Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MATLKIQDLHVEIEGKEILKGVNLEISTGEIHAIMGPNGTGKSTLSSAIMGHPKYEVTQGTITLDGEDVLEMEVD------------ERARAGLFLAMQYPSEISGVTNAEFIRAAINSRREEGDEIPVMQFIRKLDAKMDILDMDEEMAERYLNEGFSGGEKKRNEILQLLMIEPKLAILDEIDSGLDIDALKVVSKGVNEMRGEGFGCLIITHYQRLLNYITPDFVHVMMQGKVVKEGGPELAKRLEAEGYDWIKQELGIELEEEEAVDQQ 1B0U Chain:A ((5-242)) -NKLHVIDLHKRYGGHEVLKGVSLQARAGDVISIIGSSGSGKSTFLRCINF--LEKPSEGAIIVNGQNINLVRDKDGQLKVADKNQLRLLRTRLTMVFQHFNLWSHMTVLENVMEAPIQVLGL----SKHDARERALKYLAKVGIDE-RAQGKYPVHLSGGQQQRVSIARALAMEPDVLLFDEPTSALDPELVGEVLRIMQQLAEEGKTMVVVTHEMGFAR-HVSSHVIFLHQGKIEEEGDPEQVFG--------------------------

General information: TITO was launched using: RESULT: Template: 1B0U.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output 3D Compatibility (PKB) -101746 for 1828 contacts (-55.7/contact) + 2D Compatibility (PS) -24520 + (NN) -9513 + (LL) 2792 1D Compatibility (HY) -6000 + (ID) 2950 Total energy: -141937.0 ( -77.65 by residue) QMean score : 0.493

(partial model without unconserved sides chains): PDB file : Tito_1B0U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1B0U-query.scw PDB file : Tito_Scwrl_1B0U.pdb: