Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTLELDAKAISRIIQYLEPDLTISGFSRLEGGSTEVYRIDLANSDYGSLVLKIYPDEPEWGPS--KEALVAGWLKD-LTLPVPTWLRVDESRSLLPL--RYSLLTHLPGRSLRHWMAEPDIRNVYRQMGELLRRIHAVPMPGYGYVRGHGIDKPLPTNADYMTAAFDDVFRRFRDLGGDPELAGRLQQFAEGSFDIFDASYGAVLAHDDLHQGNVLALRGKAGGLELSGLVDFGNARAADKLFDLAKAIFCSAHEDPRSYQPILEGYGSVDHPDTERALRLYTLFHRVSMWCWLTKIGVDVAAEDGPGGLIRDLSEMVV 5IGT Chain:A ((36-242)) ------------------------------------YRIVIATVDDGRRWVLRIPRRAEVSAKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTAMVIQPGSSTPDWVVPQDSEVFAESFATALAALHAVPISA---AVDAGMLIRTPTQARQKVA--DDVDRVRREFVVNDKRLHRWQRWLDDDSSWPDFS---VVVHGDLYVGHVLIDNTE----RVSGMIDWSEARVDDPAIDMAAHLMVFGEE----------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5IGT.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 : 781 -6400 -8.19 -31.68 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -8.19 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.226

(partial model without unconserved sides chains): PDB file : Tito_5IGT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igt-query.scw PDB file : Tito_Scwrl_5IGT.pdb: