Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVLKPGLLTTVQDIGRTGYQKYGVLASGAMDTVSLRIANLLIGNGENEAGLEITMMGPGPSFHFSKQTLIAVTGADFTLRINDEEAPLWKPVLIKENSTVSFGPCKLGSRAYLAAAGGIEVPAVMESKSTYVRGSIGGLHGRALQKEDELNIGEMSALSQTILSRLSSQLGKQGFAAPKWSVSRGRFLPLKKNPVIRVLEGKQFAFFTEESKTRFYEEAFRVTPQSDR-MGY----RLKGEPLELKAP-LEMVSEAVSFGTVQVPPDGNPIILLAD-RQTTGGYPRIAHIISA-DL--------PIVSQIMPGEHVQFEPVSLQEAEALAVEREQHIKELKTRMKMEWLT 3VA7 Chain:A ((973-1097)) -----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------NDVKNMLYSAKFMVLGLGDVFLGSPCAVPLD-PRHRYLGTKYNPSRTYTARGVVGIGGM-YMCIYNAEGS--PGGYQLVGRTITAWDKLVIGDHPIDHPWLLTPFDQVEFYPVTEEELEVI---------------------

General information: TITO was launched using: RESULT: Template: 3VA7.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 : 413 -46376 -112.29 -459.17 target 2D structure prediction score : 0.43 Monomeric hydrophicity matching model chain A : 0.54 3D Compatibility (PKB) : -112.29 2D Compatibility (Sec. Struct. Predict.) : 0.43 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.467

(partial model without unconserved sides chains): PDB file : Tito_3VA7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3VA7-query.scw PDB file : Tito_Scwrl_3VA7.pdb: