Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKMKYYEETSALLHEFSEENQKYFEELWESFNLAG--FLYDEDYLREQIYLMMLDFSEAERDGMSAEDYLGKNPKKIMKEILKGAPRSSIKESLLTPILVLAVLRYYQLLGDFSKGPLLTVNLLTFLGQLLIFLIGFGLVATI--LRRSLVQDSPKMKIG--TYIVVGTIVLLVVLGY-VGMASFIQEGAFYIPAPWDSLSVFTISLV--------IGI-------------WNWKEAVFRPFVSMII----AHLVVGSLLRYYEWMGISNVFLTKVIPLAVLFI---------------GIFLLFRGFKKIKWSEVQSKSRCKAVFCYNEGKN----VRN------ 4MFL Chain:A ((23-345)) -----MDPETVRIALGLEERTAAWLTELDELGPPAEPVRLPRGEEARDLLRRL-------EVPELDAEEIVAAAPD----------PDRDPALWWLLERTHHAIVRH---MGDHRAKPRGGPPLPYEGGAAARYFHVYVFLATVPAVRRFHAERGIPDEVGWETLTQLGELVAIHRRKYGQGGMNMQWWTTYHLRGILYRLGRLQFSLATGKDGTPHLGLAVPEWGGPLLPKAYDESLHRARPFFDRHFPEHGARVAWGSSWMLDPQLEEYLTEDSNIIQLARFWTLTDSAPEPGNADGDSSILEFVFRYNGQPLDELPQRSSLERAVIAHLKAGRHWHMRTGFVKLP

General information: TITO was launched using: RESULT: Template: 4MFL.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 : 1239 -84176 -67.94 -316.45 target 2D structure prediction score : 0.50 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -67.94 2D Compatibility (Sec. Struct. Predict.) : 0.50 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.230

(partial model without unconserved sides chains): PDB file : Tito_4MFL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4MFL-query.scw PDB file : Tito_Scwrl_4MFL.pdb: