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 -1.628 19.178 -0.322 1.00 0.00 N ATOM 2 CA GLY A 304 -2.113 19.256 -1.729 1.00 0.00 C ATOM 3 C GLY A 304 -3.249 18.290 -2.005 1.00 0.00 C ATOM 4 O GLY A 304 -4.417 18.689 -2.022 1.00 0.00 O ATOM 0 HA2 GLY A 304 -2.445 20.273 -1.940 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -1.287 19.044 -2.407 1.00 0.00 H new ATOM 10 N PHE A 305 -2.898 17.018 -2.221 1.00 0.00 N ATOM 11 CA PHE A 305 -3.883 15.972 -2.502 1.00 0.00 C ATOM 12 C PHE A 305 -4.197 15.160 -1.230 1.00 0.00 C ATOM 13 O PHE A 305 -3.324 14.438 -0.734 1.00 0.00 O ATOM 14 CB PHE A 305 -3.374 15.043 -3.614 1.00 0.00 C ATOM 15 CG PHE A 305 -3.307 15.695 -4.968 1.00 0.00 C ATOM 16 CD1 PHE A 305 -4.397 15.659 -5.824 1.00 0.00 C ATOM 17 CD2 PHE A 305 -2.154 16.346 -5.383 1.00 0.00 C ATOM 18 CE1 PHE A 305 -4.336 16.257 -7.069 1.00 0.00 C ATOM 19 CE2 PHE A 305 -2.090 16.945 -6.626 1.00 0.00 C ATOM 20 CZ PHE A 305 -3.182 16.902 -7.470 1.00 0.00 C ATOM 0 H PHE A 305 -1.933 16.688 -2.206 1.00 0.00 H new ATOM 0 HA PHE A 305 -4.802 16.451 -2.839 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -2.381 14.681 -3.346 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -4.026 14.171 -3.673 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -5.303 15.159 -5.515 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -1.297 16.385 -4.727 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -5.191 16.220 -7.728 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -1.186 17.447 -6.938 1.00 0.00 H new ATOM 0 HZ PHE A 305 -3.134 17.372 -8.441 1.00 0.00 H new ATOM 30 N PRO A 306 -5.445 15.269 -0.660 1.00 0.00 N ATOM 31 CA PRO A 306 -5.835 14.518 0.558 1.00 0.00 C ATOM 32 C PRO A 306 -5.883 13.004 0.339 1.00 0.00 C ATOM 33 O PRO A 306 -6.401 12.532 -0.679 1.00 0.00 O ATOM 34 CB PRO A 306 -7.242 15.039 0.885 1.00 0.00 C ATOM 35 CG PRO A 306 -7.386 16.307 0.117 1.00 0.00 C ATOM 36 CD PRO A 306 -6.555 16.136 -1.121 1.00 0.00 C ATOM 0 HA PRO A 306 -5.108 14.670 1.356 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -8.005 14.316 0.596 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -7.357 15.213 1.955 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -8.430 16.494 -0.136 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -7.043 17.160 0.703 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -7.123 15.671 -1.927 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -6.191 17.092 -1.498 1.00 0.00 H new ATOM 44 N ARG A 307 -5.336 12.260 1.305 1.00 0.00 N ATOM 45 CA ARG A 307 -5.306 10.795 1.247 1.00 0.00 C ATOM 46 C ARG A 307 -5.814 10.198 2.556 1.00 0.00 C ATOM 47 O ARG A 307 -5.571 10.752 3.631 1.00 0.00 O ATOM 48 CB ARG A 307 -3.884 10.296 0.964 1.00 0.00 C ATOM 49 CG ARG A 307 -3.418 10.537 -0.467 1.00 0.00 C ATOM 50 CD ARG A 307 -1.989 10.061 -0.682 1.00 0.00 C ATOM 51 NE ARG A 307 -1.004 10.951 -0.053 1.00 0.00 N ATOM 52 CZ ARG A 307 0.325 10.775 -0.097 1.00 0.00 C ATOM 53 NH1 ARG A 307 0.863 9.740 -0.739 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 1.120 11.645 0.511 1.00 0.00 N ATOM 0 H ARG A 307 -4.905 12.652 2.142 1.00 0.00 H new ATOM 0 HA ARG A 307 -5.959 10.474 0.436 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -3.194 10.789 1.648 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -3.835 9.228 1.177 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -4.082 10.018 -1.158 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -3.486 11.600 -0.697 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -1.878 9.056 -0.276 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -1.787 9.997 -1.751 1.00 0.00 H new ATOM 0 HE ARG A 307 -1.357 11.762 0.455 1.00 0.00 H new ATOM 0 HH11 ARG A 307 0.262 9.063 -1.209 1.00 0.00 H new ATOM 0 HH12 ARG A 307 1.876 9.624 -0.761 1.00 0.00 H new ATOM 0 HH21 ARG A 307 0.720 12.441 1.008 1.00 0.00 H new ATOM 0 HH22 ARG A 307 2.132 11.518 0.482 1.00 0.00 H new ATOM 68 N ALA A 308 -6.516 9.065 2.450 1.00 0.00 N ATOM 69 CA ALA A 308 -7.068 8.382 3.619 1.00 0.00 C ATOM 70 C ALA A 308 -6.194 7.197 4.038 1.00 0.00 C ATOM 71 O ALA A 308 -5.717 7.149 5.176 1.00 0.00 O ATOM 72 CB ALA A 308 -8.500 7.936 3.345 1.00 0.00 C ATOM 0 H ALA A 308 -6.714 8.602 1.563 1.00 0.00 H new ATOM 0 HA ALA A 308 -7.079 9.088 4.450 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -8.898 7.429 4.224 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -9.115 8.807 3.119 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -8.512 7.253 2.496 1.00 0.00 H new ATOM 78 N LEU A 309 -5.989 6.243 3.113 1.00 0.00 N ATOM 79 CA LEU A 309 -5.170 5.051 3.378 1.00 0.00 C ATOM 80 C LEU A 309 -4.453 4.575 2.098 1.00 0.00 C ATOM 81 O LEU A 309 -5.107 4.423 1.064 1.00 0.00 O ATOM 82 CB LEU A 309 -6.026 3.903 3.968 1.00 0.00 C ATOM 83 CG LEU A 309 -7.332 3.566 3.225 1.00 0.00 C ATOM 84 CD1 LEU A 309 -7.110 2.438 2.226 1.00 0.00 C ATOM 85 CD2 LEU A 309 -8.425 3.195 4.215 1.00 0.00 C ATOM 0 H LEU A 309 -6.382 6.276 2.172 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.416 5.331 4.114 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -5.412 3.003 4.003 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -6.276 4.159 4.998 1.00 0.00 H new ATOM 0 HG LEU A 309 -7.650 4.451 2.673 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -8.046 2.217 1.713 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -6.359 2.741 1.496 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -6.766 1.548 2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -9.341 2.960 3.674 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -8.112 2.326 4.794 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -8.606 4.033 4.888 1.00 0.00 H new ATOM 97 N PRO A 310 -3.098 4.339 2.131 1.00 0.00 N ATOM 98 CA PRO A 310 -2.349 3.862 0.951 1.00 0.00 C ATOM 99 C PRO A 310 -2.692 2.409 0.578 1.00 0.00 C ATOM 100 O PRO A 310 -3.275 1.671 1.378 1.00 0.00 O ATOM 101 CB PRO A 310 -0.868 4.017 1.338 1.00 0.00 C ATOM 102 CG PRO A 310 -0.855 4.767 2.632 1.00 0.00 C ATOM 103 CD PRO A 310 -2.188 4.536 3.283 1.00 0.00 C ATOM 0 HA PRO A 310 -2.605 4.436 0.060 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.389 3.044 1.447 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.318 4.558 0.568 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -0.046 4.417 3.273 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.688 5.830 2.460 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.171 3.664 3.936 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.490 5.386 3.894 1.00 0.00 H new ATOM 111 N ALA A 311 -2.316 2.023 -0.650 1.00 0.00 N ATOM 112 CA ALA A 311 -2.633 0.694 -1.211 1.00 0.00 C ATOM 113 C ALA A 311 -1.517 -0.258 -0.897 1.00 0.00 C ATOM 114 O ALA A 311 -1.681 -1.472 -0.759 1.00 0.00 O ATOM 115 CB ALA A 311 -2.872 0.783 -2.713 1.00 0.00 C ATOM 0 H ALA A 311 -1.784 2.619 -1.284 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.552 0.323 -0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.104 -0.208 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.707 1.455 -2.909 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.976 1.166 -3.202 1.00 0.00 H new ATOM 121 N TRP A 312 -0.378 0.384 -0.796 1.00 0.00 N ATOM 122 CA TRP A 312 0.904 -0.210 -0.500 1.00 0.00 C ATOM 123 C TRP A 312 1.011 -0.465 0.998 1.00 0.00 C ATOM 124 O TRP A 312 1.913 -1.146 1.495 1.00 0.00 O ATOM 125 CB TRP A 312 1.950 0.792 -1.031 1.00 0.00 C ATOM 126 CG TRP A 312 2.110 2.090 -0.255 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.766 3.331 -0.713 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.645 2.296 1.072 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.034 4.284 0.237 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.566 3.676 1.340 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.169 1.455 2.063 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.987 4.228 2.546 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.583 2.005 3.258 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.487 3.379 3.490 1.00 0.00 C ATOM 0 H TRP A 312 -0.318 1.394 -0.926 1.00 0.00 H new ATOM 0 HA TRP A 312 1.056 -1.181 -0.972 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.918 0.291 -1.058 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.691 1.041 -2.060 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.343 3.533 -1.686 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.864 5.285 0.137 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.247 0.391 1.893 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.920 5.290 2.728 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.988 1.363 4.027 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.816 3.778 4.438 1.00 0.00 H new ATOM 145 N ALA A 313 0.022 0.102 1.664 1.00 0.00 N ATOM 146 CA ALA A 313 -0.148 0.081 3.099 1.00 0.00 C ATOM 147 C ALA A 313 -0.890 -1.184 3.576 1.00 0.00 C ATOM 148 O ALA A 313 -1.680 -1.141 4.529 1.00 0.00 O ATOM 149 CB ALA A 313 -0.912 1.349 3.433 1.00 0.00 C ATOM 0 H ALA A 313 -0.721 0.616 1.191 1.00 0.00 H new ATOM 0 HA ALA A 313 0.813 0.048 3.613 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.078 1.401 4.509 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.335 2.216 3.113 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.872 1.342 2.918 1.00 0.00 H new ATOM 155 N ARG A 314 -0.603 -2.310 2.913 1.00 0.00 N ATOM 156 CA ARG A 314 -1.221 -3.591 3.233 1.00 0.00 C ATOM 157 C ARG A 314 -0.143 -4.681 3.409 1.00 0.00 C ATOM 158 O ARG A 314 0.440 -5.135 2.419 1.00 0.00 O ATOM 159 CB ARG A 314 -2.221 -3.994 2.138 1.00 0.00 C ATOM 160 CG ARG A 314 -3.524 -3.203 2.176 1.00 0.00 C ATOM 161 CD ARG A 314 -4.507 -3.684 1.118 1.00 0.00 C ATOM 162 NE ARG A 314 -5.129 -4.966 1.479 1.00 0.00 N ATOM 163 CZ ARG A 314 -6.104 -5.567 0.781 1.00 0.00 C ATOM 164 NH1 ARG A 314 -6.594 -5.019 -0.330 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -6.591 -6.725 1.201 1.00 0.00 N ATOM 0 H ARG A 314 0.063 -2.354 2.142 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.763 -3.488 4.173 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -1.753 -3.859 1.163 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -2.448 -5.055 2.238 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.977 -3.296 3.163 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.312 -2.145 2.021 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -5.284 -2.932 0.978 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -3.989 -3.789 0.165 1.00 0.00 H new ATOM 0 HE ARG A 314 -4.795 -5.433 2.322 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -6.228 -4.127 -0.663 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -7.335 -5.491 -0.847 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -6.225 -7.154 2.051 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -7.333 -7.187 0.675 1.00 0.00 H new ATOM 179 N PRO A 315 0.165 -5.102 4.680 1.00 0.00 N ATOM 180 CA PRO A 315 1.176 -6.155 4.972 1.00 0.00 C ATOM 181 C PRO A 315 0.956 -7.468 4.222 1.00 0.00 C ATOM 182 O PRO A 315 1.901 -8.205 3.933 1.00 0.00 O ATOM 183 CB PRO A 315 1.038 -6.393 6.484 1.00 0.00 C ATOM 184 CG PRO A 315 -0.223 -5.703 6.891 1.00 0.00 C ATOM 185 CD PRO A 315 -0.399 -4.567 5.933 1.00 0.00 C ATOM 0 HA PRO A 315 2.163 -5.823 4.651 1.00 0.00 H new ATOM 0 HB2 PRO A 315 0.991 -7.458 6.709 1.00 0.00 H new ATOM 0 HB3 PRO A 315 1.896 -5.991 7.023 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -1.072 -6.385 6.848 1.00 0.00 H new ATOM 0 HG3 PRO A 315 -0.156 -5.341 7.917 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.448 -4.293 5.819 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.130 -3.673 6.265 1.00 0.00 H new ATOM 193 N ASP A 316 -0.302 -7.723 3.926 1.00 0.00 N ATOM 194 CA ASP A 316 -0.734 -8.928 3.204 1.00 0.00 C ATOM 195 C ASP A 316 -0.614 -8.743 1.678 1.00 0.00 C ATOM 196 O ASP A 316 -0.885 -9.671 0.908 1.00 0.00 O ATOM 197 CB ASP A 316 -2.180 -9.273 3.588 1.00 0.00 C ATOM 198 CG ASP A 316 -2.498 -10.748 3.420 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.945 -11.137 2.320 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.302 -11.513 4.389 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.070 -7.100 4.177 1.00 0.00 H new ATOM 0 HA ASP A 316 -0.078 -9.751 3.490 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -2.354 -8.984 4.624 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -2.864 -8.687 2.974 1.00 0.00 H new ATOM 205 N TYR A 317 -0.199 -7.539 1.264 1.00 0.00 N ATOM 206 CA TYR A 317 -0.033 -7.203 -0.146 1.00 0.00 C ATOM 207 C TYR A 317 1.454 -7.177 -0.509 1.00 0.00 C ATOM 208 O TYR A 317 2.230 -6.403 0.064 1.00 0.00 O ATOM 209 CB TYR A 317 -0.696 -5.845 -0.440 1.00 0.00 C ATOM 210 CG TYR A 317 -0.807 -5.495 -1.913 1.00 0.00 C ATOM 211 CD1 TYR A 317 0.131 -4.667 -2.518 1.00 0.00 C ATOM 212 CD2 TYR A 317 -1.847 -5.988 -2.693 1.00 0.00 C ATOM 213 CE1 TYR A 317 0.038 -4.340 -3.856 1.00 0.00 C ATOM 214 CE2 TYR A 317 -1.947 -5.665 -4.033 1.00 0.00 C ATOM 215 CZ TYR A 317 -1.002 -4.842 -4.610 1.00 0.00 C ATOM 216 OH TYR A 317 -1.098 -4.520 -5.945 1.00 0.00 O ATOM 0 H TYR A 317 0.029 -6.775 1.900 1.00 0.00 H new ATOM 0 HA TYR A 317 -0.518 -7.963 -0.758 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -1.695 -5.843 -0.004 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -0.127 -5.063 0.063 1.00 0.00 H new ATOM 0 HD1 TYR A 317 0.947 -4.272 -1.931 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -2.588 -6.633 -2.245 1.00 0.00 H new ATOM 0 HE1 TYR A 317 0.776 -3.695 -4.310 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -2.761 -6.055 -4.626 1.00 0.00 H new ATOM 0 HH TYR A 317 -1.886 -4.956 -6.331 1.00 0.00 H new ATOM 226 N ASN A 318 1.832 -8.034 -1.458 1.00 0.00 N ATOM 227 CA ASN A 318 3.220 -8.131 -1.920 1.00 0.00 C ATOM 228 C ASN A 318 3.438 -7.291 -3.191 1.00 0.00 C ATOM 229 O ASN A 318 2.483 -7.072 -3.945 1.00 0.00 O ATOM 230 CB ASN A 318 3.592 -9.591 -2.195 1.00 0.00 C ATOM 231 CG ASN A 318 3.698 -10.417 -0.926 1.00 0.00 C ATOM 232 OD1 ASN A 318 4.763 -10.510 -0.317 1.00 0.00 O ATOM 233 ND2 ASN A 318 2.588 -11.025 -0.522 1.00 0.00 N ATOM 0 H ASN A 318 1.192 -8.676 -1.926 1.00 0.00 H new ATOM 0 HA ASN A 318 3.863 -7.741 -1.131 1.00 0.00 H new ATOM 0 HB2 ASN A 318 2.844 -10.035 -2.851 1.00 0.00 H new ATOM 0 HB3 ASN A 318 4.543 -9.626 -2.727 1.00 0.00 H new ATOM 0 HD21 ASN A 318 2.598 -11.596 0.323 1.00 0.00 H new ATOM 0 HD22 ASN A 318 1.726 -10.921 -1.057 1.00 0.00 H new ATOM 240 N PRO A 319 4.693 -6.802 -3.460 1.00 0.00 N ATOM 241 CA PRO A 319 4.990 -5.992 -4.660 1.00 0.00 C ATOM 242 C PRO A 319 4.969 -6.821 -5.959 1.00 0.00 C ATOM 243 O PRO A 319 5.119 -8.044 -5.899 1.00 0.00 O ATOM 244 CB PRO A 319 6.412 -5.457 -4.412 1.00 0.00 C ATOM 245 CG PRO A 319 6.724 -5.768 -2.987 1.00 0.00 C ATOM 246 CD PRO A 319 5.907 -6.975 -2.633 1.00 0.00 C ATOM 0 HA PRO A 319 4.241 -5.212 -4.797 1.00 0.00 H new ATOM 0 HB2 PRO A 319 7.130 -5.931 -5.081 1.00 0.00 H new ATOM 0 HB3 PRO A 319 6.463 -4.384 -4.598 1.00 0.00 H new ATOM 0 HG2 PRO A 319 7.788 -5.966 -2.856 1.00 0.00 H new ATOM 0 HG3 PRO A 319 6.474 -4.926 -2.341 1.00 0.00 H new ATOM 0 HD2 PRO A 319 6.430 -7.901 -2.871 1.00 0.00 H new ATOM 0 HD3 PRO A 319 5.671 -7.006 -1.569 1.00 0.00 H new ATOM 254 N PRO A 320 4.783 -6.177 -7.158 1.00 0.00 N ATOM 255 CA PRO A 320 4.758 -6.889 -8.449 1.00 0.00 C ATOM 256 C PRO A 320 6.145 -7.384 -8.873 1.00 0.00 C ATOM 257 O PRO A 320 7.033 -6.590 -9.211 1.00 0.00 O ATOM 258 CB PRO A 320 4.227 -5.844 -9.452 1.00 0.00 C ATOM 259 CG PRO A 320 3.777 -4.681 -8.633 1.00 0.00 C ATOM 260 CD PRO A 320 4.569 -4.729 -7.360 1.00 0.00 C ATOM 0 HA PRO A 320 4.140 -7.785 -8.394 1.00 0.00 H new ATOM 0 HB2 PRO A 320 5.005 -5.548 -10.156 1.00 0.00 H new ATOM 0 HB3 PRO A 320 3.403 -6.250 -10.039 1.00 0.00 H new ATOM 0 HG2 PRO A 320 3.948 -3.744 -9.162 1.00 0.00 H new ATOM 0 HG3 PRO A 320 2.708 -4.740 -8.428 1.00 0.00 H new ATOM 0 HD2 PRO A 320 5.512 -4.190 -7.451 1.00 0.00 H new ATOM 0 HD3 PRO A 320 4.025 -4.281 -6.529 1.00 0.00 H new ATOM 268 N LEU A 321 6.318 -8.705 -8.823 1.00 0.00 N ATOM 269 CA LEU A 321 7.581 -9.345 -9.198 1.00 0.00 C ATOM 270 C LEU A 321 7.516 -9.895 -10.620 1.00 0.00 C ATOM 271 O LEU A 321 6.602 -10.653 -10.959 1.00 0.00 O ATOM 272 CB LEU A 321 7.925 -10.473 -8.213 1.00 0.00 C ATOM 273 CG LEU A 321 8.295 -10.025 -6.792 1.00 0.00 C ATOM 274 CD1 LEU A 321 7.973 -11.124 -5.789 1.00 0.00 C ATOM 275 CD2 LEU A 321 9.770 -9.650 -6.706 1.00 0.00 C ATOM 0 H LEU A 321 5.594 -9.358 -8.524 1.00 0.00 H new ATOM 0 HA LEU A 321 8.365 -8.588 -9.158 1.00 0.00 H new ATOM 0 HB2 LEU A 321 7.072 -11.149 -8.151 1.00 0.00 H new ATOM 0 HB3 LEU A 321 8.757 -11.046 -8.622 1.00 0.00 H new ATOM 0 HG LEU A 321 7.703 -9.142 -6.550 1.00 0.00 H new ATOM 0 HD11 LEU A 321 8.241 -10.791 -4.786 1.00 0.00 H new ATOM 0 HD12 LEU A 321 6.907 -11.348 -5.824 1.00 0.00 H new ATOM 0 HD13 LEU A 321 8.540 -12.021 -6.037 1.00 0.00 H new ATOM 0 HD21 LEU A 321 10.007 -9.336 -5.689 1.00 0.00 H new ATOM 0 HD22 LEU A 321 10.381 -10.513 -6.971 1.00 0.00 H new ATOM 0 HD23 LEU A 321 9.978 -8.832 -7.396 1.00 0.00 H new ATOM 287 N VAL A 322 8.493 -9.501 -11.443 1.00 0.00 N ATOM 288 CA VAL A 322 8.569 -9.943 -12.841 1.00 0.00 C ATOM 289 C VAL A 322 10.016 -10.210 -13.261 1.00 0.00 C ATOM 290 O VAL A 322 10.911 -9.411 -12.967 1.00 0.00 O ATOM 291 CB VAL A 322 7.913 -8.929 -13.830 1.00 0.00 C ATOM 292 CG1 VAL A 322 6.398 -9.045 -13.776 1.00 0.00 C ATOM 293 CG2 VAL A 322 8.342 -7.483 -13.556 1.00 0.00 C ATOM 0 H VAL A 322 9.247 -8.873 -11.164 1.00 0.00 H new ATOM 0 HA VAL A 322 8.002 -10.872 -12.894 1.00 0.00 H new ATOM 0 HB VAL A 322 8.263 -9.185 -14.830 1.00 0.00 H new ATOM 0 HG11 VAL A 322 5.954 -8.332 -14.471 1.00 0.00 H new ATOM 0 HG12 VAL A 322 6.100 -10.056 -14.054 1.00 0.00 H new ATOM 0 HG13 VAL A 322 6.052 -8.830 -12.765 1.00 0.00 H new ATOM 0 HG21 VAL A 322 7.858 -6.818 -14.271 1.00 0.00 H new ATOM 0 HG22 VAL A 322 8.050 -7.202 -12.544 1.00 0.00 H new ATOM 0 HG23 VAL A 322 9.424 -7.399 -13.658 1.00 0.00 H new ATOM 303 N GLU A 323 10.226 -11.335 -13.949 1.00 0.00 N ATOM 304 CA GLU A 323 11.556 -11.727 -14.421 1.00 0.00 C ATOM 305 C GLU A 323 11.527 -12.059 -15.912 1.00 0.00 C ATOM 306 O GLU A 323 10.793 -12.995 -16.300 1.00 0.00 O ATOM 307 CB GLU A 323 12.086 -12.926 -13.618 1.00 0.00 C ATOM 308 CG GLU A 323 12.507 -12.588 -12.191 1.00 0.00 C ATOM 309 CD GLU A 323 13.884 -11.950 -12.113 1.00 0.00 C ATOM 310 OE1 GLU A 323 14.877 -12.697 -11.989 1.00 0.00 O ATOM 311 OE2 GLU A 323 13.966 -10.705 -12.177 1.00 0.00 O1- ATOM 312 OXT GLU A 323 12.240 -11.379 -16.680 1.00 0.00 O1- ATOM 0 H GLU A 323 9.487 -11.994 -14.193 1.00 0.00 H new ATOM 0 HA GLU A 323 12.229 -10.883 -14.269 1.00 0.00 H new ATOM 0 HB2 GLU A 323 11.315 -13.696 -13.584 1.00 0.00 H new ATOM 0 HB3 GLU A 323 12.939 -13.353 -14.145 1.00 0.00 H new ATOM 0 HG2 GLU A 323 11.774 -11.911 -11.753 1.00 0.00 H new ATOM 0 HG3 GLU A 323 12.500 -13.498 -11.591 1.00 0.00 H new TER 319 GLU A 323