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= -0.0513 X(o=-0.051,f=-0.44) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 304 -10.139 13.473 13.952 1.00 0.00 N ATOM 2 CA GLY A 304 -10.418 12.375 14.918 1.00 0.00 C ATOM 3 C GLY A 304 -10.023 11.014 14.380 1.00 0.00 C ATOM 4 O GLY A 304 -9.277 10.278 15.032 1.00 0.00 O ATOM 0 HA2 GLY A 304 -9.879 12.566 15.846 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -11.480 12.371 15.162 1.00 0.00 H new ATOM 10 N PHE A 305 -10.529 10.686 13.187 1.00 0.00 N ATOM 11 CA PHE A 305 -10.237 9.405 12.539 1.00 0.00 C ATOM 12 C PHE A 305 -9.609 9.623 11.150 1.00 0.00 C ATOM 13 O PHE A 305 -9.787 10.698 10.567 1.00 0.00 O ATOM 14 CB PHE A 305 -11.517 8.571 12.412 1.00 0.00 C ATOM 15 CG PHE A 305 -12.048 8.066 13.724 1.00 0.00 C ATOM 16 CD1 PHE A 305 -11.642 6.838 14.226 1.00 0.00 C ATOM 17 CD2 PHE A 305 -12.955 8.817 14.456 1.00 0.00 C ATOM 18 CE1 PHE A 305 -12.130 6.372 15.432 1.00 0.00 C ATOM 19 CE2 PHE A 305 -13.445 8.354 15.662 1.00 0.00 C ATOM 20 CZ PHE A 305 -13.032 7.130 16.151 1.00 0.00 C ATOM 0 H PHE A 305 -11.146 11.294 12.649 1.00 0.00 H new ATOM 0 HA PHE A 305 -9.521 8.866 13.159 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -12.285 9.174 11.928 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -11.321 7.721 11.759 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -10.937 6.240 13.668 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -13.282 9.775 14.079 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -11.806 5.415 15.812 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -14.151 8.949 16.222 1.00 0.00 H new ATOM 0 HZ PHE A 305 -13.414 6.767 17.094 1.00 0.00 H new ATOM 30 N PRO A 306 -8.864 8.615 10.581 1.00 0.00 N ATOM 31 CA PRO A 306 -8.233 8.746 9.251 1.00 0.00 C ATOM 32 C PRO A 306 -9.243 8.666 8.106 1.00 0.00 C ATOM 33 O PRO A 306 -10.333 8.108 8.268 1.00 0.00 O ATOM 34 CB PRO A 306 -7.261 7.553 9.175 1.00 0.00 C ATOM 35 CG PRO A 306 -7.237 6.955 10.542 1.00 0.00 C ATOM 36 CD PRO A 306 -8.561 7.289 11.166 1.00 0.00 C ATOM 0 HA PRO A 306 -7.749 9.717 9.143 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -7.594 6.824 8.436 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -6.265 7.879 8.874 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -7.091 5.876 10.493 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -6.415 7.362 11.131 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -9.324 6.552 10.918 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -8.499 7.330 12.253 1.00 0.00 H new ATOM 44 N ARG A 307 -8.866 9.229 6.953 1.00 0.00 N ATOM 45 CA ARG A 307 -9.725 9.232 5.766 1.00 0.00 C ATOM 46 C ARG A 307 -9.010 8.618 4.562 1.00 0.00 C ATOM 47 O ARG A 307 -9.607 7.841 3.812 1.00 0.00 O ATOM 48 CB ARG A 307 -10.181 10.659 5.434 1.00 0.00 C ATOM 49 CG ARG A 307 -11.225 11.213 6.393 1.00 0.00 C ATOM 50 CD ARG A 307 -11.640 12.625 6.011 1.00 0.00 C ATOM 51 NE ARG A 307 -12.649 13.168 6.928 1.00 0.00 N ATOM 52 CZ ARG A 307 -13.222 14.374 6.805 1.00 0.00 C ATOM 53 NH1 ARG A 307 -12.901 15.191 5.803 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -14.125 14.763 7.694 1.00 0.00 N ATOM 0 H ARG A 307 -7.967 9.691 6.817 1.00 0.00 H new ATOM 0 HA ARG A 307 -10.601 8.623 5.990 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -9.312 11.317 5.438 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -10.587 10.674 4.423 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -12.100 10.563 6.394 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -10.826 11.212 7.407 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -10.764 13.273 6.011 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -12.036 12.624 4.995 1.00 0.00 H new ATOM 0 HE ARG A 307 -12.935 12.586 7.715 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -12.208 14.903 5.112 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -13.348 16.105 5.727 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -14.380 14.146 8.465 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -14.565 15.679 7.607 1.00 0.00 H new ATOM 68 N ALA A 308 -7.731 8.975 4.385 1.00 0.00 N ATOM 69 CA ALA A 308 -6.924 8.466 3.276 1.00 0.00 C ATOM 70 C ALA A 308 -5.966 7.377 3.746 1.00 0.00 C ATOM 71 O ALA A 308 -5.220 7.568 4.711 1.00 0.00 O ATOM 72 CB ALA A 308 -6.154 9.603 2.620 1.00 0.00 C ATOM 0 H ALA A 308 -7.234 9.618 5.001 1.00 0.00 H new ATOM 0 HA ALA A 308 -7.598 8.026 2.541 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -5.557 9.211 1.796 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -6.855 10.345 2.239 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -5.497 10.069 3.354 1.00 0.00 H new ATOM 78 N LEU A 309 -5.999 6.234 3.052 1.00 0.00 N ATOM 79 CA LEU A 309 -5.140 5.094 3.376 1.00 0.00 C ATOM 80 C LEU A 309 -4.432 4.583 2.107 1.00 0.00 C ATOM 81 O LEU A 309 -5.097 4.392 1.085 1.00 0.00 O ATOM 82 CB LEU A 309 -5.974 3.970 4.009 1.00 0.00 C ATOM 83 CG LEU A 309 -5.210 3.005 4.928 1.00 0.00 C ATOM 84 CD1 LEU A 309 -6.121 2.492 6.033 1.00 0.00 C ATOM 85 CD2 LEU A 309 -4.638 1.837 4.134 1.00 0.00 C ATOM 0 H LEU A 309 -6.617 6.075 2.256 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.383 5.416 4.091 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -6.783 4.423 4.582 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -6.435 3.391 3.209 1.00 0.00 H new ATOM 0 HG LEU A 309 -4.382 3.551 5.379 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -5.565 1.809 6.676 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.484 3.332 6.625 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.968 1.966 5.592 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -4.102 1.168 4.807 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -5.450 1.293 3.652 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -3.953 2.214 3.375 1.00 0.00 H new ATOM 97 N PRO A 310 -3.077 4.348 2.135 1.00 0.00 N ATOM 98 CA PRO A 310 -2.335 3.854 0.955 1.00 0.00 C ATOM 99 C PRO A 310 -2.689 2.402 0.587 1.00 0.00 C ATOM 100 O PRO A 310 -3.273 1.669 1.389 1.00 0.00 O ATOM 101 CB PRO A 310 -0.852 3.999 1.338 1.00 0.00 C ATOM 102 CG PRO A 310 -0.826 4.761 2.624 1.00 0.00 C ATOM 103 CD PRO A 310 -2.161 4.552 3.281 1.00 0.00 C ATOM 0 HA PRO A 310 -2.592 4.424 0.062 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.383 3.022 1.455 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.299 4.527 0.561 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -0.020 4.407 3.266 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.647 5.821 2.442 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.151 3.689 3.946 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.453 5.414 3.881 1.00 0.00 H new ATOM 111 N ALA A 311 -2.318 2.016 -0.644 1.00 0.00 N ATOM 112 CA ALA A 311 -2.637 0.689 -1.203 1.00 0.00 C ATOM 113 C ALA A 311 -1.516 -0.261 -0.895 1.00 0.00 C ATOM 114 O ALA A 311 -1.676 -1.478 -0.761 1.00 0.00 O ATOM 115 CB ALA A 311 -2.884 0.777 -2.704 1.00 0.00 C ATOM 0 H ALA A 311 -1.789 2.613 -1.280 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.553 0.317 -0.744 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.117 -0.214 -3.093 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.721 1.449 -2.896 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.991 1.160 -3.198 1.00 0.00 H new ATOM 121 N TRP A 312 -0.379 0.386 -0.794 1.00 0.00 N ATOM 122 CA TRP A 312 0.906 -0.206 -0.505 1.00 0.00 C ATOM 123 C TRP A 312 1.016 -0.462 0.993 1.00 0.00 C ATOM 124 O TRP A 312 1.918 -1.144 1.487 1.00 0.00 O ATOM 125 CB TRP A 312 1.948 0.799 -1.036 1.00 0.00 C ATOM 126 CG TRP A 312 2.110 2.100 -0.259 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.778 3.340 -0.723 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.633 2.303 1.072 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.042 4.294 0.227 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.560 3.687 1.337 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.143 1.463 2.070 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.974 4.237 2.545 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.548 2.012 3.267 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.460 3.388 3.497 1.00 0.00 C ATOM 0 H TRP A 312 -0.323 1.397 -0.918 1.00 0.00 H new ATOM 0 HA TRP A 312 1.060 -1.175 -0.980 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.916 0.299 -1.066 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.685 1.048 -2.064 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.365 3.542 -1.701 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.878 5.295 0.122 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.218 0.399 1.903 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.913 5.300 2.724 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.940 1.368 4.041 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.783 3.787 4.447 1.00 0.00 H new ATOM 145 N ALA A 313 0.026 0.100 1.661 1.00 0.00 N ATOM 146 CA ALA A 313 -0.146 0.075 3.096 1.00 0.00 C ATOM 147 C ALA A 313 -0.871 -1.201 3.571 1.00 0.00 C ATOM 148 O ALA A 313 -1.583 -1.193 4.584 1.00 0.00 O ATOM 149 CB ALA A 313 -0.928 1.333 3.431 1.00 0.00 C ATOM 0 H ALA A 313 -0.718 0.613 1.189 1.00 0.00 H new ATOM 0 HA ALA A 313 0.814 0.055 3.611 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.096 1.381 4.507 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.362 2.209 3.113 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.888 1.313 2.914 1.00 0.00 H new ATOM 155 N ARG A 314 -0.656 -2.299 2.836 1.00 0.00 N ATOM 156 CA ARG A 314 -1.265 -3.586 3.139 1.00 0.00 C ATOM 157 C ARG A 314 -0.190 -4.691 3.171 1.00 0.00 C ATOM 158 O ARG A 314 0.327 -5.074 2.115 1.00 0.00 O ATOM 159 CB ARG A 314 -2.354 -3.925 2.110 1.00 0.00 C ATOM 160 CG ARG A 314 -3.643 -3.137 2.296 1.00 0.00 C ATOM 161 CD ARG A 314 -4.706 -3.565 1.297 1.00 0.00 C ATOM 162 NE ARG A 314 -5.957 -2.821 1.473 1.00 0.00 N ATOM 163 CZ ARG A 314 -7.116 -3.119 0.865 1.00 0.00 C ATOM 164 NH1 ARG A 314 -7.209 -4.151 0.027 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -8.189 -2.377 1.100 1.00 0.00 N ATOM 0 H ARG A 314 -0.052 -2.313 2.014 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.731 -3.525 4.122 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -1.966 -3.737 1.109 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -2.578 -4.990 2.170 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -4.016 -3.281 3.310 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.440 -2.072 2.179 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -4.333 -3.413 0.284 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -4.900 -4.632 1.409 1.00 0.00 H new ATOM 0 HE ARG A 314 -5.946 -2.019 2.103 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -6.391 -4.730 -0.162 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -8.098 -4.362 -0.426 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -8.131 -1.585 1.740 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -9.073 -2.598 0.641 1.00 0.00 H new ATOM 179 N PRO A 315 0.195 -5.200 4.385 1.00 0.00 N ATOM 180 CA PRO A 315 1.213 -6.273 4.542 1.00 0.00 C ATOM 181 C PRO A 315 0.951 -7.523 3.703 1.00 0.00 C ATOM 182 O PRO A 315 1.878 -8.246 3.327 1.00 0.00 O ATOM 183 CB PRO A 315 1.149 -6.633 6.035 1.00 0.00 C ATOM 184 CG PRO A 315 -0.062 -5.944 6.572 1.00 0.00 C ATOM 185 CD PRO A 315 -0.278 -4.742 5.704 1.00 0.00 C ATOM 0 HA PRO A 315 2.184 -5.915 4.199 1.00 0.00 H new ATOM 0 HB2 PRO A 315 1.078 -7.712 6.174 1.00 0.00 H new ATOM 0 HB3 PRO A 315 2.048 -6.303 6.555 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -0.929 -6.604 6.546 1.00 0.00 H new ATOM 0 HG3 PRO A 315 0.085 -5.652 7.612 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.327 -4.446 5.677 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.287 -3.880 6.059 1.00 0.00 H new ATOM 193 N ASP A 316 -0.317 -7.743 3.428 1.00 0.00 N ATOM 194 CA ASP A 316 -0.785 -8.887 2.627 1.00 0.00 C ATOM 195 C ASP A 316 -0.710 -8.595 1.119 1.00 0.00 C ATOM 196 O ASP A 316 -0.984 -9.472 0.293 1.00 0.00 O ATOM 197 CB ASP A 316 -2.222 -9.252 3.018 1.00 0.00 C ATOM 198 CG ASP A 316 -2.312 -9.868 4.403 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.217 -11.108 4.509 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.480 -9.108 5.380 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.070 -7.135 3.751 1.00 0.00 H new ATOM 0 HA ASP A 316 -0.125 -9.729 2.837 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -2.843 -8.357 2.982 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -2.627 -9.951 2.286 1.00 0.00 H new ATOM 205 N TYR A 317 -0.327 -7.358 0.778 1.00 0.00 N ATOM 206 CA TYR A 317 -0.203 -6.921 -0.610 1.00 0.00 C ATOM 207 C TYR A 317 1.272 -6.730 -0.972 1.00 0.00 C ATOM 208 O TYR A 317 1.987 -5.960 -0.323 1.00 0.00 O ATOM 209 CB TYR A 317 -0.990 -5.615 -0.816 1.00 0.00 C ATOM 210 CG TYR A 317 -1.143 -5.188 -2.266 1.00 0.00 C ATOM 211 CD1 TYR A 317 -0.271 -4.265 -2.830 1.00 0.00 C ATOM 212 CD2 TYR A 317 -2.159 -5.702 -3.062 1.00 0.00 C ATOM 213 CE1 TYR A 317 -0.404 -3.869 -4.146 1.00 0.00 C ATOM 214 CE2 TYR A 317 -2.298 -5.311 -4.381 1.00 0.00 C ATOM 215 CZ TYR A 317 -1.418 -4.393 -4.917 1.00 0.00 C ATOM 216 OH TYR A 317 -1.555 -4.001 -6.230 1.00 0.00 O ATOM 0 H TYR A 317 -0.095 -6.635 1.460 1.00 0.00 H new ATOM 0 HA TYR A 317 -0.619 -7.685 -1.267 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -1.982 -5.732 -0.379 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -0.492 -4.816 -0.267 1.00 0.00 H new ATOM 0 HD1 TYR A 317 0.524 -3.850 -2.229 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -2.851 -6.418 -2.644 1.00 0.00 H new ATOM 0 HE1 TYR A 317 0.284 -3.152 -4.569 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -3.091 -5.722 -4.988 1.00 0.00 H new ATOM 0 HH TYR A 317 -2.319 -4.465 -6.632 1.00 0.00 H new ATOM 226 N ASN A 318 1.709 -7.448 -2.009 1.00 0.00 N ATOM 227 CA ASN A 318 3.092 -7.378 -2.481 1.00 0.00 C ATOM 228 C ASN A 318 3.200 -6.421 -3.686 1.00 0.00 C ATOM 229 O ASN A 318 2.289 -6.395 -4.517 1.00 0.00 O ATOM 230 CB ASN A 318 3.585 -8.778 -2.872 1.00 0.00 C ATOM 231 CG ASN A 318 5.092 -8.926 -2.761 1.00 0.00 C ATOM 232 OD1 ASN A 318 5.825 -8.672 -3.716 1.00 0.00 O ATOM 233 ND2 ASN A 318 5.560 -9.338 -1.588 1.00 0.00 N ATOM 0 H ASN A 318 1.120 -8.089 -2.541 1.00 0.00 H new ATOM 0 HA ASN A 318 3.718 -6.994 -1.675 1.00 0.00 H new ATOM 0 HB2 ASN A 318 3.104 -9.519 -2.233 1.00 0.00 H new ATOM 0 HB3 ASN A 318 3.278 -8.993 -3.896 1.00 0.00 H new ATOM 0 HD21 ASN A 318 6.564 -9.455 -1.452 1.00 0.00 H new ATOM 0 HD22 ASN A 318 4.915 -9.537 -0.823 1.00 0.00 H new ATOM 240 N PRO A 319 4.308 -5.613 -3.811 1.00 0.00 N ATOM 241 CA PRO A 319 4.482 -4.674 -4.942 1.00 0.00 C ATOM 242 C PRO A 319 4.740 -5.396 -6.281 1.00 0.00 C ATOM 243 O PRO A 319 5.546 -6.329 -6.317 1.00 0.00 O ATOM 244 CB PRO A 319 5.719 -3.843 -4.554 1.00 0.00 C ATOM 245 CG PRO A 319 5.969 -4.137 -3.114 1.00 0.00 C ATOM 246 CD PRO A 319 5.459 -5.527 -2.881 1.00 0.00 C ATOM 0 HA PRO A 319 3.582 -4.080 -5.098 1.00 0.00 H new ATOM 0 HB2 PRO A 319 6.580 -4.115 -5.164 1.00 0.00 H new ATOM 0 HB3 PRO A 319 5.541 -2.779 -4.711 1.00 0.00 H new ATOM 0 HG2 PRO A 319 7.031 -4.067 -2.880 1.00 0.00 H new ATOM 0 HG3 PRO A 319 5.454 -3.420 -2.474 1.00 0.00 H new ATOM 0 HD2 PRO A 319 6.216 -6.279 -3.104 1.00 0.00 H new ATOM 0 HD3 PRO A 319 5.155 -5.678 -1.845 1.00 0.00 H new ATOM 254 N PRO A 320 4.058 -4.996 -7.405 1.00 0.00 N ATOM 255 CA PRO A 320 4.259 -5.627 -8.720 1.00 0.00 C ATOM 256 C PRO A 320 5.539 -5.148 -9.417 1.00 0.00 C ATOM 257 O PRO A 320 5.636 -3.992 -9.849 1.00 0.00 O ATOM 258 CB PRO A 320 3.014 -5.216 -9.533 1.00 0.00 C ATOM 259 CG PRO A 320 2.141 -4.440 -8.600 1.00 0.00 C ATOM 260 CD PRO A 320 3.030 -3.941 -7.497 1.00 0.00 C ATOM 0 HA PRO A 320 4.376 -6.707 -8.625 1.00 0.00 H new ATOM 0 HB2 PRO A 320 3.295 -4.612 -10.396 1.00 0.00 H new ATOM 0 HB3 PRO A 320 2.492 -6.093 -9.915 1.00 0.00 H new ATOM 0 HG2 PRO A 320 1.662 -3.609 -9.118 1.00 0.00 H new ATOM 0 HG3 PRO A 320 1.344 -5.068 -8.202 1.00 0.00 H new ATOM 0 HD2 PRO A 320 3.466 -2.971 -7.736 1.00 0.00 H new ATOM 0 HD3 PRO A 320 2.485 -3.824 -6.560 1.00 0.00 H new ATOM 268 N LEU A 321 6.520 -6.049 -9.497 1.00 0.00 N ATOM 269 CA LEU A 321 7.804 -5.755 -10.142 1.00 0.00 C ATOM 270 C LEU A 321 7.820 -6.269 -11.579 1.00 0.00 C ATOM 271 O LEU A 321 7.233 -7.313 -11.879 1.00 0.00 O ATOM 272 CB LEU A 321 8.961 -6.380 -9.355 1.00 0.00 C ATOM 273 CG LEU A 321 9.278 -5.716 -8.011 1.00 0.00 C ATOM 274 CD1 LEU A 321 8.541 -6.412 -6.877 1.00 0.00 C ATOM 275 CD2 LEU A 321 10.779 -5.723 -7.756 1.00 0.00 C ATOM 0 H LEU A 321 6.450 -6.995 -9.121 1.00 0.00 H new ATOM 0 HA LEU A 321 7.930 -4.672 -10.155 1.00 0.00 H new ATOM 0 HB2 LEU A 321 8.731 -7.430 -9.176 1.00 0.00 H new ATOM 0 HB3 LEU A 321 9.857 -6.351 -9.975 1.00 0.00 H new ATOM 0 HG LEU A 321 8.938 -4.681 -8.052 1.00 0.00 H new ATOM 0 HD11 LEU A 321 8.781 -5.923 -5.933 1.00 0.00 H new ATOM 0 HD12 LEU A 321 7.467 -6.355 -7.052 1.00 0.00 H new ATOM 0 HD13 LEU A 321 8.846 -7.458 -6.832 1.00 0.00 H new ATOM 0 HD21 LEU A 321 10.987 -5.248 -6.797 1.00 0.00 H new ATOM 0 HD22 LEU A 321 11.140 -6.751 -7.737 1.00 0.00 H new ATOM 0 HD23 LEU A 321 11.286 -5.175 -8.550 1.00 0.00 H new ATOM 287 N VAL A 322 8.499 -5.524 -12.457 1.00 0.00 N ATOM 288 CA VAL A 322 8.606 -5.887 -13.876 1.00 0.00 C ATOM 289 C VAL A 322 10.018 -5.631 -14.409 1.00 0.00 C ATOM 290 O VAL A 322 10.598 -4.570 -14.160 1.00 0.00 O ATOM 291 CB VAL A 322 7.564 -5.144 -14.765 1.00 0.00 C ATOM 292 CG1 VAL A 322 6.187 -5.772 -14.605 1.00 0.00 C ATOM 293 CG2 VAL A 322 7.498 -3.643 -14.461 1.00 0.00 C ATOM 0 H VAL A 322 8.985 -4.662 -12.210 1.00 0.00 H new ATOM 0 HA VAL A 322 8.390 -6.954 -13.933 1.00 0.00 H new ATOM 0 HB VAL A 322 7.894 -5.250 -15.798 1.00 0.00 H new ATOM 0 HG11 VAL A 322 5.470 -5.242 -15.232 1.00 0.00 H new ATOM 0 HG12 VAL A 322 6.227 -6.819 -14.905 1.00 0.00 H new ATOM 0 HG13 VAL A 322 5.876 -5.705 -13.563 1.00 0.00 H new ATOM 0 HG21 VAL A 322 6.757 -3.173 -15.108 1.00 0.00 H new ATOM 0 HG22 VAL A 322 7.216 -3.495 -13.419 1.00 0.00 H new ATOM 0 HG23 VAL A 322 8.474 -3.192 -14.640 1.00 0.00 H new ATOM 303 N GLU A 323 10.553 -6.612 -15.141 1.00 0.00 N ATOM 304 CA GLU A 323 11.893 -6.514 -15.720 1.00 0.00 C ATOM 305 C GLU A 323 11.863 -6.823 -17.217 1.00 0.00 C ATOM 306 O GLU A 323 11.463 -7.949 -17.584 1.00 0.00 O ATOM 307 CB GLU A 323 12.866 -7.462 -15.000 1.00 0.00 C ATOM 308 CG GLU A 323 13.245 -7.020 -13.588 1.00 0.00 C ATOM 309 CD GLU A 323 14.306 -5.934 -13.572 1.00 0.00 C ATOM 310 OE1 GLU A 323 15.506 -6.276 -13.535 1.00 0.00 O ATOM 311 OE2 GLU A 323 13.935 -4.741 -13.595 1.00 0.00 O1- ATOM 312 OXT GLU A 323 12.240 -5.934 -18.009 1.00 0.00 O1- ATOM 0 H GLU A 323 10.074 -7.488 -15.347 1.00 0.00 H new ATOM 0 HA GLU A 323 12.243 -5.490 -15.587 1.00 0.00 H new ATOM 0 HB2 GLU A 323 12.418 -8.454 -14.949 1.00 0.00 H new ATOM 0 HB3 GLU A 323 13.774 -7.553 -15.596 1.00 0.00 H new ATOM 0 HG2 GLU A 323 12.354 -6.658 -13.075 1.00 0.00 H new ATOM 0 HG3 GLU A 323 13.607 -7.882 -13.028 1.00 0.00 H new TER 319 GLU A 323