NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
573062 | 2m4w | 19024 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | simple |
!intraresiddue restraints !distances below 2.9 were overestimated => doubled lower distance limit !ref standard A-RNA: 6(n)-1'(n)=3.514A 8(n)-1'(n)=3.725A assign (resid 1 and name H8) (resid 1 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 2 and name H8) (resid 2 and name H1' ) 3.7 0.8 0.8 !average of 2 assign (resid 3 and name H1') (resid 3 and name H8 ) 4.0 0.8 0.8 !average of 2 assign (resid 4 and name H8) (resid 4 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 5 and name H6) (resid 5 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 6 and name H6) (resid 6 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 7 and name H8) (resid 7 and name H1' ) 4.6 1.0 1.0 !average of 2 assign (resid 8 and name H1') (resid 8 and name H8 ) 3.4 0.7 0.7 !average of 2 assign (resid 9 and name H8) (resid 9 and name H1' ) 3.5 0.7 0.7 !average of 2 assign (resid 10 and name H1') (resid 10 and name H8 ) 2.9 0.6 0.6 !average of 2 !assign (resid 11 and name H8) (resid 11 and name H1' ) 4.7 1.0 1.0 !average of 2 assign (resid 11 and name H8) (resid 11 and name H1' ) 3.7 1.0 1.0 !bad fitting in monoscope => minus 1A assign (resid 12 and name H1') (resid 12 and name H8 ) 3.5 0.7 0.7 !average of 2 assign (resid 13 and name H6) (resid 13 and name H1' ) 3.9 0.8 0.8 !average of 2 assign (resid 14 and name H8) (resid 14 and name H1' ) 2.9 0.6 0.6 !average of 2 assign (resid 15 and name H6) (resid 15 and name H1' ) 3.3 0.7 0.7 !average of 2 assign (resid 16 and name H6) (resid 16 and name H1' ) 3.6 0.8 0.8 !average of 2 assign (resid 17 and name H1') (resid 17 and name H6 ) 3.4 0.7 0.7 !average of 2 !ref standard A-RNA: 6(n)-2'(n)=3.992A 8(n)-2'(n)=4.124A assign (resid 1 and name H8) (resid 1 and name H2' ) 4.8 1.0 1.0 !average of 2 assign (resid 2 and name H8) (resid 2 and name H2' ) 3.8 0.8 0.8 !average of 2 assign (resid 3 and name H8) (resid 3 and name H2' ) 4.4 0.9 0.9 !average of 2 assign (resid 4 and name H2') (resid 4 and name H8 ) 3.7 0.7 0.7 !average of 2 !assign (resid 5 and name H6) (resid 5 and name H2' ) 3.0 0.6 0.6 !overlap => add 1A assign (resid 5 and name H6) (resid 5 and name H2' ) 4.0 0.8 0.8 !assign (resid 6 and name H2') (resid 6 and name H6 ) 3.4 0.7 0.7 !overlap => add 1A assign (resid 6 and name H2') (resid 6 and name H6 ) 4.4 0.9 0.9 assign (resid 7 and name H8) (resid 7 and name H2' ) 3.9 0.8 0.8 !average of 2 assign (resid 8 and name H2') (resid 8 and name H8 ) 3.0 0.6 0.6 !average of 2 assign (resid 9 and name H2') (resid 9 and name H8 ) 3.6 0.7 0.7 !average of 2 assign (resid 10 and name H2') (resid 10 and name H8 ) 3.5 0.7 0.7 !average of 2 assign (resid 11 and name H8) (resid 11 and name H2' ) 3.8 0.8 0.8 !average of 2 assign (resid 12 and name H2') (resid 12 and name H8 ) 3.4 0.7 0.7 !average of 2 !assign (resid 13 and name H6) (resid 13 and name H2' ) 2.7 0.5 0.5 !average of 2, disturbed by water signal !assign (resid 14 and name H8) (resid 14 and name H2' ) 2.6 0.5 0.5 !disturbed by water signal assign (resid 15 and name H6) (resid 15 and name H2' ) 3.3 0.7 0.7 !average of 2 assign (resid 16 and name H2') (resid 16 and name H6 ) 4.0 0.8 0.8 !average of 2 assign (resid 17 and name H2') (resid 17 and name H6 ) 3.1 0.6 0.6 !average of 2 !ref standard A-RNA: 6(n)-3'=2.994A 8(n)-3'(n)=3.195A assign (resid 1 and name H3') (resid 1 and name H8 ) 3.3 0.7 0.7 assign (resid 2 and name H8) (resid 2 and name H3' ) 3.0 0.6 0.6 !average of 2 assign (resid 3 and name H8) (resid 3 and name H3' ) 3.3 0.7 0.7 !average of 2 assign (resid 4 and name H3') (resid 4 and name H8 ) 3.2 0.6 0.6 !average of 2 !assign (resid 5 and name H3') (resid 5 and name H6 ) 2.5 0.5 0.5 !average of 2, overlap => add 1A assign (resid 5 and name H3') (resid 5 and name H6 ) 3.5 .7 0.7 assign (resid 6 and name H6) (resid 6 and name H3' ) 3.7 0.8 0.8 !average of 2 assign (resid 7 and name H8) (resid 7 and name H3' ) 4.1 0.8 0.8 !average of 2 assign (resid 8 and name H3') (resid 8 and name H8 ) 3.4 0.7 0.7 !average of 2 assign (resid 9 and name H8) (resid 9 and name H3' ) 3.1 0.6 0.6 !average of 2 !assign (resid 10 and name H3') (resid 10 and name H8 ) 4.0 0.8 0.8 !average of 2 !bad fitting in monoscope => minus 1A assign (resid 10 and name H3') (resid 10 and name H8 ) 3.0 0.8 0.8 !average of 2 assign (resid 11 and name H8) (resid 11 and name H3' ) 3.4 0.7 0.7 !average of 2 assign (resid 12 and name H3') (resid 12 and name H8 ) 3.1 0.6 0.6 !average of 2 assign (resid 13 and name H6) (resid 13 and name H3' ) 2.8 0.6 0.6 !average of 2 assign (resid 14 and name H8) (resid 14 and name H3' ) 3.0 0.6 0.6 !average of 2 assign (resid 15 and name H6) (resid 15 and name H3' ) 3.3 0.7 0.7 !average of 2 assign (resid 16 and name H3') (resid 16 and name H6 ) 3.1 0.6 0.6 !average of 2 assign (resid 17 and name H3') (resid 17 and name H6 ) 2.3 0.5 0.5 !average of 2 !ref standard A-RNA: 6(n)-4'=4.0394A 8(n)-4'(n)=4.408A assign (resid 1 and name H8) (resid 1 and name H4' ) 4.4 0.9 0.9 !average of 2 !assign (resid 2 and name H8) (resid 2 and name H4' ) 3.4 0.7 0.7 assign (resid 3 and name H8) (resid 3 and name H4' ) 3.9 0.8 0.8 assign (resid 4 and name H8) (resid 4 and name H4' ) 3.8 0.8 0.8 !average of 2 assign (resid 7 and name H8) (resid 7 and name H4' ) 4.3 0.9 0.9 assign (resid 8 and name H4') (resid 8 and name H8 ) 3.9 0.8 0.8 assign (resid 10 and name H8) (resid 10 and name H4' ) 3.9 0.8 0.8 !average of 2 assign (resid 14 and name H4') (resid 14 and name H8 ) 4.1 0.8 0.8 !average of 2 assign (resid 15 and name H4') (resid 15 and name H6 ) 4.0 0.8 0.8 !average of 2 assign (resid 16 and name H6) (resid 16 and name H4' ) 4.4 0.9 0.9 !average of 2 !ref standard A-RNA: 6(n)-5'1=4.043A 8(n)-5'1(n)=4.367A !ref standard A-RNA: 1'(n)-2'(n)=2.805A assign (resid 1 and name H2') (resid 1 and name H1' ) 2.8 0.6 0.6 !average of 2 assign (resid 2 and name H1') (resid 2 and name H2' ) 2.5 0.5 0.5 !average of 2 assign (resid 3 and name H2') (resid 3 and name H1' ) 2.5 0.5 0.5 !average of 2 assign (resid 4 and name H2') (resid 4 and name H1' ) 2.5 0.5 0.5 !average of 2 assign (resid 5 and name H1') (resid 5 and name H2' ) 2.4 0.5 0.5 !average of 2 assign (resid 6 and name H1') (resid 6 and name H2' ) 2.4 0.5 0.5 !average of 2 assign (resid 7 and name H1') (resid 7 and name H2' ) 2.6 0.5 0.5 !average of 2 assign (resid 8 and name H1') (resid 8 and name H2' ) 2.7 0.5 0.5 !average of 2 assign (resid 9 and name H1') (resid 9 and name H2' ) 2.7 0.5 0.5 !average of 2 assign (resid 10 and name H1') (resid 10 and name H2' ) 2.7 0.5 0.5 !average of 2 assign (resid 11 and name H2') (resid 11 and name H1' ) 3.2 0.6 0.6 !average of 2 assign (resid 12 and name H2') (resid 12 and name H1' ) 2.5 0.5 0.5 !average of 2 assign (resid 13 and name H1') (resid 13 and name H2' ) 3.1 0.6 0.6 !average of 2 assign (resid 14 and name H1') (resid 14 and name H2' ) 3.1 0.6 0.6 assign (resid 15 and name H1') (resid 15 and name H2' ) 3.1 0.6 0.6 !average of 2 assign (resid 16 and name H2') (resid 16 and name H1' ) 2.5 0.5 0.5 !average of 2 assign (resid 17 and name H1') (resid 17 and name H2' ) 2.3 0.5 0.5 !average of 2 !ref standard A-RNA: 1'(n)-3'(n)=3.857A assign (resid 1 and name H3') (resid 1 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 2 and name H1') (resid 2 and name H3' ) 3.5 0.7 0.7 !average of 2 assign (resid 4 and name H1') (resid 4 and name H3' ) 3.9 0.8 0.8 !average of 2 assign (resid 5 and name H3') (resid 5 and name H1' ) 3.3 0.7 0.7 !average of 2 !assign (resid 6 and name H1') (resid 6 and name H3' ) 3.2 0.6 0.6 !average of 2, overlap => add 1A assign (resid 6 and name H1') (resid 6 and name H3' ) 4.2 0.8 0.8 assign (resid 7 and name H3') (resid 7 and name H1' ) 4.0 0.8 0.8 !average of 2 assign (resid 8 and name H1') (resid 8 and name H3' ) 3.5 0.7 0.7 !average of 2 assign (resid 9 and name H1') (resid 9 and name H3' ) 3.7 0.7 0.7 !average of 2 assign (resid 11 and name H3') (resid 11 and name H1' ) 4.8 1.0 1.0 !average of 2 assign (resid 12 and name H3') (resid 12 and name H1' ) 3.6 0.7 0.7 !average of 2 assign (resid 13 and name H3') (resid 13 and name H1' ) 4.1 0.8 0.8 !average of 2 assign (resid 14 and name H1') (resid 14 and name H3' ) 3.5 0.7 0.7 !average of 2 assign (resid 16 and name H3') (resid 16 and name H1' ) 3.5 0.7 0.7 !assign (resid 17 and name H1') (resid 17 and name H3' ) 2.8 0.6 0.6 !average of 2 !overlap => add 1A assign (resid 17 and name H1') (resid 17 and name H3' ) 3.8 0.6 0.6 !average of 2 !ref standard A-RNA: 1'(n)-4'(n)=3.394A assign (resid 1 and name H4') (resid 1 and name H1' ) 3.8 0.8 0.8 !average of 2 assign (resid 2 and name H4') (resid 2 and name H1' ) 3.3 0.7 0.7 !average of 2 !assign (resid 3 and name H1') (resid 3 and name H4' ) 2.8 0.6 0.6 !average of 2 !overlap => add 1A assign (resid 3 and name H1') (resid 3 and name H4' ) 3.8 0.6 0.6 !average of 2 assign (resid 4 and name H4') (resid 4 and name H1' ) 3.5 0.7 0.7 !average of 2 assign (resid 5 and name H1') (resid 5 and name H4' ) 3.1 0.6 0.6 !average of 2 assign (resid 7 and name H1') (resid 7 and name H4' ) 3.9 1.0 1.0 !average of 2, bad fitting=> minus 1A assign (resid 8 and name H4') (resid 8 and name H1' ) 3.4 0.7 0.7 !average of 2 assign (resid 9 and name H1') (resid 9 and name H4' ) 3.7 0.7 0.7 !average of 2 assign (resid 10 and name H1') (resid 10 and name H4' ) 3.5 0.7 0.7 !average of 2 assign (resid 11 and name H4') (resid 11 and name H1' ) 4.3 0.9 0.9 !average of 2 assign (resid 12 and name H4') (resid 12 and name H1' ) 3.0 0.6 0.6 !average of 2 assign (resid 13 and name H4') (resid 13 and name H1' ) 3.5 0.7 0.7 !average of 2 assign (resid 14 and name H4') (resid 14 and name H1' ) 3.2 0.6 0.6 !average of 2 assign (resid 15 and name H4') (resid 15 and name H1' ) 3.4 0.7 0.7 !average of 2 assign (resid 16 and name H1') (resid 16 and name H4' ) 3.2 0.6 0.6 !average of 2 !assign (resid 17 and name H1') (resid 17 and name H4' ) 2.8 0.6 0.6 !average of 2 !overlap => add 1A assign (resid 17 and name H1') (resid 17 and name H4' ) 3.8 0.6 0.6 !average of 2 !ref standard A-RNA: 1'(n)-2(n)=4.791A !assign (resid 3 and name H2) (resid 3 and name H8 ) 3.5 0.7 0.7 !average of 2, overlapping with 2:H8 - 3:H1' => add 1A !assign (resid 3 and name H2) (resid 3 and name H8 ) 4.5 1 1 !assign (resid 4 and name H2) (resid 4 and name H1' ) 4.8 1.0 1.0 !average of 2 !ref standard A-RNA: 5(n)-6(n)=2.6A assign (resid 5 and name H5) (resid 5 and name H6 ) 2.7 0.5 0.5 assign (resid 13 and name H6) (resid 13 and name H5 ) 2.6 0.5 0.5 !interresiddue restraints !ref standard A-RNA: 6(n)-1'(n-1)=4.281A 8(n)-1'(n-1)=4.321A assign (resid 1 and name H1') (resid 2 and name H8) 4.1 0.8 0.8 !average of 2 assign (resid 3 and name H8) (resid 2 and name H1') 4.1 0.8 0.8 assign (resid 4 and name H8) (resid 3 and name H1') 3.9 0.8 0.8 !average of 2 assign (resid 4 and name H1') (resid 5 and name H6) 4.3 0.9 0.9 !assign (resid 6 and name H6) (resid 5 and name H1') 3.4 0.7 0.7 !average of 2 !overlap => add 1A assign (resid 6 and name H6) (resid 5 and name H1') 4.4 0.9 0.9 !average of 2 !assign (resid 6 and name H1') (resid 7 and name H8) 5.4 1.1 1.1 !average of 2 !badd fitting => minus 1A assign (resid 6 and name H1') (resid 7 and name H8) 4.4 1.1 1.1 !average of 2 assign (resid 8 and name H8) (resid 7 and name H1') 4.9 1 1 !average of 2 assign (resid 9 and name H8) (resid 8 and name H1') 4.3 0.9 0.9 !average of 2 assign (resid 10 and name H8) (resid 9 and name H1') 4.9 0.8 0.8 !average of 2 assign (resid 10 and name H1') (resid 11 and name H8) 5.1 1.0 1.0 assign (resid 10 and name H8) (resid 11 and name H1') 4.9 1.0 1.0 !average of 2 assign (resid 11 and name H1') (resid 12 and name H8) 4.8 1.0 1.0 !average of 2 assign (resid 12 and name H1') (resid 13 and name H6) 4.2 0.8 0.8 !average of 2 assign (resid 14 and name H1') (resid 15 and name H5) 4.2 0.8 0.8 !average of 2 assign (resid 16 and name H6) (resid 15 and name H1') 4.3 0.9 0.9 !average of 2 assign (resid 16 and name H1') (resid 17 and name H6) 4.2 0.7 0.7 !average of 2 !ref standard A-RNA: 5(n)-1'(n-1)= 4.979 assign (resid 5 and name H5) (resid 4 and name H1') 5.0 1.0 1.0 !ref standard A-RNA: 2(n)-1'(n+1)= 3.831 !assign (resid 3 and name H2) (resid 4 and name H1') 3.0 0.6 0.6 !average of 2 !overlap => add 1A assign (resid 3 and name H2) (resid 4 and name H1') 4.0 0.8 0.8 assign (resid 5 and name H1') (resid 4 and name H2) 3.2 0.6 0.6 !average of 2 assign (resid 6 and name H1') (resid 12 and name H2) 3.3 0.7 0.7 !average of 2 assign (resid 9 and name H1') (resid 8 and name H2) 3.3 0.7 0.7 assign (resid 10 and name H1') (resid 9 and name H2) 3.8 0.8 0.8 !average of 2 assign (resid 11 and name H1') (resid 10 and name H2) 4.8 1 1 !added manual assign (resid 13 and name H1') (resid 12 and name H2) 3.9 0.8 0.8 !average of 2 !ref standard A-RNA: 2(n)-1'(interstrand)= 4.658 assign (resid 5 and name H1') (resid 12 and name H2) 4.7 0.9 0.9 !average of 2 assign (resid 4 and name H2) (resid 14 and name H1') 4.7 0.9 0.9 !average of 2 assign (resid 4 and name H2) (resid 15 and name H1') 4.1 0.8 0.8 !average of 2 assign (resid 3 and name H2) (resid 16 and name H1') 3.3 0.7 0.7 !average of 2 !ref standard A-RNA: 1'(n)-2'(n-1)=4.189A assign (resid 2 and name H1') (resid 1 and name H2') 4.0 0.8 0.8 !average of 2 assign (resid 3 and name H2') (resid 4 and name H1') 4.0 0.8 0.8 !average of 2 assign (resid 5 and name H2') (resid 6 and name H1') 3.9 0.8 0.8 !average of 2 assign (resid 8 and name H2') (resid 9 and name H1') 3.8 0.8 0.8 assign (resid 10 and name H1') (resid 9 and name H2') 3.9 0.8 0.8 !average of 2 assign (resid 10 and name H2') (resid 11 and name H1') 4.4 0.9 0.9 !average of 2 assign (resid 13 and name H1') (resid 12 and name H2') 4.6 0.9 0.9 !average of 2 assign (resid 14 and name H1') (resid 13 and name H2') 4.5 0.9 0.9 !average of 2 assign (resid 16 and name H1') (resid 15 and name H2') 4.2 0.8 0.8 !average of 2 assign (resid 16 and name H2') (resid 17 and name H1') 4.0 0.8 0.8 !average of 2 !ref standard A-RNA: 1'(n)-1'(n-1)=5.8A !ref standard A-RNA: 6(n)-2'(n-1)=1.565A 8(n)-2'(n-1)=1.675A (increased lower distance) assign (resid 1 and name H2') (resid 2 and name H8) 2.8 1.2 0.6 !average of 2 assign (resid 3 and name H8) (resid 2 and name H2') 2.7 1 0.5 !average of 2 assign (resid 5 and name H6) (resid 4 and name H2') 2.4 1 0.5 !average of 2 assign (resid 5 and name H2') (resid 6 and name H6) 2.6 1 0.5 !average of 2 assign (resid 6 and name H2') (resid 7 and name H8) 3.1 1.2 0.6 !average of 2 assign (resid 7 and name H2') (resid 8 and name H8) 3.8 0.8 0.8 !average of 2 assign (resid 8 and name H2') (resid 9 and name H8) 2.7 1 0.5 !average of 2 assign (resid 10 and name H8) (resid 9 and name H2') 2.5 1 0.5 !average of 2 assign (resid 10 and name H2') (resid 11 and name H8) 4.1 0.8 0.8 !average of 2 assign (resid 11 and name H2') (resid 12 and name H8) 2.2 .8 0.4 !average of 2 assign (resid 13 and name H6) (resid 12 and name H2') 2.7 1 0.5 !average of 2 assign (resid 13 and name H2') (resid 14 and name H8) 3.5 0.7 0.7 !average of 2 assign (resid 15 and name H6) (resid 14 and name H2') 3.7 0.7 0.7 assign (resid 16 and name H6) (resid 15 and name H2') 2.6 1 0.5 !average of 2 assign (resid 17 and name H6) (resid 16 and name H2') 2.4 1 0.5 !average of 2 !ref standard A-RNA: 6(n)-3'(n-1)=3.099A 8(n)-3'(n-1)=3.026A assign (resid 1 and name H3') (resid 2 and name H8) 2.8 0.6 0.6 !average of 2 assign (resid 3 and name H8) (resid 2 and name H3') 3.6 0.7 0.7 !average of 2 assign (resid 3 and name H3') (resid 4 and name H8) 2.7 0.5 0.5 !average of 2 assign (resid 5 and name H6) (resid 4 and name H3') 3.4 0.7 0.7 !average of 2 assign (resid 8 and name H8) (resid 7 and name H3') 4.1 0.8 0.8 assign (resid 8 and name H3') (resid 9 and name H8) 2.6 0.5 0.5 !average of 2 assign (resid 9 and name H3') (resid 10 and name H8) 3.0 0.6 0.6 !average of 2 assign (resid 11 and name H8) (resid 10 and name H3') 4.9 1.0 1.0 !average of 2 assign (resid 12 and name H8) (resid 11 and name H3') 3.2 0.6 0.6 !average of 2 assign (resid 13 and name H3') (resid 14 and name H8) 3.7 0.7 0.7 !average of 2 assign (resid 15 and name H6) (resid 14 and name H3') 4.3 0.9 0.9 assign (resid 15 and name H3') (resid 16 and name H6) 3.4 0.7 0.7 !average of 2 assign (resid 16 and name H3') (resid 17 and name H6) 3.1 0.6 0.6 !average of 2 !ref standard A-RNA: 6(n)-5(n+1)=4.020A 8(n)-5(n+1)=3.882A assign (resid 5 and name H5) (resid 4 and name H8) 4.1 0.8 0.8 !average of 2 assign (resid 13 and name H5) (resid 12 and name H8) 4.3 0.9 0.9 !average of 2 assign (resid 16 and name H5) (resid 15 and name H6) 5.5 1.1 1.1 !average of 2 assign (resid 16 and name H6) (resid 17 and name H5) 4.7 0.9 0.9 !average of 2 assign (resid 13 and name H6) (resid 12 and name H8) 4.3 0.9 0.9 !average of 2 assign (resid 16 and name H6) (resid 17 and name H6) 4.7 0.9 0.9 !average of 2 !ref standard A-RNA: 5(n)-5(n+1)=3.999A assign (resid 5 and name H5) (resid 6 and name H5) 4.0 0.8 0.8 !ref standard A-RNA: 8(n)-8(n+1)=4.785A assign (resid 2 and name H8) (resid 1 and name H8) 4.8 1.0 1.0 !average of 2 assign (resid 3 and name H8) (resid 4 and name H8) 4.1 0.8 0.8 !average of 2 assign (resid 8 and name H8) (resid 9 and name H8) 4.1 0.8 0.8 assign (resid 9 and name H8) (resid 10 and name H8) 4.2 0.8 0.8 !average of 2 assign (resid 10 and name H8) (resid 11 and name H8) 4.0 0.7 0.7 !average of 2 assign (resid 11 and name H8) (resid 12 and name H8) 4.0 0.8 0.8 !average of 2 !ref standard A-RNA: 6(n)-8(n+1)=4.761A assign (resid 7 and name H8) (resid 6 and name H6) 3.9 0.8 0.8 !average of 2 assign (resid 13 and name H6) (resid 14 and name H8) 5.3 1.1 1.1 !average of 2 !assign (resid 8 and name H2) (resid 7 and name H8) 4.8 1.0 1.0 !average of 2 !assign (resid 10 and name H2) (resid 9 and name H1') 4.8 1.0 1.0 !average of 2 assign (resid 9 and name H1') (resid 8 and name H3') 4.6 0.9 0.9 !average of 2 assign (resid 9 and name H8) (resid 7 and name H2') 3.5 0.7 0.7 !average of 2 !assign (resid 10 and name H2) (resid 11 and name H8) 4.6 0.9 0.9 !average of 2 assign (resid 12 and name H2) (resid 13 and name H6) 4.5 0.9 0.9 assign (resid 13 and name H4') (resid 14 and name H8) 4.7 0.9 0.9 !average of 2 assign (resid 3 and name H2) (resid 4 and name H2) 4.7 0.9 0.9 !average of 2 assign (resid 10 and name H2) (resid 9 and name H2) 4.9 1.0 1.0 !average of 2 assign (resid 9 and name H8) (resid 7 and name H1') 5 1 1 !added manual ! restraints from spectrum in 90% water assign (resid 2 and name H1) (resid 17 and name H1') 5 4 1 !weak assign (resid 2 and name H1) (resid 3 and name H1') 5 4 1 !weak assign (resid 5 and name H3) (resid 11 and name H1) 4 3 1 !medium assign (resid 5 and name H3) (resid 12 and name H2) 3 2 1 !strong assign (resid 5 and name H3) (resid 6 and name H1') 5 4 1 !weak assign (resid 11 and name H1) (resid 12 and name H1') 5 4 1 !weak assign (resid 11 and name H1) (resid 7 and name H1') 4 3 1 !medium assign (resid 11 and name H1) (resid 12 and name H2) 4 3 1 !medium
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