Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSFLEGKKIVIMGVANKKSIAWGCAEAMLK-QGAEIIYTYQNERMKKSLVKLVGE---EAFTVECDV--SSDESIEKAMNAIGEYAGE-IHGLVHAVAYANKEE-----LSGNVSDISRDGYQLAQDISSYSLIAVSKYAQPFLAPNSG----IVSMTYLGSERAIPNY--NMMGIAKASLEAAIRYLAAEF--SPKGIRVNGISAGAIKTLAVTGVKDYQKLIQLSESRTPDQQG---VTIEEVGNACAFLIS-PLSSGIIGDIIYVDKGVHLS---- 1DFI Chain:A ((1-257)) G-FLSGKRILVTGVASKLSIAYGIAQAMHRE-GAELAFTYQNDKLKGRVEEFAAQLGSD-IVLQCDVAE--DASIDTMFAELGKVWP-KFDGFVHSIGFAPGDQLDGDYVNAVT----REGFKIAHDISSYSFVAMAKACRSM----LNPGSALLTLSYLGAER-AIPNYN-VMGLAKASLEANVRYMAN-AMGP-EGVRVNAISAGPIRTL---------MLAHCEA-VTPI--RRTV-TIEDVGNSAAFLCSD-LSAGISGEVVHVDGGFSIAAMNE

General information: TITO was launched using: RESULT: Template: 1DFI.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 : 1110 -44415 -40.01 -202.81 target 2D structure prediction score : 0.72 Monomeric hydrophicity matching model chain A : 0.81 3D Compatibility (PKB) : -40.01 2D Compatibility (Sec. Struct. Predict.) : 0.72 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.555

(partial model without unconserved sides chains): PDB file : Tito_1DFI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1DFI-query.scw PDB file : Tito_Scwrl_1DFI.pdb: