Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKIIVQKFGGTSVKDDKGRKLALGHIKEAISEGYKVVVVVSAMGRKGDPYATDSLLGLLYGDQSAISP----REQDLLLSCGETISSVVFTSMLLDNGVKAAALTGAQAGFLTNDQHTNAKIIEMKPERLFSVLANHDAVVVAGFQGATEKGDTTTIGRGGSDTSAAALGAAVDAEYIDIFTDVEGVMTADPRVVENAKPLPVVTYTEICNLAYQGAKVISPRAVEIAMQAKVPIRVRSTYSNDKGTLVTSHHSSKVGSDVFERLITGIAHVKD---VTQFKVPAKIGQYNVQTEVFKAMANAGISVDF-----FNITPSEIVYTVAGNKTETAQRILMDMG-------YDPMVTRNCAKVSAVGAGIMGVPGVTSKIVSALSEKEIPILQSADSHTTIWVLVHEADMVPAVNALHEVFELSK 3AB4 Chain:G ((2-407)) -ALVVQKYGGSSLESAERIRNVAERIVATKKAGNDVVVVCSAMGD-----TTDELLEL----AAAVNPVPPAREMDMLLTAGERISNALVAMAIESLGAEAQSFT-----------------------RVREALDEGKICIVA----------------GGSDTTAVALAAALNADVCEIYSDVDGVYTADPRIVPNAQKLEKLSFEEMLELAAVGSKILVLRSVEYARAFNVPLRVRSSYSNDPGTLIAGSMED---IPV--AVLTGVATDKSEAKVTVLGISDKPGE---AAKVFRALADAEINIDMVLQNVF---TTDITFTCPRSDGRRAMEILKKLQVQWTNVLYDDQV----GKVSLVGAGMKSHPGVTAEFMEALRDVNVNIELISTSEIRISVLIREDDLDAAARALHEQFQL--

General information: TITO was launched using: RESULT: Template: 3AB4.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain G - contact count / total energy / energy per contact / energy per residue : 1762 -244866 -138.97 -724.45 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain G : 0.76 3D Compatibility (PKB) : -138.97 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.76 QMean score : 0.464

(partial model without unconserved sides chains): PDB file : Tito_3AB4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3AB4-query.scw PDB file : Tito_Scwrl_3AB4.pdb: