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



Input alignment information:
Query sequenceMRIVQPVIEQLKAQSHPVCHYIYDLVGLEHHLQHITSSLPSNCQMYYAMKANSERTILDTISQYVEGFEVASQGEIAKGL-AFKPANHIIFGGPGKTDEELRYAVSEGVQRIHVESMHELQRLNAILEDEDKTQHILLRVNLAGPFPNATLHMAGRPTQFGISEDEVDDVIEAALVMPNIHLDGFHFHSISNNLDSNLHVDVVKLYFKKAKSWSEKHRFPLKHINLGGGIGVNYADLTSQFEWDNFVENFKTLIVEQEMEDVTLNFECGRFIVAHIGYYVTEVLDIKKVHGAWYAILRGGTQQFRLPVSWQHNHPFEIYRYKDNPYSFEKVSISRQDTTLVGQLCTPKDVFAREVQIDAISTGDVIVFKYAGAYGWSISHHDFLSHPHPEFIYLTQTKEDE
2P3E Chain:A ((22-399))-----GVSLKELAQTFGTPLYVYSSNFIKERFEAYRKAFP-DALICYAVKANFNPHLVKLLGELGAGADIVSGGELYLAKKAGIPPERIVYAGVGKTEKELTDAVDSEILMFNVESRQELDVLNEIAGKLGKKARIAIRVNP---------------SKFGVDIREAQKEYEYASKLENLEIVGIHCHIGSQILDISPYREAVEKVVSLYESL-TQKGFDIKYLDIGGGLGIKYKPEDKEPAPQDLADLLKDLL--V---KAKIILEPGRSIMGNAGILITQVQFLKDKGSKHFIIVDAGMNDLIRPSIYNAYHHI--IPVET-------KE---VVADIVGPICETGDFLALDREIEEVQRGEYLAVLSAGAYGFAMSSH-YNMRPRAAEVLVENG----


General information:
TITO was launched using:
RESULT:

Template: 2P3E.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
3D Compatibility (PKB) -234714 for 3068 contacts (-76.5/contact) +
2D Compatibility (PS) -37521 + (NN) -7485 + (LL) 2628
1D Compatibility (HY) -18800 + (ID) 4450
Total energy: -300342.0 ( -97.90 by residue)
QMean score : 0.524

(partial model without unconserved sides chains):
PDB file : Tito_2P3E.pdb:





(Unconserved sides chains are recalculated) :
Sequence: align-2P3E-query.scw
PDB file : Tito_Scwrl_2P3E.pdb: