Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFQGYSKDRREETCSYCGAIY-------IVDI-PGLPGHEEREEYFCPECSHVNFARASNSPRVSLVKARTDGKNDKSPSFQALIDSYKDE 2MS3 Chain:A ((6-43)) -------------CSVCQWIYDPAKGEPMQDVAPGTPWSEVPDNFLCPECS----------------------------------------

General information: TITO was launched using: RESULT: Template: 2MS3.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 : 50 3263 65.25 108.75 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : 65.25 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.721

(partial model without unconserved sides chains): PDB file : Tito_2MS3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2MS3-query.scw PDB file : Tito_Scwrl_2MS3.pdb: