Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKNILRAMVILLIICGTYVLFIQYGSVPEKKSNDSEPQVSNEEAQSGKRIHMPTSGLLSFMGKHADEVTKKLGEPERIDPSAYDYDWWVYNQGK--------DQYIQIGVL-NNKVVTLFASGNDINAKPFKIGESTGEVFKTTQVAPFVNVEYKGNSYRFEFSEEDINTRPTVKVGKMYVQLYMDKFEGKLSSIRAFDAQTFVKQRPYEVVYRGELIKPKAVSDEKWKKIQTTSEKQILDLTNVIRVKHGLAKLEWDQPTAEVAFGHSEDMKENNYFSHVSKKYGSLKDRLEEGHVDFQQAGENIAYNYVDGPAAVEGWLNSEGHRKALLNSDYTHLGVGVDRKYYTQNFIKRW 5D0O Chain:E ((44-110)) --------------------------------------------------------SKIRVGMTQQQVAYALGTPLMSDPF--GTNTWFYVFRQQPGHEGVTQQTLTLTFNSSGVLTNIDNKPAL--------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 5D0O.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 193 -22419 -116.16 -386.53 target 2D structure prediction score : 0.74 Monomeric hydrophicity matching model chain E : 0.54 3D Compatibility (PKB) : -116.16 2D Compatibility (Sec. Struct. Predict.) : 0.74 1D Compatibility (Hydrophobicity) : 0.54 QMean score : 0.544

(partial model without unconserved sides chains): PDB file : Tito_5D0O.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5D0O-query.scw PDB file : Tito_Scwrl_5D0O.pdb: