Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDNKYHLVGQIDLENLNKIIIPVTKNVFNSRISEIKRFPTGSCHFVYDAVLESWENLVFRIGYSDSNKAKIGWSVFWHGKLKELG---IKIPALLYHDVSCIEYGKPFTVSERIRWDDIWNAIDSLTDENLDLIA-KEIAGIQNRISTLEPWRWFWEMTSYDDANLKGKWREFVLEKFEK-AKMAL-SEG---GIFDDSYIERVREALDRNSWYLENVKGTMFFDDITSKN--------------IIVDNSEFSWVVDFDTMTCWDRLYWL------GLCNMAFIYLEREIY-ISYLIRYLGCSEDDISA-MNL-YTLLFCLDFMSEIGQKFNKEEAIIDYIKAERYKSIFERICNNIK 2Q83 Chain:A ((11-346)) LSAEDAKKLTELAENVLQG--------WDVQAEKIDVIQ----ALVWKVHTDSGAVCLKRIHRP---EKKALFSIFAQDYLAKKGMNVPGILPNKKGSLYSKHGSFLFVVYDWIEGRPF-----ELTVKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKL------GRWPNHYTKRCKQMETWKLMAEAEKEDPFSQLYLQEIDGFIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGENEQIWVIDLDTVSFDLPIRDLRKMIIPLLDTTGVWDDETFNVMLNAYESRAPLTEEQKQVMFIDMLFPYELYDVIREKYVRKSALPKEELESAFEYERIKANALRQLI-

General information: TITO was launched using: RESULT: Template: 2Q83.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 : 1256 -34850 -27.75 -116.17 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -27.75 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.225

(partial model without unconserved sides chains): PDB file : Tito_2Q83.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2q83-query.scw PDB file : Tito_Scwrl_2Q83.pdb: