Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------MEESHAVREMIKIIAKWDPFKYGEEFYETEAVDVVQAVYDENDPDLLAKSIQQIFETSFEQTLPIASCREVAGQLLFIKNSSSCTP----------------------------------------------------------------------------------------------------------------------------------------------------------- 2HUO Chain:A ((32-289)) FRNYTSGPLLDRVFTTYKLMHTHQTVDFVSRKRIQYGSFSY-KKMTIMEAVGMLDDLVDESDPDVDFPNSFHAFQTA-EGIRKAHPDKDWFHLVGLLHDLGKIMALWGEPQWAVVGDTFPVGCRPQASVVFCDSTFQDNPDLQDPRYSTELGMYQPHCGLENVLMSWGHDEYLYQMMKFNKFSLPSEAFYMIRFHSFYPWHTGGDYRQLCSQQDLDMLPWVQEFNKFDLYTKCPDLPDVESLRPYYQGLIDKYCPGTLSW

General information: TITO was launched using: RESULT: Template: 2HUO.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 : 131 7069 53.96 84.15 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain A : 0.55 3D Compatibility (PKB) : 53.96 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.55 QMean score : 0.181

(partial model without unconserved sides chains): PDB file : Tito_2HUO.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2HUO-query.scw PDB file : Tito_Scwrl_2HUO.pdb: