Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGGMTMSQFDQSITLPSGVQLKNRLMLSPMTTQLSFFNGVITEDEITYYKQRSKGLGAVITGAANVQDIGKGWPGELSIAHDEMIPRLSELAKAIQGEGAKAIIQIFHGGRMTSRATLSGEQPVSASAVAAKR--------PDAETPRAMSEEEIVETIQAFGKATRRAIESGFDGIELHGANTYLIQQFFSPHSNRREDQWGGSLENRYRFIEELLTTVFSAVEQYAKKPFIVGYRFSPEEYET--PGIR-FEDTIWLLERLRESKLDYLHVSLNMYDRIARSDKYNDKSILEVVHNTIQGKIPLVGVGGIRNREDVEQVLK-Y-AELAAIGQQMIVDPDWAEKLLENREDEFVTKPFEEAYKELYLPSPLYNFLKARYQ 3GKA Chain:B ((8-341)) ----HMPSLFDPLTIG-DLTLANRIIMAPLTRARAGDTRTPNALMARYYAERA-SAGLIISEATSVTPQGVGYASTPGIWSPEQVDGWRLVTDAVHAAGGRIFLQLWHVGRVSDPVFLDGALPVAPSAIAPGGHVSLVRPQRPYVTPRALELDEIPGVVAAFRRGAENARAAGFDGVEVHGANGYLLDQFLQDSANRRTDAYGGSIENRARLLLEVVDAAIDVWS-----AARVGVHLAPRGDAHTMGDSDPAATFGHVARELGRRRIAFLFARESFG----------GDAIGQQLKAAF--GGPFIVNENF-TLDSAQAALDAGQADAVAWGKLFIANPDLPRRFKLNAPLNEPNAA-----------------------

General information: TITO was launched using: RESULT: Template: 3GKA.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 : 2016 -13473 -6.68 -41.97 target 2D structure prediction score : 0.66 Monomeric hydrophicity matching model chain B : 0.72 3D Compatibility (PKB) : -6.68 2D Compatibility (Sec. Struct. Predict.) : 0.66 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.568

(partial model without unconserved sides chains): PDB file : Tito_3GKA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3GKA-query.scw PDB file : Tito_Scwrl_3GKA.pdb: