Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAKKDEHLRKPEWLKIKLNTNENYTGLKKLMRENNLHTVCEEAKCPNIHECWAVRRTATFMILGSVCTRACRFCAVKTGLP----TELDLQEPERVADSVAL---MNLKHAVITAVARDDQKDGGAGIFAETVRAIRRKSPFTTIEVLPSDMGGN-YDNLKTLMDTRPDILNHNIETV-RRLTPRVRARATYDRSLEFLRRAKEMQPDIPTKSSIMI--GLGETKEEIIEVMDDLLANN-VDIMAIGQYLQPTKK-------HLK--VQKYYHPDEFAELKEIAMQKGFSHCEAGPLVRSSYHADEQVNEASKKRQAQA 3C8F Chain:A ((25-242)) --------------------------------------------------------------FFQGCLMRCLYCHNRDTWDTHGGKEVTVEDLMKEVVTYRHFMNASGGGVTASGGE-AIL---QAEFVRDWFRACKKEG--IHTCLDTNGFVRRYDPVIDELLE-VTDLVMLDLKQMNDEIHQNLVGV-SNHRTLEFAKYLANK--NVKVWIRYVVVPGWSDDDDSAHRLGEFTRDMGNVEKIELLPYHELGKHKWVAMGEEYKLDGVKPPKKETMERVKGILEQYGHK-----------------------------

General information: TITO was launched using: RESULT: Template: 3C8F.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 : 874 30184 34.54 153.22 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 34.54 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.406

(partial model without unconserved sides chains): PDB file : Tito_3C8F.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3C8F-query.scw PDB file : Tito_Scwrl_3C8F.pdb: