Friday, September 20 2024 12:29:38
UNRES
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CTEST_FULL_OUTPUT STOP ********** Program terminated normally. STOP ********** Program terminated normally. T 76189808 1 T 76189808 4 T 76189808 9 T 76189808 12 T 76189808 15 T 76189808 26 T 76189808 33 T 76189808 37 T 76189808 38 T 76189808 50 T 76189808 53 T 76189808 2 T 76189808 7 T 76189808 11 T 76189808 14 T 76189808 19 T 76189808 24 T 76189808 25 T 76189808 28 T 76189808 42 T 76189808 43 T 76189808 45 T 76189808 47 T 76189808 3 T 76189808 5 T 76189808 13 T 76189808 16 T 76189808 35 T 76189808 48 T 76189808 6 T 76189808 10 T 76189808 17 T 76189808 20 T 76189808 21 T 76189808 22 T 76189808 23 T 76189808 29 T 76189808 30 T 76189808 32 T 76189808 34 T 76189808 39 T 76189808 40 T 76189808 41 T 76189808 44 T 76189808 46 T 76189808 51 T 76189808 52 T 76189808 8 T 76189808 18 T 76189808 27 T 76189808 31 T 76189808 36 T 76189808 49 THERE ARE 5 FAMILIES OF CONFORMATIONS 1L2Y_wham_T280K_0001.pdb:REMARK CLUSTER 1 FREE ENERGY 4.88719E+00 AVE RMSD 3.28 1L2Y_wham_T280K_0001.pdb:REMARK 1L2Y clustering ENERGY 5.00998E+00 RMS 3.22 1L2Y_wham_T280K_0002.pdb:REMARK CLUSTER 2 FREE ENERGY 5.51604E+00 AVE RMSD 3.73 1L2Y_wham_T280K_0002.pdb:REMARK 1L2Y clustering ENERGY 5.86048E+00 RMS 3.93 1L2Y_wham_T280K_0003.pdb:REMARK CLUSTER 3 FREE ENERGY 5.59557E+00 AVE RMSD 4.73 1L2Y_wham_T280K_0003.pdb:REMARK 1L2Y clustering ENERGY 5.95984E+00 RMS 4.54 1L2Y_wham_T280K_0004.pdb:REMARK CLUSTER 4 FREE ENERGY 5.79408E+00 AVE RMSD 2.24 1L2Y_wham_T280K_0004.pdb:REMARK 1L2Y clustering ENERGY 6.38056E+00 RMS 2.19 1L2Y_wham_T280K_0005.pdb:REMARK CLUSTER 5 FREE ENERGY 6.35101E+00 AVE RMSD 4.09 1L2Y_wham_T280K_0005.pdb:REMARK 1L2Y clustering ENERGY 6.63064E+00 RMS 3.96
