Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------MEQYSEACIEACIDCMKACNHCFTKC--LEESVQHHLSGCIRLDRE-------CADICALAVKAMQT-----DSPFMKEICALCADICEACGTECGKHDHDHCQACAKACFTCAEQCRSMAA----------- 2VVW Chain:A ((40-189)) IKPDYLEYDDLLDRDEMFTILEEYFMYRGLLGLR--IKYGRLFNEIKKFDNDAEEQFGTIEELKQKLRLNSEEGADNFIDYIKVQKQDIVKLTVYDCISMIGLCACVVDVWRNEKLFSRWKYCLRAIKLFIN-DHMLDKIKSILQNRLVYVEM

General information: TITO was launched using: RESULT: Template: 2VVW.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 : 369 -74787 -202.67 -712.25 target 2D structure prediction score : 0.71 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -202.67 2D Compatibility (Sec. Struct. Predict.) : 0.71 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.412

(partial model without unconserved sides chains): PDB file : Tito_2VVW.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2VVW-query.scw PDB file : Tito_Scwrl_2VVW.pdb: