Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYPGINETQLEL-IFSRYG-KDCKIEPLQEEASTRR-YFRITSVNGKEEVVCADET-VNEDFIVISEFLNANGIR-VPRIHDTNQ--------NLGLTFMSFEGLKDFSTYNLNDYKNKFPILIDLILKLQSLD-PPSLVK---TRKFDTEKLSFETNLTLDKFEA-----F-RKQFQIKTDI---TNEA-KAFIEETVGYLN-KYPINVFTHRDFHCRNILIAPNTDYALIDFQDARMGVPQYDLASILYDAYYPLP-RDFRSLMLKSFRERNVDQTKKFNDTFYLQALQRSFKALGTYFRMVTDHKKDKFKTSIISCLNQLEEIIQLGMFADSLYIFVRSLREELSRHKEFKNL 3I1A Chain:B ((5-293)) ---PIQAQQLIELLKVHYGIDIHTAQFIQGGADTNAFAYQADSE-SKSYFIKLKYGYHDEINLSIIRLLHDSGIKEIIFPIHTLEAKLFQQLKHFKIIAYPFIHAPNGFTQNL--TGKQWKQLGKVLRQIHETSVPISIQQQLRKEIYSP-KWREIVRSFYNQIEFDNSDDKLTAAFKSFFNQNSAAIHRLVDTSEKLSKKIQPDLDKYVLCHSDIHAGNVLVGNEESIYIIDWDEPMLAPKERDLMFIGGGVGNVWNKPHEIQYFYEGYGEINV-D-K---TILSYYRHERIVEDIAVYG-------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3I1A.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1018 1252 1.23 4.81 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.65 3D Compatibility (PKB) : 1.23 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.394

(partial model without unconserved sides chains): PDB file : Tito_3I1A.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3i1a-query.scw PDB file : Tito_Scwrl_3I1A.pdb: