NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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1616 |
1arj   |
cing | 1-original | 3 | XPLOR/CNS | distance | NOE | simple |
!restraints from h2o noesy, tighter for GH1 to AH2 very intense NOEs !3d means constraint is derived soley from 3d data, upper bound=6 angstroms !200 ms means observed in 200 ms NOESY and confirmed in 3d, but not present !at 60 or 120 ms. upper bound=6 angstroms !120 ms means observed in 120 ms and 200 ms NOESY and confirmed in 3d but !not present at 60 ms. upper bound=6 angstroms !all other non-exchangeable NOES are present in the 60 ms NOESY and either !confirmed in the 3d or self evident from the 2d. !numbers refer to cross peak assignments within one of 5 felix databases; !arosug.1995 !onepsug.1995 !argwt.aroh1p !argtar.aroaro !sugsug.611 !argtar.h1ph1p !the first three databases are fully updated. corresponding text files !with lists of assignments are in the directory /usr/people/fard/felix210/text !The text files are titled argwt.aroh1p, onepsug.latest, and arosug.latest !Numbers at the ends of lines in this file refer to the assignment within the !appropriate database. !To view the assignments on the screen within felix, just open the !corresponding database and, after plotting the data, select the "footprint" !icon from within the "display" submenu. The option "show id numbers" will !display boxes with numbers over the crosspeaks, while the "show labels" !will display the actual assignments. assign (resid 36 and name H8) (resid 36 and name H1') 3.0 1.2 1.0 !4 assign (resid 36 and name H8) (resid 36 and name H3') 2.4 0.6 0.6 !5 assign (resid 36 and name H8) (resid 36 and name H4') 3.5 1.7 3.0 !3d assign (resid 36 and name H8) (resid 36 and name H5') 3.5 1.7 3.0 !3d assign (resid 36 and name H8) (resid 36 and name H5'') 3.5 1.7 3.0 !3d assign (resid 36 and name H8) (resid 37 and name H5) 3.5 1.7 1.5 !3 assign (resid 36 and name H8) (resid 37 and name H6) 3.5 1.7 1.5 !35 assign (resid 36 and name H8) (resid 36 and name H2'') 3.5 1.7 1.5 !med to med weaK assign (resid 36 and name H1') (resid 36 and name H2'') 3.5 1.7 3.0 !3d assign (resid 36 and name H1') (resid 36 and name H3') 3.5 1.7 3.0 !3d !assign (resid 36 and name H3') (resid 36 and name H5') 3.5 1.7 3.0 !3d stereo 4.19 !assign (resid 36 and name H4') (resid 36 and name H5'') 3.5 1.7 3.0 !gab assign (resid 36 and name H5') (resid 37 and name H6) 3.5 1.7 2.5 !3d nonnoe assign (resid 36 and name H4') (resid 36 and name H1') 3.5 1.7 3.0 !3d assign (resid 36 and name H4') (resid 36 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 37 and name H6) (resid 37 and name H1') 3.0 1.2 1.0 !41 assign (resid 38 and name H6) (resid 37 and name H6) 3.5 1.7 2.5 !36 assign (resid 37 and name H6) (resid 36 and name H4') 3.5 1.7 3.0 !3d assign (resid 37 and name H6) (resid 36 and name H3') 3.0 1.7 1.0 !46 assign (resid 37 and name H6) (resid 36 and name H2'') 3.5 1.7 2.5 !3D? assign (resid 37 and name H6) (resid 36 and name H1') 3.5 1.7 2.5 !3d assign (resid 37 and name H6) (resid 37 and name H3') 3.5 1.7 1.5 !45 o resolved in 3d assign (resid 37 and name H6) (resid 38 and name H5) 3.5 1.7 2.5 !3d assign (resid 37 and name H5) (resid 36 and name H2'') 3.5 1.7 2.5 !120 ms assign (resid 37 and name H1') (resid 36 and name H2'') 3.5 1.7 2.5 !3d assign (resid 37 and name H6) (resid 37 and name H2'') 3.5 1.7 2.5 !gab assign (resid 37 and name H6) (resid 37 and name H4') 3.5 1.7 2.5 !gab assign (resid 37 and name H6) (resid 37 and name H5') 3.5 1.7 2.5 !gab assign (resid 37 and name H6) (resid 37 and name H5'') 3.5 1.7 2.5 !gab assign (resid 37 and name H1') (resid 37 and name H2'') 3.5 1.7 2.5 !gab assign (resid 37 and name H5) (resid 37 and name H2'') 3.5 1.7 3.5 !gab assign (resid 37 and name H1') (resid 37 and name H3') 3.5 1.7 2.5 !3d assign (resid 37 and name H1') (resid 37 and name H4') 3.5 1.7 2.5 !3d assign (resid 37 and name H1') (resid 37 and name H5') 3.5 1.7 2.5 !gab assign (resid 37 and name H1') (resid 37 and name H5'') 3.5 1.7 2.5 !gab !assign (resid 37 and name H3') (resid 37 and name H5') 3.5 1.7 2.5 !gab assign (resid 37 and name H4') (resid 37 and name H5') 3.5 1.7 2.5 !gab assign (resid 37 and name H4') (resid 37 and name H5'') 3.5 1.7 2.5 !gab assign (resid 38 and name H6) (resid 37 and name H1') 3.5 1.7 2.5 !3d assign (resid 38 and name H6) (resid 37 and name H2'') 3.5 1.7 1.5 !13 assign (resid 38 and name H6) (resid 37 and name H3') 2.4 0.6 0.6 !18 oL tightened assign (resid 38 and name H6) (resid 37 and name H4') 3.5 1.7 3.0 !18 ol 3d !assign (resid 38 and name H6) (resid 37 and name H5') 3.5 1.7 3.0 !200 ms stereo 4.12 not clear in 3d !assign (resid 38 and name H6) (resid 37 and name H5'') 3.5 1.7 2.5 !3d mbiguous assign (resid 38 and name H6) (resid 38 and name H1') 3.5 1.7 1.5 !12 assign (resid 38 and name H6) (resid 38 and name H2'') 3.5 1.7 1.5 !21 vw at 60 assign (resid 38 and name H6) (resid 38 and name H3') 2.4 0.6 0.6 !18 oL tightened assign (resid 38 and name H6) (resid 38 and name H4') 3.5 1.7 3.0 !3d not clear assign (resid 38 and name H6) (resid 38 and name H5') 3.5 1.7 2.5 !gab assign (resid 38 and name H6) (resid 38 and name H5'') 3.5 1.7 2.5 !gab assign (resid 38 and name H6) (resid 39 and name H5) 3.5 1.7 2.5 !15 assign (resid 38 and name H6) (resid 39 and name H6) 3.5 1.7 2.5 !53 assign (resid 38 and name H5) (resid 37 and name H2'') 3.5 1.7 3.0 !3d assign (resid 38 and name H1') (resid 37 and name H2'') 3.5 1.7 2.5 !3d assign (resid 38 and name H2'') (resid 37 and name H2'') 3.5 1.7 2.5 !3d assign (resid 38 and name H2'') (resid 39 and name H6) 2.4 0.6 0.6 !75 assign (resid 38 and name H2'') (resid 39 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 38 and name H2'') (resid 39 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 37 and name H5) (resid 38 and name H5) 3.5 1.7 2.5 !66/67 h1ph1P assign (resid 37 and name H5) (resid 36 and name H3') 3.5 1.7 1.5 !56? confirmed 3d assign (resid 37 and name H5) (resid 37 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 37 and name H5) (resid 37 and name H1') 3.5 1.7 2.5 !65 h1ph1P !assign (resid 37 and name H4') (resid 38 and name H1') 3.5 1.7 2.5 !3d must be s-d assign (resid 38 and name H5) (resid 38 and name H2'') 3.5 1.7 3.0 !gab assign (resid 38 and name H5) (resid 38 and name H3') 3.5 1.7 2.5 !gab assign (resid 38 and name H5) (resid 38 and name H4') 3.5 1.7 3.5 !3d loosened assign (resid 38 and name H5) (resid 39 and name H5) 3.5 1.7 1.5 !48 h1ph1P assign (resid 39 and name H5) (resid 38 and name H2'') 2.4 0.6 0.6 !15 tighten f. 5.0 assign (resid 39 and name H5) (resid 38 and name H3') 3.5 1.7 2.5 !200 ms assign (resid 39 and name H5) (resid 38 and name H4') 3.5 1.7 2.5 !3d not clear !assign (resid 38 and name H1') (resid 37 and name H4') 3.5 1.7 2.5 !200 ms ? assign (resid 38 and name H1') (resid 38 and name H2'') 2.4 0.6 0.6 !15 assign (resid 38 and name H1') (resid 38 and name H3') 3.5 1.7 2.5 !200 ms assign (resid 38 and name H1') (resid 38 and name H4') 2.4 0.6 0.6 !44 tighten f. 4.0 assign (resid 39 and name H1') (resid 38 and name H2'') 3.5 1.7 1.5 !120 ms assign (resid 39 and name H6) (resid 38 and name H1') 3.5 1.7 2.5 !63 ol assign (resid 39 and name H6) (resid 38 and name H3') 3.5 1.5 2.5 !74 ol but in 3d assign (resid 39 and name H6) (resid 39 and name H1') 3.0 1.2 1.0 !65 tight. f. 5.0 assign (resid 38 and name H2'') (resid 38 and name H3') 3.5 1.7 2.5 !gab assign (resid 38 and name H3') (resid 38 and name H4') 3.5 1.7 2.5 !gab recommends < 5 !assign (resid 38 and name H3') (resid 38 and name H5'') 3.5 1.7 2.5 !gab stereo !assign (resid 38 and name H4') (resid 38 and name H5'') 3.5 1.7 2.5 !gab stereo assign (resid 39 and name H6) (resid 39 and name H2'') 3.5 1.7 2.5 !74 ol but in 3D assign (resid 39 and name H6) (resid 39 and name H3') 3.0 1.2 1.0 !76 assign (resid 39 and name H6) (resid 39 and name H4') 3.5 1.7 2.5 !74 ol but in 3d assign (resid 39 and name H6) (resid 39 and name H5') 3.5 1.7 2.5 !3d assign (resid 39 and name H6) (resid 39 and name H5'') 3.5 1.7 2.5 !3d assign (resid 39 and name H5) (resid 39 and name H3') 3.5 1.7 2.5 !3d assign (resid 39 and name H5) (resid 39 and name H5'') 3.5 1.7 3.5 !3d stereo assign (resid 39 and name H1') (resid 39 and name H4') 3.5 1.7 2.5 !looks like 38 in 200ms but 39 3d assign (resid 39 and name H1') (resid 39 and name H2'') 2.4 0.6 0.6 !36 assign (resid 39 and name H1') (resid 39 and name H3') 3.5 1.7 1.5 !65 assign (resid 39 and name H1') (resid 39 and name H4') 3.5 1.7 2.5 !3d assign (resid 39 and name H2'') (resid 39 and name H3') 3.5 1.7 2.5 !3d !assign (resid 39 and name H2'') (resid 39 and name H5'') 3.5 1.7 2.5 !gab stereo assign (resid 39 and name H3') (resid 39 and name H4') 3.5 1.7 2.5 !gab rec. < 5 assign (resid 39 and name H3') (resid 39 and name H5') 3.5 1.7 2.5 !gab rec. < 5 assign (resid 39 and name H3') (resid 39 and name H5'') 3.5 1.7 2.5 !gab rec. < 5 assign (resid 39 and name H4') (resid 39 and name H5') 3.5 1.7 2.5 !gab rec. < 5 assign (resid 39 and name H4') (resid 39 and name H5'') 3.5 1.7 2.5 !gab rec. < 5 assign (resid 39 and name H6) (resid 40 and name H6) 3.5 1.7 2.5 !52 aroarO assign (resid 40 and name H6) (resid 40 and name H1') 3.5 1.7 1.5 !5 oL assign (resid 40 and name H6) (resid 40 and name H2'') 3.5 1.7 2.5 !3d assign (resid 40 and name H6) (resid 40 and name H3') 2.4 0.6 0.6 !8 tightened assign (resid 40 and name H6) (resid 40 and name H4') 3.5 1.7 2.5 !3d assign (resid 40 and name H6) (resid 40 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 40 and name H6) (resid 40 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 40 and name H6) (resid 39 and name H1') 3.5 1.7 1.5 !4 assign (resid 40 and name H6) (resid 39 and name H2'') 2.4 0.6 0.6 !8 assign (resid 40 and name H6) (resid 39 and name H4') 3.5 1.7 2.5 !3d assign (resid 40 and name H6) (resid 39 and name H3') 3.0 1.2 1.0 !9 assign (resid 40 and name H5) (resid 39 and name H3') 3.5 1.7 1.5 !67 ol but clear in 3d assign (resid 40 and name H5) (resid 39 and name H4') 3.5 1.7 2.5 !3d assign (resid 40 and name H5) (resid 39 and name H6) 3.5 1.7 1.5 !64 assign (resid 40 and name H5) (resid 39 and name H2'') 3.5 1.7 2.5 !3d nonnoe assign (resid 40 and name H1') (resid 39 and name H2'') 3.5 1.7 2.5 !3d unclear assign (resid 40 and name H1') (resid 39 and name H3') 3.5 1.7 1.5 !67 ol but not clear in 3d assign (resid 40 and name H5) (resid 39 and name H2'') 3.0 1.2 1.0 !38 ol but clear in 3D assign (resid 40 and name H1') (resid 40 and name H2'') 3.5 1.7 2.5 !3d assign (resid 40 and name H1') (resid 40 and name H3') 3.5 1.7 2.5 !3d assign (resid 40 and name H1') (resid 40 and name H4') 3.5 1.7 2.5 !3d assign (resid 40 and name H1') (resid 40 and name H5') 3.5 1.7 2.5 !3d assign (resid 40 and name H1') (resid 40 and name H5'') 3.5 1.7 2.5 !3d assign (resid 40 and name H2'') (resid 40 and name H3') 3.5 1.7 2.5 !3d assign (resid 40 and name H3') (resid 40 and name H4') 3.5 1.7 2.5 !gab rec < 5 !assign (resid 40 and name H3') (resid 40 and name H5'') 3.5 1.7 2.5 !gab rec < 5 stereo assign (resid 40 and name H4') (resid 40 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 40 and name H4') (resid 40 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 40 and name H5) (resid 40 and name H3') 3.5 1.7 2.5 !38 ol in 2d assign (resid 40 and name H6) (resid 41 and name H5) 3.5 1.7 1.5 !6 oL !assign (resid 40 and name H1') (resid 41 and name H1') 3.5 1.7 3.0 !3D? assign (resid 40 and name H5) (resid 41 and name H5) 3.5 1.7 2.5 !44 assign (resid 40 and name H1') (resid 41 and name H6) 3.5 1.7 1.5 !18 loosened ol assign (resid 40 and name H2'') (resid 41 and name H6) 2.4 0.6 0.6 !26 ol tightened assign (resid 40 and name H3') (resid 41 and name H6) 3.5 1.7 2.5 !3d !assign (resid 41 and name H6) (resid 40 and name H5') 3.5 1.7 2.5 !3d stereo 4.53 assign (resid 40 and name H2'') (resid 41 and name H5) 3.5 1.7 1.5 !50 assign (resid 40 and name H3') (resid 41 and name H5) 3.0 1.2 2.0 !weak for noW assign (resid 40 and name H6) (resid 41 and name H6) 3.5 1.7 2.5 !49 aroarO assign (resid 41 and name H6) (resid 42 and name H5) 3.5 1.7 3.0 !21 assign (resid 41 and name H1') (resid 41 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 41 and name H1') (resid 41 and name H5'') 3.5 1.7 2.5 !200 ms assign (resid 41 and name H1') (resid 41 and name H5') 3.5 1.7 2.5 !200 ms assign (resid 41 and name H2'') (resid 41 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 41 and name H2'') (resid 41 and name H5') 3.5 1.7 2.5 !gab assign (resid 41 and name H2'') (resid 41 and name H5'') 3.5 1.7 2.5 !gab assign (resid 41 and name H3') (resid 41 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 41 and name H3') (resid 41 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 41 and name H4') (resid 41 and name H6) 3.5 1.7 2.5 !3d nonnoe assign (resid 41 and name H4') (resid 41 and name H5) 3.5 1.7 3.5 !gab assign (resid 41 and name H4') (resid 41 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 41 and name H4') (resid 41 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 41 and name H4') (resid 41 and name H2'') 3.5 1.7 2.5 !3d nonnoe assign (resid 41 and name H6) (resid 41 and name H1') 3.5 1.7 1.5 !20 assign (resid 41 and name H6) (resid 41 and name H2'') 3.5 1.7 2.5 !3d assign (resid 41 and name H6) (resid 41 and name H3') 3.5 1.7 2.5 !3d nonnoe assign (resid 41 and name H5) (resid 41 and name H2'') 3.5 1.7 1.5 !62 assign (resid 41 and name H5) (resid 41 and name H3') 3.5 1.7 2.5 !200 ms assign (resid 41 and name H1') (resid 41 and name H2'') 2.4 0.6 0.6 !60 assign (resid 41 and name H1') (resid 41 and name H4') 2.4 0.6 0.6 !47 assign (resid 41 and name H5'') (resid 41 and name H6) 3.5 1.7 2.5 !27 4.14 assign (resid 41 and name H5') (resid 41 and name H6) 3.5 1.7 2.5 !gab assign (resid 41 and name H2'') (resid 42 and name H6) 2.4 0.6 0.6 !41 !assign (resid 42 and name H1') (resid 41 and name H3') 3.5 1.7 2.5 !3d strnage but true! assign (resid 42 and name H1') (resid 41 and name H2'') 3.5 1.7 2.5 !120 ms assign (resid 42 and name H1') (resid 42 and name H2'') 2.4 0.6 0.6 !35 assign (resid 42 and name H1') (resid 42 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 42 and name H1') (resid 42 and name H4') 3.5 1.7 2.5 !120 ms assign (resid 42 and name H1') (resid 42 and name H5') 3.5 1.7 2.5 !200 ms stereo 4.6 assign (resid 42 and name H1') (resid 42 and name H5'') 3.5 1.7 2.5 !gab assign (resid 42 and name H1') (resid 42 and name H6) 3.5 1.7 1.5 !38 assign (resid 42 and name H2'') (resid 42 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 42 and name H6) (resid 42 and name H2'') 3.5 1.7 2.5 !3d assign (resid 42 and name H3') (resid 42 and name H6) 2.4 0.6 0.6 !40 o tightened f. 5.0 assign (resid 42 and name H5') (resid 42 and name H6) 3.5 1.7 3.5 !3d nonnoe assign (resid 42 and name H5'') (resid 42 and name H6) 3.5 1.7 3.5 !3d nonnoe L assign (resid 42 and name H3') (resid 42 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 42 and name H3') (resid 42 and name H5'') 3.5 1.7 2.5 !gab rec <5 assign (resid 42 and name H4') (resid 42 and name H6) 3.5 1.7 2.5 !gab assign (resid 42 and name H4') (resid 42 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 42 and name H4') (resid 42 and name H5'') 3.5 1.7 2.5 !gab rec <5 assign (resid 42 and name H5) (resid 41 and name H2'') 3.5 1.7 1.5 !61 assign (resid 42 and name H5) (resid 41 and name H3') 3.5 1.7 2.5 !200 ms assign (resid 42 and name H6) (resid 41 and name H1') 3.5 1.7 1.5 !36 !assign (resid 42 and name H6) (resid 42 and name H5') 3.5 1.7 2.5 !gab rec < 5 stereo assign (resid 42 and name H6) (resid 41 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 42 and name H5) (resid 42 and name H1') 3.5 1.7 2.5 !gab assign (resid 42 and name H5) (resid 42 and name H2'') 3.5 1.7 2.5 !gab assign (resid 41 and name H5) (resid 42 and name H5) 3.5 1.7 2.5 !58 h1ph1p assign (resid 42 and name H3') (resid 42 and name H4') 3.5 1.7 2.5 !3d assign (resid 42 and name H5) (resid 42 and name H3') 3.5 1.7 2.5 !200 ms assign (resid 42 and name H5) (resid 42 and name H4') 3.5 1.7 3.5 !gab assign (resid 43 and name H8) (resid 42 and name H3') 3.5 1.7 2.5 !3d assign (resid 43 and name H8) (resid 42 and name H2'') 2.4 0.6 0.6 !43 assign (resid 43 and name H8) (resid 42 and name H4') 3.5 1.7 2.5 !3d !assign (resid 42 and name H5'') (resid 42 and name H6) 3.5 1.7 1.5 !42 4.09 ppm assign (resid 43 and name H8) (resid 43 and name H1') 3.0 1.2 1.0 !39 tight. f. 5.0 !assign (resid 43 and name H8) (resid 44 and name H5) 3.5 1.7 3.0 !under 40 not visible in 2D assign (resid 42 and name H1') (resid 43 and name H8) 3.5 1.7 1.5 !38 top halF assign (resid 43 and name H8) (resid 43 and name H2'') 3.5 1.7 2.5 !45 oL 3DcH assign (resid 43 and name H8) (resid 43 and name H3') 3.0 1.2 1.0 !47 loosened (ol) assign (resid 43 and name H8) (resid 43 and name H4') 3.5 1.7 1.5 !45 or 48 ol assign (resid 43 and name H8) (resid 43 and name H5') 3.5 1.7 2.5 !3d assign (resid 43 and name H8) (resid 43 and name H5'') 3.5 1.7 2.5 !3d assign (resid 43 and name H8) (resid 44 and name H5) 3.5 1.7 2.5 !3d assign (resid 43 and name H1') (resid 42 and name H1') 3.5 1.7 2.5 !gab assign (resid 43 and name H1') (resid 42 and name H2'') 3.5 1.7 2.5 !3d assign (resid 43 and name H1') (resid 43 and name H2'') 2.4 0.6 0.6 !39 assign (resid 43 and name H1') (resid 43 and name H3') 3.0 1.2 1.0 !25 tight. 5.0 assign (resid 43 and name H1') (resid 43 and name H4') 3.5 1.7 2.5 !3d assign (resid 43 and name H2'') (resid 43 and name H3') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H2'') (resid 43 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H2'') (resid 43 and name H5'') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H3') (resid 43 and name H4') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H3') (resid 43 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H3') (resid 43 and name H5'') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H4') (resid 43 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 43 and name H4') (resid 43 and name H5'') 3.5 1.7 2.5 !gab rec <5 !assign (resid 43 and name H5'') (resid 43 and name H8) 3.5 1.7 1.5 !44 4.15 ppm assign (resid 43 and name H1') (resid 44 and name H5) 3.5 1.7 2.5 !60 h1p h1P assign (resid 43 and name H2'') (resid 44 and name H5) 3.5 1.7 2.5 !3d assign (resid 43 and name H3') (resid 44 and name H5) 3.5 1.7 2.5 !120 ms assign (resid 43 and name H2'') (resid 44 and name H1') 3.5 1.7 2.5 !3d !assign (resid 43 and name H4') (resid 44 and name H1') 3.5 1.7 2.5 !3d fishy assign (resid 44 and name H1') (resid 44 and name H5) 3.5 1.7 2.5 !3d assign (resid 44 and name H5) (resid 44 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 44 and name H1') (resid 44 and name H3') 3.5 1.7 3.0 assign (resid 44 and name H1') (resid 44 and name H4') 3.5 1.7 2.5 !3d assign (resid 44 and name H1') (resid 44 and name H5') 3.5 1.7 2.5 !3d stereo? assign (resid 44 and name H1') (resid 44 and name H5'')3.5 1.7 2.5 !3d assign (resid 44 and name H1') (resid 44 and name H2'') 2.4 0.6 0.6 !59 assign (resid 44 and name H6) (resid 44 and name H1') 3.5 1.7 2.5 !3d nonnoe assign (resid 44 and name H2'') (resid 44 and name H4') 3.5 1.7 2.5 !gab assign (resid 44 and name H2'') (resid 44 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 44 and name H3') (resid 44 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 44 and name H3') (resid 44 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 44 and name H4') (resid 44 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 44 and name H4') (resid 44 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 43 and name H1') (resid 44 and name H6) 3.5 1.7 1.5 !55 assign (resid 43 and name H2'') (resid 44 and name H6) 3.0 1.2 1.0 !63 assign (resid 43 and name H3') (resid 44 and name H6) 3.0 1.2 1.0 !65 oL but distincT assign (resid 43 and name H4') (resid 44 and name H6) 3.5 1.7 2.5 !62 ol assign (resid 44 and name H5) (resid 45 and name H5) 3.5 1.7 2.5 !66/67 h1ph1P assign (resid 44 and name H2'') (resid 44 and name H3') 3.5 1.7 2.5 !3d assign (resid 44 and name H6) (resid 44 and name H3') 3.5 1.7 1.5 !64 ol assign (resid 44 and name H6) (resid 44 and name H4') 3.5 1.7 2.5 !gab assign (resid 44 and name H6) (resid 44 and name H5') 3.5 1.7 2.5 !3d stereo! assign (resid 44 and name H6) (resid 44 and name H5'') 3.5 1.7 2.5 !3d !assign (resid 44 and name H5) (resid 44 and name H5'') 3.5 1.7 2.5 ! gab stereo assign (resid 45 and name H6) (resid 44 and name H3') 3.5 1.7 2.5 !87 ol but clear in 3D assign (resid 45 and name H6) (resid 45 and name H1') 3.0 1.2 1.0 !59 assign (resid 45 and name H6) (resid 44 and name H4') 3.5 1.7 2.5 !3d assign (resid 45 and name H6) (resid 44 and name H1') 3.5 1.7 1.5 !60 ol w. 45:H1' assign (resid 45 and name H6) (resid 44 and name H2'') 2.4 0.6 0.6 !67 assign (resid 45 and name H6) (resid 45 and name H3') 2.4 0.6 0.6 !68 assign (resid 45 and name H6) (resid 45 and name H4') 3.5 1.7 2.5 !3d loosened assign (resid 45 and name H6) (resid 45 and name H2'') 3.5 1.7 1.5 !69 assign (resid 45 and name H6) (resid 45 and name H5') 3.5 1.7 2.5 !3d assign (resid 45 and name H6) (resid 45 and name H5'') 3.5 1.7 2.5 !3d assign (resid 45 and name H5) (resid 44 and name H2'') 3.5 1.7 2.5 !gab assign (resid 45 and name H4') (resid 44 and name H3') 3.5 1.7 2.5 !gab flexible assign (resid 45 and name H5) (resid 45 and name H2'') 3.5 1.7 2.5 !3d and 120 ms assign (resid 45 and name H5) (resid 45 and name H3') 3.5 1.7 2.5 !3d and 120 ms !assign (resid 45 and name H5) (resid 45 and name H4') 3.5 1.7 2.5 !3d unclear assign (resid 45 and name H5) (resid 44 and name H3') 3.5 1.7 2.5 !3d assign (resid 45 and name H5) (resid 44 and name H4') 3.5 1.7 2.5 !3d assign (resid 44 and name H5) (resid 45 and name H5) 3.5 1.7 2.5 !nonnoe assign (resid 45 and name H1') (resid 45 and name H3') 3.0 1.2 1.0 !64 assign (resid 45 and name H1') (resid 45 and name H2'') 2.4 0.6 0.6 !70 assign (resid 45 and name H1') (resid 45 and name H4') 3.5 1.7 2.5 !3d assign (resid 45 and name H1') (resid 45 and name H5') 3.5 1.7 2.5 !120 ms stereo 4.15 assign (resid 45 and name H1') (resid 45 and name H5'') 3.5 1.7 2.5 !gab assign (resid 45 and name H1') (resid 44 and name H2'') 3.5 1.7 2.5 !3d assign (resid 45 and name H1') (resid 44 and name H3') 3.5 1.7 3.5 !3d flexibility !assign (resid 45 and name H1') (resid 44 and name H4') 3.5 1.7 3.5 !200 ms fishy assign (resid 45 and name H2'') (resid 45 and name H3') 3.5 1.7 2.5 !3d assign (resid 45 and name H2'') (resid 45 and name H4') 3.5 1.7 2.5 !3d assign (resid 45 and name H3') (resid 44 and name H3') 3.5 1.7 2.5 !3d !assign (resid 45 and name H4') (resid 44 and name H3') 3.5 1.7 2.5 !3d assign (resid 45 and name H3') (resid 45 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 45 and name H3') (resid 45 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 45 and name H4') (resid 45 and name H5') 3.5 1.7 2.5 !gab rec <5 assign (resid 45 and name H4') (resid 45 and name H5'') 3.5 1.7 2.5 !gab rec <5 assign (resid 17 and name H8) (resid 17 and name H1') 3.5 1.7 2.5 !3d assign (resid 17 and name H8) (resid 17 and name H2'') 3.5 1.7 1.5 !10 assign (resid 17 and name H8) (resid 17 and name H3') 3.5 1.7 2.5 !3d assign (resid 17 and name H8) (resid 17 and name H4') 3.5 1.7 2.5 !3d assign (resid 17 and name H8) (resid 17 and name H5') 3.5 1.7 2.5 !3d assign (resid 17 and name H8) (resid 17 and name H5'') 3.5 1.7 2.5 !3d !assign (resid 17 and name H8) (resid 17 and name H5') 3.5 1.7 1.5 !11 assign (resid 17 and name H1') (resid 17 and name H4') 3.5 1.7 1.5 !37 assign (resid 17 and name H1') (resid 17 and name H2'') 2.4 0.6 0.6 !13 tighten f. 4.0 assign (resid 17 and name H1') (resid 17 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 17 and name H1') (resid 17 and name H5') 3.5 1.7 2.5 !3d stereo assign (resid 17 and name H1') (resid 17 and name H5'') 3.5 1.7 2.5 !gab assign (resid 17 and name H2'') (resid 17 and name H3') 3.5 1.7 2.5 !3d assign (resid 17 and name H2'') (resid 17 and name H4') 3.5 1.7 2.5 !3d assign (resid 17 and name H2'') (resid 17 and name H5') 3.5 1.7 2.5 !3d stereo assign (resid 17 and name H2'') (resid 17 and name H5'') 3.5 1.7 2.5 !gab assign (resid 17 and name H3') (resid 17 and name H4') 3.5 1.7 2.5 !3d assign (resid 17 and name H3') (resid 17 and name H5') 3.5 1.7 2.5 !3d stereo assign (resid 17 and name H3') (resid 17 and name H5'') 3.5 1.7 2.5 !gab assign (resid 17 and name H4') (resid 17 and name H5') 3.5 1.7 2.5 !3d assign (resid 17 and name H4') (resid 17 and name H5'') 3.5 1.7 2.5 !3d assign (resid 17 and name H8) (resid 18 and name H8) 3.5 1.7 2.5 !49 aroarO assign (resid 17 and name H2'') (resid 18 and name H1') 3.5 1.7 1.5 !12 assign (resid 18 and name H8) (resid 17 and name H1') 3.5 1.7 2.5 !3d assign (resid 18 and name H8) (resid 17 and name H2'') 2.4 0.6 0.6 !66 assign (resid 18 and name H8) (resid 17 and name H3') 3.5 1.7 2.5 !3d assign (resid 18 and name H8) (resid 17 and name H4') 3.5 1.7 2.5 !3d assign (resid 18 and name H8) (resid 18 and name H1') 3.5 1.7 1.5 !58 assign (resid 18 and name H8) (resid 18 and name H2'') 3.5 1.7 1.5 !65 ol looks right 3d assign (resid 18 and name H8) (resid 18 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 18 and name H8) (resid 18 and name H4') 3.5 1.7 2.5 !3d assign (resid 18 and name H8) (resid 18 and name H5') 3.5 1.7 2.5 !gab assign (resid 18 and name H8) (resid 18 and name H5'') 3.5 1.7 2.5 !gab assign (resid 18 and name H1') (resid 18 and name H2'') 2.4 0.6 0.6 !34 assign (resid 18 and name H1') (resid 18 and name H3') 3.5 1.7 1.5 !27 assign (resid 18 and name H1') (resid 18 and name H4') 3.5 1.7 2.5 !gab rec < 5 assign (resid 18 and name H1') (resid 18 and name H5') 3.5 1.7 2.5 !200 ms 4.14 assign (resid 18 and name H1') (resid 18 and name H5'') 3.5 1.7 2.5 !gab assign (resid 18 and name H2'') (resid 18 and name H5') 3.5 1.7 2.5 !3d assign (resid 18 and name H2'') (resid 18 and name H5'') 3.5 1.7 2.5 !gab assign (resid 18 and name H3') (resid 18 and name H5') 3.5 1.7 2.5 !3d assign (resid 18 and name H3') (resid 18 and name H5'') 3.5 1.7 2.5 !gab assign (resid 18 and name H3') (resid 18 and name H4') 3.5 1.7 2.5 !3d stereo assign (resid 19 and name H6) (resid 18 and name H1') 3.5 1.7 1.5 !58 assign (resid 19 and name H6) (resid 18 and name H2'') 3.5 1.7 1.5 !62 ol assign (resid 19 and name H6) (resid 18 and name H3') 3.5 1.7 2.5 !3d !assign (resid 19 and name H6) (resid 18 and name H4') 3.5 1.7 2.5 !62 ol (gab) assign (resid 19 and name H5) (resid 18 and name H1') 3.5 1.7 2.5 !59 h1ph1P assign (resid 19 and name H5) (resid 18 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 19 and name H5) (resid 18 and name H2'') 3.5 1.7 2.5 !120 ms assign (resid 19 and name H6) (resid 20 and name H8) 3.5 1.7 1.5 !47 assign (resid 19 and name H6) (resid 19 and name H1') 3.5 1.7 1.5 !54 assign (resid 19 and name H6) (resid 19 and name H2'') 3.5 1.7 6.0 !3d nonnoe assign (resid 19 and name H6) (resid 19 and name H3') 2.4 0.6 0.6 !62 oL tightened from 6.0 assign (resid 19 and name H6) (resid 19 and name H4') 3.5 1.7 2.5 !64 ol assign (resid 19 and name H6) (resid 19 and name H5') 3.5 1.7 2.5 !gab assign (resid 19 and name H6) (resid 19 and name H5'') 3.5 1.7 2.5 !gab assign (resid 19 and name H1') (resid 18 and name H2'') 3.5 1.7 2.5 !3d assign (resid 19 and name H1') (resid 19 and name H2'') 3.5 1.7 2.5 !3d assign (resid 19 and name H1') (resid 19 and name H3') 3.5 1.7 2.5 !3d assign (resid 19 and name H1') (resid 19 and name H4') 3.5 1.7 2.5 !3d assign (resid 19 and name H1') (resid 19 and name H5') 3.5 1.7 2.5 !gab assign (resid 19 and name H1') (resid 19 and name H5'') 3.5 1.7 2.5 !gab assign (resid 19 and name H1') (resid 19 and name H5) 3.5 1.7 2.5 !200 ms gab assign (resid 19 and name H2'') (resid 19 and name H3') 3.5 1.7 2.5 !3d assign (resid 19 and name H2'') (resid 19 and name H5') 3.5 1.7 2.5 !3d check these 5 assign (resid 19 and name H2'') (resid 19 and name H5'') 3.5 1.7 2.5 !3d assign (resid 19 and name H3') (resid 19 and name H4') 3.5 1.7 2.5 !3d assign (resid 19 and name H3') (resid 19 and name H5') 3.5 1.7 2.5 !3d assign (resid 19 and name H3') (resid 19 and name H5'') 3.5 1.7 2.5 !3d assign (resid 19 and name H4') (resid 19 and name H5'') 3.5 1.7 2.5 !3d assign (resid 19 and name H4') (resid 19 and name H5') 3.5 1.7 2.5 !3d assign (resid 19 and name H5) (resid 19 and name H3') 3.5 1.7 2.5 !gab assign (resid 20 and name H8) (resid 19 and name H1') 3.5 1.7 2.5 !18 and 3D assign (resid 20 and name H8) (resid 19 and name H2'') 2.4 0.6 0.6 !gab rec < 3 tightened assign (resid 20 and name H8) (resid 19 and name H3') 3.5 1.7 1.5 !23/24 assign (resid 20 and name H8) (resid 20 and name H5') 3.5 1.7 2.5 !3d assign (resid 20 and name H8) (resid 20 and name H5'') 3.5 1.7 2.5 !3d assign (resid 19 and name H1') (resid 20 and name H1') 3.5 1.6 2.5 !gab assign (resid 20 and name H1') (resid 19 and name H2'') 3.5 1.7 2.5 !3d assign (resid 20 and name H8) (resid 20 and name H1') 3.5 1.7 1.5 !16 assign (resid 20 and name H8) (resid 20 and name H3') 3.0 1.2 1.0 !22 assign (resid 20 and name H8) (resid 20 and name H2'') 3.5 1.7 2.5 !3d assign (resid 20 and name H8) (resid 20 and name H4') 3.5 1.7 2.5 !3d assign (resid 20 and name H8) (resid 21 and name H8) 3.5 1.7 1.5 !77 assign (resid 20 and name H2) (resid 20 and name H1') 3.5 1.7 2.5 !200 ms onlY assign (resid 20 and name H1') (resid 21 and name H1') 3.5 1.7 2.5 !43 h1ph1P 19-20 acc to gab assign (resid 20 and name H2) (resid 21 and name H1') 3.5 1.7 1.5 !84 assign (resid 20 and name H1') (resid 20 and name H2'') 2.4 0.6 0.6 !19 assign (resid 20 and name H1') (resid 20 and name H3') 3.5 1.6 2.5 !gab rec < 5 assign (resid 20 and name H1') (resid 20 and name H4') 3.5 1.7 2.5 !120 ms assign (resid 20 and name H1') (resid 20 and name H5') 3.5 1.6 2.5 !gab assign (resid 20 and name H1') (resid 20 and name H5'') 3.5 1.6 2.5 !gab assign (resid 20 and name H2'') (resid 20 and name H3') 3.5 1.6 2.5 !gab rec < 5 assign (resid 20 and name H2'') (resid 20 and name H4') 3.5 1.7 2.5 !3d assign (resid 20 and name H3') (resid 20 and name H4') 3.5 1.7 2.5 !3d assign (resid 20 and name H3') (resid 20 and name H5') 3.5 1.6 2.5 !gab rec < 5 assign (resid 20 and name H3') (resid 20 and name H5'') 3.5 1.6 2.5 !gab rec < 5 !assign (resid 20 and name H4') (resid 20 and name H5'') 3.5 1.7 2.5 !gab rec < 5 stereo assign (resid 21 and name H8) (resid 20 and name H1') 3.5 1.7 1.5 !81 !assign (resid 20 and name H4') (resid 21 and name H1') 3.5 1.7 2.5 !3d fishy assign (resid 21 and name H8) (resid 20 and name H2'') 2.4 0.6 0.6 !96 assign (resid 21 and name H8) (resid 20 and name H3') 3.5 1.7 1.5 !beside 96 assign (resid 21 and name H8) (resid 20 and name H4') 3.5 1.7 2.5 !3d assign (resid 20 and name H2'') (resid 21 and name H5') 3.5 1.7 2.5 !gab assign (resid 20 and name H2'') (resid 21 and name H5'') 3.5 1.7 2.5 !gab assign (resid 21 and name H8) (resid 21 and name H1') 3.5 1.7 1.5 !82 assign (resid 21 and name H8) (resid 21 and name H2'') 3.5 1.7 1.5 !besdie 96 assign (resid 21 and name H8) (resid 21 and name H3') 3.5 1.7 1.5 !besdie 96 assign (resid 21 and name H8) (resid 21 and name H4') 3.5 1.7 2.5 !3d assign (resid 21 and name H1') (resid 20 and name H2'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 21 and name H1') (resid 21 and name H2'') 2.4 0.6 0.6 !46 oL tight f. 5.0 assign (resid 21 and name H1') (resid 21 and name H3') 3.5 1.7 1.5 !46 ol assign (resid 21 and name H1') (resid 21 and name H4') 3.5 1.7 1.5 !46 oL assign (resid 21 and name H1') (resid 21 and name H5') 3.5 1.7 2.5 !gab assign (resid 21 and name H1') (resid 21 and name H5'') 3.5 1.7 2.5 !gab assign (resid 21 and name H3') (resid 21 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 21 and name H3') (resid 21 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 21 and name H4') (resid 21 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 21 and name H4') (resid 21 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 21 and name H8) (resid 21 and name H5'') 3.5 1.7 1.5 !99 4 ppm assign (resid 21 and name H8) (resid 21 and name H5') 3.5 1.7 2.5 !gab assign (resid 21 and name H8) (resid 22 and name H8) 3.5 1.7 2.5 !78 assign (resid 22 and name H8) (resid 21 and name H1') 3.5 1.7 1.5 !45 assign (resid 22 and name H8) (resid 21 and name H2'') 2.4 0.6 0.6 !48 assign (resid 22 and name H8) (resid 21 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 22 and name H8) (resid 23 and name H6) 3.5 1.7 2.5 !64 aro-arO assign (resid 22 and name H8) (resid 22 and name H1') 3.0 1.2 1.0 !43 tight. f. 5.0 assign (resid 22 and name H8) (resid 22 and name H2'') 3.5 1.7 2.5 !gab assign (resid 22 and name H8) (resid 22 and name H3') 2.4 0.6 0.6 !47 tightened assign (resid 22 and name H8) (resid 22 and name H4') 3.5 1.7 2.5 !gab assign (resid 22 and name H8) (resid 22 and name H5') 3.5 1.7 2.5 !gab nonnoe assign (resid 22 and name H8) (resid 22 and name H5'') 3.5 1.7 2.5 !gab nonnoe assign (resid 22 and name H8) (resid 23 and name H5) 3.5 1.7 2.5 !3d doubted by gab assign (resid 22 and name H2) (resid 22 and name H1') 3.5 1.7 1.5 !78 assign (resid 22 and name H2) (resid 22 and name H2'') 3.5 1.7 3.5 !3d nonnoe assign (resid 22 and name H1') (resid 21 and name H2'') 3.5 1.7 2.5 !gab assign (resid 22 and name H1') (resid 22 and name H4') 3.5 1.7 2.5 !3d assign (resid 22 and name H1') (resid 22 and name H3') 3.5 1.7 1.5 !26 assign (resid 22 and name H1') (resid 22 and name H2'') 2.4 0.6 0.6 !54 assign (resid 22 and name H1') (resid 22 and name H5'') 3.5 1.7 2.5 !gab nonoe assign (resid 22 and name H2'') (resid 23 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 22 and name H2'') (resid 22 and name H4') 3.5 1.7 2.5 !gab nonnoe assign (resid 22 and name H3') (resid 22 and name H4') 3.5 1.7 2.5 !3d assign (resid 22 and name H3') (resid 22 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 22 and name H3') (resid 22 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 22 and name H4') (resid 22 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 22 and name H4') (resid 22 and name H5'') 3.5 1.7 2.5 !gab rec < 5 !assign (resid 23 and name H6) (resid 22 and name H1') 3.5 1.7 3.0 ! check assign (resid 23 and name H5) (resid 23 and name H1') 3.5 1.7 2.5 !26 h1ph1P assign (resid 23 and name H5) (resid 23 and name H2'') 3.5 1.7 2.5 !3d assign (resid 23 and name H5) (resid 22 and name H2'') 3.5 1.7 2.5 !gab OK assign (resid 23 and name H5) (resid 22 and name H3') 3.5 1.7 2.5 !3d nonoe assign (resid 23 and name H5) (resid 22 and name H4') 3.5 1.7 2.5 !3d assign (resid 23 and name H6) (resid 23 and name H1') 3.0 1.2 1.0 !70 assign (resid 23 and name H6) (resid 22 and name H2'') 3.5 1.7 1.5 !83 assign (resid 23 and name H6) (resid 23 and name H2'') 3.5 1.7 2.5 !80 3DcH assign (resid 23 and name H6) (resid 23 and name H3') 2.4 0.6 0.6 !82 assign (resid 23 and name H5) (resid 23 and name H3') 3.5 1.7 1.5 !18 assign (resid 23 and name H6) (resid 23 and name H4') 3.5 1.7 2.5 !80 3DcH assign (resid 23 and name H6) (resid 23 and name H5') 3.5 1.7 2.5 !gab assign (resid 23 and name H6) (resid 23 and name H5'') 3.5 1.7 2.5 !gab assign (resid 23 and name H1') (resid 23 and name H2'') 3.5 1.7 1.5 !43 oL assign (resid 23 and name H1') (resid 23 and name H3') 3.5 1.7 1.5 !17 oL assign (resid 23 and name H1') (resid 23 and name H4') 3.5 1.7 1.5 !43 oL assign (resid 23 and name H1') (resid 23 and name H5') 3.5 1.7 2.5 !gab assign (resid 23 and name H1') (resid 23 and name H5'') 3.5 1.7 2.5 !gab assign (resid 24 and name H1') (resid 24 and name H2'') 2.4 0.6 0.6 !42 assign (resid 23 and name H2'') (resid 23 and name H3') 3.5 1.7 1.5 !tight. f. 6.0 assign (resid 23 and name H2'') (resid 23 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 23 and name H2'') (resid 23 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 23 and name H3') (resid 23 and name H4') 3.5 1.7 2.5 !gab rec < 5 assign (resid 23 and name H3') (resid 23 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 23 and name H3') (resid 23 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 23 and name H4') (resid 23 and name H5') 3.5 1.7 2.5 !3d nonoe assign (resid 23 and name H4') (resid 23 and name H5'') 3.5 1.7 2.5 !gab nonoe assign (resid 24 and name H1') (resid 24 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 24 and name H1') (resid 24 and name H4') 3.5 1.7 2.5 !3d assign (resid 24 and name H1') (resid 24 and name H5') 3.5 1.7 2.5 !200 ms stereo 4.25 assign (resid 24 and name H1') (resid 24 and name H5'') 3.5 1.7 2.5 !gab assign (resid 24 and name H2'') (resid 24 and name H3') 3.5 1.7 2.5 !3d assign (resid 24 and name H3') (resid 24 and name H4') 3.5 1.7 2.5 !gab assign (resid 24 and name H3') (resid 24 and name H5') 3.5 1.7 2.5 !gab assign (resid 24 and name H3') (resid 24 and name H5'') 3.5 1.7 2.5 !gab assign (resid 24 and name H4') (resid 24 and name H5') 3.5 1.7 2.5 !3d assign (resid 24 and name H4') (resid 24 and name H5'') 3.5 1.7 2.5 !3d assign (resid 24 and name H5) (resid 24 and name H2'') 3.5 1.7 2.5 !40 maybe also U23:H3' assign (resid 24 and name H5) (resid 24 and name H3') 3.5 1.7 1.5 !31 ol !assign (resid 24 and name H5) (resid 25 and name H3') 3.5 1.7 2.5 !200 ms not in 3d assign (resid 24 and name H6) (resid 24 and name H1') 3.0 1.2 1.0 !23 assign (resid 24 and name H6) (resid 24 and name H2'') 3.5 1.7 2.5 !gab assign (resid 24 and name H6) (resid 24 and name H3') 3.5 1.7 2.5 !gab assign (resid 24 and name H6) (resid 24 and name H4') 3.5 1.7 2.5 !gab !assign (resid 25 and name H6) (resid 24 and name H1') 3.5 1.7 2.5 !3d assuming 7.93 vs 7.94 !assign (resid 25 and name H6) (resid 24 and name H3') 3.5 1.7 2.5 !3d check !assign (resid 25 and name H6) (resid 24 and name H4') 3.5 1.7 1.5 !3 !3 originally assigned C24 H6-H2' !assign (resid 24 and name H6) (resid 24 and name H5') 3.5 1.7 1.5 !32 maybe U25:H6 assign (resid 24 and name H6) (resid 24 and name H5') 3.5 1.7 2.5 !3d maybe also U25:H6 assign (resid 24 and name H6) (resid 24 and name H5'') 3.5 1.7 2.5 !3d maybe also U25:H6 assign (resid 25 and name H6) (resid 25 and name H1') 3.5 1.7 1.5 !24 assign (resid 25 and name H6) (resid 25 and name H2'') 3.5 1.7 2.5 !3d assign (resid 25 and name H6) (resid 25 and name H3') 3.5 1.7 2.5 !3d but strong assign (resid 25 and name H6) (resid 25 and name H4') 3.5 1.7 2.5 !gab assign (resid 25 and name H1') (resid 25 and name H2'') 3.5 1.7 2.5 !3d assign (resid 25 and name H1') (resid 25 and name H3') 3.5 1.7 2.5 !3d assign (resid 25 and name H1') (resid 25 and name H4') 3.5 1.7 2.5 !3d assign (resid 25 and name H1') (resid 25 and name H5') 3.5 1.7 2.5 !200 ms assign (resid 25 and name H1') (resid 25 and name H5'') 3.5 1.7 2.5 !200 ms assign (resid 25 and name H2'') (resid 25 and name H3') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H2'') (resid 25 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H2'') (resid 25 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H3') (resid 25 and name H4') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H3') (resid 25 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H3') (resid 25 and name H5'') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H3') (resid 26 and name H5') 3.5 1.7 2.5 !60 ms noesy nonnoe assign (resid 25 and name H3') (resid 26 and name H5'') 3.5 1.7 2.5 !60 ms noesy nonnoe assign (resid 25 and name H4') (resid 25 and name H5') 3.5 1.7 2.5 !gab rec < 5 assign (resid 25 and name H4') (resid 25 and name H5'') 3.5 1.7 2.5 ! gab rec < 5 !assign (resid 25 and name H6) (resid 25 and name H5'') 3.5 1.7 1.5 !31 4.3 ppm stereo assign (resid 25 and name H6) (resid 25 and name H5') 3.5 1.7 2.5 !3d assign (resid 25 and name H6) (resid 25 and name H5'') 3.5 1.7 2.5 !3d assign (resid 25 and name H5) (resid 25 and name H1') 3.5 1.7 2.5 !gab assign (resid 26 and name H8) (resid 26 and name H1') 3.0 1.2 1.0 !49 assign (resid 26 and name H8) (resid 26 and name H3') 3.0 1.2 1.0 !53 assign (resid 25 and name H5) (resid 25 and name H2'') 3.5 1.7 2.5 !3d assign (resid 26 and name H8) (resid 25 and name H1') 3.5 1.7 2.5 !gab assign (resid 26 and name H8) (resid 25 and name H2'') 3.5 1.7 2.5 !3d assign (resid 26 and name H8) (resid 26 and name H2'') 3.5 1.7 1.5 !51 assign (resid 26 and name H8) (resid 26 and name H4') 3.5 1.7 2.5 !3d assign (resid 26 and name H8) (resid 25 and name H3') 3.5 1.7 2.5 !3d assign (resid 26 and name H8) (resid 26 and name H5') 3.5 1.7 2.5 !3d assign (resid 26 and name H8) (resid 26 and name H5'') 3.5 1.7 2.5 !3d assign (resid 26 and name H1') (resid 26 and name H2'') 2.4 0.6 0.6 !10 assign (resid 26 and name H1') (resid 26 and name H3') 3.0 1.2 1.0 !5 assign (resid 26 and name H1') (resid 26 and name H4') 2.4 0.6 0.6 !20 tighten f. 4.0 assign (resid 26 and name H1') (resid 26 and name H5') 3.5 1.7 2.5 !120 ms stereo 4.55 assign (resid 26 and name H1') (resid 26 and name H5'') 3.5 1.7 2.5 !both clear in 3d !assign (resid 26 and name H1') (resid 27 and name H4') 3.5 1.7 2.5 !200 ms not in 3d assign (resid 26 and name H2'') (resid 26 and name H3') 3.5 1.7 1.5 !8 assign (resid 26 and name H2'') (resid 26 and name H4') 3.5 1.7 2.5 !gab assign (resid 26 and name H2'') (resid 26 and name H5') 3.5 1.7 2.5 !gab assign (resid 26 and name H2'') (resid 26 and name H5'') 3.5 1.7 2.5 !gab assign (resid 26 and name H2'') (resid 27 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 26 and name H2'') (resid 27 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 26 and name H3') (resid 26 and name H4') 3.0 1.2 1.0 !21 !assign (resid 26 and name H3') (resid 26 and name H5') 3.0 1.2 1.0 !53 4.31 ppM stereo assign (resid 26 and name H3') (resid 26 and name H5'') 3.5 1.7 2.5 !both present 3d assign (resid 26 and name H3') (resid 26 and name H5'') 3.5 1.7 2.5 !both present 3d assign (resid 26 and name H4') (resid 26 and name H5') 3.5 1.7 2.5 !3d assign (resid 26 and name H4') (resid 26 and name H5'') 3.5 1.7 2.5 !3d assign (resid 27 and name H8) (resid 26 and name H1') 3.5 1.7 1.5 !35 assign (resid 27 and name H8) (resid 26 and name H4') 3.5 1.7 2.5 !gab assign (resid 27 and name H1') (resid 26 and name h1') 3.5 1.7 2.5 !gab assign (resid 26 and name H2'') (resid 27 and name H1') 3.5 1.7 1.5 !9 assign (resid 27 and name H4') (resid 26 and name H3') 3.5 1.7 2.5 !gab assign (resid 27 and name H1') (resid 27 and name H4') 3.0 1.2 1.0 !29 assign (resid 27 and name H1') (resid 27 and name H2'') 2.4 0.6 0.6 !16 assign (resid 27 and name H1') (resid 27 and name H3') 3.5 1.7 1.5 !16 !assign (resid 27 and name H1') (resid 27 and name H5') 3.5 1.7 2.5 !200 ms sstereo 4.21 assign (resid 27 and name H1') (resid 27 and name H5') 3.5 1.7 2.5 !3d assign (resid 27 and name H1') (resid 27 and name H5'') 3.5 1.7 2.5 !3d assign (resid 27 and name H3') (resid 27 and name H2'') 3.5 1.7 2.5 !3d assign (resid 27 and name H3') (resid 27 and name H4') 3.5 1.7 2.5 !3d assign (resid 27 and name H3') (resid 27 and name H5') 3.5 1.7 2.5 !gab assign (resid 27 and name H3') (resid 27 and name H5'') 3.5 1.7 2.5 !gab assign (resid 27 and name H4') (resid 27 and name H5') 3.5 1.7 2.5 !gab assign (resid 27 and name H4') (resid 27 and name H5'') 3.5 1.7 2.5 !gab assign (resid 27 and name H8) (resid 26 and name H3') 3.0 1.2 1.0 !36 tight. f. 5.0 assign (resid 27 and name H4') (resid 26 and name H2'') 3.5 1.7 2.5 !3d hard to dis from 3' assign (resid 27 and name H2'') (resid 27 and name H4') 3.5 1.7 2.5 !3d assign (resid 27 and name H8) (resid 26 and name H2'') 2.4 0.6 0.6 !37 assign (resid 27 and name H8) (resid 27 and name H1') 3.0 1.2 1.0 !33 tight. f. 5.0 assign (resid 27 and name H8) (resid 27 and name H2'') 3.5 1.7 1.5 !38 assign (resid 27 and name H8) (resid 27 and name H3') 3.0 1.2 1.0 !39 assign (resid 27 and name H8) (resid 27 and name H4') 3.5 1.7 1.5 !40 assign (resid 27 and name H8) (resid 27 and name H5') 3.5 1.7 2.5 !gab assign (resid 27 and name H8) (resid 27 and name H5'') 3.5 1.7 2.5 !gab assign (resid 27 and name H8) (resid 28 and name H8) 3.5 1.7 1.5 !63 ar-arO !assign (resid 27 and name H2) (resid 27 and name H1') 3.5 1.7 3.0 !def. not in bup or 3D! assign (resid 27 and name H2) (resid 28 and name H1') 3.5 1.7 1.5 !72 assign (resid 26 and name H8) (resid 22 and name H2) 3.5 1.7 1.5 !73 aro-arO assign (resid 27 and name H2'') (resid 28 and name H1') 3.5 1.7 2.5 !120 ms only assign (resid 27 and name H2'') (resid 28 and name H3') 3.5 1.7 2.5 !3d assign (resid 27 and name H2'') (resid 28 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 27 and name H2'') (resid 28 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 28 and name H4') (resid 28 and name H1') 2.4 0.6 0.6 !32 assign (resid 28 and name H2'') (resid 28 and name H1') 2.4 0.6 0.6 !32 assign (resid 28 and name H3') (resid 28 and name H1') 3.5 1.7 2.5 !3d assign (resid 28 and name H2'') (resid 28 and name H3') 3.5 1.7 2.5 !3d assign (resid 28 and name H2'') (resid 28 and name H4') 3.5 1.7 2.5 !gab nonnoe assign (resid 28 and name H3') (resid 28 and name H4') 3.5 1.7 2.5 !gab nonnoe assign (resid 28 and name H2'') (resid 28 and name H5') 3.5 1.7 2.5 !gab assign (resid 28 and name H2'') (resid 28 and name H5'') 3.5 1.7 2.5 !gab !assign (resid 28 and name H1') (resid 28 and name H5') 3.5 1.7 2.5 !200 ms stereo 4.17 assign (resid 28 and name H3') (resid 28 and name H5') 3.5 1.7 2.5 !3d stereo 4.17 assign (resid 28 and name H3') (resid 28 and name H5'') 3.5 1.7 2.5 !gab !assign (resid 28 and name H4') (resid 28 and name H5') 3.5 1.7 2.5 !3d stereo 4.17 assign (resid 27 and name H1') (resid 28 and name H8) 3.5 1.7 1.5 !73 !assign (resid 27 and name H2'') (resid 24 and name H5'') 3.5 1.7 1.5 !3d stereo 4.35 lr! assign (resid 27 and name H2'') (resid 28 and name H8) 2.4 0.6 0.6 !84 assign (resid 27 and name H3') (resid 28 and name H8) 3.0 1.2 1.0 !82 oL assign (resid 27 and name H4') (resid 28 and name H8) 3.5 1.7 2.5 !3d assign (resid 28 and name H2'') (resid 28 and name H8) 3.5 1.7 1.5 !85 ol assign (resid 28 and name H8) (resid 28 and name H1') 3.0 1.2 1.5 !72 assign (resid 28 and name H8) (resid 28 and name H3') 3.5 1.7 2.5 !88 assign (resid 28 and name H8) (resid 28 and name H4') 3.5 1.7 2.5 !88 assign (resid 28 and name H8) (resid 28 and name H5'') 3.5 1.7 1.5 !89 4.15 pp assign (resid 27 and name H2'') (resid 28 and name H5') 3.5 1.7 2.5 !3d assign (resid 27 and name H2'') (resid 28 and name H5'') 3.5 1.7 2.5 !3d assign (resid 28 and name H8) (resid 28 and name H5') 3.5 1.7 2.5 !3d 4.51 ppm assign (resid 28 and name H8) (resid 29 and name H6) 3.5 1.7 2.5 !gab assign (resid 28 and name H8) (resid 29 and name H5) 3.5 1.7 2.5 !3D assign (resid 29 and name H6) (resid 29 and name H1') 3.0 1.2 1.0 !76 assign (resid 29 and name H6) (resid 28 and name H1') 3.5 1.7 1.5 !75 assign (resid 29 and name H6) (resid 28 and name H2'') 3.5 1.7 1.5 !85 assign (resid 29 and name H6) (resid 28 and name H3') 3.5 1.7 2.5 !88 assign (resid 29 and name H6) (resid 28 and name H4') 3.5 1.7 2.5 !3d assign (resid 29 and name H6) (resid 29 and name H4') 3.5 1.7 2.5 !88 assign (resid 29 and name H1') (resid 28 and name H2'') 3.5 1.7 2.5 !3d assign (resid 29 and name H6) (resid 29 and name H5'') 3.5 1.7 1.5 !89 4.07 ppm assign (resid 29 and name H6) (resid 29 and name H5') 3.5 1.7 1.5 !gab assign (resid 29 and name H6) (resid 30 and name H5) 3.5 1.7 2.5 !3d assign (resid 29 and name H5) (resid 28 and name H3') 3.5 1.7 2.5 !120 ms assign (resid 29 and name H5) (resid 28 and name H4') 3.5 1.7 2.5 !gab OK !assign (resid 29 and name H5) (resid 29 and name H1') 3.5 1.7 1.5 !65 invariably violated assign (resid 29 and name H5) (resid 29 and name H3') 3.5 1.7 2.5 !3d assign (resid 29 and name H5) (resid 28 and name H2'') 3.5 1.7 2.5 !3d assign (resid 29 and name H6) (resid 29 and name H2'') 3.5 1.7 2.5 !87 ol res in 3d assign (resid 29 and name H6) (resid 29 and name H3') 3.5 1.7 2.5 !3d assign (resid 29 and name H1') (resid 29 and name H2'') 3.5 1.7 2.5 !120 ms assign (resid 29 and name H1') (resid 29 and name H3') 3.5 1.7 2.5 !3d assign (resid 29 and name H1') (resid 29 and name H4') 3.5 1.7 2.5 !3d assign (resid 29 and name H1') (resid 29 and name H5') 3.5 1.7 2.5 !gab assign (resid 29 and name H1') (resid 29 and name H5'') 3.5 1.7 2.5 !gab assign (resid 30 and name H6) (resid 30 and name H1') 3.5 1.7 2.5 !3d assign (resid 29 and name H2'') (resid 29 and name H3') 3.5 1.7 2.5 !3d assign (resid 29 and name H2'') (resid 29 and name H4') 3.5 1.7 2.5 !gab assign (resid 29 and name H2'') (resid 29 and name H5') 3.5 1.7 2.5 !3d assign (resid 29 and name H2'') (resid 29 and name H5'') 3.5 1.7 2.5 !3d assign (resid 29 and name H3') (resid 29 and name H5') 3.5 1.7 2.5 !3d assign (resid 29 and name H3') (resid 29 and name H5'') 3.5 1.7 2.5 !3d !assign (resid 29 and name H5) (resid 31 and name H6) 3.5 1.7 2.5 !? assign (resid 29 and name H4') (resid 29 and name H5') 3.5 1.7 2.5 !3d assign (resid 29 and name H4') (resid 29 and name H5'') 3.5 1.7 2.5 !3d assign (resid 30 and name H6) (resid 30 and name H2'') 3.0 1.2 1.5 !wt !assign (resid 29 and name H4') (resid 31 and name H5) 3.5 1.7 2.5 !3d ? assign (resid 30 and name H6) (resid 30 and name H3') 3.0 1.2 1.0 !wt 70 strong but ol assign (resid 30 and name H6) (resid 29 and name H2'') 2.4 0.6 0.6 !wt 71 assign (resid 30 and name H6) (resid 29 and name H3') 3.5 1.7 2.5 !3d assign (resid 30 and name H6) (resid 30 and name H4') 3.5 1.7 2.5 !gab assign (resid 30 and name H6) (resid 30 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 30 and name H5) (resid 29 and name H3') 3.5 1.7 2.5 !gab assign (resid 30 and name H5) (resid 29 and name H5) 3.5 1.7 2.5 !3d assign (resid 30 and name H5) (resid 29 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 30 and name H5) (resid 29 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 30 and name H5) (resid 30 and name H3') 3.5 1.7 2.5 !3d assign (resid 30 and name H5) (resid 29 and name H4') 3.5 1.7 2.5 !3d assign (resid 30 and name H5) (resid 29 and name H2'') 3.5 1.7 2.5 !3d assign (resid 30 and name H1') (resid 30 and name H2'') 3.5 1.7 1.5 !3d assign (resid 30 and name H1') (resid 30 and name H5') 3.5 1.7 3.5 !gab assign (resid 30 and name H1') (resid 30 and name H5'') 3.5 1.7 3.5 !gab assign (resid 30 and name H1') (resid 30 and name H4') 3.5 1.7 1.5 !3d assign (resid 30 and name H1') (resid 30 and name H3') 3.5 1.7 2.5 !gab assign (resid 30 and name H1') (resid 29 and name H2'') 3.5 1.7 1.5 !3d assign (resid 30 and name H5') (resid 29 and name H2'') 3.5 1.7 2.5 !3d nonnoe assign (resid 30 and name H2'') (resid 31 and name H5) 3.5 1.7 3.5 !gab assign (resid 30 and name H2'') (resid 30 and name H3') 3.5 1.7 2.5 !3d assign (resid 30 and name H2'') (resid 30 and name H5') 3.5 1.7 2.5 !gab assign (resid 30 and name H2'') (resid 30 and name H5'') 3.5 1.7 2.5 !gab assign (resid 30 and name H2'') (resid 31 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 30 and name H2'') (resid 31 and name H5') 3.5 1.7 2.5 !3d nonnoe !assign (resid 30 and name H2'') (resid 33 and name H5' or H5'') 3.5 1.7 2.5 ? assign (resid 30 and name H3') (resid 30 and name H4') 3.5 1.7 2.5 !3d assign (resid 30 and name H3') (resid 30 and name H5') 3.5 1.7 2.5 !gab assign (resid 30 and name H3') (resid 30 and name H5'') 3.5 1.7 2.5 !gab assign (resid 30 and name H4') (resid 30 and name H5') 3.5 1.7 2.5 !3d stereo 4.07 assign (resid 30 and name H4') (resid 30 and name H5'') 3.5 1.7 2.5 !gab assign (resid 31 and name H6) (resid 31 and name H1') 3.5 1.7 1.5 !3d under H6-H5 assign (resid 31 and name H6) (resid 30 and name H1') 3.5 1.7 2.5 !gab assign (resid 31 and name H6) (resid 30 and name H2'') 3.5 1.7 2.5 !3d assign (resid 31 and name H6) (resid 30 and name H3') 3.5 1.7 2.5 !gab assign (resid 31 and name H6) (resid 31 and name H3') 3.5 1.7 2.5 !3d assign (resid 31 and name H6) (resid 31 and name H2'') 2.4 0.6 1.5 !wt 60 assign (resid 31 and name H6) (resid 31 and name H4') 3.5 1.7 2.5 !3d assign (resid 31 and name H6) (resid 30 and name H2'') 3.0 1.2 1.0 !3d assign (resid 31 and name H6) (resid 30 and name H4') 3.5 1.7 2.5 !3d assign (resid 31 and name H6) (resid 31 and name H5') 3.5 1.7 2.5 !3d assign (resid 31 and name H6) (resid 31 and name H5'') 3.5 1.7 2.5 !3d assign (resid 31 and name H5) (resid 30 and name H6) 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 30 and name H2'') 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 30 and name H3') 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 30 and name H4') 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 31 and name H3') 3.5 1.7 2.5 !gab assign (resid 31 and name H5) (resid 31 and name H2'') 3.5 1.7 2.5 !gab assign (resid 31 and name H5) (resid 31 and name H4') 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 31 and name H5') 3.5 1.7 3.5 !gab assign (resid 31 and name H5) (resid 31 and name H5'') 3.5 1.7 3.5 !gab assign (resid 31 and name H1') (resid 31 and name H5') 3.5 1.7 3.5 !gab assign (resid 31 and name H1') (resid 31 and name H5'') 3.5 1.7 3.5 !gab assign (resid 31 and name H1') (resid 31 and name H3') 3.5 1.7 2.5 !3d assign (resid 31 and name H1') (resid 31 and name H2'') 3.5 1.7 2.5 !3d assign (resid 31 and name H4') (resid 31 and name H1') 3.5 1.7 2.5 !3d assign (resid 31 and name H3') (resid 31 and name H4') 3.5 1.7 2.5 !3d assign (resid 31 and name H3') (resid 31 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 31 and name H3') (resid 31 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 31 and name H4') (resid 31 and name H5') 3.5 1.7 2.5 !3d assign (resid 31 and name H4') (resid 31 and name H5'') 3.5 1.7 2.5 !3d assign (resid 31 and name H2'') (resid 31 and name H5') 3.5 1.7 2.5 !3d assign (resid 31 and name H2'') (resid 31 and name H5'') 3.5 1.7 2.5 !3d assign (resid 31 and name H2'') (resid 31 and name H3') 3.5 1.7 2.5 !3d assign (resid 32 and name H8) (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H8) (resid 32 and name H2'') 3.0 1.2 2.0 !wt 52 vs but ol assign (resid 32 and name H8) (resid 32 and name H3') 3.0 1.2 1.0 !wt 52 vs but ol assign (resid 32 and name H8) (resid 32 and name H4') 3.5 1.7 2.5 !3d nonnoe vw assign (resid 32 and name H8) (resid 31 and name H1') 3.5 1.7 3.5 !gab assign (resid 32 and name H8) (resid 31 and name H2'') 3.5 1.7 2.5 !3d assign (resid 32 and name H8) (resid 31 and name H4') 3.5 1.7 2.5 !3d assign (resid 32 and name H8) (resid 32 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 32 and name H8) (resid 32 and name H5'') 3.5 1.7 2.5 !3d nonnoe !assign (resid 32 and name H8) (resid 31 and name H5') 3.5 1.7 2.5 !3d !assign (resid 32 and name H8) (resid 31 and name H5'') 3.5 1.7 2.5 !3d assign (resid 32 and name H2'') (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H3') (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H4') (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H5') (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H5'') (resid 32 and name H1') 3.5 1.7 2.5 !3d assign (resid 32 and name H2'') (resid 32 and name H4') 3.5 1.7 2.5 !3d assign (resid 32 and name H2'') (resid 32 and name H5') 3.5 1.7 2.5 !3d assign (resid 32 and name H2'') (resid 32 and name H5'') 3.5 1.7 2.5 !3d assign (resid 32 and name H3') (resid 32 and name H4') 3.5 1.7 2.5 !3d assign (resid 32 and name H3') (resid 32 and name H5') 3.5 1.7 2.5 !3d assign (resid 32 and name H3') (resid 32 and name H5'') 3.5 1.7 2.5 !3d assign (resid 32 and name H3') (resid 33 and name H8) 3.5 1.7 2.5 !3d assign (resid 32 and name H4') (resid 32 and name H5') 3.5 1.7 2.5 !3d assign (resid 32 and name H4') (resid 32 and name H5'') 3.5 1.7 3.0 !3d assign (resid 33 and name H8) (resid 32 and name H1') 3.5 1.7 2.5 !3d but strong assign (resid 33 and name H8) (resid 33 and name H1') 3.5 1.7 2.5 !3d assign (resid 33 and name H8) (resid 33 and name H3') 3.0 1.2 1.5 !wt 77 assign (resid 33 and name H8) (resid 33 and name H2'') 3.5 1.7 1.5 !3d assign (resid 33 and name H8) (resid 33 and name H4') 3.5 1.7 2.5 !3d assign (resid 33 and name H8) (resid 32 and name H4') 3.5 1.7 2.5 !3d assign (resid 33 and name H8) (resid 33 and name H5'') 3.5 1.7 2.5 !3d stereo 4.6 assign (resid 33 and name H8) (resid 33 and name H5') 3.5 1.7 2.5 !gab assign (resid 33 and name H1') (resid 33 and name H3') 3.5 1.7 2.5 !3d assign (resid 33 and name H1') (resid 33 and name H2'') 3.5 1.7 2.5 !3d strong assign (resid 33 and name H1') (resid 33 and name H4') 3.5 1.7 2.5 !3d strong assign (resid 33 and name H1') (resid 33 and name H5') 3.5 1.7 2.5 !3d assign (resid 33 and name H1') (resid 33 and name H5'') 3.5 1.7 2.5 !3d assign (resid 33 and name H2'') (resid 33 and name H5'') 3.5 1.7 2.5 !gab assign (resid 33 and name H2'') (resid 33 and name H5') 3.5 1.7 2.5 !gab assign (resid 33 and name H2'') (resid 34 and name H1') 3.5 1.7 2.5 !3d assign (resid 33 and name H2'') (resid 34 and name H5') 3.5 1.7 2.5 !3d ambiguous 4.11 assign (resid 33 and name H2'') (resid 33 and name H3') 3.5 1.7 2.5 !3d assign (resid 33 and name H2'') (resid 33 and name H4') 3.5 1.7 2.5 !3d assign (resid 33 and name H2'') (resid 34 and name H5'') 3.5 1.7 2.5 !gab assign (resid 33 and name H3') (resid 33 and name H4') 3.5 1.7 2.5 !3d assign (resid 33 and name H3') (resid 33 and name H5') 3.5 1.7 2.5 !3d assign (resid 33 and name H3') (resid 33 and name H5'') 3.5 1.7 2.5 !3d assign (resid 33 and name H4') (resid 33 and name H5') 3.5 1.7 2.5 !gab assign (resid 33 and name H4') (resid 33 and name H5'') 3.5 1.7 2.5 !gab assign (resid 33 and name H5') (resid 34 and name H1') 3.5 1.7 2.5 !3d nonnoe assign (resid 33 and name H5'') (resid 34 and name H1') 3.5 1.7 2.5 !3d nonnoe assign (resid 33 and name H4') (resid 34 and name H8) 3.5 1.7 2.5 !gab assign (resid 33 and name H4') (resid 34 and name H1') 3.5 1.7 2.5 !gab assign (resid 34 and name H8) (resid 34 and name H1') 3.5 1.7 2.5 !3d assign (resid 34 and name H8) (resid 34 and name H2'') 3.5 1.7 2.5 !3d assign (resid 34 and name H8) (resid 34 and name H3') 2.4 0.6 1.1 !wt 36 assign (resid 34 and name H8) (resid 34 and name H5') 3.5 1.7 2.5 !3d stereo 4.13 assign (resid 34 and name H8) (resid 34 and name H5'') 3.5 1.7 2.5 !gab assign (resid 34 and name H1') (resid 34 and name H2'') 3.5 1.7 1.5 !3d assign (resid 34 and name H1') (resid 34 and name H3') 3.5 1.7 1.5 !3d assign (resid 34 and name H1') (resid 34 and name H4') 3.5 1.7 2.5 !gab assign (resid 34 and name H1') (resid 34 and name H5') 3.5 1.7 2.5 !gab assign (resid 34 and name H1') (resid 34 and name H5'') 3.5 1.7 2.5 !gab assign (resid 34 and name H1') (resid 35 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 34 and name H2'') (resid 34 and name H4') 3.5 1.7 2.5 !gab assign (resid 34 and name H2'') (resid 34 and name H5') 3.5 1.7 2.5 !3d stereo 4.22 assign (resid 34 and name H2'') (resid 34 and name H5'') 3.5 1.7 2.5 !gab assign (resid 34 and name H2'') (resid 35 and name H3') 3.5 1.7 2.5 !3d nonnoe assign (resid 34 and name H2'') (resid 35 and name H5') 3.5 1.7 2.5 !3d nonnoe assign (resid 34 and name H2'') (resid 35 and name H5'') 3.5 1.7 2.5 !3d nonnoe assign (resid 34 and name H3') (resid 35 and name H8) 3.5 1.7 2.5 !3d assign (resid 34 and name H3') (resid 34 and name H4') 3.5 1.7 2.5 !3d assign (resid 34 and name H3') (resid 34 and name H5') 3.5 1.7 2.5 !3d assign (resid 34 and name H3') (resid 34 and name H5'') 3.5 1.7 2.5 !3d assign (resid 34 and name H3') (resid 35 and name H5'') 3.5 1.7 2.5 !3d assign (resid 34 and name H3') (resid 35 and name H5') 3.5 1.7 2.5 !3d assign (resid 34 and name H4') (resid 34 and name H8) 3.5 1.7 2.5 !3d assign (resid 34 and name H4') (resid 34 and name H5') 3.5 1.7 2.5 !gab assign (resid 34 and name H4') (resid 34 and name H5'') 3.5 1.7 2.5 !gab assign (resid 36 and name H8) (resid 34 and name H1') 3.5 1.7 2.5 !3d assign (resid 36 and name H8) (resid 34 and name H2'') 3.5 1.7 2.5 !3d assign (resid 36 and name H1') (resid 34 and name H1') 3.5 1.7 2.5 !3d assign (resid 36 and name H8) (resid 34 and name H8) 3.5 1.7 2.5 !gab assign (resid 36 and name H1') (resid 35 and name H2) 3.5 1.7 3.0 !3d assign (resid 35 and name H8) (resid 35 and name H1') 3.5 1.7 2.0 !wt 5 assign (resid 35 and name H8) (resid 35 and name H2'') 3.0 1.2 2.0 !wt 6 !assign (resid 35 and name H8) (resid 34 and name H2'') 3.5 1.7 2.5 !3d ol assign (resid 35 and name H8) (resid 35 and name H3') 3.5 1.7 2.5 !3d assign (resid 35 and name H8) (resid 35 and name H4') 3.5 1.7 2.5 !3ds assign (resid 35 and name H8) (resid 34 and name H1') 3.5 1.7 2.5 !gab !assign (resid 35 and name H8) (resid 34 and name H2'') 3.5 1.7 2.5 !gab assign (resid 35 and name H8) (resid 34 and name H4') 3.5 1.7 2.5 !3d assign (resid 35 and name H8) (resid 35 and name H5') 3.5 1.7 2.5 !3d assign (resid 35 and name H8) (resid 35 and name H5'') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 35 and name H2'') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 35 and name H4') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 35 and name H5'') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 35 and name H5') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 34 and name H2'') 3.5 1.7 2.5 !3d assign (resid 35 and name H1') (resid 35 and name H3') 3.5 1.7 2.5 !gab assign (resid 35 and name H2'') (resid 35 and name H3') 3.5 1.7 2.5 !gab assign (resid 35 and name H2'') (resid 35 and name H4') 3.5 1.7 2.5 !3d assign (resid 35 and name H2'') (resid 35 and name H5') 3.5 1.7 2.5 !3d assign (resid 35 and name H2'') (resid 35 and name H5'') 3.5 1.7 2.5 !3d assign (resid 35 and name H3') (resid 35 and name H4') 3.5 1.7 2.5 !3d assign (resid 35 and name H3') (resid 35 and name H5') 3.5 1.7 2.5 !3d assign (resid 35 and name H3') (resid 35 and name H5'') 3.5 1.7 2.5 !3d assign (resid 35 and name H3') (resid 36 and name H8) 3.5 1.7 2.5 !3d assign (resid 35 and name H4') (resid 36 and name H8) 3.5 1.7 2.5 !3d assign (resid 35 and name H4') (resid 34 and name H8) 3.5 1.7 2.5 !3d assign (resid 35 and name H4') (resid 35 and name H5') 3.5 1.7 2.5 !gab assign (resid 35 and name H4') (resid 35 and name H5'') 3.5 1.7 2.5 !gab assign (resid 35 and name H4') (resid 35 and name H5'') 3.5 1.7 2.5 !gab assign (resid 35 and name H2) (resid 36 and name H1') 3.5 1.7 2.5 !gab assign (resid 35 and name H2'') (resid 36 and name H8) 3.5 1.7 2.0 !wt 105 assign (resid 35 and name H2'') (resid 36 and name H5') 3.5 1.7 2.5 !gab assign (resid 35 and name H2'') (resid 36 and name H5'') 3.5 1.7 2.5 !gab assign (resid 36 and name H8) (resid 35 and name H5') 3.5 1.7 2.5 !gab assign (resid 36 and name H8) (resid 35 and name H5'') 3.5 1.7 2.5 !gab assign (resid 35 and name H3') (resid 36 and name H5') 3.5 1.7 2.5 !gab assign (resid 35 and name H3') (resid 36 and name H5'') 3.5 1.7 2.5 !gab !peaks which appear at contour level of 5.0=strong !peaks which appear at contour level of 2.5=medium !peaks which appear at all at 120 ms=weak, 2-5 angstroms !peaks which appear only at long mixing times 2-6.0 angstroms !peaks which are present but overlap, 2.0-5.5 angstroms !assign (resid 18 and name H1) (resid 19 and name HN') 3.5 1.7 2.0 !assign (resid 18 and name H1) (resid 19 and name HN'') 3.5 1.7 2.0 !assign (resid 42 and name H3) (resid 41 and name HN') 3.5 1.7 2.0 !assign (resid 19 and name HN') (resid 20 and name HN') 3.5 1.7 3.0 !assign (resid 19 and name HN') (resid 20 and name HN'') 3.5 1.7 3.0 !assign (resid 19 and name HN'') (resid 20 and name HN'') 3.5 1.7 3.0 !gab but I don't see assign (resid 18 and name H1) (resid 19 and name H1') 3.5 1.7 2.0 !gab assign (resid 21 and name H1) (resid 22 and name H1') 3.5 1.7 2.0 !gab assign (resid 21 and name H1) (resid 22 and name H2) 3.5 1.7 2.0 !gab assign (resid 21 and name H1) (resid 20 and name H2) 3.5 1.7 2.0 !gab assign (resid 40 and name H3) (resid 41 and name H1') 3.5 1.7 2.0 !gab assign (resid 42 and name H3) (resid 41 and name HN'') 3.5 1.7 2.0 assign (resid 42 and name H3) (resid 43 and name H1) 3.5 1.7 2.0 assign (resid 43 and name H1) (resid 44 and name H1') 3.5 1.7 2.0 !gab assign (resid 26 and name H1) (resid 27 and name H2) 3.5 1.7 2.0 assign (resid 28 and name H1) (resid 27 and name H2) 3.5 1.7 2.0 !assign (resid 28 and name H1) (resid 27 and name H2) 3.5 1.7 2.0 !check assign (resid 28 and name H1) (resid 29 and name H1') 3.5 1.7 2.0 !gab assign (resid 26 and name H1) (resid 27 and name H1') 3.5 1.7 2.0 !gab assign (resid 37 and name HN') (resid 36 and name H1) 3.5 1.7 2.0 assign (resid 37 and name HN'') (resid 36 and name H1) 3.5 1.7 2.0 assign (resid 38 and name H3) (resid 39 and name H1') 3.5 1.7 2.0 assign (resid 38 and name H3) (resid 39 and name H5) 3.5 1.7 2.0 !assign (resid 38 and name H3) (resid 39 and name HN') 3.5 1.7 2.0 assign (resid 38 and name H3) (resid 39 and name HN'') 3.5 1.7 2.0 assign (resid 39 and name HN') (resid 40 and name H3) 3.5 1.7 2.0 !nonnoe
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