Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLIYKVYLNIISLHWGRTDMNLSYLKTSLYTAATTAILLCSSQSQ------AQQYYKWMDKSGSTHYTTTPP------PKGAKHLNKVSTYGSQPLLKNPTSNSEQPSQDKDKVVQEVTNVAVEKGAPAVPVPPAPSVSAPR 3QA3 Chain:D ((74-148)) -----------------TSSNTAYLQLSSLTSEDTAVYYCASEGHYGYDGYAMDYWGQGTTVTVSSAKTTPPSVYPLAPGSAAQTNSMVTLG--------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3QA3.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain D - contact count / total energy / energy per contact / energy per residue : 83 -3347 -40.33 -53.13 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain D : 0.62 3D Compatibility (PKB) : -40.33 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.189

(partial model without unconserved sides chains): PDB file : Tito_3QA3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QA3-query.scw PDB file : Tito_Scwrl_3QA3.pdb: