NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | in_dress | stage | position | program | type | subtype | subsubtype |
|
|
4079 |
1eph   |
1729 | cing | recoord | dress | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (resid 1 and name HA )(resid 2 and name HN ) 2.6 0.8 0.9 assign (resid 1 and name HB# )(resid 2 and name HN ) 2.9 1.1 1.1 assign (resid 2 and name HN )(resid 2 and name HA ) 2.1 0.3 0.4 assign (resid 2 and name HN )(resid 2 and name HB# ) 2.9 1.1 1.1 assign (resid 2 and name HA )(resid 3 and name HN ) 2.6 0.8 0.9 assign (resid 2 and name HB# )(resid 3 and name HN ) 2.9 1.1 1.1 assign (resid 2 and name HA )(resid 23 and name HA ) 2.9 1.1 1.1 assign (resid 3 and name HN )(resid 3 and name HA ) 2.1 0.3 0.4 assign (resid 3 and name HN )(resid 3 and name HB# ) 2.6 0.8 0.9 assign (resid 3 and name HN )(resid 3 and name HD# ) 2.9 1.1 1.1 assign (resid 3 and name HN )(resid 4 and name HD# ) 2.9 1.1 1.1 assign (resid 3 and name HA )(resid 4 and name HD# ) 2.4 0.6 0.6 ! relaxed by 0.5 A assign (resid 3 and name HB# )(resid 4 and name HD# ) 2.9 1.1 1.6 assign (resid 3 and name HD# )(resid 4 and name HD# ) 2.9 1.1 1.1 assign (resid 3 and name HB# )(resid 22 and name HE1 ) 2.9 1.1 1.1 assign (resid 4 and name HA )(resid 5 and name HN ) 2.4 0.6 0.6 assign (resid 4 and name HB# )(resid 5 and name HN ) 2.9 1.1 1.1 assign (resid 5 and name HN )(resid 5 and name HA# ) 2.4 0.6 0.6 assign (resid 5 and name HA# )(resid 6 and name HN ) 2.6 0.8 0.9 assign (resid 5 and name HN )(resid 21 and name HA ) 2.9 1.1 1.1 assign (resid 6 and name HN )(resid 6 and name HA ) 2.4 0.6 0.6 assign (resid 6 and name HN )(resid 6 and name HB# ) 2.6 0.8 0.9 ! relaxed by 0.5 A assign (resid 6 and name HN )(resid 7 and name HD# ) 2.9 1.1 1.6 assign (resid 6 and name HA )(resid 7 and name HD# ) 2.6 0.8 0.9 assign (resid 6 and name HB# )(resid 7 and name HD# ) 2.9 1.1 1.1 assign (resid 6 and name HB# )(resid 10 and name HB# ) 2.9 1.1 1.1 assign (resid 6 and name HB# )(resid 10 and name HD# ) 2.9 1.1 1.1 assign (resid 6 and name HB# )(resid 10 and name HE# ) 2.9 1.1 1.1 assign (resid 6 and name HB# )(resid 20 and name HB# ) 2.9 1.1 1.1 assign (resid 6 and name HA )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 6 and name HA )(resid 29 and name HE# ) 2.9 1.1 1.1 assign (resid 7 and name HA )(resid 8 and name HN ) 2.1 0.3 0.4 assign (resid 7 and name HB# )(resid 8 and name HN ) 2.9 1.1 1.1 assign (resid 7 and name HA )(resid 9 and name HN ) 2.9 1.1 1.1 assign (resid 7 and name HB# )(resid 9 and name HN ) 2.9 1.1 1.1 assign (resid 7 and name HB# )(resid 10 and name HD# ) 2.9 1.1 1.1 assign (resid 7 and name HB# )(resid 10 and name HE# ) 2.9 1.1 1.1 assign (resid 7 and name HG# )(resid 10 and name HD# ) 2.9 1.1 1.1 assign (resid 7 and name HG# )(resid 10 and name HE# ) 2.9 1.1 1.1 assign (resid 7 and name HD# )(resid 10 and name HD# ) 2.9 1.1 1.1 assign (resid 7 and name HD# )(resid 10 and name HE# ) 2.9 1.1 1.1 assign (resid 7 and name HD# )(resid 22 and name HE1 ) 2.9 1.1 1.1 assign (resid 7 and name HG# )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 7 and name HD# )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 7 and name HD# )(resid 29 and name HE# ) 2.9 1.1 1.1 assign (resid 8 and name HN )(resid 8 and name HB# ) 2.4 0.6 0.6 assign (resid 8 and name HN )(resid 9 and name HN ) 2.6 0.8 0.9 assign (resid 8 and name HA )(resid 9 and name HN ) 2.9 1.1 1.1 assign (resid 8 and name HB# )(resid 9 and name HN ) 2.9 1.1 1.1 assign (resid 8 and name HA )(resid 11 and name HN ) 2.9 1.1 1.1 assign (resid 8 and name HB# )(resid 11 and name HB# ) 2.9 1.1 1.1 assign (resid 9 and name HN )(resid 9 and name HA ) 2.4 0.6 0.6 assign (resid 9 and name HN )(resid 9 and name HB# ) 2.4 0.6 0.6 ! relaxed by 0.2 A v6 assign (resid 10 and name HN )(resid 10 and name HA ) 2.1 0.3 0.6 assign (resid 10 and name HN )(resid 10 and name HB# ) 2.6 0.8 0.9 assign (resid 10 and name HN )(resid 10 and name HD# ) 2.9 1.1 1.1 assign (resid 10 and name HN )(resid 11 and name HN ) 2.9 1.1 1.1 assign (resid 10 and name HA )(resid 11 and name HN ) 2.9 1.1 1.1 assign (resid 10 and name HB# )(resid 11 and name HN ) 2.9 1.1 1.1 assign (resid 10 and name HD# )(resid 13 and name HB# ) 2.9 1.1 1.1 assign (resid 10 and name HD# )(resid 13 and name HD# ) 2.6 0.8 0.9 assign (resid 10 and name HE# )(resid 13 and name HB# ) 2.9 1.1 1.1 assign (resid 10 and name HE# )(resid 13 and name HD# ) 2.9 1.1 1.1 assign (resid 10 and name HE# )(resid 13 and name HE# ) 2.9 1.1 1.1 assign (resid 10 and name HE# )(resid 29 and name HB# ) 2.9 1.1 1.1 assign (resid 10 and name HE# )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 11 and name HN )(resid 11 and name HA ) 2.4 0.6 0.6 assign (resid 11 and name HN )(resid 11 and name HB# ) 2.1 0.3 0.4 assign (resid 11 and name HN )(resid 12 and name HN ) 2.9 1.1 1.1 assign (resid 11 and name HA )(resid 12 and name HN ) 2.4 0.6 0.6 assign (resid 11 and name HB# )(resid 12 and name HN ) 2.9 1.1 1.1 assign (resid 12 and name HN )(resid 12 and name HA# ) 2.4 0.6 0.6 assign (resid 12 and name HN )(resid 13 and name HN ) 2.9 1.1 1.1 assign (resid 12 and name HA# )(resid 13 and name HN ) 2.9 1.1 1.1 assign (resid 13 and name HN )(resid 13 and name HA ) 2.4 0.6 0.6 assign (resid 13 and name HN )(resid 13 and name HB# ) 2.4 0.6 0.6 assign (resid 13 and name HN )(resid 13 and name HD# ) 2.9 1.1 1.1 assign (resid 13 and name HN )(resid 14 and name HN ) 2.9 1.1 1.1 assign (resid 13 and name HB# )(resid 14 and name HN ) 2.9 1.1 1.1 assign (resid 13 and name HD# )(resid 14 and name HN ) 2.9 1.1 1.1 assign (resid 13 and name HE# )(resid 30 and name HA ) 2.9 1.1 1.1 assign (resid 13 and name HA )(resid 41 and name HE# ) 2.9 1.1 1.1 assign (resid 13 and name HA )(resid 41 and name HH# ) 2.9 1.1 1.1 assign (resid 13 and name HD# )(resid 41 and name HG# ) 2.9 1.1 1.1 assign (resid 13 and name HD# )(resid 41 and name HD# ) 2.9 1.1 1.1 assign (resid 13 and name HE# )(resid 41 and name HB# ) 2.9 1.1 1.1 assign (resid 13 and name HE# )(resid 41 and name HG# ) 2.9 1.1 1.1 assign (resid 13 and name HE# )(resid 41 and name HD# ) 2.9 1.1 1.1 assign (resid 14 and name HN )(resid 14 and name HB# ) 2.9 1.1 1.1 assign (resid 14 and name HA )(resid 15 and name HN ) 2.4 0.6 0.6 assign (resid 14 and name HB# )(resid 15 and name HN ) 2.9 1.1 1.1 assign (resid 14 and name HB# )(resid 18 and name HA# ) 2.9 1.1 1.1 assign (resid 14 and name HB# )(resid 18 and name HN ) 2.9 1.1 1.1 assign (resid 14 and name HB# )(resid 20 and name HB# ) 2.9 1.1 1.1 assign (resid 14 and name HA )(resid 41 and name HD# ) 2.6 0.8 0.9 assign (resid 15 and name HN )(resid 15 and name HA ) 2.4 0.6 0.6 assign (resid 15 and name HN )(resid 15 and name HB# ) 2.9 1.1 1.1 assign (resid 15 and name HN )(resid 15 and name HG ) 2.9 1.1 1.1 assign (resid 15 and name HN )(resid 15 and name HD* ) 2.6 0.8 1.4 assign (resid 15 and name HA )(resid 16 and name HN ) 2.4 0.6 0.6 assign (resid 15 and name HB# )(resid 16 and name HN ) 2.6 0.8 0.9 assign (resid 15 and name HB# )(resid 16 and name HD# ) 2.9 1.1 1.1 assign (resid 15 and name HG )(resid 16 and name HD# ) 2.9 1.1 1.1 assign (resid 15 and name HD* )(resid 16 and name HN ) 2.9 1.1 1.6 assign (resid 15 and name HD* )(resid 16 and name HD# ) 2.9 1.1 1.6 assign (resid 15 and name HD* )(resid 41 and name HB# ) 2.9 1.1 1.6 assign (resid 15 and name HD* )(resid 41 and name HG# ) 2.9 1.1 1.6 assign (resid 15 and name HD* )(resid 41 and name HE# ) 2.9 1.1 1.6 assign (resid 15 and name HD* )(resid 41 and name HH# ) 2.9 1.1 1.6 assign (resid 15 and name HN )(resid 42 and name HB# ) 2.9 1.1 1.1 assign (resid 15 and name HB# )(resid 42 and name HB# ) 2.9 1.1 1.1 ! relaxed by 0.5 A assign (resid 15 and name HA )(resid 43 and name HA ) 2.9 1.1 1.6 assign (resid 15 and name HB# )(resid 43 and name HA ) 2.9 1.1 1.1 assign (resid 15 and name HG )(resid 43 and name HA ) 2.9 1.1 1.1 assign (resid 15 and name HD* )(resid 43 and name HA ) 2.4 0.6 1.1 assign (resid 15 and name HD* )(resid 43 and name HB# ) 2.9 1.1 1.6 assign (resid 16 and name HN )(resid 16 and name HA ) 2.1 0.3 0.4 assign (resid 16 and name HN )(resid 16 and name HB# ) 2.9 1.1 1.1 assign (resid 16 and name HN )(resid 17 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.5 A assign (resid 16 and name HA )(resid 37 and name HD# ) 2.9 1.1 1.6 assign (resid 16 and name HA )(resid 37 and name HE# ) 2.9 1.1 1.1 assign (resid 16 and name HB# )(resid 37 and name HD# ) 2.9 1.1 1.1 assign (resid 16 and name HB# )(resid 37 and name HE# ) 2.9 1.1 1.1 assign (resid 16 and name HD# )(resid 37 and name HD# ) 2.9 1.1 1.1 assign (resid 16 and name HD# )(resid 43 and name HA ) 2.6 0.8 0.9 assign (resid 16 and name HD# )(resid 43 and name HB# ) 2.9 1.1 1.1 assign (resid 17 and name HN )(resid 17 and name HA# ) 2.4 0.6 0.6 assign (resid 17 and name HN )(resid 18 and name HN ) 2.6 0.8 0.9 assign (resid 17 and name HA# )(resid 18 and name HN ) 2.9 1.1 1.1 assign (resid 18 and name HN )(resid 18 and name HA# ) 2.4 0.6 0.6 assign (resid 18 and name HA# )(resid 19 and name HN ) 2.6 0.8 0.9 assign (resid 18 and name HA# )(resid 33 and name HA ) 2.9 1.1 1.1 ! relaxed by 0.2A assign (resid 19 and name HN )(resid 19 and name HA ) 2.1 0.3 0.6 assign (resid 19 and name HN )(resid 19 and name HB ) 2.6 0.8 0.9 assign (resid 19 and name HN )(resid 19 and name HG* ) 2.6 0.8 1.4 assign (resid 19 and name HA )(resid 20 and name HN ) 2.1 0.3 0.4 assign (resid 19 and name HB )(resid 20 and name HN ) 2.9 1.1 1.1 assign (resid 19 and name HG* )(resid 20 and name HN ) 2.6 0.8 1.4 assign (resid 19 and name HN )(resid 32 and name HN ) 2.9 1.1 1.1 assign (resid 19 and name HB )(resid 32 and name HB# ) 2.9 1.1 1.1 assign (resid 20 and name HN )(resid 20 and name HB# ) 2.6 0.8 0.9 assign (resid 20 and name HA )(resid 21 and name HN ) 2.4 0.6 0.6 assign (resid 20 and name HA )(resid 31 and name HA ) 2.4 0.6 0.6 assign (resid 21 and name HN )(resid 21 and name HB# ) 2.9 1.1 1.1 assign (resid 21 and name HN )(resid 21 and name HG# ) 2.9 1.1 1.1 assign (resid 21 and name HA )(resid 22 and name HN ) 2.4 0.6 0.6 assign (resid 21 and name HB# )(resid 22 and name HN ) 2.9 1.1 1.1 assign (resid 21 and name HG# )(resid 22 and name HN ) 2.9 1.1 1.1 assign (resid 21 and name HE# )(resid 22 and name HN ) 2.9 1.1 1.6 assign (resid 21 and name HN )(resid 30 and name HN ) 2.9 1.1 1.1 assign (resid 21 and name HG# )(resid 30 and name HG2#) 2.9 1.1 1.6 assign (resid 21 and name HN )(resid 31 and name HA ) 2.9 1.1 1.1 ! relaxed by 0.5 A assign (resid 21 and name HG# )(resid 32 and name HB# ) 2.9 1.1 1.6 assign (resid 22 and name HN )(resid 22 and name HA ) 2.4 0.6 0.6 assign (resid 22 and name HN )(resid 22 and name HB# ) 2.9 1.1 1.1 assign (resid 22 and name HA )(resid 23 and name HN ) 2.6 0.8 0.9 assign (resid 22 and name HD2 )(resid 23 and name HN ) 2.9 1.1 1.1 assign (resid 22 and name HE1 )(resid 24 and name HA ) 2.9 1.1 1.1 assign (resid 22 and name HE1 )(resid 24 and name HG# ) 2.9 1.1 1.1 assign (resid 22 and name HD2 )(resid 24 and name HA ) 2.9 1.1 1.1 assign (resid 22 and name HE1 )(resid 27 and name HA ) 2.9 1.1 1.1 assign (resid 22 and name HA )(resid 29 and name HA ) 2.9 1.1 1.1 assign (resid 22 and name HA )(resid 29 and name HD# ) 2.6 0.8 0.9 assign (resid 22 and name HA )(resid 29 and name HE# ) 2.9 1.1 1.1 assign (resid 22 and name HB# )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 22 and name HB# )(resid 29 and name HE# ) 2.6 0.8 0.9 assign (resid 22 and name HE1 )(resid 29 and name HE# ) 2.9 1.1 1.1 assign (resid 22 and name HD2 )(resid 29 and name HA ) 2.9 1.1 1.1 assign (resid 22 and name HA )(resid 30 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.2A assign (resid 23 and name HN )(resid 23 and name HA ) 2.1 0.3 0.6 assign (resid 23 and name HN )(resid 23 and name HB ) 2.6 0.8 0.9 assign (resid 23 and name HN )(resid 23 and name HG1#) 2.9 1.1 1.1 assign (resid 23 and name HN )(resid 23 and name HG2#) 2.9 1.1 1.6 assign (resid 23 and name HA )(resid 24 and name HN ) 2.1 0.3 0.4 assign (resid 23 and name HB )(resid 24 and name HN ) 2.9 1.1 1.1 assign (resid 23 and name HG2#)(resid 24 and name HN ) 2.6 0.8 1.4 assign (resid 23 and name HD# )(resid 30 and name HG2#) 2.9 1.1 2.1 assign (resid 24 and name HN )(resid 24 and name HB# ) 2.6 0.8 0.9 assign (resid 24 and name HN )(resid 24 and name HG# ) 2.9 1.1 1.1 assign (resid 24 and name HA )(resid 27 and name HN ) 2.9 1.1 1.1 assign (resid 24 and name HA )(resid 27 and name HA ) 2.9 1.1 1.1 ! relaxed by 0.2A assign (resid 25 and name HN )(resid 25 and name HA ) 2.1 0.3 0.6 assign (resid 25 and name HN )(resid 25 and name HB# ) 2.6 0.8 0.9 assign (resid 25 and name HN )(resid 26 and name HN ) 2.6 0.8 0.9 ! relaxed by 0.2A assign (resid 26 and name HN )(resid 26 and name HA ) 2.1 0.3 0.6 assign (resid 26 and name HN )(resid 26 and name HB# ) 2.9 1.1 1.1 assign (resid 26 and name HN )(resid 26 and name HG ) 2.9 1.1 1.1 assign (resid 26 and name HN )(resid 26 and name HD* ) 2.6 0.8 1.4 assign (resid 26 and name HN )(resid 27 and name HN ) 2.6 0.8 0.9 assign (resid 26 and name HA )(resid 27 and name HN ) 2.9 1.1 1.1 assign (resid 26 and name HB# )(resid 27 and name HN ) 2.9 1.1 1.1 assign (resid 27 and name HN )(resid 27 and name HA ) 2.1 0.3 0.4 assign (resid 27 and name HN )(resid 27 and name HB# ) 2.9 1.1 1.1 assign (resid 27 and name HA )(resid 28 and name HN ) 2.6 0.8 0.9 ! relaxed by 0.2A assign (resid 28 and name HN )(resid 28 and name HA ) 2.1 0.3 0.6 assign (resid 28 and name HN )(resid 28 and name HB# ) 2.9 1.1 1.1 assign (resid 28 and name HA )(resid 29 and name HN ) 2.6 0.8 0.9 assign (resid 28 and name HA )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 28 and name HA )(resid 29 and name HE# ) 2.9 1.1 1.1 assign (resid 28 and name HB# )(resid 29 and name HN ) 2.9 1.1 1.1 assign (resid 29 and name HN )(resid 29 and name HA ) 2.4 0.6 0.6 assign (resid 29 and name HN )(resid 29 and name HB# ) 2.9 1.1 1.1 assign (resid 29 and name HN )(resid 29 and name HD# ) 2.9 1.1 1.1 assign (resid 29 and name HA )(resid 30 and name HN ) 2.4 0.6 0.6 assign (resid 29 and name HB# )(resid 30 and name HN ) 2.9 1.1 1.1 assign (resid 29 and name HD# )(resid 30 and name HN ) 2.9 1.1 1.1 assign (resid 30 and name HN )(resid 30 and name HA ) 2.4 0.6 0.6 assign (resid 30 and name HN )(resid 30 and name HG2#) 2.9 1.1 1.6 assign (resid 30 and name HN )(resid 31 and name HN ) 2.9 1.1 1.1 assign (resid 30 and name HA )(resid 31 and name HN ) 2.4 0.6 0.6 assign (resid 30 and name HB )(resid 31 and name HN ) 2.9 1.1 1.1 assign (resid 30 and name HG2#)(resid 31 and name HN ) 2.9 1.1 1.6 assign (resid 31 and name HN )(resid 31 and name HA ) 2.4 0.6 0.6 assign (resid 31 and name HN )(resid 31 and name HB# ) 2.9 1.1 1.1 assign (resid 31 and name HA )(resid 32 and name HN ) 2.4 0.6 0.6 assign (resid 31 and name HB# )(resid 32 and name HN ) 2.9 1.1 1.1 assign (resid 32 and name HN )(resid 32 and name HA ) 2.6 0.8 0.9 assign (resid 32 and name HN )(resid 32 and name HB# ) 2.9 1.1 1.1 assign (resid 32 and name HA )(resid 33 and name HN ) 2.4 0.6 0.6 assign (resid 33 and name HN )(resid 33 and name HB# ) 2.9 1.1 1.1 assign (resid 33 and name HA )(resid 34 and name HN ) 2.9 1.1 1.1 assign (resid 33 and name HB# )(resid 34 and name HN ) 2.9 1.1 1.1 assign (resid 33 and name HB# )(resid 37 and name HA ) 2.9 1.1 1.1 assign (resid 33 and name HB# )(resid 37 and name HB# ) 2.9 1.1 1.1 assign (resid 34 and name HN )(resid 34 and name HA ) 2.4 0.6 0.6 assign (resid 34 and name HN )(resid 34 and name HB ) 2.6 0.8 0.9 assign (resid 34 and name HN )(resid 34 and name HG* ) 2.6 0.8 1.4 assign (resid 34 and name HA )(resid 35 and name HN ) 2.1 0.3 0.4 assign (resid 34 and name HB )(resid 35 and name HN ) 2.9 1.1 1.1 assign (resid 34 and name HG* )(resid 35 and name HN ) 2.6 0.8 1.4 assign (resid 34 and name HB )(resid 37 and name HD# ) 2.6 0.8 0.9 assign (resid 34 and name HB )(resid 37 and name HE# ) 2.9 1.1 1.1 assign (resid 34 and name HG* )(resid 37 and name HD# ) 2.6 0.8 1.4 assign (resid 34 and name HG* )(resid 37 and name HE# ) 2.6 0.8 1.4 assign (resid 35 and name HN )(resid 35 and name HA ) 2.4 0.6 0.6 assign (resid 35 and name HN )(resid 35 and name HG1#) 2.9 1.1 1.1 assign (resid 35 and name HN )(resid 35 and name HG2#) 2.6 0.8 1.4 assign (resid 35 and name HA )(resid 36 and name HN ) 2.1 0.3 0.4 assign (resid 35 and name HG2#)(resid 36 and name HN ) 2.9 1.1 1.6 assign (resid 35 and name HA )(resid 37 and name HN ) 2.9 1.1 1.1 assign (resid 35 and name HG1#)(resid 49 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.5 A assign (resid 35 and name HG2#)(resid 49 and name HZ2 ) 2.9 1.1 2.1 assign (resid 36 and name HN )(resid 36 and name HA# ) 2.4 0.6 0.6 assign (resid 36 and name HN )(resid 37 and name HB# ) 2.9 1.1 1.1 assign (resid 36 and name HA# )(resid 37 and name HN ) 2.9 1.1 1.1 assign (resid 36 and name HA# )(resid 50 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.2A assign (resid 37 and name HN )(resid 37 and name HA ) 2.1 0.3 0.6 assign (resid 37 and name HN )(resid 37 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HN )(resid 37 and name HD# ) 2.9 1.1 1.1 assign (resid 37 and name HA )(resid 38 and name HN ) 2.4 0.6 0.6 assign (resid 37 and name HB# )(resid 38 and name HN ) 2.9 1.1 1.1 assign (resid 37 and name HA )(resid 42 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HA )(resid 45 and name HA ) 2.4 0.6 0.6 assign (resid 37 and name HD# )(resid 45 and name HA ) 2.6 0.8 0.9 assign (resid 37 and name HD# )(resid 45 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HD# )(resid 45 and name HG# ) 2.9 1.1 1.1 assign (resid 37 and name HD# )(resid 45 and name HD# ) 2.9 1.1 1.1 assign (resid 37 and name HE# )(resid 45 and name HA ) 2.6 0.8 0.9 assign (resid 37 and name HE# )(resid 45 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HE# )(resid 45 and name HG# ) 2.4 0.6 0.6 assign (resid 37 and name HE# )(resid 45 and name HD# ) 2.9 1.1 1.1 assign (resid 37 and name HA )(resid 46 and name HN ) 2.9 1.1 1.1 assign (resid 37 and name HD# )(resid 49 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HE# )(resid 49 and name HB# ) 2.9 1.1 1.1 assign (resid 37 and name HE# )(resid 49 and name HZ2 ) 2.6 0.8 0.9 assign (resid 38 and name HN )(resid 38 and name HA ) 2.9 1.1 1.1 assign (resid 38 and name HB# )(resid 39 and name HN ) 2.6 0.8 0.9 assign (resid 38 and name HA )(resid 42 and name HA ) 2.9 1.1 1.1 assign (resid 38 and name HN )(resid 44 and name HN ) 2.9 1.1 1.1 assign (resid 39 and name HN )(resid 39 and name HA# ) 2.6 0.8 0.9 assign (resid 39 and name HA# )(resid 40 and name HN ) 2.6 0.8 0.9 assign (resid 40 and name HN )(resid 40 and name HA ) 2.6 0.8 0.9 assign (resid 40 and name HN )(resid 40 and name HB# ) 2.4 0.6 0.6 assign (resid 40 and name HN )(resid 41 and name HN ) 2.9 1.1 1.1 assign (resid 40 and name HB# )(resid 42 and name HN ) 2.9 1.1 1.1 assign (resid 40 and name HN )(resid 43 and name HE# ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 41 and name HA ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 41 and name HB# ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 41 and name HG# ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 42 and name HN ) 2.9 1.1 1.1 assign (resid 41 and name HG# )(resid 42 and name HN ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 43 and name HN ) 2.9 1.1 1.1 assign (resid 41 and name HN )(resid 43 and name HE# ) 2.9 1.1 1.1 ! relaxed by 0.2 A assign (resid 42 and name HN )(resid 42 and name HA ) 2.1 0.3 0.6 assign (resid 42 and name HN )(resid 43 and name HN ) 2.9 1.1 1.1 assign (resid 42 and name HA )(resid 43 and name HN ) 2.9 1.1 1.1 assign (resid 42 and name HB# )(resid 43 and name HN ) 2.9 1.1 1.1 assign (resid 43 and name HN )(resid 43 and name HA ) 2.9 1.1 1.1 assign (resid 43 and name HN )(resid 43 and name HB# ) 2.9 1.1 1.1 assign (resid 43 and name HN )(resid 43 and name HG# ) 2.9 1.1 1.1 assign (resid 43 and name HN )(resid 44 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.2 A assign (resid 44 and name HN )(resid 44 and name HA ) 2.1 0.3 0.6 assign (resid 44 and name HN )(resid 44 and name HB ) 2.6 0.8 0.9 assign (resid 44 and name HN )(resid 44 and name HG2#) 2.9 1.1 1.6 assign (resid 44 and name HA )(resid 45 and name HN ) 2.1 0.3 0.4 assign (resid 44 and name HG2#)(resid 45 and name HN ) 2.9 1.1 1.6 assign (resid 45 and name HN )(resid 45 and name HA ) 2.4 0.6 0.6 assign (resid 45 and name HN )(resid 45 and name HB# ) 2.6 0.8 0.9 assign (resid 45 and name HN )(resid 45 and name HG# ) 2.9 1.1 1.1 assign (resid 45 and name HA )(resid 46 and name HN ) 2.4 0.6 0.6 assign (resid 45 and name HG# )(resid 46 and name HN ) 2.9 1.1 1.1 ! relaxed by 0.5 A assign (resid 45 and name HA )(resid 50 and name HE1 ) 2.9 1.1 1.6 assign (resid 45 and name HG# )(resid 50 and name HD1 ) 2.9 1.1 1.1 assign (resid 46 and name HN )(resid 46 and name HA ) 2.4 0.6 0.6 assign (resid 46 and name HN )(resid 46 and name HB# ) 2.6 0.8 0.9 assign (resid 46 and name HA )(resid 47 and name HN ) 2.4 0.6 0.6 assign (resid 46 and name HB# )(resid 47 and name HN ) 2.9 1.1 1.1 assign (resid 47 and name HN )(resid 47 and name HB# ) 2.6 0.8 0.9 assign (resid 47 and name HN )(resid 47 and name HG ) 2.1 0.3 0.4 assign (resid 47 and name HN )(resid 47 and name HD* ) 2.9 1.1 1.6 ! HD1 -> HZ3 assign (resid 47 and name HA )(resid 50 and name HZ3 ) 2.9 1.1 1.1 assign (resid 48 and name HN )(resid 48 and name HA ) 2.1 0.3 0.4 assign (resid 48 and name HN )(resid 48 and name HB# ) 2.6 0.8 0.9 assign (resid 48 and name HN )(resid 48 and name HG# ) 2.6 0.8 0.9 assign (resid 48 and name HN )(resid 49 and name HN ) 2.6 0.8 0.9 assign (resid 48 and name HA )(resid 49 and name HN ) 2.4 0.6 0.6 assign (resid 48 and name HB# )(resid 49 and name HN ) 2.9 1.1 1.1 assign (resid 48 and name HG# )(resid 50 and name HZ2 ) 2.9 1.1 1.1 assign (resid 49 and name HN )(resid 49 and name HA ) 2.1 0.3 0.4 assign (resid 49 and name HN )(resid 49 and name HB# ) 2.4 0.6 0.6 assign (resid 49 and name HN )(resid 50 and name HN ) 2.9 1.1 1.1 assign (resid 49 and name HA )(resid 50 and name HN ) 2.4 0.6 0.6 assign (resid 49 and name HB# )(resid 50 and name HN ) 2.9 1.1 1.1 ! HZ3 -> HD1 assign (resid 49 and name HE1 )(resid 50 and name HD1 ) 2.9 1.1 1.1 assign (resid 49 and name HE3 )(resid 50 and name HA ) 2.9 1.1 1.1 assign (resid 50 and name HN )(resid 51 and name HN ) 2.9 1.1 1.1 assign (resid 50 and name HA )(resid 51 and name HN ) 2.6 0.8 0.9 assign (resid 50 and name HB# )(resid 51 and name HN ) 2.9 1.1 1.1 assign (resid 51 and name HN )(resid 51 and name HA ) 2.1 0.3 0.4 assign (resid 51 and name HN )(resid 51 and name HB# ) 2.6 0.8 0.9 assign (resid 51 and name HN )(resid 51 and name HG# ) 2.9 1.1 1.1 assign (resid 52 and name HN )(resid 52 and name HA ) 2.1 0.3 0.4 assign (resid 52 and name HN )(resid 52 and name HD* ) 2.9 1.1 1.6 assign (resid 52 and name HB# )(resid 53 and name HN ) 2.9 1.1 1.1 assign (resid 53 and name HN )(resid 53 and name HA ) 2.1 0.3 0.4 assign (resid 53 and name HN )(resid 53 and name HG# ) 2.9 1.1 1.1 remarks S-S bridges assign (resid 6 and name SG )(resid 20 and name SG ) 2.02 0.10 0.10 assign (resid 14 and name SG )(resid 31 and name SG ) 2.02 0.10 0.10 assign (resid 33 and name SG )(resid 42 and name SG ) 2.02 0.10 0.10 remarks H-bonds assign (resid 21 and name HN )(resid 30 and name O ) 1.8 0.5 0.5 assign (resid 21 and name N )(resid 30 and name O ) 2.8 0.5 0.5 assign (resid 21 and name O )(resid 30 and name HN ) 1.8 0.5 0.5 assign (resid 21 and name O )(resid 30 and name N ) 2.8 0.5 0.5 assign (resid 19 and name HN )(resid 32 and name O ) 1.8 0.5 0.5 assign (resid 19 and name N )(resid 32 and name O ) 2.8 0.5 0.5 assign (resid 19 and name O )(resid 32 and name HN ) 1.8 0.5 0.5 assign (resid 19 and name O )(resid 32 and name N ) 2.8 0.5 0.5 assign (resid 34 and name HN )(resid 37 and name O ) 1.8 0.5 0.5 assign (resid 34 and name N )(resid 37 and name O ) 2.8 0.5 0.5 assign (resid 34 and name O )(resid 37 and name HN ) 1.8 0.5 0.5 assign (resid 34 and name O )(resid 37 and name N ) 2.8 0.5 0.5 assign (resid 38 and name HN )(resid 44 and name O ) 1.8 0.5 0.5 assign (resid 38 and name N )(resid 44 and name O ) 2.8 0.5 0.5 assign (resid 38 and name O )(resid 44 and name HN ) 1.8 0.5 0.5 assign (resid 38 and name O )(resid 44 and name N ) 2.8 0.5 0.5
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