Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence ------------MDKTSLIGIILAFVALSVGMVLKGVSFSALANPAAILIIIA---GTISAVVIAFPTK---------------------EIKKVPTLFRVLFKENKQLTIEELIPMFSEWAQ-----LARREGL-LALEASIEDVDDAFL-KNGLSMAVDGQSAEFIRDIMTEEVEAMEDRHQAGAAIFTQAGT----YAPTLGVLGAVIGLIAA--------LSHMDNTDELGHAISAAFVATLLGIFTGYVLWHPFAN-------------------------------------KLKRKS---KQEVKLREVMIEG-VLSVL---EGQAPKVIEQKLLM---YLPAKDRLK--FAEQGEAQNGEKKEEEA----- 1ZY7 Chain:A ((8-402)) SRQPIPSEGLQLHLPQVLADAVSRLVLGKFGDLTDNFSSPHARRKVLAGVVMTTGTDVKDAKVISVSTGTKCINGEYMSDRGLALNDCHAEIISRRSLLRFLYTQLELYLNNKDDQKRSIFQKSERGGFRLKENVQFHLYISTSPCGDARIFKARGQLRTKIESGEGTIPVRSNASIQTWDGVLQGERLLTMSCSDKIARWNVVGIQGSLLSIFVEPIYFSSIILGSLYHGDHLSRAMYQRI-SNIEDLPPLYTLNKPLLSGISNAEARQPGKAPNFSVNWTVGDSAIEVINATTGKDELGRASRLCKHALYCRWMRVHGKVPSHLLRSKITKPNVYHESKLAAKEYQAAKARLFTAFIKAGLGAWVEKPTEQDQFSLT

General information: TITO was launched using: RESULT: Template: 1ZY7.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 : 1158 -115763 -99.97 -430.34 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.64 3D Compatibility (PKB) : -99.97 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.64 QMean score : 0.164

(partial model without unconserved sides chains): PDB file : Tito_1ZY7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1ZY7-query.scw PDB file : Tito_Scwrl_1ZY7.pdb: