Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIESQAPMLEMLWEPHDPRHALAERFGFSDSESASRWVAAMLDEHWGIRIDSCERILMSGGNALAWVGTPSGRLLAKWSVVLDCFPRLMETARLTNWLHGRGLPVSVPVPTRDGCLQVEVDRVSMGLQREIVGDLLDTGDLNQVRAAGVILAQLQDALAAYPDADQ-F-L--APVVSS---KPLTVRVTDWLDS------RA------DHLPMAARDTLRGLVASA---------PPDRLPRQLVHFDIRSANILWACGGVAAILDFEEAQHDHRIVELARAAVLLGTRYHNWGPVSADVRTEFLTGYQSERLLTPAEAGWLHIVLLWQALAMVPPGDDPTGWGPSALSQLSQETAR 2Q83 Chain:A ((18-306)) ---------------------------------KLTELAENVLQGWDVQA-EKIDVIQ---ALVWKVHTDSGAVCLKRIHRPE--KKALFSIFAQDYLAKKGMNVPGILPNKKGSLYSKHGSFLFVVYDWIEGRPFELTVKQDLEFIMKGLADFHTASVGYQPPNGVPIFTKLGRWPNHYTKRC-KQMETWKLMAEAEKEDPFSQLYLQEIDG-FIEDGLRIKDRLLQSTYVPWTEQLKKSPNLCHQDYGTGNTLLGENEQIWVIDLDTVSFDLPIRDLRKMIIPLLDTT---GVWDDETFNVMLNAYESRAPLTEEQKQVMFIDMLFP----------------------------

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 : 991 -62468 -63.03 -243.06 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -63.03 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.276

(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: