Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEQKKSTQKRNQLLAAALDVFSLYGFSGASLDEIAQLADMHKSNIFYYYENKESLYVEVLTTVLQKWLAPLQTL-EA-ELEPAEALSHYLIQKIELSRSQPKASRLFALEIIQGA-PHILPILKGPLKKLFKRKAKVIQTWQEQGKISPDIDPELLILNIWGLTQNYADFATQMEMVTGKTLRNRSMFQRSIEHTVHMMLYGVLPR 2QTQ Chain:D ((16-212)) -------GARDLLLQTASNIMREGDVVDISLSELSLRSGLNSALVKYYFGNKAGLLKALLDRDMENIVKSVDALLAKDDMSPEAKLRRHISKCIDTYYDYPYLNRLLMRLVRDSDEAEAKRIADQYLLPLHRAYNRFIGEGVKAGVFRP-INPQLFYFTVTGAADRFFSARLVLKHCFDQDTLTEQLRDSYREHTVDFIMAGILA-

General information: TITO was launched using: RESULT: Template: 2QTQ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 684 -37697 -55.11 -194.31 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain D : 0.70 3D Compatibility (PKB) : -55.11 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.449

(partial model without unconserved sides chains): PDB file : Tito_2QTQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2QTQ-query.scw PDB file : Tito_Scwrl_2QTQ.pdb: