Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVNKDVTKVCIGKIEELPEQLGKTVYIEDKELAVFKLSDGSIRAIENRCPHKGGVLAEGIV--SGQYVFCPMHDWKISLEDGIVQE-P--------DHGCVKTYETLIEGEHVYLVY 3GKQ Chain:A ((29-140)) ----RNHWYPVRLSAEVAEASPVPVQLLGEKVLLNR-VDGVVHAIADRCLHRGVTLSDKVECYSKATISCWYHGWTYRWDNGKLVDILTNPTSVQIGRHALKTYPVREEKGLVFLFV

General information: TITO was launched using: RESULT: Template: 3GKQ.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 : 480 -68927 -143.60 -682.45 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -143.60 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.554

(partial model without unconserved sides chains): PDB file : Tito_3GKQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3GKQ-query.scw PDB file : Tito_Scwrl_3GKQ.pdb: