Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKLATLLLLSTVALAGCSSVQRSLRGDDYVDSSLAAEESSKVAAQSAKELNDALTNENANFPQLSKEVAEDEAEVILHTSQGDIRIKLFPKLAPLAVENF--LTHAKEGY-YNGITFHRVIDGFMVQTGD-PKGDGTGGQSIWHDKDKTKDKGTGFKNEITPYLYNIRGALAMANTGQPNTNGSQFFINQNSTDTSSKLPTSKYPQKIIEAYKEGGNPSLDGKHPVFGQVIGGMDVVDKIAKAEKDEKDKPTTAITIDSIEVVKDYDFKS 5CCQ Chain:A ((17-141)) ----------------------------------------------------------------------------------GRVVLELKADVVPKTAENFRALCTGEKGFGYKGSTFHRVIPSFMCQAGDFTNHNGTGGKSIY---------GSRFPDENFTLKHVGPGVLSMANAG-PNTNGSQFFICTIKTDW------------------------LDGKHVVFGHVIEGMDVVKKI------------------------------

General information: TITO was launched using: RESULT: Template: 5CCQ.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 : 591 3658 6.19 30.23 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain A : 0.71 3D Compatibility (PKB) : 6.19 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.71 QMean score : 0.515

(partial model without unconserved sides chains): PDB file : Tito_5CCQ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5CCQ-query.scw PDB file : Tito_Scwrl_5CCQ.pdb: