Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence -----------------------MSAENLSQMGAANVQRLVDQ-----YGQQVIEKCPVSPV---EYAFYERAAEELNSRGIK-----TPT------LLSADPH-PRRLRL----EYIPGKVSQDEVSG---DDILKCLSHLHHTPPDPTWVYHPHSWPEKALEKSLALLRLPDRAAHQMRCFQQAGSVLFRQKCLIS-GDTNAGNWGRRENGEWVLFDWERFGTGSPAIDLAPLVKGMGS-------RQSILQLAERY---------SVHCPHMPARQLATEITLAKAWIVSEVM---SLLYDRNKTDFELYLN-----------WYRETLPGWLDEAISVL------------------------------------ 1FUI Chain:A ((1-355)) MKKISLPKIGIRPVIDGRRMGVRESLEEQTMNMAKATAALLTEKLRHACGAAV--ECVISDTCIAGMAEAAACEEKFSSQNVGLTITVTPCWCYGSETIDMDPTRPKAIWGFNGTER-PGAVYLAAALAAHSQKGIPAFSIYGHDVQDAD----DTSIPADVEEKLLRFAR-AGLAVASM-----------KGKSYLSLGGVSMGIAGSIVDHN--FFE-SWLGMKVQAVDMTELRRRIDQKIYDEAELEMALAWADKNFRYGEDENNKQYQRNAEQSRAVLRESLLMAMCIRDMMQGNSKLADIGRVEESLGYNAIAAGFQGQRHW-TDQYPN-GDTAEAILNSSFDWNGVREPFVVATENDSLNGVAMLMGHQLTGT

General information: TITO was launched using: RESULT: Template: 1FUI.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 : 995 41119 41.33 172.77 target 2D structure prediction score : 0.58 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : 41.33 2D Compatibility (Sec. Struct. Predict.) : 0.58 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.312

(partial model without unconserved sides chains): PDB file : Tito_1FUI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1fui-query.scw PDB file : Tito_Scwrl_1FUI.pdb: