Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFIVAGAAAHSSFKKAQLLTRLSSIS-SVQSFDSQWVYLFD--QALNEQQHQSALQLLNDGESFELRQPASDEIQILVTPRVGTISPWSSKATDIFKNCN-TPVHRLERGLLFTLKGVSEITNEVKQV---LHDRMTETVFAQIEDAKALFSETAPKPLNSIDILGQGKEALVKANNEFGFALSEQEIDYLTEAFTRLGRNPNDIELMMFAQANSEHCRHKIFGSEWTIDGEKQPLSLFQMIKNTYKESPTDVLSAYKDNASVIVGYDTMRFYPKADENGHFVYKYKSQAAHILMKVETHNHPTAISPFAGAATGSGGEIRDEGATGRGGKPKAGLTGFTVSNLNIPGFEQPWEENYGKPSRMASPLQIMIEGPLGGAAFNNEFGRPALNGYFRTFEQNVNG----EVKGFHKPIMIAGGYGNIRPDHVEKDAIQPGDLLIVLGGPAMLIGLGGGAASSVDSGTMGESLDFASVQRENPEMERRCQEVIDTCWRLEDFNPIVSIHDVGAGGLSNAMPELVNDHELGAVLNLRKIPSLEPGMSPMEIWSNEAQERYVLAIRPESLEQFESICARERCPFAVLGEATEARHLTVEDPLFQNNAVDIPMQVMLGGTPRMQCSYETIERKGNEFDASKVDLKDAIFRVLKNPTVASKSFLITIGDRSITGMVARDQMVGRWQIPVADAAVTTTSLQGFTGEAMAMGERPPVALLNPAASARLAVAEAITNIACANIEQISDIKLSANWMAAAGQKGEDQALFEGVKAIGMEMCPALGIAIPVGKDSLSMRTTWNDNGEDKAVTSPMTGVITAFAPVADVRKTLTPELKNLEDSVLVRIDLSKGQFRLGGSILAQVYKAIGSVTPDVDSFDDFKAFFALIQDWNNRGLIQAYHDIGDGGLLATVAEMMFASRLGV-----ALEDQTTAGLFAEEIGAVVQIKAADWEALQAEVAASSLKDAIAVVGRVNNTDQLSVNG-----LTLERAELQQAWSEVSHQIQRLRDNVETADQEFALITDKSHQGLIAKPTFDLNEPIEAPFINS-RRPNMAILREQGVNGHIEMAAAFDKVGFNTIDVHMSDLLAGRVSLSDFEGLVTCGGFSYGDVMGAGGGWAKSVLFNAKLRDQFEQFFHREGTFSLGICNGCQMLSQLAPLIPGAEHWPRFHRNMSEVFEARSVNVRVEKSVSVLLDGMEGSILPIAVAHGEGRA-VASEADIASLNAANQVALRYVDSHGNPTQHYPLNPNGSPEAITGVTSKDGRATIMMPHPERTFRAIQHSWKPEEWTEDGAWLRMFRNARKFIG 3UGJ Chain:A ((10-1303)) MEILRGSPALSAFRINKLLARFQAANLQVHNIYAEYVHFADLNAPLNDSEQAQLTRLLQYGPALSSHTPAGK--LLLVTPRPGTISPWSSKATDIAHNCGLQQVDRLERGVAYYIEASTLTAEQWRQVAAELHDRMMETVFSSLTDAEKLFIHHQPAPVSSVDLLGEGRQALIDANLRLGLALAEDEIDYLQEAFTKLGRNPNDIELYMFAQANSEHCRHKIFNADWIIDGKPQPKSLFKMIKNTFETTPDYVLSAYKDNAAVMEGSAVGRYF--ADHNTG-RYDFHQEPAHILMKVETHNHPTAISPWPGAATGSGGEIRDEGATGRGAKPKAGLVGFSVSNLRIPGFEQPWEEDFGKPERIVTALDIMTEGPLGGAAFNNEFGRPALTGYFRTYEEKVNSHNGEELRGYHKPIMLAGGIGNIRADHVQKGEIVVGAKLIVLGGPAMNIGL-----------------DFASVQRDNPEMERRCQEVIDRCWQLGDANPILFIHDVGAGGLSNAMPELVSDGGRGGKFELRDILSDEPGMSPLEIWCNESQERYVLAVAADQLPLFDELCKRERAPYAVIGDATEEQHLSLHDNHFDNQPIDLPLDVLLGKTPKMTRDVQTLKAKGDALNRADITIADAVKRVLHLPTVAEKTFLVTIGDRTVTGMVARDQMVGPWQVPVADCAVTTASLDSYYGEAMSIGERAPVALLDFAASARLAVGEALTNIAATQIGDIKRIKLSANWMAAAGHPGEDAGLYDAVKAVGEELCPQLGLTIPVGKDSMSMKTRWQEG--QREMTSPLSLVISAFARVEDVRHTLTPQLST-EDNALLLIDLGKGHNALGATALAQVYRQLGDKPADVRDVAQLKGFYDAMQALVAARKLLAWHDRSDGGLLVTLAEMAFAGHCGVQVDIAALGDDHLAALFNEELGGVIQVRAEDRDAVEALLAQYGLADCVHYLGQALAGDRFVITANDQTVFSESRTTLRVWWAETTWQMQRLRDNPQCADQEHEAKANDTDPGLNVKLSFDINEDIAAPYIATGARPKVAVLREQGVNSHVEMAAAFHRAGFDAIDVHMSDLLGGRIGLGNFHALVACGGFSYGDVLGAGEGWAKSILFNHRVRDEFETFFHRPQTLALGVCNGCQMMSNLRELIPGSELWPRFVRNHSDRFEARFSLVEVTQSPSLLLQGMVGSQMPIAVSHGEGRVEVRDDAHLAALESKGLVALRYVDNFGKVTETYPANPNGSPNGITAVTTENGRVTIMMPHPERVFRTVANSWHPENWGEDSPWMRIFRNARKQLG

General information: TITO was launched using: RESULT: Template: 3UGJ.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 : 8600 195046 22.68 155.79 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.88 3D Compatibility (PKB) : 22.68 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.88 QMean score : 0.528

(partial model without unconserved sides chains): PDB file : Tito_3UGJ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3UGJ-query.scw PDB file : Tito_Scwrl_3UGJ.pdb: