Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLDSKQCEAFLAVAEVGSFDAAGEYLCITPSAVSLRVQALEKYLGQILIIRG-RPCVLTQAGQTLLQHLRHTRLMEQNLLQGLMGKSSDSEFYKIALASNADSLATWLLPSIQQTLFKEKIVLELKIDDQSHTHTLLETGQVNACITAEEQVMAGCLAQPLGKMRYKMLASAEFVNRWFSGGINREVLRKTPAVIFNHKDLMHSEVLLKGYGLPMQSYPYSFIPATDAFVKAIQLGLGYGMVPELQVQPLLENETLVDIMPEAQLDVPLYWHHWKRQSKQLDVLTETIVESAKQILR 4IHS Chain:A ((9-67)) ---------FVAVVEEQSFTKAADKLCIAQPPLSRQIQNLEEELGIQLLERGSRPVKTTPEGHFFYQY-------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4IHS.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 : 179 -26722 -149.28 -460.72 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -149.28 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.415

(partial model without unconserved sides chains): PDB file : Tito_4IHS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IHS-query.scw PDB file : Tito_Scwrl_4IHS.pdb: