Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKTIHITHPHHLIKEEQAKSVMALGYFDGVHLGHQKVIGTAKQIAEEKGLTLAVMTFHPHPSHVLGRDKEPKDLITPLEDKINQIEQLGTEVLYVVKFNEVFASLSPKQFIDQYIIGLNVQHAVAGFDFTYGKYGKGTMKTMPDDLDGKAGCTM--VEKLTEQDKKISSSYIRTALQNGDVELANVLLGQPYFIKGIVIHGDKRGRTIGFPTANVGLNNSYIVP-PTGVYAVKAEV-NGEVYNGVCNIGYKPTFYEKRPEQPSIEVNLFDFNQEVYGAAIKIEWYKRIRSERKFNGIKELTEQIEKDKQEAIRYFSNLRK 1MRZ Chain:B ((2-277)) --------------------VVSIGVFDGVHIGHQKVLRTMKEIAFFRKDDSLIYTISYPPEYFL---PDFPGLLMTVESRVEMLSRYARTV--VLDFFRI-KDLTPEGFVERYLSG--VSAVVVGRDFRFGKNASGNASFLR-----KKGVEVYEIEDVVVQGKRVSSSLIRNLVQEGRVEEIPAYLGRYFEIEGIV-H---------FPTANIDRGNEKLVDLKRGVYLVRVHLPDGKKKFGVMNVGF----------NVKYEVYILDFEGDLYGQRLKLEVLKFMRDEKKFDSIEELKAAIDQDVKSA---------

General information: TITO was launched using: RESULT: Template: 1MRZ.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1252 -175616 -140.27 -691.40 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain B : 0.75 3D Compatibility (PKB) : -140.27 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.75 QMean score : 0.492

(partial model without unconserved sides chains): PDB file : Tito_1MRZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1MRZ-query.scw PDB file : Tito_Scwrl_1MRZ.pdb: