Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPARGRSVNKGYPITDLVILAGGQARRMNGLNKLLQQFDSDTQLLKIHQKLKSSVSEIWVNSHRDYSIYQSIVPDIKCFQDDASGFFGPLMGMKSAWSHV-KADYVLFIPCDVTYMPTQVVAKLHSALRKNKQAQAAYVSINGDALYPFCLLKRESLEVLEQQIDKQQLSLKNCFKLLHA-QVAIFQKQNLFFHSINSLDELQQYKQIKAFKEIFSTN 3D5N Chain:E ((1-178)) ------------MNIGVIILAAGE-------DKLLAKIDNTPIIMRTIRIYGD-LEKIIIVGKYVN-EMLPLLMDQIVIYNP-FWNEGISTSLKLGLRFFKDYDAVLVALGDMPFVTKEDVNKIINTFKP--NCKAVIPTHKGERGNPV-LISKSLFNEIEKLR--GDVGARVILNKIKIEELCFIECSEGVLIDIDKK-------------------

General information: TITO was launched using: RESULT: Template: 3D5N.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 891 -96104 -107.86 -568.66 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain E : 0.69 3D Compatibility (PKB) : -107.86 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.090

(partial model without unconserved sides chains): PDB file : Tito_3D5N.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3D5N-query.scw PDB file : Tito_Scwrl_3D5N.pdb: