USER MOD reduce.3.24.130724 H: found=0, std=0, add=270, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 272 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 265 LYS NZ :NH3+ 144:sc= -3.1! (180deg=-5.93!) USER MOD Single : A 270 SER OG : rot 75:sc= 0.449 USER MOD Single : A 272 LYS NZ :NH3+ -138:sc= -3.17! (180deg=-5.94!) USER MOD Single : A 307 LYS NZ :NH3+ 167:sc= -0.034 (180deg=-0.268) USER MOD Single : A 311 GLN : amide:sc= 0 X(o=0,f=-0.15) USER MOD Single : A 313 SER OG : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ 165:sc= -0.0439 (180deg=-0.306) USER MOD ----------------------------------------------------------------- ATOM 155 N GLU A 259 -51.729 -8.069 -5.900 1.00 0.00 N ATOM 156 CA GLU A 259 -50.928 -7.015 -6.513 1.00 0.00 C ATOM 157 C GLU A 259 -50.907 -5.782 -5.616 1.00 0.00 C ATOM 158 O GLU A 259 -49.872 -5.132 -5.452 1.00 0.00 O ATOM 159 CB GLU A 259 -51.488 -6.655 -7.891 1.00 0.00 C ATOM 160 CG GLU A 259 -50.683 -5.593 -8.625 1.00 0.00 C ATOM 161 CD GLU A 259 -49.281 -6.055 -8.977 1.00 0.00 C ATOM 162 OE1 GLU A 259 -48.498 -6.347 -8.048 1.00 0.00 O ATOM 163 OE2 GLU A 259 -48.966 -6.125 -10.184 1.00 0.00 O ATOM 0 HA GLU A 259 -49.908 -7.379 -6.635 1.00 0.00 H new ATOM 0 HB2 GLU A 259 -51.526 -7.556 -8.503 1.00 0.00 H new ATOM 0 HB3 GLU A 259 -52.514 -6.304 -7.775 1.00 0.00 H new ATOM 0 HG2 GLU A 259 -51.208 -5.313 -9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 259 -50.621 -4.698 -8.006 1.00 0.00 H new ATOM 170 N GLU A 260 -52.061 -5.476 -5.030 1.00 0.00 N ATOM 171 CA GLU A 260 -52.192 -4.332 -4.136 1.00 0.00 C ATOM 172 C GLU A 260 -51.267 -4.478 -2.932 1.00 0.00 C ATOM 173 O GLU A 260 -50.669 -3.505 -2.475 1.00 0.00 O ATOM 174 CB GLU A 260 -53.641 -4.190 -3.665 1.00 0.00 C ATOM 175 CG GLU A 260 -54.634 -4.007 -4.801 1.00 0.00 C ATOM 176 CD GLU A 260 -56.066 -3.888 -4.314 1.00 0.00 C ATOM 177 OE1 GLU A 260 -56.285 -3.954 -3.086 1.00 0.00 O ATOM 178 OE2 GLU A 260 -56.970 -3.729 -5.162 1.00 0.00 O ATOM 0 H GLU A 260 -52.922 -6.008 -5.160 1.00 0.00 H new ATOM 0 HA GLU A 260 -51.907 -3.436 -4.687 1.00 0.00 H new ATOM 0 HB2 GLU A 260 -53.916 -5.075 -3.092 1.00 0.00 H new ATOM 0 HB3 GLU A 260 -53.713 -3.338 -2.990 1.00 0.00 H new ATOM 0 HG2 GLU A 260 -54.372 -3.113 -5.367 1.00 0.00 H new ATOM 0 HG3 GLU A 260 -54.556 -4.852 -5.485 1.00 0.00 H new ATOM 185 N GLU A 261 -51.156 -5.703 -2.422 1.00 0.00 N ATOM 186 CA GLU A 261 -50.303 -5.978 -1.270 1.00 0.00 C ATOM 187 C GLU A 261 -48.858 -5.578 -1.558 1.00 0.00 C ATOM 188 O GLU A 261 -48.217 -4.897 -0.754 1.00 0.00 O ATOM 189 CB GLU A 261 -50.368 -7.463 -0.905 1.00 0.00 C ATOM 190 CG GLU A 261 -49.544 -7.826 0.320 1.00 0.00 C ATOM 191 CD GLU A 261 -49.638 -9.297 0.672 1.00 0.00 C ATOM 192 OE1 GLU A 261 -50.761 -9.774 0.938 1.00 0.00 O ATOM 193 OE2 GLU A 261 -48.588 -9.973 0.683 1.00 0.00 O ATOM 0 H GLU A 261 -51.646 -6.519 -2.788 1.00 0.00 H new ATOM 0 HA GLU A 261 -50.666 -5.387 -0.429 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -51.407 -7.740 -0.728 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -50.021 -8.053 -1.754 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -48.501 -7.565 0.142 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -49.881 -7.231 1.169 1.00 0.00 H new ATOM 200 N LEU A 262 -48.354 -6.005 -2.713 1.00 0.00 N ATOM 201 CA LEU A 262 -46.987 -5.696 -3.117 1.00 0.00 C ATOM 202 C LEU A 262 -46.785 -4.192 -3.256 1.00 0.00 C ATOM 203 O LEU A 262 -45.783 -3.646 -2.795 1.00 0.00 O ATOM 204 CB LEU A 262 -46.652 -6.390 -4.441 1.00 0.00 C ATOM 205 CG LEU A 262 -46.742 -7.918 -4.420 1.00 0.00 C ATOM 206 CD1 LEU A 262 -46.416 -8.490 -5.791 1.00 0.00 C ATOM 207 CD2 LEU A 262 -45.808 -8.497 -3.367 1.00 0.00 C ATOM 0 H LEU A 262 -48.874 -6.567 -3.387 1.00 0.00 H new ATOM 0 HA LEU A 262 -46.317 -6.065 -2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 262 -47.326 -6.013 -5.210 1.00 0.00 H new ATOM 0 HB3 LEU A 262 -45.642 -6.106 -4.736 1.00 0.00 H new ATOM 0 HG LEU A 262 -47.764 -8.196 -4.163 1.00 0.00 H new ATOM 0 HD11 LEU A 262 -46.485 -9.577 -5.757 1.00 0.00 H new ATOM 0 HD12 LEU A 262 -47.124 -8.104 -6.524 1.00 0.00 H new ATOM 0 HD13 LEU A 262 -45.405 -8.199 -6.076 1.00 0.00 H new ATOM 0 HD21 LEU A 262 -45.887 -9.584 -3.369 1.00 0.00 H new ATOM 0 HD22 LEU A 262 -44.782 -8.208 -3.592 1.00 0.00 H new ATOM 0 HD23 LEU A 262 -46.085 -8.114 -2.385 1.00 0.00 H new ATOM 219 N ILE A 263 -47.741 -3.527 -3.898 1.00 0.00 N ATOM 220 CA ILE A 263 -47.664 -2.085 -4.100 1.00 0.00 C ATOM 221 C ILE A 263 -47.612 -1.342 -2.767 1.00 0.00 C ATOM 222 O ILE A 263 -46.830 -0.406 -2.600 1.00 0.00 O ATOM 223 CB ILE A 263 -48.861 -1.566 -4.923 1.00 0.00 C ATOM 224 CG1 ILE A 263 -48.888 -2.239 -6.299 1.00 0.00 C ATOM 225 CG2 ILE A 263 -48.792 -0.051 -5.067 1.00 0.00 C ATOM 226 CD1 ILE A 263 -50.069 -1.831 -7.156 1.00 0.00 C ATOM 0 H ILE A 263 -48.577 -3.964 -4.287 1.00 0.00 H new ATOM 0 HA ILE A 263 -46.745 -1.893 -4.653 1.00 0.00 H new ATOM 0 HB ILE A 263 -49.782 -1.817 -4.397 1.00 0.00 H new ATOM 0 HG12 ILE A 263 -47.966 -1.999 -6.829 1.00 0.00 H new ATOM 0 HG13 ILE A 263 -48.905 -3.320 -6.164 1.00 0.00 H new ATOM 0 HG21 ILE A 263 -49.644 0.298 -5.650 1.00 0.00 H new ATOM 0 HG22 ILE A 263 -48.815 0.410 -4.079 1.00 0.00 H new ATOM 0 HG23 ILE A 263 -47.868 0.225 -5.574 1.00 0.00 H new ATOM 0 HD11 ILE A 263 -50.019 -2.348 -8.114 1.00 0.00 H new ATOM 0 HD12 ILE A 263 -50.996 -2.096 -6.648 1.00 0.00 H new ATOM 0 HD13 ILE A 263 -50.042 -0.754 -7.323 1.00 0.00 H new ATOM 238 N ARG A 264 -48.452 -1.759 -1.823 1.00 0.00 N ATOM 239 CA ARG A 264 -48.503 -1.125 -0.510 1.00 0.00 C ATOM 240 C ARG A 264 -47.162 -1.237 0.211 1.00 0.00 C ATOM 241 O ARG A 264 -46.654 -0.253 0.749 1.00 0.00 O ATOM 242 CB ARG A 264 -49.605 -1.754 0.345 1.00 0.00 C ATOM 243 CG ARG A 264 -49.787 -1.079 1.695 1.00 0.00 C ATOM 244 CD ARG A 264 -50.885 -1.743 2.511 1.00 0.00 C ATOM 245 NE ARG A 264 -51.119 -1.052 3.776 1.00 0.00 N ATOM 246 CZ ARG A 264 -52.017 -1.442 4.676 1.00 0.00 C ATOM 247 NH1 ARG A 264 -52.753 -2.524 4.459 1.00 0.00 N ATOM 248 NH2 ARG A 264 -52.179 -0.750 5.795 1.00 0.00 N ATOM 0 H ARG A 264 -49.106 -2.533 -1.943 1.00 0.00 H new ATOM 0 HA ARG A 264 -48.725 -0.069 -0.661 1.00 0.00 H new ATOM 0 HB2 ARG A 264 -50.547 -1.713 -0.203 1.00 0.00 H new ATOM 0 HB3 ARG A 264 -49.374 -2.808 0.503 1.00 0.00 H new ATOM 0 HG2 ARG A 264 -48.849 -1.115 2.249 1.00 0.00 H new ATOM 0 HG3 ARG A 264 -50.030 -0.027 1.546 1.00 0.00 H new ATOM 0 HD2 ARG A 264 -51.808 -1.760 1.931 1.00 0.00 H new ATOM 0 HD3 ARG A 264 -50.613 -2.780 2.709 1.00 0.00 H new ATOM 0 HE ARG A 264 -50.562 -0.223 3.981 1.00 0.00 H new ATOM 0 HH11 ARG A 264 -52.631 -3.060 3.600 1.00 0.00 H new ATOM 0 HH12 ARG A 264 -53.441 -2.820 5.152 1.00 0.00 H new ATOM 0 HH21 ARG A 264 -51.615 0.082 5.966 1.00 0.00 H new ATOM 0 HH22 ARG A 264 -52.868 -1.050 6.485 1.00 0.00 H new ATOM 262 N LYS A 265 -46.593 -2.440 0.221 1.00 0.00 N ATOM 263 CA LYS A 265 -45.313 -2.668 0.884 1.00 0.00 C ATOM 264 C LYS A 265 -44.213 -1.813 0.259 1.00 0.00 C ATOM 265 O LYS A 265 -43.448 -1.156 0.967 1.00 0.00 O ATOM 266 CB LYS A 265 -44.929 -4.148 0.814 1.00 0.00 C ATOM 267 CG LYS A 265 -43.616 -4.467 1.514 1.00 0.00 C ATOM 268 CD LYS A 265 -43.279 -5.952 1.453 1.00 0.00 C ATOM 269 CE LYS A 265 -44.204 -6.789 2.329 1.00 0.00 C ATOM 270 NZ LYS A 265 -45.605 -6.802 1.825 1.00 0.00 N ATOM 0 H LYS A 265 -46.996 -3.267 -0.220 1.00 0.00 H new ATOM 0 HA LYS A 265 -45.421 -2.380 1.930 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -45.725 -4.743 1.262 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -44.857 -4.448 -0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 265 -42.811 -3.894 1.053 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -43.675 -4.152 2.556 1.00 0.00 H new ATOM 0 HD2 LYS A 265 -43.349 -6.296 0.421 1.00 0.00 H new ATOM 0 HD3 LYS A 265 -42.247 -6.102 1.770 1.00 0.00 H new ATOM 0 HE2 LYS A 265 -43.828 -7.811 2.376 1.00 0.00 H new ATOM 0 HE3 LYS A 265 -44.190 -6.397 3.346 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 -46.026 -7.738 1.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -46.160 -6.079 2.325 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -45.609 -6.598 0.805 1.00 0.00 H new ATOM 284 N ALA A 266 -44.142 -1.821 -1.070 1.00 0.00 N ATOM 285 CA ALA A 266 -43.137 -1.044 -1.787 1.00 0.00 C ATOM 286 C ALA A 266 -43.197 0.423 -1.382 1.00 0.00 C ATOM 287 O ALA A 266 -42.171 1.043 -1.095 1.00 0.00 O ATOM 288 CB ALA A 266 -43.331 -1.188 -3.290 1.00 0.00 C ATOM 0 H ALA A 266 -44.768 -2.357 -1.671 1.00 0.00 H new ATOM 0 HA ALA A 266 -42.153 -1.430 -1.523 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -42.574 -0.603 -3.812 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -43.236 -2.237 -3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -44.322 -0.827 -3.565 1.00 0.00 H new ATOM 294 N ILE A 267 -44.408 0.970 -1.349 1.00 0.00 N ATOM 295 CA ILE A 267 -44.605 2.361 -0.967 1.00 0.00 C ATOM 296 C ILE A 267 -44.149 2.595 0.469 1.00 0.00 C ATOM 297 O ILE A 267 -43.587 3.641 0.787 1.00 0.00 O ATOM 298 CB ILE A 267 -46.082 2.785 -1.111 1.00 0.00 C ATOM 299 CG1 ILE A 267 -46.535 2.632 -2.566 1.00 0.00 C ATOM 300 CG2 ILE A 267 -46.271 4.221 -0.638 1.00 0.00 C ATOM 301 CD1 ILE A 267 -47.995 2.966 -2.789 1.00 0.00 C ATOM 0 H ILE A 267 -45.266 0.470 -1.582 1.00 0.00 H new ATOM 0 HA ILE A 267 -44.003 2.969 -1.642 1.00 0.00 H new ATOM 0 HB ILE A 267 -46.696 2.136 -0.487 1.00 0.00 H new ATOM 0 HG12 ILE A 267 -45.924 3.277 -3.197 1.00 0.00 H new ATOM 0 HG13 ILE A 267 -46.353 1.607 -2.888 1.00 0.00 H new ATOM 0 HG21 ILE A 267 -47.318 4.505 -0.746 1.00 0.00 H new ATOM 0 HG22 ILE A 267 -45.980 4.300 0.409 1.00 0.00 H new ATOM 0 HG23 ILE A 267 -45.651 4.886 -1.239 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -48.242 2.834 -3.843 1.00 0.00 H new ATOM 0 HD12 ILE A 267 -48.616 2.304 -2.185 1.00 0.00 H new ATOM 0 HD13 ILE A 267 -48.180 4.001 -2.500 1.00 0.00 H new ATOM 313 N GLU A 268 -44.395 1.611 1.333 1.00 0.00 N ATOM 314 CA GLU A 268 -44.008 1.710 2.737 1.00 0.00 C ATOM 315 C GLU A 268 -42.504 1.942 2.862 1.00 0.00 C ATOM 316 O GLU A 268 -42.065 2.873 3.541 1.00 0.00 O ATOM 317 CB GLU A 268 -44.424 0.438 3.488 1.00 0.00 C ATOM 318 CG GLU A 268 -44.296 0.538 5.004 1.00 0.00 C ATOM 319 CD GLU A 268 -42.879 0.330 5.506 1.00 0.00 C ATOM 320 OE1 GLU A 268 -41.999 -0.016 4.691 1.00 0.00 O ATOM 321 OE2 GLU A 268 -42.653 0.498 6.723 1.00 0.00 O ATOM 0 H GLU A 268 -44.860 0.738 1.085 1.00 0.00 H new ATOM 0 HA GLU A 268 -44.521 2.562 3.184 1.00 0.00 H new ATOM 0 HB2 GLU A 268 -45.458 0.203 3.237 1.00 0.00 H new ATOM 0 HB3 GLU A 268 -43.813 -0.394 3.137 1.00 0.00 H new ATOM 0 HG2 GLU A 268 -44.647 1.518 5.327 1.00 0.00 H new ATOM 0 HG3 GLU A 268 -44.949 -0.203 5.466 1.00 0.00 H new ATOM 328 N LEU A 269 -41.718 1.101 2.191 1.00 0.00 N ATOM 329 CA LEU A 269 -40.264 1.234 2.223 1.00 0.00 C ATOM 330 C LEU A 269 -39.838 2.585 1.661 1.00 0.00 C ATOM 331 O LEU A 269 -38.948 3.241 2.204 1.00 0.00 O ATOM 332 CB LEU A 269 -39.590 0.106 1.433 1.00 0.00 C ATOM 333 CG LEU A 269 -39.542 -1.256 2.134 1.00 0.00 C ATOM 334 CD1 LEU A 269 -40.942 -1.798 2.369 1.00 0.00 C ATOM 335 CD2 LEU A 269 -38.717 -2.241 1.319 1.00 0.00 C ATOM 0 H LEU A 269 -42.061 0.326 1.623 1.00 0.00 H new ATOM 0 HA LEU A 269 -39.946 1.165 3.263 1.00 0.00 H new ATOM 0 HB2 LEU A 269 -40.113 -0.012 0.484 1.00 0.00 H new ATOM 0 HB3 LEU A 269 -38.570 0.410 1.199 1.00 0.00 H new ATOM 0 HG LEU A 269 -39.066 -1.122 3.106 1.00 0.00 H new ATOM 0 HD11 LEU A 269 -40.879 -2.765 2.868 1.00 0.00 H new ATOM 0 HD12 LEU A 269 -41.501 -1.103 2.995 1.00 0.00 H new ATOM 0 HD13 LEU A 269 -41.452 -1.915 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 269 -38.692 -3.204 1.829 1.00 0.00 H new ATOM 0 HD22 LEU A 269 -39.166 -2.364 0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 269 -37.701 -1.862 1.210 1.00 0.00 H new ATOM 347 N SER A 270 -40.481 2.995 0.572 1.00 0.00 N ATOM 348 CA SER A 270 -40.171 4.271 -0.063 1.00 0.00 C ATOM 349 C SER A 270 -40.386 5.427 0.908 1.00 0.00 C ATOM 350 O SER A 270 -39.563 6.339 0.993 1.00 0.00 O ATOM 351 CB SER A 270 -41.031 4.467 -1.312 1.00 0.00 C ATOM 352 OG SER A 270 -40.791 3.445 -2.264 1.00 0.00 O ATOM 0 H SER A 270 -41.219 2.463 0.111 1.00 0.00 H new ATOM 0 HA SER A 270 -39.121 4.258 -0.356 1.00 0.00 H new ATOM 0 HB2 SER A 270 -42.085 4.469 -1.034 1.00 0.00 H new ATOM 0 HB3 SER A 270 -40.816 5.439 -1.756 1.00 0.00 H new ATOM 0 HG SER A 270 -41.222 2.616 -1.969 1.00 0.00 H new ATOM 358 N LEU A 271 -41.494 5.380 1.642 1.00 0.00 N ATOM 359 CA LEU A 271 -41.815 6.420 2.613 1.00 0.00 C ATOM 360 C LEU A 271 -40.747 6.489 3.698 1.00 0.00 C ATOM 361 O LEU A 271 -40.327 7.575 4.101 1.00 0.00 O ATOM 362 CB LEU A 271 -43.187 6.161 3.240 1.00 0.00 C ATOM 363 CG LEU A 271 -44.367 6.219 2.267 1.00 0.00 C ATOM 364 CD1 LEU A 271 -45.660 5.847 2.975 1.00 0.00 C ATOM 365 CD2 LEU A 271 -44.480 7.606 1.647 1.00 0.00 C ATOM 0 H LEU A 271 -42.185 4.632 1.582 1.00 0.00 H new ATOM 0 HA LEU A 271 -41.843 7.377 2.092 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -43.174 5.179 3.712 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -43.352 6.893 4.031 1.00 0.00 H new ATOM 0 HG LEU A 271 -44.190 5.498 1.469 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -46.488 5.894 2.268 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -45.579 4.835 3.373 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -45.841 6.545 3.792 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -45.324 7.629 0.958 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -44.634 8.345 2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -43.563 7.838 1.105 1.00 0.00 H new ATOM 377 N LYS A 272 -40.309 5.323 4.166 1.00 0.00 N ATOM 378 CA LYS A 272 -39.285 5.250 5.204 1.00 0.00 C ATOM 379 C LYS A 272 -38.021 5.990 4.777 1.00 0.00 C ATOM 380 O LYS A 272 -37.425 6.727 5.563 1.00 0.00 O ATOM 381 CB LYS A 272 -38.952 3.791 5.521 1.00 0.00 C ATOM 382 CG LYS A 272 -40.126 3.006 6.086 1.00 0.00 C ATOM 383 CD LYS A 272 -39.773 1.544 6.334 1.00 0.00 C ATOM 384 CE LYS A 272 -38.741 1.380 7.443 1.00 0.00 C ATOM 385 NZ LYS A 272 -37.397 1.882 7.044 1.00 0.00 N ATOM 0 H LYS A 272 -40.647 4.416 3.843 1.00 0.00 H new ATOM 0 HA LYS A 272 -39.679 5.729 6.100 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -38.602 3.301 4.612 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -38.129 3.762 6.235 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -40.451 3.463 7.020 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -40.966 3.063 5.394 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -40.676 0.994 6.597 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -39.388 1.104 5.414 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -39.077 1.915 8.331 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -38.667 0.327 7.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -36.667 1.219 7.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -37.350 1.962 6.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -37.234 2.816 7.471 1.00 0.00 H new ATOM 892 N ASP A 305 33.070 -3.548 10.431 1.00 0.00 N ATOM 893 CA ASP A 305 33.158 -4.406 9.253 1.00 0.00 C ATOM 894 C ASP A 305 33.732 -3.651 8.058 1.00 0.00 C ATOM 895 O ASP A 305 34.605 -4.159 7.353 1.00 0.00 O ATOM 896 CB ASP A 305 31.778 -4.964 8.900 1.00 0.00 C ATOM 897 CG ASP A 305 31.811 -5.862 7.679 1.00 0.00 C ATOM 898 OD1 ASP A 305 32.529 -6.883 7.712 1.00 0.00 O ATOM 899 OD2 ASP A 305 31.118 -5.543 6.689 1.00 0.00 O ATOM 0 HA ASP A 305 33.831 -5.230 9.491 1.00 0.00 H new ATOM 0 HB2 ASP A 305 31.388 -5.525 9.749 1.00 0.00 H new ATOM 0 HB3 ASP A 305 31.090 -4.138 8.721 1.00 0.00 H new ATOM 904 N LEU A 306 33.229 -2.442 7.828 1.00 0.00 N ATOM 905 CA LEU A 306 33.687 -1.624 6.710 1.00 0.00 C ATOM 906 C LEU A 306 35.172 -1.299 6.833 1.00 0.00 C ATOM 907 O LEU A 306 35.923 -1.422 5.866 1.00 0.00 O ATOM 908 CB LEU A 306 32.876 -0.328 6.631 1.00 0.00 C ATOM 909 CG LEU A 306 33.273 0.622 5.497 1.00 0.00 C ATOM 910 CD1 LEU A 306 33.089 -0.047 4.143 1.00 0.00 C ATOM 911 CD2 LEU A 306 32.464 1.907 5.571 1.00 0.00 C ATOM 0 H LEU A 306 32.505 -2.007 8.400 1.00 0.00 H new ATOM 0 HA LEU A 306 33.537 -2.198 5.795 1.00 0.00 H new ATOM 0 HB2 LEU A 306 31.823 -0.584 6.517 1.00 0.00 H new ATOM 0 HB3 LEU A 306 32.975 0.202 7.578 1.00 0.00 H new ATOM 0 HG LEU A 306 34.328 0.870 5.614 1.00 0.00 H new ATOM 0 HD11 LEU A 306 33.377 0.646 3.353 1.00 0.00 H new ATOM 0 HD12 LEU A 306 33.714 -0.938 4.090 1.00 0.00 H new ATOM 0 HD13 LEU A 306 32.044 -0.329 4.015 1.00 0.00 H new ATOM 0 HD21 LEU A 306 32.759 2.570 4.758 1.00 0.00 H new ATOM 0 HD22 LEU A 306 31.403 1.674 5.483 1.00 0.00 H new ATOM 0 HD23 LEU A 306 32.649 2.399 6.526 1.00 0.00 H new ATOM 923 N LYS A 307 35.587 -0.879 8.023 1.00 0.00 N ATOM 924 CA LYS A 307 36.983 -0.530 8.267 1.00 0.00 C ATOM 925 C LYS A 307 37.901 -1.721 8.008 1.00 0.00 C ATOM 926 O LYS A 307 38.945 -1.583 7.370 1.00 0.00 O ATOM 927 CB LYS A 307 37.164 -0.034 9.703 1.00 0.00 C ATOM 928 CG LYS A 307 38.582 0.412 10.018 1.00 0.00 C ATOM 929 CD LYS A 307 38.701 0.921 11.445 1.00 0.00 C ATOM 930 CE LYS A 307 40.125 1.339 11.768 1.00 0.00 C ATOM 931 NZ LYS A 307 40.614 2.405 10.850 1.00 0.00 N ATOM 0 H LYS A 307 34.978 -0.772 8.834 1.00 0.00 H new ATOM 0 HA LYS A 307 37.255 0.268 7.576 1.00 0.00 H new ATOM 0 HB2 LYS A 307 36.483 0.798 9.880 1.00 0.00 H new ATOM 0 HB3 LYS A 307 36.881 -0.830 10.392 1.00 0.00 H new ATOM 0 HG2 LYS A 307 39.268 -0.422 9.869 1.00 0.00 H new ATOM 0 HG3 LYS A 307 38.880 1.198 9.324 1.00 0.00 H new ATOM 0 HD2 LYS A 307 38.030 1.768 11.588 1.00 0.00 H new ATOM 0 HD3 LYS A 307 38.383 0.142 12.138 1.00 0.00 H new ATOM 0 HE2 LYS A 307 40.174 1.696 12.797 1.00 0.00 H new ATOM 0 HE3 LYS A 307 40.782 0.472 11.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 307 41.491 2.815 11.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 307 40.801 1.996 9.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 307 39.892 3.149 10.766 1.00 0.00 H new ATOM 945 N ALA A 308 37.506 -2.888 8.507 1.00 0.00 N ATOM 946 CA ALA A 308 38.294 -4.101 8.329 1.00 0.00 C ATOM 947 C ALA A 308 38.417 -4.469 6.854 1.00 0.00 C ATOM 948 O ALA A 308 39.483 -4.875 6.393 1.00 0.00 O ATOM 949 CB ALA A 308 37.676 -5.251 9.112 1.00 0.00 C ATOM 0 H ALA A 308 36.645 -3.019 9.038 1.00 0.00 H new ATOM 0 HA ALA A 308 39.297 -3.911 8.712 1.00 0.00 H new ATOM 0 HB1 ALA A 308 38.275 -6.151 8.970 1.00 0.00 H new ATOM 0 HB2 ALA A 308 37.649 -4.997 10.172 1.00 0.00 H new ATOM 0 HB3 ALA A 308 36.662 -5.430 8.756 1.00 0.00 H new ATOM 955 N ALA A 309 37.317 -4.329 6.121 1.00 0.00 N ATOM 956 CA ALA A 309 37.298 -4.651 4.699 1.00 0.00 C ATOM 957 C ALA A 309 38.245 -3.752 3.909 1.00 0.00 C ATOM 958 O ALA A 309 38.989 -4.225 3.049 1.00 0.00 O ATOM 959 CB ALA A 309 35.882 -4.534 4.154 1.00 0.00 C ATOM 0 H ALA A 309 36.426 -3.994 6.489 1.00 0.00 H new ATOM 0 HA ALA A 309 37.642 -5.679 4.584 1.00 0.00 H new ATOM 0 HB1 ALA A 309 35.880 -4.777 3.091 1.00 0.00 H new ATOM 0 HB2 ALA A 309 35.229 -5.226 4.686 1.00 0.00 H new ATOM 0 HB3 ALA A 309 35.521 -3.515 4.294 1.00 0.00 H new ATOM 965 N ILE A 310 38.207 -2.455 4.197 1.00 0.00 N ATOM 966 CA ILE A 310 39.057 -1.492 3.505 1.00 0.00 C ATOM 967 C ILE A 310 40.536 -1.754 3.775 1.00 0.00 C ATOM 968 O ILE A 310 41.344 -1.803 2.848 1.00 0.00 O ATOM 969 CB ILE A 310 38.719 -0.045 3.921 1.00 0.00 C ATOM 970 CG1 ILE A 310 37.245 0.266 3.640 1.00 0.00 C ATOM 971 CG2 ILE A 310 39.624 0.944 3.197 1.00 0.00 C ATOM 972 CD1 ILE A 310 36.853 0.127 2.182 1.00 0.00 C ATOM 0 H ILE A 310 37.597 -2.046 4.905 1.00 0.00 H new ATOM 0 HA ILE A 310 38.863 -1.615 2.439 1.00 0.00 H new ATOM 0 HB ILE A 310 38.891 0.054 4.993 1.00 0.00 H new ATOM 0 HG12 ILE A 310 36.623 -0.400 4.238 1.00 0.00 H new ATOM 0 HG13 ILE A 310 37.030 1.283 3.968 1.00 0.00 H new ATOM 0 HG21 ILE A 310 39.371 1.959 3.503 1.00 0.00 H new ATOM 0 HG22 ILE A 310 40.664 0.737 3.449 1.00 0.00 H new ATOM 0 HG23 ILE A 310 39.485 0.844 2.121 1.00 0.00 H new ATOM 0 HD11 ILE A 310 35.795 0.364 2.065 1.00 0.00 H new ATOM 0 HD12 ILE A 310 37.447 0.813 1.578 1.00 0.00 H new ATOM 0 HD13 ILE A 310 37.034 -0.896 1.852 1.00 0.00 H new ATOM 984 N GLN A 311 40.885 -1.914 5.047 1.00 0.00 N ATOM 985 CA GLN A 311 42.270 -2.162 5.435 1.00 0.00 C ATOM 986 C GLN A 311 42.796 -3.455 4.818 1.00 0.00 C ATOM 987 O GLN A 311 43.887 -3.483 4.247 1.00 0.00 O ATOM 988 CB GLN A 311 42.387 -2.226 6.959 1.00 0.00 C ATOM 989 CG GLN A 311 41.997 -0.931 7.654 1.00 0.00 C ATOM 990 CD GLN A 311 42.105 -1.023 9.163 1.00 0.00 C ATOM 991 OE1 GLN A 311 41.439 -1.842 9.797 1.00 0.00 O ATOM 992 NE2 GLN A 311 42.946 -0.179 9.748 1.00 0.00 N ATOM 0 H GLN A 311 40.229 -1.877 5.827 1.00 0.00 H new ATOM 0 HA GLN A 311 42.876 -1.337 5.061 1.00 0.00 H new ATOM 0 HB2 GLN A 311 41.755 -3.033 7.330 1.00 0.00 H new ATOM 0 HB3 GLN A 311 43.413 -2.477 7.226 1.00 0.00 H new ATOM 0 HG2 GLN A 311 42.637 -0.124 7.296 1.00 0.00 H new ATOM 0 HG3 GLN A 311 40.974 -0.671 7.382 1.00 0.00 H new ATOM 0 HE21 GLN A 311 43.478 0.483 9.184 1.00 0.00 H new ATOM 0 HE22 GLN A 311 43.060 -0.193 10.762 1.00 0.00 H new ATOM 1001 N GLU A 312 42.015 -4.523 4.938 1.00 0.00 N ATOM 1002 CA GLU A 312 42.402 -5.820 4.395 1.00 0.00 C ATOM 1003 C GLU A 312 42.570 -5.751 2.883 1.00 0.00 C ATOM 1004 O GLU A 312 43.494 -6.342 2.323 1.00 0.00 O ATOM 1005 CB GLU A 312 41.361 -6.881 4.758 1.00 0.00 C ATOM 1006 CG GLU A 312 41.727 -8.284 4.295 1.00 0.00 C ATOM 1007 CD GLU A 312 42.980 -8.817 4.967 1.00 0.00 C ATOM 1008 OE1 GLU A 312 44.058 -8.214 4.783 1.00 0.00 O ATOM 1009 OE2 GLU A 312 42.881 -9.839 5.678 1.00 0.00 O ATOM 0 H GLU A 312 41.109 -4.516 5.407 1.00 0.00 H new ATOM 0 HA GLU A 312 43.360 -6.097 4.835 1.00 0.00 H new ATOM 0 HB2 GLU A 312 41.226 -6.889 5.840 1.00 0.00 H new ATOM 0 HB3 GLU A 312 40.403 -6.602 4.319 1.00 0.00 H new ATOM 0 HG2 GLU A 312 40.895 -8.958 4.500 1.00 0.00 H new ATOM 0 HG3 GLU A 312 41.874 -8.279 3.215 1.00 0.00 H new ATOM 1016 N SER A 313 41.670 -5.028 2.228 1.00 0.00 N ATOM 1017 CA SER A 313 41.713 -4.882 0.778 1.00 0.00 C ATOM 1018 C SER A 313 42.980 -4.160 0.337 1.00 0.00 C ATOM 1019 O SER A 313 43.626 -4.557 -0.633 1.00 0.00 O ATOM 1020 CB SER A 313 40.481 -4.124 0.282 1.00 0.00 C ATOM 1021 OG SER A 313 40.495 -3.996 -1.129 1.00 0.00 O ATOM 0 H SER A 313 40.900 -4.533 2.678 1.00 0.00 H new ATOM 0 HA SER A 313 41.717 -5.880 0.341 1.00 0.00 H new ATOM 0 HB2 SER A 313 39.578 -4.648 0.594 1.00 0.00 H new ATOM 0 HB3 SER A 313 40.450 -3.135 0.740 1.00 0.00 H new ATOM 0 HG SER A 313 39.696 -3.509 -1.421 1.00 0.00 H new ATOM 1027 N LEU A 314 43.330 -3.096 1.052 1.00 0.00 N ATOM 1028 CA LEU A 314 44.520 -2.319 0.730 1.00 0.00 C ATOM 1029 C LEU A 314 45.776 -3.173 0.853 1.00 0.00 C ATOM 1030 O LEU A 314 46.650 -3.134 -0.013 1.00 0.00 O ATOM 1031 CB LEU A 314 44.620 -1.094 1.641 1.00 0.00 C ATOM 1032 CG LEU A 314 43.478 -0.085 1.499 1.00 0.00 C ATOM 1033 CD1 LEU A 314 43.642 1.051 2.496 1.00 0.00 C ATOM 1034 CD2 LEU A 314 43.418 0.457 0.078 1.00 0.00 C ATOM 0 H LEU A 314 42.807 -2.753 1.857 1.00 0.00 H new ATOM 0 HA LEU A 314 44.436 -1.982 -0.303 1.00 0.00 H new ATOM 0 HB2 LEU A 314 44.658 -1.433 2.676 1.00 0.00 H new ATOM 0 HB3 LEU A 314 45.562 -0.585 1.437 1.00 0.00 H new ATOM 0 HG LEU A 314 42.539 -0.597 1.712 1.00 0.00 H new ATOM 0 HD11 LEU A 314 42.821 1.758 2.380 1.00 0.00 H new ATOM 0 HD12 LEU A 314 43.635 0.650 3.509 1.00 0.00 H new ATOM 0 HD13 LEU A 314 44.588 1.561 2.314 1.00 0.00 H new ATOM 0 HD21 LEU A 314 42.600 1.173 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 314 44.359 0.952 -0.163 1.00 0.00 H new ATOM 0 HD23 LEU A 314 43.252 -0.365 -0.618 1.00 0.00 H new ATOM 1046 N ARG A 315 45.859 -3.946 1.931 1.00 0.00 N ATOM 1047 CA ARG A 315 47.010 -4.813 2.159 1.00 0.00 C ATOM 1048 C ARG A 315 47.137 -5.851 1.047 1.00 0.00 C ATOM 1049 O ARG A 315 48.233 -6.117 0.557 1.00 0.00 O ATOM 1050 CB ARG A 315 46.893 -5.512 3.515 1.00 0.00 C ATOM 1051 CG ARG A 315 48.023 -6.490 3.791 1.00 0.00 C ATOM 1052 CD ARG A 315 47.851 -7.179 5.135 1.00 0.00 C ATOM 1053 NE ARG A 315 47.908 -6.235 6.248 1.00 0.00 N ATOM 1054 CZ ARG A 315 47.778 -6.591 7.522 1.00 0.00 C ATOM 1055 NH1 ARG A 315 47.572 -7.861 7.842 1.00 0.00 N ATOM 1056 NH2 ARG A 315 47.851 -5.674 8.478 1.00 0.00 N ATOM 0 H ARG A 315 45.145 -3.990 2.659 1.00 0.00 H new ATOM 0 HA ARG A 315 47.906 -4.192 2.157 1.00 0.00 H new ATOM 0 HB2 ARG A 315 46.874 -4.759 4.303 1.00 0.00 H new ATOM 0 HB3 ARG A 315 45.943 -6.044 3.560 1.00 0.00 H new ATOM 0 HG2 ARG A 315 48.058 -7.239 3.000 1.00 0.00 H new ATOM 0 HG3 ARG A 315 48.976 -5.961 3.772 1.00 0.00 H new ATOM 0 HD2 ARG A 315 46.895 -7.703 5.153 1.00 0.00 H new ATOM 0 HD3 ARG A 315 48.630 -7.932 5.258 1.00 0.00 H new ATOM 0 HE ARG A 315 48.056 -5.248 6.036 1.00 0.00 H new ATOM 0 HH11 ARG A 315 47.513 -8.568 7.110 1.00 0.00 H new ATOM 0 HH12 ARG A 315 47.473 -8.131 8.821 1.00 0.00 H new ATOM 0 HH21 ARG A 315 48.007 -4.696 8.235 1.00 0.00 H new ATOM 0 HH22 ARG A 315 47.751 -5.947 9.456 1.00 0.00 H new ATOM 1070 N GLU A 316 46.007 -6.435 0.657 1.00 0.00 N ATOM 1071 CA GLU A 316 45.989 -7.444 -0.396 1.00 0.00 C ATOM 1072 C GLU A 316 46.523 -6.873 -1.707 1.00 0.00 C ATOM 1073 O GLU A 316 47.339 -7.500 -2.382 1.00 0.00 O ATOM 1074 CB GLU A 316 44.567 -7.973 -0.598 1.00 0.00 C ATOM 1075 CG GLU A 316 44.461 -9.043 -1.673 1.00 0.00 C ATOM 1076 CD GLU A 316 43.043 -9.550 -1.852 1.00 0.00 C ATOM 1077 OE1 GLU A 316 42.156 -8.732 -2.172 1.00 0.00 O ATOM 1078 OE2 GLU A 316 42.821 -10.766 -1.672 1.00 0.00 O ATOM 0 H GLU A 316 45.092 -6.226 1.055 1.00 0.00 H new ATOM 0 HA GLU A 316 46.636 -8.266 -0.089 1.00 0.00 H new ATOM 0 HB2 GLU A 316 44.203 -8.380 0.345 1.00 0.00 H new ATOM 0 HB3 GLU A 316 43.913 -7.141 -0.860 1.00 0.00 H new ATOM 0 HG2 GLU A 316 44.821 -8.639 -2.619 1.00 0.00 H new ATOM 0 HG3 GLU A 316 45.112 -9.878 -1.415 1.00 0.00 H new ATOM 1085 N ALA A 317 46.054 -5.680 -2.058 1.00 0.00 N ATOM 1086 CA ALA A 317 46.478 -5.020 -3.287 1.00 0.00 C ATOM 1087 C ALA A 317 47.970 -4.701 -3.258 1.00 0.00 C ATOM 1088 O ALA A 317 48.673 -4.884 -4.251 1.00 0.00 O ATOM 1089 CB ALA A 317 45.668 -3.751 -3.507 1.00 0.00 C ATOM 0 H ALA A 317 45.379 -5.150 -1.507 1.00 0.00 H new ATOM 0 HA ALA A 317 46.299 -5.703 -4.117 1.00 0.00 H new ATOM 0 HB1 ALA A 317 45.993 -3.267 -4.428 1.00 0.00 H new ATOM 0 HB2 ALA A 317 44.610 -4.003 -3.584 1.00 0.00 H new ATOM 0 HB3 ALA A 317 45.819 -3.073 -2.667 1.00 0.00 H new ATOM 1095 N GLU A 318 48.444 -4.221 -2.112 1.00 0.00 N ATOM 1096 CA GLU A 318 49.852 -3.873 -1.949 1.00 0.00 C ATOM 1097 C GLU A 318 50.744 -5.095 -2.145 1.00 0.00 C ATOM 1098 O GLU A 318 51.747 -5.036 -2.855 1.00 0.00 O ATOM 1099 CB GLU A 318 50.089 -3.271 -0.562 1.00 0.00 C ATOM 1100 CG GLU A 318 51.536 -2.884 -0.303 1.00 0.00 C ATOM 1101 CD GLU A 318 51.742 -2.296 1.080 1.00 0.00 C ATOM 1102 OE1 GLU A 318 51.455 -2.998 2.072 1.00 0.00 O ATOM 1103 OE2 GLU A 318 52.190 -1.134 1.170 1.00 0.00 O ATOM 0 H GLU A 318 47.873 -4.064 -1.282 1.00 0.00 H new ATOM 0 HA GLU A 318 50.109 -3.135 -2.709 1.00 0.00 H new ATOM 0 HB2 GLU A 318 49.460 -2.388 -0.446 1.00 0.00 H new ATOM 0 HB3 GLU A 318 49.773 -3.989 0.195 1.00 0.00 H new ATOM 0 HG2 GLU A 318 52.170 -3.763 -0.418 1.00 0.00 H new ATOM 0 HG3 GLU A 318 51.855 -2.160 -1.053 1.00 0.00 H new ATOM 1110 N GLU A 319 50.370 -6.202 -1.509 1.00 0.00 N ATOM 1111 CA GLU A 319 51.134 -7.440 -1.611 1.00 0.00 C ATOM 1112 C GLU A 319 51.153 -7.950 -3.048 1.00 0.00 C ATOM 1113 O GLU A 319 52.196 -8.362 -3.558 1.00 0.00 O ATOM 1114 CB GLU A 319 50.544 -8.507 -0.686 1.00 0.00 C ATOM 1115 CG GLU A 319 51.279 -9.839 -0.739 1.00 0.00 C ATOM 1116 CD GLU A 319 52.708 -9.747 -0.235 1.00 0.00 C ATOM 1117 OE1 GLU A 319 53.117 -8.652 0.207 1.00 0.00 O ATOM 1118 OE2 GLU A 319 53.418 -10.774 -0.278 1.00 0.00 O ATOM 0 H GLU A 319 49.542 -6.266 -0.917 1.00 0.00 H new ATOM 0 HA GLU A 319 52.159 -7.231 -1.305 1.00 0.00 H new ATOM 0 HB2 GLU A 319 50.558 -8.135 0.338 1.00 0.00 H new ATOM 0 HB3 GLU A 319 49.499 -8.668 -0.952 1.00 0.00 H new ATOM 0 HG2 GLU A 319 50.735 -10.572 -0.143 1.00 0.00 H new ATOM 0 HG3 GLU A 319 51.284 -10.204 -1.766 1.00 0.00 H new ATOM 1125 N ALA A 320 49.992 -7.919 -3.695 1.00 0.00 N ATOM 1126 CA ALA A 320 49.874 -8.377 -5.073 1.00 0.00 C ATOM 1127 C ALA A 320 50.819 -7.604 -5.986 1.00 0.00 C ATOM 1128 O ALA A 320 51.511 -8.189 -6.817 1.00 0.00 O ATOM 1129 CB ALA A 320 48.437 -8.239 -5.555 1.00 0.00 C ATOM 0 H ALA A 320 49.121 -7.581 -3.286 1.00 0.00 H new ATOM 0 HA ALA A 320 50.155 -9.430 -5.108 1.00 0.00 H new ATOM 0 HB1 ALA A 320 48.364 -8.585 -6.586 1.00 0.00 H new ATOM 0 HB2 ALA A 320 47.782 -8.840 -4.924 1.00 0.00 H new ATOM 0 HB3 ALA A 320 48.134 -7.193 -5.501 1.00 0.00 H new ATOM 1135 N LYS A 321 50.844 -6.285 -5.818 1.00 0.00 N ATOM 1136 CA LYS A 321 51.707 -5.427 -6.621 1.00 0.00 C ATOM 1137 C LYS A 321 53.177 -5.741 -6.361 1.00 0.00 C ATOM 1138 O LYS A 321 53.993 -5.749 -7.283 1.00 0.00 O ATOM 1139 CB LYS A 321 51.424 -3.955 -6.317 1.00 0.00 C ATOM 1140 CG LYS A 321 52.256 -2.992 -7.146 1.00 0.00 C ATOM 1141 CD LYS A 321 51.933 -1.546 -6.809 1.00 0.00 C ATOM 1142 CE LYS A 321 52.754 -0.583 -7.650 1.00 0.00 C ATOM 1143 NZ LYS A 321 52.511 -0.771 -9.106 1.00 0.00 N ATOM 0 H LYS A 321 50.276 -5.788 -5.132 1.00 0.00 H new ATOM 0 HA LYS A 321 51.494 -5.619 -7.672 1.00 0.00 H new ATOM 0 HB2 LYS A 321 50.367 -3.753 -6.493 1.00 0.00 H new ATOM 0 HB3 LYS A 321 51.613 -3.768 -5.260 1.00 0.00 H new ATOM 0 HG2 LYS A 321 53.315 -3.180 -6.970 1.00 0.00 H new ATOM 0 HG3 LYS A 321 52.072 -3.170 -8.206 1.00 0.00 H new ATOM 0 HD2 LYS A 321 50.872 -1.361 -6.974 1.00 0.00 H new ATOM 0 HD3 LYS A 321 52.128 -1.365 -5.752 1.00 0.00 H new ATOM 0 HE2 LYS A 321 52.510 0.442 -7.371 1.00 0.00 H new ATOM 0 HE3 LYS A 321 53.813 -0.728 -7.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 52.879 0.050 -9.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 52.994 -1.633 -9.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 51.489 -0.861 -9.279 1.00 0.00 H new ATOM 1157 N LEU A 322 53.505 -5.998 -5.097 1.00 0.00 N ATOM 1158 CA LEU A 322 54.876 -6.315 -4.707 1.00 0.00 C ATOM 1159 C LEU A 322 55.386 -7.536 -5.467 1.00 0.00 C ATOM 1160 O LEU A 322 56.485 -7.521 -6.023 1.00 0.00 O ATOM 1161 CB LEU A 322 54.946 -6.569 -3.199 1.00 0.00 C ATOM 1162 CG LEU A 322 56.339 -6.893 -2.651 1.00 0.00 C ATOM 1163 CD1 LEU A 322 57.281 -5.716 -2.850 1.00 0.00 C ATOM 1164 CD2 LEU A 322 56.256 -7.266 -1.178 1.00 0.00 C ATOM 0 H LEU A 322 52.839 -5.993 -4.325 1.00 0.00 H new ATOM 0 HA LEU A 322 55.511 -5.465 -4.957 1.00 0.00 H new ATOM 0 HB2 LEU A 322 54.566 -5.688 -2.681 1.00 0.00 H new ATOM 0 HB3 LEU A 322 54.277 -7.395 -2.955 1.00 0.00 H new ATOM 0 HG LEU A 322 56.736 -7.745 -3.203 1.00 0.00 H new ATOM 0 HD11 LEU A 322 58.265 -5.967 -2.454 1.00 0.00 H new ATOM 0 HD12 LEU A 322 57.364 -5.492 -3.914 1.00 0.00 H new ATOM 0 HD13 LEU A 322 56.890 -4.844 -2.325 1.00 0.00 H new ATOM 0 HD21 LEU A 322 57.254 -7.493 -0.803 1.00 0.00 H new ATOM 0 HD22 LEU A 322 55.838 -6.432 -0.614 1.00 0.00 H new ATOM 0 HD23 LEU A 322 55.616 -8.140 -1.060 1.00 0.00 H new