Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ---------------MIGTEKVTALKAKHQSKSSTGLSWFERIGYGFGDMSYNIIFQFVNAYLLFYYTDVGGIQPAVIATLFLVVRVLDAIFDP----------IMGLILDKTN--TRWGKARPYLLWVAFPFALFTFLCFTTPHFGE----TGNMVYAYVTYILLGMSFSMQTIPVNSLTGRMTNSVEERTVLTTTRMILVYIGILLSISCATPLATAIGGEDQAFGFQMTALIYAAVSIVLNLFSFFT--VRERIQPKKRKK-----------QGIKKTLSVLFKNKPLLMLISSFLAFAIGFNIKLSTMVYY----FTYNVNHKEFVFMGTVLFFGAALISNLFIPFFSEKWGRKQVMIIT-----AALSLISY-----AGLHFTPYSSIPLIFIWL--FASGFFTTPLNTLAWGMVADCV------------------DYAEWKTG--IRADGVVISSMS--------------FINKLGVALAGSFSAIYLG-IAGYVANTDQT---------VASLNAIKNMNALIPGFFILLSIIL--IAFYPLTEK------RYKHIISELEQRSAR------------ 4TZ1 Chain:A ((1-549)) EVVGGGDLGPNVLVFDPSTPDIQGKVDEVFRKQESNQFGTDRYALMFKPGTYN----DINAQIGFY-TSIAGLGLNPDDTTFNGDVTVDAGWFDGNATQNFWRSAENLALNPVNGTNRWAVSQ------AAPFRRMHVKGGLNLAPDGYGWASGGYIADSKIDGEVGPYSQQQWYTRDSSVGGWGNGVWNMTFSGVE-----------------------GAPAQSFPEPPYTTLETTPVSREKPFLYLDGDDYKVFVPAKRTNARGTSWGNGTPEGESLPLDQFYVVKPGATAETINAAVDQGLHLLFTPGVYHVDQPIEIDRANTVALGLGLATIIPDNGVTALKVG---DVDGVKVAGLLVDAGPVNSETLVEVGSDGASGDHAANPTSLQDVFVRIGGAGPGKATTSIVVNSNDTIIDHTWVWRADHGEGVGWETNRADYGVHVKGDNVLATGLFVEHFNKYDVQWSGENGKTIFYQNAKAYDAPDQAAIQNGDIKGYAAYKVDDSVTTHEGWGMGSYCYF-NVNPDIRQQHGFQAPVKPGVKFHDLLVVSLGGKGQYEHVINDIGDPTSGDTTIPSQVVSFP

General information: TITO was launched using: RESULT: Template: 4TZ1.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 : 2628 -252695 -96.15 -594.58 target 2D structure prediction score : 0.31 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -96.15 2D Compatibility (Sec. Struct. Predict.) : 0.31 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.156

(partial model without unconserved sides chains): PDB file : Tito_4TZ1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4TZ1-query.scw PDB file : Tito_Scwrl_4TZ1.pdb: