Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRAYFEKLLDSSQQQKQLPLIFPLLIALFSGAVFSFALAPYYWWWLAILSPALLYATLHNRSAKQAFAIGWSYGFGLWFVGAFWLYTSIHVYGDTNAFLSVCMIAVMALVMGLFTAFQTWVYRRFFPETPLTFAPLWIIFEWAKTWVFTGFPWLFVGYAFTERLLDGYAPLFGIYAISFVVIVLACALVEVLRKRIFWVIPAALLVLGAWGASYIQFVQPKATKPLSVSLIQGNIPQDLKWLTEYQVRTLEIYAGLTQS--EWGRDLIVWPESSIPLFQTDI-------------EPFLDAMDAQAKKNHTAWVTGIPYWDVTKSHQVGSPLYYNSIMASGSD--SSGLYKKQRLVPFGEYIPLSGLLSWVLPAMQNDISMSGFTRGESDQKPLLI-KGHALAAAICYEVAYPNLTRRN-AEDSDFLVTVSNDAWFTGTAGPWQHLQMVQMRAKENGRWFIRATN----------TGVTAFIDQNGHITEQAPIDKEFVLRGDLPAMQGQTFYNRLGDYPILGFAVLLLVLGWIYRPRKVDVSYKSRR 1F89 Chain:A ((8-265)) ------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SQKIKVALVQLSGSSPDK--MANLQRAA-TFIERAMKEQP-DTKLVVLPECFNSPYSTDQFRKYSEVINPKEPSTSVQFLSNLANKFKIILVGGTIPELDP-----KTDKIYNTSIIFNEDGKLIDKHRKVHLF----------------------HESETLSPGEKS--TTIDTKYGKFGVGICYDMRFPELAMLSARKGAFAMIYPSAFNT---VTGPLHWHLLARSRAVDNQVYVMLCSPARNLQSSYHAYGHSIVVDPRGKIVAEAGE-GEEIIYAELDPE-----------------------------------------

General information: TITO was launched using: RESULT: Template: 1F89.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 : 1261 -11889 -9.43 -54.29 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.49 3D Compatibility (PKB) : -9.43 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.49 QMean score : 0.397

(partial model without unconserved sides chains): PDB file : Tito_1F89.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1F89-query.scw PDB file : Tito_Scwrl_1F89.pdb: