Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKKIALTLCPAIVGSLLFFTAPASAHVSV-KPAESAAGSWETYTMKVPSEK----------N-LPTTKVVLKMPKDVEFQQYEPIPGWKVSTQKHDDKS---------VSVTWEATDGGIQEGQFQQFTFVAKNPD--KAEEAAWDAYQYYKDGSIVEWTGDEDADTPHSITNITSAKQVTDEHGATKTEDDSENSGSSALDITAMVLSAAAIILSVAALVKKKRA 1Q90 Chain:A ((31-149)) ---------------------------VEIEVPQAVLPDTVFEAVIELPYDKQVKQVLANGKKGDLNVGMVLILPEGFELAP---PDRVPAEIKEKVGNLYYQPYSPEQKNILVV---GPVPGKKYSEMVVPILSPDPAKNKNVSYLKYPIY---------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1Q90.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 : 369 -31890 -86.42 -332.19 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -86.42 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.275

(partial model without unconserved sides chains): PDB file : Tito_1Q90.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1Q90-query.scw PDB file : Tito_Scwrl_1Q90.pdb: