Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLRAISNSHGVLLPRSAIFMSVLFCLLIFQSLWNIAAAFCAHENQEKALHHFGHHAALNVYQTSSHTHVEHTETLDAAHKAPLNLQDHHDHLPTCFHVVMTEVAKQAQTPVLHVHELSQIYHWSNSYQSPHLSALKPPPVLTPL 4UXV Chain:A ((451-513)) ---------------------------------------------------------------NAHHHIQ--ETVNQLNELPLNMEEAGAHLKQAEDIV-NRASRESEELVEQVILIEKIIQFGNRFRS---------------

General information: TITO was launched using: RESULT: Template: 4UXV.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 : 66 1866 28.27 29.61 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : 28.27 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.162

(partial model without unconserved sides chains): PDB file : Tito_4UXV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4UXV-query.scw PDB file : Tito_Scwrl_4UXV.pdb: