Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKQTRALMEGAILISLFAIITLLVVYVPVIGTILLFALPLPMILYTIRHGLKLGIWMGAVSLPVVFIVGSFNGLIVAFMSACAGIAMGHFFKRKEPGHAIISGALIYMLSIVFYFVISIQFLGINIIDEAMTQYRQSLDIVETVAKQSGNAGQFEKQLKLMEEQLGIVQYLFPTAIVMVGVIFSFLSYLIAKPLLRRFSPDIPNLKPFRELKFPQSVVVLYLIIVMLSFLPLEKGQMLYSIALNGEFILGFLIFIQGLSFIFFYCHKKQYPKAAAVIAVILGFVHPVFMAAIRILGVLDMGFHIRNKVK 1KIL Chain:E ((9-49)) ----------------------------------------------------------------------------------------------------------------------------KKEEERQEALRQAEE--ERKAKYAKMEAEREVMRQGIRDKYGI----------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1KIL.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 7 -568 -81.14 -13.85 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain E : 0.35 3D Compatibility (PKB) : -81.14 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.35 QMean score : 0.682

(partial model without unconserved sides chains): PDB file : Tito_1KIL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1KIL-query.scw PDB file : Tito_Scwrl_1KIL.pdb: