Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRAYFEKLLDSSQQQKQLPLIFPLLIALFSGAVFSFALAPYYWWWLAILSPALLYATLHNRSAKQAFAIGWSYGFGLWFVGAFWLYTSIHVYGDTNAFLSVCMIAVMALVMGLFTAFQTWVYRRFFPETPLTFAPLWIIFEWAKTWVFTGFPWLFVGYAFTERLLDGYAPLFGIYAISFVVIVLACALVEVLRKRIFWVIPAALLVLGAWGASYIQFVQPKATKPLSVSLIQGNIPQDLKWLTEYQVRTLEIYAGLTQSEWGRDLIVWPESSIPLFQTDI--------EPFLDAMDAQAKKN----HTAWVTGIPYWDVTKS------HQVGSPLYYNSIMASGSD-SSGLYKKQRLVPFGEYIPLSGLLSWVLPAMQNDISMSGFTRGESDQKPLLI-KGHALAAAICYEVAYPNLTRRN-AEDSDFLVTVSNDAWFTGTAGPWQHLQMVQMRAKENGRWFIRATN---------TGVTAFIDQNGHITEQAPIDKEFVLRGDLPAMQGQTFYNRLGDYPILGFAVLLLVLGWIYRPRKVDVSYKSRR 4F4H Chain:B ((4-280)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SMKTRIALAQLNVTVGDF--AGNVAKIV-AAAQAAHDA-GAHFLIAPELALSGYPPEDLLLRPAFYAASDAALAELAAQLKPFAGLAVLVGHPLRAP---ANRAIE-GVPPVDTYNAASLIVGGEVAGTYRKQDLP-NTEVFD----------------EKRYFATDAAP--YVFELNGVKFGVVICEDVWHASAAQLAKAAGAQVLIVPNGS-PYHM-NKDAVRIDILRARIRETGLPMVYVNLVGGQDELVFDGGSFVLDGAGELVAKMPQFEEGNAIVEFDG------------------------------------------

General information: TITO was launched using: RESULT: Template: 4F4H.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1235 -16251 -13.16 -71.90 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain B : 0.49 3D Compatibility (PKB) : -13.16 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.391

(partial model without unconserved sides chains): PDB file : Tito_4F4H.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4F4H-query.scw PDB file : Tito_Scwrl_4F4H.pdb: