Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MLSQIYPQAQHPYSFELNKDMHISAAHFIPRESAG-ACSRVHGHTYTVNITVAGDELDDSGFLVNFSVLKKLVHGNY---DHTLLNDHEDFSQDDRYSLPTTEVVAKTIYDNVQAYLDTLENKPTCVQVFVRETPTSYCVYRPKKGGLNG 3QNA Chain:C ((23-139)) -------------STTLFKDFTFEAAHRLPHVPEGHKAGRLHGHSFMVRLEITGEVDPHTGWIIDFAELKAAFKPTYERLDHHYLNDIPGLEN------PTSEVLAKWIWDQVKPVV------PLLSAVMVKETCTAGCIYR--------

General information: TITO was launched using: RESULT: Template: 3QNA.pdb Alignment : align.pir Tito was launched with SMD and SCWRL Tito text output Monomeric PKB - chain C - contact count / total energy / energy per contact / energy per residue : 464 -76431 -164.72 -676.38 target 2D structure prediction score : 0.68 Monomeric hydrophicity matching model chain C : 0.78 3D Compatibility (PKB) : -164.72 2D Compatibility (Sec. Struct. Predict.) : 0.68 1D Compatibility (Hydrophobicity) : 0.78 QMean score : 0.633

(partial model without unconserved sides chains): PDB file : Tito_3QNA.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3QNA-query.scw PDB file : Tito_Scwrl_3QNA.pdb: