Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKKRITFGLLVLMVCVILFVLYVQLRNKDSIPVQSSAIHPEEDRIFFIYSNPFIKESVLLSTSTGERFNRRTFKVADVPYIQTKSYASTDLVLLAEHEPFYYTLEKDVIKEHPLSDPFAFWYEGKDVTIEAYNVDTTGNEIHINDRKTKKEYTLTLPPLVTMGASDENFIYIIQSMSIYVIDRKTEEMIETLSLASYADQFADSEEFIVASSDHKLTVIEKGTWKTTYIAYPEDLEYADTVYYDKESGSFYVAYEDKEGGANLLEYGEDFSIHTYSLKFPYMEAKFKGNLLYIVAQEEHKKGIGGYVGVFDIHSKEMLYQFDLPEEQVKVQDFVVVDNK 5DH1 Chain:A ((218-258)) ---------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------QRFEERVEEISTA-YADQLADTTFALVFGVDGEFAVVNTNAW-------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5DH1.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 : 38 -10347 -272.28 -252.35 target 2D structure prediction score : 0.80 Monomeric hydrophicity matching model chain A : 0.51 3D Compatibility (PKB) : -272.28 2D Compatibility (Sec. Struct. Predict.) : 0.80 1D Compatibility (Hydrophobicity) : 0.51 QMean score : 0.478

(partial model without unconserved sides chains): PDB file : Tito_5DH1.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5DH1-query.scw PDB file : Tito_Scwrl_5DH1.pdb: