Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNLLKVCTLLPCSLVIAACSVNSSSTPPTLSSSTPQVQKSSIEISCQDLQNPAYRQAVLNAINQIRQDSRQCGQ---------QYF---SAAKPLSWNNNLYQGANAHSKDMANNNFLGHVGSTGLDLRARLKKYHMLSKANGENVASG--------QKTLNEVLAKWIA-----------------SPLHCSNIMNPRYTEYAIACASDQSAK-QRSYWTQQFAGF 4G2U Chain:A ((14-172)) -------------------------------------------------QTDEARKIFLDFHNQVRRDIAGASPLLNLAVQMRNVLGPAKNMYRMDWDCNLEAKAKAMIWPCTTPLPI--DT------------------SIPQNLAQWLLFQNSQENEVLTQTPWSWVTASLRNLQPDTEANIYNWQIRPLSNIANWQNLKVGCAHKVCKFPTGTNMVVSCAYGG-

General information: TITO was launched using: RESULT: Template: 4G2U.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 : 292 3133 10.73 26.32 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 10.73 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.258

(partial model without unconserved sides chains): PDB file : Tito_4G2U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4G2U-query.scw PDB file : Tito_Scwrl_4G2U.pdb: