Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MKKAISIFPKEFGFFPYIFLVYTIMPFLSLLKESGVKQGIGYGMLLLFVAAYRQLFCSVGKASFTYWLIVQMAVILMYSVFYNITYIYLGFFPANFVGYYKEKTNFNRAFCALIFILLFPCLYQFIANSVSLRELFSVLPFLVIMLISPFGIRSMFRRIELEAKLAQANEQIKELSKREERVRIARDLHDTLGHTLSLLTLKSQLIQRLAASD----PERTKLEAKEMETSSRSALKQVRELVSDM-------RTVTITEELVNIQHI----LRAGNITFQYEGADDFSVISPVTQNIISMCMREAVTNIIKHSKAT-HCAITIS---QFADKMRIVIRDDGKGAPKE--------------KMFGNGLWGMEERLMLIEGGLTVSD--HNGTVVALTIPLIKKAE 4GCZ Chain:A ((125-373)) ---------------------------------------------------------------------------------------------------------------------------------------------------------DITEHQQTQARLQELQSELVHVSRLSAMGEMASALAHELNQPLAAISNYMKGSRRLLAGSSDPNTPKVESALDRAAEQALRAGQIIRRLRDFVARGESEKRVESLSKLIEEAGALGLAGAREQNVQLRFSLDPG-ADLVLADRVQIQQVLVNLFRNALEAMAQSQRRELVVTNTPAADDMIEVEVSDTGSGFQDDVIPNLFQTFFTTKDTGMGVGLSISRSIIEAHGGRMWAESNASGGATFRFTLPAAD---

General information: TITO was launched using: RESULT: Template: 4GCZ.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 : 569 14344 25.21 67.03 target 2D structure prediction score : 0.76 Monomeric hydrophicity matching model chain A : 0.53 3D Compatibility (PKB) : 25.21 2D Compatibility (Sec. Struct. Predict.) : 0.76 1D Compatibility (Hydrophobicity) : 0.53 QMean score : 0.482

(partial model without unconserved sides chains): PDB file : Tito_4GCZ.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4GCZ-query.scw PDB file : Tito_Scwrl_4GCZ.pdb: