Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKERGLLIVLSGPSGVGKGTVRQAIFSQEDTKFEYSISVTTRSPREGEVNGVDYFFKTRDEFEQMIADNKLLEWAEYVGNYYGTPVDYVEQTLQDGKDVFLEIEVQGALQVRNAFPE--GLFIFLAPPSLSELKNRIVTRGTETDALIENRMKAAKAEIEMMD--AYDYVVENDNVETACDKIKAIVLAEHLKRERVAPRYKKMLEVE 1GKY Chain:A ((4-185)) -------IVISGPSGTGKSTLLKKLFAEYPDSFGFSVSSTTRTPRAGEVNGKDYNFVSVDEFKSMIKNNEFIEWAQFSGNYYGSTVASVKQVSKSGKTCILDIDMQGVKSVK-AIPELNARFLFIAPPSVEDLKKRLEGRGTETEESINKRLSAAQAELAYAETGAHDKVIVNDDLDKAYKELKDFIFAE------------------

General information: TITO was launched using: RESULT: Template: 1GKY.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 : 772 -60318 -78.13 -338.86 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -78.13 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.460

(partial model without unconserved sides chains): PDB file : Tito_1GKY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1GKY-query.scw PDB file : Tito_Scwrl_1GKY.pdb: