Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKQTRALMEGAILISLFAIITLLV--VYVPVIGTILLFALPLPMILYTIRHGLKLGIWMGAVSLPVVFI---V-GS-F-N------GLIVAFMSACAGIAMGHFFKRKEPGHAIISGALIYMLSIVFYFVISIQFLGINIIDEAMTQYRQSLDIVETVAKQSGNAGQFEKQLKLMEEQLGIVQYLFPTAIVMVGVIFSFLSYLIAKPLLRRFSPDIPNLKPFRELKFPQSVVVLYLIIVMLSFLPLEKGQMLYSIALNGEFILGFLIFIQGLSFIFFYCHKKQYPKAAAVIAVILGFVHPVFMAAIRILGVLDMGFHIRNKVK 4RFS Chain:S ((4-121)) -HKTFRLVVDALLMAIVLLQNLVPFLGYIPFGP-FSMTLIGLTVIVAGSALGPRDGLLIGGFWGLITFVRAFTWPSSPVAPLIFTNPLISILPRLLMGLVAGSLYLWGR----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4RFS.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain S - contact count / total energy / energy per contact / energy per residue : 289 -59529 -205.98 -640.10 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain S : 0.47 3D Compatibility (PKB) : -205.98 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.47 QMean score : 0.234

(partial model without unconserved sides chains): PDB file : Tito_4RFS.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RFS-query.scw PDB file : Tito_Scwrl_4RFS.pdb: