Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRRNKRERQELLQQTIQATPFITDEELAGKFGVSIQTIRLDRLELSIPELRERIKNVAEKTLEDEVKSLSLDE-VIGEIIDLELDDQAISILEIKQEHVFSRNQIARGHHLFAQANSLAVAVIDDELALTASADIRFTRQVKQGERVVAKAKVTAV-EKEKGRTVVEVNSYVGEEIVFSGRFDMYRSKHS 3BNV Chain:A ((33-150)) --------------------------------------------------------------------PELNTSLAGTIIEIDKN-YAKSILITTSEMVADDQGLIFDAFIFAAANYVAQASINKEFSVIIGSKCFFYAPLKLGDVLELEAHALFDET--SKKRDVKVVGHVKEIKMFEGTIQVVSTDE-

General information: TITO was launched using: RESULT: Template: 3BNV.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 : 577 -64302 -111.44 -554.33 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -111.44 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.419

(partial model without unconserved sides chains): PDB file : Tito_3BNV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3BNV-query.scw PDB file : Tito_Scwrl_3BNV.pdb: