Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKISHLCMLLLLLCTTFFVFNVNYTREVVRIQEMGKTVDSLDLYLKDINEPAASVLRFFEDVSKEYKVSIIKTDSGDEVVKSGVFDKDTFPYQEFGISSLDFTTDGEGVYSNKEISNKLGTIPTFLKAKPIQLMTFQTYIKDTSRSLNGRYTITSTQEMDKDRIVQKWSDFFKIDQATLLEPTYKSAVEVINRDLLLSAIVFVLAILLL------VLVTVYQPMMEMKRVGVQKLLGFQDRAVLADVVKGNLYLLLGGALVINLGVFFLLDYKPKDLFPMLWLSHFLLLQLYLFISWLTYLLIQ-KMTISSLLKGFSSFKFGLIFNYVMKIG--TTILLT----------ALLIGVGRSLEQENKELAYQQQWVSQGNYLTLETFKLNDNLWQEELAGSGKSTDY-FYRFYQDLVEKTQAGYVQSSSLPVKNFVQSEQIQQY-------------QLTDTVDVYYANRNFLKSKGFKLPDTGIKKVILMPASTKGEEDKNQL--LGKLIAFHSMKYEEQQKRTIEEMDVEIAYYEGDWSFFPYSDKRKENLSNPIISLVNDSDMMWDEKASLSTTGLNNPIKIENTVQHQKEITELVEKLSDGNYLKFSSIQAIQQEKVDSYRDAVRNFNLLFALFGLLSMMISYFLLVTTFLLKRRDIITKKFMGWKLVDRYRPLLVLLLLGYSFPLLVLIFFAHAFLPLLLFAGFTCLDILFVLGLASRMEKRSLVELLKGGIL 4IC4 Chain:A ((625-996)) -----------------------------------------------------------------------------------------------------------------KSVTRR-NDIPEAAASPPSLLSFLRKNVGKDLSSIA--MPVTSNEPIS---ILQLISETFEY--APLLTKATQRP------DPITFVSAFAISFLSIYRDKTRTLRKPFNPLLAETFELIREDMGFR---LISEKVSHRPPVFAFFAEHLDWECSYTVTPSQKFWGKSIELNNEGILRLKFKTTGELFEWTQPTTILKNLIAGERYMEPVNEFEVHSSKGDKSHILFDKAGMFSGRSEGFKVSIIPPPSSNRKKETLAGKWTQ-----SLANETTHETIWEVGDLVSNPKKKYGFTKFTANLNEITE---IEKGNLPPTDSRLRPDIRAYEEGNVDKAEEWKLKLEQLQRERRNKGQDVEPKYFEKVSKNEWKYITGPKSYWERRKKHDWSDISQLW-----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4IC4.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 : 1815 -24337 -13.41 -72.22 target 2D structure prediction score : 0.33 Monomeric hydrophicity matching model chain A : 0.58 3D Compatibility (PKB) : -13.41 2D Compatibility (Sec. Struct. Predict.) : 0.33 1D Compatibility (Hydrophobicity) : 0.58 QMean score : 0.135

(partial model without unconserved sides chains): PDB file : Tito_4IC4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4IC4-query.scw PDB file : Tito_Scwrl_4IC4.pdb: