Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRIAISG---GGTGGHIYPALAFIKEVQRRHPNVEFLYIGTENGLEKKIVERENIPFRSIEITGFKRKLSFENVKTVMRFLKGVKKSKSYLAEFKPDAVIGTGGYVCGPVVYAAAKMGIPTIVHEQNSLP---------GITNKF--LSKYVNKVAICFEEAKSHF----P--SEKVVFTGNPRASEVVSIKT--GRSL-A-E-FGLSEDKKTVLIFGGSRGAAPINRAVIDMQDVLKT---RDYQVLYITGEVHYEKVMN-ELKSKGAADNMVTKPFLHQMPEYLKAIDVIVARA----GATTIAEITALGIPSVLIPSPYVTANHQEVNARSLGQHDAAIVL-KETELSGEKLIEALDRIVLNEQTLKEMSERTKSLGVPDAAARLYSVLEELKK 2IW1 Chain:A ((2-365)) -IVAFCLYKYFPFGGLQRDFMRIASTVA-AR-GHHVRVYTQSWEGD---CPK-AFELI--QVPVKSHT--NH-----GRNAEYYAWVQNHLKEHPADRVVGFNKMPGLDVYFAADVCYAEKVAQEKGFLYRLTSRYRHYAAFERATFEQGKSTKLMMLTDKQIADFQKHYQTEPERFQILPPGIYPDRKYSEQIPNSREIYRQKNGIKEQQNLLLQVGSDFGRKGV-DRSIEALASLPESLRHNT-LLFVVGQDKPR-KFEALAEKLGVRSNVHFFSGRNDVSELMAAADLLLHPAYQEAAGIVLLEAITAGLPVLTTAVCG--------YAHYIADANCGTVIAEPFSQE--QLNEVLRKALTQSPLRMAWAENARHYADTQDLYSLPEKAA----

General information: TITO was launched using: RESULT: Template: 2IW1.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 : 1692 -200435 -118.46 -607.38 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -118.46 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.438

(partial model without unconserved sides chains): PDB file : Tito_2IW1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2IW1-query.scw PDB file : Tito_Scwrl_2IW1.pdb: