Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------------------------------MSQRVSYYEIAPEGMKIMMDMEKYTKQSSINRTTRELIKIRVSQMNGCAFCIDMHTSDARKMGETEQRIYCLHAWNECD----FYSPEEKAALELS---------EHITLIPSKRVPDELYHRVREHYDEEQYVDLVLIINQINSWNRISIAMGNRAASK----------------------------------------------------------------------------------------------------------------------------------- 1ZEL Chain:A ((2-297)) AMVVSPAGADRRIPTWASRVVSGLARDRPVVVTKEDLTQRLTEAGCGRDPDSAIRELRRI----------GWLVQLPV---KGTWAFIPPGEA------AISDPYLPLRSWLARDQNAGFMLAGASAAWHLGYLDRQPDGRIPIWLPPAKRLPDGL----------ASYVSVVRI-----PWNAADTALLAPRPALLVRRRLDLVAWATGLPALGPEALLVQIATRPASFGPWADLVPHLDDLVADCSDERLERLLSGRPTSAWQRASYLLDSGGEPARGQALLAKRHTEVMPVTRFTTAHSGESVWAPEYQLVDELVVPLLRVIGK

General information: TITO was launched using: RESULT: Template: 1ZEL.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 : 345 -61090 -177.07 -540.62 target 2D structure prediction score : 0.56 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -177.07 2D Compatibility (Sec. Struct. Predict.) : 0.56 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.188

(partial model without unconserved sides chains): PDB file : Tito_1ZEL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1ZEL-query.scw PDB file : Tito_Scwrl_1ZEL.pdb: