Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSSIVAIKGFNDVLPTQTAAWRRLEQHLASLMDAYGYQQIRLPIVEQTGLFKRAIGDATDIVEKEMYTFFDKGNPPESLTLRPEGTAGCVRALVEHNLLRGATPRVWYMGPMFRYEKPQKGRYRQFHQFGVETFGVATPDIDAELIMLTARLWKRMGVDHMVQLELNTLGETDERTEYRNALVAFLNEHKDALDEDSQRRLTTNPLRILDSKIESTQKILENAPKLHDFLKEDSLSHFQQLQDYLTAAGIKFVINQKLVRGLDYYNKTVFEWTTTALGSQGTVCAGGRYDGLVGQLKGKADQSVPAVGFAMGMERLLLLLEQVEQAEIVRHCEAFLVAE-PAYQSKALVLAEQLRDQLEAANSNIRIKT---GSQSSMKSQMKKADQAGAVYAIILGEREWEAQQLAVKELATAEQSQVALAELVPFLIEKFTK 4E51 Chain:A ((30-452)) -EKLTGVKGMNDILPQDAGLWEFFEATVKSLLRAYGYQNIRTPIVEHTPLFTRGIGEVTDIVEKEMYSFVDALNG-ENLTLRPENTAAVVRAAIEHNMLYDGPKRLWYIGPMFRHERP---RYRQFHQVGVEALGFAGPDADAEIVMMCQRLWEDLGLTG-IKLEINSLGLAEERAAHRVELIKYLEQHADKLDDDAQRRLYTNPLRVLDTKNPALQEIVRNAPKLIDFLGDVSRAHFEGLQRLLKANNVPFTINPRLVRGLDYYNLTVFEWVTDK----GTVAAGGRYDPLIEQLGGK---PTAACGWAMGIERILELLKEEHLVPEQEGVDVYVVHQGDAAREQAFIVAERLRD----TGLDVILHCSADGAGASFKSQMKRADASGAAFAVIFGEDEVTNGTASVKPL--------SVQQSVP--VESLTE

General information: TITO was launched using: RESULT: Template: 4E51.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 : 1967 -150500 -76.51 -373.45 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.85 3D Compatibility (PKB) : -76.51 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.85 QMean score : 0.547

(partial model without unconserved sides chains): PDB file : Tito_4E51.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4E51-query.scw PDB file : Tito_Scwrl_4E51.pdb: