Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLKKVILAAFILVGSTLGAFSFSSDASAKHVNGNITWYNGVGKKGSSGKKLGHWDC--AT-KIGFDV------P-RNGTKIRAYAKAK----------PKKVITV---YKNDVGRM------------------PNAVLDVSPKAFKALGY-PLSKGKVAGHYSY 3X2M Chain:A ((8-139)) ---------------------------QATGQASFTMYSGC-GSPACGKAA--SGFTAAINQLAFGSAPGLGAGDACGRCFALTG-NHDPYSPNYTGPFGQTIVVKVTDLCPVQGNQEFCGQTTSNPTNQHGMPFH--FDICEDTGGSAKFFPSGHGALTGTFTE

General information: TITO was launched using: RESULT: Template: 3X2M.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 : 432 -38079 -88.15 -423.10 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -88.15 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.416

(partial model without unconserved sides chains): PDB file : Tito_3X2M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3X2M-query.scw PDB file : Tito_Scwrl_3X2M.pdb: