Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIVALLAGGHVLFEDIPGVGKTLLVKALAKAVQGTFSRVQCTPDLLPSDILGFSVYNSQSKEFEFRPGPIFTTILLADEINRTTPRTQSALLEAMAENHATIDNNTYPLDNHFFVLATQNPIEYEGTYPLPEAQLDRFLFRLQIGYPSFDDELLLLLDKFEKVLDNLNEVLNSYEIEEIKTNVANVFVSPEVASYALQLVSATRSHAAIQLGISPRGSLSFIQAAKAYALIHGRNYVTPKDLQDLVPYVFSHRLIFYDRSLKEDEKKQIIHTLVAQIPIPVR 5C1B Chain:C ((513-553)) ----------VLFYGPPGCGKTLLAKAIANECQANFISIK-GPELL--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5C1B.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 35 -6343 -181.21 -181.21 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain C : 0.52 3D Compatibility (PKB) : -181.21 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.52 QMean score : 0.619

(partial model without unconserved sides chains): PDB file : Tito_5C1B.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5C1B-query.scw PDB file : Tito_Scwrl_5C1B.pdb: