Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNGFMDKL----SEKIMPLANLL---GQNRYLTVLRDAFMLSFPLTMFGSIVVVINNLPFFSDATKGTLSNLFGNGQNATMSIMSVFVTFGIGYYLSKSYDVEGIFGGAVS--FASFLILTPFAMKTAGGEDVTGVLSLDRLGAKGMFI----------GMIAAFLAGEIYCRITKRGWQIKMPDGVPPAVTKPFAALIPAVVTLTIFLVINAVMTGIFNANLHDVVYEVIQKP-LTGLGSSLPATLIALFFVQFLWFFGLHGQIIVNSVMDPIWNTLMLDNLEAYQHGKELPHIITKPFMETFTVGIGGSGMTLAVVLLMAFVLKKKQYRDVGRLALAPGIFNVNEPAIFGLPIVLNATILIPWVVAPLIVTTFNYLVMAAGLVPAPTGVSVPWTVPIIASG-VLATNSWLGGMLQVIDFVIVAFIWYPFLKVLDKQPDLDIA------------ 4K2M Chain:A ((1-442)) AGMQKQVKISGKSKENMSLLKHLKGDVQGKELVIEDSIVNERWKQVLKEKID--IEHDLFNYQKNREISKVPFLPVDRLITNDEVEDILNTLTEVLPTGKFTSGPYLEQFEKVLSTYLHKRYVIATSSGTDAIMIGLLALGLNPGDEVIMPANSFSATENAVLASGGVPIYVDINPQTFCID-PDKIEEAITPYTKFILP--VHLYGKHSDMQHIRQIANRYKLKVIEDACQGIGLTDLGKYADITTLSFNPYKNFGVCGKAGAIATD-------NEELAKKCIQFSYHGFEVNVKNKKVINFGFNSKMDNLQAAIGLERMKYLSLNNFKRLFLADRYITQLAELQNKGYIELPELSEDHVWHLFPIK--VRTEDRADIMTKLNEDFGVQTDVYYPILSHMQKTPLVQDKYAGLQLVHTEKAHSQVLHLPLYPSFTLEEQDRVMEGLFHVIKQEIG

General information: TITO was launched using: RESULT: Template: 4K2M.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 : 2192 -57819 -26.38 -141.37 target 2D structure prediction score : 0.44 Monomeric hydrophicity matching model chain A : 0.60 3D Compatibility (PKB) : -26.38 2D Compatibility (Sec. Struct. Predict.) : 0.44 1D Compatibility (Hydrophobicity) : 0.60 QMean score : 0.114

(partial model without unconserved sides chains): PDB file : Tito_4K2M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4K2M-query.scw PDB file : Tito_Scwrl_4K2M.pdb: