Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------RDCRLYYCWGPGSDNRRVVGTVDKGGSLKDYVNGETITVKAGKDCKAEIIGGKVEEGYFYEGF------------------------------------------------------------------------------- 4OIF Chain:A ((2-686)) PKYERTYTTQANFILHGGDYNPDQWLDRPDILQADLELMKLSHTNTFTVGVFAWSALEPEEGVYRFEWLDKVFDDIYRIGGRVILATPSGARPAWLSQKYPEVLRVNAARVRQLHGGRHNHCFTSSVYREKTQHINRLLAERYGDHPALLMWHVSNEYGGECHCNLCQEAFREWLKKKYNHDLDALNAAWWTSFWSHTYTDWSQIESPSPIGEHTIHGLNLDWKRFVTDQTISFFENEIVPLRELTPHIPITTNFMADTHDLIPFQGLDYSKFAKHLDVISWDAYPAWHNDWESTADLAMKVGFINDLYRSLKQQPFLLMECTPSLVNWHKVNKAKRPGMHFLSSMQMIAHGSDSILYFQWRKSRGSFEKFHGAVVDHDNRTDSRVFQEVAEVGKALKKMSGIVGTNRPAEVAILYDWENNWALNDAQGFAAETKRYPQTLVQHYRPFWERDIPVDVITKEHDFSRYKLLIAPMLYLVSEETIARLKEFVANGGTLVMTYISGIVDEHDLAYLGGWHQDLREMFGMEPIETDTLYPRDRNSVHYRGRSYELKDYATVIKIHAA--------TVEGVYEDD----FYADTPAVTSNQYGKGQAYYIGGRLEDQFHRDFYQELMEKLDLRPVLFVKHEKGVSVQARQAPECDYVFIMNFTEEKQAVVLEEKVKDLFTGEEIVGEIMLDKYEVRVVEKRR

General information: TITO was launched using: RESULT: Template: 4OIF.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 77 5246 68.12 102.85 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : 68.12 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.161

(partial model without unconserved sides chains): PDB file : Tito_4OIF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4oif-query.scw PDB file : Tito_Scwrl_4OIF.pdb: