Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNDAQGSLVHELK-SLPCWPAPVQAIRPL-TGLSGGSLLIELCDGRRYVARSQNAQLQMQAVSRERERQVLCAIGEQVARSD---FLPQVLFYNARWLVVSWLEGSPWPHTLA-------------DDACAQRHLVTLMRRFHPVDSE-LQ-LD-----IPSRLQFYRQQLSAEKQ-PEALFSLCARFASLR---SPCWWFPVLAHHDIHPGNVVSDG-AT-LALIDWEYAARSPLACELILLFEANGFNRAQRQQFCRYYAEAIYSTETVYAADSKCVGSSAAALEDWLHRLQQDIASWQPWCEMLMAMWSAIRFEQTDDVQYAVWRDNYLKAAEQSLGKRE 5IWU Chain:A ((1-299)) MSKDIKQVIEIAKKHNLFL--KEETIQFNESGLDFQAVFAQDNNGIDWVLRLPRREDV--MPRTKVEKQALDLV----NKYAISFQAPNWIIYTEELIAYKKLDGVPAGTIDHNIGNYIWEIDINNVPELFHKSLGRVLAELHSIPSNKAAALDLVVHTPEEARMSMKQRMDAVRAKFGVGENLWNRWQAWLNDDDMWPKKTGLIHGDVHAGHTMIDKDANVTGLIDWTEAKVTDVSHDFIFNYRA--FGEEGLEALILAYKEIGGY--------------------Y-WPKMKEHIIELNAAYPVSIAEFALVS----GIEEYEQMAKEALEV---------

General information: TITO was launched using: RESULT: Template: 5IWU.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 : 1190 -29221 -24.56 -109.03 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.66 3D Compatibility (PKB) : -24.56 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.66 QMean score : 0.342

(partial model without unconserved sides chains): PDB file : Tito_5IWU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-5iwu-query.scw PDB file : Tito_Scwrl_5IWU.pdb: