NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype
1290 1ag7 cing 1-original 1 XPLOR/CNS distance NOE simple


! DISTANCE RESTRAINTS
! residue 1  ALA  
assign (resid   1 and name  HA    )(resid   2 and name  HN    ) 0 0 2.7 ! 

! residue 2  CYS
assign (resid   2 and name  HA    )(resid  14 and name  HN    ) 0 0 5.0 !
assign (resid   2 and name  HB2   )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HA    )(resid   3 and name  HN    ) 0 0 2.7 !
assign (resid   2 and name  HB1   )(resid   3 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HB2   )(resid   3 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HA    )(resid   2 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HB1   )(resid   2 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HB2   )(resid   2 and name  HN    ) 0 0 3.5 !
assign (resid   2 and name  HA    )(resid  12 and name  HN    ) 0 0 6.0 !
assign (resid   2 and name  HB1   )(resid  15 and name  HN    ) 0 0 5.0 !
assign (resid   2 and name  HB2   )(resid  15 and name  HN    ) 0 0 5.0 !
assign (resid   2 and name  HA    )(resid  14 and name  HA    ) 0 0 5.0 !
assign (resid   2 and name  HA    )(resid   3 and name  HA    ) 0 0 5.0 !
assign (resid   2 and name  HA    )(resid  12 and name  HA    ) 0 0 6.0 !
assign (resid   2 and name  HA    )(resid   3 and name  HB*   ) 0 0 6.0 !
assign (resid   2 and name  HB1   )(resid   2 and name  HA    ) 0 0 2.7 !
assign (resid   2 and name  HB2   )(resid   2 and name  HA    ) 0 0 2.7 !
assign (resid   2 and name  HB1   )(resid  14 and name  HA    ) 0 0 2.7 !
assign (resid   2 and name  HB2   )(resid  14 and name  HA    ) 0 0 2.7 !

! residue 3  SER
assign (resid   3 and name  HA    )(resid  14 and name  HN    ) 0 0 6.0 !
assign (resid   3 and name  HB*   )(resid  14 and name  HN    ) 0 0 4.5 !
assign (resid   3 and name  HB*   )(resid  13 and name  HN    ) 0 0 5.0 !
assign (resid   3 and name  HN    )(resid   4 and name  HN    ) 0 0 5.0 !
assign (resid   3 and name  HN    )(resid  12 and name  HN    ) 0 0 5.0 !
assign (resid   3 and name  HN    )(resid   3 and name  HN    ) 0 0 3.5 !
assign (resid   3 and name  HB*   )(resid   3 and name  HN    ) 0 0 3.7 !
assign (resid   3 and name  HA    )(resid   4 and name  HN    ) 0 0 2.7 !
assign (resid   3 and name  HB*   )(resid   4 and name  HN    ) 0 0 4.5 !
assign (resid   3 and name  HA    )(resid  13 and name  HA    ) 0 0 5.0 !
assign (resid   3 and name  HB*   )(resid  13 and name  HA    ) 0 0 3.7 !
assign (resid   3 and name  HA    )(resid   4 and name  HA*   ) 0 0 6.0 !
assign (resid   3 and name  HB*   )(resid   3 and name  HA    ) 0 0 2.7 !

! residue 4  GLY
assign (resid   4 and name  HN    )(resid  14 and name  HN    ) 0 0 5.0 !
assign (resid   4 and name  HA1   )(resid  14 and name  HN    ) 0 0 6.0 !
assign (resid   4 and name  HA2   )(resid  14 and name  HN    ) 0 0 6.0 !
assign (resid   4 and name  HA1   )(resid   4 and name  HN    ) 0 0 3.5 !
assign (resid   4 and name  HA2   )(resid   4 and name  HN    ) 0 0 3.5 !
assign (resid   4 and name  HA1   )(resid   4 and name  HA2   ) 0 0 2.7 !
assign (resid   4 and name  HA*   )(resid  14 and name  HB1   ) 0 0 6.0 !
assign (resid   4 and name  HA*   )(resid  14 and name  HB2   ) 0 0 6.0 !
assign (resid   4 and name  HA1   )(resid  17 and name  HD*   ) 0 0 5.2 !
assign (resid   4 and name  HA2   )(resid  17 and name  HD*   ) 0 0 5.2 !
assign (resid   4 and name  HN    )(resid   7 and name  HN    ) 0 0 5.0 !

! residue 5  ARG
assign (resid   5 and name  HN    )(resid   6 and name  HN    ) 0 0 5.0 !
assign (resid   5 and name  HA    )(resid   6 and name  HN    ) 0 0 2.7 !
assign (resid   5 and name  HB*   )(resid   6 and name  HN    ) 0 0 6.0 !
assign (resid   5 and name  HG1   )(resid   6 and name  HN    ) 0 0 5.0 !
assign (resid   5 and name  HG2   )(resid   6 and name  HN    ) 0 0 5.0 !
assign (resid   5 and name  HA    )(resid  27 and name  HN    ) 0 0 6.0 !
assign (resid   5 and name  HA    )(resid   5 and name  HN    ) 0 0 3.5 !
assign (resid   5 and name  HB*   )(resid   5 and name  HN    ) 0 0 4.5 !
assign (resid   5 and name  HG1   )(resid   5 and name  HN    ) 0 0 5.0 !
assign (resid   5 and name  HG2   )(resid   5 and name  HN    ) 0 0 5.0 !
assign (resid   5 and name  HA    )(resid   7 and name  HN    ) 0 0 3.5 !
assign (resid   5 and name  HA    )(resid   5 and name  HE    ) 0 0 5.0 !
assign (resid   5 and name  HD1   )(resid   5 and name  HE    ) 0 0 3.5 !
assign (resid   5 and name  HD2   )(resid   5 and name  HE    ) 0 0 3.5 !
assign (resid   5 and name  HB1   )(resid   5 and name  HE    ) 0 0 3.5 ! 288K
assign (resid   5 and name  HB2   )(resid   5 and name  HE    ) 0 0 3.5 ! 288K
assign (resid   5 and name  HG1   )(resid   5 and name  HE    ) 0 0 5.0 ! 288K
assign (resid   5 and name  HG2   )(resid   5 and name  HE    ) 0 0 5.0 ! 288K
assign (resid   5 and name  HD*   )(resid   5 and name  HA    ) 0 0 4.5 !
assign (resid   5 and name  HB*   )(resid   5 and name  HA    ) 0 0 3.7 !
assign (resid   5 and name  HG1   )(resid   5 and name  HA    ) 0 0 3.5 !
assign (resid   5 and name  HG2   )(resid   5 and name  HA    ) 0 0 3.5 !
assign (resid   5 and name  HA    )(resid  17 and name  HD1*  ) 0 0 4.2 !
assign (resid   5 and name  HA    )(resid  17 and name  HD2*  ) 0 0 4.2 !

! residue 6  GLY
assign (resid   6 and name  HN    )(resid  27 and name  HN    ) 0 0 3.5 !
assign (resid   6 and name  HN    )(resid   7 and name  HN    ) 0 0 2.7 !
assign (resid   6 and name  HA1   )(resid   6 and name  HN    ) 0 0 3.5 !
assign (resid   6 and name  HA2   )(resid   6 and name  HN    ) 0 0 3.5 !
assign (resid   6 and name  HA1   )(resid   7 and name  HN    ) 0 0 3.5 !
assign (resid   6 and name  HA2   )(resid   7 and name  HN    ) 0 0 3.5 !
assign (resid   6 and name  HA1   )(resid   6 and name  HA2   ) 0 0 2.7 !
assign (resid   6 and name  HA1   )(resid  26 and name  HD*   ) 0 0 6.0 !
assign (resid   6 and name  HA2   )(resid  26 and name  HD*   ) 0 0 6.0 !
assign (resid   6 and name  HA1   )(resid  26 and name  HB*   ) 0 0 6.0 !
assign (resid   6 and name  HA2   )(resid  26 and name  HB*   ) 0 0 6.0 !

! residue 7  SER
assign (resid   7 and name  HN    )(resid   8 and name  HN    ) 0 0 5.0 ! 
assign (resid   7 and name  HA    )(resid   8 and name  HN    ) 0 0 3.5 !
assign (resid   7 and name  HB*   )(resid   8 and name  HN    ) 0 0 3.7 !
assign (resid   7 and name  HN    )(resid  26 and name  HA    ) 0 0 5.0 !
assign (resid   7 and name  HA    )(resid   7 and name  HN    ) 0 0 3.5 !
assign (resid   7 and name  HB*   )(resid   7 and name  HA    ) 0 0 3.7 !
assign (resid   7 and name  HN    )(resid  26 and name  HB*   ) 0 0 6.0 !

! residue 8  ARG
assign (resid   8 and name  HA    )(resid  27 and name  HN    ) 0 0 3.5 !
assign (resid   8 and name  HN    )(resid   9 and name  HN    ) 0 0 5.0 !
assign (resid   8 and name  HN    )(resid  26 and name  HA    ) 0 0 5.0 !
assign (resid   8 and name  HA    )(resid   8 and name  HN    ) 0 0 3.5 !
assign (resid   8 and name  HB*   )(resid   8 and name  HN    ) 0 0 4.5 !
assign (resid   8 and name  HG1   )(resid   8 and name  HN    ) 0 0 3.5 !
assign (resid   8 and name  HG2   )(resid   8 and name  HN    ) 0 0 3.5 !
assign (resid   8 and name  HA    )(resid   9 and name  HN    ) 0 0 2.7 !
assign (resid   8 and name  HB*   )(resid   9 and name  HN    ) 0 0 3.7 ! 288K
assign (resid   8 and name  HG1   )(resid   9 and name  HN    ) 0 0 3.5 ! 288K
assign (resid   8 and name  HG2   )(resid   9 and name  HN    ) 0 0 3.5 ! 288K
assign (resid   8 and name  HD*   )(resid   8 and name  HE    ) 0 0 4.5 !
assign (resid   8 and name  HB*   )(resid   8 and name  HE    ) 0 0 4.5 !
assign (resid   8 and name  HG1   )(resid   8 and name  HE    ) 0 0 5.0 !
assign (resid   8 and name  HG2   )(resid   8 and name  HE    ) 0 0 5.0 !
assign (resid   8 and name  HA    )(resid  26 and name  HA    ) 0 0 2.7 !
assign (resid   8 and name  HB*   )(resid  26 and name  HA    ) 0 0 6.0 !
assign (resid   8 and name  HD*   )(resid   8 and name  HA    ) 0 0 6.0 !
assign (resid   8 and name  HB*   )(resid   8 and name  HA    ) 0 0 4.5 !
assign (resid   8 and name  HG1   )(resid   8 and name  HA    ) 0 0 5.0 !
assign (resid   8 and name  HG2   )(resid   8 and name  HA    ) 0 0 5.0 !
assign (resid   8 and name  HA    )(resid  26 and name  HN    ) 0 0 6.0 !

! residue 9  CYS
assign (resid   9 and name  HN    )(resid  27 and name  HN    ) 0 0 5.0 !
assign (resid   9 and name  HA    )(resid   9 and name  HN    ) 0 0 2.7 !
assign (resid   9 and name  HB1   )(resid   9 and name  HN    ) 0 0 5.0 !
assign (resid   9 and name  HB2   )(resid   9 and name  HN    ) 0 0 5.0 !
assign (resid   9 and name  HA    )(resid  10 and name  HA    ) 0 0 2.7 !
assign (resid   9 and name  HB1   )(resid   9 and name  HA    ) 0 0 2.7 !
assign (resid   9 and name  HB2   )(resid   9 and name  HA    ) 0 0 2.7 !
assign (resid   9 and name  HB1   )(resid  10 and name  HA    ) 0 0 3.5 !
assign (resid   9 and name  HB2   )(resid  10 and name  HA    ) 0 0 3.5 !
assign (resid   9 and name  HB1   )(resid  12 and name  HA    ) 0 0 5.0 !
assign (resid   9 and name  HB2   )(resid  12 and name  HA    ) 0 0 5.0 !
assign (resid   9 and name  HB1   )(resid   3 and name  HB*   ) 0 0 6.0 !
assign (resid   9 and name  HB2   )(resid   3 and name  HB*   ) 0 0 6.0 !
assign (resid   9 and name  HB1   )(resid  13 and name  HN    ) 0 0 5.0 !
assign (resid   9 and name  HB2   )(resid  13 and name  HN    ) 0 0 5.0 !

! residue 10  HYP
assign (resid  10 and name  HB1   )(resid   2 and name  HA    ) 0 0 6.0 !
assign (resid  10 and name  HB2   )(resid   2 and name  HA    ) 0 0 6.0 !
assign (resid  10 and name  HD11  )(resid  10 and name  HA    ) 0 0 5.0 !
assign (resid  10 and name  HD12  )(resid  10 and name  HA    ) 0 0 5.0 !
assign (resid  10 and name  HB1   )(resid  10 and name  HA    ) 0 0 3.5 !
assign (resid  10 and name  HB2   )(resid  10 and name  HA    ) 0 0 3.5 !
assign (resid  10 and name  HD11  )(resid  10 and name  HG    ) 0 0 2.7 !
assign (resid  10 and name  HD12  )(resid  10 and name  HG    ) 0 0 2.7 !
assign (resid  10 and name  HB1   )(resid  10 and name  HG    ) 0 0 3.5 !
assign (resid  10 and name  HB2   )(resid  10 and name  HG    ) 0 0 3.5 !
assign (resid  10 and name  HB*   )(resid   3 and name  HB*   ) 0 0 7.0 !
assign (resid  10 and name  HD11  )(resid  10 and name  HD12  ) 0 0 2.7 !
assign (resid  10 and name  HD11  )(resid  10 and name  HB1   ) 0 0 5.0 !
assign (resid  10 and name  HD11  )(resid  10 and name  HB2   ) 0 0 5.0 !
assign (resid  10 and name  HD12  )(resid  10 and name  HB1   ) 0 0 5.0 !
assign (resid  10 and name  HD12  )(resid  10 and name  HB2   ) 0 0 5.0 !
assign (resid  10 and name  HB*   )(resid  12 and name  HN    ) 0 0 4.5 !

! residue 11  HYP
assign (resid  11 and name  HA    )(resid  13 and name  HN    ) 0 0 6.0 !
assign (resid  11 and name  HA    )(resid  12 and name  HN    ) 0 0 2.7 !
assign (resid  11 and name  HB1   )(resid  11 and name  HA    ) 0 0 3.5 !
assign (resid  11 and name  HB2   )(resid  11 and name  HA    ) 0 0 3.5 !
assign (resid  11 and name  HD11  )(resid  11 and name  HG    ) 0 0 3.5 !
assign (resid  11 and name  HD12  )(resid  11 and name  HG    ) 0 0 3.5 !
assign (resid  11 and name  HB1   )(resid  11 and name  HG    ) 0 0 3.5 !
assign (resid  11 and name  HB2   )(resid  11 and name  HG    ) 0 0 3.5 !
assign (resid  11 and name  HD1*  )(resid  11 and name  HB1   ) 0 0 6.0 !
assign (resid  11 and name  HD1*  )(resid  11 and name  HB2   ) 0 0 6.0 !
assign (resid  11 and name  HB*   )(resid  12 and name  HN    ) 0 0 4.5 !

! residue 12  GLN
assign (resid  12 and name  HN    )(resid  13 and name  HN    ) 0 0 5.0 !
assign (resid  12 and name  HA    )(resid  13 and name  HN    ) 0 0 2.7 !
assign (resid  12 and name  HG*   )(resid  13 and name  HN    ) 0 0 5.0 !
assign (resid  12 and name  HB*   )(resid  13 and name  HN    ) 0 0 5.0 !
assign (resid  12 and name  HA    )(resid  12 and name  HN    ) 0 0 2.7 !
assign (resid  12 and name  HG*   )(resid  12 and name  HN    ) 0 0 4.5 !
assign (resid  12 and name  HB*   )(resid  12 and name  HN    ) 0 0 3.7 !
assign (resid  12 and name  HG1   )(resid  12 and name  HA    ) 0 0 5.0 !
assign (resid  12 and name  HG2   )(resid  12 and name  HA    ) 0 0 5.0 !
assign (resid  12 and name  HB*   )(resid  12 and name  HA    ) 0 0 4.5 !

! residue 13  CYS
assign (resid  13 and name  HN    )(resid  14 and name  HN    ) 0 0 5.0 !
assign (resid  13 and name  HA    )(resid  14 and name  HN    ) 0 0 2.7 !
assign (resid  13 and name  HB2   )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid  13 and name  HN    )(resid  19 and name  HN    ) 0 0 5.0 !
assign (resid  13 and name  HB2   )(resid  19 and name  HN    ) 0 0 5.0 !
assign (resid  13 and name  HA    )(resid  13 and name  HN    ) 0 0 3.5 !
assign (resid  13 and name  HB1   )(resid  13 and name  HN    ) 0 0 3.5 !
assign (resid  13 and name  HB2   )(resid  13 and name  HN    ) 0 0 3.5 !
assign (resid  13 and name  HA    )(resid   3 and name  HN    ) 0 0 2.7 !
assign (resid  13 and name  HB1   )(resid  17 and name  HN    ) 0 0 5.0 !
assign (resid  13 and name  HB2   )(resid  17 and name  HN    ) 0 0 5.0 !
assign (resid  13 and name  HB1   )(resid  13 and name  HA    ) 0 0 2.7 !
assign (resid  13 and name  HB2   )(resid  13 and name  HA    ) 0 0 3.5 !
assign (resid  13 and name  HB1   )(resid  12 and name  HA    ) 0 0 6.0 !
assign (resid  13 and name  HB2   )(resid  12 and name  HA    ) 0 0 6.0 !
assign (resid  13 and name  HB1   )(resid   3 and name  HB*   ) 0 0 5.0 !
assign (resid  13 and name  HB2   )(resid   3 and name  HB*   ) 0 0 6.0 !
assign (resid  13 and name  HB1   )(resid  27 and name  HB1   ) 0 0 3.5 !
assign (resid  13 and name  HB1   )(resid  18 and name  HA    ) 0 0 5.0 !
assign (resid  13 and name  HB2   )(resid  18 and name  HA    ) 0 0 5.0 !

! residue 14  CYS
assign (resid  14 and name  HN    )(resid   3 and name  HN    ) 0 0 2.7 !
assign (resid  14 and name  HN    )(resid  15 and name  HN    ) 0 0 5.0 !
assign (resid  14 and name  HA    )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid  14 and name  HB1   )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid  14 and name  HB2   )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid  14 and name  HA    )(resid   3 and name  HN    ) 0 0 5.0 !
assign (resid  14 and name  HA    )(resid  15 and name  HN    ) 0 0 2.7 !
assign (resid  14 and name  HB1   )(resid  15 and name  HN    ) 0 0 2.7 !
assign (resid  14 and name  HB2   )(resid  15 and name  HN    ) 0 0 3.5 !
assign (resid  14 and name  HB1   )(resid  14 and name  HA    ) 0 0 2.7 !
assign (resid  14 and name  HB2   )(resid  14 and name  HA    ) 0 0 3.5 !
assign (resid  14 and name  HA    )(resid  17 and name  HD*   ) 0 0 7.5 !

! residue 15  MET
assign (resid  15 and name  HN    )(resid  16 and name  HN    ) 0 0 5.0 !
assign (resid  15 and name  HA    )(resid  16 and name  HN    ) 0 0 2.7 !
assign (resid  15 and name  HG*   )(resid  16 and name  HN    ) 0 0 6.0 !
assign (resid  15 and name  HB1   )(resid  16 and name  HN    ) 0 0 5.0 !
assign (resid  15 and name  HB2   )(resid  16 and name  HN    ) 0 0 5.0 !
assign (resid  15 and name  HA    )(resid  15 and name  HN    ) 0 0 2.7 !
assign (resid  15 and name  HG*   )(resid  15 and name  HN    ) 0 0 6.0 !
assign (resid  15 and name  HB1   )(resid  15 and name  HN    ) 0 0 2.7 !
assign (resid  15 and name  HB2   )(resid  15 and name  HN    ) 0 0 2.7 !
assign (resid  15 and name  HA    )(resid  17 and name  HN    ) 0 0 3.5 !
assign (resid  15 and name  HG*   )(resid  15 and name  HA    ) 0 0 4.5 !
assign (resid  15 and name  HB1   )(resid  15 and name  HA    ) 0 0 3.5 !
assign (resid  15 and name  HB2   )(resid  15 and name  HA    ) 0 0 3.5 !

! residue 16  GLY
assign (resid  16 and name  HN    )(resid  17 and name  HN    ) 0 0 2.7 !
assign (resid  16 and name  HA1   )(resid  16 and name  HN    ) 0 0 2.7 !
assign (resid  16 and name  HA2   )(resid  16 and name  HN    ) 0 0 2.7 !
assign (resid  16 and name  HA1   )(resid  17 and name  HN    ) 0 0 3.5 !
assign (resid  16 and name  HA2   )(resid  17 and name  HN    ) 0 0 3.5 !
assign (resid  16 and name  HA1   )(resid  16 and name  HA2   ) 0 0 2.7 !
assign (resid  16 and name  HA*   )(resid  17 and name  HG    ) 0 0 6.0 !

! residue 17  LEU
assign (resid  17 and name  HB1   )(resid  28 and name  HN    ) 0 0 3.5 !
assign (resid  17 and name  HD1*  )(resid  28 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD2*  )(resid  28 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HN    )(resid  18 and name  HN    ) 0 0 5.0 !
assign (resid  17 and name  HA    )(resid  18 and name  HN    ) 0 0 2.7 !
assign (resid  17 and name  HB2   )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  17 and name  HG    )(resid  18 and name  HN    ) 0 0 5.0 ! 288K
assign (resid  17 and name  HD1*  )(resid  18 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD2*  )(resid  18 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD1*  )(resid   6 and name  HN    ) 0 0 6.5 ! 288K
assign (resid  17 and name  HD2*  )(resid   6 and name  HN    ) 0 0 6.5 ! 288K
assign (resid  17 and name  HG    )(resid  14 and name  HN    ) 0 0 6.0 !
assign (resid  17 and name  HB1   )(resid  14 and name  HN    ) 0 0 5.0 !
assign (resid  17 and name  HB2   )(resid  14 and name  HN    ) 0 0 3.5 !
assign (resid  17 and name  HD*   )(resid  14 and name  HN    ) 0 0 7.5 !
assign (resid  17 and name  HD*   )(resid  29 and name  HN    ) 0 0 7.5 !
assign (resid  17 and name  HD1*  )(resid   5 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD2*  )(resid   5 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD*   )(resid  30 and name  HN    ) 0 0 6.0 !
assign (resid  17 and name  HA    )(resid  17 and name  HN    ) 0 0 2.7 !
assign (resid  17 and name  HB1   )(resid  17 and name  HN    ) 0 0 3.5 !
assign (resid  17 and name  HB2   )(resid  17 and name  HN    ) 0 0 2.7 !
assign (resid  17 and name  HG    )(resid  17 and name  HN    ) 0 0 3.5 ! 
assign (resid  17 and name  HD1*  )(resid  17 and name  HN    ) 0 0 6.5 ! 
assign (resid  17 and name  HD2*  )(resid  17 and name  HN    ) 0 0 6.5 !
assign (resid  17 and name  HD*   )(resid   5 and name  HE    ) 0 0 7.5 !
assign (resid  17 and name  HB1   )(resid  17 and name  HA    ) 0 0 3.5 ! 
assign (resid  17 and name  HB2   )(resid  17 and name  HA    ) 0 0 3.5 !
assign (resid  17 and name  HG    )(resid  17 and name  HA    ) 0 0 3.5 !
assign (resid  17 and name  HD1*  )(resid  17 and name  HA    ) 0 0 5.0 !
assign (resid  17 and name  HD2*  )(resid  17 and name  HA    ) 0 0 5.0 !
assign (resid  17 and name  HD*   )(resid  28 and name  HA    ) 0 0 7.5 !
assign (resid  17 and name  HD*   )(resid  14 and name  HB1   ) 0 0 6.0 !
assign (resid  17 and name  HD*   )(resid  14 and name  HB2   ) 0 0 6.0 !
assign (resid  17 and name  HB2   )(resid  13 and name  HB2   ) 0 0 2.7 !
assign (resid  17 and name  HB2   )(resid  13 and name  HB1   ) 0 0 3.5 !
assign (resid  17 and name  HB1   )(resid  13 and name  HB2   ) 0 0 2.7 !
assign (resid  17 and name  HB1   )(resid  13 and name  HB1   ) 0 0 3.5 !
assign (resid  17 and name  HG    )(resid  13 and name  HB1   ) 0 0 5.0 !
assign (resid  17 and name  HG    )(resid  13 and name  HB2   ) 0 0 5.0 !
assign (resid  17 and name  HD1*  )(resid  13 and name  HB1   ) 0 0 5.0 !
assign (resid  17 and name  HD1*  )(resid  13 and name  HB2   ) 0 0 5.0 !
assign (resid  17 and name  HD2*  )(resid  13 and name  HB1   ) 0 0 6.5 !
assign (resid  17 and name  HB1   )(resid  27 and name  HB1   ) 0 0 3.5 !
assign (resid  17 and name  HB1   )(resid  27 and name  HB2   ) 0 0 3.5 !
assign (resid  17 and name  HG    )(resid  27 and name  HB1   ) 0 0 5.0 !
assign (resid  17 and name  HG    )(resid  27 and name  HB2   ) 0 0 5.0 !
assign (resid  17 and name  HD1*  )(resid  27 and name  HB1   ) 0 0 5.0 !
assign (resid  17 and name  HD1*  )(resid  27 and name  HB2   ) 0 0 5.0 !
assign (resid  17 and name  HD2*  )(resid  27 and name  HB1   ) 0 0 5.0 !
assign (resid  17 and name  HD2*  )(resid  27 and name  HB2   ) 0 0 5.0 !

! residue 18  ARG
assign (resid  18 and name  HN    )(resid  28 and name  HN    ) 0 0 2.7 !
assign (resid  18 and name  HN    )(resid  19 and name  HN    ) 0 0 5.0 !
assign (resid  18 and name  HN    )(resid  30 and name  HN    ) 0 0 5.0 !
assign (resid  18 and name  HA    )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HB1   )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HB2   )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HG1   )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HG2   )(resid  18 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HA    )(resid  19 and name  HN    ) 0 0 2.7 !
assign (resid  18 and name  HB1   )(resid  19 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HB2   )(resid  19 and name  HN    ) 0 0 3.5 !
assign (resid  18 and name  HG1   )(resid  19 and name  HN    ) 0 0 5.0 !
assign (resid  18 and name  HG2   )(resid  19 and name  HN    ) 0 0 5.0 !
assign (resid  18 and name  HD*   )(resid  18 and name  HE    ) 0 0 3.7 !
assign (resid  18 and name  HB1   )(resid  18 and name  HE    ) 0 0 5.0 !
assign (resid  18 and name  HB2   )(resid  18 and name  HE    ) 0 0 5.0 !
assign (resid  18 and name  HG1   )(resid  18 and name  HE    ) 0 0 3.5 !
assign (resid  18 and name  HG2   )(resid  18 and name  HE    ) 0 0 3.5 !
assign (resid  18 and name  HD*   )(resid  18 and name  HA    ) 0 0 6.0 !
assign (resid  18 and name  HB1   )(resid  18 and name  HA    ) 0 0 3.5 !
assign (resid  18 and name  HB2   )(resid  18 and name  HA    ) 0 0 3.5 !
assign (resid  18 and name  HG1   )(resid  18 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HG2   )(resid  18 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HD*   )(resid  30 and name  HA    ) 0 0 4.5 !
assign (resid  18 and name  HB1   )(resid  30 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HB2   )(resid  30 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HG1   )(resid  30 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HG2   )(resid  30 and name  HA    ) 0 0 5.0 !
assign (resid  18 and name  HD*   )(resid  30 and name  HB*   ) 0 0 7.5 ! 
assign (resid  18 and name  HD*   )(resid  28 and name  HD1*  ) 0 0 7.5 !

! residue 19  CYS
assign (resid  19 and name  HN    )(resid  28 and name  HN    ) 0 0 6.0 !
assign (resid  19 and name  HN    )(resid  20 and name  HN    ) 0 0 5.0 !
assign (resid  19 and name  HN    )(resid  27 and name  HA    ) 0 0 5.0 !
assign (resid  19 and name  HA    )(resid  19 and name  HN    ) 0 0 3.5 !
assign (resid  19 and name  HB1   )(resid  19 and name  HN    ) 0 0 3.5 !
assign (resid  19 and name  HB2   )(resid  19 and name  HN    ) 0 0 3.5 !
assign (resid  19 and name  HA    )(resid  20 and name  HN    ) 0 0 2.7 !
assign (resid  19 and name  HB1   )(resid  19 and name  HA    ) 0 0 5.0 !
assign (resid  19 and name  HB2   )(resid  19 and name  HA    ) 0 0 5.0 !
assign (resid  19 and name  HB*   )(resid   9 and name  HB*   ) 0 0 5.5 !
assign (resid  19 and name  HA    )(resid  27 and name  HA    ) 0 0 2.7 !

! residue 20  GLY
assign (resid  20 and name  HN    )(resid  28 and name  HN    ) 0 0 3.5 !
assign (resid  20 and name  HN    )(resid  21 and name  HN    ) 0 0 5.0 !
assign (resid  20 and name  HA1   )(resid  20 and name  HN    ) 0 0 3.5 ! 
assign (resid  20 and name  HA2   )(resid  20 and name  HN    ) 0 0 3.5 !
assign (resid  20 and name  HA*   )(resid  21 and name  HN    ) 0 0 3.7 !
assign (resid  20 and name  HA*   )(resid  26 and name  HN    ) 0 0 6.0 !
assign (resid  20 and name  HA1   )(resid  20 and name  HA2   ) 0 0 2.7 !
assign (resid  20 and name  HA1   )(resid  28 and name  HG11  ) 0 0 5.0 !
assign (resid  20 and name  HA2   )(resid  28 and name  HG11  ) 0 0 5.0 !
assign (resid  20 and name  HA1   )(resid  28 and name  HG12  ) 0 0 5.0 !
assign (resid  20 and name  HA2   )(resid  28 and name  HG12  ) 0 0 5.0 !
assign (resid  20 and name  HA1   )(resid  28 and name  HG2*  ) 0 0 6.5 !
assign (resid  20 and name  HA2   )(resid  28 and name  HG2*  ) 0 0 6.5 !
assign (resid  20 and name  HA1   )(resid  28 and name  HD1*  ) 0 0 4.2 !
assign (resid  20 and name  HA2   )(resid  28 and name  HD1*  ) 0 0 4.2 !

! residue 21  ARG
assign (resid  21 and name  HA    )(resid  21 and name  HN    ) 0 0 2.7 !
assign (resid  21 and name  HB1   )(resid  21 and name  HN    ) 0 0 3.5 !
assign (resid  21 and name  HB2   )(resid  21 and name  HN    ) 0 0 3.5 !
assign (resid  21 and name  HG*   )(resid  21 and name  HN    ) 0 0 4.5 ! 
assign (resid  21 and name  HB1   )(resid  21 and name  HA    ) 0 0 3.5 !
assign (resid  21 and name  HB2   )(resid  21 and name  HA    ) 0 0 3.5 !
assign (resid  21 and name  HG1   )(resid  21 and name  HA    ) 0 0 5.0 !
assign (resid  21 and name  HG2   )(resid  21 and name  HA    ) 0 0 5.0 !
assign (resid  21 and name  HA    )(resid  25 and name  HG1   ) 0 0 5.0 !
assign (resid  21 and name  HA    )(resid  25 and name  HG2   ) 0 0 5.0 !

! residue 22  GLY
assign (resid  22 and name  HA1   )(resid  22 and name  HN    ) 0 0 3.5 !
assign (resid  22 and name  HA2   )(resid  22 and name  HN    ) 0 0 3.5 !
assign (resid  22 and name  HA1   )(resid  23 and name  HN    ) 0 0 3.5 !
assign (resid  22 and name  HA2   )(resid  23 and name  HN    ) 0 0 3.5 !

! residue 23  ASN
assign (resid  23 and name  HA    )(resid  25 and name  HN    ) 0 0 2.7 !
assign (resid  23 and name  HA    )(resid  23 and name  HN    ) 0 0 3.5 !
assign (resid  23 and name  HB1   )(resid  23 and name  HN    ) 0 0 3.5 !
assign (resid  23 and name  HB2   )(resid  23 and name  HN    ) 0 0 3.5 !
assign (resid  23 and name  HB1   )(resid  23 and name  HD2*  ) 0 0 6.0 !
assign (resid  23 and name  HB2   )(resid  23 and name  HD2*  ) 0 0 6.0 !
assign (resid  23 and name  HA    )(resid  24 and name  HA    ) 0 0 2.7 !
assign (resid  23 and name  HB1   )(resid  23 and name  HA    ) 0 0 3.5 !
assign (resid  23 and name  HB2   )(resid  23 and name  HA    ) 0 0 3.5 !
assign (resid  23 and name  HB1   )(resid  24 and name  HA    ) 0 0 5.0 !
assign (resid  23 and name  HB2   )(resid  24 and name  HA    ) 0 0 5.0 !
assign (resid  23 and name  HB*   )(resid  24 and name  HD*   ) 0 0 5.5 !

! residue 24  PRO
assign (resid  24 and name  HA    )(resid  25 and name  HN    ) 0 0 2.7 !
assign (resid  24 and name  HB*   )(resid  25 and name  HN    ) 0 0 4.5 !
assign (resid  24 and name  HA    )(resid  23 and name  HN    ) 0 0 5.0 !
assign (resid  24 and name  HB1   )(resid  23 and name  HA    ) 0 0 5.0 !
assign (resid  24 and name  HB2   )(resid  23 and name  HA    ) 0 0 5.0 !
assign (resid  24 and name  HD*   )(resid  24 and name  HA    ) 0 0 6.0 !
assign (resid  24 and name  HB1   )(resid  24 and name  HA    ) 0 0 2.7 !
assign (resid  24 and name  HB2   )(resid  24 and name  HA    ) 0 0 2.7 !
assign (resid  24 and name  HG1   )(resid  24 and name  HA    ) 0 0 5.0 !
assign (resid  24 and name  HG2   )(resid  24 and name  HA    ) 0 0 5.0 !

! residue 25  GLN
assign (resid  25 and name  HN    )(resid  26 and name  HN    ) 0 0 5.0 !
assign (resid  25 and name  HA    )(resid  25 and name  HN    ) 0 0 3.5 !
assign (resid  25 and name  HG1   )(resid  25 and name  HN    ) 0 0 3.5 !
assign (resid  25 and name  HG2   )(resid  25 and name  HN    ) 0 0 3.5 !
assign (resid  25 and name  HB*   )(resid  25 and name  HN    ) 0 0 3.7 !
assign (resid  25 and name  HA    )(resid  26 and name  HN    ) 0 0 2.7 !
assign (resid  25 and name  HG1   )(resid  26 and name  HN    ) 0 0 5.0 !
assign (resid  25 and name  HG2   )(resid  26 and name  HN    ) 0 0 5.0 !
assign (resid  25 and name  HB*   )(resid  26 and name  HN    ) 0 0 4.5 !
assign (resid  25 and name  HG1   )(resid  25 and name  HA    ) 0 0 3.5 !
assign (resid  25 and name  HG2   )(resid  25 and name  HA    ) 0 0 3.5 !
assign (resid  25 and name  HB*   )(resid  25 and name  HA    ) 0 0 3.7 !

! residue 26  LYS
assign (resid  26 and name  HN    )(resid  20 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HB*   )(resid  27 and name  HN    ) 0 0 4.5 !
assign (resid  26 and name  HG1   )(resid  27 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HG2   )(resid  27 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HN    )(resid  27 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HN    )(resid  22 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HA    )(resid  26 and name  HN    ) 0 0 3.5 !
assign (resid  26 and name  HB*   )(resid  26 and name  HN    ) 0 0 4.5 ! 
assign (resid  26 and name  HG1   )(resid  26 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HG2   )(resid  26 and name  HN    ) 0 0 5.0 !
assign (resid  26 and name  HB*   )(resid  26 and name  HA    ) 0 0 4.5 !
assign (resid  26 and name  HG1   )(resid  26 and name  HA    ) 0 0 3.5 !
assign (resid  26 and name  HG2   )(resid  26 and name  HA    ) 0 0 3.5 !
assign (resid  26 and name  HG1   )(resid   8 and name  HA    ) 0 0 5.0 !
assign (resid  26 and name  HG2   )(resid   8 and name  HA    ) 0 0 5.0 !

! residue 27  CYS
assign (resid  27 and name  HN    )(resid  28 and name  HN    ) 0 0 5.0 !
assign (resid  27 and name  HA    )(resid  28 and name  HN    ) 0 0 2.7 ! 
assign (resid  27 and name  HB1   )(resid  28 and name  HN    ) 0 0 3.5 ! 
assign (resid  27 and name  HB2   )(resid  28 and name  HN    ) 0 0 5.0 ! 
assign (resid  27 and name  HB1   )(resid   6 and name  HN    ) 0 0 5.0 ! 
assign (resid  27 and name  HB2   )(resid   6 and name  HN    ) 0 0 5.0 ! 
assign (resid  27 and name  HA    )(resid  27 and name  HN    ) 0 0 2.7 !
assign (resid  27 and name  HB1   )(resid  27 and name  HN    ) 0 0 3.5 !
assign (resid  27 and name  HB2   )(resid  27 and name  HN    ) 0 0 2.7 !
assign (resid  27 and name  HB2   )(resid   8 and name  HN    ) 0 0 6.0 ! 
assign (resid  27 and name  HB2   )(resid   7 and name  HN    ) 0 0 3.5 !
assign (resid  27 and name  HB1   )(resid  27 and name  HA    ) 0 0 3.5 !
assign (resid  27 and name  HB2   )(resid  27 and name  HA    ) 0 0 3.5 !
assign (resid  27 and name  HB*   )(resid  18 and name  HN    ) 0 0 6.0 !
assign (resid  27 and name  HN    )(resid   7 and name  HN    ) 0 0 5.0 !

! residue 28  ILE
assign (resid  28 and name  HN    )(resid  29 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HA    )(resid  28 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HB1   )(resid  28 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HG11  )(resid  28 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HG12  )(resid  28 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HG2*  )(resid  28 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HD1*  )(resid  28 and name  HN    ) 0 0 6.5 !
assign (resid  28 and name  HG1*  )(resid  18 and name  HN    ) 0 0 6.0 !
assign (resid  28 and name  HG2*  )(resid  18 and name  HN    ) 0 0 6.5 !
assign (resid  28 and name  HA    )(resid   6 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HG11  )(resid  20 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HG12  )(resid  20 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HG2*  )(resid  20 and name  HN    ) 0 0 6.5 !
assign (resid  28 and name  HD1*  )(resid  20 and name  HN    ) 0 0 6.5 !
assign (resid  28 and name  HA    )(resid  29 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HB1   )(resid  29 and name  HN    ) 0 0 2.7 !
assign (resid  28 and name  HG11  )(resid  29 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HG12  )(resid  29 and name  HN    ) 0 0 3.5 !
assign (resid  28 and name  HG2*  )(resid  29 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HD1*  )(resid  29 and name  HN    ) 0 0 5.0 !
assign (resid  28 and name  HB1   )(resid  28 and name  HA    ) 0 0 2.7 !
assign (resid  28 and name  HG11  )(resid  28 and name  HA    ) 0 0 5.0 !
assign (resid  28 and name  HG12  )(resid  28 and name  HA    ) 0 0 5.0 !
assign (resid  28 and name  HG2*  )(resid  28 and name  HA    ) 0 0 4.2 !
assign (resid  28 and name  HD1*  )(resid  28 and name  HA    ) 0 0 6.5 !
assign (resid  28 and name  HD1*  )(resid  18 and name  HE    ) 0 0 6.5 !

! residue 29  GLY
assign (resid  29 and name  HA1   )(resid  18 and name  HN    ) 0 0 5.0 !
assign (resid  29 and name  HA2   )(resid  18 and name  HN    ) 0 0 5.0 !
assign (resid  29 and name  HA*   )(resid  31 and name  HN    ) 0 0 6.0 !
assign (resid  29 and name  HN    )(resid  30 and name  HN    ) 0 0 5.0 !
assign (resid  29 and name  HA1   )(resid  29 and name  HN    ) 0 0 2.7 !
assign (resid  29 and name  HA2   )(resid  29 and name  HN    ) 0 0 2.7 !
assign (resid  29 and name  HA1   )(resid  30 and name  HN    ) 0 0 3.5 !
assign (resid  29 and name  HA2   )(resid  30 and name  HN    ) 0 0 3.5 !
assign (resid  29 and name  HA1   )(resid  17 and name  HA    ) 0 0 3.5 !
assign (resid  29 and name  HA2   )(resid  17 and name  HA    ) 0 0 3.5 !
assign (resid  29 and name  HA1   )(resid  29 and name  HA2   ) 0 0 2.7 !
assign (resid  29 and name  HA1   )(resid  17 and name  HD*   ) 0 0 5.2 !
assign (resid  29 and name  HA2   )(resid  17 and name  HD*   ) 0 0 5.2 !
assign (resid  29 and name  HA*   )(resid  32 and name  HB*   ) 0 0 7.0 !

! residue 30  ALA
assign (resid  30 and name  HN    )(resid  31 and name  HN    ) 0 0 2.7 !
assign (resid  30 and name  HA    )(resid  31 and name  HN    ) 0 0 3.5 !
assign (resid  30 and name  HB*   )(resid  31 and name  HN    ) 0 0 4.5 !
assign (resid  30 and name  HN    )(resid  32 and name  HN    ) 0 0 5.0 !
assign (resid  30 and name  HN    )(resid  17 and name  HA    ) 0 0 2.7 !
assign (resid  30 and name  HA    )(resid  30 and name  HN    ) 0 0 3.5 !
assign (resid  30 and name  HB*   )(resid  30 and name  HN    ) 0 0 3.7 !
assign (resid  30 and name  HA    )(resid  32 and name  HN    ) 0 0 5.0 !
assign (resid  30 and name  HA    )(resid  18 and name  HE    ) 0 0 5.0 !
assign (resid  30 and name  HB*   )(resid  18 and name  HE    ) 0 0 6.5 !
assign (resid  30 and name  HB*   )(resid  30 and name  HA    ) 0 0 3.7 !

! residue 31  HIS
assign (resid  31 and name  HN    )(resid  32 and name  HN    ) 0 0 3.5 !
assign (resid  31 and name  HA    )(resid  31 and name  HN    ) 0 0 3.5 ! 288K
assign (resid  31 and name  HB1   )(resid  31 and name  HN    ) 0 0 3.5 !
assign (resid  31 and name  HB2   )(resid  31 and name  HN    ) 0 0 3.5 !
assign (resid  31 and name  HA    )(resid  32 and name  HN    ) 0 0 2.7 ! 288K
assign (resid  31 and name  HB1   )(resid  32 and name  HN    ) 0 0 5.0 ! 
assign (resid  31 and name  HB2   )(resid  32 and name  HN    ) 0 0 5.0 !
assign (resid  31 and name  HB1   )(resid  31 and name  HA    ) 0 0 3.5 !
assign (resid  31 and name  HB2   )(resid  31 and name  HA    ) 0 0 3.5 !

! residue 32  CGU
assign (resid  32 and name  HN    )(resid  33 and name  HN    ) 0 0 3.5 !
assign (resid  32 and name  HA    )(resid  33 and name  HN    ) 0 0 2.7 !
assign (resid  32 and name  HG    )(resid  33 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB1   )(resid  33 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB2   )(resid  33 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB1   )(resid  29 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB2   )(resid  29 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB1   )(resid  34 and name  HN    ) 0 0 5.0 ! 288K
assign (resid  32 and name  HB2   )(resid  34 and name  HN    ) 0 0 5.0 ! 288K
assign (resid  32 and name  HA    )(resid  32 and name  HN    ) 0 0 3.5 !
assign (resid  32 and name  HG    )(resid  32 and name  HN    ) 0 0 5.0 !
assign (resid  32 and name  HB1   )(resid  32 and name  HN    ) 0 0 3.5 !
assign (resid  32 and name  HB2   )(resid  32 and name  HN    ) 0 0 3.5 !
assign (resid  32 and name  HB1   )(resid  32 and name  HA    ) 0 0 3.5 !
assign (resid  32 and name  HB2   )(resid  32 and name  HA    ) 0 0 3.5 !

! residue 33  ASP
assign (resid  33 and name  HN    )(resid  34 and name  HN    ) 0 0 3.5 !
assign (resid  33 and name  HA    )(resid  33 and name  HN    ) 0 0 3.5 ! 288K
assign (resid  33 and name  HB1   )(resid  33 and name  HN    ) 0 0 3.5 !
assign (resid  33 and name  HB2   )(resid  33 and name  HN    ) 0 0 3.5 !
assign (resid  33 and name  HA    )(resid  34 and name  HN    ) 0 0 2.7 !
assign (resid  33 and name  HB1   )(resid  34 and name  HN    ) 0 0 5.0 ! 288K
assign (resid  33 and name  HB2   )(resid  34 and name  HN    ) 0 0 5.0 ! 288K
assign (resid  33 and name  HB1   )(resid  33 and name  HA    ) 0 0 3.5 !
assign (resid  33 and name  HB2   )(resid  33 and name  HA    ) 0 0 3.5 ! 

! residue 34  VAL
assign (resid  34 and name  HA    )(resid  34 and name  HN    ) 0 0 3.5 !
assign (resid  34 and name  HB    )(resid  34 and name  HN    ) 0 0 3.5 !
assign (resid  34 and name  HG*   )(resid  34 and name  HN    ) 0 0 7.5 !




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