Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAGNFDSEERSSWYWGRLSRQEAVALLQG--QRHGVFLVRDSSTSPGDYVLSVSENS---RVSHYIINSSGPRPPVPPSPAQPPPGVSPSRLRIGDQEFDSLPALLEFYKIHYLDTTTLIEPVSRSRQGSGVILRQEEAEYVRALFDFNGNDEEDLPFKKGDILRIRDKPEEQWWNAEDSEGKRGMIPVPYVEKYRPASASVSALIGGNQEGSHPQPLGGPEPGPYAQPSVNTPLPNLQNGPIYARVIQKRVPNAYDKTALALEVGELVKVTKINVSGQWEGECNGKRGHFPFTHVRLLDQQNPDEDFS 3QWX Chain:X ((4-173)) --NGFDPFEWRSFYFPGMSREEAHKLLGEPQVSIGTFLMRDS-SRPGEYSLTVREADEGNAVCHYLIERGEPKE----------DGTAAAGVKIANQSFPDIPALLNHFKMRVLTEASLLAAYKKP-----------IIEVVVGTFKFTGERETDLPFEQGERLEILSKTNQDWWEARNALGTTGLVPANYVQI-------------------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 3QWX.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain X - contact count / total energy / energy per contact / energy per residue : 721 36484 50.60 221.12 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain X : 0.69 3D Compatibility (PKB) : 50.60 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.69 QMean score : 0.533

(partial model without unconserved sides chains): PDB file : Tito_3QWX.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QWX-query.scw PDB file : Tito_Scwrl_3QWX.pdb: