Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MNDLSEKVIVIMGASSGIGEATTKLLAEKGAKLVIAARREDRLKAIKESLPEAELYIQTADVRDFAQVQAVIDLAMEKFGRIDVLYNNAGIMPTAPLVEGHRDEWQNMLDINIMGVLNGISAVLPIMEKQKSGHIISTDSVAGHVVYPDSAVYCGTKFAVRAIMEGLRQEQRQNNIKSTIISPGAVQTELYQTISDKKAALELHEAQKEWGLTS--EDIASAVAFAIETPDRMSVSNMIIRPTTQEV 4NBU Chain:B ((8-228)) MSRLQDKVAIITGAANGIGLEAARVFMKEGAKVVIADFNEAAGKEAVEANP-GVVFIRV-DVSDRESVHRLVENVAERFGKIDILINNAGITRDSMLSKMTVDQFQQVINVNLTGVFHCTQAVLPYMAEQGKGKIINTSSVTGTYGNVGQTNYAAAKAGVIGMTKTWAKELARKGINVNAVAPGFTETAMVAEVPEK--VIEKMKAQVPMGRLGKPEDIANAYLF----------------------

General information: TITO was launched using: RESULT: Template: 4NBU.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain B - contact count / total energy / energy per contact / energy per residue : 1186 -115913 -97.73 -529.28 target 2D structure prediction score : 0.70 Monomeric hydrophicity matching model chain B : 0.77 3D Compatibility (PKB) : -97.73 2D Compatibility (Sec. Struct. Predict.) : 0.70 1D Compatibility (Hydrophobicity) : 0.77 QMean score : 0.525

(partial model without unconserved sides chains): PDB file : Tito_4NBU.pdb: (Unconserved sides chains are recalculated) : Sequence: align-4NBU-query.scw PDB file : Tito_Scwrl_4NBU.pdb: