Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MSNFVFKRGDTFNLNLQLVDMD---ETLQYPPDDVRRAIDLTRYTFTSQVKTLEGAAVATFTCAALNQRTQKGWLN--VKSAASTATWPLG--LCQMDIKAVVGGVVQHTETLVFQVIDGVTA 2XN3 Chain:A ((214-294)) ----------------HLVDMELNCTVLQM--DYSKNALALFVLPKEGQMESVE-AAMSSKTLKKWNRLLQKGWVDLFVPKFSISATYDLGATLLKMGIQ-----------------------

General information: TITO was launched using: RESULT: Template: 2XN3.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 : 160 4166 26.04 56.30 target 2D structure prediction score : 0.20 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : 26.04 2D Compatibility (Sec. Struct. Predict.) : 0.20 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.236

(partial model without unconserved sides chains): PDB file : Tito_2XN3.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2XN3-query.scw PDB file : Tito_Scwrl_2XN3.pdb: