Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MVIGLFLGFKREFSKLIGFLVIALIAVGLVFNASGVKDVLLNLFNRIVGA 2PQ4 Chain:B ((1-35)) -------------MKLSRRSFMKANAVAAAAAAAGLS--VPGVARAVVGQ

General information: TITO was launched using: RESULT: Template: 2PQ4.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 45 -7125 -158.32 -203.56 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain B : 0.60 3D Compatibility (PKB) : -158.32 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.665

(partial model without unconserved sides chains): PDB file : Tito_2PQ4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2PQ4-query.scw PDB file : Tito_Scwrl_2PQ4.pdb: