Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNKQIGVLQMRMNVESFNLDHTKVKAPYVRVADRKTGAHGDVIIKYDVRFKQPNKEHMDMPSLHSLEHLTAELIRNHADYIVDWSPMGCQTGFYLTVLNHESYEDILDVLEATMKDVL--E-ATEVPASNETQCGWAASHTLEGAQALAREFLAKRDEWSEVEA 4XCH Chain:C ((46-187)) ------------------LDHTIVKAPYIRLISEEVGPKGDIITNFDIRLIQPNENAMDTAGLHTIEHLLAKLIRQRIDGLIDCSPFGCRTGFHMIMWGKQDSEKIAQVIKSSLEEIAEGITWEDVPGTTIESCGNYKDHSLHSAKEWAKLILSQ--GISTD--

General information: TITO was launched using: RESULT: Template: 4XCH.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 : 623 -61561 -98.81 -442.88 target 2D structure prediction score : 0.80 Monomeric hydrophicity matching model chain C : 0.80 3D Compatibility (PKB) : -98.81 2D Compatibility (Sec. Struct. Predict.) : 0.80 1D Compatibility (Hydrophobicity) : 0.80 QMean score : 0.537

(partial model without unconserved sides chains): PDB file : Tito_4XCH.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4XCH-query.scw PDB file : Tito_Scwrl_4XCH.pdb: