Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKIIVTTCLLATGFLLTACGESQSSNESQQTTIQFMHSS-VEQERLSVINELVADFEKENPDIKIKQVPVEESAFNTKIVTLARSGKLPEVMEVSQDFAKVMDKDELIDQTAVQNVIEEAGEDNYYD--GAKNLVRSEDGKSYIAAPISGWVQGIWYDKEKLSEAGFSEPENWDDILKIAQHFTDKENKQYGIAMPTAEGT-MSEQAFSQFALSNGANVLDDEGEVTIDTEKMREALSFYQNLSQYTMPGSNDVT----EIKDAFMNGTAPMAIYSTYILPSVYEAGNSENIGFAIPTQKDQAVYGTVSGLTISSGLDE----KQKEAAEAFTA-FLSQPKNMEKWVLMSPGGAQPVNKQVVELDGYKENEVIKSFGELPSEIASAFDEVQVFGLVGEKNFTKMGDITSSGVIGKAVNQVTVGNEDVDQALADAQKNTK----- 4R2F Chain:A ((38-431)) -------------------------------GAIKFWDMPWATPAYNDAAKKIAEGFSGANSKATYQII--QWNNFYQTFSSAIASKTGPAVSTGGGFQAFQFEEQGQIAY--ADKVIEKLKSNGQFDDFLPGVVEPFKTSKGYVAVPWQLDIRPLWYRKSLFEKAGVGVPTDWASLLEAGKKLKGVGA--VGFATGSGAGNNIGNHLMIMMMLNNGGGVFTKDGELDVLNDRNVEAVEFLLELVSNGVIDPAAVSYTTDNLNAQWKDSKAAYGMLTLGVPERVGD--TSGDIVVASPIA---GPHGDKAALIFPNNIMMYTNTPSQEASEEFVVYYLGKLKELWQQKLMN---ALPVFKSITEMPEFTADPNNVKIVNEYVPI------AKTFASQGTALSANLAALDGGQALNQFTQTVLTGKTDAKSALTAFDTGLKSVLKK

General information: TITO was launched using: RESULT: Template: 4R2F.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 : 2166 76683 35.40 203.94 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 35.40 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.406

(partial model without unconserved sides chains): PDB file : Tito_4R2F.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4R2F-query.scw PDB file : Tito_Scwrl_4R2F.pdb: