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 |
|
|
23667 |
2jxf   |
15559 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!============================================================================ ! ! > SEQUENCE ! QTNWQKLEVFWAKHMWNFISGIQYLAGLST ! !============================================================================ ! <========== Q1 ==========> assign (resid 1 and name HA )(resid 2 and name HN ) 2.8 1.0 0.3 assign (resid 1 and name HB1 )(resid 2 and name HN ) 5.0 3.2 0.5 assign (resid 1 and name HB2 )(resid 2 and name HN ) 5.0 3.2 0.5 assign (resid 1 and name HG# )(resid 2 and name HN ) 6.0 4.2 0.6 assign (resid 1 and name HA )(resid 3 and name HN ) 5.0 3.2 0.5 ! <========== T2 ==========> assign (resid 2 and name HN )(resid 3 and name HN ) 6.0 4.2 0.6 assign (resid 2 and name HA )(resid 3 and name HN ) 2.8 1.0 0.3 assign (resid 2 and name HB )(resid 3 and name HN ) 2.8 1.0 0.3 assign (resid 2 and name HG2# )(resid 3 and name HN ) 3.9 2.1 0.4 assign (resid 2 and name HA )(resid 4 and name HN ) 6.0 4.2 0.6 assign (resid 2 and name HA )(resid 5 and name HB1 ) 6.0 4.2 0.6 assign (resid 2 and name HA )(resid 5 and name HG1 ) 6.0 4.2 0.6 assign (resid 2 and name HA )(resid 6 and name HN ) 6.0 4.2 0.6 ! <========== N3 ==========> assign (resid 3 and name HN )(resid 4 and name HN ) 3.9 2.1 0.4 assign (resid 3 and name HA )(resid 4 and name HN ) 2.8 1.0 0.3 assign (resid 3 and name HB# )(resid 4 and name HN ) 3.9 2.1 0.4 assign (resid 3 and name HN )(resid 5 and name HN ) 6.0 4.2 0.6 assign (resid 3 and name HA )(resid 5 and name HN ) 5.0 3.2 0.5 assign (resid 3 and name HA )(resid 6 and name HN ) 2.8 1.0 0.3 assign (resid 3 and name HA )(resid 6 and name HB1 ) 3.9 2.1 0.4 assign (resid 3 and name HA )(resid 6 and name HB2 ) 5.0 3.2 0.5 assign (resid 3 and name HA )(resid 6 and name HD# ) 3.9 2.1 1.4 ! <========== W4 ==========> assign (resid 4 and name HN )(resid 5 and name HN ) 2.8 1.0 0.3 assign (resid 4 and name HA )(resid 5 and name HN ) 3.9 2.1 0.4 assign (resid 4 and name HB2 )(resid 5 and name HN ) 3.9 2.1 0.4 assign (resid 4 and name HB1 )(resid 5 and name HN ) 2.8 1.0 0.3 assign (resid 4 and name HA )(resid 7 and name HN ) 2.8 1.0 0.3 assign (resid 4 and name HA )(resid 7 and name HB1 ) 3.9 2.1 0.4 assign (resid 4 and name HA )(resid 7 and name HB2 ) 2.8 1.0 0.3 assign (resid 4 and name HA )(resid 7 and name HD1# ) 3.9 2.1 2.4 assign (resid 4 and name HA )(resid 7 and name HD2# ) 5.0 3.2 2.5 assign (resid 4 and name HA )(resid 8 and name HN ) 5.0 3.2 0.5 ! <========== Q5 ==========> assign (resid 5 and name HN )(resid 6 and name HN ) 2.8 1.0 0.3 assign (resid 5 and name HB1 )(resid 6 and name HN ) 3.9 2.1 0.4 assign (resid 5 and name HB2 )(resid 6 and name HN ) 2.8 1.0 0.3 assign (resid 5 and name HG1 )(resid 6 and name HN ) 5.0 3.2 0.5 assign (resid 5 and name HA )(resid 8 and name HN ) 3.9 2.1 0.4 ! <========== K6 ==========> assign (resid 6 and name HA )(resid 9 and name HN ) 3.9 2.1 0.4 assign (resid 6 and name HA )(resid 9 and name HB ) 2.8 1.0 0.3 assign (resid 6 and name HA )(resid 10 and name HN ) 6.0 4.2 0.6 ! <========== L7 ==========> assign (resid 7 and name HN )(resid 8 and name HN ) 2.8 1.0 0.3 assign (resid 7 and name HB1 )(resid 8 and name HN ) 3.9 2.1 0.4 assign (resid 7 and name HB2 )(resid 8 and name HN ) 3.9 2.1 0.4 assign (resid 7 and name HD1# )(resid 8 and name HN ) 5.0 3.2 2.5 assign (resid 7 and name HN )(resid 9 and name HN ) 5.0 3.2 0.5 assign (resid 7 and name HA )(resid 10 and name HN ) 3.9 2.1 0.4 assign (resid 7 and name HA )(resid 10 and name HB1 ) 2.8 1.0 0.3 assign (resid 7 and name HA )(resid 10 and name HB2 ) 2.8 1.0 0.3 ! <========== E8 ==========> assign (resid 8 and name HN )(resid 9 and name HN ) 2.8 1.0 0.3 assign (resid 8 and name HA )(resid 9 and name HN ) 5.0 3.2 0.5 assign (resid 8 and name HB1 )(resid 9 and name HN ) 3.9 2.1 0.4 assign (resid 8 and name HB2 )(resid 9 and name HN ) 2.8 1.0 0.3 assign (resid 8 and name HG1 )(resid 9 and name HN ) 6.0 4.2 0.6 assign (resid 8 and name HG2 )(resid 9 and name HN ) 6.0 4.2 0.6 assign (resid 8 and name HN )(resid 10 and name HN ) 5.0 3.2 0.5 assign (resid 8 and name HA )(resid 11 and name HN ) 3.9 2.1 0.4 assign (resid 8 and name HA )(resid 11 and name HB1 ) 3.9 2.1 0.4 assign (resid 8 and name HA )(resid 11 and name HB2 ) 2.8 1.0 0.3 assign (resid 8 and name HA )(resid 12 and name HN ) 6.0 4.2 0.6 ! <========== V9 ==========> assign (resid 9 and name HN )(resid 10 and name HN ) 2.8 1.0 0.3 assign (resid 9 and name HA )(resid 10 and name HN ) 5.0 3.2 0.5 assign (resid 9 and name HB )(resid 10 and name HN ) 2.8 1.0 0.3 assign (resid 9 and name HG1# )(resid 10 and name HN ) 5.0 3.2 2.5 assign (resid 9 and name HG2# )(resid 10 and name HN ) 3.9 2.1 2.4 assign (resid 9 and name HN )(resid 11 and name HN ) 6.0 4.2 0.6 assign (resid 9 and name HA )(resid 11 and name HN ) 6.0 4.2 0.6 assign (resid 9 and name HA )(resid 12 and name HN ) 5.0 3.2 0.5 assign (resid 9 and name HA )(resid 12 and name HB# ) 2.8 1.0 2.3 assign (resid 9 and name HA )(resid 13 and name HN ) 6.0 4.2 0.6 ! <========== F10 ==========> assign (resid 10 and name HN )(resid 11 and name HN ) 3.9 2.1 0.4 assign (resid 10 and name HA )(resid 11 and name HN ) 5.0 3.2 0.5 assign (resid 10 and name HB1 )(resid 11 and name HN ) 3.9 2.1 0.4 assign (resid 10 and name HB2 )(resid 11 and name HN ) 5.0 3.2 0.5 assign (resid 10 and name HA )(resid 13 and name HN ) 3.9 2.1 0.4 assign (resid 10 and name HA )(resid 13 and name HB1 ) 3.9 2.1 0.4 assign (resid 10 and name HA )(resid 13 and name HB2 ) 3.9 2.1 0.4 assign (resid 10 and name HA )(resid 13 and name HG2 ) 6.0 4.2 0.6 assign (resid 10 and name HA )(resid 14 and name HN ) 5.0 3.2 0.5 ! <========== W11 ==========> assign (resid 11 and name HN )(resid 12 and name HN ) 3.9 2.1 0.4 assign (resid 11 and name HA )(resid 12 and name HN ) 5.0 3.2 0.5 assign (resid 11 and name HB1 )(resid 12 and name HN ) 3.9 2.1 0.4 assign (resid 11 and name HB2 )(resid 12 and name HN ) 5.0 3.2 0.5 assign (resid 11 and name HN )(resid 13 and name HN ) 6.0 4.2 0.6 assign (resid 11 and name HA )(resid 13 and name HN ) 5.0 3.2 0.5 assign (resid 11 and name HA )(resid 14 and name HN ) 5.0 3.2 0.5 assign (resid 11 and name HA )(resid 14 and name HB1 ) 3.9 2.1 0.4 assign (resid 11 and name HA )(resid 14 and name HB2 ) 3.9 2.1 0.4 assign (resid 11 and name HA )(resid 15 and name HN ) 5.0 3.2 0.5 ! <========== A12 ==========> assign (resid 12 and name HN )(resid 13 and name HN ) 3.9 2.1 0.4 assign (resid 12 and name HA )(resid 13 and name HN ) 3.9 2.1 0.4 assign (resid 12 and name HB# )(resid 13 and name HN ) 3.9 2.1 2.4 assign (resid 12 and name HN )(resid 14 and name HN ) 6.0 4.2 0.6 assign (resid 12 and name HA )(resid 14 and name HN ) 5.0 3.2 0.5 assign (resid 12 and name HA )(resid 15 and name HN ) 5.0 3.2 0.5 assign (resid 12 and name HA )(resid 15 and name HB1 ) 2.8 1.0 0.3 assign (resid 12 and name HA )(resid 15 and name HB2 ) 2.8 1.0 0.3 assign (resid 12 and name HA )(resid 16 and name HN ) 6.0 4.2 0.6 ! <========== K13 ==========> assign (resid 13 and name HN )(resid 14 and name HN ) 2.8 1.0 0.3 assign (resid 13 and name HA )(resid 14 and name HN ) 5.0 3.2 0.5 assign (resid 13 and name HB1 )(resid 14 and name HN ) 3.9 2.1 0.4 assign (resid 13 and name HB2 )(resid 14 and name HN ) 5.0 3.2 0.5 assign (resid 13 and name HG2 )(resid 14 and name HN ) 6.0 4.2 0.6 assign (resid 13 and name HA )(resid 15 and name HN ) 6.0 4.2 0.6 assign (resid 13 and name HA )(resid 16 and name HN ) 3.9 2.1 0.4 assign (resid 13 and name HA )(resid 16 and name HB1 ) 3.9 2.1 0.4 assign (resid 13 and name HA )(resid 16 and name HB2 ) 3.9 2.1 0.4 assign (resid 13 and name HA )(resid 17 and name HN ) 6.0 4.2 0.6 ! <========== H14 ==========> assign (resid 14 and name HN )(resid 15 and name HN ) 2.8 1.0 0.3 assign (resid 14 and name HA )(resid 15 and name HN ) 5.0 3.2 0.5 assign (resid 14 and name HB1 )(resid 15 and name HN ) 5.0 3.2 0.5 assign (resid 14 and name HB2 )(resid 15 and name HN ) 5.0 3.2 0.5 assign (resid 14 and name HA )(resid 16 and name HN ) 6.0 4.2 0.6 assign (resid 14 and name HA )(resid 17 and name HB1 ) 2.8 1.0 0.3 assign (resid 14 and name HA )(resid 17 and name HB2 ) 2.8 1.0 0.3 ! <========== M15 ==========> assign (resid 15 and name HN )(resid 16 and name HN ) 2.8 1.0 0.3 assign (resid 15 and name HA )(resid 16 and name HN ) 5.0 3.2 0.5 assign (resid 15 and name HB1 )(resid 16 and name HN ) 5.0 3.2 0.5 assign (resid 15 and name HB2 )(resid 16 and name HN ) 5.0 3.2 0.5 assign (resid 15 and name HG1 )(resid 16 and name HN ) 6.0 4.2 0.6 assign (resid 15 and name HG2 )(resid 16 and name HN ) 6.0 4.2 0.6 assign (resid 15 and name HN )(resid 17 and name HN ) 6.0 4.2 0.6 assign (resid 15 and name HA )(resid 17 and name HN ) 6.0 4.2 0.6 assign (resid 15 and name HA )(resid 18 and name HB1 ) 2.8 1.0 0.3 assign (resid 15 and name HA )(resid 18 and name HB2 ) 2.8 1.0 0.3 ! <========== W16 ==========> assign (resid 16 and name HN )(resid 17 and name HN ) 2.8 1.0 0.3 assign (resid 16 and name HA )(resid 17 and name HN ) 5.0 3.2 0.5 assign (resid 16 and name HB1 )(resid 17 and name HN ) 5.0 3.2 0.5 assign (resid 16 and name HB2 )(resid 17 and name HN ) 5.0 3.2 0.5 assign (resid 16 and name HA )(resid 18 and name HN ) 6.0 4.2 0.6 assign (resid 16 and name HA )(resid 19 and name HB ) 2.8 1.0 0.3 assign (resid 16 and name HA )(resid 19 and name HG11 ) 5.0 3.2 0.5 assign (resid 16 and name HA )(resid 19 and name HG12 ) 6.0 4.2 0.6 assign (resid 16 and name HA )(resid 20 and name HN ) 6.0 4.2 0.6 ! <========== N17 ==========> assign (resid 17 and name HN )(resid 18 and name HN ) 2.8 1.0 0.3 assign (resid 17 and name HA )(resid 18 and name HN ) 3.9 2.1 0.4 assign (resid 17 and name HB1 )(resid 18 and name HN ) 3.9 2.1 0.4 assign (resid 17 and name HB2 )(resid 18 and name HN ) 5.0 3.2 0.5 assign (resid 17 and name HA )(resid 19 and name HN ) 5.0 3.2 0.5 assign (resid 17 and name HA )(resid 20 and name HN ) 2.8 1.0 0.3 assign (resid 17 and name HA )(resid 20 and name HB1 ) 3.9 2.1 0.4 assign (resid 17 and name HA )(resid 20 and name HB2 ) 3.9 2.1 0.4 assign (resid 17 and name HA )(resid 21 and name HN ) 5.0 3.2 0.5 ! <========== F18 ==========> assign (resid 18 and name HN )(resid 19 and name HN ) 2.8 1.0 0.3 assign (resid 18 and name HA )(resid 19 and name HN ) 3.9 2.1 0.4 assign (resid 18 and name HB1 )(resid 19 and name HN ) 3.9 2.1 0.4 assign (resid 18 and name HB2 )(resid 19 and name HN ) 3.9 2.1 0.4 assign (resid 18 and name HA )(resid 20 and name HN ) 5.0 3.2 0.5 assign (resid 18 and name HA )(resid 21 and name HN ) 5.0 3.2 0.5 assign (resid 18 and name HA )(resid 22 and name HN ) 6.0 4.2 0.6 ! <========== I19 ==========> assign (resid 19 and name HN )(resid 20 and name HN ) 2.8 1.0 0.3 assign (resid 19 and name HA )(resid 20 and name HN ) 5.0 3.2 0.5 assign (resid 19 and name HB )(resid 20 and name HN ) 2.8 1.0 0.3 assign (resid 19 and name HG11 )(resid 20 and name HN ) 5.0 3.2 0.5 assign (resid 19 and name HG12 )(resid 20 and name HN ) 6.0 4.2 0.6 assign (resid 19 and name HN )(resid 21 and name HN ) 6.0 4.2 0.6 assign (resid 19 and name HA )(resid 21 and name HN ) 6.0 4.2 0.6 assign (resid 19 and name HA )(resid 22 and name HN ) 3.9 2.1 0.4 assign (resid 19 and name HA )(resid 22 and name HB ) 2.8 1.0 0.3 assign (resid 19 and name HA )(resid 22 and name HG12 ) 5.0 3.2 0.5 assign (resid 19 and name HA )(resid 22 and name HG2# ) 3.9 2.1 2.4 assign (resid 19 and name HA )(resid 22 and name HD# ) 3.9 2.1 2.4 assign (resid 19 and name HA )(resid 23 and name HN ) 5.0 3.2 0.5 ! <========== S20 ==========> assign (resid 20 and name HN )(resid 21 and name HN ) 2.8 1.0 0.3 assign (resid 20 and name HA )(resid 21 and name HN ) 3.9 2.1 0.4 assign (resid 20 and name HB1 )(resid 21 and name HN ) 5.0 3.2 0.5 assign (resid 20 and name HB2 )(resid 21 and name HN ) 5.0 3.2 0.5 assign (resid 20 and name HN )(resid 22 and name HN ) 5.0 3.2 0.5 assign (resid 20 and name HA )(resid 22 and name HN ) 5.0 3.2 0.5 assign (resid 20 and name HA )(resid 23 and name HN ) 3.9 2.1 0.4 assign (resid 20 and name HA )(resid 23 and name HB1 ) 2.8 1.0 0.3 assign (resid 20 and name HA )(resid 23 and name HB2 ) 3.9 2.1 0.4 assign (resid 20 and name HA )(resid 23 and name HG1 ) 5.0 3.2 0.5 assign (resid 20 and name HA )(resid 23 and name HG2 ) 3.9 2.1 0.4 assign (resid 20 and name HA )(resid 24 and name HN ) 5.0 3.2 0.5 ! <========== G21 ==========> assign (resid 21 and name HA# )(resid 22 and name HN ) 2.8 1.0 1.3 assign (resid 21 and name HN )(resid 23 and name HN ) 5.0 3.2 0.5 assign (resid 21 and name HA# )(resid 24 and name HN ) 3.9 2.1 1.4 assign (resid 21 and name HA# )(resid 24 and name HB1 ) 5.0 3.2 1.5 assign (resid 21 and name HA# )(resid 24 and name HB2 ) 5.0 3.2 1.5 assign (resid 21 and name HA# )(resid 25 and name HN ) 5.0 3.2 1.5 ! <========== I22 ==========> assign (resid 22 and name HN )(resid 23 and name HN ) 2.8 1.0 0.3 assign (resid 22 and name HA )(resid 23 and name HN ) 3.9 2.1 0.4 assign (resid 22 and name HB )(resid 23 and name HN ) 2.8 1.0 0.3 assign (resid 22 and name HG11 )(resid 23 and name HN ) 6.0 4.2 0.6 assign (resid 22 and name HG12 )(resid 23 and name HN ) 6.0 4.2 0.6 assign (resid 22 and name HG2# )(resid 23 and name HN ) 3.9 2.1 2.4 assign (resid 22 and name HD# )(resid 23 and name HN ) 6.0 4.2 2.6 assign (resid 22 and name HN )(resid 24 and name HN ) 5.0 3.2 0.5 assign (resid 22 and name HA )(resid 24 and name HN ) 5.0 3.2 0.5 assign (resid 22 and name HA )(resid 25 and name HN ) 3.9 2.1 0.4 assign (resid 22 and name HA )(resid 25 and name HB2 ) 3.9 2.1 0.4 assign (resid 22 and name HA )(resid 25 and name HD* ) 2.8 1.0 2.7 assign (resid 22 and name HA )(resid 26 and name HN ) 5.0 3.2 0.5 ! <========== Q23 ==========> assign (resid 23 and name HN )(resid 24 and name HN ) 2.8 1.0 0.3 assign (resid 23 and name HA )(resid 24 and name HN ) 2.8 1.0 0.3 assign (resid 23 and name HB1 )(resid 24 and name HN ) 3.9 2.1 0.4 assign (resid 23 and name HB2 )(resid 24 and name HN ) 5.0 3.2 0.5 assign (resid 23 and name HG1 )(resid 24 and name HN ) 6.0 4.2 0.6 assign (resid 23 and name HG2 )(resid 24 and name HN ) 5.0 3.2 0.5 assign (resid 23 and name HN )(resid 25 and name HN ) 5.0 3.2 0.5 assign (resid 23 and name HA )(resid 25 and name HN ) 5.0 3.2 0.5 assign (resid 23 and name HA )(resid 26 and name HN ) 3.9 2.1 0.4 assign (resid 23 and name HA )(resid 26 and name HB# ) 2.8 1.0 2.3 ! <========== Y24 ==========> assign (resid 24 and name HN )(resid 25 and name HN ) 2.8 1.0 0.3 assign (resid 24 and name HA )(resid 25 and name HN ) 5.0 3.2 0.5 assign (resid 24 and name HB2 )(resid 25 and name HN ) 3.9 2.1 0.4 assign (resid 24 and name HB1 )(resid 25 and name HN ) 3.9 2.1 0.4 assign (resid 24 and name HN )(resid 26 and name HN ) 6.0 4.2 0.6 assign (resid 24 and name HA )(resid 26 and name HN ) 6.0 4.2 0.6 assign (resid 24 and name HA )(resid 27 and name HN ) 5.0 3.2 0.5 ! <========== L25 ==========> assign (resid 25 and name HN )(resid 26 and name HN ) 2.8 1.0 0.3 assign (resid 25 and name HA )(resid 26 and name HN ) 3.9 2.1 0.4 assign (resid 25 and name HB1 )(resid 26 and name HN ) 2.8 1.0 0.3 assign (resid 25 and name HB2 )(resid 26 and name HN ) 3.9 2.1 0.4 assign (resid 25 and name HD* )(resid 26 and name HN ) 5.0 3.2 3.0 assign (resid 25 and name HN )(resid 27 and name HN ) 6.0 4.2 0.6 assign (resid 25 and name HA )(resid 27 and name HN ) 5.0 3.2 0.5 assign (resid 25 and name HA )(resid 28 and name HN ) 2.8 1.0 0.3 ! <========== A26 ==========> assign (resid 26 and name HN )(resid 27 and name HN ) 2.8 1.0 0.3 assign (resid 26 and name HA )(resid 27 and name HN ) 3.9 2.1 0.4 assign (resid 26 and name HB# )(resid 27 and name HN ) 2.8 1.0 2.3 assign (resid 26 and name HN )(resid 28 and name HN ) 6.0 4.2 0.6 assign (resid 26 and name HA )(resid 28 and name HN ) 6.0 4.2 0.6 assign (resid 26 and name HA )(resid 29 and name HN ) 5.0 3.2 0.5 ! <========== G27 ==========> assign (resid 27 and name HN )(resid 28 and name HN ) 2.8 1.0 0.3 assign (resid 27 and name HA# )(resid 28 and name HN ) 2.8 1.0 1.3 ! <========== L28 ==========> assign (resid 28 and name HN )(resid 29 and name HN ) 2.8 1.0 0.3 assign (resid 28 and name HA )(resid 29 and name HN ) 2.8 1.0 0.3 assign (resid 28 and name HB1 )(resid 29 and name HN ) 3.9 2.1 0.4 assign (resid 28 and name HB2 )(resid 29 and name HN ) 5.0 3.2 0.5 assign (resid 28 and name HG )(resid 29 and name HN ) 5.0 3.2 0.5 assign (resid 28 and name HD1# )(resid 29 and name HN ) 6.0 4.2 2.6 assign (resid 28 and name HD2# )(resid 29 and name HN ) 6.0 4.2 2.6 assign (resid 28 and name HA )(resid 30 and name HN ) 6.0 4.2 0.6 ! <========== S29 ==========> assign (resid 29 and name HB1 )(resid 30 and name HN ) 5.0 3.2 0.5 assign (resid 29 and name HB2 )(resid 30 and name HN ) 3.9 2.1 0.4 ! <========== T30 ==========> ! !contraintes chaines lat !========================================= ! assign (resid 19 and name HG2# )(resid 23 and name HE22 ) 5.0 3.2 2.5 assign (resid 19 and name HG2# )(resid 23 and name HE21 ) 3.9 2.1 2.4 assign (resid 24 and name HE* )(resid 25 and name HA ) 6.0 4.2 1.6 assign (resid 24 and name HE* )(resid 25 and name HG ) 6.0 4.2 1.6 assign (resid 24 and name HE* )(resid 25 and name HD* ) 3.9 2.1 3.8 assign (resid 24 and name HE* )(resid 28 and name HG ) 6.0 4.2 1.6 assign (resid 24 and name HE* )(resid 28 and name HD1# ) 2.8 1.0 3.3 assign (resid 24 and name HE* )(resid 28 and name HD2# ) 3.9 2.1 3.4 assign (resid 14 and name HD2 )(resid 15 and name HA ) 6.0 4.2 0.6 assign (resid 14 and name HD2 )(resid 15 and name HB1 ) 6.0 4.2 0.6 assign (resid 14 and name HD2 )(resid 15 and name HG2 ) 6.0 4.2 0.6 assign (resid 11 and name HZ3 )(resid 12 and name HA ) 6.0 4.2 0.6 assign (resid 10 and name HD* )(resid 11 and name HA ) 2.8 1.0 1.3 assign (resid 7 and name HA )(resid 10 and name HD* ) 2.8 1.0 1.3 assign (resid 7 and name HB1 )(resid 10 and name HD* ) 5.0 3.2 1.5 assign (resid 7 and name HG )(resid 10 and name HD* ) 5.0 3.2 1.5 assign (resid 9 and name HB )(resid 10 and name HD* ) 6.0 4.2 1.6 assign (resid 9 and name HG1# )(resid 10 and name HD* ) 6.0 4.2 3.6 assign (resid 9 and name HG2# )(resid 10 and name HD* ) 5.0 3.2 3.5 assign (resid 24 and name HD* )(resid 25 and name HA ) 3.9 2.1 1.4 assign (resid 24 and name HD* )(resid 25 and name HG ) 3.9 2.1 1.4 assign (resid 24 and name HD* )(resid 25 and name HD* ) 2.8 1.0 3.3 assign (resid 24 and name HD* )(resid 28 and name HG ) 6.0 4.2 1.6 assign (resid 24 and name HD* )(resid 28 and name HD1# ) 3.9 2.1 3.4 assign (resid 24 and name HD* )(resid 28 and name HD2# ) 5.0 3.2 3.5 assign (resid 16 and name HD1 )(resid 17 and name HA ) 5.0 3.2 0.5 assign (resid 13 and name HA )(resid 16 and name HD1 ) 5.0 3.2 0.5 assign (resid 12 and name HB# )(resid 16 and name HD1 ) 5.0 3.2 2.5 assign (resid 16 and name HD1 )(resid 19 and name HG2# ) 3.9 2.1 2.4 assign (resid 15 and name HE# )(resid 18 and name HD* ) 2.8 1.0 3.3 assign (resid 18 and name HD* )(resid 19 and name HA ) 5.0 3.2 1.5 assign (resid 18 and name HD* )(resid 19 and name HB ) 6.0 4.2 1.6 assign (resid 18 and name HD* )(resid 19 and name HG11 ) 5.0 3.2 1.5 assign (resid 18 and name HD* )(resid 19 and name HG12 ) 5.0 3.2 1.5 assign (resid 18 and name HD* )(resid 19 and name HD# ) 2.8 1.0 3.3 assign (resid 18 and name HD* )(resid 22 and name HG2# ) 5.0 3.2 3.5 assign (resid 18 and name HD* )(resid 22 and name HD# ) 3.9 2.1 3.4 assign (resid 8 and name HA )(resid 11 and name HD1 ) 5.0 3.2 0.5 assign (resid 11 and name HD1 )(resid 12 and name HA ) 6.0 4.2 0.6 assign (resid 7 and name HG )(resid 11 and name HD1 ) 3.9 2.1 0.4 assign (resid 7 and name HD1# )(resid 11 and name HD1 ) 3.9 2.1 2.4 assign (resid 7 and name HD2# )(resid 11 and name HD1 ) 3.9 2.1 2.4 assign (resid 15 and name HE# )(resid 18 and name HE* ) 5.0 3.2 3.5 assign (resid 18 and name HE* )(resid 22 and name HG11 ) 5.0 3.2 1.5 assign (resid 18 and name HE* )(resid 22 and name HG2# ) 5.0 3.2 3.5 assign (resid 18 and name HE* )(resid 22 and name HD# ) 2.8 1.0 3.3 assign (resid 2 and name HB )(resid 4 and name HD1 ) 5.0 3.2 0.5 assign (resid 2 and name HG2# )(resid 4 and name HD1 ) 6.0 4.2 2.6 assign (resid 7 and name HD1# )(resid 11 and name HZ2 ) 6.0 4.2 2.6 assign (resid 7 and name HD2# )(resid 11 and name HZ2 ) 5.0 3.2 2.5 assign (resid 15 and name HE# )(resid 11 and name HZ2 ) 3.9 2.1 2.4 assign (resid 2 and name HG2# )(resid 4 and name HZ2 ) 6.0 4.2 2.6 assign (resid 2 and name HG2# )(resid 4 and name HE3 ) 6.0 4.2 2.6 assign (resid 4 and name HE3 )(resid 7 and name HG ) 5.0 3.2 0.5 assign (resid 4 and name HE3 )(resid 7 and name HD1# ) 5.0 3.2 2.5 assign (resid 4 and name HE3 )(resid 7 and name HD2# ) 5.0 3.2 2.5 assign (resid 16 and name HE3 )(resid 17 and name HA ) 6.0 4.2 0.6 assign (resid 13 and name HA )(resid 16 and name HE3 ) 6.0 4.2 0.6 assign (resid 16 and name HE3 )(resid 19 and name HG2# ) 3.9 2.1 2.4 assign (resid 8 and name HA )(resid 11 and name HE3 ) 6.0 4.2 0.6 assign (resid 11 and name HE3 )(resid 12 and name HA ) 3.9 2.1 0.4 assign (resid 7 and name HD1# )(resid 11 and name HE1 ) 5.0 3.2 2.5 assign (resid 7 and name HD2# )(resid 11 and name HE1 ) 6.0 4.2 2.6 assign (resid 15 and name HE# )(resid 11 and name HE1 ) 5.0 3.2 2.5 assign (resid 2 and name HG2# )(resid 4 and name HE1 ) 6.0 4.2 2.6
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