Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKMKKRSVKQLGLGLISLGILGGLAACGNGNSSAEGEADEGKTLTVSVDSGYKDYINEIKNTFEKENDVKIKLVEKDMFDQLESLALDGPAGKGPDVMMAAYDRIGALGQQGHLAEV---KLGNEAAYDETDKAQVTYDGKIYGEPAVIETLVLYYNKDLVDTAPSTFKDLENLSKDSRFAFESEAGKNTGFLAKWTDFYYSYGLIAGYGGYVFG-DDGT-NPSDIGLNNAGAVEGISYATDWFKNVWPKGMQDIKSAGDF--ASQQFMSNKTAAIIDGPWQAQTYKENNINYGVAKIPTLNNGQPYQPFGGGKGWVVSNYAKNKDLSQKWLD-YVTNQENQEKFFEMVNE------IPANQQARETAKAKNDELTTAVIEQYETAQAMPNIPEMGEVWTGAENLMFDAASGSKTPKESADEAVKTISEAIEQKY 3WOA Chain:A ((29-412)) ---------ELGLSQESVADKMGMGQSGSGMKIEEGKL----VIWINGDKGY-NGLAEVGKKFEKDTGIKVTVEHPDKLE--EKFPQVAATGDGPDIIFWAHDRFGGYAQSGLLAEITPDKAFQDKLYPFTWDA-VRYNGKLIAYPIAVEALSLIYNKDLLPNPPKTWEEIPALDK------ELKAKGKSALMFNLQEPYFTWPLIAADGGYAFKYENGKYDIKDVGVDNAGAKAGLTFLVDLIKN------KHMNADTDYSIAEAAFNKGETAMTINGPWAWSNIDTSKVNYGVTVLPTF-KGQPSKPFVGVLSAGINAASPNKELAKEFLENYLLTDEG----LEAVNKDKPLGAVALKSYEEELAK---DPRIAATMENAQKGEIMPNIPQMSAFWYAVRTAVINAASG----RQTVDEALK----------

General information: TITO was launched using: RESULT: Template: 3WOA.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 : 2016 35006 17.36 94.61 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.78 3D Compatibility (PKB) : 17.36 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.455

(partial model without unconserved sides chains): PDB file : Tito_3WOA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3WOA-query.scw PDB file : Tito_Scwrl_3WOA.pdb: