Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MISKRKHVIIFPILCKKIQGGGSTMIEEYIEKNILRQLFLCGQFYVNKEVNLEKLSNLLHVCKTTLLNDINNIKKEFEEQIAYTHREKDRYTLYFSEHIPRCKIMQQLSQNSLFLKTCLLYLEEDEPDYLQLTECEFISVSKAYSLKKQVLAYFNDCGIEIDRYSPRFTEMERRLLLLNVSYRLGGFNSWELPESFFERADRFIESVTENSGRFYDKENKEILSIGFAISFLRQQVCAVTIDSKFIEEIKKRPIYNYVESAWENTDFQTYYKKEEFAFILTLFNLCNYG--FHSYQLIAEDFQQLHQVFIDNTPEIKELVATFESHFNQELFGNQPFERALIHLMRSAWDNYQLFMPEKFYLLNEEQTNLYKEVQTIFSSWSSQLPYDLRL-NPNCMRAFVIELSGILRLTKEHLTIYIVTNSDV-HYLIYREALEAVTTFDFQVAPTIYSSISDIKKYAQQSSNRVLCERTLYTP---DAVQYENIIPISINTIDRAIISAVQNK 2BMF Chain:A ((169-618)) MASIEDN----PEIEDDIFRKKRLTIMDLHPGAGKTKRYLPAIVREAIKRGL----------RTLILAPTRVVAAEMEEAL-------RGLPIRYQTGREIVDLMC----HATFTMRLLSPIRVPNYNLIIMDEAHFT----------------DPASIAARGYISTRVEMGEAAGIFMTATPPGSRDPFPQSNAPIMDEEREIPERSWNSGHEWVTDFK-----GKTVWFVPSIKAGNDIAACLRKNGKK--VIQLSRKTFDSEYIKTR--TNDWDFVVTT-DISEMGANFKAERVI--DPRRCMKPVILTDGEERVILAGPMPVTHSSAAQRRG------RVGRNPKNENDQYIYMGEPLENDEDCAHWKEAKMLLDNINTPEGIIPSMFEPEREKVDAIDGEYRLRGEARKTFVDLMRRGDLPVWLAYRVAAEGINYADRRWCFDGVKNNQILEENVEVEIWTKEGERKKLKPRWLDARIYSD--PLALKEFKEFAAG---RK

General information: TITO was launched using: RESULT: Template: 2BMF.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 : 2283 -86479 -37.88 -198.80 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -37.88 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.128

(partial model without unconserved sides chains): PDB file : Tito_2BMF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2BMF-query.scw PDB file : Tito_Scwrl_2BMF.pdb: