Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAACSLSPVVRWDVSEVGYDDCNIMADTRDGRYVVKIFHTSRSPALCARYVDVVRRVTEAGVAHPRLHRAEGSALLHHRPTGNRLMVMDRVEGITFLDADACPDDTELASVVEQTYRIHALDLYPEYVHDWWAIPQIATLAAEVAHLLTPGDQDRVAAAVETFGRLRVGTLPQVFSHGDLTKANLLRTPCGVPAVLDLAVSNRYARVHDLSMLAVNVLHGSPRPLPERVALLTGLYARHAPLTAAEHAALPGYVLAAAAMELLGAEREWSQGNRSEETRYLRELGRTTLRAAADWALVPALSTSRTRNRAPQDAPHTDERNPMTGPASPVNSWDEFTQLREIIVGDAAHARIPRMTDPSAWLACYPTMTP--AELKRVEAGKFPRQVVEESDEDLAQLTKTLRGLGVTTHRPPAVDHSRSFSSPY-WEADGYISYCPRDITLVAGSTLIEVASPMRSRYFELFNLRPLFQQYMLEGATWIAAPRPQLRDELYTR------DEESRPLLGEAEPVFDAANVLRVGQDFFYQVSRSGNERGLDWLRSTLRLVDPTVRVHPLR--DVYGYTHIDSTITVLRPGLVMLNPARIARDEVPEAFRGWDVLWCPEPRPTET-ALPYHLSEPWISMNLLMVNPELAIADSDQPELLRALEAKGISVLPHRLRHQRVLGGGFHCVTLDIARDGLREDYFG 5WPI Chain:B ((30-387)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------SYFSHSPSPVEVYTEWDPLEEVIVGIMDDIRVPDWD--KSLKAIIP--EENHDFFQTYSGKRFPEELLIKARQEVETLAQILQAEGIRVKRPNESNHHQPIMTPHFTTGGTFYSAMPRDCLFAIGKKIIEVPMSWRSRYFETFAFRDILNDYFTRGAEWIAAPKPMLSDDVWEKDFDFEQEFPFRSIITEVEPLFDAADFMKMGRDIIGQRSHATNKKGIEWLRRTLG---PDYHIHIYEFDEP-APMHIDTTILPLAPGRVLINKGWVP--QIPDIFKDWEILN--PPASNLPDDHPLYMSSNWIHTNVLMLDEKTVIVEEDEEALISAFRQWGFKTILCPFKHFQTFGGSFHCATLDVKRSGSLKSYI-

General information: TITO was launched using: RESULT: Template: 5WPI.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 : 1980 24830 12.54 71.76 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain B : 0.66 3D Compatibility (PKB) : 12.54 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.286

(partial model without unconserved sides chains): PDB file : Tito_5WPI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5wpi-query.scw PDB file : Tito_Scwrl_5WPI.pdb: