Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence --MGILEYTSQLDIEFKKALGLIFKQELNLERIKQGEVNYSYKVTSEQDIPLYHARIFRYEGHPDTEKLL----WISGELKKRNIPQARILYREKSSINFPNGFMVSNWIEGKNGWQSIKDGAYSLKNFTLETAKILLKIHEIKVASFGWPYGKGWGYYNTYQDRI---------TGLPNNDEFKKLFNNDYLKRKY-VLNIVSLLLKALEKIPFPEQPI--------LAHSDPTPDNIIV--RNDRSLVLIDWDD-SEGSWWVRDYSYLRY-----WSDKPEEIKAGF----FSGYGKIDMNE-------SEIEIAELVEWILQ---SLRLLPYY---KFSFADEGKYQKRMTRLKENVRQLKLLV----------------- 4OCV Chain:A ((24-378)) TNEALFDVASHFALE---------GTVDSIEPYGDGHINTTYLVTT--DGPRYILQRMNTGIFPDTVNLMRNVELVTSTLKAQGKETLDIVR-----------------TTSGDTWAEIDGGAWRVYKFIEHTMSYNLVPNPDVFREAGRAFGDFQNFLSGFDANQLTETIAHFHDTPHRFEDFKKALAADELGRAAGCGPEIEFYLSHADQYAVVMDGLRDGSIPLRVTHNDTKLNNILMDATTGKARAIIDLDTIMPGSMLFDFGDSIRFGASTALEDERDLDKVHFSTELFRAYTEGFVGELRDSITAREAELLPFSGNLLTMECGMRFLADYLEGDVYFATKYP-EHNLVRSRTQIKLVREMEQRADETRAIVADVMETT

General information: TITO was launched using: RESULT: Template: 4OCV.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 : 1286 54445 42.34 188.39 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : 42.34 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.274

(partial model without unconserved sides chains): PDB file : Tito_4OCV.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ocv-query.scw PDB file : Tito_Scwrl_4OCV.pdb: