Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFITKRRCKQMDLNKRQLQILVVLRNKNHWITSEELAEALGTNKKTIQTEIKNMLAIYEKKIIIQSNKRSGYFLESIESETKQQIIQEVTKHKIYSSMDFRASTIVTYLLFQKGYVSMQKIADIFFLSKTAVSLQIKTILRWIERN-PKLELEVSSTKGLKIIAEENSKRIFLSLVGTETVIQHARFPQQISTIFS-NIMPTVQKTLKEVLISYNYIVSGEDFIRFSRYLVLTILRREEL--LEKTNRYTL---FIPMVETLTKKLSSELPYSFSNQEKQAIENRLLELNYLM-IN-D-------EKNKEIEKNLRAFEQTIIRFLDLPVSLLFHETEFLLTHIKQM--KTRMDAGHN-----TMNHFVQKIISRYPLEIYLIRRFFPIHF---QLRPNLAESAYFVL-------YLAEALNPFRKQGEILIVSNQPISILNTLKKQIQQSMNMWIKECRIEPVYLFKNQSNKITEYDAILTTEQEL-IFEWDDLIYLPSVLDEFESWEIYQILREKLTIVEEKKKTKLLDHYYKEENQIKIHKKIDSIQQLISPSSDLVMLPLNAETLLCCLIKSQVETKITEYQLEIPLIHQQRKIKRVFFVSFDYKRNDILVFFQAVSDLLG 5WAY Chain:A ((9-493)) -------------SHRQLELLELLFEHKRWFHRSELAELLNCTERAVKDDLSHVKSAFPDL-IF-HSSTNGIRIINTDDSDIEMVYH-------HFFKHSTHFSILEFIFF-NEGCQAESICKEFYISSSSLYRIISQINKVIK-RQFQFEVSL---TPVQIIGNERDIRYFFAQYFSEKYYFL-------EWPFENFSSEPLSQLLELVYKETSFPMNLSTHRMLKLLLVTNLYRIKFGHFMEV------FLMQAEGIEGVAQSFESEYNISLDEEVVCQLFVSYFQKMFFIDESLFMKCVKKDSYVEKSYHLLSDFIDQISVKYQIEIENKDN----LIWHLHNTAHLYRQELFTEFILFDQKGNTIRNFQNIFPKFVSDVKKELSHYLETLEVCSSSMMVNHLSYTFITHTKHLVINLLQNQPKLKVLVMSNFDQYHAKFVAETLSYYCSNNFE-LEVWTELELSKESLEDSPYDIIISNFIIPPIE-NKRLIYSNNINTVSLIYLLNAMMFIRLDE---------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5WAY.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 : 1746 -57534 -32.95 -130.76 target 2D structure prediction score : 0.54 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -32.95 2D Compatibility (Sec. Struct. Predict.) : 0.54 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.380

(partial model without unconserved sides chains): PDB file : Tito_5WAY.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5WAY-query.scw PDB file : Tito_Scwrl_5WAY.pdb: