Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRRDAHERLTERFEDYRIVRKLRRVPPHEVYEASVDSRRAVYKGDTGPTGNAAVEGRVTALVGRETAVPVPETLRVGDDCYVTAWHPDAPAPDSSDEADEAWAAAAGRGLATLHTETEPLVDGCGPFRAADGGVRVETADDWHAAAVDHVRHRRSVLAEYGHADVADAAVEFLRDRPDAFDGAGDPVCCHGWWTPEHVAVEDGRVACVVDFEHATAAPGEWDYWRTVTPTFAACDEDTTAARRAFRRGYESVRPFSPGFERRRPYYGLLNGVYYLQSLYVQDRHGPAATAERAARFRARIFETISELDRGRLGRTAHPSRRVAFARHTPTSVMSRFDAVLFDLDGTLCENEQDVEHLYFGAFERAEVEPFGAPSDLWAVLEGPPTTPDEFEYYREGFRTVAAEHGRAEADVSAVAREFVDGIDYGAVSLLGGAEAALADAGVGHRVGLMTNGPEYRQSVKLEALGLEDAF-EVVVYAGDMERRKPHTDPFDRAVEALGVDASA-TLY-VGNSLKYDVAGAREAGLPVAWYPDGDADPGSYDPDYVVESLAELADVLDGTVE- 3M9L Chain:A ((2-201)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SLSEIKHWVFDMDGTLTIAVHD-----FAAIREAL--SIPAEDDILTHLAALP----------------ADESAAKHAWLLEHERDLAQG----SRPAPGAVELVRELAGRGYRLGILTRNARELAHVTLEAIGLADCFAEADVLGRDEAPPKPHPGGLLKLAEAWDVSPSRMV--MVGDY-RFDLDCGRAAGTRTVLVNLPD-NPWPELTDWHARDCAQLRDLLSAEGHH

General information: TITO was launched using: RESULT: Template: 3M9L.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 : 947 -39011 -41.19 -199.03 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -41.19 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.168

(partial model without unconserved sides chains): PDB file : Tito_3M9L.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3m9l-query.scw PDB file : Tito_Scwrl_3M9L.pdb: