Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDRNIDQELVSIIIPTHNRYESLIRAVKSCLHQSYKNIEVIIIDDNYSNVNLRNKIIHQ--FGYTN-HRIKLILSNEDLGATNARNIGIKNSRGKYISFLDDDDEYMPDRILKLMACFKKSRMKNLALVYSYGIIIYPNGTREEEKTD---FVGNP-----LFVQ--------M-VHNIAGTSFWLCKKEVLELIN-GFEK--IDSHQDGVVLLKLLAQGYQIDIVREFLVNYYAHSKENGITGVTQKTINADEEYYNYCRKYFNLLSFNERILVTKKYYSLNIKRLLLIGDKCKALKVIKKAREEKIFNEFLFLKYMLLYNFSFFYCIYDNYVQLKFRK 3BCV Chain:A ((3-218)) -----LIPKVSVIVPIYNVEKYLDQCVQALLAQTLSDIEIILIDDESPDN-----CPKICDDYAAQYPNIKVIH-KKNAGLGMACNSGLDVATGEYVAFCDSDDYVDSDMYMTMYNVAQKY---TCDAVFT-----------------FKLYKNKNEIHTLLKDLIASDPYAREERAIQVSAKVVLYRRNLIEKKHLRFVSERILPSEDLIFNVDVLANSNIVCVLP-----------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3BCV.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 : 780 -48086 -61.65 -277.95 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -61.65 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.397

(partial model without unconserved sides chains): PDB file : Tito_3BCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BCV-query.scw PDB file : Tito_Scwrl_3BCV.pdb: