Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNSQTKTNPETQVPYDVKHLHDLLEQQKIAYLRHPVPTAKERIDRLARLKRVLVKYQDQIAEAINLDYGNRAIMETKIGELLTCLEQIKYYSKNLTGWMKPSKRHISVLHQPAKGWVQYQPMGVIGIITPWNYPLLLSVGPLICALAAGNHAMIKISSASPNFGQVLENALSEAFPQELVAVVNGGGVISDTFSHLPFDKMIFTGSTSVGKTVMAAAAQNLVPVILELGGKSPALVHASVDMKDVAQRIAVGKLWNAGQTCVAPDHIFLPRDKTAEFIENFKLIVAGMYPH-FRNNQDYTSIINDKQYNRIQGYLENARDQGARIIEINPQNEILDDVRKIAPTLVTGVTTAMDIMQNEIFGPVLPILEYDQIEEVIEFINSRPRPLAMYYFDYDQARADYISQHTHSGHFGINMVITHVAQDDLPFGGIGASGMGKYHGPEGFFGLSHERSVMSNPKL--YSLKYILPPFNKPIHRFISKTLLR 4H80 Chain:B ((42-461)) -----------------------------------------RIQQLEALQRLIQEQEQELVGALAADL-HKNEWNAYYEEVVYVLEEIEYMIQKLPEWAADEPVEKTPQTQQDELYIHSEPLGVVLVIGTWNYPFNLTIQPMVGAIAAGNAVVLKPSELSENMASLLATIIPQYLDKDLYPVINGGVPETTELLKERFDHILYTGSTGVGKIIMTAAAKHLTPVTLELGGKSPCYVDKNCDLDVACRRIAWGKFMNSGQTCVAPDYILCDPSIQNQIVEKLKKSLKEFYGEDAKKSRDYGRIISARHFQRVMGLIE-----GQKVAYGGTGDAA---TRYIAPTILTDVDPQSPVMQEEIFGPVLPIVCVRSLEEAIQFINQREKPLALYMFSSNDKVIKKMIAETSSGGVAANDVIVHITLHSLPFGGVGNSGMGSYHGKKSFETFSHRRSCLVRPLMNDEGLKVRYPP---------------

General information: TITO was launched using: RESULT: Template: 4H80.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 2266 -198274 -87.50 -475.48 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain B : 0.79 3D Compatibility (PKB) : -87.50 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.463

(partial model without unconserved sides chains): PDB file : Tito_4H80.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4H80-query.scw PDB file : Tito_Scwrl_4H80.pdb: