Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software) Input alignment information: Query sequence MTGHGMAGDDWQYRKTMPQNILRPTVEAALPHVAGAEWEPLAGGRTNPVFKINADAPLVCKLSCLSGETPLFGNRALDEAAILKHLEG-SGL-APSLTDVLAVPE--GE-ILIYSFVEGDILTQ-------------TIPAAVRILRQVHQAEIPDNLPRLD--GSSAAII---QKTKAILETLPV-QKAM--AISFAEPKVE--LPDTLVPRLIHGDPVPANFIQSK--G-KLTLIDWQCPAIGDPCEDLAIALSPAMNAVYGDGPLTPQQMKECLNAYGD-RTV--SDRYRKLAPLFHWRMAAYCAWKVEQGDKDYAAGVKLELAALK 3N4U Chain:A ((3-297)) ---------------TYTFDQVEKAIEQLYPDFTINTIEISGEGNDCIAYEI--NRDFIFKFPKH--S--RGSTNLFNEVNILKRIHNKLPLPIPEVVFTGMPSETYQMSFAGFTKIKGVPLTPLLLNNLPKQSQNQAAKDLARFLSELHSINISG-FKSNLVLDFREKINEDNKKIKKLLSRELKGPQMKKVDDFYRD-ILENEIYFKYYPCLIHNDFSSDHILFDTEKNTICGIIDFGDAAISDPDNDFISLMEDD-------EEYGMEFVSKILNHYKHKDIPTVLEKYRMKEKYWSFEKIIYGKE---YGYMDWYEEGLNEIRS--

General information: TITO was launched using: RESULT: Template: 3N4U.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 : 1133 -7620 -6.73 -29.20 target 2D structure prediction score : 0.62 Monomeric hydrophicity matching model chain A : 0.67 3D Compatibility (PKB) : -6.73 2D Compatibility (Sec. Struct. Predict.) : 0.62 1D Compatibility (Hydrophobicity) : 0.67 QMean score : 0.401

(partial model without unconserved sides chains): PDB file : Tito_3N4U.pdb: (Unconserved sides chains are recalculated) : Sequence: align-3n4u-query.scw PDB file : Tito_Scwrl_3N4U.pdb: