Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLATLLLLSTVALAGCSSVQRSLRGDDYVDSSLAAEESSKVAAQSAKELNDALTNENANFPQLSKEVAEDEAEVILHTSQGDIRIKLFPKLAPLAVENFLTHAKEGYYNGITFHRVIDGFMVQTGDPKGDGTGGQSIWHDKDKTKDKGTGFKNEITPYL-YNIRGALAMANTGQPNTNGSQFFINQNSTDTSSKLPTSKYPQKIIEAYKEGGNPSLDGKHPVFGQVIGGMDVVDKIAKAEKDE-KDKPTTAITIDSIEVVKDYDFKS 2A2N Chain:C ((19-175)) ----------------------------------------------------------------------RVSDSAIIHTSMGDIHTKLFPVECPKTVENFCVHSRNGYYNGHTFHRIIKGFMIQTGDPTGTGMGGESIWG---------GEFEDEFHSTLRHDRPYTLSMANAG-SNTNGSQFFITVV----------------------P--TPWLDNKHTVFGRVTKGMEVVQRISNVKVNPKTDKPYEDVSIINITV--------

General information: TITO was launched using: RESULT: Template: 2A2N.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 834 -21586 -25.88 -139.26 target 2D structure prediction score : 0.73 Monomeric hydrophicity matching model chain C : 0.72 3D Compatibility (PKB) : -25.88 2D Compatibility (Sec. Struct. Predict.) : 0.73 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.613

(partial model without unconserved sides chains): PDB file : Tito_2A2N.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2A2N-query.scw PDB file : Tito_Scwrl_2A2N.pdb: