Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MITKPDKNKTRQKRHRRVRNNISGTAERPRLNVFRSNKNIYAQIIDDVAGVTLASASTLDKEIS------GGTKTEAAQAVGKLVAERAAEKGIKVVVFDRGGYLYHGRVQALAEAARENGLEF 5MLC Chain:Q ((53-166)) ----------RTARHVRIRKKVEGTPERPRLCVFRSNKHLYVQVIDDTKMHTLAAASTMQKAISENIDYSAGPTVEVAQKIGEMIAKSCLEKGITKVAFDRGGYPYHGRVKALADAAREHGLVF

General information: TITO was launched using: RESULT: Template: 5MLC.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain Q - contact count / total energy / energy per contact / energy per residue : 437 -1967 -4.50 -18.21 target 2D structure prediction score : 0.75 Monomeric hydrophicity matching model chain Q : 0.85 3D Compatibility (PKB) : -4.50 2D Compatibility (Sec. Struct. Predict.) : 0.75 1D Compatibility (Hydrophobicity) : 0.85 QMean score : 0.593

(partial model without unconserved sides chains): PDB file : Tito_5MLC.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5MLC-query.scw PDB file : Tito_Scwrl_5MLC.pdb: