Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKKLFSQLWIYFASIVFISILVTLLCFLGFIFLLSRHSISPAESAGKPTLYPLFVFAGFSMVVGTGISIFVGRRILHPISALGTNMSLVATGDFSIRMDEQQKVAEVQQLYKDFHVMVQELNSIETLRNDFVSSVSHEFKTPLATIQGYVQLL--QAPNLSDEERQIFLYRIIESITQLSQLTENILKLNKLENQRIQLEKKEYRLDEQIREVIVFFQPKWEKEQL----ELDIELAAVNYTGNEEFLYQVWLNIMDNAIKYNQINGQ---IHIKLFETATEIVLEVTDSGVGMNEETRDRMFEKFYQGDTS--RQISGNGLVTFTG 3DGE Chain:A ((14-213)) --------------------------------------------------------------------------------------------------------------------------KRIDRMKTEFIANISHELRTPLTAIKAYAETIYNSLGELDLSTLKEFLEVIIDQSNHLENLLNELLDFSRLERKSLQINREKVDLCDLVESAVNAIKEFASSHNVNVLFESNVPCPVEAYI-DPTRIRQVLLNLLNNGVKYSKKDAPDKYVKVILDEKDGGVLIIVEDNGIGIPDHAKDRIFEQFYRVDSSLTYEVPGTGL-----

General information: TITO was launched using: RESULT: Template: 3DGE.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 : 548 22107 40.34 116.97 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 40.34 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.414

(partial model without unconserved sides chains): PDB file : Tito_3DGE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3DGE-query.scw PDB file : Tito_Scwrl_3DGE.pdb: