Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MDISIIAAQLVKEKVISHNPNSVKALNGGTTSTVYLLDEKYVVKLNEAEVIR----EEAHFLSFYEGNTLFSKLLYKEPLHTYI-----VYSFLEGSTWC-EQGHKRSTLR---------TLVKEVINKYKIVPEADGWGWKENPVQSWNEFLTTN--VMEAYENVRRYISE--EEYRTVLK--LANRDAGVNQPFLLHGDCGFHNFIFRENRLHGVIDPLPV-LGEPLYDLIYAFCSTPEDLTKETIAYAMKQCLFHKKERDLYEEIVIGLYLRIDTCLRHHPKDLEEYLVAWRYWMDEINPAL 4DCA Chain:A ((40-258)) --------------------NELRYLSSGDDSDTFLCNEQYVVKVPKRDSVRISQKRELELYRFLEN----CKLSYQIPAVVYQSDRFNIMKYIKGERITYEQYHKLSEKEKDALAYDEATFLKEL---HSIEIDCSVSLFSDALVNKKDKFLQDKKLLISILEKEQLLTDEMLEHIETIYENILSNAVLFKYTPCLVHNDFSANNMIFRNNRLFGVIDFGDFNVGDPDNDFLCLLDCSTDDFGKE-----------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4DCA.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 : 594 -4382 -7.38 -22.70 target 2D structure prediction score : 0.51 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -7.38 2D Compatibility (Sec. Struct. Predict.) : 0.51 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.282

(partial model without unconserved sides chains): PDB file : Tito_4DCA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4dca-query.scw PDB file : Tito_Scwrl_4DCA.pdb: