Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTRPPTPTADTVRRLVRTLLKDGAADASGPEVRPAAPGADPVTWLVGGRHVLRLARDRDAAARQRRELRLRDLVRTHVPVAVP---VSVAQGEWAPGLAYTLDTRV-PGASGAEHDV---SAVGEADLAGLLTGLREVPARQAETLGVPRAAPRSLEALRAAAEPAAERLAGADEFDAARLRQLTRAAAVQLAAQSAPP---VLVHHALTGGHLVVSADGRVRAVLGWAGTVLGDPAEDIAGLALAVGSPAAVRAATLAGYGARPCLRGLWLARCDAVLQLAARLDGTGTAPLPRLRTRLRHAWEAILLERVTELRAEAGEDGERRA 5IGR Chain:A ((46-240)) ----------------------------------------------GRRWVLRIPRRAEVSAKVEPEARVLAMLKNRLPFAVPDWRVANAELVAYPMLEDSTAMVIQPGSSTPDWVVPQDSEVFAESFATALAALHAVPISAAVDAGMLIRTPTQA---RQKVADDVDRVRREFVVNDKRLHRWQR----WLDDDSSWPDFSVVVHGDLYVGHVLIDNTERVSGMIDWSEARVDDPAIDMAAHLMVFG-------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5IGR.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 : 685 -27595 -40.28 -149.16 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -40.28 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.306

(partial model without unconserved sides chains): PDB file : Tito_5IGR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5igr-query.scw PDB file : Tito_Scwrl_5IGR.pdb: