Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPARGRSVNKGYPITDLVILAGGQARRMNGLNKLLQQFDSDTQLLKIHQKLKSSVSEIWVNSHRDYSIYQSIVPDIKCFQDDASGFFGPLMGMKSAWSHV-KADYVLFIPCDVTYMPTQVVAKLHSALRKNKQAQAAYVSINGDALYPFCLLKRESLEVLEQQIDKQQLSLKNCFKLLHA-QVAIFQKQNLFFHSINSLDELQQYKQIKAFKEIFSTN 3D5N Chain:D ((1-178)) ------------MNIGVIILAAGEGKRFG-GDKLLAKIDNTPIIMRTIRIYGD-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 D - contact count / total energy / energy per contact / energy per residue : 961 -88919 -92.53 -508.11 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain D : 0.70 3D Compatibility (PKB) : -92.53 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.129

(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: