Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MCNKASSDLTDYVIRQLGRTKNKRYEAYVVSRIIHLLNDFTLKFVTQQFVRLS--NKKIALTDLYFPQLGIHIEVDEGHHFLRNSKMEYSLNQIDEPLYSISQTESDAMREEDIISITGHKIFRVNVFKNQEGQPQNLENIHQQIDKIIEEIKTAKNKLIEASTFKEWNIETEYNPQTYIDLGRISLADNVVLKTTKDVCNCFGYSYKN-YQRGGALH--------PYKKDTLIWFPRLYENKDWINTISPDGLTITEKSTDETITLKKLEEWKNGPQKRIVFARVKDNLSSRAMYRFMGLYEFQK-ADLKDGAVWKRVKCEVQTYSPKETKC 4OQ2 Chain:A ((8-300)) ---HEFMSKTDYILRALSKISHKRWEHYIINRVVHTLDDPDIEFVCQQCIRKEGHLGKIYLADLLFPQLNLYLEIDEAHHDSNDA------------------RKADAVRRLDIVEATGFQEERIPASN------ITLSEVNKLVDEFVRLVKDKKEELENQGLFFRWDYDERYSAKKHINTGYMAVGPNSVFRYHRDALQCFGYRREGHHQSGGWALPAEVAQSIGLTGRVMVWFPRLYEAGEWKNALSADGNKITEQSLNATR------NYQETWDYRIVMAHSRDELN-RTLYRFLGVFAIDVDKSSDEVKVFSRVYSRVNVYR------

General information: TITO was launched using: RESULT: Template: 4OQ2.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 : 1254 32366 25.81 115.18 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.77 3D Compatibility (PKB) : 25.81 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.359

(partial model without unconserved sides chains): PDB file : Tito_4OQ2.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4OQ2-query.scw PDB file : Tito_Scwrl_4OQ2.pdb: