Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -------------------MKKPVPKIYRTTNWSSYNQALIKRGNISIWFDPKTQWYAQPQGKHGRNQTYSDAAIQCCLMIKSLFRLSLRMVTGFA-----------QSLIKLCGLN--WTAPDYSTLCRRQKRIDIAISYQQSRDG-----------LHLLVDSTGLK---FLGEGEWKRKKHQPAYRRQWRKLHIGIDA--KTLQIRAVQLTTNNVSDSQVLGDLLDQIPLDERIDSVYTEGAYDTKHCRQVILDRDAHAVIPPRKNAKPWKDKKLRS-------------LERNELLKTVKRLGRSLWKKW--SGYHRRSLVETKMHCIK----------------------------- 4NWV Chain:A ((30-384)) SVAPVAKANALRTTSSNSILLKGCDRIVTVVDASTYDAG---SAIVSIPITPDIAYRLGSTARTFQRIKYRSLKFRVNAQCAT--TTAGGYVAGFVKDAADVLPTGTASIPYLMSNTGSFTQPWWKSTVHNVKIPQKLFYTEAPTRGADAVREYCPGQFHVLVDSKPSQICPVTVDLEWVVELHDATFRKESDQTAISAIVADHTLNVYGLPATSNRVGHILISPIGQTPKDLTPTRFATFFGFLPDDKFC--VRIPTPVDVVLTGDNVYQSVEATHIRAYLVNGGLGIDFHLAAYNDTTHTIQPIIPTLWNVYDVTGAVTAPFTSAIYDNHVWTHKDKFVPVSFQDEPIPGTVFDYLYPRS

General information: TITO was launched using: RESULT: Template: 4NWV.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 : 1155 16635 14.40 63.25 target 2D structure prediction score : 0.34 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 14.40 2D Compatibility (Sec. Struct. Predict.) : 0.34 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.145

(partial model without unconserved sides chains): PDB file : Tito_4NWV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NWV-query.scw PDB file : Tito_Scwrl_4NWV.pdb: