MODELLER 9.16, 2016/01/07, r10745 PROTEIN STRUCTURE MODELLING BY SATISFACTION OF SPATIAL RESTRAINTS Copyright(c) 1989-2016 Andrej Sali All Rights Reserved Written by A. Sali with help from B. Webb, M.S. Madhusudhan, M-Y. Shen, G.Q. Dong, M.A. Marti-Renom, N. Eswar, F. Alber, M. Topf, B. Oliva, A. Fiser, R. Sanchez, B. Yerkovich, A. Badretdinov, F. Melo, J.P. Overington, E. Feyfant University of California, San Francisco, USA Rockefeller University, New York, USA Harvard University, Cambridge, USA Imperial Cancer Research Fund, London, UK Birkbeck College, University of London, London, UK Kind, OS, HostName, Kernel, Processor: 4, Linux sunflower.rnet.missouri.edu 2.6.32-431.23.3.el6.x86_64 x86_64 Date and time of compilation : 2016/01/07 10:19:44 MODELLER executable type : i386-intel8 Job starting time (YY/MM/DD HH:MM:SS): 2016/04/05 22:41:58 openf___224_> Open ../atom_files/pdb2abx.ent read_mo_297_> Segments, residues, atoms: 2 148 1102 read_mo_298_> Segment: 1 1 A 74 A 551 read_mo_298_> Segment: 2 1 B 74 B 551 iupac_m_486_> OE1/2 will be swapped: 102.5323 20 20 iupac_m_487_> NH1/2 swapped: 178.9432 36 36 iupac_m_486_> OE1/2 will be swapped: -115.4210 41 41 iupac_m_483_> CD1/2 CE1/2 swapped: 135.8601 54 54 iupac_m_397W> Atoms were not swapped because of the uncertainty of how to handle the H atom. iupac_m_486_> OE1/2 will be swapped: -108.0131 55 55 iupac_m_486_> OE1/2 will be swapped: 157.8800 56 56 iupac_m_487_> NH1/2 swapped: 162.9831 71 71 iupac_m_483_> CD1/2 CE1/2 swapped: 100.3794 98 24 iupac_m_397W> Atoms were not swapped because of the uncertainty of how to handle the H atom. iupac_m_486_> OE1/2 will be swapped: -164.8790 115 41 iupac_m_486_> OE1/2 will be swapped: -151.8740 129 55 iupac_m_486_> OE1/2 will be swapped: -109.6280 130 56 iupac_m_485_> OD1/2 will be swapped: 118.0614 137 63 openf___224_> Open 2abx.iup wrpdb___568_> Residues, atoms, selected atoms: 148 1102 1102 Starting time : 2016/04/05 22:41:58 Closing time : 2016/04/05 22:41:58 Total CPU time [seconds] : 0.19