Monday, September 23 2024 21:29:29
UNRES
1.00s
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CTEST_FULL_OUTPUT JESTEM T -1729501168 1 T -1729501168 5 T -1729501168 8 T -1729501168 10 T -1729501168 11 T -1729501168 12 T -1729501168 15 T -1729501168 16 T -1729501168 19 T -1729501168 20 T -1729501168 22 T -1729501168 23 T -1729501168 24 T -1729501168 26 T -1729501168 27 T -1729501168 28 T -1729501168 30 T -1729501168 34 T -1729501168 35 T -1729501168 36 T -1729501168 39 T -1729501168 41 T -1729501168 44 T -1729501168 45 T -1729501168 52 T -1729501168 60 T -1729501168 62 T -1729501168 68 T -1729501168 73 T -1729501168 74 T -1729501168 75 T -1729501168 76 T -1729501168 77 T -1729501168 83 T -1729501168 87 T -1729501168 91 T -1729501168 97 T -1729501168 98 T -1729501168 104 T -1729501168 110 T -1729501168 111 T -1729501168 113 T -1729501168 114 T -1729501168 115 T -1729501168 117 T -1729501168 121 T -1729501168 124 T -1729501168 128 T -1729501168 129 T -1729501168 134 T -1729501168 137 T -1729501168 138 T -1729501168 141 T -1729501168 146 T -1729501168 147 T -1729501168 151 T -1729501168 155 T -1729501168 161 T -1729501168 164 T -1729501168 175 T -1729501168 177 T -1729501168 178 T -1729501168 183 T -1729501168 186 T -1729501168 193 T -1729501168 196 T -1729501168 205 T -1729501168 211 T -1729501168 216 T -1729501168 219 T -1729501168 220 T -1729501168 221 T -1729501168 226 T -1729501168 229 T -1729501168 231 T -1729501168 234 T -1729501168 238 T -1729501168 250 T -1729501168 252 T -1729501168 257 T -1729501168 259 T -1729501168 261 T -1729501168 265 T -1729501168 269 T -1729501168 271 T -1729501168 277 T -1729501168 278 T -1729501168 283 T -1729501168 291 T -1729501168 294 T -1729501168 298 T -1729501168 299 T -1729501168 303 T -1729501168 307 T -1729501168 312 T -1729501168 316 T -1729501168 318 T -1729501168 319 T -1729501168 323 T -1729501168 327 T -1729501168 331 T -1729501168 338 T -1729501168 344 T -1729501168 346 T -1729501168 347 T -1729501168 353 T -1729501168 355 T -1729501168 356 T -1729501168 358 T -1729501168 359 T -1729501168 362 T -1729501168 373 T -1729501168 374 T -1729501168 378 T -1729501168 386 T -1729501168 389 T -1729501168 394 T -1729501168 405 T -1729501168 413 T -1729501168 416 T -1729501168 420 T -1729501168 429 T -1729501168 439 T -1729501168 440 T -1729501168 441 T -1729501168 447 T -1729501168 448 T -1729501168 453 T -1729501168 478 T -1729501168 479 T -1729501168 489 T -1729501168 499 T -1729501168 510 T -1729501168 513 T -1729501168 537 T -1729501168 538 T -1729501168 544 T -1729501168 545 T -1729501168 552 T -1729501168 554 T -1729501168 560 T -1729501168 563 T -1729501168 571 T -1729501168 2 T -1729501168 6 T -1729501168 9 T -1729501168 17 T -1729501168 29 T -1729501168 31 T -1729501168 40 T -1729501168 47 T -1729501168 49 T -1729501168 55 T -1729501168 57 T -1729501168 66 T -1729501168 70 T -1729501168 81 T -1729501168 82 T -1729501168 84 T -1729501168 89 T -1729501168 90 T -1729501168 92 T -1729501168 93 T -1729501168 94 T -1729501168 100 T -1729501168 101 T -1729501168 107 T -1729501168 118 T -1729501168 119 T -1729501168 120 T -1729501168 123 T -1729501168 125 T -1729501168 131 T -1729501168 132 T -1729501168 133 T -1729501168 143 T -1729501168 145 T -1729501168 150 T -1729501168 152 T -1729501168 153 T -1729501168 159 T -1729501168 162 T -1729501168 166 T -1729501168 172 T -1729501168 173 T -1729501168 180 T -1729501168 182 T -1729501168 191 T -1729501168 194 T -1729501168 203 T -1729501168 204 T -1729501168 207 T -1729501168 210 T -1729501168 213 T -1729501168 222 T -1729501168 228 T -1729501168 232 T -1729501168 235 T -1729501168 240 T -1729501168 241 T -1729501168 246 T -1729501168 251 T -1729501168 256 T -1729501168 258 T -1729501168 262 T -1729501168 270 T -1729501168 272 T -1729501168 273 T -1729501168 275 T -1729501168 279 T -1729501168 281 T -1729501168 284 T -1729501168 285 T -1729501168 286 T -1729501168 288 T -1729501168 290 T -1729501168 296 T -1729501168 301 T -1729501168 305 T -1729501168 308 T -1729501168 315 T -1729501168 321 T -1729501168 324 T -1729501168 325 T -1729501168 330 T -1729501168 333 T -1729501168 336 T -1729501168 337 T -1729501168 350 T -1729501168 369 T -1729501168 370 T -1729501168 377 T -1729501168 379 T -1729501168 380 T -1729501168 387 T -1729501168 388 T -1729501168 395 T -1729501168 398 T -1729501168 403 T -1729501168 419 T -1729501168 423 T -1729501168 428 T -1729501168 436 T -1729501168 445 T -1729501168 452 T -1729501168 456 T -1729501168 457 T -1729501168 459 T -1729501168 461 T -1729501168 462 T -1729501168 463 T -1729501168 464 T -1729501168 467 T -1729501168 471 T -1729501168 475 T -1729501168 476 T -1729501168 497 T -1729501168 498 T -1729501168 500 T -1729501168 506 T -1729501168 507 T -1729501168 511 T -1729501168 521 T -1729501168 530 T -1729501168 534 T -1729501168 539 T -1729501168 550 T -1729501168 551 T -1729501168 559 T -1729501168 568 T -1729501168 575 T -1729501168 3 T -1729501168 21 T -1729501168 33 T -1729501168 43 T -1729501168 51 T -1729501168 54 T -1729501168 58 T -1729501168 64 T -1729501168 67 T -1729501168 69 T -1729501168 71 T -1729501168 79 T -1729501168 85 T -1729501168 96 T -1729501168 99 T -1729501168 102 T -1729501168 122 T -1729501168 126 T -1729501168 127 T -1729501168 130 T -1729501168 135 T -1729501168 140 T -1729501168 142 T -1729501168 148 T -1729501168 149 T -1729501168 154 T -1729501168 165 T -1729501168 167 T -1729501168 168 T -1729501168 171 T -1729501168 176 T -1729501168 179 T -1729501168 181 T -1729501168 192 T -1729501168 197 T -1729501168 198 T -1729501168 199 T -1729501168 201 T -1729501168 206 T -1729501168 208 T -1729501168 209 T -1729501168 212 T -1729501168 214 T -1729501168 215 T -1729501168 217 T -1729501168 223 T -1729501168 227 T -1729501168 233 T -1729501168 236 T -1729501168 242 T -1729501168 243 T -1729501168 245 T -1729501168 260 T -1729501168 267 T -1729501168 268 T -1729501168 276 T -1729501168 280 T -1729501168 289 T -1729501168 292 T -1729501168 297 T -1729501168 300 T -1729501168 302 T -1729501168 311 T -1729501168 314 T -1729501168 322 T -1729501168 329 T -1729501168 341 T -1729501168 343 T -1729501168 345 T -1729501168 349 T -1729501168 357 T -1729501168 363 T -1729501168 366 T -1729501168 368 T -1729501168 371 T -1729501168 375 T -1729501168 385 T -1729501168 391 T -1729501168 400 T -1729501168 402 T -1729501168 404 T -1729501168 406 T -1729501168 409 T -1729501168 410 T -1729501168 412 T -1729501168 415 T -1729501168 424 T -1729501168 432 T -1729501168 433 T -1729501168 434 T -1729501168 437 T -1729501168 442 T -1729501168 443 T -1729501168 444 T -1729501168 446 T -1729501168 449 T -1729501168 460 T -1729501168 469 T -1729501168 473 T -1729501168 477 T -1729501168 487 T -1729501168 492 T -1729501168 509 T -1729501168 512 T -1729501168 517 T -1729501168 519 T -1729501168 523 T -1729501168 524 T -1729501168 526 T -1729501168 528 T -1729501168 533 T -1729501168 540 T -1729501168 541 T -1729501168 542 T -1729501168 546 T -1729501168 548 T -1729501168 553 T -1729501168 556 T -1729501168 558 T -1729501168 564 T -1729501168 566 T -1729501168 572 T -1729501168 573 T -1729501168 4 T -1729501168 7 T -1729501168 13 T -1729501168 14 T -1729501168 18 T -1729501168 37 T -1729501168 38 T -1729501168 48 T -1729501168 50 T -1729501168 53 T -1729501168 56 T -1729501168 59 T -1729501168 61 T -1729501168 65 T -1729501168 72 T -1729501168 78 T -1729501168 86 T -1729501168 95 T -1729501168 109 T -1729501168 112 T -1729501168 116 T -1729501168 136 T -1729501168 156 T -1729501168 157 T -1729501168 158 T -1729501168 160 T -1729501168 169 T -1729501168 184 T -1729501168 187 T -1729501168 188 T -1729501168 189 T -1729501168 190 T -1729501168 195 T -1729501168 200 T -1729501168 202 T -1729501168 218 T -1729501168 224 T -1729501168 225 T -1729501168 230 T -1729501168 237 T -1729501168 248 T -1729501168 253 T -1729501168 255 T -1729501168 263 T -1729501168 264 T -1729501168 266 T -1729501168 274 T -1729501168 282 T -1729501168 287 T -1729501168 293 T -1729501168 295 T -1729501168 304 T -1729501168 309 T -1729501168 310 T -1729501168 320 T -1729501168 328 T -1729501168 334 T -1729501168 335 T -1729501168 339 T -1729501168 340 STOP ********** Program terminated normally. STOP ********** Program terminated normally. T -1729501168 342 T -1729501168 348 T -1729501168 354 T -1729501168 360 T -1729501168 365 T -1729501168 367 T -1729501168 372 T -1729501168 381 T -1729501168 383 T -1729501168 384 T -1729501168 392 T -1729501168 396 T -1729501168 397 T -1729501168 401 T -1729501168 408 T -1729501168 411 T -1729501168 417 T -1729501168 418 T -1729501168 421 T -1729501168 422 T -1729501168 430 T -1729501168 435 T -1729501168 458 T -1729501168 465 T -1729501168 468 T -1729501168 470 T -1729501168 472 T -1729501168 474 T -1729501168 480 T -1729501168 482 T -1729501168 483 T -1729501168 488 T -1729501168 490 T -1729501168 491 T -1729501168 494 T -1729501168 496 T -1729501168 501 T -1729501168 502 T -1729501168 504 T -1729501168 508 T -1729501168 516 T -1729501168 518 T -1729501168 520 T -1729501168 525 T -1729501168 527 T -1729501168 529 T -1729501168 532 T -1729501168 535 T -1729501168 543 T -1729501168 555 T -1729501168 565 T -1729501168 569 T -1729501168 570 T -1729501168 25 T -1729501168 32 T -1729501168 42 T -1729501168 46 T -1729501168 63 T -1729501168 80 T -1729501168 88 T -1729501168 103 T -1729501168 105 T -1729501168 106 T -1729501168 108 T -1729501168 139 T -1729501168 144 T -1729501168 163 T -1729501168 170 T -1729501168 174 T -1729501168 185 T -1729501168 239 T -1729501168 244 T -1729501168 247 T -1729501168 249 T -1729501168 254 T -1729501168 306 T -1729501168 313 T -1729501168 317 T -1729501168 326 T -1729501168 332 T -1729501168 351 T -1729501168 352 T -1729501168 361 T -1729501168 364 T -1729501168 376 T -1729501168 382 T -1729501168 390 T -1729501168 393 T -1729501168 399 T -1729501168 407 T -1729501168 414 T -1729501168 425 T -1729501168 426 T -1729501168 427 T -1729501168 431 T -1729501168 438 T -1729501168 450 T -1729501168 451 T -1729501168 454 T -1729501168 455 T -1729501168 466 T -1729501168 481 T -1729501168 484 T -1729501168 485 T -1729501168 486 T -1729501168 493 T -1729501168 495 T -1729501168 503 T -1729501168 505 T -1729501168 514 T -1729501168 515 T -1729501168 522 T -1729501168 531 T -1729501168 536 T -1729501168 547 T -1729501168 549 T -1729501168 557 T -1729501168 561 T -1729501168 562 T -1729501168 567 T -1729501168 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
