Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MYSTHRSKTICSKMARAFPGYSVMFFMHKKTLVLLLSTFCASTYIHAKTDCYPSSPPVVKQLDQVYYGMNNLRIFYTTSSDNALTFQQDKNLNHIPDYVENIAIQANSIRKAWSVLGYQDPLNSPRYKNDVKYIDIQIQKLNGLGLAYDEPHRHINNPLKKNACALIILISNNIPNLTTNSSLIAHELFHLYTYGYTMFKQPWLTESLAAWSEGIIRKDKLGIYGQRNLPENEEDFEKYVLQRTYRTSQLWNRLTTLIDRSDGKLFLPLSLMQQKYTDGQPVFQDKYLKGTLFIRKFLENLGRQDQKISVLNNWNLYHWNEIDQNSAHFNEQILDTLLITLESTVERNIEKNKFKNLLKKIVKNKKTN 5K0H Chain:A ((191-218)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------TRFKDTYFVTGIVSWGEGCARKGKYGIY------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5K0H.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 : 34 -2103 -61.84 -75.09 target 2D structure prediction score : 0.46 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -61.84 2D Compatibility (Sec. Struct. Predict.) : 0.46 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.379

(partial model without unconserved sides chains): PDB file : Tito_5K0H.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5K0H-query.scw PDB file : Tito_Scwrl_5K0H.pdb: