Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -MNL-NFIVPDINMTFGDMKFMGLNRERYVYDRENNKRTDVLESRIYNIASAVQGGQIEVTIPEYAGAKEIPPFADIELKNPKISAMATSQRDSTYANVMWKLEADDIVVKGGSSVKPAAATGGNEKK 2K5D Chain:A ((1-110)) MMRLANGIVLDKDTTFGELKFSALRREVRIQN-EDGSVSDEIKERTYDLKSKGQGRMIQVSIPASVPLKEFDYNARVELINPIADTVATAT--YQGADVDWYIKADDIVLTLE---------------

General information: TITO was launched using: RESULT: Template: 2K5D.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 : 379 -20846 -55.00 -193.01 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -55.00 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.244

(partial model without unconserved sides chains): PDB file : Tito_2K5D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2K5D-query.scw PDB file : Tito_Scwrl_2K5D.pdb: