Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------------------MFKDLYLFMKDIYQNRKLLLQFSINDFKSRYAGSFLGILWAFINPLFTVLIYWLVFGVGLKAQMIDAKYPFIVYLVTGMIPWFFFSDAFASTTVVFREYTYLVKKVVFNIRILPTTKILSNLYTHLFFILIGIAVALINGIYPSAMSLQLIYYLFCMCAFLTGLTWLTASIQPFLPDIMQLITIVLQLIMWTLPILWSPNQFDSGLVSILKLNPLYYVVQGYRESFLSEAWFWEHGTYTLYFWVFTLVMFVIGSAVFRRLKPHFSDVL 5LJ5 Chain:O ((12-590)) VWTNVEDQILKAAVQKYGTHQWSKVASLLQKKTARQSELRWNEYLNPKLNFTEFSKEEDAQLLDLARELPNQWRTIADMMARPAQVCVERYNRLLEDEEKEMLAEARARLLNTQGKKATRKIRERMLEESKRIAELQKRRELKQAGINVAIKKPKKKYGTDIDYNEDIVYEQAPMPGIYDTSTEDRQIKKKFEQFERKTEVLLESIQSKVESIEQLQRKLQHVQPLEQQNNEMCSTLCHHSLPALIEGQRKYYAD------------YYAYRQEIRSLEGRRKRLQAMLNSSSSI

General information: TITO was launched using: RESULT: Template: 5LJ5.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain O - contact count / total energy / energy per contact / energy per residue : 431 -265 -0.61 -1.03 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain O : 0.56 3D Compatibility (PKB) : -0.61 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.56 QMean score : -0.026

(partial model without unconserved sides chains): PDB file : Tito_5LJ5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5LJ5-query.scw PDB file : Tito_Scwrl_5LJ5.pdb: