Sunday, September 22 2024 15:20:12
UNRES
1.61s
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CTEST_FULL_OUTPUT JESTEM T -664946736 1 T -664946736 5 T -664946736 8 T -664946736 10 T -664946736 11 T -664946736 12 T -664946736 15 T -664946736 16 T -664946736 19 T -664946736 20 T -664946736 22 T -664946736 23 T -664946736 24 T -664946736 26 T -664946736 27 T -664946736 28 T -664946736 30 T -664946736 34 T -664946736 35 T -664946736 36 T -664946736 39 T -664946736 41 T -664946736 44 T -664946736 45 T -664946736 52 T -664946736 60 T -664946736 62 T -664946736 68 T -664946736 73 T -664946736 74 T -664946736 75 T -664946736 76 T -664946736 77 T -664946736 83 T -664946736 87 T -664946736 91 T -664946736 97 T -664946736 98 T -664946736 104 T -664946736 110 T -664946736 111 T -664946736 113 T -664946736 114 T -664946736 115 T -664946736 117 T -664946736 121 T -664946736 124 T -664946736 128 T -664946736 129 T -664946736 134 T -664946736 137 T -664946736 138 T -664946736 141 T -664946736 146 T -664946736 147 T -664946736 151 T -664946736 155 T -664946736 161 T -664946736 164 T -664946736 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STOP ********** Program terminated normally. T -664946736 342 T -664946736 348 T -664946736 354 T -664946736 360 T -664946736 365 T -664946736 367 T -664946736 372 T -664946736 381 T -664946736 383 T -664946736 384 T -664946736 392 T -664946736 396 T -664946736 397 T -664946736 401 T -664946736 408 T -664946736 411 T -664946736 417 T -664946736 418 T -664946736 421 T -664946736 422 T -664946736 430 T -664946736 435 T -664946736 458 T -664946736 465 T -664946736 468 T -664946736 470 T -664946736 472 T -664946736 474 T -664946736 480 T -664946736 482 T -664946736 483 T -664946736 488 T -664946736 490 T -664946736 491 T -664946736 494 T -664946736 496 T -664946736 501 T -664946736 502 T -664946736 504 T -664946736 508 T -664946736 516 T -664946736 518 T -664946736 520 T -664946736 525 T -664946736 527 T -664946736 529 T -664946736 532 T -664946736 535 T -664946736 543 T -664946736 555 T -664946736 565 T -664946736 569 T -664946736 570 T -664946736 25 T -664946736 32 T -664946736 42 T -664946736 46 T -664946736 63 T -664946736 80 T -664946736 88 T -664946736 103 T -664946736 105 T -664946736 106 T -664946736 108 T -664946736 139 T -664946736 144 T -664946736 163 T -664946736 170 T -664946736 174 T -664946736 185 T -664946736 239 T -664946736 244 T -664946736 247 T -664946736 249 T -664946736 254 T -664946736 306 T -664946736 313 T -664946736 317 T -664946736 326 T -664946736 332 T -664946736 351 T -664946736 352 T -664946736 361 T -664946736 364 T -664946736 376 T -664946736 382 T -664946736 390 T -664946736 393 T -664946736 399 T -664946736 407 T -664946736 414 T -664946736 425 T -664946736 426 T -664946736 427 T -664946736 431 T -664946736 438 T -664946736 450 T -664946736 451 T -664946736 454 T -664946736 455 T -664946736 466 T -664946736 481 T -664946736 484 T -664946736 485 T -664946736 486 T -664946736 493 T -664946736 495 T -664946736 503 T -664946736 505 T -664946736 514 T -664946736 515 T -664946736 522 T -664946736 531 T -664946736 536 T -664946736 547 T -664946736 549 T -664946736 557 T -664946736 561 T -664946736 562 T -664946736 567 T -664946736 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
