Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEWNKTKSIFIVAFLILDIFLGYQFFQKWQATGKEYEVIKNDVEHDMKADHITYEGLNKEATEGYRITANQKSFSKEEIEALKDQKPLMDMPSDDHKVTSLKMKFANPIALSKKDIEDDAQALVSSKIQDGEKYKLWKVDKSKKEIIFFQTYEGHYIYQKTDNPSNMIGQVVLHLNG-KNEVVSYDQTTLETFK-------Q-IQKESLITEMDAVELLYYQNQLKEYSTVKSCKFGYVAQYPLTSTQVLAPVWRITVEYEKKVNGEKKTVQEYFTVNALESTILDTDQ 4EXR Chain:A ((75-170)) --------------------------------------------------------------------------------------------------------------------------------------------------------------------------YKMKIDANTKDVLEDKTEKLDSEDLNGVARKEKLDLNDIMTPQQAMEIALKEQ----NGIVKEWSLDKD---------LDVTFYKIRIDKDK---N--E---YDIKVDSKKGTVLKV--

General information: TITO was launched using: RESULT: Template: 4EXR.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 : 236 15464 65.53 177.75 target 2D structure prediction score : 0.40 Monomeric hydrophicity matching model chain A : 0.62 3D Compatibility (PKB) : 65.53 2D Compatibility (Sec. Struct. Predict.) : 0.40 1D Compatibility (Hydrophobicity) : 0.62 QMean score : 0.484

(partial model without unconserved sides chains): PDB file : Tito_4EXR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4EXR-query.scw PDB file : Tito_Scwrl_4EXR.pdb: