Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNLIFLPGASGSTTFWHPLIEKLPQQYRAKIIGYPSFGDTP-ESLEVKSFEDLTNYVVNQIH-------DESVIIAQSMGGIFAVTAALQKPQLVKGLVLIATS-----------GGI---------NLEPFNVQDWREAYRQAFLKYPD----------WFITTN-------------ANYEEFLSDINIKTLLIWGDNDPVSPVQVGQYLNQKFENSTLYVVKGGDHQLAEKYADEVAVQIKNYLKGLM 1WPR Chain:A ((22-269)) -SIMFAPGFGCDQSVWNAVAPAFEEDHRVILFDYVGSGHSDL--YDLNRYQTLDGYAQDVLDVCEALDLKETVFVGHSVGALIGMLASIRRPELFSHLVMVGPSPCYLNDPPEYYGGFEEEQLLGLLEMMEKNYIGWATVFAATVLNQPDRPEIKEELESRFCSTDPVIARQFAKAAFFSDHREDLSKVTVPSLILQCADDIIAPATVGKYMHQHLPYSSLKQMEARGHCPHMSHPDETIQLIGDYLKA--

General information: TITO was launched using: RESULT: Template: 1WPR.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 : 916 -35327 -38.57 -181.16 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -38.57 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.500

(partial model without unconserved sides chains): PDB file : Tito_1WPR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1WPR-query.scw PDB file : Tito_Scwrl_1WPR.pdb: