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= 0.158 K(o=0.16,f=-5.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 304 -3.487 15.496 -1.287 1.00 0.00 N ATOM 2 CA GLY A 304 -4.824 16.136 -1.153 1.00 0.00 C ATOM 3 C GLY A 304 -5.196 16.400 0.293 1.00 0.00 C ATOM 4 O GLY A 304 -5.021 17.518 0.790 1.00 0.00 O ATOM 0 HA2 GLY A 304 -4.831 17.076 -1.705 1.00 0.00 H new ATOM 0 HA3 GLY A 304 -5.578 15.494 -1.608 1.00 0.00 H new ATOM 10 N PHE A 305 -5.712 15.366 0.965 1.00 0.00 N ATOM 11 CA PHE A 305 -6.120 15.469 2.367 1.00 0.00 C ATOM 12 C PHE A 305 -5.036 14.890 3.298 1.00 0.00 C ATOM 13 O PHE A 305 -4.213 14.091 2.842 1.00 0.00 O ATOM 14 CB PHE A 305 -7.450 14.735 2.587 1.00 0.00 C ATOM 15 CG PHE A 305 -8.632 15.413 1.950 1.00 0.00 C ATOM 16 CD1 PHE A 305 -9.007 15.107 0.652 1.00 0.00 C ATOM 17 CD2 PHE A 305 -9.367 16.354 2.653 1.00 0.00 C ATOM 18 CE1 PHE A 305 -10.093 15.728 0.065 1.00 0.00 C ATOM 19 CE2 PHE A 305 -10.455 16.979 2.071 1.00 0.00 C ATOM 20 CZ PHE A 305 -10.819 16.665 0.775 1.00 0.00 C ATOM 0 H PHE A 305 -5.857 14.443 0.556 1.00 0.00 H new ATOM 0 HA PHE A 305 -6.252 16.524 2.607 1.00 0.00 H new ATOM 0 HB2 PHE A 305 -7.366 13.724 2.189 1.00 0.00 H new ATOM 0 HB3 PHE A 305 -7.630 14.643 3.658 1.00 0.00 H new ATOM 0 HD1 PHE A 305 -8.444 14.375 0.092 1.00 0.00 H new ATOM 0 HD2 PHE A 305 -9.087 16.602 3.666 1.00 0.00 H new ATOM 0 HE1 PHE A 305 -10.374 15.481 -0.948 1.00 0.00 H new ATOM 0 HE2 PHE A 305 -11.020 17.712 2.629 1.00 0.00 H new ATOM 0 HZ PHE A 305 -11.669 17.151 0.319 1.00 0.00 H new ATOM 30 N PRO A 306 -5.008 15.270 4.620 1.00 0.00 N ATOM 31 CA PRO A 306 -4.000 14.757 5.576 1.00 0.00 C ATOM 32 C PRO A 306 -4.222 13.288 5.958 1.00 0.00 C ATOM 33 O PRO A 306 -3.257 12.548 6.171 1.00 0.00 O ATOM 34 CB PRO A 306 -4.166 15.655 6.818 1.00 0.00 C ATOM 35 CG PRO A 306 -5.060 16.772 6.395 1.00 0.00 C ATOM 36 CD PRO A 306 -5.919 16.223 5.297 1.00 0.00 C ATOM 0 HA PRO A 306 -3.002 14.788 5.138 1.00 0.00 H new ATOM 0 HB2 PRO A 306 -4.602 15.098 7.648 1.00 0.00 H new ATOM 0 HB3 PRO A 306 -3.202 16.033 7.159 1.00 0.00 H new ATOM 0 HG2 PRO A 306 -5.669 17.121 7.229 1.00 0.00 H new ATOM 0 HG3 PRO A 306 -4.479 17.625 6.046 1.00 0.00 H new ATOM 0 HD2 PRO A 306 -6.808 15.727 5.687 1.00 0.00 H new ATOM 0 HD3 PRO A 306 -6.262 17.006 4.621 1.00 0.00 H new ATOM 44 N ARG A 307 -5.495 12.881 6.042 1.00 0.00 N ATOM 45 CA ARG A 307 -5.853 11.505 6.395 1.00 0.00 C ATOM 46 C ARG A 307 -6.167 10.686 5.141 1.00 0.00 C ATOM 47 O ARG A 307 -7.203 10.887 4.493 1.00 0.00 O ATOM 48 CB ARG A 307 -7.049 11.490 7.360 1.00 0.00 C ATOM 49 CG ARG A 307 -6.711 11.955 8.772 1.00 0.00 C ATOM 50 CD ARG A 307 -7.955 12.086 9.640 1.00 0.00 C ATOM 51 NE ARG A 307 -8.504 10.782 10.034 1.00 0.00 N ATOM 52 CZ ARG A 307 -9.665 10.606 10.681 1.00 0.00 C ATOM 53 NH1 ARG A 307 -10.427 11.643 11.025 1.00 0.00 N1+ ATOM 54 NH2 ARG A 307 -10.064 9.380 10.987 1.00 0.00 N ATOM 0 H ARG A 307 -6.295 13.489 5.869 1.00 0.00 H new ATOM 0 HA ARG A 307 -4.998 11.049 6.895 1.00 0.00 H new ATOM 0 HB2 ARG A 307 -7.836 12.127 6.957 1.00 0.00 H new ATOM 0 HB3 ARG A 307 -7.452 10.478 7.408 1.00 0.00 H new ATOM 0 HG2 ARG A 307 -6.021 11.248 9.232 1.00 0.00 H new ATOM 0 HG3 ARG A 307 -6.198 12.916 8.725 1.00 0.00 H new ATOM 0 HD2 ARG A 307 -7.712 12.660 10.534 1.00 0.00 H new ATOM 0 HD3 ARG A 307 -8.715 12.648 9.098 1.00 0.00 H new ATOM 0 HE ARG A 307 -7.963 9.950 9.798 1.00 0.00 H new ATOM 0 HH11 ARG A 307 -10.130 12.592 10.796 1.00 0.00 H new ATOM 0 HH12 ARG A 307 -11.307 11.488 11.517 1.00 0.00 H new ATOM 0 HH21 ARG A 307 -9.489 8.578 10.730 1.00 0.00 H new ATOM 0 HH22 ARG A 307 -10.946 9.239 11.479 1.00 0.00 H new ATOM 68 N ALA A 308 -5.247 9.774 4.795 1.00 0.00 N ATOM 69 CA ALA A 308 -5.396 8.912 3.619 1.00 0.00 C ATOM 70 C ALA A 308 -4.896 7.498 3.904 1.00 0.00 C ATOM 71 O ALA A 308 -3.986 7.305 4.717 1.00 0.00 O ATOM 72 CB ALA A 308 -4.650 9.501 2.427 1.00 0.00 C ATOM 0 H ALA A 308 -4.386 9.616 5.319 1.00 0.00 H new ATOM 0 HA ALA A 308 -6.458 8.856 3.379 1.00 0.00 H new ATOM 0 HB1 ALA A 308 -4.772 8.848 1.563 1.00 0.00 H new ATOM 0 HB2 ALA A 308 -5.053 10.487 2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 308 -3.591 9.590 2.668 1.00 0.00 H new ATOM 78 N LEU A 309 -5.499 6.519 3.223 1.00 0.00 N ATOM 79 CA LEU A 309 -5.126 5.112 3.379 1.00 0.00 C ATOM 80 C LEU A 309 -4.430 4.593 2.104 1.00 0.00 C ATOM 81 O LEU A 309 -5.093 4.420 1.073 1.00 0.00 O ATOM 82 CB LEU A 309 -6.366 4.258 3.699 1.00 0.00 C ATOM 83 CG LEU A 309 -7.005 4.503 5.072 1.00 0.00 C ATOM 84 CD1 LEU A 309 -8.019 5.639 5.007 1.00 0.00 C ATOM 85 CD2 LEU A 309 -7.664 3.232 5.586 1.00 0.00 C ATOM 0 H LEU A 309 -6.253 6.678 2.554 1.00 0.00 H new ATOM 0 HA LEU A 309 -4.427 5.032 4.211 1.00 0.00 H new ATOM 0 HB2 LEU A 309 -7.118 4.440 2.931 1.00 0.00 H new ATOM 0 HB3 LEU A 309 -6.088 3.206 3.630 1.00 0.00 H new ATOM 0 HG LEU A 309 -6.216 4.792 5.766 1.00 0.00 H new ATOM 0 HD11 LEU A 309 -8.457 5.792 5.993 1.00 0.00 H new ATOM 0 HD12 LEU A 309 -7.521 6.553 4.685 1.00 0.00 H new ATOM 0 HD13 LEU A 309 -8.805 5.385 4.296 1.00 0.00 H new ATOM 0 HD21 LEU A 309 -8.112 3.423 6.561 1.00 0.00 H new ATOM 0 HD22 LEU A 309 -8.438 2.915 4.887 1.00 0.00 H new ATOM 0 HD23 LEU A 309 -6.915 2.446 5.679 1.00 0.00 H new ATOM 97 N PRO A 310 -3.078 4.350 2.132 1.00 0.00 N ATOM 98 CA PRO A 310 -2.337 3.851 0.955 1.00 0.00 C ATOM 99 C PRO A 310 -2.691 2.397 0.589 1.00 0.00 C ATOM 100 O PRO A 310 -3.273 1.664 1.394 1.00 0.00 O ATOM 101 CB PRO A 310 -0.855 3.995 1.340 1.00 0.00 C ATOM 102 CG PRO A 310 -0.831 4.771 2.617 1.00 0.00 C ATOM 103 CD PRO A 310 -2.164 4.561 3.276 1.00 0.00 C ATOM 0 HA PRO A 310 -2.594 4.418 0.060 1.00 0.00 H new ATOM 0 HB2 PRO A 310 -0.389 3.018 1.469 1.00 0.00 H new ATOM 0 HB3 PRO A 310 -0.298 4.513 0.559 1.00 0.00 H new ATOM 0 HG2 PRO A 310 -0.022 4.429 3.263 1.00 0.00 H new ATOM 0 HG3 PRO A 310 -0.658 5.830 2.423 1.00 0.00 H new ATOM 0 HD2 PRO A 310 -2.151 3.701 3.945 1.00 0.00 H new ATOM 0 HD3 PRO A 310 -2.459 5.424 3.873 1.00 0.00 H new ATOM 111 N ALA A 311 -2.320 2.009 -0.641 1.00 0.00 N ATOM 112 CA ALA A 311 -2.638 0.681 -1.200 1.00 0.00 C ATOM 113 C ALA A 311 -1.514 -0.265 -0.894 1.00 0.00 C ATOM 114 O ALA A 311 -1.670 -1.481 -0.757 1.00 0.00 O ATOM 115 CB ALA A 311 -2.886 0.769 -2.699 1.00 0.00 C ATOM 0 H ALA A 311 -1.791 2.605 -1.278 1.00 0.00 H new ATOM 0 HA ALA A 311 -3.553 0.307 -0.741 1.00 0.00 H new ATOM 0 HB1 ALA A 311 -3.118 -0.222 -3.088 1.00 0.00 H new ATOM 0 HB2 ALA A 311 -3.724 1.440 -2.890 1.00 0.00 H new ATOM 0 HB3 ALA A 311 -1.994 1.153 -3.194 1.00 0.00 H new ATOM 121 N TRP A 312 -0.379 0.385 -0.796 1.00 0.00 N ATOM 122 CA TRP A 312 0.908 -0.202 -0.507 1.00 0.00 C ATOM 123 C TRP A 312 1.018 -0.459 0.991 1.00 0.00 C ATOM 124 O TRP A 312 1.916 -1.144 1.486 1.00 0.00 O ATOM 125 CB TRP A 312 1.948 0.806 -1.040 1.00 0.00 C ATOM 126 CG TRP A 312 2.110 2.103 -0.258 1.00 0.00 C ATOM 127 CD1 TRP A 312 1.778 3.348 -0.717 1.00 0.00 C ATOM 128 CD2 TRP A 312 2.635 2.303 1.073 1.00 0.00 C ATOM 129 NE1 TRP A 312 2.043 4.297 0.236 1.00 0.00 N ATOM 130 CE2 TRP A 312 2.562 3.684 1.343 1.00 0.00 C ATOM 131 CE3 TRP A 312 3.146 1.456 2.064 1.00 0.00 C ATOM 132 CZ2 TRP A 312 2.976 4.230 2.555 1.00 0.00 C ATOM 133 CZ3 TRP A 312 3.553 2.000 3.265 1.00 0.00 C ATOM 134 CH2 TRP A 312 3.464 3.374 3.501 1.00 0.00 C ATOM 0 H TRP A 312 -0.326 1.396 -0.923 1.00 0.00 H new ATOM 0 HA TRP A 312 1.066 -1.170 -0.982 1.00 0.00 H new ATOM 0 HB2 TRP A 312 2.917 0.308 -1.076 1.00 0.00 H new ATOM 0 HB3 TRP A 312 1.681 1.059 -2.066 1.00 0.00 H new ATOM 0 HD1 TRP A 312 1.365 3.554 -1.693 1.00 0.00 H new ATOM 0 HE1 TRP A 312 1.879 5.299 0.136 1.00 0.00 H new ATOM 0 HE3 TRP A 312 3.220 0.393 1.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 312 2.914 5.292 2.741 1.00 0.00 H new ATOM 0 HZ3 TRP A 312 3.947 1.353 4.035 1.00 0.00 H new ATOM 0 HH2 TRP A 312 3.788 3.768 4.453 1.00 0.00 H new ATOM 145 N ALA A 313 0.029 0.109 1.658 1.00 0.00 N ATOM 146 CA ALA A 313 -0.146 0.084 3.093 1.00 0.00 C ATOM 147 C ALA A 313 -0.873 -1.192 3.565 1.00 0.00 C ATOM 148 O ALA A 313 -1.553 -1.194 4.600 1.00 0.00 O ATOM 149 CB ALA A 313 -0.933 1.340 3.427 1.00 0.00 C ATOM 0 H ALA A 313 -0.711 0.627 1.184 1.00 0.00 H new ATOM 0 HA ALA A 313 0.814 0.065 3.609 1.00 0.00 H new ATOM 0 HB1 ALA A 313 -1.103 1.387 4.503 1.00 0.00 H new ATOM 0 HB2 ALA A 313 -0.370 2.218 3.110 1.00 0.00 H new ATOM 0 HB3 ALA A 313 -1.892 1.317 2.909 1.00 0.00 H new ATOM 155 N ARG A 314 -0.697 -2.279 2.803 1.00 0.00 N ATOM 156 CA ARG A 314 -1.315 -3.563 3.101 1.00 0.00 C ATOM 157 C ARG A 314 -0.255 -4.682 3.084 1.00 0.00 C ATOM 158 O ARG A 314 0.213 -5.069 2.007 1.00 0.00 O ATOM 159 CB ARG A 314 -2.437 -3.868 2.092 1.00 0.00 C ATOM 160 CG ARG A 314 -3.707 -3.036 2.292 1.00 0.00 C ATOM 161 CD ARG A 314 -4.650 -3.661 3.319 1.00 0.00 C ATOM 162 NE ARG A 314 -5.314 -4.867 2.804 1.00 0.00 N ATOM 163 CZ ARG A 314 -6.205 -5.599 3.487 1.00 0.00 C ATOM 164 NH1 ARG A 314 -6.561 -5.271 4.728 1.00 0.00 N1+ ATOM 165 NH2 ARG A 314 -6.742 -6.671 2.921 1.00 0.00 N ATOM 0 H ARG A 314 -0.120 -2.286 1.962 1.00 0.00 H new ATOM 0 HA ARG A 314 -1.754 -3.515 4.098 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -2.060 -3.697 1.084 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -2.694 -4.925 2.161 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -3.434 -2.032 2.616 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -4.226 -2.934 1.339 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -4.088 -3.914 4.218 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -5.404 -2.929 3.609 1.00 0.00 H new ATOM 0 HE ARG A 314 -5.080 -5.169 1.858 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -6.154 -4.450 5.175 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -7.241 -5.841 5.231 1.00 0.00 H new ATOM 0 HH21 ARG A 314 -6.476 -6.934 1.972 1.00 0.00 H new ATOM 0 HH22 ARG A 314 -7.421 -7.233 3.435 1.00 0.00 H new ATOM 179 N PRO A 315 0.172 -5.205 4.279 1.00 0.00 N ATOM 180 CA PRO A 315 1.183 -6.292 4.388 1.00 0.00 C ATOM 181 C PRO A 315 0.875 -7.532 3.550 1.00 0.00 C ATOM 182 O PRO A 315 1.780 -8.261 3.132 1.00 0.00 O ATOM 183 CB PRO A 315 1.171 -6.662 5.881 1.00 0.00 C ATOM 184 CG PRO A 315 -0.017 -5.970 6.464 1.00 0.00 C ATOM 185 CD PRO A 315 -0.245 -4.754 5.620 1.00 0.00 C ATOM 0 HA PRO A 315 2.144 -5.944 4.010 1.00 0.00 H new ATOM 0 HB2 PRO A 315 1.099 -7.741 6.015 1.00 0.00 H new ATOM 0 HB3 PRO A 315 2.090 -6.340 6.371 1.00 0.00 H new ATOM 0 HG2 PRO A 315 -0.891 -6.621 6.454 1.00 0.00 H new ATOM 0 HG3 PRO A 315 0.163 -5.695 7.503 1.00 0.00 H new ATOM 0 HD2 PRO A 315 -1.289 -4.441 5.635 1.00 0.00 H new ATOM 0 HD3 PRO A 315 0.347 -3.906 5.964 1.00 0.00 H new ATOM 193 N ASP A 316 -0.404 -7.738 3.324 1.00 0.00 N ATOM 194 CA ASP A 316 -0.916 -8.871 2.537 1.00 0.00 C ATOM 195 C ASP A 316 -0.873 -8.587 1.025 1.00 0.00 C ATOM 196 O ASP A 316 -1.176 -9.467 0.212 1.00 0.00 O ATOM 197 CB ASP A 316 -2.351 -9.205 2.962 1.00 0.00 C ATOM 198 CG ASP A 316 -2.423 -9.823 4.346 1.00 0.00 C ATOM 199 OD1 ASP A 316 -2.562 -9.063 5.328 1.00 0.00 O ATOM 200 OD2 ASP A 316 -2.341 -11.065 4.447 1.00 0.00 O1- ATOM 0 H ASP A 316 -1.137 -7.124 3.680 1.00 0.00 H new ATOM 0 HA ASP A 316 -0.267 -9.724 2.734 1.00 0.00 H new ATOM 0 HB2 ASP A 316 -2.952 -8.296 2.943 1.00 0.00 H new ATOM 0 HB3 ASP A 316 -2.789 -9.892 2.238 1.00 0.00 H new ATOM 205 N TYR A 317 -0.486 -7.357 0.667 1.00 0.00 N ATOM 206 CA TYR A 317 -0.395 -6.934 -0.729 1.00 0.00 C ATOM 207 C TYR A 317 1.055 -7.018 -1.218 1.00 0.00 C ATOM 208 O TYR A 317 1.934 -6.308 -0.717 1.00 0.00 O ATOM 209 CB TYR A 317 -0.949 -5.504 -0.875 1.00 0.00 C ATOM 210 CG TYR A 317 -1.126 -5.032 -2.308 1.00 0.00 C ATOM 211 CD1 TYR A 317 -0.168 -4.232 -2.915 1.00 0.00 C ATOM 212 CD2 TYR A 317 -2.250 -5.384 -3.047 1.00 0.00 C ATOM 213 CE1 TYR A 317 -0.321 -3.796 -4.217 1.00 0.00 C ATOM 214 CE2 TYR A 317 -2.412 -4.952 -4.349 1.00 0.00 C ATOM 215 CZ TYR A 317 -1.444 -4.158 -4.929 1.00 0.00 C ATOM 216 OH TYR A 317 -1.602 -3.726 -6.227 1.00 0.00 O ATOM 0 H TYR A 317 -0.229 -6.632 1.337 1.00 0.00 H new ATOM 0 HA TYR A 317 -0.994 -7.602 -1.348 1.00 0.00 H new ATOM 0 HB2 TYR A 317 -1.912 -5.449 -0.368 1.00 0.00 H new ATOM 0 HB3 TYR A 317 -0.278 -4.815 -0.361 1.00 0.00 H new ATOM 0 HD1 TYR A 317 0.713 -3.945 -2.360 1.00 0.00 H new ATOM 0 HD2 TYR A 317 -3.009 -6.006 -2.595 1.00 0.00 H new ATOM 0 HE1 TYR A 317 0.435 -3.175 -4.674 1.00 0.00 H new ATOM 0 HE2 TYR A 317 -3.291 -5.234 -4.910 1.00 0.00 H new ATOM 0 HH TYR A 317 -2.446 -4.071 -6.586 1.00 0.00 H new ATOM 226 N ASN A 318 1.284 -7.901 -2.192 1.00 0.00 N ATOM 227 CA ASN A 318 2.615 -8.101 -2.772 1.00 0.00 C ATOM 228 C ASN A 318 2.690 -7.526 -4.202 1.00 0.00 C ATOM 229 O ASN A 318 2.007 -8.031 -5.100 1.00 0.00 O ATOM 230 CB ASN A 318 3.003 -9.599 -2.758 1.00 0.00 C ATOM 231 CG ASN A 318 1.992 -10.525 -3.437 1.00 0.00 C ATOM 232 OD1 ASN A 318 0.780 -10.301 -3.383 1.00 0.00 O ATOM 233 ND2 ASN A 318 2.494 -11.574 -4.079 1.00 0.00 N ATOM 0 H ASN A 318 0.560 -8.493 -2.599 1.00 0.00 H new ATOM 0 HA ASN A 318 3.333 -7.560 -2.156 1.00 0.00 H new ATOM 0 HB2 ASN A 318 3.969 -9.715 -3.249 1.00 0.00 H new ATOM 0 HB3 ASN A 318 3.131 -9.918 -1.724 1.00 0.00 H new ATOM 0 HD21 ASN A 318 1.871 -12.229 -4.551 1.00 0.00 H new ATOM 0 HD22 ASN A 318 3.503 -11.724 -4.100 1.00 0.00 H new ATOM 240 N PRO A 319 3.509 -6.448 -4.447 1.00 0.00 N ATOM 241 CA PRO A 319 3.649 -5.839 -5.792 1.00 0.00 C ATOM 242 C PRO A 319 4.242 -6.807 -6.835 1.00 0.00 C ATOM 243 O PRO A 319 5.193 -7.530 -6.524 1.00 0.00 O ATOM 244 CB PRO A 319 4.615 -4.664 -5.570 1.00 0.00 C ATOM 245 CG PRO A 319 4.578 -4.395 -4.108 1.00 0.00 C ATOM 246 CD PRO A 319 4.332 -5.720 -3.448 1.00 0.00 C ATOM 0 HA PRO A 319 2.676 -5.549 -6.189 1.00 0.00 H new ATOM 0 HB2 PRO A 319 5.623 -4.917 -5.898 1.00 0.00 H new ATOM 0 HB3 PRO A 319 4.305 -3.787 -6.139 1.00 0.00 H new ATOM 0 HG2 PRO A 319 5.517 -3.959 -3.768 1.00 0.00 H new ATOM 0 HG3 PRO A 319 3.789 -3.684 -3.862 1.00 0.00 H new ATOM 0 HD2 PRO A 319 5.264 -6.244 -3.236 1.00 0.00 H new ATOM 0 HD3 PRO A 319 3.807 -5.606 -2.500 1.00 0.00 H new ATOM 254 N PRO A 320 3.691 -6.837 -8.090 1.00 0.00 N ATOM 255 CA PRO A 320 4.191 -7.728 -9.155 1.00 0.00 C ATOM 256 C PRO A 320 5.550 -7.294 -9.715 1.00 0.00 C ATOM 257 O PRO A 320 5.717 -6.155 -10.168 1.00 0.00 O ATOM 258 CB PRO A 320 3.103 -7.645 -10.236 1.00 0.00 C ATOM 259 CG PRO A 320 2.442 -6.325 -10.030 1.00 0.00 C ATOM 260 CD PRO A 320 2.535 -6.030 -8.556 1.00 0.00 C ATOM 0 HA PRO A 320 4.363 -8.738 -8.782 1.00 0.00 H new ATOM 0 HB2 PRO A 320 3.535 -7.717 -11.234 1.00 0.00 H new ATOM 0 HB3 PRO A 320 2.388 -8.462 -10.138 1.00 0.00 H new ATOM 0 HG2 PRO A 320 2.935 -5.548 -10.614 1.00 0.00 H new ATOM 0 HG3 PRO A 320 1.402 -6.356 -10.355 1.00 0.00 H new ATOM 0 HD2 PRO A 320 2.693 -4.967 -8.373 1.00 0.00 H new ATOM 0 HD3 PRO A 320 1.619 -6.311 -8.036 1.00 0.00 H new ATOM 268 N LEU A 321 6.510 -8.216 -9.662 1.00 0.00 N ATOM 269 CA LEU A 321 7.866 -7.970 -10.153 1.00 0.00 C ATOM 270 C LEU A 321 8.036 -8.521 -11.570 1.00 0.00 C ATOM 271 O LEU A 321 7.433 -9.540 -11.923 1.00 0.00 O ATOM 272 CB LEU A 321 8.896 -8.606 -9.206 1.00 0.00 C ATOM 273 CG LEU A 321 10.311 -8.009 -9.254 1.00 0.00 C ATOM 274 CD1 LEU A 321 10.417 -6.778 -8.361 1.00 0.00 C ATOM 275 CD2 LEU A 321 11.342 -9.052 -8.847 1.00 0.00 C ATOM 0 H LEU A 321 6.371 -9.151 -9.279 1.00 0.00 H new ATOM 0 HA LEU A 321 8.032 -6.893 -10.182 1.00 0.00 H new ATOM 0 HB2 LEU A 321 8.522 -8.523 -8.185 1.00 0.00 H new ATOM 0 HB3 LEU A 321 8.963 -9.669 -9.435 1.00 0.00 H new ATOM 0 HG LEU A 321 10.513 -7.700 -10.280 1.00 0.00 H new ATOM 0 HD11 LEU A 321 11.429 -6.376 -8.414 1.00 0.00 H new ATOM 0 HD12 LEU A 321 9.708 -6.022 -8.698 1.00 0.00 H new ATOM 0 HD13 LEU A 321 10.190 -7.055 -7.331 1.00 0.00 H new ATOM 0 HD21 LEU A 321 12.339 -8.613 -8.886 1.00 0.00 H new ATOM 0 HD22 LEU A 321 11.135 -9.392 -7.832 1.00 0.00 H new ATOM 0 HD23 LEU A 321 11.292 -9.899 -9.531 1.00 0.00 H new ATOM 287 N VAL A 322 8.863 -7.838 -12.365 1.00 0.00 N ATOM 288 CA VAL A 322 9.126 -8.239 -13.752 1.00 0.00 C ATOM 289 C VAL A 322 10.628 -8.256 -14.048 1.00 0.00 C ATOM 290 O VAL A 322 11.333 -7.281 -13.770 1.00 0.00 O ATOM 291 CB VAL A 322 8.397 -7.326 -14.786 1.00 0.00 C ATOM 292 CG1 VAL A 322 6.916 -7.671 -14.847 1.00 0.00 C ATOM 293 CG2 VAL A 322 8.579 -5.834 -14.481 1.00 0.00 C ATOM 0 H VAL A 322 9.365 -7.000 -12.071 1.00 0.00 H new ATOM 0 HA VAL A 322 8.728 -9.248 -13.858 1.00 0.00 H new ATOM 0 HB VAL A 322 8.855 -7.516 -15.757 1.00 0.00 H new ATOM 0 HG11 VAL A 322 6.422 -7.025 -15.573 1.00 0.00 H new ATOM 0 HG12 VAL A 322 6.797 -8.712 -15.147 1.00 0.00 H new ATOM 0 HG13 VAL A 322 6.467 -7.523 -13.865 1.00 0.00 H new ATOM 0 HG21 VAL A 322 8.052 -5.243 -15.230 1.00 0.00 H new ATOM 0 HG22 VAL A 322 8.174 -5.613 -13.493 1.00 0.00 H new ATOM 0 HG23 VAL A 322 9.640 -5.585 -14.503 1.00 0.00 H new ATOM 303 N GLU A 323 11.099 -9.373 -14.611 1.00 0.00 N ATOM 304 CA GLU A 323 12.513 -9.538 -14.955 1.00 0.00 C ATOM 305 C GLU A 323 12.670 -10.009 -16.401 1.00 0.00 C ATOM 306 O GLU A 323 12.157 -11.101 -16.731 1.00 0.00 O ATOM 307 CB GLU A 323 13.194 -10.529 -13.995 1.00 0.00 C ATOM 308 CG GLU A 323 13.408 -9.989 -12.584 1.00 0.00 C ATOM 309 CD GLU A 323 14.609 -9.064 -12.477 1.00 0.00 C ATOM 310 OE1 GLU A 323 15.732 -9.570 -12.267 1.00 0.00 O ATOM 311 OE2 GLU A 323 14.425 -7.835 -12.603 1.00 0.00 O1- ATOM 312 OXT GLU A 323 13.306 -9.280 -17.191 1.00 0.00 O1- ATOM 0 H GLU A 323 10.518 -10.180 -14.839 1.00 0.00 H new ATOM 0 HA GLU A 323 12.999 -8.567 -14.854 1.00 0.00 H new ATOM 0 HB2 GLU A 323 12.590 -11.434 -13.937 1.00 0.00 H new ATOM 0 HB3 GLU A 323 14.159 -10.816 -14.412 1.00 0.00 H new ATOM 0 HG2 GLU A 323 12.514 -9.452 -12.267 1.00 0.00 H new ATOM 0 HG3 GLU A 323 13.538 -10.825 -11.897 1.00 0.00 H new TER 319 GLU A 323