Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLEKFLDMSLVQRIVVGILVGILFGIFFPTW-------TFISILGTLFVSCLKA-IAPILVFFLTM--ASIAKHKIGNKTFVKPILILYLVGTLLSALVAVIVSSIFTV--PITLQETVSEKAPQSLESVLSTMLTNVTQNPVQSLIDANYLGVLFWAVLLGLAF-----------RARSESTKELVDQISIALSQVVQVIIAFAPIGILGLVYQSIATTGIAGLAEYLQLLLVLIGTMLFVALVVYPFLTFLFIKENPYPLIFFCLKESALPAFFTRSSAANIPINMMLAER-LKLTKESYSISIPLGATINMGGAAITISLMTLTAVHSLGIEAPFVLKVLLCILSALAACGASGVAGGSLLLIPLACSLFGIS----NDVAM---QIVGIGFIIGVIQDSMETALNSSSDLLFTAIGELGARKRSGEKIKLKDCLDGLSER 4KY0 Chain:A ((9-415)) ----YLDYPVLWKILWGLVLGAVFGLIAGHFGYAGAVKTYIKPFGDLFVRLLKMLVMPIVLASLVVGAASISPARLG-RVGVK-IVVYYLATSAMAVFFGLIVGRLFNVGANVNLGSGTGKAI------LVQTLLNIVPTNPFASLAKGEVLPVIFFAIILGIAITYLMNRNEERVRKSAETLLRVFDGLAEAMYLIVGGVMQYAPIGVFALIAYVMAEQGVRVVGP-LAKVVGAVYTGLFLQIVITYFILLKVFGIDPIKFIRKA-KDAMITAFVTRSSSGTLPVTMRVAEEEMGVDKGIFSFTLPLGATINMDGTALYQGVTVLFVANAIGHPLTLGQQLVVVLTAVLASIGTAGVPGAGAIMLAMVLQSVGLDLTPGSPVALAYAMILGIDAIL----DMGRTMVNVTGDLAGTVI-------------------------

General information: TITO was launched using: RESULT: Template: 4KY0.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 : 1594 -224402 -140.78 -606.49 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : -140.78 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.294

(partial model without unconserved sides chains): PDB file : Tito_4KY0.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4KY0-query.scw PDB file : Tito_Scwrl_4KY0.pdb: