Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MERPTISPEHLQEAAENLSTIRDFIRFGVSALRQYDAHLGQGTEDYFAESSALVLQTLSLEWSADSEILDAKLLPSEKAEFLSLLERRINERIPTSYLLNLAYFFNKPFYVDERVLIPRSPIAELSEQRFAPYCLDENGQMREALNNLPENTKPKTPQRILDMCTGSGCIAVALAYAYPDAEVDATDISKEALEVASINVEHHNKQYQVALLESDLFEKIP-AENQYDLIVSNPPYVDAEDMADLPEEFLHEPELALAAGQDGLDLVRKMLAQAADYLTED-GLIVIEVGNSEWAMRQNFNTVDFNWLTFQKGGSGIFALTAEQCRRYRKLFEEQV 1NV8 Chain:A ((14-260)) ------------------RKIWSLIRDCSGKLEG--V-----TETSVLEVLLIVSRVLGIRKEDLFL-KDLGVSPTEEKRILELVEKR-ASGYPLHYILGEKEFMGLSFLVEEGVFVPRPETEELVEL-ALELIRK------------------YGIKTVADIGTGSGAIGVSVAKFS-DAIVFATDVSSKAVEIARKNAERHGVSDRFFVRKGEFLEPFKEKFASIEMILSNPPYVKSSA--HLPKDVLFEPPEALFGGEDGLDFYREFFG----RYDTSGKIVLMEIGEDQVEELKKI------------------------------------

General information: TITO was launched using: RESULT: Template: 1NV8.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 : 1148 -92410 -80.50 -377.18 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : -80.50 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.460

(partial model without unconserved sides chains): PDB file : Tito_1NV8.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1NV8-query.scw PDB file : Tito_Scwrl_1NV8.pdb: