Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRGFFVTGTDTEVGKTVISSGLAALLKEHNRDVGVYKPFLSGISRHHPDSDTSLLKDMSQTSLSHEDITPFAFKAPLAPYVAGKLEG-KTVTMEEVLSHWGRIREKHECFIVEGAGGISVPLGE-DYLVSHVIKALQLPMIIVARPHLGTINHTFLTVKYAESMGLPIAGIIINGISDSPDED-EKTNPEMIERLCGVPILGVTPKLANVTKETVLHMVKDHINLSLLMNQMGV 3FGN Chain:A ((1-201)) MTILVVTGTGTGVGKTVVCAALASAARQAGIDVAVCKPVQTGTARG--DDDLAEVGRLAG---VTQLAGLARYPQPMAPAAAAEHAGMALPARDQIVRLIADLDRPGRLTLVEGAGGLLVELAEPGVTLRDVAVDVAAAALVVVTADLGTLNHTKLTLEALAAQQVSCAGLVIGSWP-DPPGLVAASNRSALARI--AMVRAALPAGAA-------------------------

General information: TITO was launched using: RESULT: Template: 3FGN.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 : 1088 -74089 -68.10 -374.19 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -68.10 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.545

(partial model without unconserved sides chains): PDB file : Tito_3FGN.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3FGN-query.scw PDB file : Tito_Scwrl_3FGN.pdb: