Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLHQFSRNELAIGKEGLETLKNSTVAVLGVGGVGSFAAEALARSGVGRILLVDKDDVDITNVNRQLHALLSTVGQPKVDLMKARIADINPECEVIALKMFYTEETYEQFFDYGLDYVIDASDTICYKIHLMKECLKRDIPLISSMGAANKTDPTRFQIADISKTHTDPIAKVVRTKLRKEGIKKGVQVIFSDESPIVIREDVRKEVGNDEAKIRKAKMPPSSNAFVPSVAGLIMGGHVVMDLLKDIEIKRVKDK 1JWB Chain:B ((24-161)) --------------DGQEALKDSRVLIVGLGGLGCAASQYLASAGVGNLTLLDFDTVSLSNLQRQTLHSDATVGQPKVESARDALTRINPHIAITPVNALLDDAELAALIAEH-DLVLDCTDNVAVRNQLNAGCFAAKVPLVS--GAA----------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1JWB.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 : 673 -90486 -134.45 -690.73 target 2D structure prediction score : 0.67 Monomeric hydrophicity matching model chain B : 0.69 3D Compatibility (PKB) : -134.45 2D Compatibility (Sec. Struct. Predict.) : 0.67 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.633

(partial model without unconserved sides chains): PDB file : Tito_1JWB.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1JWB-query.scw PDB file : Tito_Scwrl_1JWB.pdb: