NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)
image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
15668 1ysf 6478 cing 1-original 4 unknown distance hydrogen bond simple 


!!! H-BOND RESTRAINTS

! monomer A

! h1

patch hbon reference=1=( segid A and resid 24 ) reference=2=( segid A and resid 21 ) end
patch hbon reference=1=( segid A and resid 25 ) reference=2=( segid A and resid 21 ) end
patch hbon reference=1=( segid A and resid 26 ) reference=2=( segid A and resid 22 ) end
patch hbon reference=1=( segid A and resid 27 ) reference=2=( segid A and resid 23 ) end
patch hbon reference=1=( segid A and resid 28 ) reference=2=( segid A and resid 24 ) end
patch hbon reference=1=( segid A and resid 29 ) reference=2=( segid A and resid 26 ) end
patch hbon reference=1=( segid A and resid 30 ) reference=2=( segid A and resid 25 ) end

! b-turn

patch hbon reference=1=( segid A and resid 34 ) reference=2=( segid A and resid 31 ) end
patch hbon reference=1=( segid A and resid 16 ) reference=2=( segid A and resid 13 ) end

! b3 - b4

patch hbon reference=1=( segid A and resid 37 ) reference=2=( segid A and resid 48 ) end
patch hbon reference=1=( segid A and resid 48 ) reference=2=( segid A and resid 37 ) end

patch hbon reference=1=( segid A and resid 39 ) reference=2=( segid A and resid 46 ) end
patch hbon reference=1=( segid A and resid 46 ) reference=2=( segid A and resid 39 ) end

patch hbon reference=1=( segid A and resid 41 ) reference=2=( segid A and resid 44 ) end
patch hbon reference=1=( segid A and resid 44 ) reference=2=( segid A and resid 41 ) end


! intermol A-B

! b4 - b4'

patch hbon reference=1=( segid A and resid 45 ) reference=2=( segid B and resid 47 ) end
patch hbon reference=1=( segid A and resid 47 ) reference=2=( segid B and resid 45 ) end
patch hbon reference=1=( segid A and resid 49 ) reference=2=( segid B and resid 43 ) end

! b1 - b3'

patch hbon reference=1=( segid A and resid  8 ) reference=2=( segid B and resid 38 ) end
patch hbon reference=1=( segid A and resid 38 ) reference=2=( segid B and resid  8 ) end

patch hbon reference=1=( segid A and resid 10 ) reference=2=( segid B and resid 36 ) end
patch hbon reference=1=( segid A and resid 36 ) reference=2=( segid B and resid 10 ) end

patch hbon reference=1=( segid A and resid 12 ) reference=2=( segid B and resid 34 ) end
patch hbon reference=1=( segid A and resid 33 ) reference=2=( segid B and resid 12 ) end

! b2 - b2'

patch hbon reference=1=( segid A and resid 18 ) reference=2=( segid B and resid 18 ) end
patch hbon reference=1=( segid A and resid 20 ) reference=2=( segid B and resid 16 ) end



! intermol B-A

! b4' - b4

patch hbon reference=1=( segid B and resid 45 ) reference=2=( segid A and resid 47 ) end
patch hbon reference=1=( segid B and resid 47 ) reference=2=( segid A and resid 45 ) end
patch hbon reference=1=( segid B and resid 49 ) reference=2=( segid A and resid 43 ) end

! b1' - b3

patch hbon reference=1=( segid B and resid  8 ) reference=2=( segid A and resid 38 ) end
patch hbon reference=1=( segid B and resid 38 ) reference=2=( segid A and resid  8 ) end

patch hbon reference=1=( segid B and resid 10 ) reference=2=( segid A and resid 36 ) end
patch hbon reference=1=( segid B and resid 36 ) reference=2=( segid A and resid 10 ) end

patch hbon reference=1=( segid B and resid 12 ) reference=2=( segid A and resid 34 ) end
patch hbon reference=1=( segid B and resid 33 ) reference=2=( segid A and resid 12 ) end

! b2' - b2

patch hbon reference=1=( segid B and resid 18 ) reference=2=( segid A and resid 18 ) end
patch hbon reference=1=( segid B and resid 20 ) reference=2=( segid A and resid 16 ) end

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