Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNDLLATIFTGIIIDENEKNYFVQKNGQTFGLSKSEGEHKIGEAVEGFGYQNQKHENRITTQIPKSRIGHYAFGIVTATRKDLGAFVDIGLPDKDFVVSLDELPTMTELWPKKGDRLMISLRVDAKDRIWGSLADEKIFKSLSKYGTEEMKNKDVIGTAYRLKLTGTYVLTEDFYLGFIHPSERYNEPRLGEQIKGRVIGVRPDGVLNLSLKPRAYEAISDDAQMILTILERSADQQINFTDKSDPEEIMKAFGISKGAFKRALGNLLKQGLITQENGVTKLVKKSN 5D4S Chain:B ((52-82)) -------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ELMQQFGVSRHTIRKAIGDLVSQGLLYSVQG---------

General information: TITO was launched using: RESULT: Template: 5D4S.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 : 42 -9501 -226.20 -306.47 target 2D structure prediction score : 0.61 Monomeric hydrophicity matching model chain B : 0.56 3D Compatibility (PKB) : -226.20 2D Compatibility (Sec. Struct. Predict.) : 0.61 1D Compatibility (Hydrophobicity) : 0.56 QMean score : 0.676

(partial model without unconserved sides chains): PDB file : Tito_5D4S.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5D4S-query.scw PDB file : Tito_Scwrl_5D4S.pdb: