Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ----MANRGNVHQLLKSKEEIEYLVTLHTHRYANMPLPKQLEKKF---WCLNLDRTRQNISKFLASGVLT---YLIFILLALPTDYLVIGVPYITLDFIHCLLSAM-----------NIALAL------LLFWVFAKFTKLSEHFYLAACG--------IVF--------------------------LTIIINAMLLLSVGNMALKNQSMLLLSFLYMLGFILSGIKPLHMLCVGLLAAFLVFAF----------LILLDVNCDYIAL---GRALFGSCILGFSISSMLISRERSLFLNNQLAEINEQILRIEASELLHLSQQDALTQISNRRTFDEMFDFFYYRANQEKRPLAVLFID-----IDFFKNYSDFTGTRWEIKSSLALPQQLKTQ-----------FVMSTLLRVMGARSL-----------LYYYLKH--------------LHRVLIQWLQISIKPLSGKRFLMQLL--------------------------------- 5ERX Chain:A ((22-574)) NPSTTQARVVVDELIRGG--VRDVVLCPGSR--NAPLAFALQDADRSGRIRLHVRIDERTAGYLAIGLAIGAGAPVCVAMTSGTAVANLGPAVVEANYARVPLIVLSANYFGTQVRASISLGLAEDAPERTSALNATWRSATCRVLAAATGARTANAGPVHFDIPLTPPGRPAGKPWTYTPPVTFDQPLDIDLSVDTVVISGHGAGVHPNLAALPTVAEPTAPRSGDNPLHPLALPLLRPQQVIMLGRPTLHRPVSVLLADAEVPVFALTTGPRWPDVSGNSQATGTRAVTTGAPRPAWLDRCAAMNRHAIAAVREQLAAHPLTTGLHVAAAVSHALRPGDQLVLGASNPVRDVALAGLDTRGIRVRSNRGVAGIDGTVSTAIGAALAYEGAHERTGSPDSPPRTIALIGDLTFVHDSSGLLIGPTEPIPRSLTIVVSNDNGGGDVSSRIFGTPHDVDVGALCRAYHVESRQIEVDELGPTLDQPGAGMRVLEVKADRSSLRQLHAAIKAAL

General information: TITO was launched using: RESULT: Template: 5ERX.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 : 1939 -125483 -64.72 -348.56 target 2D structure prediction score : 0.38 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -64.72 2D Compatibility (Sec. Struct. Predict.) : 0.38 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.216

(partial model without unconserved sides chains): PDB file : Tito_5ERX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5ERX-query.scw PDB file : Tito_Scwrl_5ERX.pdb: