Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
568584 | 2mf8 RC | 19540 | cing | 1-original | 1 | HADDOCK | distance | NOE | ambi |
!
! HADDOCK AIR restraints for F4 and F5
! F4
!
! HIS 812
assign ( resid 812 and segid A and name NE2)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 812 and segid A and name ND1)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 812 and segid A and name HE2)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! TYR 817
assign ( resid 817 and segid A and name OH)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 817 and segid A and name HH)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! SER 819
assign ( resid 819 and segid A and name OG)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 819 and segid A and name HG)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! ARG 821
assign ( resid 821 and segid A and name NE)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 821 and segid A and name HE)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! SER 822
assign ( resid 822 and segid A and name OG)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 822 and segid A and name HG)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! LEU 823
assign ( resid 823 and segid A and name HD*)
(
( resid 20 and segid B and name C7)
or
( resid 21 and segid B and name C7)
) 2.0 2.0 0.0
!
! SER 824
assign ( resid 824 and segid A and name OG)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 824 and segid A and name HG)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
!F5
!
! HIS 856
assign ( resid 856 and segid A and name NE2)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 856 and segid A and name ND1)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 856 and segid A and name HE2)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! TYR 861
assign ( resid 861 and segid A and name OH)
(
( resid 6 and segid B and name H* and not name *')
or
( resid 7 and segid B and name H* and not name *')
or
( resid 20 and segid B and name H* and not name *')
or
( resid 21 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 861 and segid A and name HH)
(
( resid 6 and segid B and (name O* or name N*) and not name *')
or
( resid 7 and segid B and (name O* or name N*) and not name *')
or
( resid 20 and segid B and (name O* or name N*) and not name *')
or
( resid 21 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! SER 863
assign ( resid 863 and segid A and name OG)
(
( resid 9 and segid B and name H* and not name *')
or
( resid 10 and segid B and name H* and not name *')
or
( resid 17 and segid B and name H* and not name *')
or
( resid 18 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 863 and segid A and name HG)
(
( resid 9 and segid B and (name O* or name N*) and not name *')
or
( resid 10 and segid B and (name O* or name N*) and not name *')
or
( resid 17 and segid B and (name O* or name N*) and not name *')
or
( resid 18 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! ARG 865
assign ( resid 865 and segid A and name HE)
(
( resid 9 and segid B and (name O* or name N*) and not name *')
or
( resid 10 and segid B and (name O* or name N*) and not name *')
or
( resid 17 and segid B and (name O* or name N*) and not name *')
or
( resid 18 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
assign ( resid 865 and segid A and name NE)
(
( resid 9 and segid B and name H* and not name *')
or
( resid 10 and segid B and name H* and not name *')
or
( resid 17 and segid B and name H* and not name *')
or
( resid 18 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
! SER 866
assign ( resid 866 and segid A and name OG)
(
( resid 9 and segid B and name H* and not name *')
or
( resid 10 and segid B and name H* and not name *')
or
( resid 17 and segid B and name H* and not name *')
or
( resid 18 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 866 and segid A and name HG)
(
( resid 9 and segid B and (name O* or name N*) and not name *')
or
( resid 10 and segid B and (name O* or name N*) and not name *')
or
( resid 17 and segid B and (name O* or name N*) and not name *')
or
( resid 18 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
! LEU 867
assign ( resid 867 and segid A and name HD*)
(
( resid 9 and segid B and name C7)
or
( resid 10 and segid B and name C7)
) 2.0 2.0 0.0
!
! SER 868
assign ( resid 868 and segid A and name OG)
(
( resid 9 and segid B and name H* and not name *')
or
( resid 10 and segid B and name H* and not name *')
or
( resid 17 and segid B and name H* and not name *')
or
( resid 18 and segid B and name H* and not name *')
) 2.0 2.0 0.0
!
assign ( resid 868 and segid A and name HG)
(
( resid 9 and segid B and (name O* or name N*) and not name *')
or
( resid 10 and segid B and (name O* or name N*) and not name *')
or
( resid 17 and segid B and (name O* or name N*) and not name *')
or
( resid 18 and segid B and (name O* or name N*) and not name *')
) 2.0 2.0 0.0
!
!
! HADDOCK AIR restraints for RARE - modified for specificity
!
!
! ADE 6
assign ( resid 6 and segid B and name N6)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 6 and segid B and name H6#)
(
( resid 812 and segid A and (name O* or name N*))
or
( resid 817 and segid A and (name O* or name N*))
or
( resid 819 and segid A and (name O* or name N*))
or
( resid 821 and segid A and (name O* or name N*))
or
( resid 822 and segid A and (name O* or name N*))
or
( resid 823 and segid A and (name O* or name N*))
or
( resid 824 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
! ADE 7
assign ( resid 7 and segid B and name N6)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 7 and segid B and name H6#)
(
( resid 812 and segid A and (name O* or name N*))
or
( resid 817 and segid A and (name O* or name N*))
or
( resid 819 and segid A and (name O* or name N*))
or
( resid 821 and segid A and (name O* or name N*))
or
( resid 822 and segid A and (name O* or name N*))
or
( resid 823 and segid A and (name O* or name N*))
or
( resid 824 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
! THY 20
assign ( resid 20 and segid B and name N6)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 20 and segid B and name H3)
(
( resid 812 and segid A and (name O* or name N*))
or
( resid 817 and segid A and (name O* or name N*))
or
( resid 819 and segid A and (name O* or name N*))
or
( resid 821 and segid A and (name O* or name N*))
or
( resid 822 and segid A and (name O* or name N*))
or
( resid 823 and segid A and (name O* or name N*))
or
( resid 824 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
assign ( resid 20 and segid B and name C7)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
! THY 21
assign ( resid 21 and segid B and name O4)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 21 and segid B and name H3)
(
( resid 812 and segid A and (name O* or name N*))
or
( resid 817 and segid A and (name O* or name N*))
or
( resid 819 and segid A and (name O* or name N*))
or
( resid 821 and segid A and (name O* or name N*))
or
( resid 822 and segid A and (name O* or name N*))
or
( resid 823 and segid A and (name O* or name N*))
or
( resid 824 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
assign ( resid 21 and segid B and name C7)
(
( resid 812 and segid A and name H*)
or
( resid 817 and segid A and name H*)
or
( resid 819 and segid A and name H*)
or
( resid 821 and segid A and name H*)
or
( resid 822 and segid A and name H*)
or
( resid 823 and segid A and name H*)
or
( resid 824 and segid A and name H*)
) 2.0 2.0 0.0
!
! ADE 17
assign ( resid 17 and segid B and name N6)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 17 and segid B and name H6#)
(
( resid 856 and segid A and (name O* or name N*))
or
( resid 861 and segid A and (name O* or name N*))
or
( resid 863 and segid A and (name O* or name N*))
or
( resid 865 and segid A and (name O* or name N*))
or
( resid 866 and segid A and (name O* or name N*))
or
( resid 867 and segid A and (name O* or name N*))
or
( resid 868 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
! ADE 18
assign ( resid 18 and segid B and name N6)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 18 and segid B and name H6#)
(
( resid 856 and segid A and (name O* or name N*))
or
( resid 861 and segid A and (name O* or name N*))
or
( resid 863 and segid A and (name O* or name N*))
or
( resid 865 and segid A and (name O* or name N*))
or
( resid 866 and segid A and (name O* or name N*))
or
( resid 867 and segid A and (name O* or name N*))
or
( resid 868 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
! THY 9
assign ( resid 9 and segid B and name O4)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 9 and segid B and name H3)
(
( resid 856 and segid A and (name O* or name N*))
or
( resid 861 and segid A and (name O* or name N*))
or
( resid 863 and segid A and (name O* or name N*))
or
( resid 865 and segid A and (name O* or name N*))
or
( resid 866 and segid A and (name O* or name N*))
or
( resid 867 and segid A and (name O* or name N*))
or
( resid 868 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
assign ( resid 9 and segid B and name C7)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
! THY 10
assign ( resid 10 and segid B and name O4)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
assign ( resid 10 and segid B and name H3)
(
( resid 856 and segid A and (name O* or name N*))
or
( resid 861 and segid A and (name O* or name N*))
or
( resid 863 and segid A and (name O* or name N*))
or
( resid 865 and segid A and (name O* or name N*))
or
( resid 866 and segid A and (name O* or name N*))
or
( resid 867 and segid A and (name O* or name N*))
or
( resid 868 and segid A and (name O* or name N*))
) 2.0 2.0 0.0
!
assign ( resid 10 and segid B and name C7)
(
( resid 856 and segid A and name H*)
or
( resid 861 and segid A and name H*)
or
( resid 863 and segid A and name H*)
or
( resid 865 and segid A and name H*)
or
( resid 866 and segid A and name H*)
or
( resid 867 and segid A and name H*)
or
( resid 868 and segid A and name H*)
) 2.0 2.0 0.0
!
!