Modeling by threading (Tito software)
Unconserved sides chains calculation (Scwrl software)
Evaluation (QMean software)



Input alignment information:
Query sequenceMKMTNNTVLITGGSAGIGLELAKRLLELGNEVIICGRSEARLAEAKQQLPN----IHTKQCDVADRSQREALYEWALKEY-PNLNVLVNNAGIQKEIDFKKGTEELFVDGDEI-ELNFQAPVHLSALFTPHLMKQPEAAIVQVTSGLAFNPLAVYPVYCATKAALHSFSLTLRHQLRDTSVEVIEMAPPMVDTGLNQKSRDKQGLTYRGISSEEYVQYFLDGLKEGKQEITNERVEGLRDATRADYDRLFEQMNTQEN
2AE2 Chain:A ((11-196))------TALVTGGSRGIGYGIVEELASLGASVYTCSRNQKELNDCLTQWRSKGFKVEASVCDLSSRSERQELMNTVANHFHGKLNILVNNAGI---VIYKEAKDYTVEDYSLIMSINFEAAYHLSVLAHPFLKASERGNVVFISSVSGALAVPYEAVYGATKGAMDQLTRCLAFEWAKDNIRVNGVGPGVIATSL---------------------------------------------------------------


General information:
TITO was launched using:
RESULT:

Template: 2AE2.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 : 913 -46624 -51.07 -259.02
target 2D structure prediction score : 0.67
Monomeric hydrophicity matching model chain A : 0.75

3D Compatibility (PKB) : -51.07
2D Compatibility (Sec. Struct. Predict.) : 0.67
1D Compatibility (Hydrophobicity) : 0.75
QMean score : 0.489

(partial model without unconserved sides chains):
PDB file : Tito_2AE2.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2AE2-query.scw
PDB file : Tito_Scwrl_2AE2.pdb: