Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNTENHLMIERQGKLGVITLDRVTHLNALSLDMIEGIGAQLELWRNDAAV-QAILIKSNSPKAFCAGGDIRYLYDSYKNGTAD-YKGYFSAEYKMLNTLREYEKPIIVVLDGYVLGGGFGLAQACHIVVSSEKSRFAMPETAIGFFPDVGATHFLSRLD-DIGVYMAITGEQISSSDALYLDLIDYHVPSEQLQALQDALVEAPSLSKEGIEHIITRFITRPAESELKQLAEGIRKHFGFQHLDEIEQSLENEQDESLKTWASKMLSILQQRSFIAKQTSLKLQHLGR-GLSLQQCMQLERDLQDIWFEHGDFIEGVRALIVDKDKQPRWQERNPELEQILEKLS 4J2U Chain:B ((2-318)) ----SDVLIRKVRRAGRITLSRPAALNALTCAMVQEIDAALRGWIGD-PEVELVVIDAEGPRAFCAGGDIAELHGRGVAGDHAFGQDFWRVEYRMNDRIAAFPKPIVSLMQGFTMGGGVGLGCHARHRIVGETSQISMPECAIGLVPDVGGTHLLARAPGRIGVWLGLTGARMGPGDAIFAGFADRFVPEADWPDLIAALEGGD--------LALPDHAAPE--GRLPVLQDEIDRLFA-GTLAEIPARLEAT----DTPLAAEALKALRRSSPLALAATLEILQRLGPSAGIREALDLEYRFTYRAQGQADFLEGIRAAIIDKDRSPRWRHGDPEA--------

General information: TITO was launched using: RESULT: Template: 4J2U.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1819 -62284 -34.24 -198.99 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 0.77 3D Compatibility (PKB) : -34.24 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.591

(partial model without unconserved sides chains): PDB file : Tito_4J2U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4J2U-query.scw PDB file : Tito_Scwrl_4J2U.pdb: