Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MASLRSSAIPVSDPASGLRITEIFYSLQGEANASGLPTVFIRLTGCPL-----------RCSYCDTTYSFEGGER-----------LSLEHIIETAEKYQTPYICVTGGEPLAQPNCLILLQRLCDAGFDVSLETSGALDVSR------VDPRVSKVLDLKTPTSGEEHRNLISNLDHLTPRDQIKFVICNREDYEWSKQQ---VEQYQLQTKVSTVWFSPAFAVEKGAVGLPRLARDMAQWILDDKLPVRFQLQLHKLLWNDESGR 4NJI Chain:A ((25-210)) -------------------VKEIFYTLQGEGANAGRPAVFCRFAGCNLWSGREEDRAQAVCRFCDTDFVGTDGENGGKFKDADALVATIAGLWPAGEAHR--FVVCTGGEPMLQLD-QPLVDALHAAGFGIAIETNGSLPVLESIDWICVSPKADAPLVV---TKGNELKVVI-------PQDNQRLADYAKLDFEYFLVQPMDGPSRDLNTKLAIDW-------------------------------------------------

General information: TITO was launched using: RESULT: Template: 4NJI.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 : 775 7925 10.23 51.13 target 2D structure prediction score : 0.52 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : 10.23 2D Compatibility (Sec. Struct. Predict.) : 0.52 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.264

(partial model without unconserved sides chains): PDB file : Tito_4NJI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NJI-query.scw PDB file : Tito_Scwrl_4NJI.pdb: