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 -15.861 17.107 9.214 1.00 0.00 N ATOM 2 CA GLY A 304 -16.164 15.891 8.409 1.00 0.00 C ATOM 3 C GLY A 304 -14.966 15.407 7.618 1.00 0.00 C ATOM 4 O GLY A 304 -13.894 15.182 8.184 1.00 0.00 O ATOM 0 HA2 GLY A 304 -16.503 15.095 9.072 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -16.984 16.107 7.725 1.00 0.00 H new ATOM 10 N PHE A 305 -15.156 15.249 6.290 1.00 0.00 N ATOM 11 CA PHE A 305 -14.103 14.784 5.353 1.00 0.00 C ATOM 12 C PHE A 305 -13.556 13.388 5.741 1.00 0.00 C ATOM 13 O PHE A 305 -12.825 13.268 6.730 1.00 0.00 O ATOM 14 CB PHE A 305 -12.947 15.802 5.253 1.00 0.00 C ATOM 15 CG PHE A 305 -13.338 17.100 4.602 1.00 0.00 C ATOM 16 CD1 PHE A 305 -13.822 18.154 5.361 1.00 0.00 C ATOM 17 CD2 PHE A 305 -13.222 17.265 3.230 1.00 0.00 C ATOM 18 CE1 PHE A 305 -14.181 19.347 4.764 1.00 0.00 C ATOM 19 CE2 PHE A 305 -13.580 18.456 2.629 1.00 0.00 C ATOM 20 CZ PHE A 305 -14.060 19.500 3.397 1.00 0.00 C ATOM 0 H PHE A 305 -16.048 15.441 5.833 1.00 0.00 H new ATOM 0 HA PHE A 305 -14.574 14.698 4.374 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -12.568 16.008 6.254 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -12.129 15.355 4.688 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -13.920 18.041 6.431 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -12.847 16.453 2.624 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -14.557 20.161 5.367 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -13.485 18.571 1.559 1.00 0.00 H new ATOM 0 HZ PHE A 305 -14.340 20.433 2.929 1.00 0.00 H new ATOM 30 N PRO A 306 -13.911 12.301 4.978 1.00 0.00 N ATOM 31 CA PRO A 306 -13.428 10.928 5.267 1.00 0.00 C ATOM 32 C PRO A 306 -11.908 10.787 5.140 1.00 0.00 C ATOM 33 O PRO A 306 -11.260 11.586 4.458 1.00 0.00 O ATOM 34 CB PRO A 306 -14.119 10.059 4.205 1.00 0.00 C ATOM 35 CG PRO A 306 -15.263 10.873 3.713 1.00 0.00 C ATOM 36 CD PRO A 306 -14.820 12.304 3.804 1.00 0.00 C ATOM 0 HA PRO A 306 -13.658 10.644 6.294 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -13.435 9.812 3.393 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -14.462 9.116 4.631 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -15.518 10.608 2.687 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -16.153 10.701 4.318 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -14.307 12.626 2.898 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -15.664 12.979 3.949 1.00 0.00 H new ATOM 44 N ARG A 307 -11.360 9.764 5.803 1.00 0.00 N ATOM 45 CA ARG A 307 -9.920 9.497 5.782 1.00 0.00 C ATOM 46 C ARG A 307 -9.584 8.402 4.773 1.00 0.00 C ATOM 47 O ARG A 307 -10.374 7.477 4.565 1.00 0.00 O ATOM 48 CB ARG A 307 -9.428 9.088 7.175 1.00 0.00 C ATOM 49 CG ARG A 307 -9.377 10.237 8.174 1.00 0.00 C ATOM 50 CD ARG A 307 -8.904 9.767 9.540 1.00 0.00 C ATOM 51 NE ARG A 307 -8.864 10.862 10.515 1.00 0.00 N ATOM 52 CZ ARG A 307 -8.606 10.712 11.823 1.00 0.00 C ATOM 53 NH1 ARG A 307 -8.360 9.511 12.344 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -8.596 11.776 12.613 1.00 0.00 N ATOM 0 H ARG A 307 -11.897 9.103 6.365 1.00 0.00 H new ATOM 0 HA ARG A 307 -9.414 10.415 5.482 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -10.082 8.308 7.566 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -8.432 8.654 7.085 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -8.708 11.013 7.803 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -10.366 10.686 8.265 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -9.568 8.982 9.903 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -7.911 9.327 9.448 1.00 0.00 H new ATOM 0 HE ARG A 307 -9.045 11.806 10.174 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -8.366 8.685 11.746 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -8.166 9.418 13.341 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -8.784 12.701 12.226 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -8.401 11.670 13.609 1.00 0.00 H new ATOM 68 N ALA A 308 -8.406 8.522 4.153 1.00 0.00 N ATOM 69 CA ALA A 308 -7.942 7.552 3.162 1.00 0.00 C ATOM 70 C ALA A 308 -6.588 6.968 3.551 1.00 0.00 C ATOM 71 O ALA A 308 -5.776 7.642 4.192 1.00 0.00 O ATOM 72 CB ALA A 308 -7.863 8.203 1.788 1.00 0.00 C ATOM 0 H ALA A 308 -7.754 9.288 4.323 1.00 0.00 H new ATOM 0 HA ALA A 308 -8.661 6.734 3.127 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -7.516 7.471 1.058 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -8.850 8.564 1.499 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -7.166 9.040 1.822 1.00 0.00 H new ATOM 78 N LEU A 309 -6.361 5.713 3.157 1.00 0.00 N ATOM 79 CA LEU A 309 -5.108 5.014 3.456 1.00 0.00 C ATOM 80 C LEU A 309 -4.428 4.526 2.166 1.00 0.00 C ATOM 81 O LEU A 309 -5.112 4.322 1.158 1.00 0.00 O ATOM 82 CB LEU A 309 -5.369 3.823 4.390 1.00 0.00 C ATOM 83 CG LEU A 309 -5.810 4.181 5.816 1.00 0.00 C ATOM 84 CD1 LEU A 309 -7.322 4.351 5.895 1.00 0.00 C ATOM 85 CD2 LEU A 309 -5.342 3.115 6.797 1.00 0.00 C ATOM 0 H LEU A 309 -7.032 5.157 2.627 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.441 5.719 3.953 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -6.136 3.193 3.940 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -4.459 3.225 4.450 1.00 0.00 H new ATOM 0 HG LEU A 309 -5.350 5.132 6.085 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -7.607 4.604 6.916 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -7.634 5.150 5.223 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -7.809 3.420 5.603 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -5.662 3.382 7.804 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -5.774 2.153 6.522 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -4.255 3.046 6.768 1.00 0.00 H new ATOM 97 N PRO A 310 -3.068 4.321 2.164 1.00 0.00 N ATOM 98 CA PRO A 310 -2.336 3.844 0.971 1.00 0.00 C ATOM 99 C PRO A 310 -2.683 2.393 0.595 1.00 0.00 C ATOM 100 O PRO A 310 -3.257 1.651 1.398 1.00 0.00 O ATOM 101 CB PRO A 310 -0.850 3.999 1.340 1.00 0.00 C ATOM 102 CG PRO A 310 -0.818 4.774 2.617 1.00 0.00 C ATOM 103 CD PRO A 310 -2.139 4.548 3.295 1.00 0.00 C ATOM 0 HA PRO A 310 -2.607 4.418 0.085 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.376 3.025 1.463 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.306 4.522 0.553 1.00 0.00 H new ATOM 0 HG2 PRO A 310 0.004 4.441 3.251 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.660 5.835 2.422 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.105 3.690 3.966 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.437 5.409 3.893 1.00 0.00 H new ATOM 111 N ALA A 311 -2.315 2.015 -0.639 1.00 0.00 N ATOM 112 CA ALA A 311 -2.636 0.689 -1.205 1.00 0.00 C ATOM 113 C ALA A 311 -1.516 -0.261 -0.902 1.00 0.00 C ATOM 114 O ALA A 311 -1.674 -1.478 -0.777 1.00 0.00 O ATOM 115 CB ALA A 311 -2.883 0.784 -2.703 1.00 0.00 C ATOM 0 H ALA A 311 -1.788 2.615 -1.273 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.553 0.316 -0.748 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.117 -0.205 -3.097 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.719 1.457 -2.892 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.990 1.168 -3.195 1.00 0.00 H new ATOM 121 N TRP A 312 -0.378 0.385 -0.796 1.00 0.00 N ATOM 122 CA TRP A 312 0.906 -0.207 -0.504 1.00 0.00 C ATOM 123 C TRP A 312 1.011 -0.467 0.993 1.00 0.00 C ATOM 124 O TRP A 312 1.912 -1.147 1.491 1.00 0.00 O ATOM 125 CB TRP A 312 1.951 0.796 -1.032 1.00 0.00 C ATOM 126 CG TRP A 312 2.109 2.098 -0.258 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.776 3.338 -0.723 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.633 2.304 1.072 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.041 4.293 0.224 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.560 3.686 1.335 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.143 1.463 2.071 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.974 4.240 2.544 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.550 2.016 3.268 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.462 3.392 3.496 1.00 0.00 C ATOM 0 H TRP A 312 -0.321 1.396 -0.918 1.00 0.00 H new ATOM 0 HA TRP A 312 1.061 -1.175 -0.981 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.919 0.296 -1.056 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.694 1.043 -2.062 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.362 3.538 -1.700 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.878 5.294 0.118 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.216 0.398 1.906 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.911 5.303 2.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.943 1.374 4.042 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.787 3.793 4.445 1.00 0.00 H new ATOM 145 N ALA A 313 0.018 0.096 1.656 1.00 0.00 N ATOM 146 CA ALA A 313 -0.165 0.062 3.090 1.00 0.00 C ATOM 147 C ALA A 313 -0.923 -1.202 3.542 1.00 0.00 C ATOM 148 O ALA A 313 -1.619 -1.198 4.565 1.00 0.00 O ATOM 149 CB ALA A 313 -0.926 1.332 3.429 1.00 0.00 C ATOM 0 H ALA A 313 -0.720 0.616 1.181 1.00 0.00 H new ATOM 0 HA ALA A 313 0.790 0.018 3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.102 1.375 4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.342 2.199 3.122 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.882 1.334 2.905 1.00 0.00 H new ATOM 155 N ARG A 314 -0.751 -2.283 2.774 1.00 0.00 N ATOM 156 CA ARG A 314 -1.399 -3.558 3.049 1.00 0.00 C ATOM 157 C ARG A 314 -0.359 -4.696 3.041 1.00 0.00 C ATOM 158 O ARG A 314 0.125 -5.076 1.970 1.00 0.00 O ATOM 159 CB ARG A 314 -2.507 -3.835 2.020 1.00 0.00 C ATOM 160 CG ARG A 314 -3.747 -2.972 2.200 1.00 0.00 C ATOM 161 CD ARG A 314 -4.783 -3.252 1.124 1.00 0.00 C ATOM 162 NE ARG A 314 -5.980 -2.418 1.282 1.00 0.00 N ATOM 163 CZ ARG A 314 -6.944 -2.282 0.360 1.00 0.00 C ATOM 164 NH1 ARG A 314 -6.877 -2.920 -0.807 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -7.984 -1.500 0.612 1.00 0.00 N ATOM 0 H ARG A 314 -0.157 -2.293 1.945 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.856 -3.509 4.038 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -2.107 -3.675 1.019 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -2.795 -4.884 2.084 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -4.182 -3.159 3.182 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.466 -1.919 2.171 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -4.344 -3.073 0.143 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -5.067 -4.304 1.159 1.00 0.00 H new ATOM 0 HE ARG A 314 -6.086 -1.904 2.157 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -6.082 -3.525 -1.012 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -7.621 -2.803 -1.495 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -8.047 -1.007 1.502 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -8.721 -1.392 -0.085 1.00 0.00 H new ATOM 179 N PRO A 315 0.032 -5.244 4.239 1.00 0.00 N ATOM 180 CA PRO A 315 1.022 -6.349 4.363 1.00 0.00 C ATOM 181 C PRO A 315 0.792 -7.534 3.426 1.00 0.00 C ATOM 182 O PRO A 315 1.716 -8.293 3.116 1.00 0.00 O ATOM 183 CB PRO A 315 0.876 -6.819 5.819 1.00 0.00 C ATOM 184 CG PRO A 315 -0.261 -6.042 6.403 1.00 0.00 C ATOM 185 CD PRO A 315 -0.409 -4.803 5.574 1.00 0.00 C ATOM 0 HA PRO A 315 2.011 -5.981 4.090 1.00 0.00 H new ATOM 0 HB2 PRO A 315 0.677 -7.890 5.863 1.00 0.00 H new ATOM 0 HB3 PRO A 315 1.795 -6.642 6.378 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -1.179 -6.629 6.388 1.00 0.00 H new ATOM 0 HG3 PRO A 315 -0.062 -5.789 7.444 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.439 -4.446 5.562 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.206 -3.987 5.954 1.00 0.00 H new ATOM 193 N ASP A 316 -0.446 -7.665 2.995 1.00 0.00 N ATOM 194 CA ASP A 316 -0.879 -8.734 2.083 1.00 0.00 C ATOM 195 C ASP A 316 -0.612 -8.375 0.604 1.00 0.00 C ATOM 196 O ASP A 316 -1.169 -8.997 -0.308 1.00 0.00 O ATOM 197 CB ASP A 316 -2.371 -9.029 2.299 1.00 0.00 C ATOM 198 CG ASP A 316 -2.647 -9.709 3.627 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.636 -10.955 3.670 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.873 -8.990 4.624 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.198 -7.031 3.264 1.00 0.00 H new ATOM 0 HA ASP A 316 -0.294 -9.625 2.311 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -2.933 -8.096 2.250 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -2.733 -9.662 1.489 1.00 0.00 H new ATOM 205 N TYR A 317 0.263 -7.383 0.383 1.00 0.00 N ATOM 206 CA TYR A 317 0.623 -6.932 -0.963 1.00 0.00 C ATOM 207 C TYR A 317 1.874 -7.666 -1.456 1.00 0.00 C ATOM 208 O TYR A 317 2.971 -7.489 -0.909 1.00 0.00 O ATOM 209 CB TYR A 317 0.853 -5.409 -0.963 1.00 0.00 C ATOM 210 CG TYR A 317 0.735 -4.756 -2.327 1.00 0.00 C ATOM 211 CD1 TYR A 317 1.820 -4.714 -3.196 1.00 0.00 C ATOM 212 CD2 TYR A 317 -0.460 -4.180 -2.741 1.00 0.00 C ATOM 213 CE1 TYR A 317 1.716 -4.117 -4.437 1.00 0.00 C ATOM 214 CE2 TYR A 317 -0.570 -3.581 -3.982 1.00 0.00 C ATOM 215 CZ TYR A 317 0.520 -3.554 -4.825 1.00 0.00 C ATOM 216 OH TYR A 317 0.414 -2.957 -6.062 1.00 0.00 O ATOM 0 H TYR A 317 0.737 -6.875 1.130 1.00 0.00 H new ATOM 0 HA TYR A 317 -0.197 -7.162 -1.643 1.00 0.00 H new ATOM 0 HB2 TYR A 317 0.133 -4.945 -0.289 1.00 0.00 H new ATOM 0 HB3 TYR A 317 1.845 -5.204 -0.560 1.00 0.00 H new ATOM 0 HD1 TYR A 317 2.759 -5.155 -2.896 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -1.316 -4.201 -2.083 1.00 0.00 H new ATOM 0 HE1 TYR A 317 2.568 -4.092 -5.100 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -1.505 -3.137 -4.289 1.00 0.00 H new ATOM 0 HH TYR A 317 -0.495 -2.610 -6.181 1.00 0.00 H new ATOM 226 N ASN A 318 1.689 -8.499 -2.481 1.00 0.00 N ATOM 227 CA ASN A 318 2.785 -9.274 -3.066 1.00 0.00 C ATOM 228 C ASN A 318 3.258 -8.642 -4.384 1.00 0.00 C ATOM 229 O ASN A 318 2.428 -8.130 -5.141 1.00 0.00 O ATOM 230 CB ASN A 318 2.345 -10.721 -3.313 1.00 0.00 C ATOM 231 CG ASN A 318 2.150 -11.501 -2.026 1.00 0.00 C ATOM 232 OD1 ASN A 318 3.080 -12.131 -1.520 1.00 0.00 O ATOM 233 ND2 ASN A 318 0.934 -11.466 -1.491 1.00 0.00 N ATOM 0 H ASN A 318 0.784 -8.655 -2.926 1.00 0.00 H new ATOM 0 HA ASN A 318 3.615 -9.270 -2.359 1.00 0.00 H new ATOM 0 HB2 ASN A 318 1.413 -10.722 -3.878 1.00 0.00 H new ATOM 0 HB3 ASN A 318 3.091 -11.224 -3.928 1.00 0.00 H new ATOM 0 HD21 ASN A 318 0.742 -11.974 -0.628 1.00 0.00 H new ATOM 0 HD22 ASN A 318 0.193 -10.931 -1.944 1.00 0.00 H new ATOM 240 N PRO A 319 4.598 -8.658 -4.696 1.00 0.00 N ATOM 241 CA PRO A 319 5.130 -8.078 -5.945 1.00 0.00 C ATOM 242 C PRO A 319 4.890 -8.982 -7.172 1.00 0.00 C ATOM 243 O PRO A 319 4.622 -10.175 -7.002 1.00 0.00 O ATOM 244 CB PRO A 319 6.643 -7.947 -5.684 1.00 0.00 C ATOM 245 CG PRO A 319 6.859 -8.342 -4.257 1.00 0.00 C ATOM 246 CD PRO A 319 5.697 -9.211 -3.876 1.00 0.00 C ATOM 0 HA PRO A 319 4.638 -7.134 -6.178 1.00 0.00 H new ATOM 0 HB2 PRO A 319 7.211 -8.591 -6.356 1.00 0.00 H new ATOM 0 HB3 PRO A 319 6.981 -6.926 -5.860 1.00 0.00 H new ATOM 0 HG2 PRO A 319 7.800 -8.880 -4.141 1.00 0.00 H new ATOM 0 HG3 PRO A 319 6.913 -7.463 -3.615 1.00 0.00 H new ATOM 0 HD2 PRO A 319 5.884 -10.260 -4.104 1.00 0.00 H new ATOM 0 HD3 PRO A 319 5.478 -9.150 -2.810 1.00 0.00 H new ATOM 254 N PRO A 320 4.981 -8.436 -8.430 1.00 0.00 N ATOM 255 CA PRO A 320 4.779 -9.230 -9.660 1.00 0.00 C ATOM 256 C PRO A 320 5.880 -10.272 -9.878 1.00 0.00 C ATOM 257 O PRO A 320 7.046 -9.931 -10.115 1.00 0.00 O ATOM 258 CB PRO A 320 4.796 -8.186 -10.794 1.00 0.00 C ATOM 259 CG PRO A 320 4.659 -6.864 -10.124 1.00 0.00 C ATOM 260 CD PRO A 320 5.262 -7.022 -8.760 1.00 0.00 C ATOM 0 HA PRO A 320 3.852 -9.801 -9.611 1.00 0.00 H new ATOM 0 HB2 PRO A 320 5.723 -8.242 -11.364 1.00 0.00 H new ATOM 0 HB3 PRO A 320 3.979 -8.356 -11.496 1.00 0.00 H new ATOM 0 HG2 PRO A 320 5.173 -6.086 -10.689 1.00 0.00 H new ATOM 0 HG3 PRO A 320 3.612 -6.569 -10.055 1.00 0.00 H new ATOM 0 HD2 PRO A 320 6.332 -6.815 -8.766 1.00 0.00 H new ATOM 0 HD3 PRO A 320 4.810 -6.342 -8.038 1.00 0.00 H new ATOM 268 N LEU A 321 5.490 -11.541 -9.773 1.00 0.00 N ATOM 269 CA LEU A 321 6.413 -12.667 -9.953 1.00 0.00 C ATOM 270 C LEU A 321 6.352 -13.209 -11.381 1.00 0.00 C ATOM 271 O LEU A 321 5.275 -13.277 -11.982 1.00 0.00 O ATOM 272 CB LEU A 321 6.124 -13.787 -8.930 1.00 0.00 C ATOM 273 CG LEU A 321 4.658 -14.243 -8.803 1.00 0.00 C ATOM 274 CD1 LEU A 321 4.367 -15.408 -9.739 1.00 0.00 C ATOM 275 CD2 LEU A 321 4.346 -14.625 -7.364 1.00 0.00 C ATOM 0 H LEU A 321 4.532 -11.820 -9.562 1.00 0.00 H new ATOM 0 HA LEU A 321 7.424 -12.298 -9.777 1.00 0.00 H new ATOM 0 HB2 LEU A 321 6.729 -14.654 -9.194 1.00 0.00 H new ATOM 0 HB3 LEU A 321 6.462 -13.449 -7.950 1.00 0.00 H new ATOM 0 HG LEU A 321 4.016 -13.410 -9.091 1.00 0.00 H new ATOM 0 HD11 LEU A 321 3.326 -15.711 -9.630 1.00 0.00 H new ATOM 0 HD12 LEU A 321 4.550 -15.102 -10.769 1.00 0.00 H new ATOM 0 HD13 LEU A 321 5.017 -16.247 -9.489 1.00 0.00 H new ATOM 0 HD21 LEU A 321 3.307 -14.945 -7.290 1.00 0.00 H new ATOM 0 HD22 LEU A 321 5.000 -15.440 -7.054 1.00 0.00 H new ATOM 0 HD23 LEU A 321 4.508 -13.764 -6.716 1.00 0.00 H new ATOM 287 N VAL A 322 7.519 -13.593 -11.911 1.00 0.00 N ATOM 288 CA VAL A 322 7.624 -14.134 -13.272 1.00 0.00 C ATOM 289 C VAL A 322 8.621 -15.293 -13.329 1.00 0.00 C ATOM 290 O VAL A 322 9.710 -15.214 -12.753 1.00 0.00 O ATOM 291 CB VAL A 322 8.016 -13.049 -14.320 1.00 0.00 C ATOM 292 CG1 VAL A 322 6.817 -12.176 -14.654 1.00 0.00 C ATOM 293 CG2 VAL A 322 9.189 -12.179 -13.854 1.00 0.00 C ATOM 0 H VAL A 322 8.409 -13.539 -11.415 1.00 0.00 H new ATOM 0 HA VAL A 322 6.631 -14.501 -13.531 1.00 0.00 H new ATOM 0 HB VAL A 322 8.342 -13.577 -15.216 1.00 0.00 H new ATOM 0 HG11 VAL A 322 7.108 -11.424 -15.387 1.00 0.00 H new ATOM 0 HG12 VAL A 322 6.020 -12.795 -15.066 1.00 0.00 H new ATOM 0 HG13 VAL A 322 6.463 -11.683 -13.749 1.00 0.00 H new ATOM 0 HG21 VAL A 322 9.421 -11.440 -14.621 1.00 0.00 H new ATOM 0 HG22 VAL A 322 8.919 -11.669 -12.929 1.00 0.00 H new ATOM 0 HG23 VAL A 322 10.062 -12.808 -13.680 1.00 0.00 H new ATOM 303 N GLU A 323 8.233 -16.361 -14.032 1.00 0.00 N ATOM 304 CA GLU A 323 9.077 -17.549 -14.180 1.00 0.00 C ATOM 305 C GLU A 323 9.804 -17.537 -15.525 1.00 0.00 C ATOM 306 O GLU A 323 11.054 -17.529 -15.517 1.00 0.00 O ATOM 307 CB GLU A 323 8.238 -18.828 -14.045 1.00 0.00 C ATOM 308 CG GLU A 323 7.790 -19.122 -12.620 1.00 0.00 C ATOM 309 CD GLU A 323 6.968 -20.391 -12.518 1.00 0.00 C ATOM 310 OE1 GLU A 323 5.728 -20.308 -12.643 1.00 0.00 O ATOM 311 OE2 GLU A 323 7.563 -21.470 -12.313 1.00 0.00 O1- ATOM 312 OXT GLU A 323 9.122 -17.520 -16.573 1.00 0.00 O1- ATOM 0 H GLU A 323 7.334 -16.426 -14.510 1.00 0.00 H new ATOM 0 HA GLU A 323 9.822 -17.533 -13.385 1.00 0.00 H new ATOM 0 HB2 GLU A 323 7.358 -18.743 -14.682 1.00 0.00 H new ATOM 0 HB3 GLU A 323 8.819 -19.673 -14.415 1.00 0.00 H new ATOM 0 HG2 GLU A 323 8.667 -19.209 -11.978 1.00 0.00 H new ATOM 0 HG3 GLU A 323 7.203 -18.282 -12.247 1.00 0.00 H new TER 319 GLU A 323