Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSLFIQNDQQRQWMEKIGRIADE-FQQTAAEDDEQ---------------GRFPA---EKIQKLRDAGYTALTLPASHGGGGISVYDMLLFQERLARGDAPTAL--SIGWHLSVIGELGEGNSWDEDVFAFVAKEVQNGA-VINRAATEAKT-GSPTRGGRPGTHAVKKDGKWAVNGRKTFTTMSQALDY--FLVTAWIEDK----QTTGVFLIHKDDPGLSIEETWDMMAMRA--TGSHDLVLNEVMLDENKLVELLQGP-RG--AKPNGWLLHIPAIYLGVAQAARDYAVQFASEYSPNSLNGPIKNVPAVQQRTGEMELELLNARHFLFHIAQLYDDPVRRPHLTSELGAAKHIVTNAALSVVDKAMRIVGAKSLERTNPLQRYYRDVRAGLHNPPMDDAVIHKLAAEAFES 4HR3 Chain:A ((7-410)) ---FAPSARAAELIAAVREFIDAEVMPVERAVLAHHDELLGARAGTTAELWHVPPELDSLKAKARAAGLWNLFLPDPELGGGLSNSEYAPLAEQMGRSLFAPTVFNCNAPDSGNME--VLHRYGSQEQKEVWLEPLLEGDIRSAFCMTEPDVASSDATN--MAATAVVEGDEVVINGRKWWSTGVGHPDCKVIIFMGLTDPNAHRYARHSMVLVPMDTPGITVERMLPTMGFYDEPGGHGVVSFDNVRLPADAFIAGPGKGFEIAQGRLGPGRVHHAMRLIGLAEVALEHACRRGLDRTA--FGKPLVNLGGNRERIADARIAINQTRLLVLHAAWLLDTVGI-MGALSAVSEIKVAAPNMAQQVIDMAIQIHGGGGLSNDFPLAAAWVNARALRLADGPDEVHRGVVARIELA-

General information: TITO was launched using: RESULT: Template: 4HR3.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 : 1912 -187030 -97.82 -505.49 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.69 3D Compatibility (PKB) : -97.82 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.430

(partial model without unconserved sides chains): PDB file : Tito_4HR3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4HR3-query.scw PDB file : Tito_Scwrl_4HR3.pdb: