Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDDLPHSSWIPTGQGSSSMNTMTKNKLFG---LADDRTDVWATP-QDFFEKLDRVFKFDLDVCALPDNAKCERFFTP-EIDGLKQEWTGTCWMNPPYGKEIIDWVAK-AADTASKGHTVVALV-PVRTDARWFQDYCL---GREIHFIRGRLKFGGSKTNAPF-GCCVVV-FRPS-----LVDVNWEKSA---- 2DG5 Chain:B ((1-190)) ---TTHYSVV-DKDGNAVAVTYTLNTTFGTGIVAGESGILLNNQMDDFSAKPGVPNVYGLVGGDANAVGPNKRPLSSMSPTIVVKDGKTWLVTGSPGGSRIITTVLQMVVNSIDYGLNVAEATNAPRFHHQWLPDELRVEKGFSPDTLKLLEAKGQKVALKEAMGSTQSIMVGPDGELYGASDPRSVDDLTAGY

General information: TITO was launched using: RESULT: Template: 2DG5.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 : 701 28955 41.31 171.33 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain B : 0.62 3D Compatibility (PKB) : 41.31 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.078

(partial model without unconserved sides chains): PDB file : Tito_2DG5.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2DG5-query.scw PDB file : Tito_Scwrl_2DG5.pdb: