Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFTKKDLLQQRMLIDQLRTQNSLSPQNAAKLGQSIASSWERSASAAIPKERFAAPLLEKKSASQNALDLALSQCADDLRHIAEQSSMVIAVGDIGSTIIWTASSAQMQSAAERVHFVQGG---QWREEFVGTNALALSLKTQQSSCVFSNEHYMESIHDWVCYAAPIIDPYSKQTLGVVDLSTTWKNHNTLGILAAERCASIIQSALLEQQRQQ-LHIRAFSTPQVKFNGKSLLLTPRQIEILTILAL--CP-HGL-TLENLYQALYGERKVSMGTLKAEMSQLRDILGGLLGSRPYRLLVHVEADFLQAEQALDAGYVASALQLYAGVFLAKTESPFLCAWRDCLESRLSDAIFKAQETDLLLKHLAHFPEAIDAVERLMELLPSEHPAHQLLVKYIDSPKLS 5LOE Chain:A ((39-228)) -------------------------------------------------------------------------------------DSNIFVVSRRGKLLGYSINQQIENDRMKKMLEDRQFPEEYTKNLFNVPETSSNLDINSEYTAFPVENRDL-FQAGLTTIVPIIG--GGERLGTLILSRLQDQFNDDDLILAEYGATVVGMEILREKAEEIEEEARSKA---VVQMAISSLSYSELEAIEHIFEELDGNEGLLVASKIADRV----GITRSVIVNALRKLE-----------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5LOE.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 : 630 -6195 -9.83 -34.04 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -9.83 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.331

(partial model without unconserved sides chains): PDB file : Tito_5LOE.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5LOE-query.scw PDB file : Tito_Scwrl_5LOE.pdb: