Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFIEQMFPFINESVRVHQLPEGGVLEIDYLRDNVSISDFEYLDLNKTAYELCMRMDGQKTAEQILAEQCAVYDESPEDHKDWYYDMLNMLQNKQVIQLGNRASRHTITTSGSNEFPMPLHATFE-LTHRCNLKCAHCYLESSPE---ALGTVSIEQFKKTADMLFD--NGVLTCEITGGEIFVHP-NA-NEILDYVCKK-----FKKVAVLTNGTLMRKESLELLKTYKQKIIVGISLDSVNSEVHDSFRG---RKGSFAQTCKTIKLLSDHGIFVRVAMSVFEKNMWEIHDMAQKVRDLGAKAFSYNW-VDDFGRGRDIVHPTKDAEQHRKFM-EYEQHVIDE---FKD-LI-PII----PYERKRAANCGAG---WKSIVISPFGEVRPCALFPK-EFSLGNIFHDSYESIFNSPLVHKLWQAQAPRFSEHCMKDKCPFSGYCG-GCYLKGLNSNKY--HRKNICSWAKNEQLEDVVQLI 4K36 Chain:A ((4-360)) ----------------------------------------------------------------------------------------------------------------------LSLLIKPASSGCNLKCTYCFYHSLSDNVKSYGIMRDEVLESMVKRVLNEANGHCSFAFQGGEPTLAGLEFFEKLMELQRKHNYKNLKIYNSLQTNGTLIDESWAKFLSENK--FLVGLSMDGP-KEIHNLNRKDCCGLDTFSKVERAAELFKKYKVEFNILCVVTSNTARHVNKVYKYFKEKDFKFLQFINCLDPLYEEKGKYNYSLKPKDYTKFLKNLFDFWYEDFLNGNRVSIRYFDGLLETILLGKSSSCGMNGTCTCQFVVESDGSVYPCDFYVLDKWRLGNIQDMTMKELFETNKNHEFIKL-SFKVHEECK--KCKWFRLCKGGCRRCRDSKEDSALELNYYCQSYK-----------

General information: TITO was launched using: RESULT: Template: 4K36.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 : 1571 36812 23.43 117.61 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 23.43 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.423

(partial model without unconserved sides chains): PDB file : Tito_4K36.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K36-query.scw PDB file : Tito_Scwrl_4K36.pdb: