Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGVTKTPLYETLNESSAVALAVKLGLFPSKSTLTCQEIGDGNLNYVFHIYDQEHDRALIIKQAVPYAKVVGESWPLTIDRARIESSALIRQGEHVPHLVPRVFYSD--------TEMAVTVMEDLSHLKIARKGLIEGENYPHLSQHIGEFLGKTLFYSSDYALEPKVKKQLVKQFTNP--ELCDITERLVFTDPFFDHDTNDFEEELRPFVEKLWNN-DSVKIEAAKLKKSFLTSAETLIHGDLHTGSIFASE---HETKVIDPEFAFYGPIGFDVGQFIANLFLNALSRDGADREPLYEHVNQVWETFEETFSEAWQKDSLDVYANIDGYLTDTLSHIFEEAIGFAGCELIRRTIGLAHVADLDTIVPFDKRIGRKRLALETGTAFIEKRSEFKTITDVIELFKLLVKE 4OCV Chain:A ((24-299)) ------------TNEALFDVASHFALE--GTVDSIEPYGDGHINTTYLVTT--DGPRYILQRMNTGI------FPDTVNLMRNVELVTSTLKAQ-GKETLDIVRTTSGDTWAEIDGGAWRVYKFIEH-TMSYNLV----PNPDVFREAGRAFGDFQNFLSGFDANQLT--ETIAHFHDTPHRFEDFKKA------LAADELGRA-AGCGPEIEFYLSHADQYAVVMDGLRD--GSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLD--KVHFSTELFRAYTEGFVGE----------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4OCV.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 : 1107 -106873 -96.54 -407.91 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -96.54 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.414

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4OCV-query.scw PDB file : Tito_Scwrl_4OCV.pdb: