Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKKRRLFIRTGILLVLICALGYTIYNAVFAGKESISEGSDAPNFVLEDTNGKRIELSDLKGKGVFLNFWGTWCEPCKKEFPYMANQYKHFKSQGVEIVAVNVGESKIAVHNFMKSYGVNFPVVLDTDRQVLDAYDVSPLPTTFLINPEGKVVKVVTGTMTESMIHDYMNLIKPGETSG 4NMU Chain:C ((12-147)) --------------------------------------GKEAPNFVVTDLEGKKIELKDLKGKGVFLNFWGTWCKPCEKEMPYMNELYPKYKEKGVEIIALDADETDIAVKNFVNQYGLKFPVAIDKGQKIIGTYGVGPLPTSFLIDKDGKVVEQIIGEQTKEQLEGYLKKITP-----

General information: TITO was launched using: RESULT: Template: 4NMU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 656 -89562 -136.53 -658.54 target 2D structure prediction score : 0.81 Monomeric hydrophicity matching model chain C : 0.78 3D Compatibility (PKB) : -136.53 2D Compatibility (Sec. Struct. Predict.) : 0.81 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.725

(partial model without unconserved sides chains): PDB file : Tito_4NMU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NMU-query.scw PDB file : Tito_Scwrl_4NMU.pdb: