Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAVKKVVTHPAEVLETPAETVTVFDKKLKKLLDDMYDTMLEMDGVGLAAPQIGILKRAAVVEI-GDDRGRIDLVNPEILEKSGEQTGIE-GCLSFPNVYGDVTRADYVKVRAFNRQGKPFILEARGFLARAVQHEMDHLDGVLFTSKISKYYTEDELADMEG 4WXL Chain:B ((5-148)) ----NVLIYPDDHLKVVCEPVTEVNDAIRKIVDDMFDTMYQEKGIGLAAPQVDILQRIITIDVEGDKQNQFVLINPEILASEGE-TGIEEGCLSIPGFRALVPRKEKVTVRALDRDGKEFTLDADGLLAICIQHEIDHLNGILFVDYLS-------------

General information: TITO was launched using: RESULT: Template: 4WXL.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 703 -78141 -111.15 -550.29 target 2D structure prediction score : 0.57 Monomeric hydrophicity matching model chain B : 0.83 3D Compatibility (PKB) : -111.15 2D Compatibility (Sec. Struct. Predict.) : 0.57 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.521

(partial model without unconserved sides chains): PDB file : Tito_4WXL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WXL-query.scw PDB file : Tito_Scwrl_4WXL.pdb: