Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSFPQVELNTNKGRIVLELNTEKAPKTAANF--LEYVRDGF-YDGVIFHRVIDGFMIQGGGF-----------------DENFKEKATRDAIENEADNGLSNDVGTIAMARTQAPHSASAQFFINVKNNSFLNHTSKTAQGWGYAVFGKVVEGMDVVEAIKGVRTGNRGYHADVPLENVVIESAKIISE 4N1M Chain:A ((21-151)) ------------GRVSFELFADKVPKTAENFRALSTGEKGFGYKGSCFHRIIPGFMCQGGDFTRHNGTGGKSIYGEKFEDENFILKHTGPGILSMANAG---------------PNTNGSQFFICTAKTEWLDGK--------HVVFGKVKEGMNIVEAME--RFGSR---------------------

General information: TITO was launched using: RESULT: Template: 4N1M.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 : 483 25422 52.63 229.02 target 2D structure prediction score : 0.59 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 52.63 2D Compatibility (Sec. Struct. Predict.) : 0.59 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.271

(partial model without unconserved sides chains): PDB file : Tito_4N1M.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4N1M-query.scw PDB file : Tito_Scwrl_4N1M.pdb: