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 -12.700 15.347 0.494 1.00 0.00 N ATOM 2 CA GLY A 304 -13.273 14.247 1.318 1.00 0.00 C ATOM 3 C GLY A 304 -12.745 14.251 2.740 1.00 0.00 C ATOM 4 O GLY A 304 -13.340 14.879 3.623 1.00 0.00 O ATOM 0 HA2 GLY A 304 -14.359 14.339 1.337 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -13.042 13.290 0.851 1.00 0.00 H new ATOM 10 N PHE A 305 -11.630 13.547 2.953 1.00 0.00 N ATOM 11 CA PHE A 305 -11.006 13.457 4.273 1.00 0.00 C ATOM 12 C PHE A 305 -9.516 13.845 4.191 1.00 0.00 C ATOM 13 O PHE A 305 -8.864 13.518 3.196 1.00 0.00 O ATOM 14 CB PHE A 305 -11.155 12.033 4.824 1.00 0.00 C ATOM 15 CG PHE A 305 -11.157 11.949 6.330 1.00 0.00 C ATOM 16 CD1 PHE A 305 -9.992 11.660 7.022 1.00 0.00 C ATOM 17 CD2 PHE A 305 -12.325 12.157 7.049 1.00 0.00 C ATOM 18 CE1 PHE A 305 -9.991 11.580 8.402 1.00 0.00 C ATOM 19 CE2 PHE A 305 -12.329 12.079 8.429 1.00 0.00 C ATOM 20 CZ PHE A 305 -11.160 11.790 9.106 1.00 0.00 C ATOM 0 H PHE A 305 -11.140 13.029 2.223 1.00 0.00 H new ATOM 0 HA PHE A 305 -11.506 14.152 4.947 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -12.084 11.605 4.446 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -10.341 11.419 4.438 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -9.074 11.495 6.477 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -13.242 12.382 6.524 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -9.076 11.353 8.929 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -13.245 12.244 8.977 1.00 0.00 H new ATOM 0 HZ PHE A 305 -11.161 11.728 10.184 1.00 0.00 H new ATOM 30 N PRO A 306 -8.943 14.546 5.228 1.00 0.00 N ATOM 31 CA PRO A 306 -7.515 14.954 5.222 1.00 0.00 C ATOM 32 C PRO A 306 -6.542 13.767 5.209 1.00 0.00 C ATOM 33 O PRO A 306 -5.480 13.838 4.583 1.00 0.00 O ATOM 34 CB PRO A 306 -7.350 15.751 6.526 1.00 0.00 C ATOM 35 CG PRO A 306 -8.728 16.128 6.936 1.00 0.00 C ATOM 36 CD PRO A 306 -9.618 15.016 6.463 1.00 0.00 C ATOM 0 HA PRO A 306 -7.280 15.520 4.321 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -6.862 15.151 7.294 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -6.731 16.635 6.371 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -8.794 16.248 8.017 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -9.021 17.079 6.491 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -9.699 14.222 7.205 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -10.630 15.368 6.260 1.00 0.00 H new ATOM 44 N ARG A 307 -6.916 12.683 5.902 1.00 0.00 N ATOM 45 CA ARG A 307 -6.089 11.476 5.978 1.00 0.00 C ATOM 46 C ARG A 307 -6.570 10.424 4.985 1.00 0.00 C ATOM 47 O ARG A 307 -7.776 10.192 4.852 1.00 0.00 O ATOM 48 CB ARG A 307 -6.105 10.898 7.397 1.00 0.00 C ATOM 49 CG ARG A 307 -5.310 11.715 8.405 1.00 0.00 C ATOM 50 CD ARG A 307 -5.368 11.095 9.793 1.00 0.00 C ATOM 51 NE ARG A 307 -4.609 11.876 10.777 1.00 0.00 N ATOM 52 CZ ARG A 307 -4.505 11.570 12.078 1.00 0.00 C ATOM 53 NH1 ARG A 307 -5.108 10.495 12.584 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -3.792 12.350 12.879 1.00 0.00 N ATOM 0 H ARG A 307 -7.792 12.620 6.420 1.00 0.00 H new ATOM 0 HA ARG A 307 -5.067 11.755 5.722 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -7.138 10.825 7.737 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -5.706 9.884 7.370 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -4.272 11.786 8.080 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -5.703 12.731 8.442 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -6.407 11.020 10.113 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -4.973 10.080 9.753 1.00 0.00 H new ATOM 0 HE ARG A 307 -4.126 12.712 10.447 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -5.661 9.888 11.979 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -5.017 10.279 13.577 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -3.327 13.177 12.504 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -3.709 12.123 13.870 1.00 0.00 H new ATOM 68 N ALA A 308 -5.616 9.794 4.292 1.00 0.00 N ATOM 69 CA ALA A 308 -5.921 8.759 3.303 1.00 0.00 C ATOM 70 C ALA A 308 -5.148 7.475 3.592 1.00 0.00 C ATOM 71 O ALA A 308 -4.044 7.518 4.139 1.00 0.00 O ATOM 72 CB ALA A 308 -5.606 9.262 1.902 1.00 0.00 C ATOM 0 H ALA A 308 -4.620 9.986 4.400 1.00 0.00 H new ATOM 0 HA ALA A 308 -6.985 8.532 3.367 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -5.837 8.483 1.175 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -6.207 10.146 1.689 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -4.548 9.517 1.836 1.00 0.00 H new ATOM 78 N LEU A 309 -5.744 6.339 3.215 1.00 0.00 N ATOM 79 CA LEU A 309 -5.130 5.027 3.424 1.00 0.00 C ATOM 80 C LEU A 309 -4.436 4.535 2.139 1.00 0.00 C ATOM 81 O LEU A 309 -5.109 4.344 1.119 1.00 0.00 O ATOM 82 CB LEU A 309 -6.189 4.006 3.874 1.00 0.00 C ATOM 83 CG LEU A 309 -6.783 4.238 5.271 1.00 0.00 C ATOM 84 CD1 LEU A 309 -8.197 3.682 5.343 1.00 0.00 C ATOM 85 CD2 LEU A 309 -5.911 3.596 6.345 1.00 0.00 C ATOM 0 H LEU A 309 -6.657 6.304 2.761 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.378 5.126 4.207 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -7.002 4.009 3.148 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -5.743 3.012 3.849 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.816 5.312 5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -8.605 3.854 6.339 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -8.823 4.182 4.603 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -8.178 2.612 5.138 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -6.352 3.774 7.326 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -5.844 2.523 6.166 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -4.913 4.032 6.312 1.00 0.00 H new ATOM 97 N PRO A 310 -3.076 4.329 2.147 1.00 0.00 N ATOM 98 CA PRO A 310 -2.339 3.848 0.959 1.00 0.00 C ATOM 99 C PRO A 310 -2.687 2.397 0.586 1.00 0.00 C ATOM 100 O PRO A 310 -3.266 1.657 1.390 1.00 0.00 O ATOM 101 CB PRO A 310 -0.855 4.001 1.333 1.00 0.00 C ATOM 102 CG PRO A 310 -0.825 4.783 2.605 1.00 0.00 C ATOM 103 CD PRO A 310 -2.151 4.568 3.279 1.00 0.00 C ATOM 0 HA PRO A 310 -2.604 4.421 0.070 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.384 3.027 1.464 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.306 4.517 0.545 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -0.008 4.449 3.245 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.661 5.842 2.404 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.122 3.718 3.961 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.449 5.437 3.865 1.00 0.00 H new ATOM 111 N ALA A 311 -2.320 2.013 -0.644 1.00 0.00 N ATOM 112 CA ALA A 311 -2.638 0.686 -1.207 1.00 0.00 C ATOM 113 C ALA A 311 -1.516 -0.262 -0.901 1.00 0.00 C ATOM 114 O ALA A 311 -1.675 -1.479 -0.769 1.00 0.00 O ATOM 115 CB ALA A 311 -2.886 0.776 -2.707 1.00 0.00 C ATOM 0 H ALA A 311 -1.794 2.612 -1.280 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.554 0.313 -0.750 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.118 -0.215 -3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.724 1.447 -2.898 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.994 1.161 -3.201 1.00 0.00 H new ATOM 121 N TRP A 312 -0.380 0.385 -0.797 1.00 0.00 N ATOM 122 CA TRP A 312 0.903 -0.205 -0.504 1.00 0.00 C ATOM 123 C TRP A 312 1.009 -0.462 0.994 1.00 0.00 C ATOM 124 O TRP A 312 1.907 -1.147 1.490 1.00 0.00 O ATOM 125 CB TRP A 312 1.948 0.799 -1.033 1.00 0.00 C ATOM 126 CG TRP A 312 2.109 2.098 -0.256 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.776 3.340 -0.719 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.635 2.302 1.074 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.042 4.293 0.230 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.562 3.685 1.339 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.147 1.460 2.070 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.977 4.235 2.547 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.555 2.010 3.267 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.466 3.384 3.498 1.00 0.00 C ATOM 0 H TRP A 312 -0.324 1.396 -0.922 1.00 0.00 H new ATOM 0 HA TRP A 312 1.058 -1.174 -0.979 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.916 0.298 -1.061 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.688 1.049 -2.062 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.361 3.542 -1.696 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.878 5.294 0.126 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.221 0.396 1.903 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.915 5.298 2.727 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.950 1.367 4.039 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.790 3.783 4.448 1.00 0.00 H new ATOM 145 N ALA A 313 0.022 0.111 1.658 1.00 0.00 N ATOM 146 CA ALA A 313 -0.152 0.086 3.093 1.00 0.00 C ATOM 147 C ALA A 313 -0.896 -1.177 3.569 1.00 0.00 C ATOM 148 O ALA A 313 -1.387 -1.234 4.705 1.00 0.00 O ATOM 149 CB ALA A 313 -0.924 1.349 3.429 1.00 0.00 C ATOM 0 H ALA A 313 -0.716 0.632 1.184 1.00 0.00 H new ATOM 0 HA ALA A 313 0.810 0.053 3.604 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.093 1.397 4.505 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.351 2.221 3.112 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.883 1.338 2.911 1.00 0.00 H new ATOM 155 N ARG A 314 -0.949 -2.189 2.695 1.00 0.00 N ATOM 156 CA ARG A 314 -1.618 -3.450 2.991 1.00 0.00 C ATOM 157 C ARG A 314 -0.685 -4.640 2.688 1.00 0.00 C ATOM 158 O ARG A 314 -0.491 -4.986 1.515 1.00 0.00 O ATOM 159 CB ARG A 314 -2.921 -3.571 2.186 1.00 0.00 C ATOM 160 CG ARG A 314 -4.044 -2.676 2.692 1.00 0.00 C ATOM 161 CD ARG A 314 -5.310 -2.852 1.870 1.00 0.00 C ATOM 162 NE ARG A 314 -6.402 -1.998 2.351 1.00 0.00 N ATOM 163 CZ ARG A 314 -7.643 -1.989 1.843 1.00 0.00 C ATOM 164 NH1 ARG A 314 -7.980 -2.783 0.828 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -8.555 -1.174 2.357 1.00 0.00 N ATOM 0 H ARG A 314 -0.529 -2.152 1.766 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.866 -3.467 4.052 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -2.717 -3.327 1.144 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -3.257 -4.608 2.210 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -4.252 -2.907 3.737 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.726 -1.634 2.653 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -5.100 -2.618 0.826 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -5.623 -3.895 1.906 1.00 0.00 H new ATOM 0 HE ARG A 314 -6.203 -1.366 3.127 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -7.288 -3.414 0.422 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -8.930 -2.761 0.456 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -8.310 -0.560 3.134 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -9.501 -1.162 1.976 1.00 0.00 H new ATOM 179 N PRO A 315 -0.063 -5.278 3.735 1.00 0.00 N ATOM 180 CA PRO A 315 0.849 -6.441 3.560 1.00 0.00 C ATOM 181 C PRO A 315 0.251 -7.588 2.747 1.00 0.00 C ATOM 182 O PRO A 315 0.965 -8.345 2.085 1.00 0.00 O ATOM 183 CB PRO A 315 1.133 -6.914 4.996 1.00 0.00 C ATOM 184 CG PRO A 315 0.153 -6.192 5.863 1.00 0.00 C ATOM 185 CD PRO A 315 -0.150 -4.905 5.161 1.00 0.00 C ATOM 0 HA PRO A 315 1.735 -6.142 2.999 1.00 0.00 H new ATOM 0 HB2 PRO A 315 1.011 -7.994 5.083 1.00 0.00 H new ATOM 0 HB3 PRO A 315 2.158 -6.684 5.288 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -0.753 -6.782 6.003 1.00 0.00 H new ATOM 0 HG3 PRO A 315 0.570 -6.008 6.853 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.139 -4.527 5.420 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.567 -4.126 5.419 1.00 0.00 H new ATOM 193 N ASP A 316 -1.059 -7.682 2.822 1.00 0.00 N ATOM 194 CA ASP A 316 -1.836 -8.704 2.112 1.00 0.00 C ATOM 195 C ASP A 316 -2.317 -8.186 0.753 1.00 0.00 C ATOM 196 O ASP A 316 -2.433 -8.958 -0.204 1.00 0.00 O ATOM 197 CB ASP A 316 -3.038 -9.145 2.955 1.00 0.00 C ATOM 198 CG ASP A 316 -2.633 -9.952 4.173 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.402 -9.344 5.239 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.546 -11.193 4.062 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.631 -7.049 3.381 1.00 0.00 H new ATOM 0 HA ASP A 316 -1.184 -9.561 1.944 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -3.594 -8.264 3.276 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -3.711 -9.740 2.338 1.00 0.00 H new ATOM 205 N TYR A 317 -2.591 -6.864 0.681 1.00 0.00 N ATOM 206 CA TYR A 317 -3.063 -6.178 -0.546 1.00 0.00 C ATOM 207 C TYR A 317 -4.407 -6.741 -1.036 1.00 0.00 C ATOM 208 O TYR A 317 -4.498 -7.907 -1.435 1.00 0.00 O ATOM 209 CB TYR A 317 -2.004 -6.245 -1.668 1.00 0.00 C ATOM 210 CG TYR A 317 -2.090 -5.107 -2.666 1.00 0.00 C ATOM 211 CD1 TYR A 317 -1.345 -3.947 -2.494 1.00 0.00 C ATOM 212 CD2 TYR A 317 -2.917 -5.196 -3.780 1.00 0.00 C ATOM 213 CE1 TYR A 317 -1.421 -2.908 -3.404 1.00 0.00 C ATOM 214 CE2 TYR A 317 -2.998 -4.162 -4.693 1.00 0.00 C ATOM 215 CZ TYR A 317 -2.249 -3.020 -4.500 1.00 0.00 C ATOM 216 OH TYR A 317 -2.327 -1.989 -5.407 1.00 0.00 O ATOM 0 H TYR A 317 -2.490 -6.237 1.479 1.00 0.00 H new ATOM 0 HA TYR A 317 -3.219 -5.131 -0.285 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -1.012 -6.245 -1.217 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -2.113 -7.190 -2.200 1.00 0.00 H new ATOM 0 HD1 TYR A 317 -0.696 -3.855 -1.636 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -3.506 -6.088 -3.934 1.00 0.00 H new ATOM 0 HE1 TYR A 317 -0.834 -2.013 -3.256 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -3.645 -4.248 -5.554 1.00 0.00 H new ATOM 0 HH TYR A 317 -2.954 -2.228 -6.121 1.00 0.00 H new ATOM 226 N ASN A 318 -5.441 -5.892 -0.992 1.00 0.00 N ATOM 227 CA ASN A 318 -6.786 -6.270 -1.426 1.00 0.00 C ATOM 228 C ASN A 318 -7.391 -5.165 -2.319 1.00 0.00 C ATOM 229 O ASN A 318 -7.675 -4.068 -1.822 1.00 0.00 O ATOM 230 CB ASN A 318 -7.684 -6.529 -0.204 1.00 0.00 C ATOM 231 CG ASN A 318 -8.846 -7.457 -0.512 1.00 0.00 C ATOM 232 OD1 ASN A 318 -9.927 -7.012 -0.898 1.00 0.00 O ATOM 233 ND2 ASN A 318 -8.626 -8.756 -0.343 1.00 0.00 N ATOM 0 H ASN A 318 -5.367 -4.931 -0.657 1.00 0.00 H new ATOM 0 HA ASN A 318 -6.722 -7.188 -2.010 1.00 0.00 H new ATOM 0 HB2 ASN A 318 -7.084 -6.960 0.597 1.00 0.00 H new ATOM 0 HB3 ASN A 318 -8.072 -5.579 0.164 1.00 0.00 H new ATOM 0 HD21 ASN A 318 -9.369 -9.428 -0.535 1.00 0.00 H new ATOM 0 HD22 ASN A 318 -7.714 -9.081 -0.021 1.00 0.00 H new ATOM 240 N PRO A 319 -7.588 -5.418 -3.655 1.00 0.00 N ATOM 241 CA PRO A 319 -8.171 -4.416 -4.579 1.00 0.00 C ATOM 242 C PRO A 319 -9.631 -4.057 -4.232 1.00 0.00 C ATOM 243 O PRO A 319 -10.430 -4.962 -3.973 1.00 0.00 O ATOM 244 CB PRO A 319 -8.119 -5.102 -5.954 1.00 0.00 C ATOM 245 CG PRO A 319 -7.143 -6.216 -5.806 1.00 0.00 C ATOM 246 CD PRO A 319 -7.241 -6.666 -4.379 1.00 0.00 C ATOM 0 HA PRO A 319 -7.622 -3.476 -4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -9.101 -5.476 -6.243 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -7.803 -4.404 -6.729 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -7.377 -7.032 -6.489 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -6.132 -5.883 -6.041 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -8.005 -7.433 -4.250 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -6.301 -7.090 -4.025 1.00 0.00 H new ATOM 254 N PRO A 320 -10.014 -2.734 -4.213 1.00 0.00 N ATOM 255 CA PRO A 320 -11.395 -2.312 -3.903 1.00 0.00 C ATOM 256 C PRO A 320 -12.389 -2.687 -5.007 1.00 0.00 C ATOM 257 O PRO A 320 -12.356 -2.133 -6.113 1.00 0.00 O ATOM 258 CB PRO A 320 -11.304 -0.781 -3.759 1.00 0.00 C ATOM 259 CG PRO A 320 -9.848 -0.467 -3.699 1.00 0.00 C ATOM 260 CD PRO A 320 -9.153 -1.557 -4.460 1.00 0.00 C ATOM 0 HA PRO A 320 -11.765 -2.809 -3.006 1.00 0.00 H new ATOM 0 HB2 PRO A 320 -11.778 -0.280 -4.603 1.00 0.00 H new ATOM 0 HB3 PRO A 320 -11.815 -0.441 -2.858 1.00 0.00 H new ATOM 0 HG2 PRO A 320 -9.642 0.508 -4.140 1.00 0.00 H new ATOM 0 HG3 PRO A 320 -9.500 -0.430 -2.667 1.00 0.00 H new ATOM 0 HD2 PRO A 320 -9.081 -1.325 -5.523 1.00 0.00 H new ATOM 0 HD3 PRO A 320 -8.137 -1.717 -4.099 1.00 0.00 H new ATOM 268 N LEU A 321 -13.253 -3.651 -4.691 1.00 0.00 N ATOM 269 CA LEU A 321 -14.273 -4.129 -5.629 1.00 0.00 C ATOM 270 C LEU A 321 -15.658 -3.605 -5.246 1.00 0.00 C ATOM 271 O LEU A 321 -16.110 -3.799 -4.113 1.00 0.00 O ATOM 272 CB LEU A 321 -14.276 -5.672 -5.704 1.00 0.00 C ATOM 273 CG LEU A 321 -14.389 -6.429 -4.366 1.00 0.00 C ATOM 274 CD1 LEU A 321 -15.131 -7.742 -4.562 1.00 0.00 C ATOM 275 CD2 LEU A 321 -13.010 -6.686 -3.774 1.00 0.00 C ATOM 0 H LEU A 321 -13.268 -4.121 -3.786 1.00 0.00 H new ATOM 0 HA LEU A 321 -14.025 -3.741 -6.617 1.00 0.00 H new ATOM 0 HB2 LEU A 321 -15.105 -5.980 -6.341 1.00 0.00 H new ATOM 0 HB3 LEU A 321 -13.359 -5.991 -6.199 1.00 0.00 H new ATOM 0 HG LEU A 321 -14.952 -5.809 -3.669 1.00 0.00 H new ATOM 0 HD11 LEU A 321 -15.203 -8.265 -3.608 1.00 0.00 H new ATOM 0 HD12 LEU A 321 -16.133 -7.541 -4.942 1.00 0.00 H new ATOM 0 HD13 LEU A 321 -14.590 -8.363 -5.276 1.00 0.00 H new ATOM 0 HD21 LEU A 321 -13.113 -7.221 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 321 -12.422 -7.286 -4.469 1.00 0.00 H new ATOM 0 HD23 LEU A 321 -12.506 -5.735 -3.599 1.00 0.00 H new ATOM 287 N VAL A 322 -16.315 -2.941 -6.200 1.00 0.00 N ATOM 288 CA VAL A 322 -17.653 -2.378 -5.984 1.00 0.00 C ATOM 289 C VAL A 322 -18.543 -2.571 -7.214 1.00 0.00 C ATOM 290 O VAL A 322 -18.218 -2.092 -8.305 1.00 0.00 O ATOM 291 CB VAL A 322 -17.612 -0.867 -5.596 1.00 0.00 C ATOM 292 CG1 VAL A 322 -17.191 -0.704 -4.143 1.00 0.00 C ATOM 293 CG2 VAL A 322 -16.687 -0.053 -6.508 1.00 0.00 C ATOM 0 H VAL A 322 -15.941 -2.779 -7.135 1.00 0.00 H new ATOM 0 HA VAL A 322 -18.079 -2.926 -5.144 1.00 0.00 H new ATOM 0 HB VAL A 322 -18.621 -0.477 -5.728 1.00 0.00 H new ATOM 0 HG11 VAL A 322 -17.167 0.355 -3.888 1.00 0.00 H new ATOM 0 HG12 VAL A 322 -17.904 -1.217 -3.498 1.00 0.00 H new ATOM 0 HG13 VAL A 322 -16.199 -1.134 -4.001 1.00 0.00 H new ATOM 0 HG21 VAL A 322 -16.695 0.991 -6.195 1.00 0.00 H new ATOM 0 HG22 VAL A 322 -15.672 -0.445 -6.440 1.00 0.00 H new ATOM 0 HG23 VAL A 322 -17.036 -0.126 -7.538 1.00 0.00 H new ATOM 303 N GLU A 323 -19.661 -3.276 -7.020 1.00 0.00 N ATOM 304 CA GLU A 323 -20.613 -3.547 -8.099 1.00 0.00 C ATOM 305 C GLU A 323 -21.840 -2.643 -7.982 1.00 0.00 C ATOM 306 O GLU A 323 -22.091 -1.865 -8.926 1.00 0.00 O ATOM 307 CB GLU A 323 -21.036 -5.022 -8.092 1.00 0.00 C ATOM 308 CG GLU A 323 -19.956 -5.974 -8.581 1.00 0.00 C ATOM 309 CD GLU A 323 -20.405 -7.424 -8.562 1.00 0.00 C ATOM 310 OE1 GLU A 323 -20.202 -8.094 -7.527 1.00 0.00 O ATOM 311 OE2 GLU A 323 -20.956 -7.888 -9.582 1.00 0.00 O1- ATOM 312 OXT GLU A 323 -22.534 -2.713 -6.943 1.00 0.00 O1- ATOM 0 H GLU A 323 -19.930 -3.672 -6.119 1.00 0.00 H new ATOM 0 HA GLU A 323 -20.117 -3.333 -9.046 1.00 0.00 H new ATOM 0 HB2 GLU A 323 -21.323 -5.303 -7.079 1.00 0.00 H new ATOM 0 HB3 GLU A 323 -21.921 -5.139 -8.718 1.00 0.00 H new ATOM 0 HG2 GLU A 323 -19.667 -5.700 -9.596 1.00 0.00 H new ATOM 0 HG3 GLU A 323 -19.069 -5.864 -7.957 1.00 0.00 H new TER 319 GLU A 323