USER MOD reduce.3.24.130724 H: found=0, std=0, add=153, rem=0, adj=1 USER MOD reduce.3.24.130724 removed 156 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 317 TYR OH : rot 180:sc= 0 USER MOD Single : A 318 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 304 -16.424 10.680 -4.076 1.00 0.00 N ATOM 2 CA GLY A 304 -15.314 9.761 -3.700 1.00 0.00 C ATOM 3 C GLY A 304 -14.140 9.850 -4.654 1.00 0.00 C ATOM 4 O GLY A 304 -14.063 9.088 -5.623 1.00 0.00 O ATOM 0 HA2 GLY A 304 -14.977 9.997 -2.691 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -15.685 8.736 -3.680 1.00 0.00 H new ATOM 10 N PHE A 305 -13.224 10.782 -4.372 1.00 0.00 N ATOM 11 CA PHE A 305 -12.034 10.986 -5.201 1.00 0.00 C ATOM 12 C PHE A 305 -10.731 10.952 -4.374 1.00 0.00 C ATOM 13 O PHE A 305 -9.770 10.314 -4.812 1.00 0.00 O ATOM 14 CB PHE A 305 -12.134 12.302 -5.985 1.00 0.00 C ATOM 15 CG PHE A 305 -13.138 12.267 -7.105 1.00 0.00 C ATOM 16 CD1 PHE A 305 -14.456 12.635 -6.882 1.00 0.00 C ATOM 17 CD2 PHE A 305 -12.764 11.865 -8.377 1.00 0.00 C ATOM 18 CE1 PHE A 305 -15.381 12.604 -7.908 1.00 0.00 C ATOM 19 CE2 PHE A 305 -13.685 11.832 -9.406 1.00 0.00 C ATOM 20 CZ PHE A 305 -14.994 12.203 -9.172 1.00 0.00 C ATOM 0 H PHE A 305 -13.286 11.410 -3.571 1.00 0.00 H new ATOM 0 HA PHE A 305 -11.994 10.156 -5.906 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -12.399 13.105 -5.297 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -11.154 12.545 -6.396 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -14.763 12.949 -5.895 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -11.741 11.574 -8.566 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -16.405 12.893 -7.722 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -13.381 11.516 -10.393 1.00 0.00 H new ATOM 0 HZ PHE A 305 -15.715 12.180 -9.976 1.00 0.00 H new ATOM 30 N PRO A 306 -10.649 11.624 -3.172 1.00 0.00 N ATOM 31 CA PRO A 306 -9.421 11.621 -2.348 1.00 0.00 C ATOM 32 C PRO A 306 -9.225 10.311 -1.582 1.00 0.00 C ATOM 33 O PRO A 306 -10.188 9.577 -1.339 1.00 0.00 O ATOM 34 CB PRO A 306 -9.630 12.783 -1.359 1.00 0.00 C ATOM 35 CG PRO A 306 -10.884 13.472 -1.791 1.00 0.00 C ATOM 36 CD PRO A 306 -11.693 12.439 -2.515 1.00 0.00 C ATOM 0 HA PRO A 306 -8.532 11.727 -2.969 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -9.720 12.414 -0.337 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -8.782 13.468 -1.377 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -11.430 13.864 -0.933 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -10.661 14.318 -2.440 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -12.301 11.846 -1.832 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -12.373 12.889 -3.238 1.00 0.00 H new ATOM 44 N ARG A 307 -7.972 10.034 -1.212 1.00 0.00 N ATOM 45 CA ARG A 307 -7.625 8.820 -0.470 1.00 0.00 C ATOM 46 C ARG A 307 -6.811 9.162 0.774 1.00 0.00 C ATOM 47 O ARG A 307 -5.983 10.077 0.749 1.00 0.00 O ATOM 48 CB ARG A 307 -6.836 7.852 -1.359 1.00 0.00 C ATOM 49 CG ARG A 307 -7.684 7.159 -2.417 1.00 0.00 C ATOM 50 CD ARG A 307 -6.850 6.215 -3.267 1.00 0.00 C ATOM 51 NE ARG A 307 -7.654 5.545 -4.295 1.00 0.00 N ATOM 52 CZ ARG A 307 -7.179 4.657 -5.180 1.00 0.00 C ATOM 53 NH1 ARG A 307 -5.892 4.310 -5.185 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -8.000 4.114 -6.066 1.00 0.00 N ATOM 0 H ARG A 307 -7.176 10.639 -1.416 1.00 0.00 H new ATOM 0 HA ARG A 307 -8.552 8.338 -0.160 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -6.032 8.399 -1.852 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -6.367 7.095 -0.730 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -8.487 6.602 -1.934 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -8.154 7.907 -3.056 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -6.044 6.773 -3.744 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -6.384 5.466 -2.626 1.00 0.00 H new ATOM 0 HE ARG A 307 -8.648 5.771 -4.340 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -5.250 4.722 -4.508 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -5.549 3.633 -5.866 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -8.987 4.372 -6.072 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -7.646 3.438 -6.742 1.00 0.00 H new ATOM 68 N ALA A 308 -7.057 8.417 1.855 1.00 0.00 N ATOM 69 CA ALA A 308 -6.356 8.627 3.123 1.00 0.00 C ATOM 70 C ALA A 308 -5.425 7.456 3.449 1.00 0.00 C ATOM 71 O ALA A 308 -4.305 7.667 3.926 1.00 0.00 O ATOM 72 CB ALA A 308 -7.356 8.844 4.249 1.00 0.00 C ATOM 0 H ALA A 308 -7.740 7.660 1.876 1.00 0.00 H new ATOM 0 HA ALA A 308 -5.740 9.520 3.022 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -6.821 8.999 5.186 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -7.966 9.721 4.030 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -7.999 7.968 4.339 1.00 0.00 H new ATOM 78 N LEU A 309 -5.896 6.229 3.189 1.00 0.00 N ATOM 79 CA LEU A 309 -5.111 5.019 3.449 1.00 0.00 C ATOM 80 C LEU A 309 -4.420 4.528 2.164 1.00 0.00 C ATOM 81 O LEU A 309 -5.098 4.330 1.151 1.00 0.00 O ATOM 82 CB LEU A 309 -6.008 3.908 4.015 1.00 0.00 C ATOM 83 CG LEU A 309 -6.558 4.155 5.426 1.00 0.00 C ATOM 84 CD1 LEU A 309 -7.889 4.888 5.369 1.00 0.00 C ATOM 85 CD2 LEU A 309 -6.704 2.840 6.177 1.00 0.00 C ATOM 0 H LEU A 309 -6.821 6.050 2.797 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.345 5.266 4.184 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -6.849 3.764 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -5.441 2.977 4.023 1.00 0.00 H new ATOM 0 HG LEU A 309 -5.848 4.784 5.963 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -8.258 5.051 6.382 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -7.754 5.849 4.873 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -8.610 4.290 4.812 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -7.095 3.033 7.176 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -7.391 2.188 5.638 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -5.731 2.356 6.256 1.00 0.00 H new ATOM 97 N PRO A 310 -3.059 4.323 2.165 1.00 0.00 N ATOM 98 CA PRO A 310 -2.327 3.844 0.973 1.00 0.00 C ATOM 99 C PRO A 310 -2.677 2.393 0.597 1.00 0.00 C ATOM 100 O PRO A 310 -3.252 1.652 1.400 1.00 0.00 O ATOM 101 CB PRO A 310 -0.842 3.993 1.343 1.00 0.00 C ATOM 102 CG PRO A 310 -0.809 4.781 2.611 1.00 0.00 C ATOM 103 CD PRO A 310 -2.127 4.555 3.294 1.00 0.00 C ATOM 0 HA PRO A 310 -2.596 4.420 0.087 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.374 3.018 1.478 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.293 4.504 0.552 1.00 0.00 H new ATOM 0 HG2 PRO A 310 0.016 4.458 3.246 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.657 5.840 2.404 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.090 3.699 3.968 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.424 5.417 3.891 1.00 0.00 H new ATOM 111 N ALA A 311 -2.314 2.014 -0.637 1.00 0.00 N ATOM 112 CA ALA A 311 -2.635 0.689 -1.201 1.00 0.00 C ATOM 113 C ALA A 311 -1.515 -0.261 -0.899 1.00 0.00 C ATOM 114 O ALA A 311 -1.674 -1.478 -0.771 1.00 0.00 O ATOM 115 CB ALA A 311 -2.885 0.783 -2.701 1.00 0.00 C ATOM 0 H ALA A 311 -1.790 2.614 -1.274 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.551 0.316 -0.742 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.120 -0.206 -3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.722 1.456 -2.889 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.993 1.167 -3.195 1.00 0.00 H new ATOM 121 N TRP A 312 -0.378 0.384 -0.797 1.00 0.00 N ATOM 122 CA TRP A 312 0.907 -0.207 -0.509 1.00 0.00 C ATOM 123 C TRP A 312 1.014 -0.464 0.989 1.00 0.00 C ATOM 124 O TRP A 312 1.916 -1.145 1.484 1.00 0.00 O ATOM 125 CB TRP A 312 1.951 0.797 -1.038 1.00 0.00 C ATOM 126 CG TRP A 312 2.111 2.099 -0.263 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.785 3.340 -0.732 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.627 2.305 1.071 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.048 4.295 0.216 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.557 3.689 1.332 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.128 1.465 2.075 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.964 4.242 2.541 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.527 2.017 3.273 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.441 3.393 3.498 1.00 0.00 C ATOM 0 H TRP A 312 -0.322 1.395 -0.920 1.00 0.00 H new ATOM 0 HA TRP A 312 1.062 -1.174 -0.987 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.919 0.297 -1.064 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.692 1.045 -2.067 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.377 3.541 -1.712 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.890 5.297 0.107 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.200 0.400 1.912 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.905 5.306 2.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.913 1.375 4.051 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.759 3.794 4.449 1.00 0.00 H new ATOM 145 N ALA A 313 0.026 0.103 1.655 1.00 0.00 N ATOM 146 CA ALA A 313 -0.146 0.077 3.091 1.00 0.00 C ATOM 147 C ALA A 313 -0.857 -1.200 3.577 1.00 0.00 C ATOM 148 O ALA A 313 -1.312 -1.274 4.725 1.00 0.00 O ATOM 149 CB ALA A 313 -0.939 1.325 3.428 1.00 0.00 C ATOM 0 H ALA A 313 -0.715 0.620 1.182 1.00 0.00 H new ATOM 0 HA ALA A 313 0.819 0.064 3.598 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.107 1.370 4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.382 2.207 3.110 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.899 1.297 2.912 1.00 0.00 H new ATOM 155 N ARG A 314 -0.923 -2.202 2.695 1.00 0.00 N ATOM 156 CA ARG A 314 -1.556 -3.480 2.998 1.00 0.00 C ATOM 157 C ARG A 314 -0.612 -4.646 2.644 1.00 0.00 C ATOM 158 O ARG A 314 -0.450 -4.971 1.461 1.00 0.00 O ATOM 159 CB ARG A 314 -2.892 -3.614 2.240 1.00 0.00 C ATOM 160 CG ARG A 314 -4.101 -3.060 2.991 1.00 0.00 C ATOM 161 CD ARG A 314 -4.276 -1.562 2.775 1.00 0.00 C ATOM 162 NE ARG A 314 -5.397 -1.025 3.555 1.00 0.00 N ATOM 163 CZ ARG A 314 -6.084 0.083 3.244 1.00 0.00 C ATOM 164 NH1 ARG A 314 -5.783 0.803 2.165 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -7.083 0.474 4.025 1.00 0.00 N ATOM 0 H ARG A 314 -0.538 -2.146 1.752 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.763 -3.518 4.067 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -2.806 -3.099 1.283 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -3.067 -4.667 2.020 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -5.001 -3.580 2.662 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.988 -3.261 4.056 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -3.358 -1.045 3.055 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -4.443 -1.365 1.716 1.00 0.00 H new ATOM 0 HE ARG A 314 -5.674 -1.532 4.396 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -5.017 0.514 1.557 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -6.319 1.643 1.947 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -7.323 -0.068 4.855 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -7.611 1.316 3.795 1.00 0.00 H new ATOM 179 N PRO A 315 0.056 -5.287 3.662 1.00 0.00 N ATOM 180 CA PRO A 315 0.986 -6.429 3.441 1.00 0.00 C ATOM 181 C PRO A 315 0.394 -7.574 2.623 1.00 0.00 C ATOM 182 O PRO A 315 1.112 -8.306 1.933 1.00 0.00 O ATOM 183 CB PRO A 315 1.317 -6.921 4.859 1.00 0.00 C ATOM 184 CG PRO A 315 0.353 -6.230 5.767 1.00 0.00 C ATOM 185 CD PRO A 315 0.005 -4.937 5.096 1.00 0.00 C ATOM 0 HA PRO A 315 1.849 -6.101 2.862 1.00 0.00 H new ATOM 0 HB2 PRO A 315 1.214 -8.004 4.931 1.00 0.00 H new ATOM 0 HB3 PRO A 315 2.346 -6.680 5.126 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -0.537 -6.838 5.926 1.00 0.00 H new ATOM 0 HG3 PRO A 315 0.798 -6.054 6.746 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -0.982 -4.582 5.391 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.715 -4.148 5.345 1.00 0.00 H new ATOM 193 N ASP A 316 -0.911 -7.702 2.726 1.00 0.00 N ATOM 194 CA ASP A 316 -1.680 -8.734 2.017 1.00 0.00 C ATOM 195 C ASP A 316 -2.118 -8.250 0.632 1.00 0.00 C ATOM 196 O ASP A 316 -2.212 -9.047 -0.306 1.00 0.00 O ATOM 197 CB ASP A 316 -2.909 -9.140 2.836 1.00 0.00 C ATOM 198 CG ASP A 316 -2.547 -9.938 4.075 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.315 -9.317 5.133 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.498 -11.183 3.986 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.486 -7.092 3.307 1.00 0.00 H new ATOM 0 HA ASP A 316 -1.031 -9.600 1.888 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -3.456 -8.245 3.132 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -3.579 -9.731 2.211 1.00 0.00 H new ATOM 205 N TYR A 317 -2.378 -6.927 0.514 1.00 0.00 N ATOM 206 CA TYR A 317 -2.810 -6.275 -0.745 1.00 0.00 C ATOM 207 C TYR A 317 -4.162 -6.812 -1.232 1.00 0.00 C ATOM 208 O TYR A 317 -4.319 -8.016 -1.457 1.00 0.00 O ATOM 209 CB TYR A 317 -1.743 -6.422 -1.850 1.00 0.00 C ATOM 210 CG TYR A 317 -1.776 -5.320 -2.891 1.00 0.00 C ATOM 211 CD1 TYR A 317 -1.004 -4.173 -2.742 1.00 0.00 C ATOM 212 CD2 TYR A 317 -2.578 -5.429 -4.019 1.00 0.00 C ATOM 213 CE1 TYR A 317 -1.030 -3.168 -3.689 1.00 0.00 C ATOM 214 CE2 TYR A 317 -2.611 -4.427 -4.970 1.00 0.00 C ATOM 215 CZ TYR A 317 -1.835 -3.300 -4.801 1.00 0.00 C ATOM 216 OH TYR A 317 -1.866 -2.300 -5.747 1.00 0.00 O ATOM 0 H TYR A 317 -2.293 -6.277 1.296 1.00 0.00 H new ATOM 0 HA TYR A 317 -2.932 -5.215 -0.524 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -0.756 -6.441 -1.387 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -1.880 -7.382 -2.348 1.00 0.00 H new ATOM 0 HD1 TYR A 317 -0.374 -4.066 -1.871 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -3.186 -6.311 -4.155 1.00 0.00 H new ATOM 0 HE1 TYR A 317 -0.423 -2.284 -3.559 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -3.241 -4.526 -5.841 1.00 0.00 H new ATOM 0 HH TYR A 317 -2.482 -2.550 -6.467 1.00 0.00 H new ATOM 226 N ASN A 318 -5.127 -5.899 -1.390 1.00 0.00 N ATOM 227 CA ASN A 318 -6.471 -6.252 -1.851 1.00 0.00 C ATOM 228 C ASN A 318 -6.667 -5.852 -3.324 1.00 0.00 C ATOM 229 O ASN A 318 -5.976 -4.947 -3.803 1.00 0.00 O ATOM 230 CB ASN A 318 -7.532 -5.569 -0.979 1.00 0.00 C ATOM 231 CG ASN A 318 -7.603 -6.154 0.420 1.00 0.00 C ATOM 232 OD1 ASN A 318 -8.351 -7.098 0.672 1.00 0.00 O ATOM 233 ND2 ASN A 318 -6.825 -5.592 1.337 1.00 0.00 N ATOM 0 H ASN A 318 -4.999 -4.904 -1.204 1.00 0.00 H new ATOM 0 HA ASN A 318 -6.584 -7.333 -1.767 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -7.311 -4.504 -0.913 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -8.506 -5.663 -1.458 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -6.832 -5.941 2.295 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -6.220 -4.811 1.083 1.00 0.00 H new ATOM 240 N PRO A 319 -7.612 -6.508 -4.077 1.00 0.00 N ATOM 241 CA PRO A 319 -7.864 -6.183 -5.500 1.00 0.00 C ATOM 242 C PRO A 319 -8.418 -4.762 -5.702 1.00 0.00 C ATOM 243 O PRO A 319 -9.226 -4.301 -4.891 1.00 0.00 O ATOM 244 CB PRO A 319 -8.913 -7.217 -5.942 1.00 0.00 C ATOM 245 CG PRO A 319 -8.874 -8.289 -4.910 1.00 0.00 C ATOM 246 CD PRO A 319 -8.494 -7.613 -3.627 1.00 0.00 C ATOM 0 HA PRO A 319 -6.939 -6.217 -6.075 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -9.904 -6.768 -6.004 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -8.680 -7.615 -6.930 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -9.843 -8.780 -4.820 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -8.150 -9.059 -5.175 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -9.368 -7.239 -3.094 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -7.975 -8.293 -2.951 1.00 0.00 H new ATOM 254 N PRO A 320 -7.993 -4.039 -6.787 1.00 0.00 N ATOM 255 CA PRO A 320 -8.462 -2.668 -7.066 1.00 0.00 C ATOM 256 C PRO A 320 -9.923 -2.615 -7.532 1.00 0.00 C ATOM 257 O PRO A 320 -10.293 -3.232 -8.537 1.00 0.00 O ATOM 258 CB PRO A 320 -7.516 -2.179 -8.170 1.00 0.00 C ATOM 259 CG PRO A 320 -7.040 -3.414 -8.856 1.00 0.00 C ATOM 260 CD PRO A 320 -7.013 -4.495 -7.808 1.00 0.00 C ATOM 0 HA PRO A 320 -8.443 -2.049 -6.169 1.00 0.00 H new ATOM 0 HB2 PRO A 320 -8.032 -1.517 -8.865 1.00 0.00 H new ATOM 0 HB3 PRO A 320 -6.682 -1.615 -7.752 1.00 0.00 H new ATOM 0 HG2 PRO A 320 -7.705 -3.684 -9.676 1.00 0.00 H new ATOM 0 HG3 PRO A 320 -6.049 -3.263 -9.285 1.00 0.00 H new ATOM 0 HD2 PRO A 320 -7.294 -5.462 -8.226 1.00 0.00 H new ATOM 0 HD3 PRO A 320 -6.017 -4.610 -7.380 1.00 0.00 H new ATOM 268 N LEU A 321 -10.739 -1.878 -6.778 1.00 0.00 N ATOM 269 CA LEU A 321 -12.161 -1.718 -7.081 1.00 0.00 C ATOM 270 C LEU A 321 -12.541 -0.238 -7.097 1.00 0.00 C ATOM 271 O LEU A 321 -12.203 0.506 -6.172 1.00 0.00 O ATOM 272 CB LEU A 321 -13.011 -2.476 -6.049 1.00 0.00 C ATOM 273 CG LEU A 321 -14.429 -2.863 -6.501 1.00 0.00 C ATOM 274 CD1 LEU A 321 -14.418 -4.185 -7.260 1.00 0.00 C ATOM 275 CD2 LEU A 321 -15.363 -2.943 -5.303 1.00 0.00 C ATOM 0 H LEU A 321 -10.434 -1.377 -5.943 1.00 0.00 H new ATOM 0 HA LEU A 321 -12.355 -2.135 -8.069 1.00 0.00 H new ATOM 0 HB2 LEU A 321 -12.480 -3.385 -5.767 1.00 0.00 H new ATOM 0 HB3 LEU A 321 -13.091 -1.862 -5.152 1.00 0.00 H new ATOM 0 HG LEU A 321 -14.794 -2.089 -7.177 1.00 0.00 H new ATOM 0 HD11 LEU A 321 -15.433 -4.436 -7.568 1.00 0.00 H new ATOM 0 HD12 LEU A 321 -13.783 -4.093 -8.141 1.00 0.00 H new ATOM 0 HD13 LEU A 321 -14.030 -4.972 -6.614 1.00 0.00 H new ATOM 0 HD21 LEU A 321 -16.363 -3.218 -5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 321 -14.995 -3.695 -4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 321 -15.401 -1.974 -4.806 1.00 0.00 H new ATOM 287 N VAL A 322 -13.246 0.173 -8.156 1.00 0.00 N ATOM 288 CA VAL A 322 -13.682 1.564 -8.315 1.00 0.00 C ATOM 289 C VAL A 322 -15.133 1.638 -8.798 1.00 0.00 C ATOM 290 O VAL A 322 -15.513 0.947 -9.748 1.00 0.00 O ATOM 291 CB VAL A 322 -12.763 2.374 -9.279 1.00 0.00 C ATOM 292 CG1 VAL A 322 -11.466 2.756 -8.580 1.00 0.00 C ATOM 293 CG2 VAL A 322 -12.460 1.615 -10.577 1.00 0.00 C ATOM 0 H VAL A 322 -13.528 -0.442 -8.920 1.00 0.00 H new ATOM 0 HA VAL A 322 -13.609 2.019 -7.327 1.00 0.00 H new ATOM 0 HB VAL A 322 -13.308 3.278 -9.553 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -10.835 3.321 -9.266 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -11.690 3.368 -7.706 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -10.942 1.853 -8.266 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -11.817 2.223 -11.213 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -11.956 0.678 -10.341 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -13.392 1.404 -11.101 1.00 0.00 H new ATOM 303 N GLU A 323 -15.927 2.482 -8.131 1.00 0.00 N ATOM 304 CA GLU A 323 -17.339 2.662 -8.475 1.00 0.00 C ATOM 305 C GLU A 323 -17.608 4.097 -8.932 1.00 0.00 C ATOM 306 O GLU A 323 -17.369 5.031 -8.138 1.00 0.00 O ATOM 307 CB GLU A 323 -18.236 2.309 -7.281 1.00 0.00 C ATOM 308 CG GLU A 323 -18.322 0.817 -6.996 1.00 0.00 C ATOM 309 CD GLU A 323 -19.214 0.501 -5.811 1.00 0.00 C ATOM 310 OE1 GLU A 323 -18.698 0.457 -4.675 1.00 0.00 O ATOM 311 OE2 GLU A 323 -20.428 0.298 -6.020 1.00 0.00 O1- ATOM 312 OXT GLU A 323 -18.057 4.272 -10.084 1.00 0.00 O1- ATOM 0 H GLU A 323 -15.613 3.053 -7.346 1.00 0.00 H new ATOM 0 HA GLU A 323 -17.574 1.988 -9.298 1.00 0.00 H new ATOM 0 HB2 GLU A 323 -17.860 2.818 -6.393 1.00 0.00 H new ATOM 0 HB3 GLU A 323 -19.239 2.692 -7.467 1.00 0.00 H new ATOM 0 HG2 GLU A 323 -18.702 0.303 -7.879 1.00 0.00 H new ATOM 0 HG3 GLU A 323 -17.321 0.429 -6.807 1.00 0.00 H new TER 319 GLU A 323