Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------MKKRRKICYCNTALL------LMILLAGCTDSKDGEAQQPSNQASAVQTDEKHTEPEESTKIRKDEAEPITESEESATKAANDTSSAEEKSKEDNVLAAYSSEKIEYARVWLQLGPNQEID-ELNVRHIAAGEPINPNDDTSASYPEN---VTQLAGSRLVDGSVTYHGNGDGTIHVYNVPLRWDSADDIEKGVMREVTESIIKNRKTVYVDTGDDEKIKRLIDIMMIH- 3CP7 Chain:A ((3-218)) PADSPHIGKVFFSTNQGDFVCSANIVASANQSTVATAGHCLHDGNG--GQFARNFVFAPAYDYGESEHGVWAAEELVT--------------SAEWANRGDFEHDYAFAVLETKGGTTVQQQVGTASPIAFNQPRGQYYSAYGYPAAAPFNGQELHSCHGTATNDPMGSSTQGIPCNMTGGSSGGPWFLGNGTGGA-----QNSTNSYGYTFLPNVMFGPYFG----SGAQQNYNYASTTN

General information: TITO was launched using: RESULT: Template: 3CP7.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 : 1081 -35783 -33.10 -184.45 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -33.10 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.170

(partial model without unconserved sides chains): PDB file : Tito_3CP7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3CP7-query.scw PDB file : Tito_Scwrl_3CP7.pdb: