Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MIKCGENNEGGKYMQIDWNNLGFSYIKTPWRFIAKWKDGQWEEGELTEDNYLTIHEGSPALHYGQQCFEGLKAYRRKDGKVNLFRPEQNSRRMNQSARRLLMPMVPEKMFVDAVKQVVKANEDFVPPYGTGATLYLRPLLIGVGENIGVHPAPEYLFVVFCTPVGAYFKGG-LKPTNFIVSD-YDRAAPKGTGAAKVGGNYAASLLPGTEAKELDYSDCVYL-DPATHTKIEEVGAANFFGIT---KDG--KFITPQ-SPSILPSITKYSLLQLAEERL-GLQAIEGDIFIDDLDQF------AEAGACGTAAVISPIGGIYHNNNLHVFYSETE-VGPVTKRLYDELTGIQFGDIEAPEGWIEVVE 1EKV Chain:B ((24-365)) ----------------PGEPLVFGKTFTDHMLMVEWNDKGWGQPRIQPFQNLTLHPASSSLHYSLQLFEGMKAFKGKDQQVRLFRPWLNMDRMLRSAMRLCLPSFDKLELLECIRRLIEVDKDWVPD-AAGTSLYVRPVLIGNEPSLGVSQPRRALLFVILCPVGAYFPGGSVTPVSLLADPAFIRAWVGGVGNYKLGGNYGPTVLVQQEALKRGCEQVLWLYGP--DHQLTEVGTMNIFVYWTHED-GVLELVTPPLNGVILPGVVRQSLLDMAQ-TWGEFRVVERTITMKQLLRALEEGRVREVFGSGTACQVCPVHRILYKDRNLHIPT-MENGPELILRFQKELKEIQYGIR--AHEWMFPV-

General information: TITO was launched using: RESULT: Template: 1EKV.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 : 1735 -120053 -69.19 -369.39 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain B : 0.76 3D Compatibility (PKB) : -69.19 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.419

(partial model without unconserved sides chains): PDB file : Tito_1EKV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1EKV-query.scw PDB file : Tito_Scwrl_1EKV.pdb: