NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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654430 |
6var   |
30701 | cing | 1-original | 6 | XPLOR/CNS | distance | NOE | simple |
# Restraints file 6: D_1000243858_mr_P1.xplor-nih.V2 ! distance restraints ! nonEx !------------------------------------------------------------------------------ !H1' and H2' from C to all base NOESY HSQC !Deut C Sample !------------------------------------------------------------------------------ ! residue 5 assign (resid 5 and name H1' ) (resid 6 and name H8) 4.1 1.9 1.9 assign (resid 5 and name H2'') (resid 6 and name H8) 2.6 0.8 0.7 ! residue 10 assign (resid 10 and name H1' ) (resid 11 and name H6) 3.2 1.2 1.3 assign (resid 10 and name H2'') (resid 11 and name H6) 2.6 0.8 0.7 ! residue 14 BULGE assign (resid 14 and name H1' ) (resid 15 and name H6) 4.1 1.9 1.9 assign (resid 14 and name H2'') (resid 15 and name H6) 2.6 0.8 0.7 !Very Weak H2'' to residue 16 base assign (resid 14 and name H2'') (resid 16 and name H8) 5 1.9 1.9 ! residue 19 Bulge assign (resid 19 and name H1' ) (resid 20 and name H8) 4.1 1.9 1.9 assign (resid 19 and name H2'') (resid 20 and name H8) 2.6 0.8 0.7 ! residue 24 assign (resid 24 and name H1' ) (resid 25 and name H6) 4.1 1.9 1.9 assign (resid 24 and name H2'') (resid 25 and name H6) 2.6 0.8 0.7 ! residue 27 assign (resid 27 and name H1' ) (resid 28 and name H8) 4.1 1.9 1.9 assign (resid 27 and name H2'') (resid 28 and name H8) 2.6 0.8 0.7 ! residue 31 assign (resid 31 and name H2'') (resid 32 and name H6) 2.6 0.8 0.7 ! residue 37 assign (resid 37 and name H1' ) (resid 38 and name H6) 4.1 1.9 1.9 assign (resid 37 and name H2'') (resid 38 and name H6) 2.6 0.8 0.7 ! residue 46 assign (resid 46 and name H1' ) (resid 47 and name H6) 4.1 1.9 1.9 assign (resid 46 and name H2'') (resid 47 and name H6) 2.6 0.8 0.7 ! residue 54 assign (resid 54 and name H1' ) (resid 55 and name H8) 4.1 1.9 1.9 assign (resid 54 and name H2'') (resid 55 and name H8) 2.6 0.8 0.7 !------------------------------------------------------------------------ !H1' and H2' from C to intrabase NOESY F/F !Deut C Sample !------------------------------------------------------------------------ ! residue 5 assign (resid 5 and name H1' ) (resid 5 and name H6) 3.2 1.2 1.3 assign (resid 5 and name H2'') (resid 5 and name H6) 3.2 1.2 1.3 ! residue 10 assign (resid 10 and name H1' ) (resid 10 and name H6) 3.2 1.2 1.3 assign (resid 10 and name H2'') (resid 10 and name H6) 3.2 1.2 1.3 assign (resid 10 and name H1' ) (resid 11 and name H6) 3.2 1.2 1.3 assign (resid 10 and name H2'') (resid 11 and name H6) 2.6 0.8 0.7 assign (resid 10 and name H6 ) (resid 11 and name H6) 4.1 1.9 1.9 ! residue 11 assign (resid 11 and name H1' ) (resid 11 and name H6) 3.2 1.2 1.3 assign (resid 11 and name H2'') (resid 11 and name H6) 3.2 1.2 1.3 ! residue 14 assign (resid 14 and name H1' ) (resid 14 and name H6) 3.2 1.2 1.3 assign (resid 14 and name H2'') (resid 14 and name H6) 2.6 0.8 0.7 ! residue 19 assign (resid 19 and name H1' ) (resid 19 and name H6) 3.2 1.2 1.3 assign (resid 19 and name H2'') (resid 19 and name H6) 2.6 0.8 0.7 ! residue 23 assign (resid 23 and name H1' ) (resid 23 and name H6) 4.1 1.9 1.9 assign (resid 23 and name H2'') (resid 23 and name H6) 4.1 1.9 1.9 assign (resid 23 and name H1' ) (resid 24 and name H6) 4.1 1.9 1.9 assign (resid 23 and name H2'') (resid 24 and name H6) 2.6 0.8 0.7 assign (resid 23 and name H6 ) (resid 24 and name H6) 4.1 1.9 1.9 ! residue 24 assign (resid 24 and name H1' ) (resid 24 and name H6) 4.1 1.9 1.9 assign (resid 24 and name H2'') (resid 24 and name H6) 4.1 1.9 1.9 ! residue 26 assign (resid 26 and name H1' ) (resid 26 and name H6) 4.1 1.9 1.9 assign (resid 26 and name H2'') (resid 26 and name H6) 4.1 1.9 1.9 assign (resid 26 and name H1' ) (resid 27 and name H6) 3.2 1.2 1.3 assign (resid 26 and name H2'') (resid 27 and name H6) 2.6 0.8 0.7 assign (resid 26 and name H6 ) (resid 27 and name H6) 3.2 1.2 1.3 ! residue 27 assign (resid 27 and name H1' ) (resid 27 and name H6) 3.2 1.2 1.3 assign (resid 27 and name H2'') (resid 27 and name H6) 4.1 1.9 1.9 ! residue 31 assign (resid 31 and name H1' ) (resid 31 and name H6) 4.1 1.9 1.9 assign (resid 31 and name H2'') (resid 31 and name H6) 4.1 1.9 1.9 ! residue 36 assign (resid 36 and name H1' ) (resid 36 and name H6) 2.3 0.5 0.5 assign (resid 36 and name H2'') (resid 36 and name H6) 2.6 0.8 0.7 ! residue 37 assign (resid 37 and name H1' ) (resid 37 and name H6) 4.1 1.9 1.9 assign (resid 37 and name H2'') (resid 37 and name H6) 4.1 1.9 1.9 ! residue 46 assign (resid 46 and name H1' ) (resid 46 and name H6) 4.1 1.9 1.9 assign (resid 46 and name H2'') (resid 46 and name H6) 4.1 1.9 1.9 ! residue 54 assign (resid 54 and name H1' ) (resid 54 and name H6) 4.1 1.9 1.9 assign (resid 54 and name H2'') (resid 54 and name H6) 3.2 1.2 1.3 ! residue 60 assign (resid 60 and name H1' ) (resid 60 and name H6) 3.2 1.2 1.3 assign (resid 60 and name H2'') (resid 60 and name H6) 3.2 1.2 1.3 assign (resid 60 and name H1' ) (resid 61 and name H6) 3.2 1.2 1.3 assign (resid 60 and name H2'') (resid 61 and name H6) 2.6 0.8 0.7 assign (resid 60 and name H6 ) (resid 61 and name H6) 4.1 1.9 1.9 ! residue 61 assign (resid 61 and name H1' ) (resid 61 and name H6) 3.60 1.6 1.6 assign (resid 61 and name H2'') (resid 61 and name H6) 3.60 1.6 1.6 !------------------------------------------------------------------------ !H2 and H2'' from C NOESY F/F !Deut C Sample !------------------------------------------------------------------------ ! residue 13 assign (resid 13 and name H2 ) (resid 14 and name H2'') 5.00 1.6 1.6 ! residue 20 assign (resid 20 and name H2 ) (resid 19 and name H1' ) 4.1 1.9 1.9 assign (resid 20 and name H2 ) (resid 19 and name H2'') 3.50 1.6 1.6 !------------------------------------------------------------------------ !H1' and H2'' from C NOESY F/F !Deut C Sample !------------------------------------------------------------------------ ! residue 5 assign (resid 5 and name H1' ) (resid 5 and name H2'') 2.6 0.8 0.7 ! residue 10 assign (resid 10 and name H1' ) (resid 10 and name H2'') 2.6 0.8 0.7 ! residue 11 assign (resid 11 and name H1' ) (resid 11 and name H2'') 2.6 0.8 0.7 ! residue 14 assign (resid 14 and name H1' ) (resid 14 and name H2'') 2.6 0.8 0.7 ! residue 19 assign (resid 19 and name H1' ) (resid 19 and name H2'') 2.6 0.8 0.7 ! residue 23 assign (resid 23 and name H1' ) (resid 23 and name H2'') 2.6 0.8 0.7 ! residue 24 assign (resid 24 and name H1' ) (resid 24 and name H2'') 2.6 0.8 0.7 ! residue 26 assign (resid 26 and name H1' ) (resid 26 and name H2'') 2.6 0.8 0.7 assign (resid 26 and name H1' ) (resid 27 and name H2'') 4.1 1.9 1.9 ! residue 27 assign (resid 27 and name H1' ) (resid 27 and name H2'') 2.6 0.8 0.7 ! residue 31 assign (resid 31 and name H1' ) (resid 31 and name H2'') 2.6 0.8 0.7 ! residue 36 assign (resid 36 and name H1' ) (resid 36 and name H2'') 2.6 0.8 0.7 ! residue 37 assign (resid 37 and name H1' ) (resid 37 and name H2'') 3.2 1.2 1.3 ! residue 46 assign (resid 46 and name H1' ) (resid 46 and name H2'') 2.6 0.8 0.7 ! residue 54 assign (resid 54 and name H1' ) (resid 54 and name H2'') 2.6 0.8 0.7 ! residue 60 assign (resid 60 and name H1' ) (resid 60 and name H2'') 2.6 0.8 0.7 ! residue 61 assign (resid 61 and name H1' ) (resid 61 and name H2'') 2.6 0.8 0.7 !------------------------------------------------------------------------------ !H1' and H2' from U to all base NOESY HSQC !Deut U Sample !------------------------------------------------------------------------------ ! residue 4 assign (resid 4 and name H1' ) (resid 5 and name H6) 4.1 1.9 1.9 assign (resid 4 and name H2'') (resid 5 and name H6) 2.6 0.8 0.7 ! residue 7 assign (resid 7 and name H1' ) (resid 8 and name H8) 4.1 1.9 1.9 assign (resid 7 and name H2'') (resid 8 and name H8) 2.6 0.8 0.7 ! residue 9 assign (resid 9 and name H1' ) (resid 10 and name H6) 4.1 1.9 1.9 assign (resid 9 and name H2'') (resid 10 and name H6) 2.6 0.8 0.7 ! residue 12 assign (resid 12 and name H1' ) (resid 13 and name H8) 2.6 0.8 0.7 assign (resid 12 and name H2'') (resid 13 and name H8) 2.6 0.8 0.7 ! residue 13 assign (resid 13 and name H8 ) (resid 14 and name H5) 4.1 1.9 1.9 ! residue 15 assign (resid 15 and name H1' ) (resid 16 and name H8) 4.1 1.9 1.9 assign (resid 15 and name H2'') (resid 16 and name H8) 2.6 0.8 0.7 ! residue 18 assign (resid 18 and name H2'') (resid 19 and name H6) 2.6 0.8 0.7 ! residue 25 assign (resid 25 and name H1' ) (resid 26 and name H6) 4.1 1.9 1.9 assign (resid 25 and name H2'') (resid 26 and name H6) 2.6 0.8 0.7 ! residue 32 assign (resid 32 and name H2'') (resid 33 and name H8) 4.1 1.9 1.9 assign (resid 32 and name H6 ) (resid 33 and name H8) 4.1 1.9 1.9 ! residue 39 assign (resid 39 and name H1' ) (resid 40 and name H8) 4.1 1.9 1.9 assign (resid 39 and name H2'') (resid 40 and name H8) 2.6 0.8 0.7 ! residue 43 assign (resid 43 and name H1' ) (resid 44 and name H8) 4.1 1.9 1.9 assign (resid 43 and name H2'') (resid 44 and name H8) 2.6 0.8 0.7 ! residue 49 assign (resid 49 and name H1' ) (resid 50 and name H8) 4.1 1.9 1.9 assign (resid 49 and name H2'') (resid 50 and name H8) 2.6 0.8 0.7 ! residue 56 assign (resid 56 and name H1' ) (resid 57 and name H8) 4.1 1.9 1.9 assign (resid 56 and name H2'') (resid 57 and name H8) 2.6 0.8 0.7 ! residue 59 assign (resid 59 and name H8 ) (resid 60 and name H5) 4.1 1.9 1.9 !------------------------------------------------------------------------ !NOESY HSQC centered on base to all sugars !------------------------------------------------------------------------ ! residue 1 !Intra assign (resid 1 and name H1' ) (resid 1 and name H8) 2.6 0.8 0.7 assign (resid 1 and name H2'') (resid 1 and name H8) 4.1 1.9 1.9 assign (resid 1 and name H3' ) (resid 1 and name H8) 3.2 1.2 1.3 assign (resid 1 and name H4' ) (resid 1 and name H8) 4.1 1.9 1.9 assign (resid 1 and name H5'') (resid 1 and name H8) 4.1 1.9 1.9 assign (resid 1 and name H5'') (resid 1 and name H8) 3.2 1.2 1.3 !Inter assign (resid 1 and name H8 ) (resid 2 and name H8) 3.2 1.2 1.3 assign (resid 1 and name H1' ) (resid 2 and name H8) 4.1 1.9 1.9 assign (resid 1 and name H2'') (resid 2 and name H8) 2.6 0.8 0.7 assign (resid 1 and name H3' ) (resid 2 and name H8) 3.2 1.2 1.3 ! residue 2 !Intra assign (resid 2 and name H1' ) (resid 2 and name H8) 4.1 1.9 1.9 assign (resid 2 and name H2'') (resid 2 and name H8) 4.1 1.9 1.9 !Inter assign (resid 2 and name H1' ) (resid 3 and name H6) 4.1 1.9 1.9 assign (resid 2 and name H2'') (resid 3 and name H6) 2.6 0.8 0.7 ! residue 3 !Intra assign (resid 3 and name H2'') (resid 3 and name H6) 4.1 1.9 1.9 !Inter assign (resid 3 and name H6 ) (resid 4 and name H6) 4.1 1.9 1.9 assign (resid 3 and name H1' ) (resid 4 and name H6) 4.1 1.9 1.9 assign (resid 3 and name H2'') (resid 4 and name H6) 2.6 0.8 0.7 ! residue 4 !Intra assign (resid 4 and name H1' ) (resid 4 and name H6) 4.1 1.9 1.9 assign (resid 4 and name H2'') (resid 4 and name H6) 4.1 1.9 1.9 !Inter assign (resid 4 and name H6 ) (resid 5 and name H6) 4.1 1.9 1.9 ! residue 6 !Intra assign (resid 6 and name H1' ) (resid 6 and name H8) 4.1 1.9 1.9 assign (resid 6 and name H2'') (resid 6 and name H8) 4.1 1.9 1.9 !Inter assign (resid 6 and name H8 ) (resid 7 and name H6) 4.1 1.9 1.9 assign (resid 6 and name H1' ) (resid 7 and name H6) 4.1 1.9 1.9 assign (resid 6 and name H2'') (resid 7 and name H6) 2.6 0.8 0.7 ! residue 7 !Intra assign (resid 7 and name H1' ) (resid 7 and name H6) 4.1 1.9 1.9 assign (resid 7 and name H2'') (resid 7 and name H6) 4.1 1.9 1.9 ! residue 8 !Intra assign (resid 8 and name H1' ) (resid 8 and name H8) 4.1 1.9 1.9 assign (resid 8 and name H2'') (resid 8 and name H8) 4.1 1.9 1.9 !Inter assign (resid 8 and name H1' ) (resid 9 and name H6) 4.1 1.9 1.9 assign (resid 8 and name H2'') (resid 9 and name H6) 2.6 0.8 0.7 ! residue 9 !Intra assign (resid 9 and name H1' ) (resid 9 and name H6) 4.1 1.9 1.9 assign (resid 9 and name H2'') (resid 9 and name H6) 4.1 1.9 1.9 ! residue 12 !Intra assign (resid 12 and name H1' ) (resid 12 and name H6) 4.1 1.9 1.9 assign (resid 12 and name H2'') (resid 12 and name H6) 4.1 1.9 1.9 ! residue 13 !Intra assign (resid 13 and name H1' ) (resid 13 and name H8) 2.6 0.8 0.7 assign (resid 13 and name H2'') (resid 13 and name H8) 4.1 1.9 1.9 !Inter assign (resid 13 and name H1' ) (resid 14 and name H6) 2.6 0.8 0.7 assign (resid 13 and name H2'') (resid 14 and name H6) 2.6 0.8 0.7 assign (resid 13 and name H8 ) (resid 14 and name H6) 3.2 1.2 1.3 assign (resid 13 and name H8 ) (resid 16 and name H8) 4.1 1.9 1.9 ! residue 14 !Inter assign (resid 14 and name H6 ) (resid 15 and name H6) 2.6 0.8 0.7 ! residue 15 !Intra assign (resid 15 and name H1' ) (resid 15 and name H6) 4.1 1.9 1.9 assign (resid 15 and name H2'') (resid 15 and name H6) 4.1 1.9 1.9 !Inter assign (resid 15 and name H6 ) (resid 16 and name H8) 4.1 1.9 1.9 ! residue 16 !Intra assign (resid 16 and name H1' ) (resid 16 and name H8) 2.3 0.5 0.5 assign (resid 16 and name H2'') (resid 16 and name H8) 3.2 1.2 1.3 !Inter assign (resid 16 and name H1' ) (resid 17 and name H6) 4.1 1.9 1.9 assign (resid 16 and name H2'') (resid 17 and name H6) 2.6 0.8 0.7 assign (resid 16 and name H8 ) (resid 17 and name H6) 4.1 1.9 1.9 ! residue 17 !Intra assign (resid 17 and name H1' ) (resid 17 and name H6) 3.2 1.2 1.3 assign (resid 17 and name H2'') (resid 17 and name H6) 3.2 1.2 1.3 !Inter assign (resid 17 and name H1' ) (resid 18 and name H6) 4.1 1.9 1.9 assign (resid 17 and name H2'') (resid 18 and name H6) 2.6 0.8 0.7 assign (resid 17 and name H6 ) (resid 18 and name H6) 4.1 1.9 1.9 ! residue 18 !Intra assign (resid 18 and name H1' ) (resid 18 and name H6) 4.1 1.9 1.9 assign (resid 18 and name H2'') (resid 18 and name H6) 4.1 1.9 1.9 !Inter assign (resid 18 and name H6 ) (resid 19 and name H6) 4.1 1.9 1.9 ! residue 19 !Inter assign (resid 19 and name H6 ) (resid 20 and name H8) 4.1 1.9 1.9 ! residue 20 !Intra assign (resid 20 and name H1' ) (resid 20 and name H8) 4.1 1.9 1.9 assign (resid 20 and name H2'') (resid 20 and name H8) 4.1 1.9 1.9 !Inter assign (resid 20 and name H1' ) (resid 21 and name H8) 4.1 1.9 1.9 assign (resid 20 and name H2'') (resid 21 and name H8) 2.6 0.8 0.7 assign (resid 20 and name H8 ) (resid 21 and name H8) 4.1 1.9 1.9 ! residue 21 !Intra assign (resid 21 and name H1' ) (resid 21 and name H8) 4.1 1.9 1.9 assign (resid 21 and name H2'') (resid 21 and name H8) 4.1 1.9 1.9 !Inter assign (resid 21 and name H1' ) (resid 22 and name H8) 4.1 1.9 1.9 assign (resid 21 and name H2'') (resid 22 and name H8) 2.6 0.8 0.7 assign (resid 21 and name H8 ) (resid 22 and name H8) 4.1 1.9 1.9 ! residue 22 !Intra assign (resid 22 and name H1' ) (resid 22 and name H8) 4.1 1.9 1.9 assign (resid 22 and name H2'') (resid 22 and name H8) 4.1 1.9 1.9 !Inter assign (resid 22 and name H1' ) (resid 23 and name H6) 4.1 1.9 1.9 assign (resid 22 and name H2'') (resid 23 and name H6) 2.6 0.8 0.7 assign (resid 22 and name H8 ) (resid 23 and name H6) 4.1 1.9 1.9 ! residue 24 !inter assign (resid 24 and name H6 ) (resid 25 and name H6) 4.1 1.9 1.9 ! residue 25 !Intra assign (resid 25 and name H1' ) (resid 25 and name H6) 4.1 1.9 1.9 assign (resid 25 and name H2'') (resid 25 and name H6) 4.1 1.9 1.9 ! residue 28 !Intra assign (resid 28 and name H1' ) (resid 28 and name H8) 4.1 1.9 1.9 assign (resid 28 and name H2'') (resid 28 and name H8) 4.1 1.9 1.9 !Inter assign (resid 28 and name H1' ) (resid 29 and name H8) 4.1 1.9 1.9 assign (resid 28 and name H2'') (resid 29 and name H8) 2.6 0.8 0.7 assign (resid 28 and name H8 ) (resid 29 and name H8) 4.1 1.9 1.9 ! residue 29 !Intra assign (resid 29 and name H1' ) (resid 29 and name H8) 4.1 1.9 1.9 assign (resid 29 and name H2'') (resid 29 and name H8) 4.1 1.9 1.9 !Inter assign (resid 29 and name H1' ) (resid 30 and name H8) 4.1 1.9 1.9 assign (resid 29 and name H2'') (resid 30 and name H8) 2.6 0.8 0.7 assign (resid 29 and name H8 ) (resid 30 and name H8) 4.1 1.9 1.9 ! residue 30 !Intra assign (resid 30 and name H1' ) (resid 30 and name H8) 4.1 1.9 1.9 assign (resid 30 and name H2'') (resid 30 and name H8) 4.1 1.9 1.9 !Inter assign (resid 30 and name H1' ) (resid 31 and name H6) 4.1 1.9 1.9 assign (resid 30 and name H2'') (resid 31 and name H6) 2.6 0.8 0.7 assign (resid 30 and name H8 ) (resid 31 and name H6) 4.1 1.9 1.9 ! residue 31 !Inter assign (resid 31 and name H6 ) (resid 32 and name H6) 4.1 1.9 1.9 ! residue 32 !Intra assign (resid 32 and name H1' ) (resid 32 and name H6) 3.2 1.2 1.3 assign (resid 32 and name H2'') (resid 32 and name H6) 4.1 1.9 1.9 assign (resid 31 and name H1' ) (resid 32 and name H2') 2.6 0.8 0.7 ! residue 33 !Intra assign (resid 33 and name H1' ) (resid 33 and name H8) 2.6 0.8 0.7 assign (resid 33 and name H2'') (resid 33 and name H8) 4.1 1.9 1.9 !Inter assign (resid 33 and name H8 ) (resid 34 and name H6) 4.1 1.9 1.9 assign (resid 33 and name H1' ) (resid 34 and name H6) 4.1 1.9 1.9 assign (resid 33 and name H1' ) (resid 33 and name H2') 2.6 0.8 0.7 ! residue 34 assign (resid 34 and name H4' ) (resid 35 and name H8) 4.1 1.9 1.9 assign (resid 34 and name H5' ) (resid 35 and name H8) 4.1 1.9 1.9 ! residue 35 !Intra assign (resid 35 and name H1' ) (resid 35 and name H8) 4.1 1.9 1.9 assign (resid 35 and name H2'') (resid 35 and name H8) 4.1 1.9 1.9 !Inter assign (resid 35 and name H1' ) (resid 37 and name H6) 4.1 1.9 1.9 assign (resid 35 and name H2'') (resid 37 and name H6) 2.6 0.8 0.7 assign (resid 35 and name H8 ) (resid 37 and name H5) 4.1 1.9 1.9 assign (resid 35 and name H1' ) (resid 37 and name H1') 4.1 1.9 1.9 assign (resid 35 and name H2' ) (resid 37 and name H1') 4.1 1.9 1.9 ! residue 37 !Inter assign (resid 37 and name H6 ) (resid 38 and name H6) 3.2 1.2 1.3 ! residue 38 !Intra assign (resid 38 and name H1' ) (resid 38 and name H6) 4.1 1.9 1.9 assign (resid 38 and name H2'') (resid 38 and name H6) 4.1 1.9 1.9 !Inter assign (resid 38 and name H1' ) (resid 39 and name H6) 4.1 1.9 1.9 assign (resid 38 and name H2'') (resid 39 and name H6) 2.50 0.7 0.7 ! residue 39 !Intra assign (resid 39 and name H1' ) (resid 39 and name H6) 4.1 1.9 1.9 assign (resid 39 and name H2'') (resid 39 and name H6) 4.1 1.9 1.9 !Inter assign (resid 39 and name H6 ) (resid 40 and name H8) 4.1 1.9 1.9 ! residue 40 !Intra assign (resid 40 and name H1' ) (resid 40 and name H8) 4.1 1.9 1.9 assign (resid 40 and name H2'') (resid 40 and name H8) 4.1 1.9 1.9 !Inter assign (resid 40 and name H1' ) (resid 41 and name H8) 3.2 1.2 1.3 assign (resid 40 and name H2'') (resid 41 and name H8) 2.6 0.8 0.7 assign (resid 40 and name H8 ) (resid 41 and name H8) 4.1 1.9 1.9 ! residue 41 !Intra assign (resid 41 and name H1' ) (resid 41 and name H8) 3.2 1.2 1.3 assign (resid 41 and name H2'') (resid 41 and name H8) 4.1 1.9 1.9 !Inter assign (resid 41 and name H1' ) (resid 42 and name H8) 4.1 1.9 1.9 assign (resid 41 and name H2'') (resid 42 and name H8) 2.6 0.8 0.7 assign (resid 41 and name H8 ) (resid 42 and name H8) 4.1 1.9 1.9 ! residue 42 !Intra assign (resid 42 and name H1' ) (resid 42 and name H8) 3.2 1.2 1.3 assign (resid 42 and name H2'') (resid 42 and name H8) 4.1 1.9 1.9 !Inter assign (resid 42 and name H1' ) (resid 43 and name H6) 4.1 1.9 1.9 assign (resid 42 and name H2'') (resid 43 and name H6) 2.6 0.8 0.7 assign (resid 42 and name H8 ) (resid 43 and name H6) 4.1 1.9 1.9 assign (resid 42 and name H8 ) (resid 44 and name H8) 4.50 2.0 2.0 assign (resid 42 and name H1' ). (resid 44 and name H8) 4.1 1.9 1.9 ! residue 43 !Intra assign (resid 43 and name H1' ) (resid 43 and name H6) 4.1 1.9 1.9 assign (resid 43 and name H2'') (resid 43 and name H6) 4.1 1.9 1.9 !Inter assign (resid 43 and name H6 ) (resid 44 and name H8) 3.2 1.2 1.3 ! residue 44 !Intra assign (resid 44 and name H1' ) (resid 44 and name H8) 3.2 1.2 1.3 assign (resid 44 and name H2'') (resid 44 and name H8) 4.1 1.9 1.9 !Inter assign (resid 44 and name H1' ) (resid 45 and name H8) 4.1 1.9 1.9 assign (resid 44 and name H2'') (resid 45 and name H8) 2.6 0.8 0.7 assign (resid 44 and name H8 ) (resid 45 and name H8) 3.2 1.2 1.3 ! residue 45 !Intra assign (resid 45 and name H1' ) (resid 45 and name H8) 2.6 0.8 0.7 assign (resid 45 and name H2'') (resid 45 and name H8) 4.1 1.9 1.9 !Inter assign (resid 45 and name H1' ) (resid 46 and name H6) 4.1 1.9 1.9 assign (resid 45 and name H2'') (resid 46 and name H6) 2.6 0.8 0.7 assign (resid 45 and name H8 ) (resid 46 and name H6) 4.1 1.9 1.9 ! residue 47 !Intra assign (resid 47 and name H1' ) (resid 47 and name H6) 4.1 1.9 1.9 assign (resid 47 and name H2'') (resid 47 and name H6) 4.1 1.9 1.9 !Inter assign (resid 47 and name H1' ) (resid 48 and name H6) 4.1 1.9 1.9 assign (resid 47 and name H2'') (resid 48 and name H6) 2.6 0.8 0.7 assign (resid 47 and name H6 ) (resid 48 and name H6) 4.1 1.9 1.9 assign (resid 47 and name H6 ) (resid 48 and name H1') 3.2 1.2 1.3 ! residue 48 !Intra assign (resid 48 and name H1' ) (resid 48 and name H6) 4.1 1.9 1.9 assign (resid 48 and name H2'') (resid 48 and name H6) 4.1 1.9 1.9 !Inter assign (resid 48 and name H1' ) (resid 49 and name H6) 4.1 1.9 1.9 assign (resid 48 and name H2'') (resid 49 and name H6) 4.1 1.9 1.9 assign (resid 48 and name H6 ) (resid 49 and name H6) 4.1 1.9 1.9 ! residue 49 !Intra assign (resid 49 and name H1' ) (resid 49 and name H6) 4.1 1.9 1.9 assign (resid 49 and name H2'') (resid 49 and name H6) 4.1 1.9 1.9 ! residue 50 !Intra assign (resid 50 and name H1' ) (resid 50 and name H8) 4.1 1.9 1.9 assign (resid 50 and name H2'') (resid 50 and name H8) 4.1 1.9 1.9 !Inter assign (resid 50 and name H1' ) (resid 51 and name H8) 4.1 1.9 1.9 assign (resid 50 and name H2'') (resid 51 and name H8) 2.6 0.8 0.7 assign (resid 50 and name H8 ) (resid 51 and name H8) 4.1 1.9 1.9 ! residue 51 !Intra assign (resid 51 and name H1' ) (resid 51 and name H8) 4.1 1.9 1.9 assign (resid 51 and name H2'') (resid 51 and name H8) 4.1 1.9 1.9 !Inter assign (resid 51 and name H1' ) (resid 52 and name H8) 4.1 1.9 1.9 assign (resid 51 and name H2'') (resid 52 and name H8) 2.6 0.8 0.7 ! residue 52 !Intra assign (resid 52 and name H1' ) (resid 52 and name H8) 4.1 1.9 1.9 assign (resid 52 and name H2'') (resid 52 and name H8) 4.1 1.9 1.9 !Inter assign (resid 52 and name H1' ) (resid 53 and name H8) 4.1 1.9 1.9 assign (resid 52 and name H2'') (resid 53 and name H8) 2.6 0.8 0.7 ! residue 53 !Intra assign (resid 53 and name H1' ) (resid 53 and name H8) 4.1 1.9 1.9 assign (resid 53 and name H2'') (resid 53 and name H8) 4.1 1.9 1.9 !Inter assign (resid 53 and name H1' ) (resid 54 and name H6) 3.2 1.2 1.3 assign (resid 53 and name H2'') (resid 54 and name H6) 2.6 0.8 0.7 assign (resid 53 and name H8 ) (resid 54 and name H6) 4.1 1.9 1.9 ! residue 54 !Inter assign (resid 54 and name H6 ) (resid 55 and name H8) 4.1 1.9 1.9 ! residue 55 !Intra assign (resid 55 and name H1' ) (resid 55 and name H8) 4.1 1.9 1.9 assign (resid 55 and name H2'') (resid 55 and name H8) 4.1 1.9 1.9 !Inter assign (resid 55 and name H1' ) (resid 56 and name H6) 4.1 1.9 1.9 assign (resid 55 and name H2'') (resid 56 and name H6) 2.6 0.8 0.7 ! residue 56 !Intra assign (resid 56 and name H1' ) (resid 56 and name H6) 4.1 1.9 1.9 assign (resid 56 and name H2'') (resid 56 and name H6) 4.1 1.9 1.9 !Inter assign (resid 56 and name H6 ) (resid 57 and name H8) 4.1 1.9 1.9 ! residue 57 !Intra assign (resid 57 and name H1' ) (resid 57 and name H8) 4.1 1.9 1.9 assign (resid 57 and name H2'') (resid 57 and name H8) 4.1 1.9 1.9 !Inter assign (resid 57 and name H1' ) (resid 58 and name H8) 4.1 1.9 1.9 assign (resid 57 and name H2'') (resid 58 and name H8) 2.6 0.8 0.7 assign (resid 57 and name H8 ) (resid 58 and name H8) 4.1 1.9 1.9 ! residue 58 !Intra assign (resid 58 and name H1' ) (resid 58 and name H8) 3.2 1.2 1.3 assign (resid 58 and name H2'') (resid 58 and name H8) 4.1 1.9 1.9 !Inter assign (resid 58 and name H1' ) (resid 59 and name H8) 4.1 1.9 1.9 assign (resid 58 and name H2'') (resid 59 and name H8) 2.6 0.8 0.7 assign (resid 58 and name H8 ) (resid 59 and name H8) 4.1 1.9 1.9 assign (resid 58 and name H8 ) (resid 59 and name H1') 3.2 1.2 1.3 ! residue 59 !Intra assign (resid 59 and name H1' ) (resid 59 and name H8) 3.2 1.2 1.3 assign (resid 59 and name H2'') (resid 59 and name H8) 4.1 1.9 1.9 !Inter assign (resid 59 and name H1' ) (resid 60 and name H6) 3.2 1.2 1.3 assign (resid 59 and name H2'') (resid 60 and name H6) 2.6 0.8 0.7 assign (resid 59 and name H8 ) (resid 60 and name H6) 4.1 1.9 1.9 assign (resid 59 and name H8 ) (resid 60 and name H1') 3.2 1.2 1.3 ! residue 61 !Intra assign (resid 61 and name H3' ) (resid 61 and name H6) 3.2 1.2 1.3 assign (resid 61 and name H4' ) (resid 61 and name H6) 4.1 1.9 1.9 assign (resid 61 and name H5'') (resid 61 and name H6) 4.1 1.9 1.9 assign (resid 61 and name H5'') (resid 61 and name H6) 3.2 1.2 1.3 !------------------------------------------------------------------------ !NOESY HSQC centered on sugar to all sugars !------------------------------------------------------------------------ ! residue 6 assign (resid 6 and name H1' ) (resid 6 and name H2'') 2.6 0.8 0.7 assign (resid 6 and name H2'' ) (resid 7 and name H1' ) 4.1 1.9 1.9 ! residue 13 assign (resid 13 and name H1' ) (resid 13 and name H2'') 2.6 0.8 0.7 assign (resid 13 and name H2'' ) (resid 14 and name H1' ) 4.1 1.9 1.9 ! residue 14 assign (resid 14 and name H1' ) (resid 15 and name H1' ) 4.1 1.9 1.9 ! residue 15 assign (resid 15 and name H1' ) (resid 17 and name H1' ) 4.1 1.9 1.9 assign (resid 15 and name H2'') (resid 16 and name H1' ) 4.1 1.9 1.9 assign (resid 15 and name H1' ) (resid 48 and name H1' ) 4.1 1.9 1.9 ! residue 17 assign (resid 17 and name H1' ) (resid 18 and name H1' ) 4.1 1.9 1.9 ! residue 20 assign (resid 20 and name H1' ) (resid 20 and name H2'') 2.6 0.8 0.7 ! residue 21 assign (resid 21 and name H1' ) (resid 21 and name H2'') 2.6 0.8 0.7 assign (resid 21 and name H2'') (resid 21 and name H1' ) 4.1 1.9 1.9 ! residue 28 assign (resid 28 and name H1' ) (resid 28 and name H2'') 2.6 0.8 0.7 ! residue 29 assign (resid 29 and name H1' ) (resid 29 and name H2'') 2.6 0.8 0.7 ! residue 55 assign (resid 55 and name H1' ) (resid 55 and name H2'') 2.6 0.8 0.7 assign (resid 55 and name H2'') (resid 56 and name H1' ) 4.1 1.9 1.9 ! residue 59 assign (resid 59 and name H1' ) (resid 59 and name H2'') 2.6 0.8 0.7 ! filterEdit ! residue 6 assign (resid 6 and name H2) (resid 6 and name H2'') 4.8 0.5 0.5 assign (resid 6 and name H2) (resid 57 and name H1') 4.1 0.5 0.5 assign (resid 6 and name H2) (resid 7 and name H1') 3.2 1.2 1.3 ! residue 13 assign (resid 13 and name H2) (resid 13 and name H2'') 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 14 and name H1') 3.2 1.2 1.3 assign (resid 13 and name H2) (resid 16 and name H1') 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 49 and name H1') 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 50 and name H1') 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 50 and name H8) 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 14 and name H6) 4.1 1.9 1.9 assign (resid 13 and name H2) (resid 15 and name H6) 4.1 1.9 1.9 ! residue 20 assign (resid 20 and name H2) (resid 20 and name H2'') 4.1 1.9 1.9 assign (resid 20 and name H2) (resid 21 and name H2'') 4.1 1.9 1.9 assign (resid 20 and name H2) (resid 48 and name H1') 4.1 1.9 1.9 assign (resid 20 and name H2) (resid 49 and name H1') 4.1 1.9 1.9 assign (resid 20 and name H2) (resid 16 and name H1') 4.1 1.9 1.9 assign (resid 20 and name H2) (resid 21 and name H8) 4.1 1.9 1.9 ! residue 21 assign (resid 21 and name H2) (resid 21 and name H2'') 4.1 1.9 1.9 assign (resid 21 and name H2) (resid 48 and name H1') 4.1 1.9 1.9 assign (resid 21 and name H2) (resid 47 and name H1') 4.1 1.9 1.9 assign (resid 21 and name H2) (resid 22 and name H1') 4.1 1.9 1.9 assign (resid 21 and name H2) (resid 22 and name H8) 4.1 1.9 1.9 ! residue 28 assign (resid 28 and name H2) (resid 28 and name H2'') 4.1 1.9 1.9 assign (resid 28 and name H2) (resid 29 and name H2'') 4.1 1.9 1.9 assign (resid 28 and name H2) (resid 39 and name H1') 4.1 1.9 1.9 assign (resid 28 and name H2) (resid 40 and name H1') 4.1 1.9 1.9 ! residue 29 assign (resid 29 and name H2) (resid 29 and name H2'') 4.1 1.9 1.9 assign (resid 29 and name H2) (resid 39 and name H1') 3.2 1.2 1.3 assign (resid 29 and name H2) (resid 30 and name H1') 4.1 1.9 1.9 assign (resid 29 and name H2) (resid 30 and name H8) 4.1 1.9 1.9 assign (resid 29 and name H2) (resid 39 and name H6) 4.1 1.9 1.9 ! residue 55 assign (resid 55 and name H2) (resid 55 and name H2'') 4.8 0.5 0.5 assign (resid 55 and name H2) (resid 8 and name H1') 2.6 0.8 0.7 assign (resid 55 and name H2) (resid 56 and name H1') 3.2 0.5 0.5 assign (resid 55 and name H2) (resid 56 and name H6) 5.0 0.5 0.5 ! residue 59 assign (resid 59 and name H2) (resid 59 and name H2'') 4.8 0.5 0.5 assign (resid 59 and name H2) (resid 60 and name H1') 4.8 0.5 0.5 assign (resid 59 and name H2) (resid 4 and name H1') 3.2 1.2 1.3 ! H2'' to H1' ! residue 6 assign (resid 6 and name H1') (resid 6 and name H2'') 2.8 0.4 0.4 ! residue 13 assign (resid 13 and name H1') (resid 13 and name H2'') 2.8 0.4 0.4 ! residue 20 assign (resid 20 and name H1') (resid 20 and name H2'') 2.8 0.4 0.4 ! residue 28 assign (resid 28 and name H1') (resid 28 and name H2'') 2.8 0.4 0.4 assign (resid 29 and name H1') (resid 28 and name H2'') 4.1 1.9 1.9 ! residue 29 assign (resid 29 and name H1') (resid 29 and name H2'') 2.8 0.4 0.4 ! residue 55 assign (resid 55 and name H1') (resid 55 and name H2'') 2.8 0.4 0.4 ! residue 59 assign (resid 59 and name H1') (resid 59 and name H2'') 2.8 0.4 0.4 !! Unlabeled H1' to Labeled H1' assign (resid 13 and name H1') (resid 14 and name H1') 4.1 1.9 1.9 !! Unlabeled H1' to Labeled Base assign (resid 6 and name H1') (resid 6 and name H8) 4.0 1.0 1.0 assign (resid 6 and name H1') (resid 7 and name H6) 4.0 1.0 1.0 assign (resid 13 and name H1') (resid 13 and name H8) 2.6 0.8 0.7 assign (resid 13 and name H1') (resid 16 and name H8) 4.0 1.9 1.9 assign (resid 13 and name H1') (resid 13 and name H8) 2.6 0.8 0.7 assign (resid 20 and name H1') (resid 20 and name H8) 4.0 1.0 1.0 assign (resid 20 and name H1') (resid 21 and name H8) 4.0 1.0 1.0 assign (resid 20 and name H1') (resid 17 and name H6) 4.5 1.9 1.9 assign (resid 21 and name H1') (resid 21 and name H8) 4.0 1.0 1.0 assign (resid 21 and name H1') (resid 22 and name H8) 4.0 1.0 1.0 assign (resid 28 and name H1') (resid 28 and name H8) 4.0 1.0 1.0 assign (resid 28 and name H1') (resid 29 and name H8) 4.0 1.0 1.0 assign (resid 29 and name H1') (resid 29 and name H8) 4.0 1.0 1.0 assign (resid 29 and name H1') (resid 30 and name H8) 4.0 1.0 1.0 assign (resid 55 and name H1') (resid 55 and name H8) 4.0 1.0 1.0 assign (resid 55 and name H1') (resid 56 and name H6) 4.0 1.0 1.0 assign (resid 59 and name H1') (resid 59 and name H8) 3.2 1.2 1.3 assign (resid 59 and name H1') (resid 60 and name H6) 3.2 1.2 1.3 ! iminoContacts assign (resid 2 and name H1 ) (resid 3 and name H3 ) 3.6 1.0 1.0 assign (resid 3 and name H3 ) (resid 4 and name H3 ) 3.6 1.0 1.0 assign (resid 3 and name H3 ) (resid 58 and name H1 ) 4.8 1.0 1.0 assign (resid 4 and name H3 ) (resid 57 and name H1 ) 4.8 1.0 1.0 assign (resid 7 and name H3 ) (resid 8 and name H1 ) 4.8 1.0 1.0 assign (resid 8 and name H1 ) (resid 53 and name H1 ) 3.6 1.0 1.0 assign (resid 8 and name H1 ) (resid 9 and name H3 ) 3.6 1.0 1.0 assign (resid 9 and name H3 ) (resid 52 and name H1 ) 3.6 1.0 1.0 assign (resid 51 and name H1 ) (resid 50 and name H1 ) 4.8 1.0 1.0 assign (resid 51 and name H1 ) (resid 12 and name H3 ) 3.6 1.0 1.0 assign (resid 52 and name H1 ) (resid 51 and name H1 ) 3.6 1.0 1.0 assign (resid 53 and name H1 ) (resid 52 and name H1 ) 3.6 1.0 1.0 assign (resid 56 and name H3 ) (resid 7 and name H3 ) 3.6 1.0 1.0 assign (resid 57 and name H1 ) (resid 56 and name H3 ) 4.8 1.0 1.0 assign (resid 58 and name H1 ) (resid 57 and name H1 ) 3.6 1.0 1.0 !Top STEM assign (resid 22 and name H1 ) (resid 47 and name H3 ) 3.6 1.0 1.0 assign (resid 22 and name H1 ) (resid 45 and name H1 ) 3.6 1.0 1.0 assign (resid 25 and name H3 ) (resid 41 and name H1 ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 30 and name H1 ) 4.5 1.0 1.0 assign (resid 39 and name H3 ) (resid 38 and name H3 ) 4.8 1.0 1.0 assign (resid 40 and name H1 ) (resid 39 and name H3 ) 4.8 1.0 1.0 assign (resid 41 and name H1 ) (resid 40 and name H1 ) 4.8 1.0 1.0 assign (resid 42 and name H1 ) (resid 41 and name H1 ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 42 and name H1 ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 25 and name H3 ) 4.8 1.0 1.0 assign (resid 45 and name H1 ) (resid 44 and name H1 ) 3.6 1.0 1.0 ! Imino and Amino Contacts assign (resid 4 and name H3 ) (resid 5 and name H42 ) 3.6 1.0 1.0 assign (resid 4 and name H3 ) (resid 5 and name H41 ) 3.6 1.0 1.0 assign (resid 4 and name H3 ) (resid 59 and name H62 ) 3.6 1.0 1.0 assign (resid 5 and name H42) (resid 58 and name H1 ) 4.8 1.0 1.0 assign (resid 5 and name H41) (resid 58 and name H1 ) 5.2 1.0 1.0 assign (resid 5 and name H42) (resid 56 and name H3 ) 4.8 1.0 1.0 assign (resid 5 and name H41) (resid 56 and name H3 ) 5.2 1.0 1.0 assign (resid 8 and name H1 ) (resid 54 and name H42 ) 4.8 1.0 1.0 assign (resid 8 and name H1 ) (resid 54 and name H41 ) 4.8 1.0 1.0 assign (resid 9 and name H3 ) (resid 54 and name H42 ) 4.8 1.0 1.0 assign (resid 9 and name H3 ) (resid 10 and name H41 ) 4.8 1.0 1.0 assign (resid 9 and name H3 ) (resid 10 and name H42 ) 4.8 1.0 1.0 assign (resid 12 and name H3 ) (resid 11 and name H41 ) 4.8 1.0 1.0 assign (resid 12 and name H3 ) (resid 11 and name H42 ) 4.8 1.0 1.0 assign (resid 53 and name H1 ) (resid 54 and name H42 ) 4.8 1.0 1.0 assign (resid 60 and name H41) (resid 3 and name H3 ) 4.8 1.0 1.0 assign (resid 60 and name H42) (resid 3 and name H3 ) 3.6 1.0 1.0 !TOP STEM assign (resid 22 and name H1 ) (resid 23 and name H42 ) 4.8 1.0 1.0 assign (resid 22 and name H1 ) (resid 23 and name H41 ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 24 and name H42 ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 24 and name H41 ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 26 and name H42 ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 26 and name H41 ) 4.8 1.0 1.0 assign (resid 30 and name H1 ) (resid 31 and name H42 ) 3.6 1.0 1.0 assign (resid 30 and name H1 ) (resid 31 and name H41 ) 3.6 1.0 1.0 assign (resid 38 and name H3 ) (resid 37 and name H42 ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 37 and name H41 ) 4.8 1.0 1.0 assign (resid 41 and name H1 ) (resid 27 and name H41 ) 4.8 1.0 1.0 assign (resid 41 and name H1 ) (resid 27 and name H42 ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 23 and name H42 ) 4.8 1.0 1.0 assign (resid 45 and name H1 ) (resid 46 and name H42 ) 4.8 1.0 1.0 assign (resid 45 and name H1 ) (resid 46 and name H41 ) 4.8 1.0 1.0 ! Imino to Sugar Contacts (C1') assign (resid 2 and name H1 ) (resid 60 and name H1' ) 4.8 1.0 1.0 assign (resid 2 and name H1 ) (resid 3 and name H1' ) 4.8 1.0 1.0 assign (resid 3 and name H3 ) (resid 4 and name H1' ) 4.8 1.0 1.0 assign (resid 4 and name H3 ) (resid 4 and name H1' ) 4.8 1.0 1.0 assign (resid 7 and name H3 ) (resid 8 and name H1' ) 4.8 1.0 1.0 assign (resid 7 and name H3 ) (resid 7 and name H1' ) 4.8 1.0 1.0 assign (resid 9 and name H3 ) (resid 9 and name H1' ) 4.8 1.0 1.0 assign (resid 9 and name H3 ) (resid 10 and name H1' ) 4.8 1.0 1.0 assign (resid 12 and name H3 ) (resid 12 and name H1' ) 4.8 1.0 1.0 assign (resid 22 and name H1 ) (resid 23 and name H1' ) 4.8 1.0 1.0 assign (resid 22 and name H1 ) (resid 46 and name H1' ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 25 and name H1' ) 4.8 1.0 1.0 assign (resid 30 and name H1 ) (resid 38 and name H1' ) 3.6 1.0 1.0 assign (resid 38 and name H3 ) (resid 38 and name H1' ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 30 and name H1' ) 4.8 1.0 1.0 assign (resid 39 and name H3 ) (resid 39 and name H1' ) 4.8 1.0 1.0 assign (resid 39 and name H3 ) (resid 40 and name H1' ) 4.8 1.0 1.0 assign (resid 40 and name H1 ) (resid 27 and name H1' ) 4.8 1.0 1.0 assign (resid 40 and name H1 ) (resid 28 and name H1' ) 4.8 1.0 1.0 assign (resid 40 and name H1 ) (resid 41 and name H1' ) 4.8 1.0 1.0 assign (resid 41 and name H1 ) (resid 27 and name H1' ) 4.8 1.0 1.0 assign (resid 42 and name H1 ) (resid 25 and name H1' ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 24 and name H1' ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 25 and name H1' ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 45 and name H1' ) 4.8 1.0 1.0 assign (resid 45 and name H1 ) (resid 23 and name H1' ) 4.8 1.0 1.0 assign (resid 47 and name H3 ) (resid 47 and name H1' ) 4.8 1.0 1.0 assign (resid 47 and name H3 ) (resid 48 and name H1' ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 51 and name H1' ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 12 and name H1' ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 12 and name H1' ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 51 and name H1' ) 4.8 1.0 1.0 assign (resid 51 and name H1 ) (resid 12 and name H1' ) 3.6 1.0 1.0 assign (resid 51 and name H1 ) (resid 11 and name H1' ) 4.8 1.0 1.0 assign (resid 51 and name H1 ) (resid 52 and name H1' ) 4.8 1.0 1.0 assign (resid 52 and name H1 ) (resid 11 and name H1' ) 4.8 1.0 1.0 assign (resid 52 and name H1 ) (resid 10 and name H1' ) 4.8 1.0 1.0 assign (resid 53 and name H1 ) (resid 10 and name H1' ) 3.6 1.0 1.0 assign (resid 53 and name H1 ) (resid 9 and name H1' ) 3.6 1.0 1.0 assign (resid 53 and name H1 ) (resid 54 and name H1' ) 4.8 1.0 1.0 assign (resid 57 and name H1 ) (resid 6 and name H1' ) 4.8 1.0 1.0 assign (resid 57 and name H1 ) (resid 5 and name H1' ) 4.8 1.0 1.0 assign (resid 58 and name H1 ) (resid 5 and name H1' ) 3.6 1.0 1.0 assign (resid 58 and name H1 ) (resid 4 and name H1' ) 3.6 1.0 1.0 assign (resid 58 and name H1 ) (resid 59 and name H1' ) 4.8 1.0 1.0 ! Imino to Sugar Contacts (All others) assign (resid 3 and name H3 ) (resid 3 and name H2'' ) 4.8 1.0 1.0 assign (resid 4 and name H3 ) (resid 4 and name H2'' ) 4.8 1.0 1.0 assign (resid 7 and name H3 ) (resid 7 and name H2'' ) 4.8 1.0 1.0 assign (resid 12 and name H3 ) (resid 12 and name H2' ) 4.8 1.0 1.0 assign (resid 22 and name H1 ) (resid 23 and name H2'' ) 4.8 1.0 1.0 assign (resid 25 and name H3 ) (resid 25 and name H2'' ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 38 and name H2'' ) 3.6 1.0 1.0 assign (resid 39 and name H3 ) (resid 38 and name H2'' ) 3.6 1.0 1.0 assign (resid 40 and name H1 ) (resid 27 and name H2'' ) 4.8 1.0 1.0 assign (resid 44 and name H1 ) (resid 24 and name H2'' ) 4.8 1.0 1.0 assign (resid 45 and name H1 ) (resid 23 and name H2'' ) 4.8 1.0 1.0 assign (resid 47 and name H3 ) (resid 47 and name H2'' ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 12 and name H2'' ) 3.6 1.0 1.0 assign (resid 51 and name H1 ) (resid 11 and name H2'' ) 4.8 1.0 1.0 assign (resid 52 and name H1 ) (resid 10 and name H2'' ) 4.8 1.0 1.0 assign (resid 53 and name H1 ) (resid 9 and name H2'' ) 4.8 1.0 1.0 assign (resid 53 and name H1 ) (resid 9 and name H2'' ) 4.8 1.0 1.0 assign (resid 57 and name H1 ) (resid 5 and name H2'' ) 4.8 1.0 1.0 !Amino-Amino assign (resid 10 and name H41 ) (resid 11 and name H41 ) 3.6 1.0 1.0 assign (resid 10 and name H42 ) (resid 11 and name H42 ) 3.6 1.0 1.0 assign (resid 23 and name H42 ) (resid 24 and name H42 ) 3.6 1.0 1.0 assign (resid 23 and name H41 ) (resid 24 and name H41 ) 3.6 1.0 1.0 assign (resid 26 and name H42 ) (resid 27 and name H42 ) 3.6 1.0 1.0 assign (resid 26 and name H41 ) (resid 27 and name H41 ) 3.6 1.0 1.0 !Imino to H2 assign (resid 3 and name H3 ) (resid 59 and name H2 ) 2.7 0.5 0.5 assign (resid 4 and name H3 ) (resid 59 and name H2 ) 4.8 1.0 1.0 assign (resid 7 and name H3 ) (resid 6 and name H2 ) 3.6 1.0 1.0 assign (resid 39 and name H3 ) (resid 29 and name H2 ) 3.6 1.0 1.0 assign (resid 39 and name H3 ) (resid 28 and name H2 ) 3.6 1.0 1.0 assign (resid 47 and name H3 ) (resid 21 and name H2 ) 3.6 1.0 1.0 assign (resid 47 and name H3 ) (resid 20 and name H2 ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 13 and name H2 ) 4.8 1.0 1.0 assign (resid 56 and name H3 ) (resid 55 and name H2 ) 3.6 1.0 1.0 !Imino to Base assign (resid 7 and name H3 ) (resid 8 and name H8 ) 4.8 1.0 1.0 assign (resid 12 and name H3 ) (resid 13 and name H8 ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 39 and name H6 ) 4.8 1.0 1.0 assign (resid 38 and name H3 ) (resid 39 and name H5 ) 3.6 1.0 1.0 assign (resid 39 and name H3 ) (resid 40 and name H8 ) 4.8 1.0 1.0 assign (resid 42 and name H1 ) (resid 43 and name H5 ) 4.8 1.0 1.0 assign (resid 50 and name H1 ) (resid 51 and name H8 ) 4.8 1.0 1.0 assign (resid 56 and name H3 ) (resid 57 and name H8 ) 4.8 1.0 1.0
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