Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDGPGSDPIDRALAAAFPDREVDRLTGVGPSWNGANETVDVAFADGGRAFLKVALADE-SNRLARARAVLRYVGAH-GQLPVPEVLAADPDGDPAYLATAPAPGRGLLD-VYEAASDDERERLLRRVGRVLAALHADRFASHGEIVGAGTERGSVAEGAATAGPDAQTGLAIEFAPWTDVLLATVERTREIG-TSERLADHYDAVVDCVRANRDLLDDAPAALLHGDVTKPNLFVTAEGDGADATDGPGVAAIDWELSHVGDPARDLVRAEDQLLNGFDSTGPERFAAALREGYRERAGGLPAGFERRRPVYEVVRMLGRSGFVDQWVPYLDEPLDALVDRADAELRARLDAV 4DCA Chain:A ((36-291)) ------------------QIKINELRYL--SSGDDSDTFLC----NEQYVVKVPKRDSVRISQKRELELYRFLENCKLSYQIPAVVYQS----DRFNIMKYIKGERITYEQYHKLSEKEKDALAYDEATFLKELHSIEIDCSVSLFSDA--------------------LVNKKDKFLQDKKLLISILEKEQLLTDEMLEHIETIYENILSNAV-LFKYTPCLVHNDFSANNMIFRNNR---------LFGVIDFGDFNVGDPDNDFLCLLDCSTDDF----GKEFGRKVLKYYQHKAP---EVAERKAELNDVYWSIDQI--------------------------------

General information: TITO was launched using: RESULT: Template: 4DCA.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 : 1048 8972 8.56 35.60 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 8.56 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.277

(partial model without unconserved sides chains): PDB file : Tito_4DCA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4dca-query.scw PDB file : Tito_Scwrl_4DCA.pdb: