Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGSHWVYKLIVYSKLKNKLMLTYDKNEFSLPSYQPELAHVAIVGHINAFVKEHFQ---LKTTVLRCCRQL--ENIRIYEVEILEEESVQFANHVWLTLSQPSDLKKLN---SDDQTILKSWIDTQRSVGIPWFHVGWRNQMERWAAN----------VLSNSSLTFAQIRSWE---RSALFRIISDTQNYYFKAVPDVFNHEPLLSDYLFQHY-PLYVPEIVQVEPN--KNWYIMREI------QGSLLGQTGKIAYWRQAIEQLAVMQKQSTRHIDELKKRNCPVRPVAKVIKSYVKCSFDDLY-ESHHISRETYQ-----KLNTSIPTIINICDKIEKSNIPLALEHGDFFGGNIMVQNGQPVIYDWSDCTLSHPFLSIMVILKEVEQFFSEEVAQSLLNDYLEKWSGFDSKPHLIEEYNWLKVIAPVYYLTIYQTFIFPAFNDNWDKQQIIEGYITEWLTMPML--------- 5T77 Chain:A ((4-470)) LFSSILFSIATFFSRILGLFRDVLFAKYFGVSYELDAYFIAIM--FPFFLRKVFGEGAMSSAFVPLYSEKSGEEKDKFLSSVINGFSLIILALVILSYFFPELIINLFGAGSSHETKILAKKLLLITSPSIYFIFLWAISYSILNTNNKFFWPALTPSISNITIIIGTFLSTKYGIISPTIGFLIGSILMFFSIIKSIIKHKYYFTIKHFPHFLKLFFPTFMTMVVSQINTVVDMNVVSFYDKGSISYLQYASRFYLLPYGLFAVSVSTVVLSKISNDRKNFNYHLNDALKTTLFFTIPSMVGLIFLSTPIIRFFYEHGAFTSKDTLITSKILIAYTL---GLPFYGIYSTISRSYHAIKNTKTPFIAATIVSLSNIILDIIFGLKY--GPIGVALATSIAGIIGVLYLLFSVKTFPIKDFLKISLNSLIMLFVIYLTDFTD--NEFWFLIQILIGILVYLIFSSIFYRDLIRRFL

General information: TITO was launched using: RESULT: Template: 5T77.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 : 2014 -110996 -55.11 -263.02 target 2D structure prediction score : 0.48 Monomeric hydrophicity matching model chain A : 0.65 3D Compatibility (PKB) : -55.11 2D Compatibility (Sec. Struct. Predict.) : 0.48 1D Compatibility (Hydrophobicity) : 0.65 QMean score : 0.117

(partial model without unconserved sides chains): PDB file : Tito_5T77.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5t77-query.scw PDB file : Tito_Scwrl_5T77.pdb: