Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------MIHKHETRELVAIEE-------------------LVMSWIEAFKSLSYFGIFLALSI---------EFIPAEVVLPLAGYWVS--KGDMTLAGVVLAGSLGGV--AGP--------LTLYWIGRYG--GRPFLERFGKYLFIKPEALDK----------SDNFFKKH-------GGFVAFSGRFLPGIRTL------ISIPCGIAKMNVWVFSLYTFIA-------------MLPITFVYV--------YLGVKLGENWKAVGSILDQYMLPIGIAILALFLLYLLMKKRKKRTHSEQLSVFLK----NKR--------- 4LK4 Chain:A ((32-372)) RIINGSNANSAEWPSIVALVKRGADAYQGQFCGGSFLGGRYVLTAAHCFDSRSAASVDVIIGAYDLNNSSQGERIAAQKIYRHLSYSPSNLLNDIAIVELAQTSSLPAITLAGPATRTSLPALTPLTVAGWGITFTPILQEVDVDLVSQSLCQIVMQHGISSDPNSTNFCAARLTQGDAGGPIVVKTGREQLGIVSWGDEQGTYGVYTNVSYFRDWITKHTNQLSYDQVANLGIRPLGKVSQSFTYTNLDANALTYTGNTFSSLPADFSVLSDGCSTKVTLATGESCSVEVAVDAQHYRQYQYDFELIFSYAGGSKRATSRIQLDT

General information: TITO was launched using: RESULT: Template: 4LK4.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 : 996 -138144 -138.70 -625.08 target 2D structure prediction score : 0.36 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -138.70 2D Compatibility (Sec. Struct. Predict.) : 0.36 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.133

(partial model without unconserved sides chains): PDB file : Tito_4LK4.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4LK4-query.scw PDB file : Tito_Scwrl_4LK4.pdb: