Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MQIKIEGIHDDRLHRPLQNIANLFYEECELAYGGEEPADFVISLALSQTDEHVTVSGEVKGTGIKEQHTKFFSPDMTEKEAFKQVKNTISYVYLNLLQAHTGITQKWGILTGIRPTKLLHKKLQSGMSKEQAHAELKKDYLIHDEKIMLMQEIVDRQLAAVPDLYRVKDEVSIYIGIPFCPTKCAYCTFPAYAIQGQAGRVGSFLWGLHYEMQKIGEWLKEHDVKVTTIYFGGG--TPTSITAEEMDLLYEEMVRSFPDVKNIREITVEAGRPDTITEEKLAVLNKYDIDRISINPQSYENETLKAIGRHHTVEETIEKYHLSRQHGMNNINMDLIIGLPGEGVKEFRHSLSETEKLM--PESLTVHTLSFKRASEMTRNKHKYKVAGREEVSQMMEDAVAWTKEHGYVPYYLYRQKNILGNLENVGYSLPGQESIYNIMIMEEVQTIIGIGCGAASKFIDRDTGKITHFANPKDPKSYNERFEHYTDEKIKYLEQIFEKTTKQH 1R30 Chain:A ((75-278)) ----------------------------------------------------------------------------------------------------------------------------------------------------------------------------------ACPEDCKYCPQSSRYKTGLEAERLMEVEQVLESARKAKA----AG--STRFCMGAAWKNPHERDMPYLEQMVQGVKAM-G-------LEACM-TLGTLSESQAQRLANAGLDYYNHNLDT-SPEFYGNIITTRTYQERLDTLEKVRDAGIK-VCSGGIVGL-GETVKDRAGLLLQLANLPTPPESVPINMLVKVKGTPLADND----DVDAFDFIRTIAVARIMMP-----------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 1R30.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 : 965 -66196 -68.60 -330.98 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain A : 0.59 3D Compatibility (PKB) : -68.60 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.355

(partial model without unconserved sides chains): PDB file : Tito_1R30.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1R30-query.scw PDB file : Tito_Scwrl_1R30.pdb: