Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKRIARIAVATYMGLAVNMGLAVNAVQAATTFLNVSYDPTREFYQEYNQAFGKFWKQRTGQDVDFKQSHGGSGKQARAVA---TGLEADVVTLALANDIDEIVKAGFIQPN----WQ---KEF--------PNNSAPYTSTVVFLVRKGNPK------NIRDWNDLTKPGV--EIITPNPKTGGAPRWIYLSAWGYALKQPGGNDAKAKELVKKLYHNVNVLDLGARGSLTTFAERGIGDVLLSWENEALLATKGLDKDKYEIVYPSIS-ILAEPSVAIVDKTVDKDGNRTLAKGYLNFLYSPLGQELAAK-HYF--RPRNPQVAA-KYAAQFPKIKLF-----TI--NDVFGGWAKAQKTHFANGAIFDQIYDGKQ 4R75 Chain:A ((3-319)) ----------------------------KGRLVIYCSATN-VMCENAAKTFEQK----YDVKTSFIRN--GSGSTFAKIEAEKNNPQADVWYGGTLDPQSQAGELGLLEAYRSPNIDQIMPKFQDPAKVKGNLSSAVYIGILGFAVNTERLKKLGIEKIPQCWNDLTDPKLKGEIQIADPQSSGTAY-TAI---ATFAQLWG--EDKAFDYFKHLHPNISQYTKSGI-TPARNAARGETTVGIGFLHDYALEKEQ-G-APLEMVVPCEGTGYELGGVSILKGA----RNLDNAKLFVDFALSKEGQETAWKKGQALQTLTNTTAEQSPLAFDLTKLKLIDYDFEKYGASDERKRLINKWVDEIKL------------

General information: TITO was launched using: RESULT: Template: 4R75.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 : 1706 41061 24.07 147.17 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 24.07 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.509

(partial model without unconserved sides chains): PDB file : Tito_4R75.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R75-query.scw PDB file : Tito_Scwrl_4R75.pdb: