Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRHVLIAVILFFLSIGLSAGCAEAGNKTQNQSATEVNASPLQPAEYFIYHNLMNDK-GLIK---TDFSDQPSYLSESLGLWMEFLLSKNDAPHFQDQYQHLTDSFLMSNHLVTWKIQNGQ------ASGTNALIDDMRIMLSLDQAAAKWGRS---DYAQTARDIGTSLKTYNMNNGFFT-DFYDSQAASKDVTLSYVMPDALAVLKKNG--IIDEETEQRNANVLYSAP--L-KNGFLPKTYSSET-------KEYTYDSEINLIDQLYAAWHLPEG----DEKAS-VLADWIKQEFQKN--GKLYGRYSAYTKEPAVQYESPSVYALAVLFLTKQHENSSVIKAIYDRMNDFEIHDPVKSYYGGYMSGTQTHSFDNLLPLLAERKLFNENIIQ 1KWF Chain:A ((20-352)) --------------------------------QSEVTAMLKAEWEDWKSKRITSNGAGGYKRVQRDASTNYDTVSQGMGYGLLLAVCFNEQALFDDLYRYVKSHFN-GNGLMHWHIDANNNVTSHDGGDGAATDADEDIALALIFADKLWGSSGAINYGQEARTLINNLYNHCVEHGSYVLKPGDRWGGSSVTNPSYFAPAWYKVYAQYTGDTRWNQVADKCYQIVEEVKKYNNGTGLVPDWCTASGTPASGQSYDYKY-------DATRYGWRTAVDYSWFGDQRAKANCDMLTKFFARDGAKGIVDGYT-IQGSKISNNHNASFIGPVAAASMTG-YDLNFAKELYR----ETVAVK---------DSEYYGYYGNSLRLLTLLYI-------

General information: TITO was launched using: RESULT: Template: 1KWF.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 : 1642 -91360 -55.64 -304.53 target 2D structure prediction score : 0.63 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -55.64 2D Compatibility (Sec. Struct. Predict.) : 0.63 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.418

(partial model without unconserved sides chains): PDB file : Tito_1KWF.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1KWF-query.scw PDB file : Tito_Scwrl_1KWF.pdb: