Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTAQSSFLQLNSIFISILIEAIPFILIGVILSGIIQMFVSEEMIARIMPKNRFLAVLFGALAGVLFPACECGIIPITRRLLLKGVPLHAGVAFMLTAPIINPIVLFSTYIAFGNRWSVVFYRGGLALAVSLIIGVILSYQFKDNQLLKPDEPGHHHHHHGTLLQKLGGTLRHAIDEFFSVGKYLIIGAFIAAAMQTYVKTSTLLAIGQNDVSSSLVMMGLAFVLSLCSEVDAFIASSFSSTFSLGSLIAFLVFGAMVDIKNLLMMLAAFKKRFVFLLITYIVVIVLAGSLLVKG 3MP7 Chain:B ((26-51)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------WATYKRAAKITGLGIILIGLIGMLI------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3MP7.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 : 5 -573 -114.60 -22.92 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain B : 0.39 3D Compatibility (PKB) : -114.60 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.39 QMean score : 0.254

(partial model without unconserved sides chains): PDB file : Tito_3MP7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MP7-query.scw PDB file : Tito_Scwrl_3MP7.pdb: