Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDAAIDGRAQSAEERMLRDALGEQLEGELRIISREPFGGGALTGFEELSPQARYWYVDTSGKRVEAETGFVLGDPGRPDARIWLHPADPRLPALAPASFPAAAATLMGRLGVSIDRPPELLVYRPGKRAMFRMRAGERETYLKIVR---PSASGSIVELQESLRA--GGVPVPHITGWSELG---IVLTETADGVPLTSRLAELE-PDRLLDSIDALRERIAAVDTGRDAR--ASLALRHDWYLARIDAALARAAEGDPAVAPSAVLRDHLAAVTAVVTGADASALVVDEAERRTIHGDLHVGQLFVDADDASAIAGVIDIDTAGLGDPADDEAALIAHLIASIALARRDEGRSAGFRRLLDAAAARWLAPGR-PGRARVAHRTAVHVLAHALAPIERGDLETAEVELALGRDILRDADERPLI 1J7L Chain:A ((2-264)) --------------------------------------------------------------------------------------AKMRIS--------PELKKLIEKYRCVKDTEGM------SPAKVYKLVGENENLYLKMTDSRYKGTTYDVEREKDMMLWLEGKLPVPKVLHFERHDGWSNLLMSEADGVLCSEEYEDEQSPEKIIELYAECIRLFHSIDI-SDCPYTNSLDSRLAELDYLLNNDLADVDCENW--EEDTPFKDPRELYDFLKTEKPEEELVF-------SHGDLGDSNIFVK---DGKVSGFIDLGRSGRADKWYDIAFCVRSIREDI-------GEEQYVELFFDLL-------GIKPDWEKIKYYILLDELF----------------------------------

General information: TITO was launched using: RESULT: Template: 1J7L.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 : 1137 -2718 -2.39 -10.83 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -2.39 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.230

(partial model without unconserved sides chains): PDB file : Tito_1J7L.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1j7l-query.scw PDB file : Tito_Scwrl_1J7L.pdb: