NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
4703 1fl8 cing 1-original 4 DISCOVER dihedral angle


#NMR_dihedral

!alpha (-68) (-46)
!backbone, do not constrain turn residue 33
1:U_27:O3*         1:C_28:P           1:C_28:O5*         1:C_28:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:C_28:O3*         1:A_29:P           1:A_29:O5*         1:A_29:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:A_29:O3*         1:G_30:P           1:G_30:O5*         1:G_30:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:G_30:O3*         1:A_31:P           1:A_31:O5*         1:A_31:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:A_31:O3*         1:C_32:P           1:C_32:O5*         1:C_32:C5*        -138.000 -16.000 100.00 100.00 1000.000
1:C_32:O3*         1:U_33:P           1:U_33:O5*         1:U_33:C5*        -138.000 -16.000 100.00 100.00 1000.000 

1:U8U_34:O3*       1:U_35:P           1:U_35:O5*         1:U_35:C5*        -138.000 -16.000 100.00 100.00 1000.000
1:U_35:O3*         1:U_36:P           1:U_36:O5*         1:U_36:C5*        -138.000 -16.000 100.00 100.00 1000.000
1:U_36:O3*         1:T6A_37:P         1:T6A_37:O5*       1:T6A_37:C5*      -138.000 -16.000 100.00 100.00 1000.000
1:T6A_37:O3*       1:A_38:P           1:A_38:O5*         1:A_38:C5*        -138.000 -16.000 100.00 100.00 1000.000
1:A_38:O3*         1:PSU_39:P         1:PSU_39:O5*       1:PSU_39:C5*      -138.000 -16.000 100.00 100.00 1000.000
1:PSU_39:O3*       1:C_40:P           1:C_40:O5*         1:C_40:C5*        -138.000 -16.000 100.00 100.00 1000.000
1:C_40:O3*         1:U_41:P           1:U_41:O5*         1:U_41:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:U_41:O3*         1:G_42:P           1:G_42:O5*         1:G_42:C5*         -98.000 -38.000 100.00 100.00 1000.000
1:G_42:O3*         1:A_43:P           1:A_43:O5*         1:A_43:C5*         -98.000 -38.000 100.00 100.00 1000.000

!beta (178) (-147)
1:C_28:P           1:C_28:O5*         1:C_28:C5*         1:C_28:C4*         148.000 -158.000 100.00 100.00 1000.000
1:A_29:P           1:A_29:O5*         1:A_29:C5*         1:A_29:C4*         148.000 -158.000 100.00 100.00 1000.000
1:G_30:P           1:G_30:O5*         1:G_30:C5*         1:G_30:C4*         148.000 -158.000 100.00 100.00 1000.000
1:A_31:P           1:A_31:O5*         1:A_31:C5*         1:A_31:C4*         148.000 -158.000 100.00 100.00 1000.000 
1:C_32:P           1:C_32:O5*         1:C_32:C5*         1:C_32:C4*         100.000 -117.000 100.00 100.00 1000.000 
1:U_33:P           1:U_33:O5*         1:U_33:C5*         1:U_33:C4*         100.000 -117.000 100.00 100.00 1000.000 

1:U_35:P           1:U_35:O5*         1:U_35:C5*         1:U_35:C4*         100.000 -117.000 100.00 100.00 1000.000
1:U_36:P           1:U_36:O5*         1:U_36:C5*         1:U_36:C4*         100.000 -117.000 100.00 100.00 1000.000
1:T6A_37:P         1:T6A_37:O5*       1:T6A_37:C5*       1:T6A_37:C4*       100.000 -117.000 100.00 100.00 1000.000
1:A_38:P           1:A_38:O5*         1:A_38:C5*         1:A_38:C4*         100.000 -117.000 100.00 100.00 1000.000

1:C_40:P           1:C_40:O5*         1:C_40:C5*         1:C_40:C4*         148.000 -158.000 100.00 100.00 1000.000
1:U_41:P           1:U_41:O5*         1:U_41:C5*         1:U_41:C4*         148.000 -158.000 100.00 100.00 1000.000
1:G_42:P           1:G_42:O5*         1:G_42:C5*         1:G_42:C4*         148.000 -158.000 100.00 100.00 1000.000
1:A_43:P           1:A_43:O5*         1:A_43:C5*         1:A_43:C4*         148.000 -158.000 100.00 100.00 1000.000

!gamma (54) (36)
1:U_27:O5*         1:U_27:C5*         1:U_27:C4*         1:U_27:C3*         24.000 84.000 100.00 100.00 1000.000
1:C_28:O5*         1:C_28:C5*         1:C_28:C4*         1:C_28:C3*         24.000 84.000 100.00 100.00 1000.000
1:A_29:O5*         1:A_29:C5*         1:A_29:C4*         1:A_29:C3*         24.000 84.000 100.00 100.00 1000.000
1:G_30:O5*         1:G_30:C5*         1:G_30:C4*         1:G_30:C3*         24.000 84.000 100.00 100.00 1000.000
1:A_31:O5*         1:A_31:C5*         1:A_31:C4*         1:A_31:C3*         24.000 84.000 100.00 100.00 1000.000
1:C_32:O5*         1:C_32:C5*         1:C_32:C4*         1:C_32:C3*          0.000 103.000 100.00 100.00 1000.000
1:U_33:O5*         1:U_33:C5*         1:U_33:C4*         1:U_33:C3*          0.000 103.000 100.00 100.00 1000.000

1:U_35:O5*         1:U_35:C5*         1:U_35:C4*         1:U_35:C3*          0.000 103.000 100.00 100.00 1000.000
1:U_36:O5*         1:U_36:C5*         1:U_36:C4*         1:U_36:C3*          0.000 103.000 100.00 100.00 1000.000
1:T6A_37:O5*       1:T6A_37:C5*       1:T6A_37:C4*       1:T6A_37:C3*        0.000 103.000 100.00 100.00 1000.000
1:A_38:O5*         1:A_38:C5*         1:A_38:C4*         1:A_38:C3*          0.000 103.000 100.00 100.00 1000.000

1:C_40:O5*         1:C_40:C5*         1:C_40:C4*         1:C_40:C3*         24.000 84.000 100.00 100.00 1000.000
1:U_41:O5*         1:U_41:C5*         1:U_41:C4*         1:U_41:C3*         24.000 84.000 100.00 100.00 1000.000
1:G_42:O5*         1:G_42:C5*         1:G_42:C4*         1:G_42:C3*         24.000 84.000 100.00 100.00 1000.000
1:A_43:O5*         1:A_43:C5*         1:A_43:C4*         1:A_43:C3*         24.000 84.000 100.00 100.00 1000.000

!delta (H3*-H4* coupling)
1:U_27:C5*         1:U_27:C4*         1:U_27:C3*         1:U_27:O3*         60.000 100.000 100.00 100.00 1000.000
1:C_28:C5*         1:C_28:C4*         1:C_28:C3*         1:C_28:O3*         60.000 100.000 100.00 100.00 1000.000
1:A_29:C5*         1:A_29:C4*         1:A_29:C3*         1:A_29:O3*         60.000 100.000 100.00 100.00 1000.000
1:G_30:C5*         1:G_30:C4*         1:G_30:C3*         1:G_30:O3*         60.000 100.000 100.00 100.00 1000.000
1:A_31:C5*         1:A_31:C4*         1:A_31:C3*         1:A_31:O3*         60.000 100.000 100.00 100.00 1000.000
1:C_32:C5*         1:C_32:C4*         1:C_32:C3*         1:C_32:O3*         60.000 100.000 100.00 100.00 1000.000

1:T6A_37:C5*       1:T6A_37:C4*       1:T6A_37:C3*       1:T6A_37:O3*       60.000 100.000 100.00 100.00 1000.000
1:A_38:C5*         1:A_38:C4*         1:A_38:C3*         1:A_38:O3*         60.000 100.000 100.00 100.00 1000.000
1:PSU_39:C5*       1:PSU_39:C4*       1:PSU_39:C3*       1:PSU_39:O3*       60.000 100.000 100.00 100.00 1000.000
1:C_40:C5*         1:C_40:C4*         1:C_40:C3*         1:C_40:O3*         60.000 100.000 100.00 100.00 1000.000
1:U_41:C5*         1:U_41:C4*         1:U_41:C3*         1:U_41:O3*         60.000 100.000 100.00 100.00 1000.000
1:G_42:C5*         1:G_42:C4*         1:G_42:C3*         1:G_42:O3*         60.000 100.000 100.00 100.00 1000.000
1:A_43:C5*         1:A_43:C4*         1:A_43:C3*         1:A_43:O3*         60.000 100.000 100.00 100.00 1000.000

!epsilon (-153) (155)
1:U_27:C4*         1:U_27:C3*         1:U_27:O3*         1:C_28:P           177.000 -123.000 100.00 100.00 1000.000
1:C_28:C4*         1:C_28:C3*         1:C_28:O3*         1:A_29:P           177.000 -123.000 100.00 100.00 1000.000
1:A_29:C4*         1:A_29:C3*         1:A_29:O3*         1:G_30:P           177.000 -123.000 100.00 100.00 1000.000
1:G_30:C4*         1:G_30:C3*         1:G_30:O3*         1:A_31:P           177.000 -123.000 100.00 100.00 1000.000
1:A_31:C4*         1:A_31:C3*         1:A_31:O3*         1:C_32:P           125.000 -89.000 100.00 100.00 1000.000 
1:C_32:C4*         1:C_32:C3*         1:C_32:O3*         1:U_33:P           125.000 -89.000 100.00 100.00 1000.000
1:U_33:C4*         1:U_33:C3*         1:U_33:O3*         1:U8U_34:P         125.000 -89.000 100.00 100.00 1000.000
1:U8U_34:C4*       1:U8U_34:C3*       1:U8U_34:O3*       1:U_35:P           125.000 -89.000 100.00 100.00 1000.000
1:U_35:C4*         1:U_35:C3*         1:U_35:O3*         1:U_36:P           125.000 -89.000 100.00 100.00 1000.000 
1:U_36:C4*         1:U_36:C3*         1:U_36:O3*         1:T6A_37:P         125.000 -89.000 100.00 100.00 1000.000 
1:T6A_37:C4*       1:T6A_37:C3*       1:T6A_37:O3*       1:A_38:P           125.000 -89.000 100.00 100.00 1000.000 
1:A_38:C4*         1:A_38:C3*         1:A_38:O3*         1:PSU_39:P         125.000 -89.000 100.00 100.00 1000.000 
1:PSU_39:C4*       1:PSU_39:C3*       1:PSU_39:O3*       1:C_40:P           177.000 -123.000 100.00 100.00 1000.000
1:C_40:C4*         1:C_40:C3*         1:C_40:O3*         1:U_41:P           177.000 -123.000 100.00 100.00 1000.000
1:U_41:C4*         1:U_41:C3*         1:U_41:O3*         1:G_42:P           177.000 -123.000 100.00 100.00 1000.000
1:G_42:C4*         1:G_42:C3*         1:G_42:O3*         1:A_43:P           177.000 -123.000 100.00 100.00 1000.000

!zeta (-71) (-96)
1:U_27:C3*         1:U_27:O3*         1:C_28:P           1:C_28:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:C_28:C3*         1:C_28:O3*         1:A_29:P           1:A_29:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:A_29:C3*         1:A_29:O3*         1:G_30:P           1:G_30:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:G_30:C3*         1:G_30:O3*         1:A_31:P           1:A_31:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:A_31:C3*         1:A_31:O3*         1:C_32:P           1:C_32:O5*         -126.000 -26.000 100.00 100.00 1000.000
1:C_32:C3*         1:C_32:O3*         1:U_33:P           1:U_33:O5*         -126.000 -26.000 100.00 100.00 1000.000

1:U8U_34:C3*       1:U8U_34:O3*       1:U_35:P           1:U_35:O5*         -126.000 -26.000 100.00 100.00 1000.000
1:U_35:C3*         1:U_35:O3*         1:U_36:P           1:U_36:O5*         -126.000 -26.000 100.00 100.00 1000.000
1:U_36:C3*         1:U_36:O3*         1:T6A_37:P         1:T6A_37:O5*       -126.000 -26.000 100.00 100.00 1000.000
1:T6A_37:C3*       1:T6A_37:O3*       1:A_38:P           1:A_38:O5*         -126.000 -26.000 100.00 100.00 1000.000
1:A_38:C3*         1:A_38:O3*         1:PSU_39:P         1:PSU_39:O5*       -126.000 -26.000 100.00 100.00 1000.000
1:PSU_39:C3*       1:PSU_39:O3*       1:C_40:P           1:C_40:O5*         -126.000 -26.000 100.00 100.00 1000.000
1:C_40:C3*         1:C_40:O3*         1:U_41:P           1:U_41:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:U_41:C3*         1:U_41:O3*         1:G_42:P           1:G_42:O5*         -101.000 -41.000 100.00 100.00 1000.000
1:G_42:C3*         1:G_42:O3*         1:A_43:P           1:A_43:O5*         -101.000 -41.000 100.00 100.00 1000.000

!chi (-158) (-98)
1:U_27:O4*         1:U_27:C1*         1:U_27:N1          1:U_27:C2           90.000 -90.000 100.00 100.00 1000.000
1:C_28:O4*         1:C_28:C1*         1:C_28:N1          1:C_28:C2           90.000 -90.000 100.00 100.00 1000.000
1:A_29:O4*         1:A_29:C1*         1:A_29:N9          1:A_29:C4           90.000 -90.000 100.00 100.00 1000.000
1:G_30:O4*         1:G_30:C1*         1:G_30:N9          1:G_30:C4           90.000 -90.000 100.00 100.00 1000.000
1:A_31:O4*         1:A_31:C1*         1:A_31:N9          1:A_31:C4           90.000 -90.000 100.00 100.00 1000.000
1:C_32:O4*         1:C_32:C1*         1:C_32:N1          1:C_32:C2           90.000 -90.000 100.00 100.00 1000.000
1:U_33:O4*         1:U_33:C1*         1:U_33:N1          1:U_33:C2           90.000 -90.000 100.00 100.00 1000.000
1:U8U_34:O4*       1:U8U_34:C1*       1:U8U_34:N1        1:U8U_34:C2         90.000 -90.000 100.00 100.00 1000.000
1:U_35:O4*         1:U_35:C1*         1:U_35:N1          1:U_35:C2           90.000 -90.000 100.00 100.00 1000.000
1:U_36:O4*         1:U_36:C1*         1:U_36:N1          1:U_36:C2           90.000 -90.000 100.00 100.00 1000.000
1:T6A_37:O4*       1:T6A_37:C1*       1:T6A_37:N9        1:T6A_37:C4         90.000 -90.000 100.00 100.00 1000.000
1:A_38:O4*         1:A_38:C1*         1:A_38:N9          1:A_38:C4           90.000 -90.000 100.00 100.00 1000.000
1:PSU_39:O4*       1:PSU_39:C1*       1:PSU_39:C5        1:PSU_39:C4         90.000 -90.000 100.00 100.00 1000.000
1:C_40:O4*         1:C_40:C1*         1:C_40:N1          1:C_40:C2           90.000 -90.000 100.00 100.00 1000.000
1:U_41:O4*         1:U_41:C1*         1:U_41:N1          1:U_41:C2           90.000 -90.000 100.00 100.00 1000.000
1:G_42:O4*         1:G_42:C1*         1:G_42:N9          1:G_42:C4           90.000 -90.000 100.00 100.00 1000.000
1:A_43:O4*         1:A_43:C1*         1:A_43:N9          1:A_43:C4           90.000 -90.000 100.00 100.00 1000.000

!v1 (H1*-H2* coupling)
1:U_27:O4*         1:U_27:C1*         1:U_27:C2*         1:U_27:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:C_28:O4*         1:C_28:C1*         1:C_28:C2*         1:C_28:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:A_29:O4*         1:A_29:C1*         1:A_29:C2*         1:A_29:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:G_30:O4*         1:G_30:C1*         1:G_30:C2*         1:G_30:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:A_31:O4*         1:A_31:C1*         1:A_31:C2*         1:A_31:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:C_32:O4*         1:C_32:C1*         1:C_32:C2*         1:C_32:C3*         -46.000 -6.000 100.00 100.00 1000.000

1:T6A_37:O4*       1:T6A_37:C1*       1:T6A_37:C2*       1:T6A_37:C3*       -46.000 -6.000 100.00 100.00 1000.000
1:A_38:O4*         1:A_38:C1*         1:A_38:C2*         1:A_38:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:PSU_39:O4*       1:PSU_39:C1*       1:PSU_39:C2*       1:PSU_39:C3*       -46.000 -6.000 100.00 100.00 1000.000
1:C_40:O4*         1:C_40:C1*         1:C_40:C2*         1:C_40:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:U_41:O4*         1:U_41:C1*         1:U_41:C2*         1:U_41:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:G_42:O4*         1:G_42:C1*         1:G_42:C2*         1:G_42:C3*         -46.000 -6.000 100.00 100.00 1000.000
1:A_43:O4*         1:A_43:C1*         1:A_43:C2*         1:A_43:C3*         -46.000 -6.000 100.00 100.00 1000.000

!v0
1:U_27:C4*         1:U_27:O4*         1:U_27:C1*         1:U_27:C2*         -14.000 26.000 100.00 100.00 1000.000
1:C_28:C4*         1:C_28:O4*         1:C_28:C1*         1:C_28:C2*         -14.000 26.000 100.00 100.00 1000.000
1:A_29:C4*         1:A_29:O4*         1:A_29:C1*         1:A_29:C2*         -14.000 26.000 100.00 100.00 1000.000
1:G_30:C4*         1:G_30:O4*         1:G_30:C1*         1:G_30:C2*         -14.000 26.000 100.00 100.00 1000.000
1:A_31:C4*         1:A_31:O4*         1:A_31:C1*         1:A_31:C2*         -14.000 26.000 100.00 100.00 1000.000
1:C_32:C4*         1:C_32:O4*         1:C_32:C1*         1:C_32:C2*         -14.000 26.000 100.00 100.00 1000.000

1:T6A_37:C4*       1:T6A_37:O4*       1:T6A_37:C1*       1:T6A_37:C2*       -14.000 26.000 100.00 100.00 1000.000
1:A_38:C4*         1:A_38:O4*         1:A_38:C1*         1:A_38:C2*         -14.000 26.000 100.00 100.00 1000.000
1:PSU_39:C4*       1:PSU_39:O4*       1:PSU_39:C1*       1:PSU_39:C2*       -14.000 26.000 100.00 100.00 1000.000
1:C_40:C4*         1:C_40:O4*         1:C_40:C1*         1:C_40:C2*         -14.000 26.000 100.00 100.00 1000.000
1:U_41:C4*         1:U_41:O4*         1:U_41:C1*         1:U_41:C2*         -14.000 26.000 100.00 100.00 1000.000
1:G_42:C4*         1:G_42:O4*         1:G_42:C1*         1:G_42:C2*         -14.000 26.000 100.00 100.00 1000.000
1:A_43:C4*         1:A_43:O4*         1:A_43:C1*         1:A_43:C2*         -14.000 26.000 100.00 100.00 1000.000

!v2
1:U_27:C1*         1:U_27:C2*         1:U_27:C3*         1:U_27:C4*          17.000 57.000 100.00 100.00 1000.000
1:C_28:C1*         1:C_28:C2*         1:C_28:C3*         1:C_28:C4*          17.000 57.000 100.00 100.00 1000.000
1:A_29:C1*         1:A_29:C2*         1:A_29:C3*         1:A_29:C4*          17.000 57.000 100.00 100.00 1000.000
1:G_30:C1*         1:G_30:C2*         1:G_30:C3*         1:G_30:C4*          17.000 57.000 100.00 100.00 1000.000
1:A_31:C1*         1:A_31:C2*         1:A_31:C3*         1:A_31:C4*          17.000 57.000 100.00 100.00 1000.000
1:C_32:C1*         1:C_32:C2*         1:C_32:C3*         1:C_32:C4*          17.000 57.000 100.00 100.00 1000.000

1:T6A_37:C1*       1:T6A_37:C2*       1:T6A_37:C3*       1:T6A_37:C4*        17.000 57.000 100.00 100.00 1000.000
1:A_38:C1*         1:A_38:C2*         1:A_38:C3*         1:A_38:C4*          17.000 57.000 100.00 100.00 1000.000
1:PSU_39:C1*       1:PSU_39:C2*       1:PSU_39:C3*       1:PSU_39:C4*        17.000 57.000 100.00 100.00 1000.000
1:C_40:C1*         1:C_40:C2*         1:C_40:C3*         1:C_40:C4*          17.000 57.000 100.00 100.00 1000.000
1:U_41:C1*         1:U_41:C2*         1:U_41:C3*         1:U_41:C4*          17.000 57.000 100.00 100.00 1000.000
1:G_42:C1*         1:G_42:C2*         1:G_42:C3*         1:G_42:C4*          17.000 57.000 100.00 100.00 1000.000
1:A_43:C1*         1:A_43:C2*         1:A_43:C3*         1:A_43:C4*          17.000 57.000 100.00 100.00 1000.000

!v4
1:U_27:C3*         1:U_27:C4*         1:U_27:O4*         1:U_27:C1*          -3.000 37.000 100.00 100.00 1000.000
1:C_28:C3*         1:C_28:C4*         1:C_28:O4*         1:C_28:C1*          -3.000 37.000 100.00 100.00 1000.000
1:A_29:C3*         1:A_29:C4*         1:A_29:O4*         1:A_29:C1*          -3.000 37.000 100.00 100.00 1000.000
1:G_30:C3*         1:G_30:C4*         1:G_30:O4*         1:G_30:C1*          -3.000 37.000 100.00 100.00 1000.000
1:A_31:C3*         1:A_31:C4*         1:A_31:O4*         1:A_31:C1*          -3.000 37.000 100.00 100.00 1000.000
1:C_32:C3*         1:C_32:C4*         1:C_32:O4*         1:C_32:C1*          -3.000 37.000 100.00 100.00 1000.000

1:T6A_37:C3*       1:T6A_37:C4*       1:T6A_37:O4*       1:T6A_37:C1*        -3.000 37.000 100.00 100.00 1000.000
1:A_38:C3*         1:A_38:C4*         1:A_38:O4*         1:A_38:C1*          -3.000 37.000 100.00 100.00 1000.000
1:PSU_39:C3*       1:PSU_39:C4*       1:PSU_39:O4*       1:PSU_39:C1*        -3.000 37.000 100.00 100.00 1000.000
1:C_40:C3*         1:C_40:C4*         1:C_40:O4*         1:C_40:C1*          -3.000 37.000 100.00 100.00 1000.000
1:U_41:C3*         1:U_41:C4*         1:U_41:O4*         1:U_41:C1*          -3.000 37.000 100.00 100.00 1000.000
1:G_42:C3*         1:G_42:C4*         1:G_42:O4*         1:G_42:C1*          -3.000 37.000 100.00 100.00 1000.000
1:A_43:C3*         1:A_43:C4*         1:A_43:O4*         1:A_43:C1*          -3.000 37.000 100.00 100.00 1000.000




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