Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MGKVYVFDHPLIQHKLTYIRNENTGTKDFRELVDEVATLMAFEITRDLPLEEVDINTP--VQAAKSKVISGKKLGVVPILRAGLGMVDGILKLIPAAKVGHVGLYRD-PETLKPVEYYVKLPSDVEER--EFIVVDPMLATGGSAVEAIHSLKKRGAKNIRFMCLVAAPEGVEELQKHHSDVDIYIAALDEKLNEKGYIVPGLGDAGDRMFGTK 1XTT Chain:B ((3-216)) ---LYVIDKPITLHILTQLRDKYTDQINFRKNLVRLGRILGYEISNTLDYEIVEVETPLGVKTKGVDITDLNNIVIINILRAAVPLVEGLLKAFPKARQGVIGASR-VPKDMDVYIYYKKIP-DIRAKVDNVIIADPMIATASTMLKVLEEVVKANPKRIYIVSIISSEYGVNKILSKYPFIYLFTVAIDPELNNKGYILPGLGDAGDRAFG--

General information: TITO was launched using: RESULT: Template: 1XTT.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 : 1059 -19240 -18.17 -95.25 target 2D structure prediction score : 0.65 Monomeric hydrophicity matching model chain B : 0.81 3D Compatibility (PKB) : -18.17 2D Compatibility (Sec. Struct. Predict.) : 0.65 1D Compatibility (Hydrophobicity) : 0.81 QMean score : 0.515

(partial model without unconserved sides chains): PDB file : Tito_1XTT.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1XTT-query.scw PDB file : Tito_Scwrl_1XTT.pdb: