Sunday, September 22 2024 07:27:12
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1.07s
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CTEST_FULL_OUTPUT JESTEM T -1587086176 1 T -1587086176 5 T -1587086176 8 T -1587086176 10 T -1587086176 11 T -1587086176 12 T -1587086176 15 T -1587086176 16 T -1587086176 19 T -1587086176 20 T -1587086176 22 T -1587086176 23 T -1587086176 24 T -1587086176 26 T -1587086176 27 T -1587086176 28 T -1587086176 30 T -1587086176 34 T -1587086176 35 T -1587086176 36 T -1587086176 39 T -1587086176 41 T -1587086176 44 T -1587086176 45 T -1587086176 52 T -1587086176 60 T -1587086176 62 T -1587086176 68 T -1587086176 73 T -1587086176 74 T -1587086176 75 T -1587086176 76 T -1587086176 77 T -1587086176 83 T -1587086176 87 T -1587086176 91 T -1587086176 97 T -1587086176 98 T -1587086176 104 T -1587086176 110 T -1587086176 111 T -1587086176 113 T -1587086176 114 T -1587086176 115 T -1587086176 117 T -1587086176 121 T -1587086176 124 T -1587086176 128 T -1587086176 129 T -1587086176 134 T -1587086176 137 T -1587086176 138 T -1587086176 141 T -1587086176 146 T -1587086176 147 T -1587086176 151 T -1587086176 155 T -1587086176 161 T -1587086176 164 T -1587086176 175 T -1587086176 177 T -1587086176 178 T -1587086176 183 T -1587086176 186 T -1587086176 193 T -1587086176 196 T -1587086176 205 T -1587086176 211 T -1587086176 216 T -1587086176 219 T -1587086176 220 T -1587086176 221 T -1587086176 226 T -1587086176 229 T -1587086176 231 T -1587086176 234 T -1587086176 238 T -1587086176 250 T -1587086176 252 T -1587086176 257 T -1587086176 259 T -1587086176 261 T -1587086176 265 T -1587086176 269 T -1587086176 271 T -1587086176 277 T -1587086176 278 T -1587086176 283 T -1587086176 291 T -1587086176 294 T -1587086176 298 T -1587086176 299 T -1587086176 303 T -1587086176 307 T -1587086176 312 T -1587086176 316 T -1587086176 318 T -1587086176 319 T -1587086176 323 T -1587086176 327 T -1587086176 331 T -1587086176 338 T -1587086176 344 T -1587086176 346 T -1587086176 347 T -1587086176 353 T -1587086176 355 T -1587086176 356 T -1587086176 358 T -1587086176 359 T -1587086176 362 T 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T -1587086176 119 T -1587086176 120 T -1587086176 123 T -1587086176 125 T -1587086176 131 T -1587086176 132 T -1587086176 133 T -1587086176 143 T -1587086176 145 T -1587086176 150 T -1587086176 152 T -1587086176 153 T -1587086176 159 T -1587086176 162 T -1587086176 166 T -1587086176 172 T -1587086176 173 T -1587086176 180 T -1587086176 182 T -1587086176 191 T -1587086176 194 T -1587086176 203 T -1587086176 204 T -1587086176 207 T -1587086176 210 T -1587086176 213 T -1587086176 222 T -1587086176 228 T -1587086176 232 T -1587086176 235 T -1587086176 240 T -1587086176 241 T -1587086176 246 T -1587086176 251 T -1587086176 256 T -1587086176 258 T -1587086176 262 T -1587086176 270 T -1587086176 272 T -1587086176 273 T -1587086176 275 T -1587086176 279 T -1587086176 281 T -1587086176 284 T -1587086176 285 T -1587086176 286 T -1587086176 288 T -1587086176 290 T -1587086176 296 T -1587086176 301 T -1587086176 305 T -1587086176 308 T -1587086176 315 T -1587086176 321 T -1587086176 324 T 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-1587086176 67 T -1587086176 69 T -1587086176 71 T -1587086176 79 T -1587086176 85 T -1587086176 96 T -1587086176 99 T -1587086176 102 T -1587086176 122 T -1587086176 126 T -1587086176 127 T -1587086176 130 T -1587086176 135 T -1587086176 140 T -1587086176 142 T -1587086176 148 T -1587086176 149 T -1587086176 154 T -1587086176 165 T -1587086176 167 T -1587086176 168 T -1587086176 171 T -1587086176 176 T -1587086176 179 T -1587086176 181 T -1587086176 192 T -1587086176 197 T -1587086176 198 T -1587086176 199 T -1587086176 201 T -1587086176 206 T -1587086176 208 T -1587086176 209 T -1587086176 212 T -1587086176 214 T -1587086176 215 T -1587086176 217 T -1587086176 223 T -1587086176 227 T -1587086176 233 T -1587086176 236 T -1587086176 242 T -1587086176 243 T -1587086176 245 T -1587086176 260 T -1587086176 267 T -1587086176 268 T -1587086176 276 T -1587086176 280 T -1587086176 289 T -1587086176 292 T -1587086176 297 T -1587086176 300 T -1587086176 302 T -1587086176 311 T -1587086176 314 T 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-1587086176 564 T -1587086176 566 T -1587086176 572 T -1587086176 573 T -1587086176 4 T -1587086176 7 T -1587086176 13 T -1587086176 14 T -1587086176 18 T -1587086176 37 T -1587086176 38 T -1587086176 48 T -1587086176 50 T -1587086176 53 T -1587086176 56 T -1587086176 59 T -1587086176 61 T -1587086176 65 T -1587086176 72 T -1587086176 78 T -1587086176 86 T -1587086176 95 T -1587086176 109 T -1587086176 112 T -1587086176 116 T -1587086176 136 T -1587086176 156 T -1587086176 157 T -1587086176 158 T -1587086176 160 T -1587086176 169 T -1587086176 184 T -1587086176 187 T -1587086176 188 T -1587086176 189 T -1587086176 190 T -1587086176 195 T -1587086176 200 T -1587086176 202 T -1587086176 218 T -1587086176 224 T -1587086176 225 T -1587086176 230 T -1587086176 237 T -1587086176 248 T -1587086176 253 T -1587086176 255 T -1587086176 263 T -1587086176 264 T -1587086176 266 T -1587086176 274 T -1587086176 282 T -1587086176 287 T -1587086176 293 T -1587086176 295 T -1587086176 304 T -1587086176 309 T -1587086176 310 T -1587086176 320 T -1587086176 328 T -1587086176 334 T -1587086176 335 T -1587086176 339 T -1587086176 340 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1587086176 342 T -1587086176 348 T -1587086176 354 T -1587086176 360 T -1587086176 365 T -1587086176 367 T -1587086176 372 T -1587086176 381 T -1587086176 383 T -1587086176 384 T -1587086176 392 T -1587086176 396 T -1587086176 397 T -1587086176 401 T -1587086176 408 T -1587086176 411 T -1587086176 417 T -1587086176 418 T -1587086176 421 T -1587086176 422 T -1587086176 430 T -1587086176 435 T -1587086176 458 T -1587086176 465 T -1587086176 468 T -1587086176 470 T -1587086176 472 T -1587086176 474 T -1587086176 480 T -1587086176 482 T -1587086176 483 T -1587086176 488 T -1587086176 490 T -1587086176 491 T -1587086176 494 T -1587086176 496 T -1587086176 501 T -1587086176 502 T -1587086176 504 T -1587086176 508 T -1587086176 516 T -1587086176 518 T -1587086176 520 T -1587086176 525 T -1587086176 527 T -1587086176 529 T -1587086176 532 T -1587086176 535 T -1587086176 543 T -1587086176 555 T -1587086176 565 T -1587086176 569 T -1587086176 570 T -1587086176 25 T -1587086176 32 T -1587086176 42 T -1587086176 46 T -1587086176 63 T -1587086176 80 T -1587086176 88 T -1587086176 103 T -1587086176 105 T -1587086176 106 T -1587086176 108 T -1587086176 139 T -1587086176 144 T -1587086176 163 T -1587086176 170 T -1587086176 174 T -1587086176 185 T -1587086176 239 T -1587086176 244 T -1587086176 247 T -1587086176 249 T -1587086176 254 T -1587086176 306 T -1587086176 313 T -1587086176 317 T -1587086176 326 T -1587086176 332 T -1587086176 351 T -1587086176 352 T -1587086176 361 T -1587086176 364 T -1587086176 376 T -1587086176 382 T -1587086176 390 T -1587086176 393 T -1587086176 399 T -1587086176 407 T -1587086176 414 T -1587086176 425 T -1587086176 426 T -1587086176 427 T -1587086176 431 T -1587086176 438 T -1587086176 450 T -1587086176 451 T -1587086176 454 T -1587086176 455 T -1587086176 466 T -1587086176 481 T -1587086176 484 T -1587086176 485 T -1587086176 486 T -1587086176 493 T -1587086176 495 T -1587086176 503 T -1587086176 505 T -1587086176 514 T -1587086176 515 T -1587086176 522 T -1587086176 531 T -1587086176 536 T -1587086176 547 T -1587086176 549 T -1587086176 557 T -1587086176 561 T -1587086176 562 T -1587086176 567 T -1587086176 574 THERE ARE 5 FAMILIES OF CONFORMATIONS 1L2Y_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY -3.63351E+00 AVE RMSD 3.31 1L2Y_wham_T280K_0001.pdb:REMARK 1L2Y clustering ENERGY -1.18055E+00 RMS 2.81 1L2Y_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY -3.49023E+00 AVE RMSD 2.71 1L2Y_wham_T280K_0002.pdb:REMARK 1L2Y clustering ENERGY -1.17937E+00 RMS 2.35 1L2Y_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY -3.39328E+00 AVE RMSD 3.24 1L2Y_wham_T280K_0003.pdb:REMARK 1L2Y clustering ENERGY -1.17917E+00 RMS 3.08 1L2Y_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY -3.33458E+00 AVE RMSD 2.85 1L2Y_wham_T280K_0004.pdb:REMARK 1L2Y clustering ENERGY -1.17823E+00 RMS 3.03 1L2Y_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY -2.95461E+00 AVE RMSD 5.18 1L2Y_wham_T280K_0005.pdb:REMARK 1L2Y clustering ENERGY -1.17076E+00 RMS 4.94
