Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------MQATVHESKQSIMQRILTVFVFTLLIATVGLFIGQFVPVALMLPLSILEVAMIILAFWMRRRKAV--------GYAFVYTFAFVSGITLFPIVSHYASI-----AGAYVVLEAFGSTFVIFAVLGTIGAKMKKDLSFLWSFLLVAVLALAVVGIFNIFSPL--------NSAAMMAYSVIGTIVFSLYILYDLNQIKHRHITEDLIPVMALSLYLDFINLFINLLRFFGILSSDD 4HYF Chain:A ((14-240)) GTENLYFQSMLNTSGSGTILIDLSPDDKEFQSVEEEMQSTVREHRDGGHAGGIFNRYNILKIQKVCNKKLWERYTHRRKEVSEENHNHANERMLFHGSPFVNAIIHKGFDERHAYIGGMFGAGIYFAENSSKSNQYVYGIGGGTGCPVHKDRS-CYICHRQLLFCRVTLGKSFLQFSAMKMAHSPPGHHSVTGRPSVNGLALAEYVIYRGEQ------------------------AYPEYLITYQIMRPEG

General information: TITO was launched using: RESULT: Template: 4HYF.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 : 932 -146266 -156.94 -773.89 target 2D structure prediction score : 0.19 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -156.94 2D Compatibility (Sec. Struct. Predict.) : 0.19 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.147

(partial model without unconserved sides chains): PDB file : Tito_4HYF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HYF-query.scw PDB file : Tito_Scwrl_4HYF.pdb: