Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKVTDTKLTDVKIVEMDVFGDHRGFFTESYSKAKFAEHGL-KYDFVQDNHSLSAEAGVLRGLHFQKGEAAQTK--LIRVVTGAVLDVVVDIRKGSPTYGQWDGFILSEHNHRQLLVPKGYAHGFVTLTPNVNFLYKCDNYYNAEADGGIAFDDPDLAIDWPIDPSRAIMSEKDHRHPTLKEFEAENPFVYGEI 2IXK Chain:A ((4-181)) MKATRLAIPDVILFEPRVFGDDRGFFFESYNQRAFEEACGHPVSFVQDNHSRSA-RGVLRGLHYQIR---QAQGKLVRATLGEVFDVAVDLRRGSPTFGQWVGERLSAENKRQMWIPAGFAHGFVVLSEYAEFLYKTTDFWAPEHERCIVWNDPELKIDWPLQD-APLLSEKDRQGKAFADAD----------

General information: TITO was launched using: RESULT: Template: 2IXK.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 : 915 -16524 -18.06 -94.42 target 2D structure prediction score : 0.55 Monomeric hydrophicity matching model chain A : 0.83 3D Compatibility (PKB) : -18.06 2D Compatibility (Sec. Struct. Predict.) : 0.55 1D Compatibility (Hydrophobicity) : 0.83 QMean score : 0.447

(partial model without unconserved sides chains): PDB file : Tito_2IXK.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2IXK-query.scw PDB file : Tito_Scwrl_2IXK.pdb: