Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MFITKRRCKQMDLNKRQLQILVVLRNKNHWITSEELAEALGTNKKTIQTEIKNMLAIYEKKIIIQSNKRSGYFLESIESETKQQIIQEVTKHKIYSSMDFRASTIVTYLLFQKGYVSMQKIADIFFLSKTAVSLQIKTILRWIERNPKLELEVSSTKGLKIIAEENSKRIFLSLVGTETVIQHARFPQQISTIFSNIMPTVQKTLKEVLISYNYIVSGEDFIRFSRYLV-LTILRREELLEKTNRYTLFIPMVETLTKKLSSEL-PYSFSNQEKQAIENRLLELNYLMINDEKNKEIEKNLRAFEQTIIRFLDLPVSLLFHETEFLLTHIKQMKTRMDAGHNTMNHFVQKIISRYPLEIYLIRRFFPIHFQLRPNLAESAYFVLYLAEALNPFRKQGEILIVSNQPISILNTLKKQIQQSMNMWIKECRIEPVYLFKNQSNKITEYDAILTTEQELIFEWDD-LIYLPSVLDEFESWEIYQILREKLTIVEEKKKTKLLDHYYKEENQIKIHKKIDSIQQLISPSSDLVMLPLNAETLLCCLIKSQVETKITEYQLEIPLIHQQRKIKRVFFVSFDYKRNDILVFFQAVSDLLG 4WW4 Chain:A ((3-458)) ------QISEVRGNTRDH------RTAAH-----THIKGLGLNSSGI------------------AEKQAAGFVGQCAAREACGVVVDLIKAHKMAG---------RGVLLAGGPGT----------GKTALALAISQEL-------------------------GTKIPFCPITGSEIYSTEVKKTEVLMENFRRAIGLRVRETKDVYE-------GEV----STLLIGLKSARGQKLDQKERVQVGDVIYIETNTGACRSDAYATEFDLEAEEYVPIPKGEV-------HKKKEIVQDVTLHDLDVANARPDIISMMGQLMK------PKMTEITDKLRMEINKVVQKYINQGVAELIP------------------GVLFIDEAHMLD---------------IECFTYLNKALESPIAP--------IVVLASNRGIATIRGADDLKAAHGIPPDFLQRLLIIPT--HPYEPDEIRRIVRIRAQTEGVQLTDAAVDRVAEHGVRIS----LRYCLQLLAPASILARVNG----------RTQVD---------------VQDIAEAEELFLDARRSANILTS---TGGLH

General information: TITO was launched using: RESULT: Template: 4WW4.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 : 1940 -10741 -5.54 -26.01 target 2D structure prediction score : 0.41 Monomeric hydrophicity matching model chain A : 0.63 3D Compatibility (PKB) : -5.54 2D Compatibility (Sec. Struct. Predict.) : 0.41 1D Compatibility (Hydrophobicity) : 0.63 QMean score : 0.171

(partial model without unconserved sides chains): PDB file : Tito_4WW4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4WW4-query.scw PDB file : Tito_Scwrl_4WW4.pdb: