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 -6.943 19.563 1.165 1.00 0.00 N ATOM 2 CA GLY A 304 -7.248 18.214 0.611 1.00 0.00 C ATOM 3 C GLY A 304 -8.258 17.457 1.451 1.00 0.00 C ATOM 4 O GLY A 304 -9.078 18.068 2.142 1.00 0.00 O ATOM 0 HA2 GLY A 304 -7.631 18.320 -0.404 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -6.327 17.635 0.546 1.00 0.00 H new ATOM 10 N PHE A 305 -8.191 16.125 1.386 1.00 0.00 N ATOM 11 CA PHE A 305 -9.100 15.258 2.139 1.00 0.00 C ATOM 12 C PHE A 305 -8.418 14.720 3.409 1.00 0.00 C ATOM 13 O PHE A 305 -7.359 14.089 3.307 1.00 0.00 O ATOM 14 CB PHE A 305 -9.576 14.092 1.263 1.00 0.00 C ATOM 15 CG PHE A 305 -10.496 14.504 0.148 1.00 0.00 C ATOM 16 CD1 PHE A 305 -11.868 14.543 0.342 1.00 0.00 C ATOM 17 CD2 PHE A 305 -9.989 14.854 -1.094 1.00 0.00 C ATOM 18 CE1 PHE A 305 -12.716 14.921 -0.682 1.00 0.00 C ATOM 19 CE2 PHE A 305 -10.833 15.233 -2.121 1.00 0.00 C ATOM 20 CZ PHE A 305 -12.197 15.267 -1.914 1.00 0.00 C ATOM 0 H PHE A 305 -7.512 15.621 0.816 1.00 0.00 H new ATOM 0 HA PHE A 305 -9.964 15.852 2.437 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -8.706 13.592 0.837 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -10.087 13.363 1.892 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -12.279 14.275 1.304 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -8.922 14.830 -1.261 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -13.783 14.946 -0.519 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -10.425 15.502 -3.084 1.00 0.00 H new ATOM 0 HZ PHE A 305 -12.858 15.564 -2.715 1.00 0.00 H new ATOM 30 N PRO A 306 -8.995 14.956 4.636 1.00 0.00 N ATOM 31 CA PRO A 306 -8.408 14.463 5.904 1.00 0.00 C ATOM 32 C PRO A 306 -8.365 12.936 5.988 1.00 0.00 C ATOM 33 O PRO A 306 -9.297 12.257 5.551 1.00 0.00 O ATOM 34 CB PRO A 306 -9.345 15.014 6.989 1.00 0.00 C ATOM 35 CG PRO A 306 -10.097 16.120 6.339 1.00 0.00 C ATOM 36 CD PRO A 306 -10.233 15.735 4.896 1.00 0.00 C ATOM 0 HA PRO A 306 -7.372 14.788 6.004 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -10.021 14.241 7.354 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -8.781 15.375 7.849 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -11.075 16.251 6.802 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -9.566 17.066 6.442 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -11.128 15.139 4.721 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -10.301 16.610 4.250 1.00 0.00 H new ATOM 44 N ARG A 307 -7.265 12.406 6.564 1.00 0.00 N ATOM 45 CA ARG A 307 -7.039 10.948 6.734 1.00 0.00 C ATOM 46 C ARG A 307 -6.957 10.221 5.388 1.00 0.00 C ATOM 47 O ARG A 307 -7.902 10.259 4.592 1.00 0.00 O ATOM 48 CB ARG A 307 -8.121 10.299 7.621 1.00 0.00 C ATOM 49 CG ARG A 307 -8.041 10.704 9.086 1.00 0.00 C ATOM 50 CD ARG A 307 -9.145 10.056 9.905 1.00 0.00 C ATOM 51 NE ARG A 307 -9.087 10.453 11.316 1.00 0.00 N ATOM 52 CZ ARG A 307 -10.032 10.178 12.227 1.00 0.00 C ATOM 53 NH1 ARG A 307 -11.130 9.498 11.898 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -9.873 10.587 13.478 1.00 0.00 N ATOM 0 H ARG A 307 -6.502 12.978 6.927 1.00 0.00 H new ATOM 0 HA ARG A 307 -6.077 10.844 7.236 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -9.104 10.567 7.233 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -8.034 9.215 7.548 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -7.070 10.418 9.491 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -8.114 11.788 9.169 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -10.114 10.332 9.490 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -9.064 8.972 9.830 1.00 0.00 H new ATOM 0 HE ARG A 307 -8.268 10.976 11.627 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -11.263 9.177 10.939 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -11.837 9.299 12.605 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -9.036 11.107 13.742 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -10.587 10.382 14.176 1.00 0.00 H new ATOM 68 N ALA A 308 -5.817 9.566 5.146 1.00 0.00 N ATOM 69 CA ALA A 308 -5.587 8.826 3.906 1.00 0.00 C ATOM 70 C ALA A 308 -5.126 7.400 4.189 1.00 0.00 C ATOM 71 O ALA A 308 -4.465 7.141 5.200 1.00 0.00 O ATOM 72 CB ALA A 308 -4.564 9.550 3.043 1.00 0.00 C ATOM 0 H ALA A 308 -5.035 9.535 5.800 1.00 0.00 H new ATOM 0 HA ALA A 308 -6.532 8.772 3.366 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -4.402 8.989 2.123 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -4.933 10.546 2.800 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -3.623 9.634 3.587 1.00 0.00 H new ATOM 78 N LEU A 309 -5.484 6.484 3.284 1.00 0.00 N ATOM 79 CA LEU A 309 -5.114 5.073 3.411 1.00 0.00 C ATOM 80 C LEU A 309 -4.427 4.570 2.125 1.00 0.00 C ATOM 81 O LEU A 309 -5.095 4.402 1.098 1.00 0.00 O ATOM 82 CB LEU A 309 -6.359 4.220 3.721 1.00 0.00 C ATOM 83 CG LEU A 309 -6.995 4.450 5.098 1.00 0.00 C ATOM 84 CD1 LEU A 309 -8.485 4.150 5.050 1.00 0.00 C ATOM 85 CD2 LEU A 309 -6.319 3.592 6.159 1.00 0.00 C ATOM 0 H LEU A 309 -6.033 6.697 2.451 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.408 4.977 4.236 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -7.111 4.416 2.956 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -6.086 3.168 3.638 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.855 5.497 5.365 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -8.922 4.318 6.034 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -8.965 4.806 4.323 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -8.638 3.111 4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -6.788 3.773 7.126 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -6.424 2.539 5.896 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -5.261 3.849 6.215 1.00 0.00 H new ATOM 97 N PRO A 310 -3.071 4.339 2.143 1.00 0.00 N ATOM 98 CA PRO A 310 -2.334 3.849 0.961 1.00 0.00 C ATOM 99 C PRO A 310 -2.687 2.397 0.590 1.00 0.00 C ATOM 100 O PRO A 310 -3.268 1.662 1.392 1.00 0.00 O ATOM 101 CB PRO A 310 -0.851 3.996 1.339 1.00 0.00 C ATOM 102 CG PRO A 310 -0.822 4.766 2.618 1.00 0.00 C ATOM 103 CD PRO A 310 -2.152 4.553 3.283 1.00 0.00 C ATOM 0 HA PRO A 310 -2.595 4.420 0.070 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.382 3.020 1.462 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.300 4.519 0.557 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -0.010 4.421 3.258 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.650 5.825 2.428 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.134 3.693 3.952 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.446 5.416 3.880 1.00 0.00 H new ATOM 111 N ALA A 311 -2.318 2.014 -0.642 1.00 0.00 N ATOM 112 CA ALA A 311 -2.636 0.687 -1.204 1.00 0.00 C ATOM 113 C ALA A 311 -1.516 -0.261 -0.899 1.00 0.00 C ATOM 114 O ALA A 311 -1.674 -1.479 -0.768 1.00 0.00 O ATOM 115 CB ALA A 311 -2.884 0.778 -2.704 1.00 0.00 C ATOM 0 H ALA A 311 -1.791 2.613 -1.278 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.552 0.313 -0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.116 -0.213 -3.095 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.722 1.449 -2.894 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.992 1.163 -3.198 1.00 0.00 H new ATOM 121 N TRP A 312 -0.379 0.386 -0.796 1.00 0.00 N ATOM 122 CA TRP A 312 0.906 -0.204 -0.505 1.00 0.00 C ATOM 123 C TRP A 312 1.014 -0.463 0.992 1.00 0.00 C ATOM 124 O TRP A 312 1.914 -1.143 1.488 1.00 0.00 O ATOM 125 CB TRP A 312 1.950 0.800 -1.034 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 3.341 -0.723 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.631 2.303 1.073 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.043 4.294 0.227 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.560 3.686 1.337 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.140 1.462 2.070 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.971 4.237 2.546 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.544 2.011 3.269 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.457 3.387 3.498 1.00 0.00 C ATOM 0 H TRP A 312 -0.323 1.397 -0.920 1.00 0.00 H new ATOM 0 HA TRP A 312 1.061 -1.172 -0.982 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.918 0.300 -1.061 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.691 1.048 -2.063 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.365 3.543 -1.700 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.880 5.296 0.122 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.215 0.398 1.902 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.908 5.300 2.726 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.934 1.367 4.043 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.781 3.786 4.448 1.00 0.00 H new ATOM 145 N ALA A 313 0.022 0.100 1.659 1.00 0.00 N ATOM 146 CA ALA A 313 -0.154 0.071 3.094 1.00 0.00 C ATOM 147 C ALA A 313 -0.883 -1.203 3.561 1.00 0.00 C ATOM 148 O ALA A 313 -1.653 -1.182 4.532 1.00 0.00 O ATOM 149 CB ALA A 313 -0.932 1.333 3.429 1.00 0.00 C ATOM 0 H ALA A 313 -0.720 0.616 1.186 1.00 0.00 H new ATOM 0 HA ALA A 313 0.804 0.045 3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.104 1.380 4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.361 2.207 3.114 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.890 1.319 2.909 1.00 0.00 H new ATOM 155 N ARG A 314 -0.607 -2.316 2.870 1.00 0.00 N ATOM 156 CA ARG A 314 -1.211 -3.605 3.174 1.00 0.00 C ATOM 157 C ARG A 314 -0.113 -4.683 3.301 1.00 0.00 C ATOM 158 O ARG A 314 0.472 -5.085 2.288 1.00 0.00 O ATOM 159 CB ARG A 314 -2.230 -3.983 2.086 1.00 0.00 C ATOM 160 CG ARG A 314 -3.357 -4.884 2.581 1.00 0.00 C ATOM 161 CD ARG A 314 -4.361 -5.193 1.478 1.00 0.00 C ATOM 162 NE ARG A 314 -5.227 -4.045 1.174 1.00 0.00 N ATOM 163 CZ ARG A 314 -6.310 -4.093 0.386 1.00 0.00 C ATOM 164 NH1 ARG A 314 -6.688 -5.231 -0.197 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -7.020 -2.992 0.181 1.00 0.00 N ATOM 0 H ARG A 314 0.043 -2.341 2.085 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.739 -3.538 4.125 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -2.662 -3.071 1.674 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -1.708 -4.485 1.272 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.937 -5.815 2.962 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.869 -4.401 3.414 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -3.826 -5.491 0.576 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -4.977 -6.041 1.778 1.00 0.00 H new ATOM 0 HE ARG A 314 -4.986 -3.147 1.593 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -6.150 -6.084 -0.046 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -7.515 -5.248 -0.794 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -6.741 -2.116 0.622 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -7.845 -3.021 -0.418 1.00 0.00 H new ATOM 179 N PRO A 315 0.211 -5.148 4.550 1.00 0.00 N ATOM 180 CA PRO A 315 1.245 -6.191 4.799 1.00 0.00 C ATOM 181 C PRO A 315 1.075 -7.466 3.974 1.00 0.00 C ATOM 182 O PRO A 315 2.045 -8.175 3.687 1.00 0.00 O ATOM 183 CB PRO A 315 1.090 -6.520 6.292 1.00 0.00 C ATOM 184 CG PRO A 315 -0.166 -5.843 6.734 1.00 0.00 C ATOM 185 CD PRO A 315 -0.350 -4.668 5.824 1.00 0.00 C ATOM 0 HA PRO A 315 2.227 -5.814 4.512 1.00 0.00 H new ATOM 0 HB2 PRO A 315 1.029 -7.597 6.450 1.00 0.00 H new ATOM 0 HB3 PRO A 315 1.948 -6.162 6.862 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -1.017 -6.521 6.671 1.00 0.00 H new ATOM 0 HG3 PRO A 315 -0.091 -5.523 7.773 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.400 -4.394 5.725 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.176 -3.787 6.191 1.00 0.00 H new ATOM 193 N ASP A 316 -0.164 -7.726 3.612 1.00 0.00 N ATOM 194 CA ASP A 316 -0.543 -8.900 2.809 1.00 0.00 C ATOM 195 C ASP A 316 -0.303 -8.669 1.307 1.00 0.00 C ATOM 196 O ASP A 316 -0.476 -9.585 0.495 1.00 0.00 O ATOM 197 CB ASP A 316 -2.016 -9.255 3.055 1.00 0.00 C ATOM 198 CG ASP A 316 -2.257 -9.822 4.442 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.533 -9.029 5.368 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.169 -11.057 4.603 1.00 0.00 O1- ATOM 0 H ASP A 316 -0.953 -7.131 3.863 1.00 0.00 H new ATOM 0 HA ASP A 316 0.090 -9.730 3.122 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -2.628 -8.363 2.920 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -2.340 -9.980 2.309 1.00 0.00 H new ATOM 205 N TYR A 317 0.104 -7.442 0.958 1.00 0.00 N ATOM 206 CA TYR A 317 0.376 -7.065 -0.426 1.00 0.00 C ATOM 207 C TYR A 317 1.867 -6.769 -0.608 1.00 0.00 C ATOM 208 O TYR A 317 2.432 -5.924 0.096 1.00 0.00 O ATOM 209 CB TYR A 317 -0.473 -5.839 -0.809 1.00 0.00 C ATOM 210 CG TYR A 317 -0.502 -5.529 -2.296 1.00 0.00 C ATOM 211 CD1 TYR A 317 -1.396 -6.170 -3.146 1.00 0.00 C ATOM 212 CD2 TYR A 317 0.367 -4.593 -2.841 1.00 0.00 C ATOM 213 CE1 TYR A 317 -1.421 -5.884 -4.499 1.00 0.00 C ATOM 214 CE2 TYR A 317 0.347 -4.302 -4.191 1.00 0.00 C ATOM 215 CZ TYR A 317 -0.549 -4.949 -5.015 1.00 0.00 C ATOM 216 OH TYR A 317 -0.571 -4.662 -6.361 1.00 0.00 O ATOM 0 H TYR A 317 0.252 -6.688 1.629 1.00 0.00 H new ATOM 0 HA TYR A 317 0.109 -7.893 -1.083 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -1.495 -5.999 -0.465 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -0.090 -4.968 -0.277 1.00 0.00 H new ATOM 0 HD1 TYR A 317 -2.081 -6.902 -2.744 1.00 0.00 H new ATOM 0 HD2 TYR A 317 1.070 -4.084 -2.198 1.00 0.00 H new ATOM 0 HE1 TYR A 317 -2.120 -6.391 -5.148 1.00 0.00 H new ATOM 0 HE2 TYR A 317 1.030 -3.571 -4.599 1.00 0.00 H new ATOM 0 HH TYR A 317 0.105 -3.981 -6.561 1.00 0.00 H new ATOM 226 N ASN A 318 2.488 -7.478 -1.553 1.00 0.00 N ATOM 227 CA ASN A 318 3.910 -7.310 -1.851 1.00 0.00 C ATOM 228 C ASN A 318 4.101 -6.379 -3.068 1.00 0.00 C ATOM 229 O ASN A 318 3.672 -6.725 -4.174 1.00 0.00 O ATOM 230 CB ASN A 318 4.555 -8.678 -2.113 1.00 0.00 C ATOM 231 CG ASN A 318 6.051 -8.686 -1.840 1.00 0.00 C ATOM 232 OD1 ASN A 318 6.856 -8.412 -2.729 1.00 0.00 O ATOM 233 ND2 ASN A 318 6.425 -9.000 -0.606 1.00 0.00 N ATOM 0 H ASN A 318 2.023 -8.180 -2.129 1.00 0.00 H new ATOM 0 HA ASN A 318 4.398 -6.851 -0.991 1.00 0.00 H new ATOM 0 HB2 ASN A 318 4.072 -9.428 -1.487 1.00 0.00 H new ATOM 0 HB3 ASN A 318 4.378 -8.966 -3.149 1.00 0.00 H new ATOM 0 HD21 ASN A 318 7.415 -9.021 -0.363 1.00 0.00 H new ATOM 0 HD22 ASN A 318 5.722 -9.220 0.099 1.00 0.00 H new ATOM 240 N PRO A 319 4.740 -5.173 -2.893 1.00 0.00 N ATOM 241 CA PRO A 319 4.973 -4.225 -4.009 1.00 0.00 C ATOM 242 C PRO A 319 5.903 -4.795 -5.100 1.00 0.00 C ATOM 243 O PRO A 319 6.668 -5.722 -4.820 1.00 0.00 O ATOM 244 CB PRO A 319 5.647 -3.018 -3.337 1.00 0.00 C ATOM 245 CG PRO A 319 5.338 -3.149 -1.888 1.00 0.00 C ATOM 246 CD PRO A 319 5.254 -4.622 -1.615 1.00 0.00 C ATOM 0 HA PRO A 319 4.039 -3.989 -4.519 1.00 0.00 H new ATOM 0 HB2 PRO A 319 6.723 -3.022 -3.511 1.00 0.00 H new ATOM 0 HB3 PRO A 319 5.262 -2.080 -3.737 1.00 0.00 H new ATOM 0 HG2 PRO A 319 6.113 -2.683 -1.280 1.00 0.00 H new ATOM 0 HG3 PRO A 319 4.399 -2.652 -1.643 1.00 0.00 H new ATOM 0 HD2 PRO A 319 6.227 -5.040 -1.358 1.00 0.00 H new ATOM 0 HD3 PRO A 319 4.584 -4.840 -0.784 1.00 0.00 H new ATOM 254 N PRO A 320 5.850 -4.262 -6.363 1.00 0.00 N ATOM 255 CA PRO A 320 6.705 -4.735 -7.463 1.00 0.00 C ATOM 256 C PRO A 320 8.139 -4.196 -7.372 1.00 0.00 C ATOM 257 O PRO A 320 8.383 -2.997 -7.559 1.00 0.00 O ATOM 258 CB PRO A 320 6.013 -4.210 -8.738 1.00 0.00 C ATOM 259 CG PRO A 320 4.763 -3.521 -8.285 1.00 0.00 C ATOM 260 CD PRO A 320 4.951 -3.190 -6.833 1.00 0.00 C ATOM 0 HA PRO A 320 6.807 -5.820 -7.442 1.00 0.00 H new ATOM 0 HB2 PRO A 320 6.663 -3.521 -9.277 1.00 0.00 H new ATOM 0 HB3 PRO A 320 5.781 -5.028 -9.419 1.00 0.00 H new ATOM 0 HG2 PRO A 320 4.587 -2.617 -8.868 1.00 0.00 H new ATOM 0 HG3 PRO A 320 3.895 -4.165 -8.425 1.00 0.00 H new ATOM 0 HD2 PRO A 320 5.394 -2.203 -6.698 1.00 0.00 H new ATOM 0 HD3 PRO A 320 4.004 -3.191 -6.293 1.00 0.00 H new ATOM 268 N LEU A 321 9.071 -5.098 -7.060 1.00 0.00 N ATOM 269 CA LEU A 321 10.490 -4.751 -6.946 1.00 0.00 C ATOM 270 C LEU A 321 11.242 -5.107 -8.225 1.00 0.00 C ATOM 271 O LEU A 321 10.995 -6.158 -8.824 1.00 0.00 O ATOM 272 CB LEU A 321 11.130 -5.468 -5.751 1.00 0.00 C ATOM 273 CG LEU A 321 10.714 -4.952 -4.371 1.00 0.00 C ATOM 274 CD1 LEU A 321 9.543 -5.755 -3.823 1.00 0.00 C ATOM 275 CD2 LEU A 321 11.891 -5.001 -3.409 1.00 0.00 C ATOM 0 H LEU A 321 8.867 -6.081 -6.880 1.00 0.00 H new ATOM 0 HA LEU A 321 10.557 -3.674 -6.789 1.00 0.00 H new ATOM 0 HB2 LEU A 321 10.884 -6.528 -5.812 1.00 0.00 H new ATOM 0 HB3 LEU A 321 12.213 -5.386 -5.839 1.00 0.00 H new ATOM 0 HG LEU A 321 10.395 -3.915 -4.476 1.00 0.00 H new ATOM 0 HD11 LEU A 321 9.265 -5.370 -2.842 1.00 0.00 H new ATOM 0 HD12 LEU A 321 8.694 -5.668 -4.501 1.00 0.00 H new ATOM 0 HD13 LEU A 321 9.830 -6.803 -3.734 1.00 0.00 H new ATOM 0 HD21 LEU A 321 11.579 -4.631 -2.433 1.00 0.00 H new ATOM 0 HD22 LEU A 321 12.240 -6.029 -3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 321 12.700 -4.378 -3.791 1.00 0.00 H new ATOM 287 N VAL A 322 12.156 -4.223 -8.630 1.00 0.00 N ATOM 288 CA VAL A 322 12.960 -4.427 -9.843 1.00 0.00 C ATOM 289 C VAL A 322 14.425 -4.054 -9.608 1.00 0.00 C ATOM 290 O VAL A 322 14.722 -2.975 -9.084 1.00 0.00 O ATOM 291 CB VAL A 322 12.404 -3.637 -11.068 1.00 0.00 C ATOM 292 CG1 VAL A 322 11.179 -4.336 -11.637 1.00 0.00 C ATOM 293 CG2 VAL A 322 12.069 -2.181 -10.724 1.00 0.00 C ATOM 0 H VAL A 322 12.360 -3.355 -8.135 1.00 0.00 H new ATOM 0 HA VAL A 322 12.895 -5.490 -10.075 1.00 0.00 H new ATOM 0 HB VAL A 322 13.193 -3.618 -11.819 1.00 0.00 H new ATOM 0 HG11 VAL A 322 10.803 -3.773 -12.491 1.00 0.00 H new ATOM 0 HG12 VAL A 322 11.450 -5.342 -11.957 1.00 0.00 H new ATOM 0 HG13 VAL A 322 10.405 -4.395 -10.872 1.00 0.00 H new ATOM 0 HG21 VAL A 322 11.686 -1.676 -11.611 1.00 0.00 H new ATOM 0 HG22 VAL A 322 11.314 -2.157 -9.939 1.00 0.00 H new ATOM 0 HG23 VAL A 322 12.969 -1.673 -10.377 1.00 0.00 H new ATOM 303 N GLU A 323 15.327 -4.958 -10.000 1.00 0.00 N ATOM 304 CA GLU A 323 16.767 -4.747 -9.844 1.00 0.00 C ATOM 305 C GLU A 323 17.413 -4.391 -11.182 1.00 0.00 C ATOM 306 O GLU A 323 17.332 -5.214 -12.120 1.00 0.00 O ATOM 307 CB GLU A 323 17.436 -5.991 -9.244 1.00 0.00 C ATOM 308 CG GLU A 323 17.139 -6.200 -7.766 1.00 0.00 C ATOM 309 CD GLU A 323 17.812 -7.438 -7.207 1.00 0.00 C ATOM 310 OE1 GLU A 323 18.959 -7.325 -6.725 1.00 0.00 O ATOM 311 OE2 GLU A 323 17.191 -8.522 -7.249 1.00 0.00 O1- ATOM 312 OXT GLU A 323 17.995 -3.289 -11.281 1.00 0.00 O1- ATOM 0 H GLU A 323 15.082 -5.849 -10.431 1.00 0.00 H new ATOM 0 HA GLU A 323 16.912 -3.911 -9.159 1.00 0.00 H new ATOM 0 HB2 GLU A 323 17.108 -6.870 -9.798 1.00 0.00 H new ATOM 0 HB3 GLU A 323 18.515 -5.912 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 323 17.470 -5.326 -7.205 1.00 0.00 H new ATOM 0 HG3 GLU A 323 16.061 -6.281 -7.623 1.00 0.00 H new TER 319 GLU A 323