Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKISLLGSGRVAFHLAKALLAQGHHIAQVYARDFEKTKKFAEQI----------Q------------A--KACQS-LQEFQPTDLIILAVSDSA--ITELATQVHELF-PKMLMVHTSGSTDIQVISQVH---EKAGVFYPLQTFSLERDVDWKATPLFVEAT--NKDDLVILSDLANSLSKRVYQYTSKQRLTLHLAAVFACNFSNYCFDMAKQVVDAEQVDFGLLYPLILETAKKATENDPKQMQTGPAMRGDQNILVMHQSLLAQANRDDLKQVYQLLSDGIVKRHHSS 3F3S Chain:A ((4-225)) GCVVIVGSGVIGRSWAMLFASGGFQVK-LYDIEQQQIRNALENIRKEMKLLEQAGSLKGSLSVEEQLSLISGCPNIQEAVEGAMHIQECVPEDLELKKKIFAQLDSIIDDRVILSSSTSCLMPSKLFAGLVHVKQCIVAHPVNPPYY------IPLVELVPHPETAPTTVDRTHALMKKIGQCPMRVQKEVAGF------VLNRLQYAIISEAWRLVEEGIVSPSDLDLVMSEGL---------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3F3S.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 994 -48355 -48.65 -255.84 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -48.65 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.453

(partial model without unconserved sides chains): PDB file : Tito_3F3S.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3F3S-query.scw PDB file : Tito_Scwrl_3F3S.pdb: