.265 -17.706 1.00 0.00 N ATOM 0 H ASN A 242 8.815 10.362 -13.959 1.00 0.00 H new ATOM 0 HA ASN A 242 5.941 9.804 -13.618 1.00 0.00 H new ATOM 0 HB2 ASN A 242 6.009 9.694 -16.120 1.00 0.00 H new ATOM 0 HB3 ASN A 242 6.383 11.263 -15.432 1.00 0.00 H new ATOM 0 HD21 ASN A 242 8.778 10.320 -18.294 1.00 0.00 H new ATOM 0 HD22 ASN A 242 7.024 10.183 -18.134 1.00 0.00 H new ATOM 307 N CYS A 243 6.491 7.377 -13.174 1.00 0.00 N ATOM 308 CA CYS A 243 6.594 5.917 -12.992 1.00 0.00 C ATOM 309 C CYS A 243 5.681 5.486 -11.829 1.00 0.00 C ATOM 310 O CYS A 243 5.934 5.832 -10.674 1.00 0.00 O ATOM 311 CB CYS A 243 8.058 5.521 -12.700 1.00 0.00 C ATOM 312 SG CYS A 243 8.398 3.733 -12.571 1.00 0.00 S ATOM 0 H CYS A 243 5.939 7.833 -12.448 1.00 0.00 H new ATOM 0 HA CYS A 243 6.277 5.413 -13.905 1.00 0.00 H new ATOM 0 HB2 CYS A 243 8.688 5.934 -13.488 1.00 0.00 H new ATOM 0 HB3 CYS A 243 8.362 5.996 -11.767 1.00 0.00 H new ATOM 317 N LYS A 244 4.599 4.762 -12.149 1.00 0.00 N ATOM 318 CA LYS A 244 3.632 4.251 -11.143 1.00 0.00 C ATOM 319 C LYS A 244 4.058 2.868 -10.622 1.00 0.00 C ATOM 320 O LYS A 244 3.721 2.482 -9.504 1.00 0.00 O ATOM 321 CB LYS A 244 2.174 4.199 -11.709 1.00 0.00 C ATOM 322 CG LYS A 244 1.898 3.184 -12.856 1.00 0.00 C ATOM 323 CD LYS A 244 2.412 3.635 -14.247 1.00 0.00 C ATOM 324 CE LYS A 244 1.786 4.962 -14.716 1.00 0.00 C ATOM 325 NZ LYS A 244 0.297 4.879 -14.778 1.00 0.00 N ATOM 0 H LYS A 244 4.362 4.510 -13.108 1.00 0.00 H new ATOM 0 HA LYS A 244 3.637 4.952 -10.309 1.00 0.00 H new ATOM 0 HB2 LYS A 244 1.498 3.971 -10.885 1.00 0.00 H new ATOM 0 HB3 LYS A 244 1.914 5.195 -12.068 1.00 0.00 H new ATOM 0 HG2 LYS A 244 2.363 2.232 -12.602 1.00 0.00 H new ATOM 0 HG3 LYS A 244 0.824 3.008 -12.918 1.00 0.00 H new ATOM 0 HD2 LYS A 244 3.496 3.743 -14.211 1.00 0.00 H new ATOM 0 HD3 LYS A 244 2.194 2.857 -14.979 1.00 0.00 H new ATOM 0 HE2 LYS A 244 2.078 5.762 -14.036 1.00 0.00 H new ATOM 0 HE3 LYS A 244 2.177 5.221 -15.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 244 -0.082 5.754 -15.193 1.00 0.00 H new ATOM 0 HZ2 LYS A 244 0.019 4.068 -15.366 1.00 0.00 H new ATOM 0 HZ3 LYS A 244 -0.084 4.758 -13.818 1.00 0.00 H new ATOM 339 N TYR A 245 4.829 2.147 -11.443 1.00 0.00 N ATOM 340 CA TYR A 245 5.305 0.782 -11.154 1.00 0.00 C ATOM 341 C TYR A 245 6.672 0.795 -10.435 1.00 0.00 C ATOM 342 O TYR A 245 7.440 -0.156 -10.577 1.00 0.00 O ATOM 343 CB TYR A 245 5.363 -0.042 -12.465 1.00 0.00 C ATOM 344 CG TYR A 245 3.996 -0.255 -13.140 1.00 0.00 C ATOM 345 CD1 TYR A 245 2.922 -0.812 -12.436 1.00 0.00 C ATOM 346 CD2 TYR A 245 3.787 0.069 -14.484 1.00 0.00 C ATOM 347 CE1 TYR A 245 1.700 -1.032 -13.043 1.00 0.00 C ATOM 348 CE2 TYR A 245 2.563 -0.148 -15.090 1.00 0.00 C ATOM 349 CZ TYR A 245 1.527 -0.699 -14.369 1.00 0.00 C ATOM 350 OH TYR A 245 0.310 -0.926 -14.982 1.00 0.00 O ATOM 0 H TYR A 245 5.148 2.499 -12.346 1.00 0.00 H new ATOM 0 HA TYR A 245 4.598 0.307 -10.474 1.00 0.00 H new ATOM 0 HB2 TYR A 245 6.028 0.461 -13.167 1.00 0.00 H new ATOM 0 HB3 TYR A 245 5.804 -1.015 -12.250 1.00 0.00 H new ATOM 0 HD1 TYR A 245 3.051 -1.075 -11.397 1.00 0.00 H new ATOM 0 HD2 TYR A 245 4.595 0.496 -15.059 1.00 0.00 H new ATOM 0 HE1 TYR A 245 0.885 -1.463 -12.481 1.00 0.00 H new ATOM 0 HE2 TYR A 245 2.420 0.114 -16.128 1.00 0.00 H new ATOM 0 HH TYR A 245 0.355 -0.634 -15.916 1.00 0.00 H new ATOM 360 N GLU A 246 6.968 1.887 -9.679 1.00 0.00 N ATOM 361 CA GLU A 246 8.247 2.065 -8.937 1.00 0.00 C ATOM 362 C GLU A 246 8.643 0.804 -8.142 1.00 0.00 C ATOM 363 O GLU A 246 9.794 0.360 -8.189 1.00 0.00 O ATOM 364 CB GLU A 246 8.130 3.276 -7.957 1.00 0.00 C ATOM 365 CG GLU A 246 8.044 4.658 -8.633 1.00 0.00 C ATOM 366 CD GLU A 246 9.396 5.183 -9.158 1.00 0.00 C ATOM 367 OE1 GLU A 246 9.896 4.679 -10.185 1.00 0.00 O ATOM 368 OE2 GLU A 246 9.969 6.104 -8.539 1.00 0.00 O ATOM 0 H GLU A 246 6.325 2.671 -9.567 1.00 0.00 H new ATOM 0 HA GLU A 246 9.025 2.251 -9.678 1.00 0.00 H new ATOM 0 HB2 GLU A 246 7.245 3.137 -7.336 1.00 0.00 H new ATOM 0 HB3 GLU A 246 8.992 3.268 -7.290 1.00 0.00 H new ATOM 0 HG2 GLU A 246 7.340 4.602 -9.463 1.00 0.00 H new ATOM 0 HG3 GLU A 246 7.639 5.376 -7.920 1.00 0.00 H new ATOM 375 N TRP A 247 7.667 0.222 -7.446 1.00 0.00 N ATOM 376 CA TRP A 247 7.878 -0.996 -6.665 1.00 0.00 C ATOM 377 C TRP A 247 7.774 -2.247 -7.554 1.00 0.00 C ATOM 378 O TRP A 247 6.826 -2.415 -8.322 1.00 0.00 O ATOM 379 CB TRP A 247 6.899 -1.043 -5.463 1.00 0.00 C ATOM 380 CG TRP A 247 7.231 0.010 -4.431 1.00 0.00 C ATOM 381 CD1 TRP A 247 6.568 1.177 -4.190 1.00 0.00 C ATOM 382 CD2 TRP A 247 8.365 0.001 -3.547 1.00 0.00 C ATOM 383 NE1 TRP A 247 7.200 1.877 -3.194 1.00 0.00 N ATOM 384 CE2 TRP A 247 8.306 1.178 -2.784 1.00 0.00 C ATOM 385 CE3 TRP A 247 9.416 -0.900 -3.319 1.00 0.00 C ATOM 386 CZ2 TRP A 247 9.257 1.487 -1.813 1.00 0.00 C ATOM 387 CZ3 TRP A 247 10.358 -0.594 -2.357 1.00 0.00 C ATOM 388 CH2 TRP A 247 10.273 0.590 -1.613 1.00 0.00 C ATOM 0 H TRP A 247 6.712 0.579 -7.408 1.00 0.00 H new ATOM 0 HA TRP A 247 8.890 -0.983 -6.260 1.00 0.00 H new ATOM 0 HB2 TRP A 247 5.879 -0.896 -5.818 1.00 0.00 H new ATOM 0 HB3 TRP A 247 6.936 -2.030 -5.001 1.00 0.00 H new ATOM 0 HD1 TRP A 247 5.677 1.502 -4.707 1.00 0.00 H new ATOM 0 HE1 TRP A 247 6.896 2.775 -2.818 1.00 0.00 H new ATOM 0 HE3 TRP A 247 9.487 -1.817 -3.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 247 9.195 2.400 -1.239 1.00 0.00 H new ATOM 0 HZ3 TRP A 247 11.173 -1.278 -2.175 1.00 0.00 H new ATOM 0 HH2 TRP A 247 11.024 0.800 -0.866 1.00 0.00 H new ATOM 399 N PHE A 248 8.824 -3.069 -7.477 1.00 0.00 N ATOM 400 CA PHE A 248 8.894 -4.414 -8.060 1.00 0.00 C ATOM 401 C PHE A 248 9.492 -5.367 -7.012 1.00 0.00 C ATOM 402 O PHE A 248 9.898 -4.942 -5.927 1.00 0.00 O ATOM 403 CB PHE A 248 9.739 -4.433 -9.374 1.00 0.00 C ATOM 404 CG PHE A 248 9.052 -3.824 -10.594 1.00 0.00 C ATOM 405 CD1 PHE A 248 7.913 -4.419 -11.129 1.00 0.00 C ATOM 406 CD2 PHE A 248 9.545 -2.680 -11.215 1.00 0.00 C ATOM 407 CE1 PHE A 248 7.289 -3.886 -12.240 1.00 0.00 C ATOM 408 CE2 PHE A 248 8.920 -2.156 -12.327 1.00 0.00 C ATOM 409 CZ PHE A 248 7.796 -2.757 -12.839 1.00 0.00 C ATOM 0 H PHE A 248 9.681 -2.808 -6.989 1.00 0.00 H new ATOM 0 HA PHE A 248 7.889 -4.738 -8.331 1.00 0.00 H new ATOM 0 HB2 PHE A 248 10.671 -3.897 -9.196 1.00 0.00 H new ATOM 0 HB3 PHE A 248 10.003 -5.465 -9.603 1.00 0.00 H new ATOM 0 HD1 PHE A 248 7.512 -5.310 -10.669 1.00 0.00 H new ATOM 0 HD2 PHE A 248 10.427 -2.197 -10.821 1.00 0.00 H new ATOM 0 HE1 PHE A 248 6.402 -4.356 -12.638 1.00 0.00 H new ATOM 0 HE2 PHE A 248 9.316 -1.268 -12.798 1.00 0.00 H new ATOM 0 HZ PHE A 248 7.311 -2.343 -13.711 1.00 0.00 H new ATOM 419 N HIS A 249 9.526 -6.657 -7.344 1.00 0.00 N ATOM 420 CA HIS A 249 10.087 -7.717 -6.472 1.00 0.00 C ATOM 421 C HIS A 249 11.119 -8.527 -7.272 1.00 0.00 C ATOM 422 O HIS A 249 10.985 -8.677 -8.497 1.00 0.00 O ATOM 423 CB HIS A 249 8.947 -8.612 -5.857 1.00 0.00 C ATOM 424 CG HIS A 249 7.639 -8.553 -6.595 1.00 0.00 C ATOM 425 ND1 HIS A 249 6.681 -7.606 -6.341 1.00 0.00 N ATOM 426 CD2 HIS A 249 7.205 -9.244 -7.671 1.00 0.00 C ATOM 427 CE1 HIS A 249 5.726 -7.737 -7.259 1.00 0.00 C ATOM 428 NE2 HIS A 249 5.985 -8.725 -8.111 1.00 0.00 N ATOM 0 H HIS A 249 9.165 -7.010 -8.230 1.00 0.00 H new ATOM 0 HA HIS A 249 10.597 -7.266 -5.621 1.00 0.00 H new ATOM 0 HB2 HIS A 249 9.289 -9.647 -5.832 1.00 0.00 H new ATOM 0 HB3 HIS A 249 8.781 -8.306 -4.824 1.00 0.00 H new ATOM 0 HD1 HIS A 249 6.697 -6.923 -5.584 1.00 0.00 H new ATOM 0 HD2 HIS A 249 7.724 -10.075 -8.124 1.00 0.00 H new ATOM 0 HE1 HIS A 249 4.845 -7.114 -7.306 1.00 0.00 H new ATOM 436 N TYR A 250 12.143 -9.032 -6.554 1.00 0.00 N ATOM 437 CA TYR A 250 13.332 -9.699 -7.144 1.00 0.00 C ATOM 438 C TYR A 250 12.970 -10.926 -8.006 1.00 0.00 C ATOM 439 O TYR A 250 13.651 -11.212 -8.997 1.00 0.00 O ATOM 440 CB TYR A 250 14.331 -10.104 -6.024 1.00 0.00 C ATOM 441 CG TYR A 250 15.099 -8.921 -5.405 1.00 0.00 C ATOM 442 CD1 TYR A 250 14.536 -8.120 -4.414 1.00 0.00 C ATOM 443 CD2 TYR A 250 16.393 -8.602 -5.828 1.00 0.00 C ATOM 444 CE1 TYR A 250 15.233 -7.060 -3.871 1.00 0.00 C ATOM 445 CE2 TYR A 250 17.085 -7.544 -5.286 1.00 0.00 C ATOM 446 CZ TYR A 250 16.502 -6.778 -4.311 1.00 0.00 C ATOM 447 OH TYR A 250 17.191 -5.724 -3.763 1.00 0.00 O ATOM 0 H TYR A 250 12.172 -8.990 -5.535 1.00 0.00 H new ATOM 0 HA TYR A 250 13.800 -8.975 -7.811 1.00 0.00 H new ATOM 0 HB2 TYR A 250 13.785 -10.621 -5.235 1.00 0.00 H new ATOM 0 HB3 TYR A 250 15.049 -10.815 -6.433 1.00 0.00 H new ATOM 0 HD1 TYR A 250 13.536 -8.332 -4.065 1.00 0.00 H new ATOM 0 HD2 TYR A 250 16.859 -9.200 -6.597 1.00 0.00 H new ATOM 0 HE1 TYR A 250 14.780 -6.453 -3.101 1.00 0.00 H new ATOM 0 HE2 TYR A 250 18.084 -7.318 -5.628 1.00 0.00 H new ATOM 0 HH TYR A 250 18.084 -6.023 -3.491 1.00 0.00 H new ATOM 457 N ASP A 251 11.892 -11.633 -7.619 1.00 0.00 N ATOM 458 CA ASP A 251 11.393 -12.831 -8.342 1.00 0.00 C ATOM 459 C ASP A 251 10.865 -12.480 -9.754 1.00 0.00 C ATOM 460 O ASP A 251 11.034 -13.257 -10.703 1.00 0.00 O ATOM 461 CB ASP A 251 10.289 -13.546 -7.517 1.00 0.00 C ATOM 462 CG ASP A 251 9.091 -12.646 -7.164 1.00 0.00 C ATOM 463 OD1 ASP A 251 9.162 -11.934 -6.140 1.00 0.00 O ATOM 464 OD2 ASP A 251 8.094 -12.624 -7.924 1.00 0.00 O ATOM 0 H ASP A 251 11.338 -11.394 -6.796 1.00 0.00 H new ATOM 0 HA ASP A 251 12.239 -13.507 -8.467 1.00 0.00 H new ATOM 0 HB2 ASP A 251 9.930 -14.408 -8.080 1.00 0.00 H new ATOM 0 HB3 ASP A 251 10.728 -13.928 -6.595 1.00 0.00 H new ATOM 469 N CYS A 252 10.228 -11.302 -9.865 1.00 0.00 N ATOM 470 CA CYS A 252 9.634 -10.807 -11.129 1.00 0.00 C ATOM 471 C CYS A 252 10.739 -10.416 -12.119 1.00 0.00 C ATOM 472 O CYS A 252 10.812 -10.926 -13.242 1.00 0.00 O ATOM 473 CB CYS A 252 8.696 -9.597 -10.849 1.00 0.00 C ATOM 474 SG CYS A 252 6.988 -9.854 -11.377 1.00 0.00 S ATOM 0 H CYS A 252 10.108 -10.661 -9.081 1.00 0.00 H new ATOM 0 HA CYS A 252 9.041 -11.606 -11.573 1.00 0.00 H new ATOM 0 HB2 CYS A 252 8.707 -9.382 -9.781 1.00 0.00 H new ATOM 0 HB3 CYS A 252 9.094 -8.717 -11.355 1.00 0.00 H new ATOM 479 N VAL A 253 11.614 -9.511 -11.656 1.00 0.00 N ATOM 480 CA VAL A 253 12.690 -8.928 -12.476 1.00 0.00 C ATOM 481 C VAL A 253 13.900 -9.879 -12.596 1.00 0.00 C ATOM 482 O VAL A 253 14.881 -9.561 -13.288 1.00 0.00 O ATOM 483 CB VAL A 253 13.127 -7.542 -11.882 1.00 0.00 C ATOM 484 CG1 VAL A 253 11.937 -6.549 -11.884 1.00 0.00 C ATOM 485 CG2 VAL A 253 13.710 -7.702 -10.459 1.00 0.00 C ATOM 0 H VAL A 253 11.596 -9.160 -10.698 1.00 0.00 H new ATOM 0 HA VAL A 253 12.300 -8.777 -13.483 1.00 0.00 H new ATOM 0 HB VAL A 253 13.914 -7.136 -12.518 1.00 0.00 H new ATOM 0 HG11 VAL A 253 12.259 -5.594 -11.469 1.00 0.00 H new ATOM 0 HG12 VAL A 253 11.588 -6.401 -12.906 1.00 0.00 H new ATOM 0 HG13 VAL A 253 11.125 -6.953 -11.279 1.00 0.00 H new ATOM 0 HG21 VAL A 253 14.004 -6.725 -10.074 1.00 0.00 H new ATOM 0 HG22 VAL A 253 12.956 -8.138 -9.804 1.00 0.00 H new ATOM 0 HG23 VAL A 253 14.582 -8.355 -10.494 1.00 0.00 H new ATOM 495 N ASN A 254 13.817 -11.028 -11.886 1.00 0.00 N ATOM 496 CA ASN A 254 14.786 -12.142 -11.959 1.00 0.00 C ATOM 497 C ASN A 254 16.176 -11.738 -11.429 1.00 0.00 C ATOM 498 O ASN A 254 17.196 -12.315 -11.816 1.00 0.00 O ATOM 499 CB ASN A 254 14.845 -12.745 -13.398 1.00 0.00 C ATOM 500 CG ASN A 254 13.489 -13.275 -13.909 1.00 0.00 C ATOM 501 OD1 ASN A 254 13.189 -13.199 -15.101 1.00 0.00 O ATOM 502 ND2 ASN A 254 12.664 -13.841 -13.029 1.00 0.00 N ATOM 0 H ASN A 254 13.056 -11.209 -11.232 1.00 0.00 H new ATOM 0 HA ASN A 254 14.430 -12.931 -11.297 1.00 0.00 H new ATOM 0 HB2 ASN A 254 15.209 -11.982 -14.086 1.00 0.00 H new ATOM 0 HB3 ASN A 254 15.570 -13.558 -13.411 1.00 0.00 H new ATOM 0 HD21 ASN A 254 11.769 -14.219 -13.339 1.00 0.00 H new ATOM 0 HD22 ASN A 254 12.927 -13.896 -12.045 1.00 0.00 H new ATOM 509 N LEU A 255 16.188 -10.755 -10.509 1.00 0.00 N ATOM 510 CA LEU A 255 17.397 -10.339 -9.776 1.00 0.00 C ATOM 511 C LEU A 255 17.678 -11.337 -8.632 1.00 0.00 C ATOM 512 O LEU A 255 16.889 -11.451 -7.690 1.00 0.00 O ATOM 513 CB LEU A 255 17.244 -8.888 -9.209 1.00 0.00 C ATOM 514 CG LEU A 255 17.465 -7.710 -10.211 1.00 0.00 C ATOM 515 CD1 LEU A 255 17.113 -6.349 -9.554 1.00 0.00 C ATOM 516 CD2 LEU A 255 18.917 -7.701 -10.746 1.00 0.00 C ATOM 0 H LEU A 255 15.355 -10.225 -10.253 1.00 0.00 H new ATOM 0 HA LEU A 255 18.239 -10.337 -10.469 1.00 0.00 H new ATOM 0 HB2 LEU A 255 16.243 -8.792 -8.788 1.00 0.00 H new ATOM 0 HB3 LEU A 255 17.948 -8.770 -8.386 1.00 0.00 H new ATOM 0 HG LEU A 255 16.794 -7.862 -11.057 1.00 0.00 H new ATOM 0 HD11 LEU A 255 17.275 -5.545 -10.272 1.00 0.00 H new ATOM 0 HD12 LEU A 255 16.068 -6.354 -9.245 1.00 0.00 H new ATOM 0 HD13 LEU A 255 17.748 -6.191 -8.683 1.00 0.00 H new ATOM 0 HD21 LEU A 255 19.043 -6.871 -11.441 1.00 0.00 H new ATOM 0 HD22 LEU A 255 19.611 -7.586 -9.913 1.00 0.00 H new ATOM 0 HD23 LEU A 255 19.121 -8.640 -11.261 1.00 0.00 H new ATOM 528 N LYS A 256 18.788 -12.084 -8.758 1.00 0.00 N ATOM 529 CA LYS A 256 19.353 -12.912 -7.667 1.00 0.00 C ATOM 530 C LYS A 256 20.342 -12.060 -6.830 1.00 0.00 C ATOM 531 O LYS A 256 20.906 -12.536 -5.841 1.00 0.00 O ATOM 532 CB LYS A 256 20.091 -14.175 -8.227 1.00 0.00 C ATOM 533 CG LYS A 256 19.212 -15.208 -8.987 1.00 0.00 C ATOM 534 CD LYS A 256 18.764 -14.736 -10.391 1.00 0.00 C ATOM 535 CE LYS A 256 17.889 -15.765 -11.132 1.00 0.00 C ATOM 536 NZ LYS A 256 16.650 -16.103 -10.384 1.00 0.00 N ATOM 0 H LYS A 256 19.325 -12.134 -9.623 1.00 0.00 H new ATOM 0 HA LYS A 256 18.530 -13.254 -7.040 1.00 0.00 H new ATOM 0 HB2 LYS A 256 20.881 -13.839 -8.898 1.00 0.00 H new ATOM 0 HB3 LYS A 256 20.575 -14.685 -7.394 1.00 0.00 H new ATOM 0 HG2 LYS A 256 19.769 -16.140 -9.088 1.00 0.00 H new ATOM 0 HG3 LYS A 256 18.328 -15.428 -8.389 1.00 0.00 H new ATOM 0 HD2 LYS A 256 18.210 -13.803 -10.293 1.00 0.00 H new ATOM 0 HD3 LYS A 256 19.647 -14.521 -10.993 1.00 0.00 H new ATOM 0 HE2 LYS A 256 17.621 -15.371 -12.112 1.00 0.00 H new ATOM 0 HE3 LYS A 256 18.467 -16.674 -11.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 256 16.041 -16.705 -10.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 256 16.899 -16.612 -9.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 256 16.142 -15.229 -10.141 1.00 0.00 H new ATOM 550 N GLU A 257 20.545 -10.803 -7.263 1.00 0.00 N ATOM 551 CA GLU A 257 21.494 -9.854 -6.660 1.00 0.00 C ATOM 552 C GLU A 257 20.763 -8.532 -6.326 1.00 0.00 C ATOM 553 O GLU A 257 19.823 -8.147 -7.043 1.00 0.00 O ATOM 554 CB GLU A 257 22.661 -9.605 -7.662 1.00 0.00 C ATOM 555 CG GLU A 257 22.249 -8.925 -8.989 1.00 0.00 C ATOM 556 CD GLU A 257 23.365 -8.923 -10.048 1.00 0.00 C ATOM 557 OE1 GLU A 257 24.379 -8.220 -9.860 1.00 0.00 O ATOM 558 OE2 GLU A 257 23.237 -9.632 -11.073 1.00 0.00 O ATOM 0 H GLU A 257 20.042 -10.411 -8.059 1.00 0.00 H new ATOM 0 HA GLU A 257 21.901 -10.262 -5.735 1.00 0.00 H new ATOM 0 HB2 GLU A 257 23.414 -8.987 -7.173 1.00 0.00 H new ATOM 0 HB3 GLU A 257 23.133 -10.560 -7.892 1.00 0.00 H new ATOM 0 HG2 GLU A 257 21.375 -9.435 -9.394 1.00 0.00 H new ATOM 0 HG3 GLU A 257 21.951 -7.897 -8.784 1.00 0.00 H new ATOM 565 N PRO A 258 21.149 -7.823 -5.219 1.00 0.00 N ATOM 566 CA PRO A 258 20.639 -6.461 -4.928 1.00 0.00 C ATOM 567 C PRO A 258 21.265 -5.419 -5.893 1.00 0.00 C ATOM 568 O PRO A 258 22.478 -5.468 -6.129 1.00 0.00 O ATOM 569 CB PRO A 258 21.079 -6.227 -3.460 1.00 0.00 C ATOM 570 CG PRO A 258 22.309 -7.069 -3.300 1.00 0.00 C ATOM 571 CD PRO A 258 22.076 -8.300 -4.152 1.00 0.00 C ATOM 0 HA PRO A 258 19.562 -6.361 -5.063 1.00 0.00 H new ATOM 0 HB2 PRO A 258 21.291 -5.174 -3.272 1.00 0.00 H new ATOM 0 HB3 PRO A 258 20.299 -6.525 -2.759 1.00 0.00 H new ATOM 0 HG2 PRO A 258 23.198 -6.529 -3.626 1.00 0.00 H new ATOM 0 HG3 PRO A 258 22.465 -7.339 -2.256 1.00 0.00 H new ATOM 0 HD2 PRO A 258 23.008 -8.679 -4.572 1.00 0.00 H new ATOM 0 HD3 PRO A 258 21.635 -9.111 -3.572 1.00 0.00 H new ATOM 579 N PRO A 259 20.458 -4.474 -6.482 1.00 0.00 N ATOM 580 CA PRO A 259 20.994 -3.419 -7.381 1.00 0.00 C ATOM 581 C PRO A 259 21.963 -2.460 -6.641 1.00 0.00 C ATOM 582 O PRO A 259 21.823 -2.210 -5.434 1.00 0.00 O ATOM 583 CB PRO A 259 19.724 -2.696 -7.889 1.00 0.00 C ATOM 584 CG PRO A 259 18.690 -2.967 -6.849 1.00 0.00 C ATOM 585 CD PRO A 259 18.982 -4.361 -6.337 1.00 0.00 C ATOM 0 HA PRO A 259 21.595 -3.825 -8.195 1.00 0.00 H new ATOM 0 HB2 PRO A 259 19.898 -1.626 -8.005 1.00 0.00 H new ATOM 0 HB3 PRO A 259 19.415 -3.076 -8.863 1.00 0.00 H new ATOM 0 HG2 PRO A 259 18.743 -2.235 -6.043 1.00 0.00 H new ATOM 0 HG3 PRO A 259 17.686 -2.906 -7.269 1.00 0.00 H new ATOM 0 HD2 PRO A 259 18.669 -4.483 -5.300 1.00 0.00 H new ATOM 0 HD3 PRO A 259 18.461 -5.121 -6.919 1.00 0.00 H new ATOM 593 N LYS A 260 22.932 -1.927 -7.398 1.00 0.00 N ATOM 594 CA LYS A 260 24.090 -1.184 -6.858 1.00 0.00 C ATOM 595 C LYS A 260 23.727 0.247 -6.402 1.00 0.00 C ATOM 596 O LYS A 260 24.472 0.852 -5.621 1.00 0.00 O ATOM 597 CB LYS A 260 25.220 -1.151 -7.921 1.00 0.00 C ATOM 598 CG LYS A 260 25.783 -2.546 -8.274 1.00 0.00 C ATOM 599 CD LYS A 260 26.878 -2.508 -9.366 1.00 0.00 C ATOM 600 CE LYS A 260 27.543 -3.883 -9.586 1.00 0.00 C ATOM 601 NZ LYS A 260 26.573 -4.933 -9.993 1.00 0.00 N ATOM 0 H LYS A 260 22.938 -1.998 -8.416 1.00 0.00 H new ATOM 0 HA LYS A 260 24.433 -1.709 -5.966 1.00 0.00 H new ATOM 0 HB2 LYS A 260 24.839 -0.683 -8.829 1.00 0.00 H new ATOM 0 HB3 LYS A 260 26.032 -0.523 -7.555 1.00 0.00 H new ATOM 0 HG2 LYS A 260 26.194 -3.002 -7.373 1.00 0.00 H new ATOM 0 HG3 LYS A 260 24.966 -3.185 -8.611 1.00 0.00 H new ATOM 0 HD2 LYS A 260 26.440 -2.166 -10.304 1.00 0.00 H new ATOM 0 HD3 LYS A 260 27.640 -1.780 -9.086 1.00 0.00 H new ATOM 0 HE2 LYS A 260 28.314 -3.791 -10.351 1.00 0.00 H new ATOM 0 HE3 LYS A 260 28.041 -4.192 -8.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 260 27.076 -5.831 -10.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 260 25.861 -5.056 -9.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 260 26.103 -4.648 -10.876 1.00 0.00 H new ATOM 615 N GLY A 261 22.589 0.774 -6.882 1.00 0.00 N ATOM 616 CA GLY A 261 22.154 2.139 -6.557 1.00 0.00 C ATOM 617 C GLY A 261 20.734 2.406 -7.038 1.00 0.00 C ATOM 618 O GLY A 261 19.854 1.553 -6.852 1.00 0.00 O ATOM 0 H GLY A 261 21.952 0.271 -7.500 1.00 0.00 H new ATOM 0 HA2 GLY A 261 22.208 2.291 -5.479 1.00 0.00 H new ATOM 0 HA3 GLY A 261 22.835 2.857 -7.015 1.00 0.00 H new ATOM 622 N THR A 262 20.510 3.576 -7.679 1.00 0.00 N ATOM 623 CA THR A 262 19.200 3.943 -8.234 1.00 0.00 C ATOM 624 C THR A 262 18.879 3.052 -9.450 1.00 0.00 C ATOM 625 O THR A 262 19.491 3.187 -10.519 1.00 0.00 O ATOM 626 CB THR A 262 19.154 5.461 -8.624 1.00 0.00 C ATOM 627 OG1 THR A 262 20.237 5.780 -9.516 1.00 0.00 O ATOM 628 CG2 THR A 262 19.231 6.368 -7.383 1.00 0.00 C ATOM 0 H THR A 262 21.231 4.283 -7.822 1.00 0.00 H new ATOM 0 HA THR A 262 18.441 3.780 -7.468 1.00 0.00 H new ATOM 0 HB THR A 262 18.201 5.641 -9.122 1.00 0.00 H new ATOM 0 HG1 THR A 262 20.347 5.058 -10.169 1.00 0.00 H new ATOM 0 HG21 THR A 262 19.196 7.412 -7.693 1.00 0.00 H new ATOM 0 HG22 THR A 262 18.388 6.157 -6.725 1.00 0.00 H new ATOM 0 HG23 THR A 262 20.163 6.178 -6.851 1.00 0.00 H new ATOM 636 N TRP A 263 17.950 2.112 -9.240 1.00 0.00 N ATOM 637 CA TRP A 263 17.556 1.119 -10.243 1.00 0.00 C ATOM 638 C TRP A 263 16.431 1.698 -11.112 1.00 0.00 C ATOM 639 O TRP A 263 15.399 2.120 -10.599 1.00 0.00 O ATOM 640 CB TRP A 263 17.107 -0.181 -9.521 1.00 0.00 C ATOM 641 CG TRP A 263 16.791 -1.352 -10.430 1.00 0.00 C ATOM 642 CD1 TRP A 263 17.689 -2.207 -11.016 1.00 0.00 C ATOM 643 CD2 TRP A 263 15.490 -1.802 -10.841 1.00 0.00 C ATOM 644 NE1 TRP A 263 17.026 -3.155 -11.749 1.00 0.00 N ATOM 645 CE2 TRP A 263 15.678 -2.924 -11.668 1.00 0.00 C ATOM 646 CE3 TRP A 263 14.186 -1.361 -10.591 1.00 0.00 C ATOM 647 CZ2 TRP A 263 14.616 -3.618 -12.235 1.00 0.00 C ATOM 648 CZ3 TRP A 263 13.134 -2.048 -11.156 1.00 0.00 C ATOM 649 CH2 TRP A 263 13.353 -3.163 -11.976 1.00 0.00 C ATOM 0 H TRP A 263 17.446 2.019 -8.358 1.00 0.00 H new ATOM 0 HA TRP A 263 18.396 0.876 -10.894 1.00 0.00 H new ATOM 0 HB2 TRP A 263 17.893 -0.482 -8.828 1.00 0.00 H new ATOM 0 HB3 TRP A 263 16.223 0.042 -8.923 1.00 0.00 H new ATOM 0 HD1 TRP A 263 18.762 -2.142 -10.914 1.00 0.00 H new ATOM 0 HE1 TRP A 263 17.466 -3.912 -12.272 1.00 0.00 H new ATOM 0 HE3 TRP A 263 14.007 -0.498 -9.967 1.00 0.00 H new ATOM 0 HZ2 TRP A 263 14.782 -4.485 -12.857 1.00 0.00 H new ATOM 0 HZ3 TRP A 263 12.123 -1.721 -10.964 1.00 0.00 H new ATOM 0 HH2 TRP A 263 12.507 -3.673 -12.412 1.00 0.00 H new ATOM 660 N TYR A 264 16.658 1.758 -12.429 1.00 0.00 N ATOM 661 CA TYR A 264 15.657 2.222 -13.400 1.00 0.00 C ATOM 662 C TYR A 264 15.020 1.005 -14.083 1.00 0.00 C ATOM 663 O TYR A 264 15.714 0.212 -14.731 1.00 0.00 O ATOM 664 CB TYR A 264 16.296 3.199 -14.431 1.00 0.00 C ATOM 665 CG TYR A 264 16.615 4.594 -13.855 1.00 0.00 C ATOM 666 CD1 TYR A 264 17.571 4.764 -12.848 1.00 0.00 C ATOM 667 CD2 TYR A 264 15.952 5.740 -14.310 1.00 0.00 C ATOM 668 CE1 TYR A 264 17.848 6.010 -12.321 1.00 0.00 C ATOM 669 CE2 TYR A 264 16.230 6.989 -13.786 1.00 0.00 C ATOM 670 CZ TYR A 264 17.179 7.121 -12.795 1.00 0.00 C ATOM 671 OH TYR A 264 17.458 8.368 -12.272 1.00 0.00 O ATOM 0 H TYR A 264 17.544 1.485 -12.854 1.00 0.00 H new ATOM 0 HA TYR A 264 14.875 2.779 -12.884 1.00 0.00 H new ATOM 0 HB2 TYR A 264 17.215 2.756 -14.815 1.00 0.00 H new ATOM 0 HB3 TYR A 264 15.619 3.312 -15.278 1.00 0.00 H new ATOM 0 HD1 TYR A 264 18.104 3.902 -12.475 1.00 0.00 H new ATOM 0 HD2 TYR A 264 15.208 5.647 -15.087 1.00 0.00 H new ATOM 0 HE1 TYR A 264 18.586 6.115 -11.540 1.00 0.00 H new ATOM 0 HE2 TYR A 264 15.705 7.859 -14.152 1.00 0.00 H new ATOM 0 HH TYR A 264 16.901 9.041 -12.716 1.00 0.00 H new ATOM 681 N CYS A 265 13.696 0.861 -13.892 1.00 0.00 N ATOM 682 CA CYS A 265 12.904 -0.263 -14.436 1.00 0.00 C ATOM 683 C CYS A 265 12.840 -0.198 -15.984 1.00 0.00 C ATOM 684 O CYS A 265 13.014 0.898 -16.535 1.00 0.00 O ATOM 685 CB CYS A 265 11.481 -0.244 -13.827 1.00 0.00 C ATOM 686 SG CYS A 265 10.395 1.073 -14.449 1.00 0.00 S ATOM 0 H CYS A 265 13.140 1.524 -13.353 1.00 0.00 H new ATOM 0 HA CYS A 265 13.392 -1.199 -14.164 1.00 0.00 H new ATOM 0 HB2 CYS A 265 11.007 -1.206 -14.020 1.00 0.00 H new ATOM 0 HB3 CYS A 265 11.567 -0.142 -12.745 1.00 0.00 H new ATOM 691 N PRO A 266 12.613 -1.368 -16.696 1.00 0.00 N ATOM 692 CA PRO A 266 12.591 -1.467 -18.189 1.00 0.00 C ATOM 693 C PRO A 266 11.925 -0.280 -18.920 1.00 0.00 C ATOM 694 O PRO A 266 12.517 0.312 -19.834 1.00 0.00 O ATOM 695 CB PRO A 266 11.803 -2.775 -18.422 1.00 0.00 C ATOM 696 CG PRO A 266 12.204 -3.648 -17.276 1.00 0.00 C ATOM 697 CD PRO A 266 12.402 -2.724 -16.092 1.00 0.00 C ATOM 0 HA PRO A 266 13.602 -1.454 -18.597 1.00 0.00 H new ATOM 0 HB2 PRO A 266 10.728 -2.597 -18.431 1.00 0.00 H new ATOM 0 HB3 PRO A 266 12.059 -3.230 -19.379 1.00 0.00 H new ATOM 0 HG2 PRO A 266 11.436 -4.392 -17.065 1.00 0.00 H new ATOM 0 HG3 PRO A 266 13.121 -4.192 -17.503 1.00 0.00 H new ATOM 0 HD2 PRO A 266 11.533 -2.733 -15.434 1.00 0.00 H new ATOM 0 HD3 PRO A 266 13.260 -3.028 -15.492 1.00 0.00 H new ATOM 705 N GLU A 267 10.706 0.070 -18.480 1.00 0.00 N ATOM 706 CA GLU A 267 9.920 1.164 -19.082 1.00 0.00 C ATOM 707 C GLU A 267 10.626 2.537 -18.953 1.00 0.00 C ATOM 708 O GLU A 267 10.593 3.312 -19.901 1.00 0.00 O ATOM 709 CB GLU A 267 8.470 1.230 -18.513 1.00 0.00 C ATOM 710 CG GLU A 267 8.332 1.265 -16.967 1.00 0.00 C ATOM 711 CD GLU A 267 8.078 -0.118 -16.326 1.00 0.00 C ATOM 712 OE1 GLU A 267 9.024 -0.932 -16.228 1.00 0.00 O ATOM 713 OE2 GLU A 267 6.929 -0.397 -15.939 1.00 0.00 O ATOM 0 H GLU A 267 10.238 -0.393 -17.701 1.00 0.00 H new ATOM 0 HA GLU A 267 9.848 0.932 -20.145 1.00 0.00 H new ATOM 0 HB2 GLU A 267 7.985 2.118 -18.919 1.00 0.00 H new ATOM 0 HB3 GLU A 267 7.918 0.367 -18.885 1.00 0.00 H new ATOM 0 HG2 GLU A 267 9.241 1.690 -16.541 1.00 0.00 H new ATOM 0 HG3 GLU A 267 7.513 1.933 -16.701 1.00 0.00 H new ATOM 720 N CYS A 268 11.275 2.811 -17.795 1.00 0.00 N ATOM 721 CA CYS A 268 12.052 4.071 -17.583 1.00 0.00 C ATOM 722 C CYS A 268 13.318 4.098 -18.456 1.00 0.00 C ATOM 723 O CYS A 268 13.632 5.121 -19.081 1.00 0.00 O ATOM 724 CB CYS A 268 12.463 4.267 -16.095 1.00 0.00 C ATOM 725 SG CYS A 268 11.118 4.740 -14.977 1.00 0.00 S ATOM 0 H CYS A 268 11.280 2.182 -16.992 1.00 0.00 H new ATOM 0 HA CYS A 268 11.389 4.887 -17.871 1.00 0.00 H new ATOM 0 HB2 CYS A 268 12.906 3.339 -15.732 1.00 0.00 H new ATOM 0 HB3 CYS A 268 13.239 5.031 -16.047 1.00 0.00 H new ATOM 730 N LYS A 269 14.029 2.960 -18.496 1.00 0.00 N ATOM 731 CA LYS A 269 15.372 2.875 -19.093 1.00 0.00 C ATOM 732 C LYS A 269 15.324 3.099 -20.623 1.00 0.00 C ATOM 733 O LYS A 269 16.264 3.647 -21.216 1.00 0.00 O ATOM 734 CB LYS A 269 16.024 1.513 -18.734 1.00 0.00 C ATOM 735 CG LYS A 269 17.519 1.412 -19.105 1.00 0.00 C ATOM 736 CD LYS A 269 18.157 0.065 -18.710 1.00 0.00 C ATOM 737 CE LYS A 269 19.659 0.001 -19.058 1.00 0.00 C ATOM 738 NZ LYS A 269 20.259 -1.319 -18.736 1.00 0.00 N ATOM 0 H LYS A 269 13.691 2.076 -18.117 1.00 0.00 H new ATOM 0 HA LYS A 269 15.989 3.671 -18.677 1.00 0.00 H new ATOM 0 HB2 LYS A 269 15.914 1.341 -17.663 1.00 0.00 H new ATOM 0 HB3 LYS A 269 15.480 0.717 -19.242 1.00 0.00 H new ATOM 0 HG2 LYS A 269 17.630 1.557 -20.180 1.00 0.00 H new ATOM 0 HG3 LYS A 269 18.063 2.221 -18.616 1.00 0.00 H new ATOM 0 HD2 LYS A 269 18.028 -0.095 -17.640 1.00 0.00 H new ATOM 0 HD3 LYS A 269 17.634 -0.745 -19.219 1.00 0.00 H new ATOM 0 HE2 LYS A 269 19.792 0.208 -20.120 1.00 0.00 H new ATOM 0 HE3 LYS A 269 20.189 0.781 -18.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 269 21.268 -1.312 -18.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 269 20.157 -1.508 -17.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 269 19.773 -2.063 -19.276 1.00 0.00 H new ATOM 752 N ILE A 270 14.209 2.689 -21.248 1.00 0.00 N ATOM 753 CA ILE A 270 13.961 2.899 -22.689 1.00 0.00 C ATOM 754 C ILE A 270 13.212 4.243 -22.900 1.00 0.00 C ATOM 755 O ILE A 270 13.603 5.058 -23.751 1.00 0.00 O ATOM 756 CB ILE A 270 13.165 1.677 -23.331 1.00 0.00 C ATOM 757 CG1 ILE A 270 14.086 0.412 -23.527 1.00 0.00 C ATOM 758 CG2 ILE A 270 12.497 2.052 -24.680 1.00 0.00 C ATOM 759 CD1 ILE A 270 14.643 -0.232 -22.264 1.00 0.00 C ATOM 0 H ILE A 270 13.451 2.201 -20.770 1.00 0.00 H new ATOM 0 HA ILE A 270 14.920 2.950 -23.204 1.00 0.00 H new ATOM 0 HB ILE A 270 12.378 1.428 -22.619 1.00 0.00 H new ATOM 0 HG12 ILE A 270 13.517 -0.342 -24.071 1.00 0.00 H new ATOM 0 HG13 ILE A 270 14.925 0.697 -24.162 1.00 0.00 H new ATOM 0 HG21 ILE A 270 11.967 1.186 -25.077 1.00 0.00 H new ATOM 0 HG22 ILE A 270 11.792 2.868 -24.522 1.00 0.00 H new ATOM 0 HG23 ILE A 270 13.262 2.366 -25.390 1.00 0.00 H new ATOM 0 HD11 ILE A 270 15.259 -1.090 -22.534 1.00 0.00 H new ATOM 0 HD12 ILE A 270 15.250 0.494 -21.723 1.00 0.00 H new ATOM 0 HD13 ILE A 270 13.820 -0.562 -21.630 1.00 0.00 H new ATOM 771 N GLU A 271 12.159 4.483 -22.102 1.00 0.00 N ATOM 772 CA GLU A 271 11.287 5.671 -22.242 1.00 0.00 C ATOM 773 C GLU A 271 11.302 6.493 -20.918 1.00 0.00 C ATOM 774 O GLU A 271 10.548 6.158 -19.979 1.00 0.00 O ATOM 775 CB GLU A 271 9.850 5.216 -22.645 1.00 0.00 C ATOM 776 CG GLU A 271 8.841 6.356 -22.916 1.00 0.00 C ATOM 777 CD GLU A 271 9.207 7.246 -24.120 1.00 0.00 C ATOM 778 OE1 GLU A 271 8.825 6.911 -25.259 1.00 0.00 O ATOM 779 OE2 GLU A 271 9.863 8.296 -23.940 1.00 0.00 O ATOM 780 OXT GLU A 271 12.098 7.457 -20.808 1.00 0.00 O ATOM 0 H GLU A 271 11.884 3.862 -21.341 1.00 0.00 H new ATOM 0 HA GLU A 271 11.658 6.324 -23.032 1.00 0.00 H new ATOM 0 HB2 GLU A 271 9.921 4.598 -23.540 1.00 0.00 H new ATOM 0 HB3 GLU A 271 9.452 4.584 -21.851 1.00 0.00 H new ATOM 0 HG2 GLU A 271 7.855 5.922 -23.085 1.00 0.00 H new ATOM 0 HG3 GLU A 271 8.766 6.980 -22.026 1.00 0.00 H new TER 787 GLU A 271 HETATM 788 ZN ZN A 301 5.396 -8.705 -10.127 1.00 0.00 ZN HETATM 789 ZN ZN A 302 10.500 3.129 -13.407 1.00 0.00 ZN