Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQHQSLFNKSQWTQLVKHFSAVAVLGLTIAAPAWAIDPTAKELRIGFQKS--SINFAIAKQ-QKLFEQEFPNAKITWNEFPAGPQILEALAVGSLDVGVTGDTPPVYAQAAGKPLYYIAYEAAKPLASAILVPKNSQLKQLKDI-KGKRIALQKG-SSSHYLLVQAVRKAGLKWSDITPIWLTPADARAAFQKGAVDAWAIWDPYYASAQLEDQARVLVSGKGL-S-PNYTFYLAAPNFVKQYPKAVPGLIKQINQADKWVQSYQVETASAIGQSTGLKPATSDLFIKRRPRPSSAAPLNSKVIAEQQQIADIFTQQGIIPKPISIKQAVWGAK 3UN6 Chain:A ((51-333)) ---------------------------------------QQVIKIGYLPITHSANLMMTKKLLSQYNHP--KYKLELVKFNNWPDLMDALNSGRIDGASTLIELAMKSKQKGSNIKAVALG--HHEGNVIMGQKGMHLNEFNNNGDDYHFGIPHRYSTHYLLLEELRKQLKIKPGHFSYHEMSPAEMPAALSEHRITGYSVAEPFGALGEKLGKGKTLKHGDDVIPDAYCCVLVLRGELLDQHKDVAQAFVQDYKKSG-FKMNDRKQSVDIMTHHFKQSRDVLTQSAAWT-SY-GD---LTIKPSGYQEITTLVKQHHLFN-PPAYDDFVEPS-

General information: TITO was launched using: RESULT: Template: 3UN6.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 : 1611 38527 23.91 139.59 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 23.91 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.470

(partial model without unconserved sides chains): PDB file : Tito_3UN6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UN6-query.scw PDB file : Tito_Scwrl_3UN6.pdb: