Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MRKKRVITCVMAASLTLGSLLPAGYASAKEDSKTTPSYEELALHYKMKSEKISSNGKLVEIEYVSGN-ETHKVQMNGNNHTVKVDGIEQKGLNFEYDENVAKRTNYENNNLK----SNEFTTQAAKPKKGYHYVGTLSGHTKAAKNALSVTMSLVGIVPGLGWGSKAATILFSYWAKEQIPDAYYKYDLYEKGAMTDSWYQYATVQFFEDKAHKKKMGKPWTSTPAKVDLPNS 2FNI Chain:A ((74-184)) --RNEIITTPISFVATANMLLESGYTPVFAGIKNDGNIDELALE-KLINERTKA---IVSVDYAGKSVEVESVQKLCKKHS----------LSFLSDSSHALGSEYQNKKVGGFALASVFSFHAIKP----------------------------------------------------------------------------------------------------------

General information: TITO was launched using: RESULT: Template: 2FNI.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 : 485 -7525 -15.52 -70.99 target 2D structure prediction score : 0.47 Monomeric hydrophicity matching model chain A : 0.61 3D Compatibility (PKB) : -15.52 2D Compatibility (Sec. Struct. Predict.) : 0.47 1D Compatibility (Hydrophobicity) : 0.61 QMean score : 0.121

(partial model without unconserved sides chains): PDB file : Tito_2FNI.pdb: (Unconserved sides chains are recalculated) : Sequence: align-2FNI-query.scw PDB file : Tito_Scwrl_2FNI.pdb: