Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFIEQMFPFINESVRVHQLPEGGVLEIDYLRDNVSISDFEYLDLNKTAYELCMRMDGQKTAEQILAEQCAVYDESPEDHKDWYYDMLNMLQNKQVIQLGNRASRHTITTSGSNEFPMPLHATFELTHRCNLKCAHCYLESSPE--ALGTVSIEQFKKTADMLFDNGVLTCEITGGEIFVHPN---ANEILDYVCKKFKKVAVLTNGTLMRKESLELLKTYKQKIIVGISLDSVNSEVHDSFRG--RKGSFAQTCKTIKLLSDHGIF-VRVAMSVFEKNMWEIHDMAQKVRDLGAKAFSYNWVDDFGRGRDIVHPTKDAEQHRKFMEYEQHVIDEFKDLIPIIPYERKRAANCGAGWKSIVISPFGEVRPCALFPKEFSLGNIFHDSYESIFNSPLVHKLWQAQAPRFSEHCMKDKCPFSGYCGGCYLKGLNSNKYHRKNICSWAKNEQLEDVVQLI 4RTB Chain:A ((98-274)) ----------------------------------------------------------------------------------------------------------------------LFAPLYLSNICINNCSYCSFRRENKELSRVRLSLEEAVDEAKAIREMGHTRILLVMGEEPEDKTLSYLEEIIPAIYSEVDIRRINVNIAPLTLKGYERLKKLKI-GTYQLFQESYNPEVYREVHLDGPKTNFLWRLNAVERAIEAGIDDIGIGAL---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4RTB.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 : 647 -6076 -9.39 -41.62 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -9.39 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.472

(partial model without unconserved sides chains): PDB file : Tito_4RTB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4RTB-query.scw PDB file : Tito_Scwrl_4RTB.pdb: