Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRIKFNMVAKKLALILCSLSFLQTSFAGFERF-WIFSKDANTQVDDTWNALSEEEQRAVIKRYQSLKELPSNQSANLQQRMDWFNQLPDAEKQKMREAWQKMSTQERNDLRQRMLKASADERTAIREEYINKYLEH 3MI6 Chain:A ((615-672)) ---ELDQVKKQVAFYKCYRQLFQ--FGKFYRIDSPFVEDGNVT---SWQVVSDDQKQAIAARYQLL----------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3MI6.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 : 126 -11357 -90.13 -199.24 target 2D structure prediction score : 0.37 Monomeric hydrophicity matching model chain A : 0.72 3D Compatibility (PKB) : -90.13 2D Compatibility (Sec. Struct. Predict.) : 0.37 1D Compatibility (Hydrophobicity) : 0.72 QMean score : 0.100

(partial model without unconserved sides chains): PDB file : Tito_3MI6.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3MI6-query.scw PDB file : Tito_Scwrl_3MI6.pdb: