Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----------------------------------------------------------------------------------------------------------------------MKKKAFGIVL----LVLAAWILLQGNFGIPS--LDGKIWPLLGIVFFAYKSIESILRRHLTSAVFTGLLAIIIANYAYDLLPVTNHSLIWASILVVLGVGYLTHSSKFWNEKK----WWYNGKKTVVTDKEVAFGSGTFYKQD---QDLVDDQ-VEVAFGDAKIYYDNAEMLGDFATLNIEVAFGNATVY-----VPQHWRVDLK-VETSFGAAKADAPVAPTSKTLTIRGDVAFGKLEIVYVK------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ 5JXL Chain:A ((1-851)) MRSLWSGVSGLQAHQVAMDVEGNNISNVNTTGFKYSRADFGTMFSQTVKIATAPTDGRGGSNPLQIGLGVSVSSTTRIHSQGSVQTTDKNTDVAINGDGFFMVSDDGGLTNYLTRSGDFKLDAYGNFVNNAGFVVQGWNINWDDQTIDSSRTPQNIFIDPGMHIPAAKSTEVAIKANLNSGLN-------IGTSSRNLYALDSVH------------GWNTKTQRAEDENDTGTTQFYTTSKNSVEVTEKGVDAGALFNANGTGLNLRDGQGIWVSYADAKFTTDRANGANVFDP-NLTVAQQNNVIFWGNKDIAVTLDINLNGVRIQNDNIRSLDEAIAYINTFTAPTDTRDG-TGVKAVKKADGSGIEFVNNNADGTTDNMKNIDLTVNVGNSAGERNTINYNANTGVFSPQGGNLTTAQNDTDWIAGAAQAGQPQNVKVVTAHKYIYSSNPVTIPPMINPDGGPAFQPNNGNRPTDPASANYWDAIQGSLKNTTERTFRTTEDLRELLQRDARYGVDYNGSGIIDNATPTFDANDINQAVKVVVTENGNFAISNANETSTIPANAGAGAGAATTNPKNMSFNITAYSNKQGTVSTNDAFTKIFKAFDGPLVIGNQIKESEQLKLSAFSAGLEIYDSLGSKHTLEVQFVKQSTTQDGGNEWQMIIRVPEPAEINTTGEGPTNIIVGTARFNNDGSLANYTPKTINFSPNNGAAPNQQIKLSFGTSGSNDGLVSSNSASTLTGQATDGYTSGNLKPDAIRVDDKGNILGEFTNGKTFAVAKIAMASVANNSGLEEIGGNLFKVTANSGNIVVGEAGTGGRGEMKTSALEMSNVDLSRSLTELIIIQRGYQANSKTISTSDQMLQTLIQLKQ

General information: TITO was launched using: RESULT: Template: 5JXL.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 : 443 8516 19.22 41.95 target 2D structure prediction score : 0.36 Monomeric hydrophicity matching model chain A : 0.57 3D Compatibility (PKB) : 19.22 2D Compatibility (Sec. Struct. Predict.) : 0.36 1D Compatibility (Hydrophobicity) : 0.57 QMean score : -0.049

(partial model without unconserved sides chains): PDB file : Tito_5JXL.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5JXL-query.scw PDB file : Tito_Scwrl_5JXL.pdb: