Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRSFATQQNGIFKSVCSLDCPDQCGLLIHKK-DGKIVKVQGDPDHP-VTAGNICNKVRNMTERIYDEKRLTTPLKRTG-AKGQAIFEPISWKEAIDTITSRWKQLIDEEGAESILPYSFYGN-MGKLTAEGMDRRFFYRMGSSQLE--RTICSKAGSEGYKYTMGISAGIDPEETVHTKLFIFWGINAVSTNMHQ-ITIAQKARKKGAKIVVIDVHKNQTGRLADWFIPIKPGTDSALALGIMHILFKENLHDEAFLSEYTVGYEELREHVKQYDPEKVSTITGVSTEDIYRLAKMYGETSPSFIRIGNGPQHHDNGGMIVRTIACLPAITGQWLHTGGGAIKHNSGI--L---EY---N-------TNAL--QRPDLL-KGR---------TPR----S------FNMNQLGRVL-LETDPPIRSLFIYGTNPAVVAPEANKVRQGLLREDLFTVVHDLFLTETAAYADIVLPATSAFENTDFYTSYWHHYI--QLQQPVIERYGESKSNTEVFRLLAEAMGFTDQELKDSDEVLIRQALDHPDNPHLAEIDYDSLTKHSF-MKAKREK-PLFPGELPTPSGKIELYSEKMKQDGFPALPTYTPLVT--------DNEHPFMYVPGPN-HNFLNSTFSNNEKHIKLEKT-PKLFINTKDAEKHGIVDGAPVRIWNSRGECELTAAVGEQVLPGVVVSQGLWADEQG-----------KKQL-VNALTPD--RLSDMGGGATFFS-GRVQIEKV 2E7Z Chain:A ((1-727)) ----------KKHVVCQ-SCDINCVVEAEVKADGKIQTKSISEPHPTTPPNSICMKSVNADTIRTHKDRVLYPLKNVGSKRGEQRWERISWDQALDEIAEKLKKIIAKYGPESLGVSQTEINQQSEYG---TLRRFMNLLGSPNWTSAMYMCIGNTAGVHRVTHG---SYSFASFADSNCLLFIGKNLSNHNWVSQFNDLKAALKRGCKLIVLDPRRTKVAEMADIWLPLRYGTDAALFLGMINVIINEQLYDKEFVENWCVGFEELKERVQEYPLDKVAEITGCDAGEIRKAAVMFATESPASIPWAVSTDMQKNSCSAIRAQCILRAIVGSFVN-GAEILGAPHSDLVPISKIQMHEALPEEKKKLQLGTETYPFLTYTGMSALEEPSERVYGVKYFHNMGAFMANPTALFTAMATEKPYPVKAFFALASNALMGYANQQN-ALKGLMNQDLVVCYDQFMTPTAQLADYVLPGDHWLERPVVQPNW-EGIPFGNTSQQVVEPAGEAKDEYYFIRELAVRMGLEEHFPWKDRLELINYRIS------PTGMEWEEYQKQYTYMSKLPDYFGPEGVGVATPSGKVELYSSVFEKLGYDPLPYYHEPLQTEISDPELAKEYPLILFAGLREDSNFQSCYHQPGILRDAE-PDPVALLHPKTAQSLGLPSGEWIWVETTHGRLKLLLKHDGAQPEGTIRIPHGRWCPEQEGGPETGFSGAMLHNDAMVLSDDDWNLDPEQGLPNLRGGILAKAYKC

General information: TITO was launched using: RESULT: Template: 2E7Z.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 : 4018 82678 20.58 126.61 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.70 3D Compatibility (PKB) : 20.58 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.472

(partial model without unconserved sides chains): PDB file : Tito_2E7Z.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2E7Z-query.scw PDB file : Tito_Scwrl_2E7Z.pdb: