Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTKIQIKQRPLLTRPEQFQGVPPFIAEILARRGVQSEQELELKLKNLLAPELKGLDAAVALMDQAIDEQKKIVIVGDYDADGATSTALMMLVLRDMGAQVDYLVPDRFKYGYGLTPAIAELAHHTYQPDLLITVDNGISSHAGVDAAHALGMQVIITDHHLTTKETPLAEAVVNPNQLGCEFPSKALAGVGVAFYVLANLASLRNRQGKSTSKVTQYLDLVALGTYADVAVLDYNNRILVDAGVKRIQQHQCRVGILALLDIAGREATSIRAQDLGFVLGPRINAAGRMESMRIGIECLLADTMETAYPIAQQLNQLNIDRRQIEGEMKQQALSALDSLQLSQQDIPAALVLFEENWHQGVIGIVAGRLKEQFHRPTIVFAPDEDGIHIKGSARSIDGVHIRDTIEQVAEQHPELVSHFGGHAAAAGLTIRKENFEAFKTVFNDCVAAMDESIFQATLWTDGELPVSALQLDTLNWIEQLGPWGQKFPLPQFEGYFKVIDFRWLKE-THLKLRLAIDQYSFDAIAFNAAGRFEFDPMRDHVHLVYEIDRNVFNGNVSLQLRIVHLNQ 2ZXR Chain:A ((73-529)) ---------------------------------------------------------------------KRIRVHGDYDADGLTGTAILVRGLAALGADVHPFIP----------------------SDLFLTVDC--------------GVEVIVTDHH-T--------LVVHP-ALTPDLKEKP-TGAGVAFLL---LWALHERLGLPPP--LEYADLAAVGTIADVAPLWGWNRALVKEGLARIPASSW-VGLRLLAEAVGYTGKAV---EVAFRIAPRINAASRLGEAEKALRLLLTDDAAEAQALVGELHRLNARRQTLEEAMLRKLLPQADPEA-------KAIVLLDPEGHPGVMGIVASRILEATLRPVFLVA------QGKGTVRSLAPISAVEALRSAE----DLLLRYGGHKEAAGFAMDEALFPAFKARVEAYAARFPDPVREVALLDL--LPEPGLLPQVFRELALLEPYGEGNPEPLFLLFGAPEEARRLGEGRHLAFRLK----GVRVLAWK-QGDLALPP---EVEVAGLLSENAWNGHLAYEVQAVDLRK

General information: TITO was launched using: RESULT: Template: 2ZXR.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 : 2247 -216940 -96.55 -524.01 target 2D structure prediction score : 0.60 Monomeric hydrophicity matching model chain A : 0.74 3D Compatibility (PKB) : -96.55 2D Compatibility (Sec. Struct. Predict.) : 0.60 1D Compatibility (Hydrophobicity) : 0.74 QMean score : 0.428

(partial model without unconserved sides chains): PDB file : Tito_2ZXR.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2ZXR-query.scw PDB file : Tito_Scwrl_2ZXR.pdb: