NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | position | program | type | subtype | subsubtype |
|
|
2935 |
1cw5   |
4506 | cing | recoord | dress | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! 1) NH-NH, 2) All-Ring, 3) HA-NH, 4) SC-NH,
! 5) SC-HA, 6) H-bond, 7) SC-SC
! 1) NH-NH
! HN(i)-NH(i+1)
assign (resid 5 and name HN )(resid 6 and name HN ) 2.5 0.7 0.5
assign (resid 6 and name HN )(resid 7 and name HN ) 2.5 0.7 0.5
assign (resid 7 and name HN )(resid 8 and name HN ) 4.5 2.7 0.5
assign (resid 8 and name HN )(resid 9 and name HN ) 3.5 1.7 0.5
assign (resid 16 and name HN )(resid 17 and name HN ) 3.5 1.7 0.5
assign (resid 18 and name HN )(resid 19 and name HN ) 2.5 0.7 0.5
assign (resid 19 and name HN )(resid 20 and name HN ) 2.5 0.7 0.5
assign (resid 21 and name HN )(resid 22 and name HN ) 2.5 0.7 0.5
assign (resid 23 and name HN )(resid 24 and name HN ) 2.5 0.7 0.5
assign (resid 24 and name HN )(resid 25 and name HN ) 2.5 0.7 0.5
assign (resid 25 and name HN )(resid 26 and name HN ) 2.5 0.7 0.5
assign (resid 26 and name HN )(resid 27 and name HN ) 2.5 0.7 0.5
assign (resid 27 and name HN )(resid 28 and name HN ) 2.5 0.7 0.5
assign (resid 28 and name HN )(resid 29 and name HN ) 2.5 0.7 0.5
assign (resid 30 and name HN )(resid 31 and name HN ) 2.5 0.7 0.5
assign (resid 32 and name HN )(resid 33 and name HN ) 2.5 0.7 0.5
assign (resid 33 and name HN )(resid 34 and name HN ) 2.5 0.7 0.5
assign (resid 34 and name HN )(resid 35 and name HN ) 2.5 0.7 0.5
assign (resid 35 and name HN )(resid 36 and name HN ) 2.5 0.7 0.5
assign (resid 36 and name HN )(resid 37 and name HN ) 2.5 0.7 0.5
assign (resid 37 and name HN )(resid 38 and name HN ) 2.5 0.7 0.5
assign (resid 38 and name HN )(resid 39 and name HN ) 2.5 0.7 0.5
assign (resid 39 and name HN )(resid 40 and name HN ) 2.5 0.7 0.5
assign (resid 40 and name HN )(resid 41 and name HN ) 2.5 0.7 0.5
assign (resid 41 and name HN )(resid 42 and name HN ) 2.5 0.7 0.5
assign (resid 42 and name HN )(resid 43 and name HN ) 2.5 0.7 0.5
assign (resid 43 and name HN )(resid 44 and name HN ) 2.5 0.7 0.5
assign (resid 44 and name HN )(resid 45 and name HN ) 2.5 0.7 0.5
assign (resid 45 and name HN )(resid 46 and name HN ) 2.5 0.7 0.5
assign (resid 45 and name HN )(resid 46 and name HN ) 2.5 0.7 0.5
! HN(i)-NH(i+2)
assign (resid 24 and name HN )(resid 26 and name HN ) 3.5 1.7 0.8
assign (resid 26 and name HN )(resid 28 and name HN ) 3.5 1.7 0.8
assign (resid 34 and name HN )(resid 36 and name HN ) 3.5 1.7 0.8
assign (resid 38 and name HN )(resid 40 and name HN ) 3.5 1.7 0.8
assign (resid 39 and name HN )(resid 41 and name HN ) 3.5 1.7 0.8
! HN(i)-NH(i+3)
assign (resid 22 and name HN )(resid 25 and name HN ) 4.5 2.7 0.5
assign (resid 23 and name HN )(resid 26 and name HN ) 4.5 2.7 0.5
assign (resid 28 and name HN )(resid 31 and name HN ) 4.5 2.7 0.5
assign (resid 31 and name HN )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 35 and name HN )(resid 38 and name HN ) 4.5 2.7 0.5
! 2) All - Ring
assign (resid 1 and name HG1*)(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 1 and name HG2*)(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 1 and name HG1*)(resid 3 and name HE* ) 4.5 2.7 1.5
assign (resid 1 and name HG2*)(resid 3 and name HE* ) 4.5 2.7 1.5
assign (resid 7 and name HG1*)(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 7 and name HB2*)(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 7 and name HG1*)(resid 3 and name HE* ) 4.5 2.7 1.5
assign (resid 7 and name HB2*)(resid 3 and name HE* ) 4.5 2.7 1.5
assign (resid 7 and name HB )(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 3 and name HB1 )(resid 3 and name HD* ) 3.5 1.7 0.5
assign (resid 3 and name HB2 )(resid 3 and name HD* ) 3.5 1.7 0.5
assign (resid 7 and name HB )(resid 3 and name HD* ) 4.5 2.7 1.5
assign (resid 5 and name HB1 )(resid 5 and name HD2* ) 4.5 2.7 0.5
assign (resid 5 and name HB2 )(resid 5 and name HD2* ) 4.5 2.7 0.5
assign (resid 18 and name HN )(resid 18 and name HE3 ) 3.5 1.7 0.5
assign (resid 18 and name HB1 )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 18 and name HB2 )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 22 and name HN )(resid 18 and name HD1 ) 3.5 1.7 0.5
assign (resid 22 and name HA )(resid 22 and name HD* ) 4.5 2.7 0.5
assign (resid 22 and name HB* )(resid 22 and name HD* ) 4.5 2.7 0.5
assign (resid 23 and name HA )(resid 22 and name HE* ) 4.5 2.7 1.0
assign (resid 25 and name HB* )(resid 22 and name HE* ) 4.5 2.7 1.5
assign (resid 22 and name HB* )(resid 26 and name HE* ) 4.5 2.7 2.0
assign (resid 26 and name HA )(resid 26 and name HD* ) 3.5 1.7 0.5
assign (resid 26 and name HB1 )(resid 26 and name HD* ) 3.5 1.7 0.5
assign (resid 26 and name HB2 )(resid 26 and name HD* ) 3.5 1.7 0.5
assign (resid 26 and name HN )(resid 26 and name HD* ) 3.5 1.7 0.5
assign (resid 27 and name HN )(resid 26 and name HD* ) 4.5 2.7 0.5
assign (resid 27 and name HG2* )(resid 26 and name HE* ) 4.5 2.7 0.5
assign (resid 30 and name HG** )(resid 26 and name HE* ) 4.5 2.7 1.5
assign (resid 30 and name HG** )(resid 26 and name HE* ) 4.5 2.7 1.5
assign (resid 27 and name HG2* )(resid 31 and name HD22 ) 4.5 2.7 1.5
assign (resid 27 and name HG2* )(resid 31 and name HD21 ) 4.5 2.7 1.5
assign (resid 31 and name HB* )(resid 31 and name HD2* ) 4.5 2.7 0.5
assign (resid 33 and name HA )(resid 33 and name HD* ) 3.5 1.7 0.5
assign (resid 33 and name HN )(resid 33 and name HD* ) 3.5 1.7 0.5
assign (resid 33 and name HB1 )(resid 33 and name HD* ) 3.5 1.7 0.5
assign (resid 33 and name HB2 )(resid 33 and name HD* ) 3.5 1.7 0.5
assign (resid 34 and name HN )(resid 33 and name HD* ) 3.5 1.7 1.5
assign (resid 34 and name HA )(resid 33 and name HD* ) 3.5 1.7 1.5
assign (resid 34 and name HG* )(resid 33 and name HE* ) 3.5 1.7 1.5
assign (resid 34 and name HG* )(resid 33 and name HD* ) 3.5 1.7 1.5
assign (resid 37 and name HG** )(resid 33 and name HD* ) 3.5 1.7 1.5
assign (resid 37 and name HG1* )(resid 33 and name HE* ) 3.5 1.7 1.5
assign (resid 37 and name HG2* )(resid 33 and name HE* ) 3.5 1.7 1.5
! 3) HA-HN
! intra resid
assign (resid 2 and name HA )(resid 2 and name HN ) 3.5 1.7 0.5
assign (resid 3 and name HA )(resid 3 and name HN ) 3.5 1.7 0.5
assign (resid 5 and name HA )(resid 5 and name HN ) 3.5 1.7 0.5
assign (resid 6 and name HA* )(resid 6 and name HN ) 3.5 1.7 0.5
assign (resid 13 and name HA )(resid 13 and name HN ) 2.5 0.7 0.5
assign (resid 16 and name HA )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 17 and name HA )(resid 17 and name HN ) 4.5 2.7 0.5
assign (resid 18 and name HA )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 19 and name HA* )(resid 19 and name HN ) 3.5 1.7 0.5
assign (resid 20 and name HA )(resid 20 and name HN ) 3.5 1.7 0.5
assign (resid 21 and name HA )(resid 21 and name HN ) 3.5 1.7 0.5
assign (resid 22 and name HA )(resid 22 and name HN ) 3.5 1.7 0.5
assign (resid 23 and name HA )(resid 23 and name HN ) 3.5 1.7 0.5
assign (resid 24 and name HA )(resid 24 and name HN ) 3.5 1.7 0.5
assign (resid 25 and name HA )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HA )(resid 26 and name HN ) 4.5 2.7 0.5
assign (resid 27 and name HA )(resid 27 and name HN ) 2.5 0.7 0.5
assign (resid 28 and name HA )(resid 28 and name HN ) 3.5 1.7 0.5
assign (resid 31 and name HA )(resid 31 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HA )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 36 and name HA1 )(resid 36 and name HN ) 4.5 2.7 0.5
assign (resid 36 and name HA2 )(resid 36 and name HN ) 4.5 2.7 0.5
assign (resid 37 and name HA )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 38 and name HA )(resid 38 and name HN ) 3.5 1.7 0.5
assign (resid 39 and name HA )(resid 39 and name HN ) 3.5 1.7 0.5
assign (resid 40 and name HA* )(resid 40 and name HN ) 3.5 1.7 0.5
assign (resid 41 and name HA )(resid 41 and name HN ) 3.5 1.7 0.5
assign (resid 42 and name HA* )(resid 42 and name HN ) 3.5 1.7 0.5
assign (resid 43 and name HA )(resid 43 and name HN ) 2.5 0.7 0.5
assign (resid 44 and name HA )(resid 44 and name HN ) 3.5 1.7 0.5
assign (resid 45 and name HA1 )(resid 45 and name HN ) 3.5 1.7 0.5
assign (resid 45 and name HA2 )(resid 45 and name HN ) 3.5 1.7 0.5
assign (resid 46 and name HA )(resid 46 and name HN ) 3.5 1.7 0.5
assign (resid 47 and name HA )(resid 47 and name HN ) 3.5 1.7 0.5
! HA(i)-HN(i+1)
assign (resid 1 and name HA )(resid 2 and name HN ) 3.5 1.7 0.5
assign (resid 5 and name HA )(resid 6 and name HN ) 3.5 1.7 0.5
assign (resid 6 and name HA1 )(resid 7 and name HN ) 3.5 1.7 0.5
assign (resid 6 and name HA2 )(resid 7 and name HN ) 3.5 1.7 0.5
assign (resid 8 and name HA )(resid 9 and name HN ) 2.5 0.7 0.5
assign (resid 10 and name HA )(resid 11 and name HN ) 3.5 1.7 0.5
assign (resid 12 and name HA )(resid 13 and name HN ) 3.5 1.7 0.5
assign (resid 15 and name HA )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 17 and name HA )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 18 and name HA )(resid 19 and name HN ) 3.5 1.7 0.5
assign (resid 25 and name HA )(resid 26 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HA )(resid 28 and name HN ) 4.5 2.7 0.5
assign (resid 32 and name HA )(resid 33 and name HN ) 3.5 1.7 0.5
assign (resid 33 and name HA )(resid 34 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HA )(resid 35 and name HN ) 3.5 1.7 0.5
assign (resid 36 and name HA1 )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 36 and name HA2 )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HA )(resid 38 and name HN ) 3.5 1.7 0.5
assign (resid 39 and name HA )(resid 40 and name HN ) 4.5 1.7 0.5
assign (resid 40 and name HA* )(resid 41 and name HN ) 3.5 1.7 0.5
assign (resid 42 and name HA* )(resid 43 and name HN ) 3.5 1.7 0.5
assign (resid 46 and name HA )(resid 47 and name HN ) 3.5 1.7 0.5
! HA(i)-HN(i+2)
assign (resid 17 and name HA )(resid 19 and name HN ) 3.5 1.7 0.5
assign (resid 32 and name HA )(resid 34 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HA )(resid 39 and name HN ) 3.5 1.7 0.5
assign (resid 44 and name HA )(resid 46 and name HN ) 3.5 1.7 0.5
! HA(i)-HN(i+3 or 4)
assign (resid 17 and name HA )(resid 20 and name HN ) 4.5 2.7 0.5
assign (resid 20 and name HA )(resid 24 and name HN ) 4.5 2.7 0.5
assign (resid 22 and name HA )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 23 and name HA )(resid 26 and name HN ) 4.5 2.7 0.5
assign (resid 24 and name HA )(resid 28 and name HN ) 3.5 1.7 0.5
assign (resid 31 and name HA )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 31 and name HA )(resid 35 and name HN ) 4.5 2.7 0.5
assign (resid 34 and name HA )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HA )(resid 38 and name HN ) 4.5 2.7 0.5
assign (resid 35 and name HA )(resid 38 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HA )(resid 40 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HA )(resid 41 and name HN ) 3.5 1.7 0.5
! 4) SC-NH
! intra-resid
assign (resid 2 and name HB1 )(resid 2 and name HN ) 3.5 1.7 0.5
assign (resid 2 and name HB2 )(resid 2 and name HN ) 3.5 1.7 0.5
assign (resid 3 and name HB1 )(resid 3 and name HN ) 3.5 1.7 0.5
assign (resid 3 and name HB2 )(resid 3 and name HN ) 3.5 1.7 0.5
assign (resid 5 and name HB1 )(resid 5 and name HN ) 4.5 2.7 0.5
assign (resid 5 and name HB2 )(resid 5 and name HN ) 4.5 2.7 0.5
assign (resid 7 and name HB )(resid 7 and name HN ) 3.5 1.7 0.5
assign (resid 7 and name HG1* )(resid 7 and name HN ) 3.5 1.7 1.5
assign (resid 7 and name HG2* )(resid 7 and name HN ) 3.5 1.7 1.5
assign (resid 8 and name HB* )(resid 8 and name HN ) 3.5 1.7 0.5
assign (resid 11 and name HB* )(resid 11 and name HN ) 3.5 1.7 0.5
assign (resid 11 and name HG* )(resid 11 and name HN ) 4.5 2.7 0.5
assign (resid 12 and name HG* )(resid 12 and name HN ) 4.5 2.7 0.5
assign (resid 14 and name HB* )(resid 14 and name HN ) 3.5 1.7 0.5
assign (resid 16 and name HB )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 16 and name HG* )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 17 and name HB* )(resid 17 and name HN ) 3.5 1.7 0.5
assign (resid 18 and name HB1 )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 18 and name HB2 )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 20 and name HB* )(resid 20 and name HN ) 3.5 1.7 0.5
assign (resid 22 and name HB* )(resid 22 and name HN ) 3.5 1.7 0.5
assign (resid 23 and name HB1 )(resid 23 and name HN ) 3.5 1.7 0.5
assign (resid 23 and name HB2 )(resid 23 and name HN ) 3.5 1.7 0.5
assign (resid 23 and name HG1 )(resid 23 and name HN ) 4.5 2.7 0.5
assign (resid 23 and name HG2 )(resid 23 and name HN ) 4.5 2.7 0.5
assign (resid 24 and name HB1 )(resid 24 and name HN ) 3.5 1.7 0.5
assign (resid 24 and name HB2 )(resid 24 and name HN ) 3.5 1.7 0.5
assign (resid 24 and name HG1 )(resid 24 and name HN ) 4.5 2.7 0.5
assign (resid 24 and name HG2 )(resid 24 and name HN ) 4.5 2.7 0.5
assign (resid 25 and name HB* )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 25 and name HG* )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HB1 )(resid 26 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HB2 )(resid 26 and name HN ) 3.5 1.7 0.5
assign (resid 27 and name HG2* )(resid 27 and name HN ) 4.5 2.7 0.5
assign (resid 28 and name HB* )(resid 28 and name HN ) 3.5 1.7 0.5
assign (resid 30 and name HB )(resid 30 and name HN ) 3.5 1.7 0.5
assign (resid 30 and name HG2* )(resid 30 and name HN ) 4.5 2.7 0.5
assign (resid 31 and name HB1 )(resid 31 and name HN ) 3.5 1.7 0.5
assign (resid 31 and name HB2 )(resid 31 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HB )(resid 34 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HG2* )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 34 and name HG1* )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 37 and name HB )(resid 37 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HG1* )(resid 37 and name HN ) 4.5 2.7 0.5
assign (resid 37 and name HG2* )(resid 37 and name HN ) 4.5 2.7 0.5
assign (resid 38 and name HB* )(resid 38 and name HN ) 3.5 1.7 0.5
assign (resid 39 and name HB1 )(resid 39 and name HN ) 3.5 1.7 0.5
assign (resid 39 and name HB2 )(resid 39 and name HN ) 3.5 1.7 0.5
assign (resid 41 and name HB* )(resid 41 and name HN ) 3.5 1.7 0.5
assign (resid 44 and name HB )(resid 44 and name HN ) 3.5 1.7 0.5
assign (resid 44 and name HG1* )(resid 44 and name HN ) 4.5 2.7 0.5
assign (resid 44 and name HG2* )(resid 44 and name HN ) 4.5 2.7 0.5
assign (resid 44 and name HG2* )(resid 44 and name HN ) 4.5 2.7 0.5
assign (resid 46 and name HB1 )(resid 46 and name HN ) 3.5 1.7 0.5
assign (resid 46 and name HB2 )(resid 46 and name HN ) 3.5 1.7 0.5
assign (resid 47 and name HG* )(resid 46 and name HN ) 4.5 2.7 0.5
! inter-resid (i,i+1)
assign (resid 1 and name HG* )(resid 2 and name HN ) 4.5 2.7 0.5
assign (resid 5 and name HB1 )(resid 6 and name HN ) 4.5 2.7 0.5
assign (resid 5 and name HB2 )(resid 6 and name HN ) 4.5 2.7 0.5
assign (resid 7 and name HB )(resid 8 and name HN ) 4.5 2.7 0.5
assign (resid 11 and name HB* )(resid 12 and name HN ) 4.5 2.7 0.5
assign (resid 15 and name HB1 )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 15 and name HB2 )(resid 16 and name HN ) 3.5 1.7 0.5
assign (resid 17 and name HB* )(resid 18 and name HN ) 3.5 1.7 0.5
assign (resid 20 and name HB* )(resid 21 and name HN ) 3.5 1.7 0.5
assign (resid 21 and name HB* )(resid 22 and name HN ) 3.5 1.7 0.5
assign (resid 24 and name HB1 )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 24 and name HB2 )(resid 25 and name HN ) 3.5 1.7 0.5
assign (resid 25 and name HB* )(resid 26 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HB1 )(resid 27 and name HN ) 3.5 1.7 0.5
assign (resid 26 and name HB2 )(resid 27 and name HN ) 3.5 1.7 0.5
assign (resid 27 and name HG2* )(resid 28 and name HN ) 3.5 1.7 1.5
assign (resid 28 and name HB* )(resid 29 and name HN ) 3.5 1.7 0.5
assign (resid 30 and name HB )(resid 31 and name HN ) 3.5 1.7 0.5
assign (resid 30 and name HG* )(resid 31 and name HN ) 4.5 2.7 0.5
assign (resid 33 and name HB1 )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 33 and name HB2 )(resid 34 and name HN ) 4.5 2.7 0.5
assign (resid 34 and name HB )(resid 35 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HG1* )(resid 35 and name HN ) 3.5 1.7 0.5
assign (resid 34 and name HG2* )(resid 35 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HB )(resid 38 and name HN ) 3.5 1.7 0.5
assign (resid 37 and name HG1* )(resid 38 and name HN ) 4.5 2.7 0.5
assign (resid 37 and name HG2* )(resid 38 and name HN ) 4.5 2.7 0.5
assign (resid 41 and name HB* )(resid 42 and name HN ) 3.5 1.7 0.5
assign (resid 44 and name HB )(resid 45 and name HN ) 4.5 2.7 0.5
assign (resid 44 and name HG* )(resid 45 and name HN ) 4.5 2.7 0.5
! inter-resid (i,i+3)
assign (resid 27 and name HG2* )(resid 31 and name HN ) 4.5 2.7 0.5
assign (resid 35 and name HB* )(resid 38 and name HN ) 4.5 2.7 0.5
! 5) SC-HA
! intra-resid or short range Chain-HA
assign (resid 2 and name HB1 )(resid 2 and name HA ) 3.5 1.7 0.5
assign (resid 2 and name HB2 )(resid 2 and name HA ) 3.5 1.7 0.5
assign (resid 3 and name HB1 )(resid 3 and name HA ) 3.5 1.7 0.5
assign (resid 3 and name HB2 )(resid 3 and name HA ) 3.5 1.7 0.5
assign (resid 5 and name HB1 )(resid 5 and name HA ) 3.5 1.7 0.5
assign (resid 5 and name HB2 )(resid 5 and name HA ) 3.5 1.7 0.5
assign (resid 7 and name HG** )(resid 7 and name HA ) 3.5 1.7 0.5
assign (resid 8 and name HB* )(resid 8 and name HA ) 3.5 1.7 0.5
assign (resid 10 and name HB* )(resid 10 and name HA ) 3.5 1.7 0.5
assign (resid 11 and name HB* )(resid 11 and name HA ) 3.5 1.7 0.5
assign (resid 13 and name HB* )(resid 13 and name HA ) 3.5 1.7 0.5
assign (resid 16 and name HG**)(resid 18 and name HA ) 4.5 1.7 2.5
assign (resid 18 and name HB1 )(resid 18 and name HA ) 3.5 1.7 0.5
assign (resid 18 and name HB2 )(resid 18 and name HA ) 3.5 1.7 0.5
assign (resid 20 and name HB* )(resid 20 and name HA ) 3.5 1.7 0.5
assign (resid 22 and name HB* )(resid 22 and name HA ) 3.5 1.7 0.5
assign (resid 23 and name HB1 )(resid 23 and name HA ) 3.5 1.7 0.5
assign (resid 23 and name HB2 )(resid 23 and name HA ) 3.5 1.7 0.5
assign (resid 24 and name HB1 )(resid 24 and name HA ) 3.5 1.7 0.5
assign (resid 26 and name HB1 )(resid 26 and name HA ) 3.5 1.7 0.5
assign (resid 26 and name HB2 )(resid 26 and name HA ) 3.5 1.7 0.5
assign (resid 28 and name HB* )(resid 28 and name HA ) 3.5 1.7 0.5
assign (resid 31 and name HB1 )(resid 31 and name HA ) 3.5 1.7 0.5
assign (resid 31 and name HB2 )(resid 31 and name HA ) 3.5 1.7 0.5
assign (resid 33 and name HB1 )(resid 33 and name HA ) 3.5 1.7 0.5
assign (resid 33 and name HB2 )(resid 33 and name HA ) 3.5 1.7 0.5
assign (resid 34 and name HB )(resid 34 and name HA ) 3.5 1.7 0.5
assign (resid 34 and name HG1* )(resid 34 and name HA ) 3.5 1.7 0.5
assign (resid 34 and name HG2* )(resid 34 and name HA ) 3.5 1.7 0.5
assign (resid 35 and name HB1 )(resid 35 and name HA ) 3.5 1.7 0.5
assign (resid 35 and name HB2 )(resid 35 and name HA ) 3.5 1.7 0.5
assign (resid 37 and name HG1* )(resid 37 and name HA ) 4.5 2.7 0.5
assign (resid 37 and name HG2* )(resid 37 and name HA ) 4.5 2.7 0.5
assign (resid 38 and name HB* )(resid 38 and name HA ) 3.5 1.7 0.5
assign (resid 39 and name HB1 )(resid 39 and name HA ) 3.5 1.7 0.5
assign (resid 39 and name HB2 )(resid 39 and name HA ) 3.5 1.7 0.5
assign (resid 41 and name HB* )(resid 41 and name HA ) 3.5 1.7 0.5
assign (resid 43 and name HB1 )(resid 43 and name HA ) 3.5 1.7 0.5
assign (resid 43 and name HB2 )(resid 43 and name HA ) 3.5 1.7 0.5
assign (resid 44 and name HB )(resid 44 and name HA ) 3.5 1.7 0.5
assign (resid 44 and name HG1* )(resid 44 and name HA ) 3.5 1.7 0.5
assign (resid 46 and name HB1 )(resid 46 and name HA ) 3.5 1.7 0.5
assign (resid 46 and name HB2 )(resid 46 and name HA ) 3.5 1.7 0.5
assign (resid 46 and name HG2 )(resid 46 and name HA ) 3.5 1.7 0.5
! inter resid-(i,i+3)
assign (resid 21 and name HB* )(resid 18 and name HA ) 3.5 1.7 0.5
assign (resid 23 and name HB1 )(resid 20 and name HA ) 3.5 1.7 0.5
assign (resid 23 and name HB2 )(resid 20 and name HA ) 3.5 1.7 0.5
assign (resid 24 and name HB1 )(resid 21 and name HA ) 3.5 1.7 0.5
assign (resid 24 and name HB2 )(resid 21 and name HA ) 3.5 1.7 0.5
assign (resid 25 and name HB* )(resid 22 and name HA ) 3.5 1.7 0.5
assign (resid 26 and name HB1 )(resid 23 and name HA ) 4.5 2.7 0.5
assign (resid 26 and name HB2 )(resid 23 and name HA ) 4.5 2.7 0.5
assign (resid 28 and name HB* )(resid 25 and name HA ) 3.5 1.7 0.5
assign (resid 30 and name HB )(resid 27 and name HA ) 3.5 1.7 0.5
assign (resid 31 and name HB1 )(resid 28 and name HA ) 3.5 1.7 0.5
assign (resid 31 and name HB2 )(resid 28 and name HA ) 3.5 1.7 0.5
assign (resid 33 and name HB1 )(resid 30 and name HA ) 3.5 1.7 0.5
assign (resid 33 and name HB2 )(resid 30 and name HA ) 3.5 1.7 0.5
assign (resid 34 and name HB )(resid 31 and name HA ) 3.5 1.7 0.5
assign (resid 37 and name HB )(resid 34 and name HA ) 4.5 2.7 0.5
assign (resid 37 and name HG1* )(resid 34 and name HA ) 4.5 2.7 0.5
assign (resid 37 and name HG2* )(resid 34 and name HA ) 4.5 2.7 0.5
assign (resid 38 and name HB* )(resid 35 and name HA ) 3.5 1.7 0.5
! inter resid-(i,i+n n>3)
assign (resid 25 and name HB*)(resid 21 and name HA ) 4.5 2.7 0.5
assign (resid 30 and name HB )(resid 26 and name HA ) 4.5 2.7 0.5
assign (resid 38 and name HB*)(resid 34 and name HA ) 4.5 2.7 0.5
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