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 |
|
|
11246 |
1r7c   |
5978 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! ! NS5A Nter TFE 50% ! ! GLY 2 assign (resid 2 and name HN )(resid 1 and name HA ) 5.0 3.2 0.5 ! ! SER 3 ! assign (resid 3 and name HN )(resid 3 and name HA ) 2.8 1 0.28 assign (resid 3 and name HN )(resid 3 and name HB1 ) 2.8 1 0.28 assign (resid 3 and name HN )(resid 3 and name HB2 ) 3.9 2.1 0.39 assign (resid 3 and name HA )(resid 3 and name HB1 ) 3.9 2.1 0.39 assign (resid 3 and name HA )(resid 3 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 3 and name HN )(resid 2 and name HN ) 5.0 3.2 0.5 ! ! TRP 4 ! assign (resid 4 and name HN )(resid 4 and name HA ) 2.8 1 0.28 assign (resid 4 and name HN )(resid 4 and name HB1 ) 2.8 1 0.28 assign (resid 4 and name HN )(resid 4 and name HB2 ) 2.8 1 0.28 assign (resid 4 and name HA )(resid 4 and name HB1 ) 2.8 1 0.28 assign (resid 4 and name HA )(resid 4 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 4 and name HN )(resid 3 and name HA ) 2.8 1 0.28 assign (resid 4 and name HA )(resid 7 and name HB1 ) 3.9 2.1 0.39 assign (resid 4 and name HA )(resid 7 and name HB2 ) 5.0 3.2 0.5 ! assign (resid 4 and name HA )(resid 4 and name HE3 ) 5.0 3.2 0.5 assign (resid 4 and name HB1 )(resid 4 and name HE3 ) 2.8 1 0.28 assign (resid 4 and name HB2 )(resid 4 and name HE3 ) 3.9 2.1 0.39 assign (resid 4 and name HN )(resid 4 and name HD1 ) 5.0 3.2 0.5 assign (resid 4 and name HB1 )(resid 4 and name HD1 ) 3.9 2.1 0.39 assign (resid 4 and name HB2 )(resid 4 and name HD1 ) 2.8 1 0.28 ! assign (resid 4 and name HE3 )(resid 8 and name HD1#) 2.8 1 1.28 assign (resid 4 and name HE3 )(resid 8 and name HG12) 5.0 3.2 0.5 ! ! LEU 5 ! assign (resid 5 and name HN )(resid 5 and name HA ) 2.8 1 0.28 assign (resid 5 and name HN )(resid 5 and name HB1 ) 3.9 2.1 0.39 assign (resid 5 and name HN )(resid 5 and name HB2 ) 5.0 3.2 0.5 assign (resid 5 and name HA )(resid 5 and name HB1 ) 2.8 1 0.28 assign (resid 5 and name HA )(resid 5 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 5 and name HN )(resid 4 and name HN ) 3.9 2.1 0.39 assign (resid 5 and name HN )(resid 4 and name HA ) 5.0 3.2 0.5 assign (resid 5 and name HN )(resid 4 and name HB1 ) 5.0 3.2 0.5 assign (resid 5 and name HN )(resid 4 and name HB2 ) 3.9 2.1 0.39 assign (resid 5 and name HA )(resid 8 and name HB ) 2.8 1 0.28 ! ! ARG 6 ! assign (resid 6 and name HN )(resid 6 and name HA ) 2.8 1 0.28 assign (resid 6 and name HN )(resid 6 and name HB1 ) 2.8 1 0.28 assign (resid 6 and name HN )(resid 6 and name HB2 ) 2.8 1 0.28 assign (resid 6 and name HN )(resid 6 and name HG# ) 3.9 2.1 1.39 assign (resid 6 and name HA )(resid 6 and name HB1 ) 3.9 2.1 0.39 assign (resid 6 and name HA )(resid 6 and name HB2 ) 2.8 1 0.28 !! assign (resid 6 and name HN )(resid 5 and name HA ) 3.9 2.1 0.39 assign (resid 6 and name HN )(resid 5 and name HB1 ) 3.9 2.1 0.39 assign (resid 6 and name HN )(resid 5 and name HB2 ) 5.0 3.2 0.5 assign (resid 6 and name HN )(resid 3 and name HA ) 5.0 3.2 0.5 assign (resid 6 and name HA )(resid 9 and name HB# ) 2.8 1 1.28 ! ! ASP 7 ! assign (resid 7 and name HN )(resid 7 and name HA ) 2.8 1 0.28 assign (resid 7 and name HN )(resid 7 and name HB1 ) 2.8 1 0.28 assign (resid 7 and name HN )(resid 7 and name HB2 ) 3.9 2.1 0.39 assign (resid 7 and name HA )(resid 7 and name HB1 ) 3.9 2.1 0.39 assign (resid 7 and name HA )(resid 7 and name HB2 ) 5.0 3.2 0.5 !! assign (resid 7 and name HN )(resid 6 and name HN ) 2.8 1 0.28 assign (resid 7 and name HN )(resid 6 and name HA ) 3.9 2.1 0.39 assign (resid 7 and name HN )(resid 6 and name HB1 ) 2.8 1 0.28 assign (resid 7 and name HN )(resid 6 and name HB2 ) 5.0 3.2 0.5 assign (resid 7 and name HN )(resid 4 and name HA ) 5.0 3.2 0.5 assign (resid 7 and name HA )(resid 10 and name HB1 ) 3.9 2.1 0.39 assign (resid 7 and name HA )(resid 10 and name HB2 ) 5.0 3.2 0.5 ! ! ILE 8 ! assign (resid 8 and name HN )(resid 8 and name HA ) 2.8 1 0.28 assign (resid 8 and name HN )(resid 8 and name HB ) 2.8 1 0.28 !! assign (resid 8 and name HN )(resid 5 and name HA ) 3.9 2.1 0.39 assign (resid 8 and name HA )(resid 11 and name HB1 ) 2.8 1 0.28 assign (resid 8 and name HA )(resid 11 and name HB2 ) 3.9 2.1 0.39 assign (resid 8 and name HG2# )(resid 12 and name HB ) 3.9 2.1 1.39 ! assign (resid 11 and name HE3 )(resid 8 and name HA ) 5.0 3.2 0.5 assign (resid 11 and name HE3 )(resid 8 and name HG2#) 5.0 3.2 1.5 ! ! TRP 9 ! assign (resid 9 and name HN )(resid 9 and name HA ) 3.9 2.1 0.39 assign (resid 9 and name HN )(resid 9 and name HB# ) 2.8 1 1.28 !! assign (resid 9 and name HN )(resid 8 and name HN ) 3.9 2.1 0.39 assign (resid 9 and name HN )(resid 8 and name HA ) 5.0 3.2 0.5 assign (resid 9 and name HN )(resid 8 and name HB ) 3.9 2.1 0.39 assign (resid 9 and name HN )(resid 8 and name HG2#) 5.0 3.2 1.5 assign (resid 9 and name HN )(resid 6 and name HA ) 3.9 2.1 0.39 assign (resid 9 and name HN )(resid 5 and name HA ) 5.0 3.2 0.5 assign (resid 9 and name HA )(resid 12 and name HB ) 2.8 1 0.28 ! assign (resid 9 and name HA )(resid 9 and name HE3 ) 2.8 1 0.28 assign (resid 9 and name HB# )(resid 9 and name HE3 ) 2.8 1 1.28 assign (resid 9 and name HB# )(resid 9 and name HD1 ) 2.8 1 1.28 ! assign (resid 9 and name HE3 )(resid 12 and name HG2#) 3.9 2.1 1.39 assign (resid 9 and name HE3 )(resid 12 and name HD1#) 2.8 1 1.28 ! ! ASP 10 ! assign (resid 10 and name HN )(resid 10 and name HA ) 2.8 1 0.28 assign (resid 10 and name HN )(resid 10 and name HB1 ) 2.8 1 0.28 assign (resid 10 and name HN )(resid 10 and name HB2 ) 3.9 2.1 0.39 assign (resid 10 and name HA )(resid 10 and name HB1 ) 3.9 2.1 0.39 assign (resid 10 and name HA )(resid 10 and name HB2 ) 2.8 1 0.28 !! assign (resid 10 and name HN )(resid 9 and name HN ) 2.8 1 0.28 assign (resid 10 and name HN )(resid 9 and name HA ) 3.9 2.1 0.39 assign (resid 10 and name HN )(resid 9 and name HB# ) 2.8 1 1.28 assign (resid 10 and name HA )(resid 13 and name HB1 ) 2.8 1 0.28 assign (resid 10 and name HA )(resid 13 and name HB2 ) 3.9 2.1 0.39 ! ! TRP 11 ! assign (resid 11 and name HN )(resid 11 and name HA ) 2.8 1 0.28 assign (resid 11 and name HN )(resid 11 and name HB1 ) 2.8 1 0.28 assign (resid 11 and name HN )(resid 11 and name HB2 ) 2.8 1 0.28 assign (resid 11 and name HA )(resid 11 and name HB1 ) 3.9 2.1 0.39 assign (resid 11 and name HA )(resid 11 and name HB2 ) 2.8 1 0.28 !! assign (resid 11 and name HN )(resid 10 and name HN ) 3.9 2.1 0.39 assign (resid 11 and name HN )(resid 10 and name HA ) 5.0 3.2 0.5 assign (resid 11 and name HN )(resid 10 and name HB1 ) 3.9 2.1 0.39 assign (resid 11 and name HN )(resid 10 and name HB2 ) 5.0 3.2 0.5 assign (resid 11 and name HN )(resid 8 and name HA ) 3.9 2.1 0.39 assign (resid 11 and name HA )(resid 14 and name HB1 ) 5.0 3.2 0.5 assign (resid 11 and name HA )(resid 14 and name HB2 ) 3.9 2.1 0.39 ! assign (resid 11 and name HA )(resid 11 and name HE3 ) 5.0 3.2 0.5 assign (resid 11 and name HB1 )(resid 11 and name HE3 ) 3.9 2.1 0.39 assign (resid 11 and name HB2 )(resid 11 and name HE3 ) 3.9 2.1 0.39 assign (resid 11 and name HA )(resid 11 and name HD1 ) 3.9 2.1 0.39 assign (resid 11 and name HB1 )(resid 11 and name HD1 ) 3.9 2.1 0.39 assign (resid 11 and name HB2 )(resid 11 and name HD1 ) 2.8 1 0.28 ! assign (resid 11 and name HE3 )(resid 12 and name HG12) 5.0 3.2 0.5 assign (resid 11 and name HE3 )(resid 12 and name HG2#) 5.0 3.2 1.5 assign (resid 11 and name HE3 )(resid 12 and name HD1#) 3.9 2.1 1.39 assign (resid 11 and name HE3 )(resid 15 and name HG2#) 5.0 3.2 1.5 assign (resid 11 and name HD1 )(resid 15 and name HG2#) 3.9 2.1 1.39 assign (resid 11 and name HZ2 )(resid 15 and name HG2#) 3.9 2.1 1.39 assign (resid 11 and name HE1 )(resid 15 and name HG2#) 3.9 2.1 1.39 ! ! ILE 12 ! assign (resid 12 and name HN )(resid 12 and name HA ) 2.8 1 0.28 assign (resid 12 and name HN )(resid 12 and name HB ) 2.8 1 0.28 assign (resid 12 and name HN )(resid 12 and name HG2#) 3.9 2.1 1.39 assign (resid 12 and name HN )(resid 12 and name HD1#) 5.0 3.2 1.5 assign (resid 12 and name HA )(resid 12 and name HB ) 2.8 1 0.28 !! assign (resid 12 and name HN )(resid 11 and name HN ) 3.9 2.1 0.39 assign (resid 12 and name HN )(resid 11 and name HA ) 3.9 2.1 0.39 assign (resid 12 and name HN )(resid 11 and name HB1 ) 5.0 3.2 0.5 assign (resid 12 and name HN )(resid 11 and name HB2 ) 3.9 2.1 0.39 assign (resid 12 and name HN )(resid 9 and name HA ) 3.9 2.1 0.39 assign (resid 12 and name HN )(resid 8 and name HA ) 5.0 3.2 1.5 assign (resid 12 and name HA )(resid 15 and name HB ) 2.8 1 0.28 assign (resid 12 and name HA )(resid 15 and name HG1#) 3.9 2.1 1.39 assign (resid 12 and name HA )(resid 15 and name HG2#) 2.8 1 1.28 ! ! CYS 13 ! assign (resid 13 and name HN )(resid 13 and name HA ) 2.8 1 0.28 assign (resid 13 and name HN )(resid 13 and name HB1 ) 2.8 1 0.28 assign (resid 13 and name HN )(resid 13 and name HB2 ) 3.9 2.1 0.39 assign (resid 13 and name HN )(resid 13 and name HG ) 5.0 3.2 0.5 assign (resid 13 and name HA )(resid 13 and name HB1 ) 2.8 1 0.28 assign (resid 13 and name HA )(resid 13 and name HB2 ) 2.8 1 0.28 ! assign (resid 13 and name HN )(resid 12 and name HN ) 2.8 1 0.28 assign (resid 13 and name HN )(resid 12 and name HA ) 3.9 2.1 0.39 assign (resid 13 and name HN )(resid 12 and name HB ) 2.8 1 0.28 assign (resid 13 and name HN )(resid 12 and name HG2#) 5.0 3.2 0.5 assign (resid 13 and name HN )(resid 11 and name HN ) 5.0 3.2 0.5 assign (resid 13 and name HN )(resid 10 and name HA ) 3.9 2.1 0.39 assign (resid 13 and name HA )(resid 16 and name HB1 ) 2.8 1 0.28 assign (resid 13 and name HA )(resid 16 and name HB2 ) 3.9 2.1 0.39 ! ! GLU 14 ! assign (resid 14 and name HN )(resid 14 and name HA ) 2.8 1 0.28 assign (resid 14 and name HN )(resid 14 and name HB1 ) 2.8 1 0.28 assign (resid 14 and name HN )(resid 14 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 14 and name HN )(resid 13 and name HN ) 3.9 2.1 0.39 assign (resid 14 and name HN )(resid 13 and name HA ) 3.9 2.1 0.39 assign (resid 14 and name HN )(resid 13 and name HB1 ) 3.9 2.1 0.39 assign (resid 14 and name HN )(resid 13 and name HB2 ) 3.9 2.1 0.39 assign (resid 14 and name HN )(resid 11 and name HA ) 2.8 1 0.28 assign (resid 14 and name HN )(resid 15 and name HG2#) 5.0 3.2 1.5 ! ! VAL 15 ! assign (resid 15 and name HN )(resid 15 and name HA ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 15 and name HB ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 15 and name HG1#) 3.9 2.1 1.39 assign (resid 15 and name HN )(resid 15 and name HG2#) 2.8 1 1.28 assign (resid 15 and name HA )(resid 15 and name HB ) 2.8 1 0.28 !! assign (resid 15 and name HN )(resid 14 and name HN ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 14 and name HA ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 14 and name HB1 ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 14 and name HB2 ) 2.8 1 0.28 assign (resid 15 and name HN )(resid 13 and name HN ) 5.0 3.2 0.5 assign (resid 15 and name HN )(resid 12 and name HA ) 3.9 2.1 0.39 assign (resid 15 and name HN )(resid 11 and name HA ) 5.0 3.2 0.5 assign (resid 15 and name HA )(resid 18 and name HB1 ) 2.8 1 0.28 assign (resid 15 and name HA )(resid 18 and name HB2 ) 3.9 2.1 0.39 ! ! LEU 16 ! assign (resid 16 and name HN )(resid 16 and name HA ) 2.8 1 0.28 assign (resid 16 and name HN )(resid 16 and name HB1 ) 2.8 1 0.28 assign (resid 16 and name HN )(resid 16 and name HB2 ) 3.9 2.1 0.39 assign (resid 16 and name HA )(resid 16 and name HB1 ) 2.8 1 0.28 assign (resid 16 and name HA )(resid 16 and name HB2 ) 2.8 1 0.28 !! assign (resid 16 and name HN )(resid 15 and name HN ) 3.9 2.1 0.39 assign (resid 16 and name HN )(resid 15 and name HA ) 3.9 2.1 0.39 assign (resid 16 and name HN )(resid 15 and name HB ) 2.8 1 0.28 assign (resid 16 and name HN )(resid 15 and name HG1#) 3.9 2.1 1.39 assign (resid 16 and name HN )(resid 15 and name HG2#) 5.0 3.2 1.5 assign (resid 16 and name HN )(resid 14 and name HA ) 5.0 3.2 0.5 assign (resid 16 and name HN )(resid 13 and name HA ) 3.9 2.1 0.39 assign (resid 16 and name HN )(resid 12 and name HA ) 5.0 3.2 0.5 assign (resid 16 and name HA )(resid 19 and name HB1 ) 3.9 2.1 0.39 assign (resid 16 and name HA )(resid 19 and name HB2 ) 2.8 1 0.28 ! ! SER 17 ! assign (resid 17 and name HN )(resid 17 and name HA ) 2.8 1 0.28 assign (resid 17 and name HN )(resid 17 and name HB1 ) 3.9 2.1 0.39 assign (resid 17 and name HN )(resid 17 and name HB2 ) 3.9 2.1 0.39 assign (resid 17 and name HA )(resid 17 and name HB1 ) 2.8 1 0.28 assign (resid 17 and name HA )(resid 17 and name HB2 ) 2.8 1 0.28 !! assign (resid 17 and name HN )(resid 16 and name HN ) 2.8 1 0.28 assign (resid 17 and name HN )(resid 16 and name HA ) 3.9 2.1 0.39 assign (resid 17 and name HN )(resid 16 and name HB1 ) 2.8 1 0.28 assign (resid 17 and name HN )(resid 16 and name HB2 ) 3.9 2.1 0.39 ! assign (resid 17 and name HN )(resid 16 and name HD* ) 3.9 2.1 2.39 assign (resid 17 and name HN )(resid 15 and name HN ) 5.0 3.2 0.5 assign (resid 17 and name HN )(resid 13 and name HA ) 5.0 3.2 0.5 assign (resid 17 and name HA )(resid 20 and name HB1 ) 3.9 2.1 0.39 assign (resid 17 and name HA )(resid 20 and name HB2 ) 5.0 3.2 0.5 ! ! ASP 18 ! assign (resid 18 and name HN )(resid 18 and name HA ) 2.8 1 0.28 assign (resid 18 and name HN )(resid 18 and name HB1 ) 2.8 1 0.28 assign (resid 18 and name HN )(resid 18 and name HB2 ) 3.9 2.1 0.39 assign (resid 18 and name HA )(resid 18 and name HB1 ) 3.9 2.1 0.39 assign (resid 18 and name HA )(resid 18 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 18 and name HN )(resid 17 and name HN ) 2.8 1 0.28 assign (resid 18 and name HN )(resid 17 and name HA ) 3.9 2.1 0.39 assign (resid 18 and name HN )(resid 17 and name HB1 ) 3.9 2.1 0.39 assign (resid 18 and name HN )(resid 17 and name HB2 ) 5.0 3.2 0.5 assign (resid 18 and name HN )(resid 16 and name HN ) 5.0 3.2 0.5 assign (resid 18 and name HN )(resid 15 and name HA ) 3.9 2.1 0.39 ! assign (resid 18 and name HA )(resid 21 and name HB ) 3.9 2.1 0.39 ! ! PHE 19 ! assign (resid 19 and name HN )(resid 19 and name HA ) 2.8 1 0.28 assign (resid 19 and name HN )(resid 19 and name HB1 ) 2.8 1 0.28 assign (resid 19 and name HN )(resid 19 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 19 and name HN )(resid 18 and name HN ) 2.8 1 0.28 assign (resid 19 and name HN )(resid 18 and name HA ) 3.9 2.1 0.39 assign (resid 19 and name HN )(resid 18 and name HB1 ) 2.8 1 0.28 assign (resid 19 and name HN )(resid 18 and name HB2 ) 5.0 3.2 0.5 assign (resid 19 and name HN )(resid 17 and name HN ) 5.0 3.2 0.5 assign (resid 19 and name HN )(resid 16 and name HA ) 3.9 2.1 0.39 assign (resid 19 and name HN )(resid 15 and name HA ) 5.0 3.2 0.5 assign (resid 19 and name HA )(resid 22 and name HB1 ) 5.0 3.2 0.5 assign (resid 19 and name HA )(resid 22 and name HB2 ) 3.9 2.1 0.39 ! assign (resid 19 and name HA )(resid 19 and name HD* ) 2.8 1 2.28 ! assign (resid 19 and name HA )(resid 22 and name HE3 ) 5.0 3.2 0.5 assign (resid 19 and name HD* )(resid 23 and name HD1#) 5.0 3.2 3.5 assign (resid 19 and name HD* )(resid 23 and name HD2#) 5.0 3.2 3.5 assign (resid 19 and name HE* )(resid 23 and name HD1#) 2.8 1 3.28 assign (resid 19 and name HE* )(resid 23 and name HD2#) 3.9 2.1 3.39 ! ! LYS 20 ! assign (resid 20 and name HN )(resid 20 and name HA ) 2.8 1 0.28 assign (resid 20 and name HN )(resid 20 and name HB1 ) 3.9 2.1 0.39 assign (resid 20 and name HN )(resid 20 and name HB2 ) 2.8 1 0.28 assign (resid 20 and name HA )(resid 20 and name HB1 ) 2.8 1 0.28 !! assign (resid 20 and name HN )(resid 19 and name HN ) 2.8 1 0.28 assign (resid 20 and name HN )(resid 19 and name HA ) 5.0 3.2 0.5 assign (resid 20 and name HN )(resid 19 and name HB1 ) 3.9 2.1 0.39 assign (resid 20 and name HN )(resid 19 and name HB2 ) 2.8 1 0.28 assign (resid 20 and name HN )(resid 18 and name HN ) 5.0 3.2 0.5 assign (resid 20 and name HN )(resid 18 and name HA ) 5.0 3.2 0.5 assign (resid 20 and name HN )(resid 17 and name HA ) 3.9 2.1 0.39 assign (resid 20 and name HN )(resid 16 and name HA ) 5.0 3.2 0.5 assign (resid 20 and name HA )(resid 23 and name HB# ) 2.8 1 1.28 ! ! THR 21 ! assign (resid 21 and name HN )(resid 21 and name HA ) 2.8 1 0.28 assign (resid 21 and name HA )(resid 21 and name HB ) 2.8 1 0.28 !! assign (resid 21 and name HN )(resid 20 and name HN ) 2.8 1 0.28 assign (resid 21 and name HN )(resid 20 and name HB1 ) 5.0 3.2 0.5 assign (resid 21 and name HN )(resid 19 and name HN ) 5.0 3.2 0.5 assign (resid 21 and name HN )(resid 18 and name HA ) 2.8 1 0.28 assign (resid 21 and name HN )(resid 17 and name HA ) 5.0 3.2 0.5 assign (resid 21 and name HA )(resid 24 and name HB# ) 2.8 1 1.28 ! ! TRP 22 ! assign (resid 22 and name HN )(resid 22 and name HA ) 2.8 1 0.28 assign (resid 22 and name HN )(resid 22 and name HB1 ) 3.9 2.1 0.39 assign (resid 22 and name HN )(resid 22 and name HB2 ) 2.8 1 0.28 assign (resid 22 and name HA )(resid 22 and name HB1 ) 3.9 2.1 0.39 assign (resid 22 and name HA )(resid 22 and name HB2 ) 2.8 1 0.28 ! assign (resid 22 and name HN )(resid 21 and name HN ) 3.9 2.1 0.39 assign (resid 22 and name HN )(resid 21 and name HA ) 3.9 2.1 0.39 assign (resid 22 and name HN )(resid 21 and name HG2#) 5.0 3.2 1.5 assign (resid 22 and name HA )(resid 25 and name HB# ) 2.8 1 1.28 ! assign (resid 22 and name HA )(resid 22 and name HE3 ) 5.0 3.2 0.5 assign (resid 22 and name HB1 )(resid 22 and name HE3 ) 3.9 2.1 0.39 assign (resid 22 and name HB2 )(resid 22 and name HE3 ) 3.9 2.1 0.39 assign (resid 22 and name HA )(resid 22 and name HD1 ) 3.9 2.1 0.39 assign (resid 22 and name HB1 )(resid 22 and name HD1 ) 5.0 3.2 0.5 assign (resid 22 and name HB2 )(resid 22 and name HD1 ) 2.8 1 0.28 ! assign (resid 23 and name HA )(resid 22 and name HE3 ) 2.8 1 0.28 assign (resid 23 and name HD1# )(resid 22 and name HE3 ) 5.0 3.2 1.5 assign (resid 23 and name HD1# )(resid 22 and name HZ3 ) 5.0 3.2 1.5 assign (resid 23 and name HD2# )(resid 22 and name HZ3 ) 5.0 3.2 1.5 ! ! LEU 23 ! assign (resid 23 and name HN )(resid 23 and name HA ) 3.9 2.1 0.39 assign (resid 23 and name HN )(resid 23 and name HB# ) 2.8 1 1.28 !! assign (resid 23 and name HN )(resid 22 and name HN ) 3.9 2.1 0.39 assign (resid 23 and name HN )(resid 22 and name HA ) 3.9 2.1 0.39 assign (resid 23 and name HN )(resid 22 and name HB1 ) 3.9 2.1 0.39 assign (resid 23 and name HN )(resid 22 and name HB2 ) 2.8 1 0.28 assign (resid 23 and name HN )(resid 20 and name HA ) 3.9 2.1 0.39 assign (resid 23 and name HN )(resid 19 and name HA ) 5.0 3.2 0.5 assign (resid 23 and name HA )(resid 26 and name HB# ) 2.8 1 1.28 ! ! LYS 24 ! assign (resid 24 and name HN )(resid 24 and name HA ) 2.8 1 0.28 assign (resid 24 and name HN )(resid 24 and name HB# ) 2.8 1 1.28 !! assign (resid 24 and name HN )(resid 23 and name HN ) 3.9 2.1 0.39 assign (resid 24 and name HN )(resid 23 and name HA ) 3.9 2.1 0.39 assign (resid 24 and name HN )(resid 23 and name HB# ) 2.8 1 1.28 assign (resid 24 and name HN )(resid 22 and name HA ) 5.0 3.2 0.5 assign (resid 24 and name HN )(resid 21 and name HA ) 2.8 1 0.28 ! ! ALA 25 ! assign (resid 25 and name HN )(resid 25 and name HA ) 2.8 1 0.28 assign (resid 25 and name HN )(resid 25 and name HB# ) 2.8 1 1.28 !! assign (resid 25 and name HN )(resid 24 and name HN ) 2.8 1 0.28 assign (resid 25 and name HN )(resid 24 and name HA ) 3.9 2.1 0.39 assign (resid 25 and name HN )(resid 24 and name HB# ) 2.8 1 1.28 assign (resid 25 and name HN )(resid 23 and name HN ) 5.0 3.2 0.5 assign (resid 25 and name HN )(resid 23 and name HA ) 5.0 3.2 0.5 assign (resid 25 and name HN )(resid 22 and name HA ) 3.9 2.1 0.39 ! assign (resid 25 and name HA )(resid 28 and name HB# ) 3.9 2.1 1.39 ! ! LYS 26 ! assign (resid 26 and name HN )(resid 26 and name HA ) 2.8 1 0.28 assign (resid 26 and name HN )(resid 26 and name HB# ) 2.8 1 1.28 assign (resid 26 and name HN )(resid 26 and name HG1 ) 3.9 2.1 0.39 assign (resid 26 and name HN )(resid 26 and name HG2 ) 5.0 3.2 0.5 !! assign (resid 26 and name HN )(resid 25 and name HA ) 3.9 2.1 0.39 assign (resid 26 and name HN )(resid 25 and name HB# ) 2.8 1 1.28 assign (resid 26 and name HN )(resid 24 and name HA ) 5.0 3.2 0.5 assign (resid 26 and name HN )(resid 23 and name HA ) 3.9 2.1 0.39 assign (resid 26 and name HN )(resid 22 and name HA ) 5.0 3.2 0.5 ! ! LEU 27 ! assign (resid 27 and name HN )(resid 27 and name HA ) 2.8 1 0.28 assign (resid 27 and name HN )(resid 27 and name HB1 ) 2.8 1 0.28 assign (resid 27 and name HN )(resid 27 and name HB2 ) 3.9 2.1 0.39 assign (resid 27 and name HN )(resid 27 and name HD* ) 5.0 3.2 2.5 assign (resid 27 and name HA )(resid 27 and name HB1 ) 2.8 1 0.28 assign (resid 27 and name HA )(resid 27 and name HB2 ) 3.9 2.1 0.39 !! assign (resid 27 and name HN )(resid 26 and name HA ) 3.9 2.1 0.39 assign (resid 27 and name HN )(resid 26 and name HB# ) 2.8 1.0 1.28 assign (resid 27 and name HN )(resid 25 and name HA ) 5.0 3.2 0.5 assign (resid 27 and name HN )(resid 24 and name HA ) 3.9 2.1 0.39 assign (resid 27 and name HN )(resid 23 and name HA ) 5.0 3.2 0.5 ! ! MET 28 ! assign (resid 28 and name HN )(resid 28 and name HB# ) 2.8 1 1.28 !! assign (resid 28 and name HN )(resid 27 and name HA ) 3.9 2.1 0.39 assign (resid 28 and name HN )(resid 27 and name HB1 ) 3.9 2.1 0.39 assign (resid 28 and name HN )(resid 27 and name HB2 ) 3.9 2.1 0.39 !oui uoi assign (resid 28 and name HA )(resid 29 and name HD1 ) 5.0 3.2 0.5 assign (resid 28 and name HA )(resid 29 and name HD2 ) 5.0 3.2 0.5 assign (resid 28 and name HA )(resid 29 and name HG# ) 5.0 3.2 1.5 assign (resid 28 and name HB# )(resid 29 and name HD1 ) 3.9 2.1 1.39 assign (resid 28 and name HB# )(resid 29 and name HD2 ) 3.9 2.1 1.39 ! ! PRO 29 ! assign (resid 29 and name HA )(resid 29 and name HB1 ) 2.8 1 0.28 assign (resid 29 and name HA )(resid 29 and name HB2 ) 2.8 1 0.28 ! ! GLN 30 ! assign (resid 30 and name HN )(resid 30 and name HA ) 2.8 1 0.28 assign (resid 30 and name HN )(resid 30 and name HB1 ) 3.9 2.1 0.39 assign (resid 30 and name HN )(resid 30 and name HB2 ) 5.0 3.2 0.5 !! assign (resid 30 and name HN )(resid 29 and name HB1 ) 2.8 1 0.28 assign (resid 30 and name HN )(resid 29 and name HB2 ) 2.8 1 0.28 ! ! LEU 31 ! assign (resid 31 and name HN )(resid 31 and name HA ) 2.8 1 0.28 assign (resid 31 and name HN )(resid 31 and name HB# ) 2.8 1 1.28 !
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