Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDELIMESLISRIKNNFPEINIKKFYAIESGWMNYIIVINDAIVFRFPKTRKMVKKFQKEIRLLSILHNP-PVKVPEYVFISKDEPVY----GGYYKINGVPLNNS------KSLGKGILSDFIRFLNYLKSYNGYKFHSNDIDIYNYKTWKYYENSLIQMFSESLADHIKESYFNNIVNLMESAFSDLEPDDF------SLIHGDLSNGNVIINRRHDRINGIIDWSDSCYGDMALDIAAIVDN---YPIAALDPLLLNYEQKFSHRAIKRVLFYRAVSPLYYAHYMARTGNNDLKNYCDQIINGRKYKIRMGAAEKMLKNK 4DT8 Chain:A ((39-261)) --------------------------------------INRDFIFKFPKHSRGSTNLFNEVNILKRIHNKLPLPIPEVVFTGMPSETYQMSFAGFTKIKGVPLTPLLLNNLPKQSQNQAAKDLARFLSELHSINISGFKSNLVLDFREKI-----NEDNKKIKKLLSRELKGPQMKKVDDF----YRDILENEIYFKYYPCLIHNDFSSDHILFDTEKNTICGIIDFGDAAISDPDNDFISLMEDDEEYGMEFVSKILNHYK----HKDIPTVL-------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4DT8.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 : 766 5790 7.56 28.52 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 7.56 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.311

(partial model without unconserved sides chains): PDB file : Tito_4DT8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4dt8-query.scw PDB file : Tito_Scwrl_4DT8.pdb: