Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------MREKLKGGNIMKKWLLLLIGMGILFTG--------CTSENTRTKATIETDTTIETKKSKTQSTEQTTTEM-------KQSVETSASSITESS--SEEVKNTLWDTNK----ASKLETFVTQWGKTLGQ-EYKSYNLQNNVSLYGTP--------LPQAVING--------------------------------DWKMAINEAPVTVQW--------SEDGTGHADFNL-----VAVYSDVETGEYL--GQHVYFFGFQNGQPKVYLTQQNQGNENNYLYFNETQNQ---------------------QLKQGFSDIVNGQTPQTPVVEESTQQATTTTTQSTSSSGISSWEAAKESVLNNKALWLYDS------------PDK----NVSNTNLISTNEYMKDLMQDENGSYYSINIVTDDDG----------NTTMAGGKQFRVYT--DGRISQRIGMTNNFQMIK-- 4GA6 Chain:A ((1-493)) MKAKIRILDMFSGRYTVLINEEDAKEAKLHPDDLVKIEAGKKAVYGSVALSNLVGKGEVGISRDVLDLHNFSEGETVSVIPAGTPESVRYIKKKMHGEKLRKVEIEAIVRDIVDRKLRDIEISSFVTALEINGLDMDEIAALTIAMAETGDMLDIDRKPIMDVHSIGGVPGNKTNILVVPIVAAAGLTIPKTSSRAITSAAGTADVVEVFADVSFSLDEIKRIVEKVGACLVWGGALNLAPADDITIKAERALSIDPTGLMLASIMSKKYAMGSQYVLIDIPTGKGVKVETVEEARSLARDFIELGKRLGQYVEVAITYGGQPIGHTVGPALEAREALSALMTGKGP-GSLIEKATGLAGILLEMGGVAPAGTGKKMAKEILESGKAWEKMKEIIEAQGGDPNIKPEEIPIGDKTYTFTAATSGYVTAIDNRAITAIARAAGAPEDKGAGIELYVKVGEKVKEGDPLFTIHAEHEARLDQAIVLARRTEPIRIE

General information: TITO was launched using: RESULT: Template: 4GA6.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 : 1931 115824 59.98 339.66 target 2D structure prediction score : 0.49 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 59.98 2D Compatibility (Sec. Struct. Predict.) : 0.49 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.108

(partial model without unconserved sides chains): PDB file : Tito_4GA6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4GA6-query.scw PDB file : Tito_Scwrl_4GA6.pdb: