Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MEPSLDMITDESLRTAAAIDFVCQHFSLGELVGIGDRLKGSYNINLKITTT--NGEFVVRFISSSVS-EAHLQYVSKLLAKLENEGIPVPLPVQDEKGMSFVELDGKRVQVTPFVQGRSF-L---CREQQVHSSASMLRRFHHILGDEPPGPL----------PEWSFYHKSSDLRERLNRLRELPT---I--------PSKEHAEVSRVMNRVLHKYDKDASLLPRTIIHGDWHFWNQKYIR--NEVSCVLDFDFVRNGTRLFDIAYSIWVIYLLLP-N---Y-AS-TFDASFLDGYGKL-SD----IEIYLLPAAVSRISLFFLCQSIHSADPAVKWKHQYRKQMPFLDWMEKEGKSRIRSLASAVQA 2QG7 Chain:E ((110-428)) ------------------------------SLEFQIING-ITNILIKVKDMSKQAKYLIRLYGPKTDEIINREREKKISCILYNKNIA-KKIYVFFTN----------GRIEEFMDGYALSREDIKNPKFQKLIAKNLKLLHDIKLNENLYKELQVTQKVPGTRPSFLWNTIWKYF---HLLNEERKKICSFDAKANILKLIDFDVLRDSIVEVESLC--KRENSPIVLCHCDLLSSNIINTVGG-DSISFIDFEYSCPMERAYDIANHFNEYAGFNCDWDLTPSKEEE--YHFIMHYLGTDDEELINQLIREIQPFYICSHINWGLWSLL---------------------------------------

General information: TITO was launched using: RESULT: Template: 2QG7.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain E - contact count / total energy / energy per contact / energy per residue : 925 -4992 -5.40 -20.80 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain E : 0.59 3D Compatibility (PKB) : -5.40 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.59 QMean score : 0.294

(partial model without unconserved sides chains): PDB file : Tito_2QG7.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2qg7-query.scw PDB file : Tito_Scwrl_2QG7.pdb: