Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --------------------------------------------------------------------------------------------------------------------------------------------MSIHPDPQINRLNVLGEPLASCCFDPITGYFRNGFCHTAVTDLGQHTVCAQMTSEFL-----NFSQKVGNDLI--------TPLPEAGFPGLQPGDFW--CICVTRWVEAYQAGQAPPVKLHACHQAVLSYVPLDVLMEFAV---------------------------------------- 5B6D Chain:A ((1-325)) TFGTFQDAYLSQLRDIYHSPEFRNAPRGQASRERIGAGFRLLDPVQRHISVPARRANVVFNFAEALWYLSGSDRLDFIQYYAPGIAAYSADGRTLRGTAYGPRIFRHPAGGVNQWENVVKTLTDDPDSKRAVIQIFDPRELAVADNIDVACTLALQFLIRDGLLCGIGYMRANDAFRGAVSDVFSFTFLQEFTARYLGLGIGTYHHVVGSVHIYDSDARWAERVLDAGFPAMPDGDNWPHVRRVLEWEERLRTNAARL------SADALDALDLPAYWKHVVALFEAHRQVRHEDTPDRALLAALPEVYRQSLAVKWPGHFG

General information: TITO was launched using: RESULT: Template: 5B6D.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 : 323 -9710 -30.06 -80.25 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -30.06 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.162

(partial model without unconserved sides chains): PDB file : Tito_5B6D.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5B6D-query.scw PDB file : Tito_Scwrl_5B6D.pdb: