Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRISDQVVMKLQALIEERHMKKGDRLPAERQLATSLGVSRPSLREAIQQLNSQGVLISRRGDGTYIQQLPEQWPQQLIVNPISNLIEEDPLYRFDVQEARLVLEGGTAWYAALRSTPEDRAKIHHYFNEISRHQNAGDSAQAAVADAEFHLAIAEASHNVVLIQMMRSLFDLLQYNVLLGRKKVYNDPVNGDLLSEQHFQVMDAIDRKDPEAARQAVCGHIEFVINHVRSLDEDEARQKRANRLNRVDSK 1E2X Chain:A ((10-231)) QSPAGFAEEYIIESIWNNRFPPGTILPAERELSELIGVTRTTLREVLQRLARDGWLTIQHGKPTKVNNFWETSG----LNILETLARLDHESVPQLIDNLLSVRTNISTIFIRTAFRQHPDKAQEVLATANEVAD--HADAFAELDYNIFRGLAFASGNPIYGLILNGMKGLYTRIGRHY----FANPEARSLALGFYHKLSALCSEGAHDQVYETVRRYGHESGEIWHRMQ------------------

General information: TITO was launched using: RESULT: Template: 1E2X.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 : 892 -112523 -126.15 -506.86 target 2D structure prediction score : 0.64 Monomeric hydrophicity matching model chain A : 0.68 3D Compatibility (PKB) : -126.15 2D Compatibility (Sec. Struct. Predict.) : 0.64 1D Compatibility (Hydrophobicity) : 0.68 QMean score : 0.533

(partial model without unconserved sides chains): PDB file : Tito_1E2X.pdb: (Unconserved sides chains are recalculated) : Sequence: align-1E2X-query.scw PDB file : Tito_Scwrl_1E2X.pdb: