Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------MQSERW----------WQDSSVTAELFQRPKS-FEFIQATRLLRHMPANDAALSWCDHFKFETSFNLNFPATEIESL-------------------ELVDER-------VHLTNL---------IVGLTGIQGTLPYTYTNKIKQA-------PRQQRAETKEFLSLFNH-KLTSQYVESSITYHLPVRYEIENKNDYLDILHALNGYVRSQHQQQDL----DEYFAEFSGLMQGQNNTVHALKTMLSCIFKHEITIKE--FVQESFKLAG----DQLTTLGGSQPSLLGIN-TFCGETIQQIDGKI---EIQIGPLKHQQYLRFLPH--------------QELSLKLKKIVETWCSPT----------LSIDLRLILDESEIQPVRLTQGQEGGLGQGAFLMSRKPNTHNDETCYSLIGEQI--- 4Y97 Chain:A ((157-598)) PSQKYNSRSNRGEVVTSFGLAQGVSWSGRGGAGNISLKVLGCPEALTGSYKSMFQKLPDIREVLTCKIEELGSELKEHYKIEAFTPLLAPAQEPVTLLGQIGCDSNGKLNNKSVILEGDREHSSGAQIPVDLSELKEYSLFPGQVVIMEGINTTGRKLVATKLYEGVPLPFYQPTEEDADFEQSMVLVACGPYTTS---DSITYDPLLDLIAVINHDRPDVCILFGPFLDAKHEQVENCLLTSPFEDIFKQCLRTIIEGTRSSGSHLVFVPSLRDVHHEPVYPQPPFSYSDLSREDKKQVQFVSEPCSLSINGVIFGLTSTDLLFHLGAEEISSSSGTSDRFSRILKHILTQRSYYPLYPPQEDMAIDYESFYVYAQLPVTPDVLIIPSELRYFVKDVLGCVCVNPGRLTKGQVGG--TFARLYLRRPAADGAERQSPCIAVQVVRI

General information: TITO was launched using: RESULT: Template: 4Y97.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 : 1386 37668 27.18 115.19 target 2D structure prediction score : 0.39 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 27.18 2D Compatibility (Sec. Struct. Predict.) : 0.39 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.217

(partial model without unconserved sides chains): PDB file : Tito_4Y97.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Y97-query.scw PDB file : Tito_Scwrl_4Y97.pdb: