Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRYRAVFPMLIIVFALSGCTLSTINPMKKSRIDNIHHTQILFFSDENQIDQEAPYYDALLDLEKDYPEQIDKMKVYDKKEG------WEDEI-ETVPTLMVVDQRHVVVKIEGCVKKKEDIIKPLQHVLSK 3AOF Chain:A ((93-167)) ---------------------------------NIHHYEELMNDPEEHKERFLALWKQIADRYKDYPETL-FFEILNAPHGNLTPEKWNELLEEALKVIRSIDKKHTII----------------------

General information: TITO was launched using: RESULT: Template: 3AOF.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 : 204 -21848 -107.10 -321.29 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -107.10 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.252

(partial model without unconserved sides chains): PDB file : Tito_3AOF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3AOF-query.scw PDB file : Tito_Scwrl_3AOF.pdb: