Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKERFQMKKYQWGIVGLGTIAHEFAESFNQE-TSELTAVASRTSEKAENFAHRYNIPKAYGSYQEMLDDAEIDIVYIAVPNRQHIDHILAALEAGKHVLCEKAITMNKKELADAMRLAEEKNLILAEAMTIFNMPLYQQLRSIMDTGKLGALKMIQAPFGSYKEPDPKNRFFNPELAGGALLDIGTYAVSFARFFLSSQPEVV-ASTMVPFETGVDEQSVTILRNKENELAAVSLTFQAKMPKVGIVAFENGYVTIADYPRADRAEILFTDGTKEFIESGN--TSEAMNYEIKNMVHMIEGDLP--N-RSLFLTKDVIEILDQMQVLWKNM 3E9M Chain:A ((1-319)) ------LDKIRYGIMSTAQIVPRFVAGLRESAQAEVRGIASRRLENAQKMAKELAIPVAYGSYEELCKDETIDIIYIPTYNQGHYSAAKLALSQGKPVLLEKPFTLNAAEAEELFAIAQEQGVFLMEAQKSVFLPITQKVKATIQEGGLGEILWVQSVTAYPN-VDHIPWFYSREAGGGALHGSGSYPLQYLQYVLGKEIQEVTGTATYQ-QGATDSQCNLALKFAEGTLGNIFINVGLKIPSEMTICGTKGQIVIPNFWKTDCAYYTDAQGN---TVKWSEQFTSEFTYEINHVNQCLQDKKLTSPVMTKELTIATVKIVESFYQEWFD-

General information: TITO was launched using: RESULT: Template: 3E9M.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 : 1772 -64198 -36.23 -205.76 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.75 3D Compatibility (PKB) : -36.23 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.499

(partial model without unconserved sides chains): PDB file : Tito_3E9M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3E9M-query.scw PDB file : Tito_Scwrl_3E9M.pdb: