Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----MEMSFIAQDFEKLD------------IIT-VLEGRTQAIIRNH-----FLRYDRVV----RCRVKIITM------------DMFSPYYDLARQLFPCAKIV-LDR---FHI--------------------------VQHLSRAMSRVRVQIM-NQLDRKSHEYKAI---------KRYWKLIQQDSRKLSDKHFYRPTFRMHLTNKEILDKLLSYSQDLKHHYQL---YQLLLFHFQNKEPEK-----FFGLIEDNLKQ--VHPLFQTVFKTFLKDKEKIVNALQLP--------YSNAKLEATNNLIK------LIKRNAFGFRNFENFKKRIFIALNIKKERTKFVLSRA 4Q98 Chain:A ((9-365)) VVETNATVSFIIKSGESRAVGDDLTDAKITKLTAMVYAGQVQEGIKTVEEDGGVLKVEGIPCKSGANRVLVVVANHNYELTGKSLNEVEALTTSLTAENQNAKNLIMTGKSAAFTIKPGSNHYGYPGGTASDNLVSAGTPLAVTRVHAGISFAGVEVNMATQYQNYYSFKPADAKIAALVAKKDSKIFGNSLVSNTNAYLYGVQTPAGLYTPDAAGETYELEASLNTNYAVGAGFYVLESKYDASNELRPTILCIYGKLLDKDGNPLTEPALTDAINAGFCDGDGTTYYPVLVNYDGNGYIYSGAITQGQNKIVRNNHYKISLNITGPGTNTPEN-PQPVQANLNVTCQVTPWVVVNQ

General information: TITO was launched using: RESULT: Template: 4Q98.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain A - contact count / total energy / energy per contact / energy per residue : 1271 14800 11.64 58.27 target 2D structure prediction score : 0.24 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : 11.64 2D Compatibility (Sec. Struct. Predict.) : 0.24 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.085

(partial model without unconserved sides chains): PDB file : Tito_4Q98.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4Q98-query.scw PDB file : Tito_Scwrl_4Q98.pdb: