Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MPNQQTIHHFDVIIVGSGGAGLSLALSLPGHFNIAVLAKAALTEASTFYAQGGVAAVLDETDSIQQHINDTMIAGAHLCEMDAVQHTVEGGRPSVDFLLKQGVQFTLDEDEQLHLTREGGHSQRRIIHSADATGKAISTTLVERAKERKNITIFENYIAIDLITSHKLGHTEQTNRAIGLYALDESTEKVHTFLAPFTALACGGAMKAYLYTSNPDIATGDGIAMAYRAGCRVANMEFNQFHPTCLYHPQARSFLITEAMRGEGAYLRLPDGERFMLRFDDRAELAPRDIVARTIDHEIKRLGIRHVWLDITHKSPEFIKEHFPTLYARLLELGIDITKDMIPVVPAAHYTCGGVVVDSNSQTDIEGLYAIGETSYTGLHGANRMASNSLLECFVYGMSAAKDIESKFDKNFKLPEVPTWDDSQVTNPDEDVVILQNWDELRSTMWNYVGIVRTTKRLERALHRIEMLKREITEYYQDYRVSKNLIELRNLVLVSEMIVRCAMHRKESRGLHYTLDYPETSSEIRKTVLTPPNFAVEQPLVNTSV 2E5V Chain:B ((2-456)) -----------IYIIGSGIAGLSAGVALRRAGKKVTLISKRIDGGSTPIAKGGVAASVGSDDSPELHAQDTIRVGDGLCDVKTVNYVTSEAKNVIETFESWGFEF----EEDLRL--EGGHTKRRVLHRTDETGREIFNFLLKLARE-EGIPIIE-----DRLVEIRVKDGKVTGFVTEKRGLVEDVDKL--------VLATGGYSYLYEYSSTQSTNIGDGMAIAFKAGTILADMEFVQFHPTVT-SLDGEVFLLTETLRGEGAQIINENGERFLFNYDKRGELAPRDILSRAI--YIEMLKGHKVFIDLS-KIEDF-ERKFPVVAKYLARHGHNY-KVKIPIFPAAHFVDGGIRVNIRGESNIVNLYAIGEVSDSGLHGANRLASNSLLEGLVFGINLPRYVDSSW-------EGISTDDGIVHSVRISGNKTLSLKEIRRINWENVGIIRNEEKLVKAIN--------------TYSSST-----QNEAIISYLTALAAEIRKESRGNHFREDYP---------------------------

General information: TITO was launched using: RESULT: Template: 2E5V.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 : 2868 -241883 -84.34 -531.61 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain B : 0.74 3D Compatibility (PKB) : -84.34 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.434

(partial model without unconserved sides chains): PDB file : Tito_2E5V.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2E5V-query.scw PDB file : Tito_Scwrl_2E5V.pdb: