Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MAQAKKSVDIKNIRNFSIIAHIDHGKSTLADRFIQMCGGLQDREMQAQVLDSMELERERGITIKAASVTLYYTHPNGQEYQLNFIDTPGHVDFSYEVSRSLAACEGALLVVDAAQGVEAQSVANCYTAIEQGLEVLPILNKIDLPQAEPERVIHEIEEII---GI----EATNAPTCSAKTGL----------GVEGVLETLVDVIPAPTGDREAPLQALIIDSWFDNYLGVVSLVRIKDGRIRKGDKMLVKSTG---QTHIVTSVGVFNP-KHTETGVLEAGEVGFVIAGIKDIFGAPVGDTITLSTTPEVASLPGFKKVKPQ---VYA-GLFPIDASD--FE---PFREALQKLQINDSALFFEPESSDALGFGFRCGFLGMLHMEIVQERLEREYDLDLISSAPTVVYEAVTKKGDTIYIDSPSKMPDGSVVEDLREPIAECHILVPQEYLGNVMILCIERRGVQKDMKFLG-NQVSITFEIPMAEVVMDFFDKLKSCSRGFASLDYNFIRFESSS---LV--KVDVLINGEKVDALAMICHRNDARHRGIALVDKMKDLIPRQMFDVAIQAAIG-AQIIARST------------VKAMRK-----------NVLAK-----CY---GGD-VSRKKKLLAKQKEGKKRMKQVGSVEIPQEAFLAVLKVER 4ZCI Chain:B ((35-628)) --------MIEKLRNIAIIAHVDHGKTTLVDKLLQQSG-----------------------TILAKNTAIKWND-----YRINIVDTPGHADFGGEVERVMSMVDSVLLVVDAFDGPMPQTRFVTKKAFAYGLKPIVVINKVDRPGARPDWVVDQVFDLFVNLDATDEQLDFPIVYASALNGIAGLDHEDMAEDMTPLYQAIVDHVPAPDVDLDGPFQMQISQLDYNSYVGVIGIGRIKRGKVKPNQQVTIIDSEGKTRNAKVGKVLGHLGLERIETDLAEAGDIVAIT-GLG---ELNISDTVCDTQN--VEALPALSVDEPTVSMFFCVNTSPFCGKEGKFVTSRQILDRLNKELVHNVALRVEET-E--DADAFRVSGRGELHLSVLIENMRRE-GFELAVSRPKVIFREID--------------------GRKQEPYENVTLDVEEQHQGSVMQALGERKGDLKNMNPDGKGRVRLDYVIPSRGL-IGFRSEFMTMTSGTGLLYSTFSHYDDVRPGEVGQRQNGVLIS----------------NGQGKAVAFALFGLQDRGKLFLGHGAEVYEGQIIG-IHSRSNDLTVNCLT------VLVPPIRMTLEQALEFIDDDELVEVTPTSIRIRKR-HLTE-----------------------------

General information: TITO was launched using: RESULT: Template: 4ZCI.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 : 2467 -37250 -15.10 -76.80 target 2D structure prediction score : 0.53 Monomeric hydrophicity matching model chain B : 0.70 3D Compatibility (PKB) : -15.10 2D Compatibility (Sec. Struct. Predict.) : 0.53 1D Compatibility (Hydrophobicity) : 0.70 QMean score : 0.420

(partial model without unconserved sides chains): PDB file : Tito_4ZCI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4ZCI-query.scw PDB file : Tito_Scwrl_4ZCI.pdb: