Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQNFTYWNPTKLIFGRGEVERLPEELKPYGKN-VLLVYGGGSIKRSGLYDQVIEQLNKAGATVHELAGVEPNPRVSTVNKGVAICKEQNIDFLLAVGGGSVIDCTKAIAAGAKYDGDAWDIVTKKHQPKDALPFGTVLTLAATGSEMNSGSVITNWETKEKYGWGSPLVFPKFSILDPVNTFTVPKNHTIYGMVDMMSHVFEQYFHHVSNTPYQDRMCESLLRTVIETAPKLINDLENYELRETILYTGTIALNGMLSMG-ARGDWATHNIEHAVSAVYDIPHAGGLAILFPNWMRHTLSENPARMKQLAVRVFDVEEAGKTDEEIALEGIDKLSAFWTSLGAPNRLADYDINDEQLDTIADKAMANG-TFGQFKSLNKEDVLSILKASL 3OX4 Chain:A ((2-383)) -ASSTFYIPFVNEMGEGSLEKAIKDLNGSGFKNALIVSDAF-MNKSGVVKQVADLLKAQGINSAVYDGVMPNPTVTAVLEGLKILKDNNSDFVISLGGGSPHDCAKAIALVATNGGEVKDYEGIDKSKKPALPLMSINTTAGTASEMTRFCIITDEVRHVKMAIVDRHVTPMVSVNDPLLMVGMPKGLTAATGMDALTHAFEAYSSTAAT-PITDACALKAASMIAKNLKTACDNGKDMPAREAMAYAQFLAGMAFNNASLG----YVHAMAHQLGGYYNLPHGVCNAVLLPHVLAYNASVVAGRLKDVGVA-MGLDIANLGDKEGAEATIQAVRDLAASIGIPANLTELGAKKEDVPLLADHALKDACALTNPRQGDQKEVEELFLSAF

General information: TITO was launched using: RESULT: Template: 3OX4.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 : 2379 -36920 -15.52 -97.41 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.76 3D Compatibility (PKB) : -15.52 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.557

(partial model without unconserved sides chains): PDB file : Tito_3OX4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3OX4-query.scw PDB file : Tito_Scwrl_3OX4.pdb: