ATOM 171 N ARG A 25 0.807 -8.370 -3.954 1.00 0.54 N ATOM 172 CA ARG A 25 1.091 -6.986 -4.298 1.00 0.12 C ATOM 173 C ARG A 25 1.107 -6.124 -3.038 1.00 0.03 C ATOM 174 O ARG A 25 2.067 -5.396 -2.791 1.00 0.07 O ATOM 175 CB ARG A 25 0.047 -6.481 -5.294 1.00 0.57 C ATOM 176 CG ARG A 25 0.351 -5.126 -5.909 1.00 1.18 C ATOM 177 CD ARG A 25 -0.721 -4.753 -6.921 1.00 1.47 C ATOM 178 NE ARG A 25 -0.458 -3.479 -7.586 1.00 2.21 N ATOM 179 CZ ARG A 25 -1.408 -2.730 -8.148 1.00 2.75 C ATOM 180 NH1 ARG A 25 -2.677 -3.121 -8.113 1.00 2.84 N1+ ATOM 181 NH2 ARG A 25 -1.085 -1.593 -8.749 1.00 3.57 N ATOM 182 H ARG A 25 -0.026 -8.585 -3.475 1.00 0.88 H ATOM 183 HA ARG A 25 2.067 -6.951 -4.758 1.00 0.42 H ATOM 184 HB2 ARG A 25 -0.038 -7.199 -6.096 1.00 1.13 H ATOM 185 HB3 ARG A 25 -0.906 -6.414 -4.788 1.00 1.34 H ATOM 186 HG2 ARG A 25 0.377 -4.381 -5.129 1.00 1.83 H ATOM 187 HG3 ARG A 25 1.308 -5.171 -6.407 1.00 1.66 H ATOM 188 HD2 ARG A 25 -0.772 -5.530 -7.670 1.00 1.61 H ATOM 189 HD3 ARG A 25 -1.670 -4.690 -6.409 1.00 1.83 H ATOM 190 HE ARG A 25 0.474 -3.174 -7.628 1.00 2.61 H ATOM 191 HH11 ARG A 25 -2.930 -3.987 -7.664 1.00 2.62 H ATOM 192 HH12 ARG A 25 -3.393 -2.556 -8.542 1.00 3.41 H ATOM 193 HH21 ARG A 25 -0.118 -1.297 -8.793 1.00 3.91 H ATOM 194 HH22 ARG A 25 -1.801 -1.016 -9.163 1.00 4.01 H ATOM 195 N GLU A 26 0.062 -6.247 -2.222 1.00 0.00 N ATOM 196 CA GLU A 26 -0.045 -5.476 -0.958 1.00 0.00 C ATOM 197 C GLU A 26 1.118 -5.772 -0.001 1.00 0.00 C ATOM 198 O GLU A 26 1.728 -4.839 0.518 1.00 0.00 O ATOM 199 CB GLU A 26 -1.377 -5.757 -0.255 1.00 0.04 C ATOM 200 CG GLU A 26 -2.595 -5.283 -1.028 1.00 1.19 C ATOM 201 CD GLU A 26 -2.593 -3.787 -1.263 1.00 1.92 C ATOM 202 OE1 GLU A 26 -3.071 -3.043 -0.383 1.00 2.56 O1- ATOM 203 OE2 GLU A 26 -2.109 -3.349 -2.329 1.00 2.45 O ATOM 204 H GLU A 26 -0.656 -6.870 -2.462 1.00 0.00 H ATOM 205 HA GLU A 26 -0.009 -4.427 -1.218 1.00 0.02 H ATOM 206 HB2 GLU A 26 -1.470 -6.822 -0.103 1.00 0.90 H ATOM 207 HB3 GLU A 26 -1.373 -5.266 0.707 1.00 0.91 H ATOM 208 HG2 GLU A 26 -2.615 -5.781 -1.985 1.00 1.89 H ATOM 209 HG3 GLU A 26 -3.482 -5.543 -0.469 1.00 1.78 H ATOM 210 N PRO A 27 1.441 -7.068 0.246 1.00 0.00 N ATOM 211 CA PRO A 27 2.561 -7.411 1.138 1.00 0.00 C ATOM 212 C PRO A 27 3.887 -6.841 0.561 1.00 0.00 C ATOM 213 O PRO A 27 4.757 -6.435 1.323 1.00 0.00 O ATOM 214 CB PRO A 27 2.580 -8.945 1.146 1.00 0.01 C ATOM 215 CG PRO A 27 1.774 -9.356 -0.038 1.00 0.46 C ATOM 216 CD PRO A 27 0.754 -8.275 -0.249 1.00 0.02 C ATOM 217 HA PRO A 27 2.406 -7.032 2.139 1.00 0.00 H ATOM 218 HB2 PRO A 27 3.600 -9.293 1.068 1.00 0.34 H ATOM 219 HB3 PRO A 27 2.141 -9.307 2.064 1.00 0.33 H ATOM 220 HG2 PRO A 27 2.414 -9.440 -0.905 1.00 0.90 H ATOM 221 HG3 PRO A 27 1.285 -10.298 0.159 1.00 0.90 H ATOM 222 HD2 PRO A 27 0.513 -8.180 -1.299 1.00 0.31 H ATOM 223 HD3 PRO A 27 -0.137 -8.476 0.328 1.00 0.31 H ATOM 224 N LEU A 28 4.024 -6.816 -0.773 1.00 0.00 N ATOM 225 CA LEU A 28 5.239 -6.278 -1.432 1.00 0.00 C ATOM 226 C LEU A 28 5.260 -4.743 -1.197 1.00 0.00 C ATOM 227 O LEU A 28 6.283 -4.183 -0.818 1.00 0.00 O ATOM 228 CB LEU A 28 5.268 -6.621 -2.926 1.00 0.02 C ATOM 229 CG LEU A 28 5.875 -7.990 -3.267 1.00 0.88 C ATOM 230 CD1 LEU A 28 5.103 -9.118 -2.602 1.00 1.71 C ATOM 231 CD2 LEU A 28 5.918 -8.194 -4.772 1.00 1.57 C ATOM 232 H LEU A 28 3.292 -7.149 -1.331 1.00 0.00 H ATOM 233 HA LEU A 28 6.101 -6.714 -0.943 1.00 0.01 H ATOM 234 HB2 LEU A 28 4.254 -6.597 -3.298 1.00 0.66 H ATOM 235 HB3 LEU A 28 5.840 -5.862 -3.438 1.00 0.66 H ATOM 236 HG LEU A 28 6.890 -8.025 -2.899 1.00 1.72 H ATOM 237 HD11 LEU A 28 4.080 -9.108 -2.950 1.00 2.21 H ATOM 238 HD12 LEU A 28 5.559 -10.063 -2.854 1.00 2.30 H ATOM 239 HD13 LEU A 28 5.121 -8.984 -1.531 1.00 2.22 H ATOM 240 HD21 LEU A 28 6.523 -7.421 -5.222 1.00 2.08 H ATOM 241 HD22 LEU A 28 6.345 -9.160 -4.993 1.00 2.16 H ATOM 242 HD23 LEU A 28 4.915 -8.143 -5.171 1.00 2.08 H ATOM 243 N ILE A 29 4.127 -4.088 -1.423 1.00 0.01 N ATOM 244 CA ILE A 29 3.979 -2.645 -1.220 1.00 0.01 C ATOM 245 C ILE A 29 4.326 -2.363 0.272 1.00 0.00 C ATOM 246 O ILE A 29 5.054 -1.433 0.592 1.00 0.00 O ATOM 247 CB ILE A 29 2.553 -2.146 -1.547 1.00 0.06 C ATOM 248 CG1 ILE A 29 2.259 -2.330 -3.040 1.00 0.43 C ATOM 249 CG2 ILE A 29 2.392 -0.685 -1.147 1.00 0.43 C ATOM 250 CD1 ILE A 29 0.856 -1.932 -3.442 1.00 1.07 C ATOM 251 H ILE A 29 3.345 -4.598 -1.713 1.00 0.01 H ATOM 252 HA ILE A 29 4.692 -2.136 -1.855 1.00 0.03 H ATOM 253 HB ILE A 29 1.848 -2.732 -0.974 1.00 0.37 H ATOM 254 HG12 ILE A 29 2.950 -1.729 -3.612 1.00 0.90 H ATOM 255 HG13 ILE A 29 2.396 -3.370 -3.300 1.00 0.97 H ATOM 256 HG21 ILE A 29 3.104 -0.081 -1.690 1.00 1.15 H ATOM 257 HG22 ILE A 29 1.390 -0.355 -1.379 1.00 1.13 H ATOM 258 HG23 ILE A 29 2.568 -0.581 -0.086 1.00 1.12 H ATOM 259 HD11 ILE A 29 0.694 -0.891 -3.199 1.00 1.63 H ATOM 260 HD12 ILE A 29 0.730 -2.076 -4.505 1.00 1.64 H ATOM 261 HD13 ILE A 29 0.142 -2.542 -2.908 1.00 1.64 H ATOM 262 N ALA A 30 3.784 -3.196 1.174 1.00 0.00 N ATOM 263 CA ALA A 30 4.038 -3.054 2.617 1.00 0.00 C ATOM 264 C ALA A 30 5.562 -3.132 2.880 1.00 0.00 C ATOM 265 O ALA A 30 6.095 -2.371 3.679 1.00 0.00 O ATOM 266 CB ALA A 30 3.303 -4.129 3.402 1.00 0.01 C ATOM 267 H ALA A 30 3.215 -3.925 0.863 1.00 0.00 H ATOM 268 HA ALA A 30 3.674 -2.085 2.931 1.00 0.00 H ATOM 269 HB1 ALA A 30 3.648 -5.103 3.088 1.00 1.02 H ATOM 270 HB2 ALA A 30 3.498 -4.001 4.458 1.00 1.02 H ATOM 271 HB3 ALA A 30 2.242 -4.046 3.220 1.00 1.02 H ATOM 272 N THR A 31 6.248 -4.052 2.196 1.00 0.00 N ATOM 273 CA THR A 31 7.702 -4.220 2.343 1.00 0.00 C ATOM 274 C THR A 31 8.403 -2.938 1.839 1.00 0.00 C ATOM 275 O THR A 31 9.347 -2.449 2.462 1.00 0.00 O ATOM 276 CB THR A 31 8.202 -5.447 1.559 1.00 0.08 C ATOM 277 OG1 THR A 31 7.479 -6.614 1.978 1.00 0.99 O ATOM 278 CG2 THR A 31 9.689 -5.670 1.776 1.00 1.09 C ATOM 279 H THR A 31 5.767 -4.629 1.566 1.00 0.00 H ATOM 280 HA THR A 31 7.924 -4.359 3.393 1.00 0.04 H ATOM 281 HB THR A 31 8.025 -5.282 0.506 1.00 0.89 H ATOM 282 HG1 THR A 31 6.530 -6.465 1.864 1.00 1.34 H ATOM 283 HG21 THR A 31 9.878 -5.844 2.825 1.00 1.64 H ATOM 284 HG22 THR A 31 10.013 -6.528 1.206 1.00 1.70 H ATOM 285 HG23 THR A 31 10.235 -4.795 1.453 1.00 1.71 H ATOM 286 N ALA A 32 7.920 -2.406 0.711 1.00 0.00 N ATOM 287 CA ALA A 32 8.473 -1.180 0.115 1.00 0.00 C ATOM 288 C ALA A 32 8.276 0.009 1.083 1.00 0.00 C ATOM 289 O ALA A 32 9.125 0.892 1.151 1.00 0.00 O ATOM 290 CB ALA A 32 7.812 -0.892 -1.223 1.00 0.00 C ATOM 291 H ALA A 32 7.164 -2.844 0.271 1.00 0.00 H ATOM 292 HA ALA A 32 9.530 -1.332 -0.048 1.00 0.00 H ATOM 293 HB1 ALA A 32 6.757 -0.719 -1.073 1.00 1.02 H ATOM 294 HB2 ALA A 32 8.261 -0.015 -1.664 1.00 1.02 H ATOM 295 HB3 ALA A 32 7.949 -1.738 -1.881 1.00 1.02 H ATOM 296 N VAL A 33 7.161 0.021 1.822 1.00 0.00 N ATOM 297 CA VAL A 33 6.889 1.094 2.784 1.00 0.00 C ATOM 298 C VAL A 33 7.980 1.044 3.892 1.00 0.00 C ATOM 299 O VAL A 33 8.516 2.083 4.285 1.00 0.00 O ATOM 300 CB VAL A 33 5.485 0.967 3.422 1.00 0.01 C ATOM 301 CG1 VAL A 33 5.273 2.034 4.487 1.00 0.03 C ATOM 302 CG2 VAL A 33 4.401 1.063 2.359 1.00 0.02 C ATOM 303 H VAL A 33 6.521 -0.714 1.732 1.00 0.00 H ATOM 304 HA VAL A 33 6.955 2.040 2.262 1.00 0.00 H ATOM 305 HB VAL A 33 5.412 -0.002 3.893 1.00 0.02 H ATOM 306 HG11 VAL A 33 5.367 3.013 4.040 1.00 1.02 H ATOM 307 HG12 VAL A 33 4.287 1.926 4.913 1.00 1.02 H ATOM 308 HG13 VAL A 33 6.015 1.920 5.263 1.00 1.02 H ATOM 309 HG21 VAL A 33 4.535 0.273 1.636 1.00 1.02 H ATOM 310 HG22 VAL A 33 3.431 0.965 2.824 1.00 1.01 H ATOM 311 HG23 VAL A 33 4.467 2.020 1.862 1.00 1.02 H ATOM 312 N LYS A 34 8.299 -0.166 4.375 1.00 0.00 N ATOM 313 CA LYS A 34 9.319 -0.366 5.432 1.00 0.00 C ATOM 314 C LYS A 34 10.671 0.110 4.922 1.00 0.00 C ATOM 315 O LYS A 34 11.433 0.757 5.645 1.00 0.00 O ATOM 316 CB LYS A 34 9.383 -1.844 5.831 1.00 0.03 C ATOM 317 CG LYS A 34 10.131 -2.115 7.132 1.00 1.12 C ATOM 318 CD LYS A 34 9.307 -1.746 8.364 1.00 1.73 C ATOM 319 CE LYS A 34 9.236 -0.242 8.587 1.00 2.35 C ATOM 320 NZ LYS A 34 8.469 0.107 9.813 1.00 3.06 N1+ ATOM 321 H LYS A 34 7.834 -0.950 4.017 1.00 0.00 H ATOM 322 HA LYS A 34 9.036 0.228 6.289 1.00 0.01 H ATOM 323 HB2 LYS A 34 8.376 -2.216 5.940 1.00 0.84 H ATOM 324 HB3 LYS A 34 9.874 -2.394 5.042 1.00 0.85 H ATOM 325 HG2 LYS A 34 10.373 -3.165 7.180 1.00 1.72 H ATOM 326 HG3 LYS A 34 11.042 -1.536 7.135 1.00 1.88 H ATOM 327 HD2 LYS A 34 8.303 -2.124 8.238 1.00 2.30 H ATOM 328 HD3 LYS A 34 9.757 -2.207 9.232 1.00 2.16 H ATOM 329 HE2 LYS A 34 10.241 0.141 8.683 1.00 2.73 H ATOM 330 HE3 LYS A 34 8.760 0.214 7.732 1.00 2.73 H ATOM 331 HZ1 LYS A 34 8.843 -0.418 10.633 1.00 3.37 H ATOM 332 HZ2 LYS A 34 8.550 1.128 10.007 1.00 3.51 H ATOM 333 HZ3 LYS A 34 7.461 -0.132 9.694 1.00 3.43 H ATOM 334 N PHE A 35 10.949 -0.221 3.661 1.00 0.00 N ATOM 335 CA PHE A 35 12.187 0.168 3.000 1.00 0.00 C ATOM 336 C PHE A 35 12.263 1.719 2.992 1.00 0.00 C ATOM 337 O PHE A 35 13.263 2.292 3.426 1.00 0.00 O ATOM 338 CB PHE A 35 12.219 -0.393 1.573 1.00 0.02 C ATOM 339 CG PHE A 35 13.398 0.054 0.753 1.00 0.15 C ATOM 340 CD1 PHE A 35 14.673 -0.420 1.017 1.00 0.28 C ATOM 341 CD2 PHE A 35 13.223 0.945 -0.295 1.00 0.32 C ATOM 342 CE1 PHE A 35 15.750 -0.014 0.251 1.00 0.39 C ATOM 343 CE2 PHE A 35 14.295 1.352 -1.064 1.00 0.43 C ATOM 344 CZ PHE A 35 15.560 0.871 -0.791 1.00 0.43 C ATOM 345 H PHE A 35 10.283 -0.730 3.153 1.00 0.00 H ATOM 346 HA PHE A 35 13.015 -0.228 3.568 1.00 0.01 H ATOM 347 HB2 PHE A 35 12.244 -1.470 1.622 1.00 0.09 H ATOM 348 HB3 PHE A 35 11.320 -0.086 1.057 1.00 0.12 H ATOM 349 HD1 PHE A 35 12.234 1.321 -0.511 1.00 0.43 H ATOM 350 HD2 PHE A 35 14.826 -1.111 1.834 1.00 0.39 H ATOM 351 HE1 PHE A 35 14.145 2.048 -1.877 1.00 0.58 H ATOM 352 HE2 PHE A 35 16.738 -0.391 0.466 1.00 0.52 H ATOM 353 HZ PHE A 35 16.399 1.189 -1.390 1.00 0.54 H ATOM 354 N LEU A 36 11.204 2.375 2.508 1.00 0.00 N ATOM 355 CA LEU A 36 11.137 3.846 2.433 1.00 0.00 C ATOM 356 C LEU A 36 11.176 4.557 3.780 1.00 0.00 C ATOM 357 O LEU A 36 11.541 5.732 3.853 1.00 0.00 O ATOM 358 CB LEU A 36 9.881 4.272 1.670 1.00 0.02 C ATOM 359 CG LEU A 36 9.849 3.867 0.194 1.00 0.86 C ATOM 360 CD1 LEU A 36 8.554 4.325 -0.454 1.00 1.51 C ATOM 361 CD2 LEU A 36 11.047 4.443 -0.546 1.00 1.55 C ATOM 362 H LEU A 36 10.443 1.855 2.178 1.00 0.00 H ATOM 363 HA LEU A 36 11.994 4.169 1.862 1.00 0.01 H ATOM 364 HB2 LEU A 36 9.023 3.835 2.161 1.00 0.65 H ATOM 365 HB3 LEU A 36 9.798 5.347 1.727 1.00 0.66 H ATOM 366 HG LEU A 36 9.895 2.789 0.122 1.00 1.77 H ATOM 367 HD11 LEU A 36 8.469 5.399 -0.373 1.00 2.07 H ATOM 368 HD12 LEU A 36 8.555 4.043 -1.497 1.00 2.05 H ATOM 369 HD13 LEU A 36 7.716 3.859 0.043 1.00 2.02 H ATOM 370 HD21 LEU A 36 11.958 4.072 -0.101 1.00 2.10 H ATOM 371 HD22 LEU A 36 11.007 4.147 -1.584 1.00 2.06 H ATOM 372 HD23 LEU A 36 11.028 5.522 -0.479 1.00 2.09 H ATOM 373 N GLN A 37 10.800 3.851 4.840 1.00 0.00 N ATOM 374 CA GLN A 37 10.804 4.429 6.184 1.00 0.00 C ATOM 375 C GLN A 37 12.160 4.237 6.892 1.00 0.00 C ATOM 376 O GLN A 37 12.402 4.823 7.955 1.00 0.00 O ATOM 377 CB GLN A 37 9.688 3.795 7.015 1.00 0.04 C ATOM 378 CG GLN A 37 9.214 4.663 8.169 1.00 1.15 C ATOM 379 CD GLN A 37 8.192 3.961 9.038 1.00 1.62 C ATOM 380 OE1 GLN A 37 8.235 2.743 9.208 1.00 2.24 O ATOM 381 NE2 GLN A 37 7.253 4.716 9.580 1.00 2.28 N ATOM 382 H GLN A 37 10.522 2.919 4.721 1.00 0.00 H ATOM 383 HA GLN A 37 10.610 5.487 6.089 1.00 0.02 H ATOM 384 HB2 GLN A 37 8.843 3.600 6.371 1.00 0.88 H ATOM 385 HB3 GLN A 37 10.045 2.861 7.420 1.00 0.90 H ATOM 386 HG2 GLN A 37 10.065 4.923 8.780 1.00 1.87 H ATOM 387 HG3 GLN A 37 8.769 5.562 7.768 1.00 1.80 H ATOM 388 HE21 GLN A 37 7.264 5.682 9.391 1.00 2.58 H ATOM 389 HE22 GLN A 37 6.578 4.280 10.147 1.00 2.84 H ATOM 390 N ASN A 38 13.034 3.421 6.300 1.00 0.00 N ATOM 391 CA ASN A 38 14.366 3.138 6.872 1.00 0.00 C ATOM 392 C ASN A 38 15.242 4.375 6.894 1.00 0.00 C ATOM 393 O ASN A 38 15.328 5.094 5.902 1.00 0.00 O ATOM 394 CB ASN A 38 15.064 2.008 6.111 1.00 0.03 C ATOM 395 CG ASN A 38 14.922 0.663 6.800 1.00 0.88 C ATOM 396 OD1 ASN A 38 15.751 0.286 7.630 1.00 1.66 O ATOM 397 ND2 ASN A 38 13.873 -0.072 6.469 1.00 1.27 N ATOM 398 H ASN A 38 12.778 2.987 5.461 1.00 0.00 H ATOM 399 HA ASN A 38 14.212 2.818 7.892 1.00 0.01 H ATOM 400 HB2 ASN A 38 14.634 1.930 5.123 1.00 0.64 H ATOM 401 HB3 ASN A 38 16.117 2.239 6.023 1.00 0.65 H ATOM 402 HD21 ASN A 38 13.246 0.289 5.803 1.00 1.47 H ATOM 403 HD22 ASN A 38 13.761 -0.945 6.900 1.00 1.74 H ATOM 404 N SER A 39 15.892 4.619 8.029 1.00 0.00 N ATOM 405 CA SER A 39 16.761 5.790 8.204 1.00 0.00 C ATOM 406 C SER A 39 17.855 5.966 7.171 1.00 0.00 C ATOM 407 O SER A 39 18.055 7.073 6.660 1.00 0.00 O ATOM 408 CB SER A 39 17.377 5.743 9.602 1.00 0.02 C ATOM 409 OG SER A 39 17.939 4.467 9.867 1.00 1.29 O ATOM 410 H SER A 39 15.770 4.005 8.784 1.00 0.00 H ATOM 411 HA SER A 39 16.125 6.659 8.159 1.00 0.01 H ATOM 412 HB2 SER A 39 18.154 6.489 9.676 1.00 0.98 H ATOM 413 HB3 SER A 39 16.611 5.947 10.337 1.00 0.98 H ATOM 414 HG SER A 39 18.854 4.576 10.175 1.00 1.79 H ATOM 415 N ARG A 40 18.564 4.884 6.868 1.00 0.00 N ATOM 416 CA ARG A 40 19.644 4.923 5.883 1.00 0.00 C ATOM 417 C ARG A 40 19.072 5.182 4.491 1.00 0.00 C ATOM 418 O ARG A 40 19.624 5.964 3.720 1.00 0.00 O ATOM 419 CB ARG A 40 20.474 3.640 5.902 1.00 0.04 C ATOM 420 CG ARG A 40 21.257 3.427 7.190 1.00 0.70 C ATOM 421 CD ARG A 40 22.446 2.498 6.978 1.00 1.41 C ATOM 422 NE ARG A 40 23.468 3.109 6.125 1.00 2.12 N ATOM 423 CZ ARG A 40 24.601 2.508 5.744 1.00 3.08 C ATOM 424 NH1 ARG A 40 24.839 1.242 6.066 1.00 3.56 N1+ ATOM 425 NH2 ARG A 40 25.484 3.171 5.007 1.00 3.96 N ATOM 426 H ARG A 40 18.351 4.037 7.311 1.00 0.00 H ATOM 427 HA ARG A 40 20.284 5.753 6.144 1.00 0.02 H ATOM 428 HB2 ARG A 40 19.813 2.796 5.767 1.00 0.54 H ATOM 429 HB3 ARG A 40 21.176 3.669 5.082 1.00 0.52 H ATOM 430 HG2 ARG A 40 21.618 4.381 7.543 1.00 1.32 H ATOM 431 HG3 ARG A 40 20.600 2.993 7.932 1.00 1.49 H ATOM 432 HD2 ARG A 40 22.882 2.265 7.937 1.00 2.05 H ATOM 433 HD3 ARG A 40 22.097 1.588 6.512 1.00 1.97 H ATOM 434 HE ARG A 40 23.305 4.043 5.832 1.00 2.34 H ATOM 435 HH11 ARG A 40 24.159 0.718 6.599 1.00 3.37 H ATOM 436 HH12 ARG A 40 25.697 0.799 5.785 1.00 4.39 H ATOM 437 HH21 ARG A 40 25.300 4.121 4.731 1.00 4.11 H ATOM 438 HH22 ARG A 40 26.345 2.734 4.727 1.00 4.69 H ATOM 439 N VAL A 41 17.960 4.517 4.183 1.00 0.00 N ATOM 440 CA VAL A 41 17.311 4.667 2.888 1.00 0.00 C ATOM 441 C VAL A 41 16.862 6.105 2.636 1.00 0.00 C ATOM 442 O VAL A 41 17.040 6.626 1.534 1.00 0.00 O ATOM 443 CB VAL A 41 16.076 3.751 2.777 1.00 0.03 C ATOM 444 CG1 VAL A 41 15.330 3.984 1.470 1.00 0.06 C ATOM 445 CG2 VAL A 41 16.488 2.301 2.897 1.00 0.10 C ATOM 446 H VAL A 41 17.571 3.907 4.843 1.00 0.00 H ATOM 447 HA VAL A 41 18.016 4.368 2.127 1.00 0.02 H ATOM 448 HB VAL A 41 15.408 3.980 3.593 1.00 0.07 H ATOM 449 HG11 VAL A 41 15.986 3.774 0.637 1.00 1.02 H ATOM 450 HG12 VAL A 41 14.472 3.330 1.424 1.00 1.01 H ATOM 451 HG13 VAL A 41 15.003 5.012 1.420 1.00 1.02 H ATOM 452 HG21 VAL A 41 16.951 2.137 3.859 1.00 1.02 H ATOM 453 HG22 VAL A 41 15.617 1.670 2.805 1.00 1.03 H ATOM 454 HG23 VAL A 41 17.192 2.061 2.114 1.00 1.01 H ATOM 455 N ARG A 42 16.288 6.739 3.655 1.00 0.00 N ATOM 456 CA ARG A 42 15.810 8.122 3.544 1.00 0.00 C ATOM 457 C ARG A 42 16.912 9.133 3.251 1.00 0.00 C ATOM 458 O ARG A 42 16.631 10.266 2.848 1.00 0.00 O ATOM 459 CB ARG A 42 15.052 8.521 4.812 1.00 0.05 C ATOM 460 CG ARG A 42 13.793 7.701 5.041 1.00 1.16 C ATOM 461 CD ARG A 42 13.005 8.193 6.242 1.00 1.46 C ATOM 462 NE ARG A 42 12.426 9.517 6.018 1.00 2.00 N ATOM 463 CZ ARG A 42 12.182 10.395 6.989 1.00 2.62 C ATOM 464 NH1 ARG A 42 12.505 10.106 8.245 1.00 2.86 N1+ ATOM 465 NH2 ARG A 42 11.632 11.567 6.700 1.00 3.47 N ATOM 466 H ARG A 42 16.177 6.266 4.505 1.00 0.00 H ATOM 467 HA ARG A 42 15.113 8.146 2.720 1.00 0.02 H ATOM 468 HB2 ARG A 42 15.704 8.391 5.663 1.00 0.90 H ATOM 469 HB3 ARG A 42 14.771 9.562 4.738 1.00 0.91 H ATOM 470 HG2 ARG A 42 13.168 7.768 4.163 1.00 1.86 H ATOM 471 HG3 ARG A 42 14.074 6.670 5.203 1.00 1.85 H ATOM 472 HD2 ARG A 42 12.208 7.493 6.445 1.00 1.94 H ATOM 473 HD3 ARG A 42 13.667 8.240 7.094 1.00 1.92 H ATOM 474 HE ARG A 42 12.191 9.755 5.089 1.00 2.39 H ATOM 475 HH11 ARG A 42 12.941 9.224 8.463 1.00 2.73 H ATOM 476 HH12 ARG A 42 12.315 10.762 8.984 1.00 3.50 H ATOM 477 HH21 ARG A 42 11.403 11.797 5.746 1.00 3.81 H ATOM 478 HH22 ARG A 42 11.435 12.231 7.433 1.00 4.00 H ATOM 479 N GLN A 43 18.162 8.722 3.449 1.00 0.00 N ATOM 480 CA GLN A 43 19.302 9.598 3.203 1.00 0.00 C ATOM 481 C GLN A 43 19.652 9.680 1.718 1.00 0.00 C ATOM 482 O GLN A 43 20.324 10.618 1.279 1.00 0.00 O ATOM 483 CB GLN A 43 20.510 9.104 4.012 1.00 0.03 C ATOM 484 CG GLN A 43 21.781 9.920 3.809 1.00 1.21 C ATOM 485 CD GLN A 43 21.627 11.376 4.208 1.00 1.79 C ATOM 486 OE1 GLN A 43 20.848 11.713 5.097 1.00 2.41 O ATOM 487 NE2 GLN A 43 22.368 12.248 3.545 1.00 2.48 N ATOM 488 H GLN A 43 18.321 7.810 3.769 1.00 0.00 H ATOM 489 HA GLN A 43 19.036 10.586 3.549 1.00 0.01 H ATOM 490 HB2 GLN A 43 20.258 9.131 5.061 1.00 0.91 H ATOM 491 HB3 GLN A 43 20.717 8.081 3.730 1.00 0.92 H ATOM 492 HG2 GLN A 43 22.570 9.485 4.403 1.00 1.94 H ATOM 493 HG3 GLN A 43 22.055 9.876 2.765 1.00 1.86 H ATOM 494 HE21 GLN A 43 22.964 11.909 2.841 1.00 2.72 H ATOM 495 HE22 GLN A 43 22.300 13.198 3.790 1.00 3.10 H ATOM 496 N SER A 44 19.193 8.697 0.951 1.00 0.00 N ATOM 497 CA SER A 44 19.470 8.664 -0.476 1.00 0.00 C ATOM 498 C SER A 44 18.525 9.548 -1.272 1.00 0.00 C ATOM 499 O SER A 44 17.390 9.779 -0.844 1.00 0.00 O ATOM 500 CB SER A 44 19.379 7.219 -0.948 1.00 0.04 C ATOM 501 OG SER A 44 19.781 7.072 -2.292 1.00 0.95 O ATOM 502 H SER A 44 18.667 7.977 1.355 1.00 0.00 H ATOM 503 HA SER A 44 20.480 9.011 -0.624 1.00 0.02 H ATOM 504 HB2 SER A 44 20.014 6.602 -0.332 1.00 0.70 H ATOM 505 HB3 SER A 44 18.356 6.880 -0.854 1.00 0.73 H ATOM 506 HG SER A 44 19.313 7.709 -2.840 1.00 1.34 H ATOM 507 N PRO A 45 18.974 10.058 -2.441 1.00 0.00 N ATOM 508 CA PRO A 45 18.121 10.904 -3.260 1.00 0.00 C ATOM 509 C PRO A 45 16.836 10.161 -3.644 1.00 0.00 C ATOM 510 O PRO A 45 16.838 8.936 -3.803 1.00 0.00 O ATOM 511 CB PRO A 45 18.971 11.188 -4.502 1.00 0.00 C ATOM 512 CG PRO A 45 20.377 10.981 -4.056 1.00 0.02 C ATOM 513 CD PRO A 45 20.326 9.906 -3.009 1.00 0.01 C ATOM 514 HA PRO A 45 17.872 11.829 -2.760 1.00 0.00 H ATOM 515 HB2 PRO A 45 18.701 10.501 -5.291 1.00 0.01 H ATOM 516 HB3 PRO A 45 18.808 12.203 -4.829 1.00 0.01 H ATOM 517 HG2 PRO A 45 20.985 10.662 -4.892 1.00 0.03 H ATOM 518 HG3 PRO A 45 20.769 11.895 -3.635 1.00 0.03 H ATOM 519 HD2 PRO A 45 20.448 8.931 -3.459 1.00 0.02 H ATOM 520 HD3 PRO A 45 21.082 10.074 -2.256 1.00 0.02 H ATOM 521 N LEU A 46 15.751 10.912 -3.785 1.00 0.00 N ATOM 522 CA LEU A 46 14.464 10.344 -4.152 1.00 0.00 C ATOM 523 C LEU A 46 14.556 9.406 -5.368 1.00 0.00 C ATOM 524 O LEU A 46 14.077 8.271 -5.305 1.00 0.00 O ATOM 525 CB LEU A 46 13.447 11.465 -4.410 1.00 0.03 C ATOM 526 CG LEU A 46 11.984 11.019 -4.549 1.00 1.24 C ATOM 527 CD1 LEU A 46 11.055 12.147 -4.143 1.00 2.00 C ATOM 528 CD2 LEU A 46 11.674 10.583 -5.976 1.00 1.95 C ATOM 529 H LEU A 46 15.820 11.880 -3.645 1.00 0.00 H ATOM 530 HA LEU A 46 14.122 9.764 -3.308 1.00 0.02 H ATOM 531 HB2 LEU A 46 13.509 12.169 -3.594 1.00 0.96 H ATOM 532 HB3 LEU A 46 13.731 11.973 -5.320 1.00 0.96 H ATOM 533 HG LEU A 46 11.803 10.181 -3.891 1.00 2.05 H ATOM 534 HD11 LEU A 46 11.223 13.001 -4.784 1.00 2.51 H ATOM 535 HD12 LEU A 46 10.029 11.822 -4.240 1.00 2.49 H ATOM 536 HD13 LEU A 46 11.249 12.424 -3.117 1.00 2.44 H ATOM 537 HD21 LEU A 46 12.331 9.774 -6.257 1.00 2.42 H ATOM 538 HD22 LEU A 46 10.647 10.252 -6.036 1.00 2.36 H ATOM 539 HD23 LEU A 46 11.822 11.416 -6.647 1.00 2.49 H ATOM 540 N ALA A 47 15.168 9.881 -6.457 1.00 0.00 N ATOM 541 CA ALA A 47 15.315 9.085 -7.684 1.00 0.00 C ATOM 542 C ALA A 47 15.966 7.735 -7.429 1.00 0.00 C ATOM 543 O ALA A 47 15.615 6.732 -8.062 1.00 0.00 O ATOM 544 CB ALA A 47 16.115 9.862 -8.720 1.00 0.01 C ATOM 545 H ALA A 47 15.525 10.792 -6.441 1.00 0.00 H ATOM 546 HA ALA A 47 14.327 8.921 -8.087 1.00 0.00 H ATOM 547 HB1 ALA A 47 17.118 10.022 -8.354 1.00 1.02 H ATOM 548 HB2 ALA A 47 16.154 9.298 -9.640 1.00 1.02 H ATOM 549 HB3 ALA A 47 15.641 10.815 -8.901 1.00 1.02 H ATOM 550 N THR A 48 16.916 7.731 -6.493 1.00 0.00 N ATOM 551 CA THR A 48 17.671 6.527 -6.093 1.00 0.00 C ATOM 552 C THR A 48 16.740 5.527 -5.403 1.00 0.00 C ATOM 553 O THR A 48 16.797 4.331 -5.684 1.00 0.00 O ATOM 554 CB THR A 48 18.846 6.876 -5.165 1.00 0.02 C ATOM 555 OG1 THR A 48 19.526 8.037 -5.663 1.00 0.11 O ATOM 556 CG2 THR A 48 19.828 5.714 -5.081 1.00 0.13 C ATOM 557 H THR A 48 17.124 8.576 -6.045 1.00 0.00 H ATOM 558 HA THR A 48 18.067 6.071 -6.991 1.00 0.01 H ATOM 559 HB THR A 48 18.464 7.083 -4.177 1.00 0.10 H ATOM 560 HG1 THR A 48 19.370 8.114 -6.623 1.00 0.61 H ATOM 561 HG21 THR A 48 20.232 5.514 -6.062 1.00 1.02 H ATOM 562 HG22 THR A 48 20.631 5.971 -4.406 1.00 1.02 H ATOM 563 HG23 THR A 48 19.316 4.836 -4.715 1.00 1.01 H ATOM 564 N ARG A 49 15.885 6.029 -4.506 1.00 0.00 N ATOM 565 CA ARG A 49 14.920 5.195 -3.776 1.00 0.00 C ATOM 566 C ARG A 49 13.904 4.581 -4.773 1.00 0.00 C ATOM 567 O ARG A 49 13.605 3.387 -4.702 1.00 0.00 O ATOM 568 CB ARG A 49 14.148 6.020 -2.738 1.00 0.04 C ATOM 569 CG ARG A 49 15.001 6.968 -1.908 1.00 0.59 C ATOM 570 CD ARG A 49 14.140 7.747 -0.921 1.00 0.63 C ATOM 571 NE ARG A 49 14.780 8.982 -0.469 1.00 1.10 N ATOM 572 CZ ARG A 49 14.112 10.030 0.019 1.00 1.25 C ATOM 573 NH1 ARG A 49 12.793 9.965 0.185 1.00 1.08 N1+ ATOM 574 NH2 ARG A 49 14.764 11.137 0.352 1.00 2.30 N ATOM 575 H ARG A 49 15.892 6.994 -4.339 1.00 0.00 H ATOM 576 HA ARG A 49 15.460 4.402 -3.282 1.00 0.01 H ATOM 577 HB2 ARG A 49 13.403 6.607 -3.252 1.00 0.46 H ATOM 578 HB3 ARG A 49 13.647 5.340 -2.063 1.00 0.44 H ATOM 579 HG2 ARG A 49 15.735 6.395 -1.361 1.00 0.94 H ATOM 580 HG3 ARG A 49 15.497 7.663 -2.568 1.00 0.99 H ATOM 581 HD2 ARG A 49 13.207 7.997 -1.403 1.00 1.46 H ATOM 582 HD3 ARG A 49 13.942 7.119 -0.064 1.00 1.27 H ATOM 583 HE ARG A 49 15.762 9.043 -0.554 1.00 1.87 H ATOM 584 HH11 ARG A 49 12.297 9.129 -0.045 1.00 1.45 H ATOM 585 HH12 ARG A 49 12.283 10.765 0.537 1.00 1.38 H ATOM 586 HH21 ARG A 49 15.765 11.192 0.241 1.00 3.06 H ATOM 587 HH22 ARG A 49 14.263 11.933 0.716 1.00 2.44 H ATOM 588 N ARG A 50 13.384 5.391 -5.693 1.00 0.00 N ATOM 589 CA ARG A 50 12.424 4.896 -6.679 1.00 0.00 C ATOM 590 C ARG A 50 13.081 3.841 -7.584 1.00 0.00 C ATOM 591 O ARG A 50 12.506 2.779 -7.824 1.00 0.00 O ATOM 592 CB ARG A 50 11.863 6.063 -7.501 1.00 0.06 C ATOM 593 CG ARG A 50 10.639 5.715 -8.345 1.00 1.20 C ATOM 594 CD ARG A 50 11.010 5.058 -9.667 1.00 1.36 C ATOM 595 NE ARG A 50 11.879 5.914 -10.472 1.00 1.99 N ATOM 596 CZ ARG A 50 12.235 5.653 -11.727 1.00 2.57 C ATOM 597 NH1 ARG A 50 11.758 4.582 -12.354 1.00 2.76 N1+ ATOM 598 NH2 ARG A 50 13.061 6.477 -12.361 1.00 3.51 N ATOM 599 H ARG A 50 13.653 6.332 -5.715 1.00 0.00 H ATOM 600 HA ARG A 50 11.615 4.428 -6.139 1.00 0.03 H ATOM 601 HB2 ARG A 50 11.588 6.859 -6.827 1.00 0.92 H ATOM 602 HB3 ARG A 50 12.638 6.419 -8.165 1.00 0.94 H ATOM 603 HG2 ARG A 50 10.012 5.037 -7.786 1.00 1.92 H ATOM 604 HG3 ARG A 50 10.090 6.624 -8.549 1.00 1.88 H ATOM 605 HD2 ARG A 50 11.525 4.130 -9.461 1.00 1.81 H ATOM 606 HD3 ARG A 50 10.105 4.853 -10.220 1.00 1.78 H ATOM 607 HE ARG A 50 12.221 6.738 -10.043 1.00 2.50 H ATOM 608 HH11 ARG A 50 11.120 3.958 -11.886 1.00 2.62 H ATOM 609 HH12 ARG A 50 12.024 4.394 -13.306 1.00 3.43 H ATOM 610 HH21 ARG A 50 13.415 7.299 -11.895 1.00 3.92 H ATOM 611 HH22 ARG A 50 13.341 6.288 -13.311 1.00 4.04 H ATOM 612 N ALA A 51 14.282 4.148 -8.080 1.00 0.00 N ATOM 613 CA ALA A 51 15.020 3.234 -8.959 1.00 0.00 C ATOM 614 C ALA A 51 15.344 1.922 -8.254 1.00 0.00 C ATOM 615 O ALA A 51 15.298 0.855 -8.874 1.00 0.00 O ATOM 616 CB ALA A 51 16.297 3.893 -9.458 1.00 0.01 C ATOM 617 H ALA A 51 14.683 5.010 -7.851 1.00 0.00 H ATOM 618 HA ALA A 51 14.396 3.023 -9.815 1.00 0.00 H ATOM 619 HB1 ALA A 51 16.955 4.081 -8.623 1.00 1.00 H ATOM 620 HB2 ALA A 51 16.788 3.238 -10.163 1.00 1.00 H ATOM 621 HB3 ALA A 51 16.054 4.827 -9.944 1.00 1.01 H ATOM 622 N PHE A 52 15.672 1.999 -6.957 1.00 0.00 N ATOM 623 CA PHE A 52 15.992 0.789 -6.195 1.00 0.00 C ATOM 624 C PHE A 52 14.748 -0.112 -6.200 1.00 0.00 C ATOM 625 O PHE A 52 14.844 -1.311 -6.466 1.00 0.00 O ATOM 626 CB PHE A 52 16.514 1.049 -4.790 1.00 0.05 C ATOM 627 CG PHE A 52 17.784 0.276 -4.549 1.00 0.37 C ATOM 628 CD1 PHE A 52 19.006 0.806 -4.933 1.00 0.60 C ATOM 629 CD2 PHE A 52 17.758 -0.990 -3.975 1.00 0.62 C ATOM 630 CE1 PHE A 52 20.176 0.094 -4.749 1.00 0.89 C ATOM 631 CE2 PHE A 52 18.931 -1.703 -3.786 1.00 0.89 C ATOM 632 CZ PHE A 52 20.138 -1.159 -4.175 1.00 0.99 C ATOM 633 H PHE A 52 15.691 2.871 -6.513 1.00 0.00 H ATOM 634 HA PHE A 52 16.763 0.274 -6.756 1.00 0.02 H ATOM 635 HB2 PHE A 52 16.722 2.103 -4.667 1.00 0.20 H ATOM 636 HB3 PHE A 52 15.781 0.733 -4.063 1.00 0.24 H ATOM 637 HD1 PHE A 52 19.040 1.788 -5.380 1.00 0.67 H ATOM 638 HD2 PHE A 52 16.812 -1.418 -3.672 1.00 0.69 H ATOM 639 HE1 PHE A 52 21.120 0.520 -5.055 1.00 1.10 H ATOM 640 HE2 PHE A 52 18.906 -2.688 -3.333 1.00 1.11 H ATOM 641 HZ PHE A 52 21.052 -1.714 -4.031 1.00 1.23 H ATOM 642 N LEU A 53 13.584 0.472 -5.913 1.00 0.00 N ATOM 643 CA LEU A 53 12.321 -0.275 -5.893 1.00 0.00 C ATOM 644 C LEU A 53 11.990 -0.850 -7.289 1.00 0.00 C ATOM 645 O LEU A 53 11.457 -1.963 -7.394 1.00 0.00 O ATOM 646 CB LEU A 53 11.176 0.618 -5.410 1.00 0.02 C ATOM 647 CG LEU A 53 11.250 1.025 -3.938 1.00 0.55 C ATOM 648 CD1 LEU A 53 10.113 1.972 -3.590 1.00 1.25 C ATOM 649 CD2 LEU A 53 11.206 -0.205 -3.044 1.00 1.14 C ATOM 650 H LEU A 53 13.571 1.432 -5.715 1.00 0.00 H ATOM 651 HA LEU A 53 12.438 -1.096 -5.203 1.00 0.01 H ATOM 652 HB2 LEU A 53 11.169 1.515 -6.012 1.00 0.42 H ATOM 653 HB3 LEU A 53 10.246 0.092 -5.569 1.00 0.41 H ATOM 654 HG LEU A 53 12.181 1.540 -3.757 1.00 1.41 H ATOM 655 HD11 LEU A 53 9.168 1.478 -3.761 1.00 1.81 H ATOM 656 HD12 LEU A 53 10.188 2.256 -2.549 1.00 1.76 H ATOM 657 HD13 LEU A 53 10.177 2.854 -4.209 1.00 1.87 H ATOM 658 HD21 LEU A 53 12.031 -0.858 -3.291 1.00 1.73 H ATOM 659 HD22 LEU A 53 11.286 0.098 -2.011 1.00 1.69 H ATOM 660 HD23 LEU A 53 10.274 -0.728 -3.195 1.00 1.74 H ATOM 661 N LYS A 54 12.303 -0.098 -8.347 1.00 0.00 N ATOM 662 CA LYS A 54 12.043 -0.557 -9.706 1.00 0.00 C ATOM 663 C LYS A 54 12.908 -1.804 -10.005 1.00 0.00 C ATOM 664 O LYS A 54 12.414 -2.767 -10.591 1.00 0.00 O ATOM 665 CB LYS A 54 12.367 0.553 -10.708 1.00 0.04 C ATOM 666 CG LYS A 54 12.257 0.116 -12.159 1.00 1.04 C ATOM 667 CD LYS A 54 12.726 1.204 -13.106 1.00 1.51 C ATOM 668 CE LYS A 54 12.671 0.743 -14.551 1.00 1.91 C ATOM 669 NZ LYS A 54 13.244 1.756 -15.475 1.00 2.46 N1+ ATOM 670 H LYS A 54 12.728 0.773 -8.208 1.00 0.00 H ATOM 671 HA LYS A 54 10.998 -0.820 -9.782 1.00 0.02 H ATOM 672 HB2 LYS A 54 11.684 1.375 -10.550 1.00 0.80 H ATOM 673 HB3 LYS A 54 13.377 0.896 -10.532 1.00 0.80 H ATOM 674 HG2 LYS A 54 12.865 -0.764 -12.307 1.00 1.73 H ATOM 675 HG3 LYS A 54 11.225 -0.117 -12.376 1.00 1.74 H ATOM 676 HD2 LYS A 54 12.091 2.069 -12.989 1.00 2.01 H ATOM 677 HD3 LYS A 54 13.745 1.466 -12.860 1.00 2.09 H ATOM 678 HE2 LYS A 54 13.231 -0.175 -14.645 1.00 2.31 H ATOM 679 HE3 LYS A 54 11.640 0.564 -14.821 1.00 2.38 H ATOM 680 HZ1 LYS A 54 14.245 1.934 -15.235 1.00 2.83 H ATOM 681 HZ2 LYS A 54 13.190 1.417 -16.460 1.00 2.93 H ATOM 682 HZ3 LYS A 54 12.717 2.653 -15.399 1.00 2.79 H ATOM 683 N LYS A 55 14.183 -1.789 -9.602 1.00 0.00 N ATOM 684 CA LYS A 55 15.078 -2.938 -9.848 1.00 0.00 C ATOM 685 C LYS A 55 14.634 -4.161 -9.049 1.00 0.00 C ATOM 686 O LYS A 55 14.998 -5.291 -9.375 1.00 0.00 O ATOM 687 CB LYS A 55 16.555 -2.579 -9.593 1.00 0.04 C ATOM 688 CG LYS A 55 16.944 -2.389 -8.137 1.00 1.16 C ATOM 689 CD LYS A 55 17.651 -3.613 -7.577 1.00 1.85 C ATOM 690 CE LYS A 55 18.899 -3.951 -8.378 1.00 2.58 C ATOM 691 NZ LYS A 55 19.687 -5.043 -7.752 1.00 3.20 N1+ ATOM 692 H LYS A 55 14.532 -1.000 -9.139 1.00 0.00 H ATOM 693 HA LYS A 55 14.973 -3.186 -10.896 1.00 0.02 H ATOM 694 HB2 LYS A 55 17.172 -3.367 -9.997 1.00 0.89 H ATOM 695 HB3 LYS A 55 16.779 -1.664 -10.122 1.00 0.90 H ATOM 696 HG2 LYS A 55 17.605 -1.539 -8.060 1.00 1.81 H ATOM 697 HG3 LYS A 55 16.050 -2.205 -7.558 1.00 1.86 H ATOM 698 HD2 LYS A 55 17.934 -3.417 -6.554 1.00 2.40 H ATOM 699 HD3 LYS A 55 16.974 -4.454 -7.611 1.00 2.28 H ATOM 700 HE2 LYS A 55 18.601 -4.257 -9.369 1.00 2.95 H ATOM 701 HE3 LYS A 55 19.517 -3.066 -8.447 1.00 3.04 H ATOM 702 HZ1 LYS A 55 19.075 -5.864 -7.550 1.00 3.54 H ATOM 703 HZ2 LYS A 55 20.455 -5.344 -8.390 1.00 3.53 H ATOM 704 HZ3 LYS A 55 20.111 -4.712 -6.857 1.00 3.58 H ATOM 705 N LYS A 56 13.842 -3.918 -8.004 1.00 0.00 N ATOM 706 CA LYS A 56 13.307 -4.972 -7.144 1.00 0.00 C ATOM 707 C LYS A 56 12.035 -5.572 -7.798 1.00 0.00 C ATOM 708 O LYS A 56 11.497 -6.574 -7.309 1.00 0.00 O ATOM 709 CB LYS A 56 12.976 -4.406 -5.757 1.00 0.05 C ATOM 710 CG LYS A 56 12.574 -5.463 -4.741 1.00 0.97 C ATOM 711 CD LYS A 56 12.148 -4.844 -3.420 1.00 1.62 C ATOM 712 CE LYS A 56 11.822 -5.913 -2.388 1.00 2.03 C ATOM 713 NZ LYS A 56 10.754 -6.836 -2.857 1.00 2.62 N1+ ATOM 714 H LYS A 56 13.591 -2.989 -7.816 1.00 0.00 H ATOM 715 HA LYS A 56 14.056 -5.745 -7.049 1.00 0.02 H ATOM 716 HB2 LYS A 56 13.844 -3.887 -5.380 1.00 0.76 H ATOM 717 HB3 LYS A 56 12.161 -3.702 -5.855 1.00 0.76 H ATOM 718 HG2 LYS A 56 11.750 -6.034 -5.141 1.00 1.70 H ATOM 719 HG3 LYS A 56 13.416 -6.117 -4.566 1.00 1.64 H ATOM 720 HD2 LYS A 56 12.951 -4.228 -3.045 1.00 2.18 H ATOM 721 HD3 LYS A 56 11.270 -4.234 -3.583 1.00 2.23 H ATOM 722 HE2 LYS A 56 12.716 -6.486 -2.187 1.00 2.43 H ATOM 723 HE3 LYS A 56 11.494 -5.430 -1.478 1.00 2.40 H ATOM 724 HZ1 LYS A 56 11.064 -7.343 -3.715 1.00 3.04 H ATOM 725 HZ2 LYS A 56 10.533 -7.539 -2.116 1.00 3.03 H ATOM 726 HZ3 LYS A 56 9.888 -6.301 -3.078 1.00 2.94 H ATOM 727 N GLY A 57 11.570 -4.954 -8.883 1.00 0.00 N ATOM 728 CA GLY A 57 10.386 -5.444 -9.573 1.00 0.00 C ATOM 729 C GLY A 57 9.079 -4.714 -9.351 1.00 0.00 C ATOM 730 O GLY A 57 8.049 -5.154 -9.862 1.00 0.00 O ATOM 731 H GLY A 57 12.041 -4.167 -9.223 1.00 0.00 H ATOM 732 HA2 GLY A 57 10.591 -5.424 -10.631 1.00 0.00 H ATOM 733 HA3 GLY A 57 10.246 -6.478 -9.285 1.00 0.00 H ATOM 734 N LEU A 58 9.089 -3.616 -8.604 1.00 0.00 N ATOM 735 CA LEU A 58 7.859 -2.873 -8.374 1.00 0.00 C ATOM 736 C LEU A 58 7.637 -1.921 -9.577 1.00 0.00 C ATOM 737 O LEU A 58 8.591 -1.471 -10.213 1.00 0.00 O ATOM 738 CB LEU A 58 7.913 -2.062 -7.072 1.00 0.02 C ATOM 739 CG LEU A 58 7.898 -2.876 -5.775 1.00 0.31 C ATOM 740 CD1 LEU A 58 9.255 -3.508 -5.509 1.00 1.28 C ATOM 741 CD2 LEU A 58 7.478 -1.998 -4.609 1.00 1.24 C ATOM 742 H LEU A 58 9.932 -3.295 -8.219 1.00 0.00 H ATOM 743 HA LEU A 58 7.043 -3.581 -8.328 1.00 0.01 H ATOM 744 HB2 LEU A 58 8.815 -1.468 -7.084 1.00 0.23 H ATOM 745 HB3 LEU A 58 7.065 -1.393 -7.057 1.00 0.25 H ATOM 746 HG LEU A 58 7.174 -3.672 -5.869 1.00 1.12 H ATOM 747 HD11 LEU A 58 10.002 -2.734 -5.421 1.00 1.90 H ATOM 748 HD12 LEU A 58 9.214 -4.075 -4.590 1.00 1.84 H ATOM 749 HD13 LEU A 58 9.511 -4.166 -6.327 1.00 1.87 H ATOM 750 HD21 LEU A 58 6.484 -1.617 -4.785 1.00 1.87 H ATOM 751 HD22 LEU A 58 7.483 -2.582 -3.699 1.00 1.81 H ATOM 752 HD23 LEU A 58 8.169 -1.174 -4.511 1.00 1.82 H ATOM 753 N THR A 59 6.381 -1.623 -9.881 1.00 0.00 N ATOM 754 CA THR A 59 6.074 -0.728 -10.984 1.00 0.00 C ATOM 755 C THR A 59 5.927 0.682 -10.360 1.00 0.00 C ATOM 756 O THR A 59 5.821 0.816 -9.135 1.00 0.00 O ATOM 757 CB THR A 59 4.783 -1.145 -11.712 1.00 0.03 C ATOM 758 OG1 THR A 59 4.656 -2.572 -11.681 1.00 1.09 O ATOM 759 CG2 THR A 59 4.798 -0.677 -13.160 1.00 1.12 C ATOM 760 H THR A 59 5.652 -2.001 -9.345 1.00 0.00 H ATOM 761 HA THR A 59 6.904 -0.735 -11.680 1.00 0.01 H ATOM 762 HB THR A 59 3.937 -0.699 -11.209 1.00 0.84 H ATOM 763 HG1 THR A 59 3.980 -2.814 -11.019 1.00 1.23 H ATOM 764 HG21 THR A 59 5.640 -1.118 -13.672 1.00 1.70 H ATOM 765 HG22 THR A 59 3.882 -0.980 -13.646 1.00 1.67 H ATOM 766 HG23 THR A 59 4.883 0.399 -13.190 1.00 1.79 H ATOM 767 N ASP A 60 5.920 1.721 -11.190 1.00 0.00 N ATOM 768 CA ASP A 60 5.776 3.095 -10.693 1.00 0.00 C ATOM 769 C ASP A 60 4.451 3.247 -9.917 1.00 0.00 C ATOM 770 O ASP A 60 4.388 3.976 -8.937 1.00 0.00 O ATOM 771 CB ASP A 60 5.801 4.101 -11.849 1.00 0.03 C ATOM 772 CG ASP A 60 7.191 4.344 -12.400 1.00 1.35 C ATOM 773 OD1 ASP A 60 7.681 3.511 -13.188 1.00 2.18 O1- ATOM 774 OD2 ASP A 60 7.795 5.383 -12.056 1.00 1.89 O ATOM 775 H ASP A 60 6.003 1.566 -12.155 1.00 0.00 H ATOM 776 HA ASP A 60 6.600 3.297 -10.025 1.00 0.01 H ATOM 777 HB2 ASP A 60 5.180 3.732 -12.651 1.00 1.00 H ATOM 778 HB3 ASP A 60 5.402 5.043 -11.500 1.00 1.01 H ATOM 779 N GLU A 61 3.410 2.549 -10.372 1.00 0.00 N ATOM 780 CA GLU A 61 2.089 2.585 -9.736 1.00 0.00 C ATOM 781 C GLU A 61 2.209 2.074 -8.285 1.00 0.00 C ATOM 782 O GLU A 61 1.664 2.669 -7.349 1.00 0.00 O ATOM 783 CB GLU A 61 1.086 1.739 -10.521 1.00 0.03 C ATOM 784 CG GLU A 61 -0.355 1.948 -10.084 1.00 1.28 C ATOM 785 CD GLU A 61 -0.805 3.387 -10.244 1.00 1.80 C ATOM 786 OE1 GLU A 61 -1.071 3.807 -11.390 1.00 2.33 O1- ATOM 787 OE2 GLU A 61 -0.883 4.110 -9.228 1.00 2.34 O ATOM 788 H GLU A 61 3.536 1.982 -11.161 1.00 0.00 H ATOM 789 HA GLU A 61 1.755 3.613 -9.719 1.00 0.01 H ATOM 790 HB2 GLU A 61 1.162 1.991 -11.568 1.00 0.96 H ATOM 791 HB3 GLU A 61 1.332 0.697 -10.390 1.00 0.96 H ATOM 792 HG2 GLU A 61 -0.995 1.318 -10.682 1.00 1.97 H ATOM 793 HG3 GLU A 61 -0.446 1.670 -9.044 1.00 1.97 H ATOM 794 N GLU A 62 2.931 0.968 -8.116 1.00 0.00 N ATOM 795 CA GLU A 62 3.145 0.351 -6.796 1.00 0.00 C ATOM 796 C GLU A 62 4.059 1.212 -5.914 1.00 0.00 C ATOM 797 O GLU A 62 3.852 1.316 -4.708 1.00 0.00 O ATOM 798 CB GLU A 62 3.741 -1.054 -6.915 1.00 0.04 C ATOM 799 CG GLU A 62 2.751 -2.115 -7.369 1.00 0.47 C ATOM 800 CD GLU A 62 2.445 -2.044 -8.845 1.00 1.11 C ATOM 801 OE1 GLU A 62 3.152 -2.705 -9.623 1.00 1.65 O ATOM 802 OE2 GLU A 62 1.493 -1.338 -9.229 1.00 1.99 O1- ATOM 803 H GLU A 62 3.337 0.548 -8.902 1.00 0.00 H ATOM 804 HA GLU A 62 2.181 0.277 -6.315 1.00 0.02 H ATOM 805 HB2 GLU A 62 4.554 -1.028 -7.625 1.00 0.34 H ATOM 806 HB3 GLU A 62 4.130 -1.348 -5.951 1.00 0.34 H ATOM 807 HG2 GLU A 62 3.163 -3.090 -7.152 1.00 1.26 H ATOM 808 HG3 GLU A 62 1.831 -1.984 -6.818 1.00 1.27 H ATOM 809 N ILE A 63 5.068 1.826 -6.527 1.00 0.00 N ATOM 810 CA ILE A 63 6.011 2.687 -5.805 1.00 0.00 C ATOM 811 C ILE A 63 5.260 3.932 -5.295 1.00 0.00 C ATOM 812 O ILE A 63 5.463 4.355 -4.158 1.00 0.00 O ATOM 813 CB ILE A 63 7.191 3.118 -6.708 1.00 0.02 C ATOM 814 CG1 ILE A 63 7.975 1.887 -7.172 1.00 0.04 C ATOM 815 CG2 ILE A 63 8.105 4.091 -5.974 1.00 0.06 C ATOM 816 CD1 ILE A 63 9.064 2.197 -8.177 1.00 0.07 C ATOM 817 H ILE A 63 5.179 1.708 -7.493 1.00 0.00 H ATOM 818 HA ILE A 63 6.399 2.134 -4.961 1.00 0.01 H ATOM 819 HB ILE A 63 6.787 3.623 -7.573 1.00 0.04 H ATOM 820 HG12 ILE A 63 8.442 1.422 -6.316 1.00 0.07 H ATOM 821 HG13 ILE A 63 7.293 1.185 -7.628 1.00 0.06 H ATOM 822 HG21 ILE A 63 8.500 3.616 -5.088 1.00 1.02 H ATOM 823 HG22 ILE A 63 8.921 4.379 -6.622 1.00 1.02 H ATOM 824 HG23 ILE A 63 7.544 4.969 -5.691 1.00 1.02 H ATOM 825 HD11 ILE A 63 9.770 2.888 -7.740 1.00 1.02 H ATOM 826 HD12 ILE A 63 9.575 1.285 -8.449 1.00 1.03 H ATOM 827 HD13 ILE A 63 8.625 2.640 -9.059 1.00 1.01 H ATOM 828 N ASP A 64 4.399 4.506 -6.143 1.00 0.00 N ATOM 829 CA ASP A 64 3.612 5.694 -5.776 1.00 0.00 C ATOM 830 C ASP A 64 2.766 5.325 -4.543 1.00 0.00 C ATOM 831 O ASP A 64 2.706 6.091 -3.588 1.00 0.00 O ATOM 832 CB ASP A 64 2.706 6.131 -6.926 1.00 0.02 C ATOM 833 CG ASP A 64 1.823 7.302 -6.547 1.00 0.76 C ATOM 834 OD1 ASP A 64 2.355 8.414 -6.354 1.00 1.09 O1- ATOM 835 OD2 ASP A 64 0.590 7.116 -6.436 1.00 1.32 O ATOM 836 H ASP A 64 4.282 4.116 -7.033 1.00 0.00 H ATOM 837 HA ASP A 64 4.294 6.491 -5.517 1.00 0.01 H ATOM 838 HB2 ASP A 64 3.319 6.423 -7.767 1.00 0.54 H ATOM 839 HB3 ASP A 64 2.075 5.303 -7.215 1.00 0.57 H ATOM 840 N MET A 65 2.123 4.147 -4.580 1.00 0.00 N ATOM 841 CA MET A 65 1.286 3.671 -3.458 1.00 0.00 C ATOM 842 C MET A 65 2.145 3.504 -2.179 1.00 0.00 C ATOM 843 O MET A 65 1.687 3.819 -1.075 1.00 0.00 O ATOM 844 CB MET A 65 0.603 2.347 -3.804 1.00 0.07 C ATOM 845 CG MET A 65 -0.250 1.788 -2.673 1.00 1.15 C ATOM 846 SD MET A 65 -1.563 2.916 -2.156 1.00 1.82 S ATOM 847 CE MET A 65 -2.591 2.930 -3.622 1.00 2.28 C ATOM 848 H MET A 65 2.217 3.580 -5.374 1.00 0.00 H ATOM 849 HA MET A 65 0.530 4.421 -3.271 1.00 0.03 H ATOM 850 HB2 MET A 65 -0.031 2.497 -4.667 1.00 0.91 H ATOM 851 HB3 MET A 65 1.362 1.619 -4.049 1.00 0.91 H ATOM 852 HG2 MET A 65 -0.701 0.866 -3.006 1.00 1.81 H ATOM 853 HG3 MET A 65 0.389 1.588 -1.825 1.00 1.92 H ATOM 854 HE1 MET A 65 -2.937 1.928 -3.830 1.00 2.60 H ATOM 855 HE2 MET A 65 -3.440 3.578 -3.460 1.00 2.69 H ATOM 856 HE3 MET A 65 -2.017 3.294 -4.461 1.00 2.74 H ATOM 857 N ALA A 66 3.378 3.015 -2.331 1.00 0.00 N ATOM 858 CA ALA A 66 4.293 2.829 -1.189 1.00 0.00 C ATOM 859 C ALA A 66 4.583 4.218 -0.574 1.00 0.00 C ATOM 860 O ALA A 66 4.495 4.392 0.649 1.00 0.00 O ATOM 861 CB ALA A 66 5.579 2.146 -1.631 1.00 0.00 C ATOM 862 H ALA A 66 3.693 2.789 -3.232 1.00 0.00 H ATOM 863 HA ALA A 66 3.798 2.207 -0.454 1.00 0.00 H ATOM 864 HB1 ALA A 66 6.071 2.753 -2.376 1.00 1.01 H ATOM 865 HB2 ALA A 66 6.231 2.022 -0.780 1.00 1.01 H ATOM 866 HB3 ALA A 66 5.347 1.178 -2.051 1.00 1.01 H ATOM 867 N PHE A 67 4.922 5.202 -1.417 1.00 0.00 N ATOM 868 CA PHE A 67 5.206 6.547 -0.923 1.00 0.00 C ATOM 869 C PHE A 67 3.953 7.123 -0.241 1.00 0.00 C ATOM 870 O PHE A 67 4.050 7.754 0.808 1.00 0.00 O ATOM 871 CB PHE A 67 5.659 7.446 -2.076 1.00 0.02 C ATOM 872 CG PHE A 67 6.355 8.697 -1.627 1.00 0.69 C ATOM 873 CD1 PHE A 67 7.688 8.672 -1.251 1.00 0.79 C ATOM 874 CD2 PHE A 67 5.673 9.902 -1.584 1.00 1.48 C ATOM 875 CE1 PHE A 67 8.326 9.824 -0.839 1.00 1.35 C ATOM 876 CE2 PHE A 67 6.306 11.057 -1.172 1.00 2.10 C ATOM 877 CZ PHE A 67 7.654 11.008 -0.796 1.00 1.97 C ATOM 878 H PHE A 67 4.976 5.017 -2.377 1.00 0.00 H ATOM 879 HA PHE A 67 5.999 6.474 -0.194 1.00 0.01 H ATOM 880 HB2 PHE A 67 6.342 6.895 -2.705 1.00 0.52 H ATOM 881 HB3 PHE A 67 4.796 7.736 -2.659 1.00 0.53 H ATOM 882 HD1 PHE A 67 8.230 7.739 -1.283 1.00 0.85 H ATOM 883 HD2 PHE A 67 4.634 9.933 -1.875 1.00 1.68 H ATOM 884 HE1 PHE A 67 9.366 9.793 -0.547 1.00 1.48 H ATOM 885 HE2 PHE A 67 5.763 11.991 -1.141 1.00 2.73 H ATOM 886 HZ PHE A 67 8.159 11.906 -0.473 1.00 2.47 H ATOM 887 N GLN A 68 2.787 6.895 -0.844 1.00 0.00 N ATOM 888 CA GLN A 68 1.539 7.393 -0.287 1.00 0.00 C ATOM 889 C GLN A 68 1.276 6.880 1.129 1.00 0.00 C ATOM 890 O GLN A 68 0.769 7.617 1.983 1.00 0.00 O ATOM 891 CB GLN A 68 0.380 7.006 -1.212 1.00 0.03 C ATOM 892 CG GLN A 68 -0.994 7.372 -0.674 1.00 1.08 C ATOM 893 CD GLN A 68 -2.116 6.979 -1.616 1.00 1.66 C ATOM 894 OE1 GLN A 68 -3.211 6.627 -1.180 1.00 2.38 O ATOM 895 NE2 GLN A 68 -1.864 7.058 -2.913 1.00 2.32 N ATOM 896 H GLN A 68 2.772 6.385 -1.679 1.00 0.00 H ATOM 897 HA GLN A 68 1.605 8.469 -0.254 1.00 0.01 H ATOM 898 HB2 GLN A 68 0.513 7.503 -2.161 1.00 0.82 H ATOM 899 HB3 GLN A 68 0.406 5.938 -1.371 1.00 0.83 H ATOM 900 HG2 GLN A 68 -1.143 6.869 0.270 1.00 1.81 H ATOM 901 HG3 GLN A 68 -1.032 8.441 -0.520 1.00 1.75 H ATOM 902 HE21 GLN A 68 -0.975 7.368 -3.198 1.00 2.52 H ATOM 903 HE22 GLN A 68 -2.576 6.805 -3.539 1.00 2.98 H ATOM 904 N GLN A 69 1.623 5.620 1.369 1.00 0.00 N ATOM 905 CA GLN A 69 1.408 5.015 2.683 1.00 0.00 C ATOM 906 C GLN A 69 2.560 5.101 3.661 1.00 0.00 C ATOM 907 O GLN A 69 2.438 4.635 4.798 1.00 0.00 O ATOM 908 CB GLN A 69 1.010 3.550 2.508 1.00 0.03 C ATOM 909 CG GLN A 69 -0.296 3.364 1.754 1.00 1.01 C ATOM 910 CD GLN A 69 -0.770 1.926 1.750 1.00 1.49 C ATOM 911 OE1 GLN A 69 -0.453 1.149 0.849 1.00 2.11 O ATOM 912 NE2 GLN A 69 -1.530 1.562 2.767 1.00 2.22 N ATOM 913 H GLN A 69 2.016 5.083 0.649 1.00 0.00 H ATOM 914 HA GLN A 69 0.567 5.525 3.124 1.00 0.01 H ATOM 915 HB2 GLN A 69 1.791 3.037 1.965 1.00 0.77 H ATOM 916 HB3 GLN A 69 0.904 3.097 3.483 1.00 0.79 H ATOM 917 HG2 GLN A 69 -1.055 3.974 2.220 1.00 1.73 H ATOM 918 HG3 GLN A 69 -0.155 3.685 0.732 1.00 1.67 H ATOM 919 HE21 GLN A 69 -1.739 2.236 3.455 1.00 2.53 H ATOM 920 HE22 GLN A 69 -1.855 0.635 2.797 1.00 2.80 H ATOM 921 N SER A 70 3.666 5.695 3.225 1.00 0.00 N ATOM 922 CA SER A 70 4.875 5.842 4.045 1.00 0.00 C ATOM 923 C SER A 70 4.820 6.859 5.153 1.00 0.00 C ATOM 924 O SER A 70 5.677 6.869 6.046 1.00 0.00 O ATOM 925 CB SER A 70 6.070 6.168 3.147 1.00 0.02 C ATOM 926 OG SER A 70 6.381 5.088 2.285 1.00 1.27 O ATOM 927 H SER A 70 3.683 6.034 2.305 1.00 0.00 H ATOM 928 HA SER A 70 5.063 4.880 4.492 1.00 0.01 H ATOM 929 HB2 SER A 70 5.840 7.034 2.546 1.00 1.00 H ATOM 930 HB3 SER A 70 6.932 6.379 3.763 1.00 1.00 H ATOM 931 HG SER A 70 5.580 4.803 1.822 1.00 1.94 H ATOM 932 N GLY A 71 3.816 7.718 5.105 1.00 0.04 N ATOM 933 CA GLY A 71 3.711 8.786 6.072 1.00 0.08 C ATOM 934 C GLY A 71 3.485 10.123 5.407 1.00 0.99 C ATOM 935 O GLY A 71 4.238 11.071 5.629 1.00 1.78 O ATOM 936 H GLY A 71 3.131 7.621 4.410 1.00 0.07 H ATOM 937 HA2 GLY A 71 2.885 8.578 6.737 1.00 0.70 H ATOM 938 HA3 GLY A 71 4.624 8.831 6.647 1.00 0.72 H