Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --MKDDQKYLLAGLYSLLVAIFYFPLID----SKGIFVSILMAVLLLY----LIYFIATVIHI--VIIKFIRKKSFKYLVLYPFTYDGSWRFQPINLLYFPEMVRDVIPINLVQEYCQGQPYGLLKKMLKRI----------RLSREIALLLATIIVYFFTHRILPL----SVFTFMFSYILLFVQSYLGSNTAWIGNRRLIIDDEFEKILLSKSY--VKEIS-SAR---YSEYLTCEYKNLTPIILIAIFENLLDSYLLQ-----NQSEVDLDIF---YKVLPLLYKEKYTMGFNYFVSLNYLLYKVGFLGIIYDNEALRDLSKQYLNKNISELQDGSFEGGIQDAVASKQIVVINEFIACLNSRCVPSQY-DRFFYKDRPYIFSRKSPIKG 2Y38 Chain:A ((8-398)) GFSLHPPYFNLAEGARITASATCHPVSNAIDGTERWWQSPPLSRGLEYNEVNVTLDLGQVFHVAYVLIKFANSPRPDLWVLERSTDFGH-TYQPWQFFASS------------KRDCLER---FGPRTLERITQDDDVICTTEYSRIVPLENGEIVVSLVNGRPGALNFSYSPLLRDFTKATNIRLRFLRTNTL---LGHLMGKALRDPTVTRRYYYSIKDISIGGRCVCHGHADVCDAKDP------------LDPFRLQCACQHNTCGGSCDRCCPGFNQQP--WKPATTDSANECQSCN-------CHGHAYDCYYDPEVDRREASQN----QDNVYQGGGVCLDCQHHTTGIN----C--ERCLPGFFRAPDQPLDSPHVCRPAAAH--

General information: TITO was launched using: RESULT: Template: 2Y38.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 : 1584 -27004 -17.05 -90.01 target 2D structure prediction score : 0.35 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : -17.05 2D Compatibility (Sec. Struct. Predict.) : 0.35 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.131

(partial model without unconserved sides chains): PDB file : Tito_2Y38.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2Y38-query.scw PDB file : Tito_Scwrl_2Y38.pdb: