Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDSQDNKRKWKNRDLISSLEFAITGIFTAIKEERNMRKHAVTALVVILAGFGFQVSRIEWLFLLLSIFLVVAFEIINSAIENVVD-LASHYHFSMLAKNAKDMAAGAVLVVSLFAALTGALIFLPRIWDLLF 5DWK Chain:B ((19-125)) --------------IIKAAGYSWKGLRAAWINEAAFRQEGVAVLLCVVIAAWLDVDAVTRVLLISSVMLVMIVELLNSAIEAVVDRIG---H--ELSGRAKDLGSAAVLIAIIDAVITWAILL---------

General information: TITO was launched using: RESULT: Template: 5DWK.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 : 216 -40032 -185.33 -388.66 target 2D structure prediction score : 0.84 Monomeric hydrophicity matching model chain B : 0.79 3D Compatibility (PKB) : -185.33 2D Compatibility (Sec. Struct. Predict.) : 0.84 1D Compatibility (Hydrophobicity) : 0.79 QMean score : 0.349

(partial model without unconserved sides chains): PDB file : Tito_5DWK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DWK-query.scw PDB file : Tito_Scwrl_5DWK.pdb: