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
1883 1b4c 4001 cing 1-original 4 XPLOR/CNS distance hydrogen bond simple


! H-BOND CONSTRAINTS

!FOR HELIX #1
!assign (segid="sbm1" and resid 0 and name o) (segid="sbm1" and resid 4 and name hn) 1.5 0 1.3
!assign (segid="sbm2" and resid 0 and name o) (segid="sbm2" and resid 4 and name hn) 1.5 0 1.3
!assign (segid="sbm1" and resid 0 and name o) (segid="sbm1" and resid 4 and name n) 2.4 0 1.1
!assign (segid="sbm2" and resid 0 and name o) (segid="sbm2" and resid 4 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 1 and name o) (segid="sbm1" and resid 5 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 1 and name o) (segid="sbm2" and resid 5 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 1 and name o) (segid="sbm1" and resid 5 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 1 and name o) (segid="sbm2" and resid 5 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 2 and name o) (segid="sbm1" and resid 6 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 2 and name o) (segid="sbm2" and resid 6 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 2 and name o) (segid="sbm1" and resid 6 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 2 and name o) (segid="sbm2" and resid 6 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 3 and name o) (segid="sbm1" and resid 7 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 3 and name o) (segid="sbm2" and resid 7 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 3 and name o) (segid="sbm1" and resid 7 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 3 and name o) (segid="sbm2" and resid 7 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 4 and name o) (segid="sbm1" and resid 8 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 4 and name o) (segid="sbm2" and resid 8 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 4 and name o) (segid="sbm1" and resid 8 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 4 and name o) (segid="sbm2" and resid 8 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 5 and name o) (segid="sbm1" and resid 9 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 5 and name o) (segid="sbm2" and resid 9 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 5 and name o) (segid="sbm1" and resid 9 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 5 and name o) (segid="sbm2" and resid 9 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 6 and name o) (segid="sbm1" and resid 10 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 6 and name o) (segid="sbm2" and resid 10 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 6 and name o) (segid="sbm1" and resid 10 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 6 and name o) (segid="sbm2" and resid 10 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 7 and name o) (segid="sbm1" and resid 11 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 7 and name o) (segid="sbm2" and resid 11 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 7 and name o) (segid="sbm1" and resid 11 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 7 and name o) (segid="sbm2" and resid 11 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 8 and name o) (segid="sbm1" and resid 12 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 8 and name o) (segid="sbm2" and resid 12 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 8 and name o) (segid="sbm1" and resid 12 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 8 and name o) (segid="sbm2" and resid 12 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 9 and name o) (segid="sbm1" and resid 13 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 9 and name o) (segid="sbm2" and resid 13 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 9 and name o) (segid="sbm1" and resid 13 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 9 and name o) (segid="sbm2" and resid 13 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 10 and name o) (segid="sbm1" and resid 14 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 10 and name o) (segid="sbm2" and resid 14 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 10 and name o) (segid="sbm1" and resid 14 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 10 and name o) (segid="sbm2" and resid 14 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 11 and name o) (segid="sbm1" and resid 15 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 11 and name o) (segid="sbm2" and resid 15 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 11 and name o) (segid="sbm1" and resid 15 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 11 and name o) (segid="sbm2" and resid 15 and name n) 2.4 0 1.1
!       15hn is weak or shows exchange
assign (segid="sbm1" and resid 12 and name o) (segid="sbm1" and resid 16 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 12 and name o) (segid="sbm2" and resid 16 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 12 and name o) (segid="sbm1" and resid 16 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 12 and name o) (segid="sbm2" and resid 16 and name n) 2.4 0 1.1
!       16hn shows some exchange?
assign (segid="sbm1" and resid 13 and name o) (segid="sbm1" and resid 17 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 13 and name o) (segid="sbm2" and resid 17 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 13 and name o) (segid="sbm1" and resid 17 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 13 and name o) (segid="sbm2" and resid 17 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 14 and name o) (segid="sbm1" and resid 18 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 14 and name o) (segid="sbm2" and resid 18 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 14 and name o) (segid="sbm1" and resid 18 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 14 and name o) (segid="sbm2" and resid 18 and name n) 2.4 0 1.1
!       18hn is weak or shows some exchange


!LOOP 1
!H25
!amb assign (segid="sbm1" and resid 18 and name og) (segid="sbm1" and resid 25 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 18 and name og) (segid="sbm2" and resid 25 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 18 and name og) (segid="sbm1" and resid 25 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 18 and name og) (segid="sbm2" and resid 25 and name n) 2.4 0 1.1
!       25hn sees 18 ha and possibly hb* (both amb but make sense), 18og thus well placed for Hbond

!K26
!amb assign (segid="sbm1" and resid 18 and name og) (segid="sbm1" and resid 26 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 18 and name og) (segid="sbm2" and resid 26 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 18 and name og) (segid="sbm1" and resid 26 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 18 and name og) (segid="sbm2" and resid 26 and name n) 2.4 0 1.1
!       26hn sees 18 ha and hb* (both amb but make sense), 18og thus well placed for Hbond


!BETA SHEET
assign (segid="sbm1" and resid 27 and name o) (segid="sbm1" and resid 68 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 27 and name o) (segid="sbm2" and resid 68 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 27 and name o) (segid="sbm1" and resid 68 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 27 and name o) (segid="sbm2" and resid 68 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 68 and name o) (segid="sbm1" and resid 27 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 68 and name o) (segid="sbm2" and resid 27 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 68 and name o) (segid="sbm1" and resid 27 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 68 and name o) (segid="sbm2" and resid 27 and name n) 2.4 0 1.1

!amb assign (segid="sbm1" and resid 66 and name o) (segid="sbm1" and resid 29 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 66 and name o) (segid="sbm2" and resid 29 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 66 and name o) (segid="sbm1" and resid 29 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 66 and name o) (segid="sbm2" and resid 29 and name n) 2.4 0 1.1
!       NOT SURE ABOUT THIS LAST ONE,  29 begins helix 2 and 30hn-29hn med in both strips


!HELIX #2
assign (segid="sbm1" and resid 28 and name o) (segid="sbm1" and resid 32 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 28 and name o) (segid="sbm2" and resid 32 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 28 and name o) (segid="sbm1" and resid 32 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 28 and name o) (segid="sbm2" and resid 32 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 29 and name o) (segid="sbm1" and resid 33 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 29 and name o) (segid="sbm2" and resid 33 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 29 and name o) (segid="sbm1" and resid 33 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 29 and name o) (segid="sbm2" and resid 33 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 30 and name o) (segid="sbm1" and resid 34 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 30 and name o) (segid="sbm2" and resid 34 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 30 and name o) (segid="sbm1" and resid 34 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 30 and name o) (segid="sbm2" and resid 34 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 31 and name o) (segid="sbm1" and resid 35 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 31 and name o) (segid="sbm2" and resid 35 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 31 and name o) (segid="sbm1" and resid 35 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 31 and name o) (segid="sbm2" and resid 35 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 32 and name o) (segid="sbm1" and resid 36 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 32 and name o) (segid="sbm2" and resid 36 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 32 and name o) (segid="sbm1" and resid 36 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 32 and name o) (segid="sbm2" and resid 36 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 33 and name o) (segid="sbm1" and resid 37 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 33 and name o) (segid="sbm2" and resid 37 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 33 and name o) (segid="sbm1" and resid 37 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 33 and name o) (segid="sbm2" and resid 37 and name n) 2.4 0 1.1
!37hn shows little exchange

assign (segid="sbm1" and resid 34 and name o) (segid="sbm1" and resid 38 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 34 and name o) (segid="sbm2" and resid 38 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 34 and name o) (segid="sbm1" and resid 38 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 34 and name o) (segid="sbm2" and resid 38 and name n) 2.4 0 1.1
!38hn shows little exchange

!amb assign (segid="sbm1" and resid 35 and name o) (segid="sbm1" and resid 39 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 35 and name o) (segid="sbm2" and resid 39 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 35 and name o) (segid="sbm1" and resid 39 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 35 and name o) (segid="sbm2" and resid 39 and name n) 2.4 0 1.1
!       39hn shows some exchange, think helix ends at 38

!amb assign (segid="sbm1" and resid 36 and name o) (segid="sbm1" and resid 40 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 36 and name o) (segid="sbm2" and resid 40 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 36 and name o) (segid="sbm1" and resid 40 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 36 and name o) (segid="sbm2" and resid 40 and name n) 2.4 0 1.1


!amb assign (segid="sbm1" and resid 37 and name o) (segid="sbm1" and resid 41 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 37 and name o) (segid="sbm2" and resid 41 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 37 and name o) (segid="sbm1" and resid 41 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 37 and name o) (segid="sbm2" and resid 41 and name n) 2.4 0 1.1
!       41hn shows some exchange or is weak

!amb assign (segid="sbm1" and resid 38 and name o) (segid="sbm1" and resid 42 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 38 and name o) (segid="sbm2" and resid 42 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 38 and name o) (segid="sbm1" and resid 42 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 38 and name o) (segid="sbm2" and resid 42 and name n) 2.4 0 1.1
!       42hn too weak to see H exchange


!HELIX #3
!amb assign (segid="sbm1" and resid 49 and name o) (segid="sbm1" and resid 53 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 49 and name o) (segid="sbm2" and resid 53 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 49 and name o) (segid="sbm1" and resid 53 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 49 and name o) (segid="sbm2" and resid 53 and name n) 2.4 0 1.1
! not sure but makes sense

assign (segid="sbm1" and resid 50 and name o) (segid="sbm1" and resid 54 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 50 and name o) (segid="sbm2" and resid 54 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 50 and name o) (segid="sbm1" and resid 54 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 50 and name o) (segid="sbm2" and resid 54 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 51 and name o) (segid="sbm1" and resid 55 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 51 and name o) (segid="sbm2" and resid 55 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 51 and name o) (segid="sbm1" and resid 55 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 51 and name o) (segid="sbm2" and resid 55 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 52 and name o) (segid="sbm1" and resid 56 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 52 and name o) (segid="sbm2" and resid 56 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 52 and name o) (segid="sbm1" and resid 56 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 52 and name o) (segid="sbm2" and resid 56 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 53 and name o) (segid="sbm1" and resid 57 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 53 and name o) (segid="sbm2" and resid 57 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 53 and name o) (segid="sbm1" and resid 57 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 53 and name o) (segid="sbm2" and resid 57 and name n) 2.4 0 1.1
! 57hn shows little exchange

assign (segid="sbm1" and resid 54 and name o) (segid="sbm1" and resid 58 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 54 and name o) (segid="sbm2" and resid 58 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 54 and name o) (segid="sbm1" and resid 58 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 54 and name o) (segid="sbm2" and resid 58 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 55 and name o) (segid="sbm1" and resid 59 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 55 and name o) (segid="sbm2" and resid 59 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 55 and name o) (segid="sbm1" and resid 59 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 55 and name o) (segid="sbm2" and resid 59 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 56 and name o) (segid="sbm1" and resid 60 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 56 and name o) (segid="sbm2" and resid 60 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 56 and name o) (segid="sbm1" and resid 60 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 56 and name o) (segid="sbm2" and resid 60 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 57 and name o) (segid="sbm1" and resid 61 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 57 and name o) (segid="sbm2" and resid 61 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 57 and name o) (segid="sbm1" and resid 61 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 57 and name o) (segid="sbm2" and resid 61 and name n) 2.4 0 1.1


assign (segid="sbm1" and resid 58 and name o) (segid="sbm1" and resid 62 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 58 and name o) (segid="sbm2" and resid 62 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 58 and name o) (segid="sbm1" and resid 62 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 58 and name o) (segid="sbm2" and resid 62 and name n) 2.4 0 1.1


!HELIX #4
!assign (segid="sbm1" and resid 69 and name o) (segid="sbm1" and resid 73 and name hn) 1.5 0 1.3
!assign (segid="sbm2" and resid 69 and name o) (segid="sbm2" and resid 73 and name hn) 1.5 0 1.3
!assign (segid="sbm1" and resid 69 and name o) (segid="sbm1" and resid 73 and name n) 2.4 0 1.1
!assign (segid="sbm2" and resid 69 and name o) (segid="sbm2" and resid 73 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 70 and name o) (segid="sbm1" and resid 74 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 70 and name o) (segid="sbm2" and resid 74 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 70 and name o) (segid="sbm1" and resid 74 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 70 and name o) (segid="sbm2" and resid 74 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 71 and name o) (segid="sbm1" and resid 75 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 71 and name o) (segid="sbm2" and resid 75 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 71 and name o) (segid="sbm1" and resid 75 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 71 and name o) (segid="sbm2" and resid 75 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 72 and name o) (segid="sbm1" and resid 76 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 72 and name o) (segid="sbm2" and resid 76 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 72 and name o) (segid="sbm1" and resid 76 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 72 and name o) (segid="sbm2" and resid 76 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 73 and name o) (segid="sbm1" and resid 77 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 73 and name o) (segid="sbm2" and resid 77 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 73 and name o) (segid="sbm1" and resid 77 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 73 and name o) (segid="sbm2" and resid 77 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 74 and name o) (segid="sbm1" and resid 78 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 74 and name o) (segid="sbm2" and resid 78 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 74 and name o) (segid="sbm1" and resid 78 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 74 and name o) (segid="sbm2" and resid 78 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 75 and name o) (segid="sbm1" and resid 79 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 75 and name o) (segid="sbm2" and resid 79 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 75 and name o) (segid="sbm1" and resid 79 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 75 and name o) (segid="sbm2" and resid 79 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 76 and name o) (segid="sbm1" and resid 80 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 76 and name o) (segid="sbm2" and resid 80 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 76 and name o) (segid="sbm1" and resid 80 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 76 and name o) (segid="sbm2" and resid 80 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 77 and name o) (segid="sbm1" and resid 81 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 77 and name o) (segid="sbm2" and resid 81 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 77 and name o) (segid="sbm1" and resid 81 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 77 and name o) (segid="sbm2" and resid 81 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 78 and name o) (segid="sbm1" and resid 82 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 78 and name o) (segid="sbm2" and resid 82 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 78 and name o) (segid="sbm1" and resid 82 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 78 and name o) (segid="sbm2" and resid 82 and name n) 2.4 0 1.1
!       82hn too weak

assign (segid="sbm1" and resid 79 and name o) (segid="sbm1" and resid 83 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 79 and name o) (segid="sbm2" and resid 83 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 79 and name o) (segid="sbm1" and resid 83 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 79 and name o) (segid="sbm2" and resid 83 and name n) 2.4 0 1.1
!       83hn shows little exchange



!HELIX CAPS

!helix 1, N-terminal
assign (segid="sbm1" and resid 1 and name og) (segid="sbm1" and resid 4 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 1 and name og) (segid="sbm2" and resid 4 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 1 and name og) (segid="sbm1" and resid 4 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 1 and name og) (segid="sbm2" and resid 4 and name n) 2.4 0 1.1

assign (segid="sbm1" and resid 4 and name oe1) (segid="sbm1" and resid 1 and name hn) 1.5 0 1.3
assign (segid="sbm2" and resid 4 and name oe1) (segid="sbm2" and resid 1 and name hn) 1.5 0 1.3
assign (segid="sbm1" and resid 4 and name oe1) (segid="sbm1" and resid 1 and name n) 2.4 0 1.1
assign (segid="sbm2" and resid 4 and name oe1) (segid="sbm2" and resid 1 and name n) 2.4 0 1.1

!helix 3
!N-terminal: only half-cap for this one b/c V52 cant reciprocate
!amb assign (segid="sbm1" and resid 49 and name oe1) (segid="sbm1" and resid 52 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 49 and name oe1) (segid="sbm2" and resid 52 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 49 and name oe1) (segid="sbm1" and resid 52 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 49 and name oe1) (segid="sbm2" and resid 52 and name n) 2.4 0 1.1

!C-terminal
!amb assign (segid="sbm1" and resid 59 and name o) (segid="sbm1" and resid 63 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 59 and name o) (segid="sbm2" and resid 63 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 59 and name o) (segid="sbm1" and resid 63 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 59 and name o) (segid="sbm2" and resid 63 and name n) 2.4 0 1.1

!amb assign (segid="sbm1" and resid 60 and name o) (segid="sbm1" and resid 64 and name hn) 1.5 0 1.3
!amb assign (segid="sbm2" and resid 60 and name o) (segid="sbm2" and resid 64 and name hn) 1.5 0 1.3
!amb assign (segid="sbm1" and resid 60 and name o) (segid="sbm1" and resid 64 and name n) 2.4 0 1.1
!amb assign (segid="sbm2" and resid 60 and name o) (segid="sbm2" and resid 64 and name n) 2.4 0 1.1




Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Saturday, April 27, 2024 5:25:40 PM GMT (wattos1)