Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAAKRTDELIPLCHPLPIYRADVEYELEHDFVKIIAAVETIGPTGVEMEALTAASLAGLTIYDMLKPHCEPEELWMDQCKLLKKKGGKSHFKRVLRQPVSAAVIVLSDTVAAGRKPDTAGKSVVETLTEAGFDPIHYQILPDEADDLKELVLELT--KSYACIMTVGGTGIGKRDITVDTLEPLLERKLDGLMEAARSFGQKRTPYAAMSRGVAGFIDRSLVVALPGSRGGASESMAAILPALVHIFDVCRDLPHPGGYE 3MCH Chain:B ((1-162)) -------------------------------------------------------------------------------------------------MFRVGILTVSDKGFRGERQDTTHLAIREVLAGGPFEVAAYELVPDEPPMIKKVLRLWADREGLDLILTNGGTGLAPRDRTPEATRELLDREVPGLAELMRLVGLRKTPMAALSRGVAGVRGRTLILNLPGSPKGARESLEAVLPVLPHALSLVTGKPWKEGH-

General information: TITO was launched using: RESULT: Template: 3MCH.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 : 862 -29888 -34.67 -186.80 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -34.67 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.522

(partial model without unconserved sides chains): PDB file : Tito_3MCH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MCH-query.scw PDB file : Tito_Scwrl_3MCH.pdb: