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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456422 |
2kug   |
16764 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | simple |
Protein NOE restraints: assign (resid 2 and name H )(resid 2 and name HB2 ) 3.7 1.2 1.8 assign (resid 2 and name HA )(resid 2 and name HB1 ) 3.7 1.2 1.8 assign (resid 2 and name HA )(resid 2 and name HB2 ) 3.1 0.8 1.4 assign (resid 2 and name HA )(resid 3 and name H ) 3.3 1.2 1.6 assign (resid 2 and name H )(resid 4 and name HA ) 3.7 1.3 1.6 assign (resid 2 and name HB2 )(resid 4 and name H ) 3.9 1.2 2 assign (resid 3 and name H )(resid 3 and name HA ) 3.1 0.8 1.2 assign (resid 3 and name HA )(resid 3 and name HB1 ) 3.5 1.3 1.6 assign (resid 3 and name HA )(resid 3 and name HB2 ) 3.4 1.3 1.6 assign (resid 3 and name HA )(resid 3 and name HG2 ) 3.6 1.3 1.7 assign (resid 3 and name HB1 )(resid 3 and name HE21 ) 4.6 1.5 2.5 assign (resid 3 and name HB1 )(resid 3 and name HG1 ) 3.1 0.8 1.4 assign (resid 3 and name HB2 )(resid 3 and name HG2 ) 2.6 0.6 1.3 assign (resid 3 and name HG1 )(resid 3 and name HE21 ) 3.9 1.5 1.9 assign (resid 3 and name HB1 )(resid 4 and name H ) 3.8 1.2 2.3 assign (resid 3 and name HB2 )(resid 4 and name H ) 3.1 0.8 1.5 assign (resid 3 and name HG1 )(resid 4 and name H ) 3.9 1.2 2.5 assign (resid 3 and name HB2 )(resid 9 and name H ) 3.7 1.0 1.7 assign (resid 3 and name HB2 )(resid 9 and name HG2* ) 4.5 1.6 2.5 assign (resid 3 and name HA )(resid 73 and name HB* ) 4.5 1.6 2.5 assign (resid 4 and name H )(resid 4 and name HA ) 3.4 1.3 1.6 assign (resid 4 and name H )(resid 4 and name HB1 ) 3.7 1.3 1.7 assign (resid 4 and name H )(resid 4 and name HB2 ) 3.7 1.4 1.7 assign (resid 4 and name H )(resid 4 and name HD1* ) 3.7 1.2 1.8 assign (resid 4 and name H )(resid 4 and name HD2* ) 3.9 1.2 1.9 assign (resid 4 and name HA )(resid 4 and name HD1* ) 3.5 1.2 1.7 assign (resid 4 and name HA )(resid 4 and name HD2* ) 4.1 1.3 2.1 assign (resid 4 and name HA )(resid 4 and name HG ) 3.9 1.3 1.8 assign (resid 4 and name HB2 )(resid 4 and name HD1* ) 3.9 1.2 2 assign (resid 4 and name HB2 )(resid 4 and name HD2* ) 4.1 1.3 2.1 assign (resid 4 and name HG )(resid 4 and name HD1* ) 3.4 1.3 1.6 assign (resid 4 and name HG )(resid 4 and name HD2* ) 3.5 1.3 1.6 assign (resid 4 and name H )(resid 5 and name H ) 3.8 1.1 1.9 assign (resid 4 and name HA )(resid 5 and name H ) 3.1 0.9 1.2 assign (resid 4 and name HD1* )(resid 5 and name H ) 3.6 1.3 1.8 assign (resid 4 and name HD1* )(resid 8 and name H ) 4.2 1.3 2.2 assign (resid 4 and name HG )(resid 8 and name HA ) 3.9 1.3 2.0 assign (resid 4 and name HB1 )(resid 9 and name H ) 3.9 1.3 2.0 assign (resid 4 and name HB2 )(resid 9 and name H ) 3.9 1.2 2.0 assign (resid 4 and name HD2* )(resid 73 and name HA ) 4.6 1.5 3 assign (resid 5 and name H )(resid 5 and name HA ) 3.3 1.1 1.2 assign (resid 5 and name HB )(resid 5 and name HG2* ) 3.2 1.0 1.1 assign (resid 5 and name HA )(resid 6 and name H ) 3.5 1.3 1.4 assign (resid 5 and name HA )(resid 6 and name HG1 ) 4.3 1.3 2.3 assign (resid 5 and name HA )(resid 6 and name HG2 ) 3.9 1.2 2.5 assign (resid 5 and name HG2* )(resid 6 and name H ) 3.8 1.1 1.9 assign (resid 5 and name HA )(resid 7 and name H ) 3.7 1.2 1.9 assign (resid 5 and name HB )(resid 7 and name H ) 3.5 1.3 1.7 assign (resid 5 and name HG2* )(resid 7 and name H ) 3.8 1.1 1.9 assign (resid 5 and name HG2* )(resid 8 and name H ) 4.1 1.3 2.2 assign (resid 6 and name H )(resid 6 and name HA ) 3.8 1.1 1.8 assign (resid 6 and name H )(resid 6 and name HG2 ) 3.8 1.1 1.8 assign (resid 6 and name HB2 )(resid 6 and name HG1 ) 2.3 0.3 0.9 assign (resid 6 and name HB2 )(resid 6 and name HG2 ) 2.2 0.2 0.8 assign (resid 6 and name H )(resid 7 and name H ) 3.1 0.8 1.5 assign (resid 6 and name H )(resid 7 and name HB2 ) 3.6 1.3 1.8 assign (resid 6 and name HB1 )(resid 7 and name H ) 3.1 0.8 1.5 assign (resid 6 and name HA )(resid 9 and name HD1* ) 4.0 1.3 2.0 assign (resid 6 and name HG1 )(resid 9 and name HD1* ) 4.3 1.3 2.3 assign (resid 7 and name H )(resid 7 and name HA ) 3.5 1.3 1.6 assign (resid 7 and name H )(resid 7 and name HB1 ) 3.2 0.9 1.4 assign (resid 7 and name H )(resid 7 and name HG1 ) 3.3 1.1 1.5 assign (resid 7 and name H )(resid 7 and name HG2 ) 3.3 1.1 1.5 assign (resid 7 and name HB1 )(resid 7 and name HG1 ) 2.4 0.4 1.4 assign (resid 7 and name H )(resid 8 and name H ) 2.8 0.7 1.3 assign (resid 7 and name H )(resid 8 and name HB2 ) 4.1 1.3 2.2 assign (resid 7 and name HB1 )(resid 8 and name HB2 ) 3.3 0.9 1.6 assign (resid 7 and name HA )(resid 9 and name H ) 3.3 0.9 1.6 assign (resid 7 and name HA )(resid 10 and name HB* ) 3.8 1.1 1.9 assign (resid 8 and name H )(resid 8 and name HA ) 3.1 0.8 1.4 assign (resid 8 and name H )(resid 8 and name HB2 ) 3.4 1.3 1.6 assign (resid 8 and name H )(resid 9 and name H ) 3.2 0.9 1.5 assign (resid 8 and name HA )(resid 10 and name HB* ) 4.1 1.3 2.2 assign (resid 8 and name HA )(resid 11 and name H ) 3.1 0.8 1.5 assign (resid 8 and name HE21 )(resid 11 and name HG1 ) 4.3 1.3 2.3 assign (resid 9 and name H )(resid 9 and name HA ) 3.3 0.9 1.5 assign (resid 9 and name H )(resid 9 and name HB ) 3.3 1.0 1.5 assign (resid 9 and name H )(resid 9 and name HD1* ) 3.9 1.2 1.9 assign (resid 9 and name H )(resid 9 and name HG2* ) 4.5 1.5 2.3 assign (resid 9 and name HA )(resid 9 and name HD1* ) 4.5 1.4 2.4 assign (resid 9 and name HA )(resid 9 and name HG2* ) 4.0 1.4 2.1 assign (resid 9 and name HB )(resid 9 and name HD1* ) 3.5 1.1 1.6 assign (resid 9 and name HB )(resid 9 and name HG2* ) 3.9 1.3 2.0 assign (resid 9 and name HG2* )(resid 9 and name HD1* ) 3.5 1.2 1.6 assign (resid 9 and name H )(resid 10 and name H ) 3 0.8 1.4 assign (resid 9 and name HA )(resid 10 and name H ) 4.3 1.3 2.3 assign (resid 9 and name HB )(resid 10 and name H ) 3.6 1.2 1.9 assign (resid 9 and name HD1* )(resid 10 and name H ) 4.2 1.4 2.2 assign (resid 9 and name HG2* )(resid 10 and name H ) 4.2 1.3 2.3 assign (resid 9 and name HA )(resid 12 and name H ) 4.5 1.4 2.5 assign (resid 9 and name HA )(resid 12 and name HE2 ) 4.0 1.1 2.0 assign (resid 9 and name HA )(resid 13 and name HB2 ) 3.7 1.2 2.4 assign (resid 9 and name HG2* )(resid 13 and name H ) 4.2 1.4 2.2 assign (resid 9 and name HG2* )(resid 65 and name HE1 ) 4.2 1.4 2.2 assign (resid 9 and name HA )(resid 69 and name HD1* ) 4.2 1.4 2.2 assign (resid 9 and name HD1* )(resid 69 and name HD1* ) 3.7 0.9 2.1 assign (resid 9 and name HG2* )(resid 69 and name HD1* ) 4.1 1.4 2.1 assign (resid 10 and name H )(resid 10 and name HA ) 3.3 1.0 1.4 assign (resid 10 and name H )(resid 10 and name HB* ) 3.5 1.1 1.7 assign (resid 10 and name HA )(resid 10 and name HB* ) 3.2 1.0 1.3 assign (resid 10 and name HA )(resid 11 and name HB2 ) 3.7 1.3 1.9 assign (resid 10 and name HB* )(resid 11 and name H ) 3.5 1.2 1.6 assign (resid 10 and name HB* )(resid 11 and name HA ) 4.3 1.3 2.3 assign (resid 10 and name H )(resid 12 and name H ) 3.7 1.2 1.9 assign (resid 10 and name HA )(resid 13 and name H ) 3.5 1.3 1.5 assign (resid 10 and name HA )(resid 13 and name HD1 ) 4.2 1.3 2.3 assign (resid 10 and name HB* )(resid 13 and name H ) 3.7 1.2 1.9 assign (resid 10 and name HB* )(resid 14 and name HG1 ) 4.1 1.4 2.1 assign (resid 11 and name H )(resid 12 and name H ) 2.9 0.8 1.3 assign (resid 11 and name HB2 )(resid 12 and name H ) 3.2 0.9 1.4 assign (resid 11 and name HA )(resid 13 and name HD2 ) 4.3 1.2 2.3 assign (resid 11 and name HA )(resid 14 and name H ) 2.7 0.7 1.2 assign (resid 11 and name HA )(resid 14 and name HB2 ) 2.6 0.6 1.2 assign (resid 11 and name HA )(resid 14 and name HG1 ) 2.7 0.7 1.2 assign (resid 11 and name HB2 )(resid 14 and name H ) 3.5 0.9 1.6 assign (resid 11 and name HG1 )(resid 14 and name H ) 3.4 0.8 1.5 assign (resid 12 and name H )(resid 12 and name HA ) 4.2 1.3 2.2 assign (resid 12 and name H )(resid 12 and name HD2 ) 3.7 1.1 1.8 assign (resid 12 and name H )(resid 12 and name HE2 ) 4 1.2 2 assign (resid 12 and name HA )(resid 12 and name HB2 ) 4.1 1.3 2.1 assign (resid 12 and name HA )(resid 12 and name HD1 ) 3.3 1.2 1.4 assign (resid 12 and name H )(resid 13 and name H ) 3.0 0.8 1.5 assign (resid 12 and name HA )(resid 15 and name H ) 4.4 1.4 2.4 assign (resid 12 and name HA )(resid 15 and name HB* ) 4.1 1.4 2.1 assign (resid 12 and name HD1 )(resid 15 and name H ) 4.1 1.3 2.2 assign (resid 12 and name HE1 )(resid 15 and name HB* ) 3.7 1.2 1.9 assign (resid 12 and name HD2 )(resid 65 and name HE1 ) 3.5 1.1 2.1 assign (resid 12 and name H )(resid 69 and name HD1* ) 4.6 1.5 2.5 assign (resid 12 and name HD2 )(resid 69 and name HD2* ) 4.1 1.5 2.6 assign (resid 12 and name HE2 )(resid 69 and name HD1* ) 4.1 1.1 2.2 assign (resid 12 and name HE2 )(resid 69 and name HG ) 3.7 1.3 1.8 assign (resid 12 and name HE1 )(resid 72 and name HE* ) 3.5 1.3 1.6 assign (resid 13 and name H )(resid 13 and name HA ) 3.0 1.3 1.1 assign (resid 13 and name H )(resid 13 and name HB2 ) 3.1 0.9 1.0 assign (resid 13 and name H )(resid 13 and name HG1 ) 4.2 1.3 2.2 assign (resid 13 and name HA )(resid 13 and name HD1 ) 4.3 1.3 2.2 assign (resid 13 and name HB2 )(resid 13 and name HD1 ) 3.6 1.3 1.7 assign (resid 13 and name HB2 )(resid 13 and name HG1 ) 3.5 1.3 1.6 assign (resid 13 and name HD2 )(resid 13 and name HE1 ) 3.3 1.3 1.4 assign (resid 13 and name HG1 )(resid 13 and name HD1 ) 3.3 0.9 1.5 assign (resid 13 and name HG1 )(resid 13 and name HD2 ) 3.3 1.3 1.5 assign (resid 13 and name H )(resid 14 and name H ) 3.0 0.8 1.4 assign (resid 13 and name H )(resid 15 and name H ) 4.4 1.4 2.4 assign (resid 13 and name HB2 )(resid 68 and name HD1 ) 4.3 1.3 2.9 assign (resid 13 and name H )(resid 69 and name HD1* ) 4.2 1.3 2.9 assign (resid 14 and name H )(resid 14 and name HA ) 2.9 0.8 1.4 assign (resid 14 and name HA )(resid 17 and name H ) 3.3 0.9 1.6 assign (resid 15 and name H )(resid 15 and name HA ) 3.3 0.9 1.5 assign (resid 15 and name H )(resid 15 and name HB* ) 3.0 0.8 1.0 assign (resid 15 and name HA )(resid 15 and name HB* ) 3.8 1.2 1.8 assign (resid 15 and name H )(resid 16 and name H ) 3.2 0.9 1.5 assign (resid 15 and name HB* )(resid 16 and name H ) 3.7 1.2 1.7 assign (resid 15 and name HA )(resid 18 and name H ) 4.1 1.3 2.2 assign (resid 15 and name HA )(resid 18 and name HD1* ) 3.7 1.4 1.7 assign (resid 15 and name HA )(resid 18 and name HD2* ) 4.5 1.4 2.5 assign (resid 15 and name HB* )(resid 18 and name HD1* ) 3.8 1.1 1.9 assign (resid 15 and name HA )(resid 19 and name HD2 ) 4.0 1.3 2.1 assign (resid 15 and name HB* )(resid 68 and name HE1 ) 3.6 1.3 2.4 assign (resid 16 and name H )(resid 16 and name HA ) 3.1 0.9 1.0 assign (resid 16 and name H )(resid 16 and name HD2 ) 4.1 1.3 2.1 assign (resid 16 and name HA )(resid 16 and name HD2 ) 3.2 1.1 1.3 assign (resid 16 and name HB2 )(resid 16 and name HD2 ) 3.9 1.2 1.9 assign (resid 16 and name HA )(resid 17 and name H ) 3.2 1.0 1.3 assign (resid 16 and name HA )(resid 17 and name HB1 ) 4.4 1.4 2.4 assign (resid 16 and name H )(resid 18 and name H ) 4.1 1.3 2.1 assign (resid 16 and name HA )(resid 19 and name HD2 ) 3.6 1.3 1.6 assign (resid 16 and name HA )(resid 19 and name HE2 ) 3.3 1.1 1.4 assign (resid 16 and name HD2 )(resid 19 and name HD2 ) 3.3 1.2 1.6 assign (resid 16 and name HE2 )(resid 19 and name HD2 ) 3.2 0.9 1.3 assign (resid 16 and name HA )(resid 27 and name HD1* ) 4.1 1.3 2.2 assign (resid 16 and name HD2 )(resid 27 and name HD1* ) 4.2 1.3 2.5 assign (resid 16 and name HB1 )(resid 65 and name HE1 ) 4.4 1.4 3 assign (resid 16 and name HA )(resid 68 and name HE1 ) 3.7 1.1 2.5 assign (resid 16 and name HD2 )(resid 68 and name HD1 ) 2.8 0.8 1.9 assign (resid 16 and name HE2 )(resid 68 and name HB2 ) 3.9 1.1 1.9 assign (resid 17 and name H )(resid 17 and name HB1 ) 3.0 0.9 1.0 assign (resid 17 and name HA )(resid 17 and name HB1 ) 3.3 1.1 1.4 assign (resid 17 and name H )(resid 18 and name H ) 3.2 0.9 1.5 assign (resid 18 and name H )(resid 18 and name HA ) 2.8 0.6 0.9 assign (resid 18 and name H )(resid 18 and name HB1 ) 3.9 1.2 1.8 assign (resid 18 and name H )(resid 18 and name HB2 ) 3.0 0.8 0.9 assign (resid 18 and name H )(resid 18 and name HD1* ) 3.9 1.2 1.9 assign (resid 18 and name H )(resid 18 and name HD2* ) 4.1 1.3 2.1 assign (resid 18 and name HA )(resid 18 and name HB1 ) 3.8 1.1 1.8 assign (resid 18 and name HA )(resid 18 and name HB2 ) 3.6 1.1 1.8 assign (resid 18 and name HA )(resid 18 and name HD1* ) 4.3 1.3 2.2 assign (resid 18 and name HA )(resid 18 and name HD2* ) 3.8 1.4 1.7 assign (resid 18 and name HB2 )(resid 18 and name HD2* ) 4.1 1.3 2.1 assign (resid 18 and name H )(resid 19 and name H ) 3.1 0.8 1.5 assign (resid 18 and name HB1 )(resid 19 and name H ) 4.3 1.3 2.3 assign (resid 18 and name HB2 )(resid 19 and name H ) 4.5 1.5 2.7 assign (resid 18 and name H )(resid 20 and name H ) 3.5 1.3 1.7 assign (resid 18 and name HD2* )(resid 39 and name HD1* ) 4.4 1.5 2.4 assign (resid 19 and name H )(resid 19 and name HA ) 2.9 0.7 1.1 assign (resid 19 and name HA )(resid 19 and name HB1 ) 2.6 0.4 0.9 assign (resid 19 and name HB1 )(resid 19 and name HD1 ) 3.7 1.2 1.9 assign (resid 19 and name HB1 )(resid 19 and name HE1 ) 4.1 1.3 2.1 assign (resid 19 and name H )(resid 20 and name H ) 2.9 0.4 0.9 assign (resid 19 and name HA )(resid 20 and name H ) 3.5 1.3 1.0 assign (resid 19 and name H )(resid 21 and name HA ) 4.3 1.3 2.3 assign (resid 19 and name HD2 )(resid 27 and name HD1* ) 3.7 1.3 2.0 assign (resid 19 and name HE2 )(resid 27 and name HG2* ) 4.4 1.4 2.5 assign (resid 19 and name HB1 )(resid 28 and name H ) 3.8 1.1 2.1 assign (resid 19 and name HD1 )(resid 32 and name HA ) 3.7 1.4 1.8 assign (resid 19 and name HE1 )(resid 32 and name HA ) 4.3 1.5 2.3 assign (resid 19 and name HD1 )(resid 35 and name HG2* ) 3.8 1.1 2.2 assign (resid 19 and name HE1 )(resid 35 and name HB ) 3.6 1.3 2.1 assign (resid 19 and name HE1 )(resid 35 and name HG1* ) 3.5 1.2 2.5 assign (resid 19 and name HE1 )(resid 35 and name HG2* ) 3.8 1.1 1.4 assign (resid 19 and name HZ )(resid 36 and name H ) 4.3 1.5 2.3 assign (resid 19 and name HZ )(resid 36 and name HA ) 4.3 1.5 2.3 assign (resid 19 and name HE1 )(resid 36 and name HE* ) 3.9 1.2 2.3 assign (resid 19 and name HE1 )(resid 39 and name HD2* ) 3.9 1.3 2.1 assign (resid 19 and name HZ )(resid 68 and name HD2 ) 3.7 1.2 1.6 assign (resid 20 and name H )(resid 20 and name HA ) 3.0 0.5 0.7 assign (resid 20 and name H )(resid 20 and name HB1 ) 3.2 1.0 1.0 assign (resid 20 and name HA )(resid 21 and name H ) 2.7 0.4 0.6 assign (resid 20 and name H )(resid 27 and name HD1* ) 4.3 1.4 2.1 assign (resid 20 and name HA )(resid 27 and name HD1* ) 4.6 1.9 2.6 assign (resid 21 and name H )(resid 21 and name HA ) 2.6 0.4 0.6 assign (resid 21 and name H )(resid 21 and name HB1 ) 3.1 0.9 1.4 assign (resid 21 and name H )(resid 21 and name HD1 ) 3.4 1.3 1.6 assign (resid 21 and name HA )(resid 21 and name HB1 ) 2.8 0.7 1.0 assign (resid 21 and name HA )(resid 21 and name HD1 ) 3.5 1.3 1.6 assign (resid 21 and name HA )(resid 22 and name H ) 3.5 1.3 1.2 assign (resid 21 and name HE1 )(resid 23 and name H ) 3.8 1.1 1.9 assign (resid 21 and name H )(resid 31 and name HG1 ) 4.1 1.2 2.1 assign (resid 21 and name HE2 )(resid 34 and name HG2* ) 4.3 1.5 2.5 assign (resid 22 and name H )(resid 22 and name HA ) 2.9 0.6 1.0 assign (resid 22 and name HA )(resid 22 and name HB1 ) 2.8 0.6 1.0 assign (resid 22 and name HA )(resid 22 and name HB2 ) 2.9 0.7 1.0 assign (resid 22 and name H )(resid 23 and name H ) 2.5 0.3 0.4 assign (resid 22 and name HA )(resid 23 and name HA1 ) 4.2 1.3 2.1 assign (resid 22 and name H )(resid 24 and name H ) 3.1 0.8 1.5 assign (resid 22 and name HB2 )(resid 24 and name HA ) 3.4 1.2 1.5 assign (resid 23 and name H )(resid 24 and name H ) 2.6 0.5 0.6 assign (resid 24 and name H )(resid 24 and name HB2 ) 3.7 1.1 1.6 assign (resid 24 and name HA )(resid 24 and name HB1 ) 3.7 1.1 1.6 assign (resid 24 and name HA )(resid 24 and name HB2 ) 2.7 0.5 0.7 assign (resid 24 and name H )(resid 25 and name H ) 2.6 0.4 0.5 assign (resid 24 and name H )(resid 26 and name H ) 3.1 0.8 1.5 assign (resid 25 and name H )(resid 25 and name HA1 ) 2.9 0.7 1.0 assign (resid 25 and name H )(resid 25 and name HA2 ) 2.9 0.7 1.0 assign (resid 25 and name H )(resid 26 and name H ) 2.6 0.5 0.6 assign (resid 25 and name HA1 )(resid 26 and name H ) 3.2 0.9 1.0 assign (resid 25 and name HA2 )(resid 26 and name H ) 3.0 0.7 0.9 assign (resid 26 and name H )(resid 26 and name HA ) 4.2 1.3 2.2 assign (resid 26 and name H )(resid 26 and name HB ) 3.8 1.2 1.4 assign (resid 26 and name H )(resid 26 and name HG2* ) 3.5 1.3 1.7 assign (resid 26 and name HA )(resid 26 and name HB ) 3.9 1.3 1.6 assign (resid 26 and name HA )(resid 26 and name HG2* ) 3.8 1.2 1.4 assign (resid 26 and name HB )(resid 26 and name HG2* ) 3.2 1.0 1.5 assign (resid 26 and name HA )(resid 27 and name H ) 3.2 1.0 1.4 assign (resid 26 and name HB )(resid 27 and name H ) 3.8 1.3 1.5 assign (resid 26 and name HG2* )(resid 27 and name H ) 4.9 1.6 2.9 assign (resid 26 and name HB )(resid 62 and name HB ) 3.9 1.3 1.7 assign (resid 26 and name HB )(resid 63 and name H ) 4.4 1.4 2.4 assign (resid 27 and name H )(resid 27 and name HD1* ) 4.5 1.6 2.5 assign (resid 27 and name H )(resid 27 and name HG2* ) 4.6 1.5 2.5 assign (resid 27 and name HA )(resid 27 and name HG2* ) 3.9 1.0 1.9 assign (resid 27 and name HB )(resid 27 and name HG12 ) 3.4 1.3 1.6 assign (resid 27 and name HB )(resid 27 and name HG2* ) 3.9 1.7 2.0 assign (resid 27 and name HG2* )(resid 27 and name HD1* ) 4.0 1.3 2.0 assign (resid 27 and name HA )(resid 28 and name H ) 3.5 1.4 1.9 assign (resid 27 and name HG2* )(resid 28 and name H ) 4.1 1.3 2.2 assign (resid 27 and name HG2* )(resid 28 and name HG2* ) 5.6 2.3 3 assign (resid 27 and name HG2* )(resid 31 and name H ) 4.1 1.3 2.3 assign (resid 27 and name HG2* )(resid 32 and name H ) 4.1 1.2 2.3 assign (resid 27 and name HG2* )(resid 32 and name HA ) 3.7 1.1 1.6 assign (resid 27 and name HG2* )(resid 32 and name HB2 ) 4.0 1.3 2.0 assign (resid 27 and name HG2* )(resid 34 and name HB ) 4.8 1.6 2.9 assign (resid 27 and name HG2* )(resid 35 and name HB ) 4.7 1.5 2.8 assign (resid 27 and name HB )(resid 52 and name HD1* ) 3.7 1.0 1.6 assign (resid 27 and name H )(resid 63 and name H ) 3.8 1.2 1.7 assign (resid 27 and name HD1* )(resid 63 and name HG2* ) 4.0 1.2 2.0 assign (resid 27 and name HG2* )(resid 63 and name HB ) 3.9 1.1 1.8 assign (resid 27 and name HD1* )(resid 68 and name HD2 ) 3.8 1.1 1.7 assign (resid 27 and name HD1* )(resid 68 and name HE2 ) 4.0 1.2 2.0 assign (resid 28 and name H )(resid 28 and name HG2* ) 3.9 1.3 1.8 assign (resid 28 and name HA )(resid 28 and name HG2* ) 3.0 0.7 1.0 assign (resid 28 and name HA )(resid 29 and name H ) 2.5 0.3 0.5 assign (resid 28 and name HG2* )(resid 29 and name H ) 3.5 1.3 1.7 assign (resid 28 and name HG2* )(resid 30 and name H ) 3.8 1.1 1.9 assign (resid 28 and name H )(resid 31 and name H ) 3.7 1.1 1.9 assign (resid 28 and name HA )(resid 62 and name HG2* ) 4.1 1.3 2.0 assign (resid 28 and name HA )(resid 63 and name H ) 3.9 1.2 2.4 assign (resid 29 and name H )(resid 29 and name HA ) 3.0 0.8 1.4 assign (resid 29 and name H )(resid 29 and name HB ) 3.6 1.3 1.5 assign (resid 29 and name HA )(resid 29 and name HB ) 3.4 1.3 1.4 assign (resid 29 and name HB )(resid 29 and name HG2* ) 3.4 1.3 1.4 assign (resid 29 and name H )(resid 30 and name H ) 3.1 0.7 1.1 assign (resid 29 and name HA )(resid 32 and name H ) 4.3 1.5 2.2 assign (resid 29 and name HA )(resid 32 and name HD2* ) 4.5 1.4 2.5 assign (resid 29 and name HG2* )(resid 49 and name H ) 3.9 1.2 2.3 assign (resid 29 and name HG2* )(resid 49 and name HA ) 3.5 1.1 1.5 assign (resid 29 and name HG2* )(resid 49 and name HB2 ) 4.4 1.4 2.7 assign (resid 29 and name HG2* )(resid 49 and name HG2 ) 4.4 1.4 2.7 assign (resid 29 and name H )(resid 52 and name HD1* ) 4.0 1.4 2.0 assign (resid 29 and name HA )(resid 52 and name HD1* ) 3.9 1.3 1.9 assign (resid 29 and name HG2* )(resid 52 and name H ) 4.8 1.5 2.8 assign (resid 29 and name HG2* )(resid 52 and name HD1* ) 3.9 1.2 1.8 assign (resid 30 and name H )(resid 30 and name HA ) 2.9 0.6 0.8 assign (resid 30 and name H )(resid 30 and name HB1 ) 2.9 0.6 0.8 assign (resid 30 and name H )(resid 30 and name HG1 ) 3.9 1.3 1.9 assign (resid 30 and name HA )(resid 30 and name HB1 ) 3.4 1 1.6 assign (resid 30 and name HA )(resid 30 and name HD1 ) 3.5 1.3 1.6 assign (resid 30 and name HA )(resid 30 and name HE2 ) 3.8 1.5 1.7 assign (resid 30 and name HB2 )(resid 30 and name HG1 ) 3.3 0.9 1.5 assign (resid 30 and name HD2 )(resid 30 and name HE2 ) 2.8 0.7 1.2 assign (resid 30 and name HG1 )(resid 30 and name HD2 ) 2.4 0.3 0.5 assign (resid 30 and name HG1 )(resid 30 and name HE2 ) 2.9 0.7 1.0 assign (resid 30 and name HB1 )(resid 31 and name H ) 3.1 0.8 1.5 assign (resid 30 and name HD1 )(resid 45 and name HG2 ) 3.7 1.2 2.1 assign (resid 30 and name HA )(resid 48 and name HD1* ) 4.1 1.3 2.5 assign (resid 30 and name HA )(resid 48 and name HG ) 3.7 1.4 2.2 assign (resid 30 and name HE2 )(resid 48 and name HD1* ) 4.2 1.3 2.6 assign (resid 30 and name HE2 )(resid 48 and name HG ) 3.5 1.3 2.0 assign (resid 31 and name H )(resid 31 and name HG1 ) 3.0 0.8 1.0 assign (resid 31 and name H )(resid 32 and name H ) 3.1 0.8 1.0 assign (resid 31 and name HA )(resid 32 and name H ) 3.1 0.8 1.0 assign (resid 31 and name H )(resid 33 and name H ) 4.0 1.4 2.0 assign (resid 31 and name HA )(resid 33 and name H ) 3.2 0.9 1.1 assign (resid 32 and name H )(resid 32 and name HB1 ) 2.9 0.6 0.8 assign (resid 32 and name HA )(resid 32 and name HD2* ) 3.9 1.2 1.9 assign (resid 32 and name HB2 )(resid 32 and name HD2* ) 3.9 1.2 1.9 assign (resid 32 and name HB1 )(resid 33 and name H ) 3.6 1.2 1.5 assign (resid 32 and name HD2* )(resid 33 and name HA2 ) 4.7 1.5 2.7 assign (resid 32 and name HA )(resid 35 and name H ) 4.0 1.2 2.0 assign (resid 32 and name HA )(resid 35 and name HB ) 3.5 1.3 1.5 assign (resid 32 and name HA )(resid 36 and name HB2 ) 3.6 1.1 1.6 assign (resid 32 and name HA )(resid 36 and name HE* ) 3.9 1.2 2.1 assign (resid 32 and name HD2* )(resid 36 and name HG2 ) 4.0 1.5 2.3 assign (resid 32 and name HD1* )(resid 48 and name HG ) 4.1 1.3 2.1 assign (resid 32 and name HD2* )(resid 48 and name HG ) 4.0 1.3 2.2 assign (resid 32 and name HD1* )(resid 48 and name HA ) 3.6 1.2 2.7 assign (resid 32 and name HB2 )(resid 51 and name H ) 4.1 1.3 2.5 assign (resid 32 and name HD1* )(resid 51 and name H ) 4.0 1.2 2.0 assign (resid 32 and name HD1* )(resid 51 and name HB2 ) 3.8 1.3 1.9 assign (resid 32 and name HD1* )(resid 51 and name HE* ) 4.5 1.3 2.5 assign (resid 32 and name HD1* )(resid 51 and name HG2 ) 4.5 1.5 2.9 assign (resid 32 and name HD2* )(resid 51 and name HG1 ) 4.6 1.5 2.9 assign (resid 32 and name HD2* )(resid 52 and name HD1* ) 4.2 1.3 2.3 assign (resid 33 and name H )(resid 33 and name HA1 ) 3.2 1.0 1.2 assign (resid 33 and name H )(resid 33 and name HA2 ) 3.0 0.7 0.9 assign (resid 33 and name H )(resid 34 and name H ) 2.9 0.6 0.8 assign (resid 33 and name HA1 )(resid 48 and name HD1* ) 3.5 1.2 1.6 assign (resid 33 and name HA2 )(resid 48 and name HD2* ) 4.5 1.5 2.7 assign (resid 34 and name H )(resid 34 and name HA ) 2.7 0.5 0.6 assign (resid 34 and name H )(resid 34 and name HB ) 2.7 0.5 0.6 assign (resid 34 and name H )(resid 34 and name HG2* ) 3.6 1.3 1.7 assign (resid 34 and name HA )(resid 34 and name HG2* ) 3.3 1.0 1.4 assign (resid 34 and name HB )(resid 34 and name HG2* ) 2.8 0.6 0.9 assign (resid 34 and name H )(resid 35 and name H ) 3.0 0.8 1.0 assign (resid 34 and name H )(resid 35 and name HA ) 4.1 1.3 2.2 assign (resid 34 and name HA )(resid 35 and name H ) 4.8 1.6 2.8 assign (resid 34 and name HB )(resid 35 and name H ) 3.2 1.1 1.2 assign (resid 34 and name HG2* )(resid 35 and name H ) 3.9 1.2 2.5 assign (resid 34 and name HG2* )(resid 35 and name HG2* ) 4.9 2.0 2.7 assign (resid 34 and name HA )(resid 37 and name H ) 4.0 1.3 2.0 assign (resid 34 and name HB )(resid 38 and name H ) 3.8 1.2 1.8 assign (resid 34 and name H )(resid 48 and name HD1* ) 4.8 1.6 3 assign (resid 35 and name H )(resid 35 and name HA ) 3.3 1.1 1.2 assign (resid 35 and name H )(resid 35 and name HB ) 2.8 0.6 0.7 assign (resid 35 and name H )(resid 35 and name HG2* ) 3.5 1.3 1.6 assign (resid 35 and name HA )(resid 35 and name HG2* ) 3.5 1.3 1.6 assign (resid 35 and name HB )(resid 35 and name HG1* ) 3.4 1.2 1.6 assign (resid 35 and name HB )(resid 35 and name HG2* ) 3.1 0.9 1.1 assign (resid 35 and name H )(resid 36 and name H ) 3.2 0.8 1.2 assign (resid 35 and name HG1* )(resid 36 and name HE* ) 3.6 1.3 1.8 assign (resid 35 and name HG2* )(resid 36 and name H ) 4.6 1.5 2.6 assign (resid 35 and name HG2* )(resid 36 and name HE* ) 4.8 1.6 2.8 assign (resid 35 and name HB )(resid 38 and name H ) 3.5 0.9 1.7 assign (resid 35 and name HG1* )(resid 38 and name H ) 3.9 1.1 1.9 assign (resid 35 and name HG2* )(resid 38 and name H ) 4.0 1.2 2.0 assign (resid 35 and name HA )(resid 39 and name HD2* ) 4.1 1.3 2.2 assign (resid 35 and name HG2* )(resid 39 and name HD1* ) 4.5 1.1 2.5 assign (resid 35 and name HG1* )(resid 68 and name HE2 ) 3.9 1.1 2.1 assign (resid 36 and name H )(resid 36 and name HA ) 3.1 1.1 1.1 assign (resid 36 and name H )(resid 36 and name HE* ) 4.0 1.3 2.0 assign (resid 36 and name H )(resid 36 and name HG2 ) 3.9 1.5 1.9 assign (resid 36 and name HG2 )(resid 36 and name HE* ) 4.1 1.3 2.1 assign (resid 36 and name H )(resid 37 and name HB2 ) 3.6 1.3 1.8 assign (resid 36 and name HA )(resid 37 and name H ) 2.9 0.8 1.3 assign (resid 36 and name H )(resid 39 and name HD2* ) 4.2 1.3 2.3 assign (resid 36 and name HE* )(resid 41 and name HB2 ) 4.2 1.4 2.2 assign (resid 36 and name HG2 )(resid 41 and name HB2 ) 3.9 1.1 2.0 assign (resid 36 and name HB1 )(resid 43 and name HA ) 3.8 1.1 2.0 assign (resid 36 and name HG1 )(resid 51 and name HG2 ) 3.3 1.3 1.4 assign (resid 36 and name HG1 )(resid 51 and name HE* ) 3.8 1.3 2.0 assign (resid 36 and name HG2 )(resid 51 and name HG1 ) 3.5 1.1 1.6 assign (resid 36 and name HE* )(resid 68 and name HE2 ) 4.1 1.5 2.1 assign (resid 36 and name HE* )(resid 71 and name HE* ) 4.3 1.5 2.3 assign (resid 36 and name HE* )(resid 72 and name HE* ) 4.4 1.4 2.9 assign (resid 37 and name H )(resid 37 and name HA ) 3.9 1.2 1.9 assign (resid 37 and name H )(resid 37 and name HD2 ) 4.1 1.3 2.1 assign (resid 37 and name HA )(resid 37 and name HB2 ) 3.5 1.1 1.6 assign (resid 37 and name H )(resid 38 and name H ) 2.6 0.5 0.6 assign (resid 37 and name HD1 )(resid 38 and name H ) 4.4 1.4 2.5 assign (resid 37 and name HD2 )(resid 41 and name HB2 ) 3.3 1.1 1.5 assign (resid 37 and name H )(resid 43 and name HB1 ) 3.6 1.2 1.7 assign (resid 37 and name HD2 )(resid 43 and name HB1 ) 3.7 1.1 2 assign (resid 38 and name H )(resid 38 and name HB1 ) 3.3 0.9 1.2 assign (resid 38 and name H )(resid 38 and name HB2 ) 3.1 0.9 1.1 assign (resid 38 and name HA )(resid 39 and name HD1* ) 4.9 1.6 2.9 assign (resid 38 and name HB1 )(resid 39 and name HA ) 4.1 1.3 2.2 assign (resid 39 and name HA )(resid 39 and name HD1* ) 3.8 1.1 1.8 assign (resid 39 and name HA )(resid 39 and name HD2* ) 3.3 1.3 1.4 assign (resid 39 and name HG )(resid 39 and name HD1* ) 2.8 0.6 0.9 assign (resid 39 and name HG )(resid 39 and name HD2* ) 2.8 0.6 0.9 assign (resid 39 and name H )(resid 40 and name H ) 3.0 0.8 1.0 assign (resid 39 and name HD2* )(resid 40 and name H ) 4.0 1.2 2 assign (resid 39 and name HA )(resid 41 and name HG2 ) 3.9 1.2 1.8 assign (resid 39 and name HB2 )(resid 41 and name H ) 4.1 1.3 2.1 assign (resid 39 and name HD2* )(resid 72 and name HE* ) 4.1 1.3 2.6 assign (resid 40 and name H )(resid 40 and name HA1 ) 2.5 0.3 0.5 assign (resid 40 and name H )(resid 40 and name HA2 ) 3.2 0.9 1.4 assign (resid 40 and name HA2 )(resid 41 and name H ) 3.6 1.1 1.6 assign (resid 41 and name H )(resid 41 and name HA ) 3.0 0.7 1.0 assign (resid 41 and name H )(resid 41 and name HG2 ) 3.4 1.2 1.6 assign (resid 41 and name HB2 )(resid 41 and name HG1 ) 3.5 1.3 1.6 assign (resid 41 and name HA )(resid 42 and name H ) 3.3 1.0 1.2 assign (resid 41 and name HB2 )(resid 42 and name HA ) 4.5 1.5 2.4 assign (resid 42 and name H )(resid 42 and name HB1 ) 4.0 1.3 2.0 assign (resid 42 and name H )(resid 42 and name HB2 ) 4.0 1.4 2.0 assign (resid 42 and name HA )(resid 42 and name HB1 ) 3.9 1.3 1.8 assign (resid 42 and name HA )(resid 42 and name HB2 ) 3.9 1.3 1.8 assign (resid 42 and name HB1 )(resid 42 and name HD21 ) 2.9 0.7 0.8 assign (resid 42 and name HB1 )(resid 42 and name HD22 ) 3.7 1.4 1.6 assign (resid 42 and name HB2 )(resid 42 and name HD21 ) 2.9 0.7 0.8 assign (resid 42 and name HB2 )(resid 42 and name HD22 ) 3.5 1.3 1.6 assign (resid 42 and name HA )(resid 43 and name HD1 ) 3.6 1.3 2.0 assign (resid 42 and name HA )(resid 43 and name HD2 ) 3.6 1.3 2.0 assign (resid 43 and name HG2 )(resid 43 and name HD2 ) 3.8 1.3 1.8 assign (resid 43 and name HA )(resid 44 and name H ) 2.6 0.4 0.7 assign (resid 43 and name HA )(resid 47 and name HB2 ) 3.8 1.1 2.6 assign (resid 43 and name HB1 )(resid 47 and name HA ) 3.7 0.9 1.8 assign (resid 43 and name HB2 )(resid 51 and name HG1 ) 4.0 1.1 2.0 assign (resid 43 and name HB2 )(resid 51 and name HG2 ) 3.5 1.3 1.8 assign (resid 44 and name H )(resid 44 and name HG2* ) 3.2 0.8 1.4 assign (resid 44 and name HA )(resid 44 and name HG2* ) 3.1 0.8 1.2 assign (resid 44 and name HA )(resid 45 and name H ) 3.2 0.9 1.5 assign (resid 44 and name HB )(resid 45 and name H ) 3.5 1.3 1.7 assign (resid 44 and name HG2* )(resid 45 and name HB2 ) 4.1 1.3 2.2 assign (resid 44 and name HG2* )(resid 45 and name HG1 ) 4.2 1.3 2.3 assign (resid 44 and name H )(resid 47 and name H ) 3.3 0.9 1.4 assign (resid 44 and name H )(resid 47 and name HG1 ) 3.1 1.0 1.6 assign (resid 45 and name H )(resid 45 and name HA ) 3.0 0.7 1.0 assign (resid 45 and name H )(resid 45 and name HB2 ) 2.6 0.4 0.5 assign (resid 45 and name H )(resid 45 and name HG1 ) 2.8 0.6 0.7 assign (resid 45 and name H )(resid 46 and name H ) 2.9 0.7 0.8 assign (resid 45 and name HB2 )(resid 46 and name H ) 3.1 0.8 1.5 assign (resid 45 and name HG1 )(resid 46 and name H ) 3.3 0.9 1.5 assign (resid 46 and name H )(resid 46 and name HA ) 3.4 1.3 1.6 assign (resid 46 and name H )(resid 46 and name HB* ) 2.9 0.8 1.2 assign (resid 46 and name HA )(resid 46 and name HB* ) 3.1 0.6 1.0 assign (resid 46 and name H )(resid 47 and name H ) 2.8 0.6 0.7 assign (resid 46 and name HB* )(resid 47 and name H ) 3.2 0.9 1.2 assign (resid 47 and name H )(resid 47 and name HG2 ) 3.0 0.7 0.8 assign (resid 47 and name HA )(resid 47 and name HB2 ) 3.0 0.8 1.0 assign (resid 47 and name H )(resid 48 and name H ) 2.9 0.7 0.9 assign (resid 47 and name HA )(resid 48 and name H ) 3.4 1.1 1.6 assign (resid 47 and name HB1 )(resid 48 and name H ) 3.6 1.2 1.7 assign (resid 47 and name HB2 )(resid 48 and name HD1* ) 3.8 1.2 2.4 assign (resid 47 and name HA )(resid 50 and name HB1 ) 3.8 1.1 1.9 assign (resid 47 and name HA )(resid 51 and name HE* ) 3.6 1.3 1.9 assign (resid 47 and name HB1 )(resid 51 and name HA ) 3.6 1.3 1.9 assign (resid 48 and name H )(resid 48 and name HD1* ) 3.5 1.2 1.6 assign (resid 48 and name HB1 )(resid 48 and name HD1* ) 3.6 1.3 1.6 assign (resid 48 and name HG )(resid 48 and name HD1* ) 2.9 0.6 0.7 assign (resid 48 and name H )(resid 49 and name HB1 ) 3.3 0.9 1.6 assign (resid 49 and name H )(resid 49 and name HA ) 3.0 0.7 0.9 assign (resid 49 and name H )(resid 49 and name HG2 ) 3.8 1.1 1.8 assign (resid 49 and name HA )(resid 49 and name HB1 ) 3.3 0.9 1.5 assign (resid 49 and name HA )(resid 49 and name HG1 ) 3.3 1.0 1.2 assign (resid 49 and name HA )(resid 49 and name HG2 ) 3.3 1.0 1.5 assign (resid 49 and name HB1 )(resid 49 and name HE21 ) 3.3 1.0 1.6 assign (resid 49 and name HB2 )(resid 49 and name HG2 ) 2.7 0.5 0.7 assign (resid 49 and name HG2 )(resid 49 and name HE22 ) 3.7 1.1 1.8 assign (resid 49 and name HA )(resid 50 and name H ) 3.6 1.1 1.7 assign (resid 49 and name HB1 )(resid 50 and name H ) 2.6 0.3 0.7 assign (resid 49 and name H )(resid 51 and name H ) 3.6 0.9 1.6 assign (resid 49 and name H )(resid 51 and name HG2 ) 4.2 1.3 2.2 assign (resid 49 and name H )(resid 52 and name HG11 ) 4.1 1.3 2.2 assign (resid 49 and name HE21 )(resid 52 and name HG2* ) 4.2 1.3 2.3 assign (resid 49 and name H )(resid 53 and name H ) 4.2 1.3 2.4 assign (resid 49 and name HG2 )(resid 53 and name HD21 ) 3.9 1.2 2.5 assign (resid 50 and name H )(resid 50 and name HA ) 2.8 0.6 0.7 assign (resid 50 and name H )(resid 50 and name HB1 ) 2.9 0.8 0.9 assign (resid 50 and name H )(resid 50 and name HB2 ) 2.5 0.3 0.5 assign (resid 50 and name HA )(resid 50 and name HB1 ) 3.5 1.3 1.6 assign (resid 50 and name HA )(resid 50 and name HB2 ) 3.6 1.3 1.7 assign (resid 50 and name H )(resid 51 and name H ) 2.7 0.5 0.6 assign (resid 50 and name HB2 )(resid 51 and name HA ) 3.7 1.1 1.9 assign (resid 50 and name HA )(resid 53 and name H ) 4.1 1.3 2.2 assign (resid 50 and name HA )(resid 53 and name HB1 ) 3.6 1.3 1.8 assign (resid 50 and name HA )(resid 53 and name HD22 ) 3.9 1.2 2 assign (resid 51 and name H )(resid 51 and name HA ) 2.8 0.6 0.7 assign (resid 51 and name H )(resid 51 and name HE* ) 3.6 1.2 1.7 assign (resid 51 and name H )(resid 51 and name HG1 ) 3.2 1.0 1.3 assign (resid 51 and name H )(resid 51 and name HG2 ) 3.7 1.2 1.8 assign (resid 51 and name HA )(resid 51 and name HB1 ) 3.2 0.9 1.4 assign (resid 51 and name HA )(resid 51 and name HB2 ) 3.5 1.3 1.6 assign (resid 51 and name HA )(resid 51 and name HE* ) 3.2 1.0 1.3 assign (resid 51 and name HA )(resid 51 and name HG1 ) 3.7 1.1 1.8 assign (resid 51 and name HG1 )(resid 51 and name HE* ) 3.8 1.2 1.8 assign (resid 51 and name HG2 )(resid 51 and name HE* ) 3.3 1.1 1.4 assign (resid 51 and name H )(resid 54 and name H ) 3.6 1.3 1.8 assign (resid 51 and name HA )(resid 54 and name HG2 ) 2.9 0.8 1.3 assign (resid 51 and name HE* )(resid 54 and name HG1 ) 3.7 1.3 1.8 assign (resid 51 and name HE* )(resid 54 and name HG2 ) 4.7 1.5 2.7 assign (resid 52 and name H )(resid 52 and name HA ) 3.4 1.2 1.2 assign (resid 52 and name H )(resid 52 and name HB ) 2.5 0.3 0.4 assign (resid 52 and name H )(resid 52 and name HD1* ) 4.1 1.3 2.1 assign (resid 52 and name H )(resid 52 and name HG11 ) 3.6 1.2 1.5 assign (resid 52 and name H )(resid 52 and name HG12 ) 3.0 0.7 0.8 assign (resid 52 and name HA )(resid 52 and name HD1* ) 4.0 1.3 2.0 assign (resid 52 and name HA )(resid 52 and name HG2* ) 3.4 1.2 1.4 assign (resid 52 and name HA )(resid 52 and name HG12 ) 3.3 1.2 1.2 assign (resid 52 and name HA )(resid 52 and name HG2* ) 4.1 1.3 2.1 assign (resid 52 and name HB )(resid 52 and name HD1* ) 4.2 1.3 2.2 assign (resid 52 and name HB )(resid 52 and name HG2* ) 3.8 1.3 2.0 assign (resid 52 and name H )(resid 53 and name H ) 3.1 0.8 1.1 assign (resid 52 and name HB )(resid 53 and name H ) 2.8 0.6 0.7 assign (resid 52 and name HG12 )(resid 53 and name H ) 3.6 1.3 1.8 assign (resid 52 and name HG2* )(resid 53 and name H ) 4.0 1.3 2.0 assign (resid 52 and name HA )(resid 55 and name HG1* ) 4.5 1.4 2.5 assign (resid 52 and name HG2* )(resid 56 and name HB2 ) 3.5 1.2 1.6 assign (resid 52 and name HD1* )(resid 62 and name HG2* ) 4.0 1.3 2.0 assign (resid 52 and name HG2* )(resid 62 and name H ) 3.9 1.2 2.2 assign (resid 52 and name H )(resid 63 and name HD1* ) 4.3 1.3 2.3 assign (resid 52 and name H )(resid 63 and name HG11 ) 4.3 1.3 2.5 assign (resid 52 and name HA )(resid 63 and name HG11 ) 3.9 1.3 1.8 assign (resid 52 and name HA )(resid 63 and name HG2* ) 4.6 1.5 2.6 assign (resid 52 and name HG11 )(resid 63 and name HG12 ) 3.3 0.9 1.8 assign (resid 52 and name HG2* )(resid 63 and name H ) 4.5 1.5 2.4 assign (resid 53 and name H )(resid 53 and name HB1 ) 3.7 1.1 1.8 assign (resid 53 and name H )(resid 53 and name HB2 ) 2.8 0.6 0.7 assign (resid 53 and name HA )(resid 53 and name HB1 ) 3.6 1.3 1.7 assign (resid 53 and name HA )(resid 53 and name HB2 ) 3.7 1.3 1.8 assign (resid 53 and name HB1 )(resid 53 and name HD21 ) 4.0 1.5 2.1 assign (resid 53 and name HB1 )(resid 53 and name HD22 ) 3.6 1.3 1.7 assign (resid 53 and name HB2 )(resid 53 and name HD21 ) 4.0 1.3 2.0 assign (resid 53 and name HB2 )(resid 53 and name HD22 ) 3.8 1.1 1.8 assign (resid 53 and name H )(resid 54 and name H ) 2.9 0.6 0.7 assign (resid 53 and name HA )(resid 54 and name H ) 3.9 1.2 2.5 assign (resid 53 and name HB1 )(resid 54 and name H ) 3.3 1.0 1.2 assign (resid 53 and name HB2 )(resid 54 and name H ) 4.0 1.1 2.0 assign (resid 53 and name HD22 )(resid 54 and name HA ) 3.9 1.2 2.5 assign (resid 53 and name HA )(resid 55 and name H ) 4.5 1.4 2.5 assign (resid 53 and name HA )(resid 56 and name H ) 3.4 1.2 1.5 assign (resid 53 and name HD22 )(resid 56 and name HB2 ) 4.3 1.3 2.3 assign (resid 53 and name HA )(resid 60 and name H ) 4.2 1.6 2.5 assign (resid 53 and name HA )(resid 63 and name HD1* ) 4.2 1.3 2.5 assign (resid 54 and name H )(resid 54 and name HA ) 2.9 0.6 0.7 assign (resid 54 and name H )(resid 54 and name HB1 ) 3.4 1.3 1.6 assign (resid 54 and name H )(resid 54 and name HB2 ) 3.3 0.9 1.5 assign (resid 54 and name H )(resid 54 and name HG1 ) 3.0 0.8 1.0 assign (resid 54 and name H )(resid 54 and name HG2 ) 3.5 1.2 1.8 assign (resid 54 and name HA )(resid 54 and name HG1 ) 2.8 0.7 1.2 assign (resid 54 and name HA )(resid 54 and name HG2 ) 2.8 0.7 1.2 assign (resid 54 and name H )(resid 55 and name H ) 2.9 0.7 1.5 assign (resid 54 and name H )(resid 55 and name HG1* ) 4.3 1.3 2.3 assign (resid 54 and name HB2 )(resid 55 and name H ) 4.3 1.3 2.3 assign (resid 54 and name HG1 )(resid 55 and name HG2* ) 3.7 1.2 1.9 assign (resid 54 and name HG2 )(resid 63 and name HD1* ) 4.5 1.5 2.5 assign (resid 55 and name H )(resid 55 and name HG1* ) 3.6 1.2 1.7 assign (resid 55 and name HA )(resid 55 and name HB ) 3.6 1.1 1.7 assign (resid 55 and name HA )(resid 55 and name HG1* ) 4.0 1.3 2.0 assign (resid 55 and name HA )(resid 55 and name HG2* ) 4.0 1.3 2.0 assign (resid 55 and name HB )(resid 55 and name HG1* ) 3.6 1.2 1.6 assign (resid 55 and name HB )(resid 55 and name HG2* ) 3.7 1.1 1.8 assign (resid 55 and name H )(resid 56 and name H ) 2.7 0.5 0.6 assign (resid 55 and name HG2* )(resid 56 and name HA ) 4.3 1.3 2.3 assign (resid 55 and name H )(resid 63 and name HD1* ) 3.6 1.3 1.5 assign (resid 55 and name HG2* )(resid 63 and name HD1* ) 3.8 1.1 1.7 assign (resid 55 and name HG2* )(resid 67 and name HB1 ) 3.8 1.1 2.1 assign (resid 55 and name HG2* )(resid 68 and name HA ) 4.2 1.4 2.2 assign (resid 55 and name HB )(resid 71 and name HB2 ) 3.1 0.8 1.8 assign (resid 55 and name HG1* )(resid 71 and name HE* ) 4.5 1.4 2.5 assign (resid 55 and name HG1* )(resid 71 and name HG1 ) 3.9 1.3 1.8 assign (resid 55 and name HG1* )(resid 72 and name H ) 4.7 1.6 2.5 assign (resid 55 and name HG1* )(resid 74 and name HG1 ) 3.8 1.3 1.6 assign (resid 56 and name H )(resid 56 and name HA ) 3.3 1.1 1.4 assign (resid 56 and name HA )(resid 57 and name H ) 2.5 0.3 0.4 assign (resid 56 and name HA )(resid 57 and name HB* ) 5.1 1.7 3 assign (resid 56 and name HB1 )(resid 57 and name H ) 3.8 1.1 1.8 assign (resid 56 and name HB2 )(resid 57 and name H ) 3.9 1.2 1.9 assign (resid 56 and name HA )(resid 59 and name H ) 3.4 1.0 1.6 assign (resid 57 and name H )(resid 57 and name HA ) 2.9 0.5 0.7 assign (resid 57 and name H )(resid 57 and name HB* ) 3.2 0.9 1.2 assign (resid 57 and name HA )(resid 57 and name HB* ) 3.5 1.3 1.6 assign (resid 57 and name H )(resid 58 and name H ) 2.5 0.3 0.4 assign (resid 57 and name HA )(resid 58 and name H ) 3.5 1.1 1.5 assign (resid 57 and name HB* )(resid 58 and name H ) 3.5 1.3 1.7 assign (resid 57 and name H )(resid 59 and name H ) 3.5 1.3 1.7 assign (resid 57 and name HB* )(resid 59 and name H ) 4.2 1.3 2.3 assign (resid 57 and name H )(resid 63 and name HD1* ) 4.3 1.3 2.4 assign (resid 58 and name H )(resid 58 and name HB1 ) 3.3 0.9 1.4 assign (resid 58 and name H )(resid 58 and name HB2 ) 3.7 1.1 1.8 assign (resid 58 and name H )(resid 59 and name HA2 ) 4.1 1.3 2.2 assign (resid 58 and name HA )(resid 60 and name HB1 ) 3.7 1.1 1.9 assign (resid 58 and name H )(resid 67 and name HG1 ) 3.5 1.3 1.9 assign (resid 59 and name H )(resid 59 and name HA1 ) 2.5 0.3 0.5 assign (resid 59 and name H )(resid 59 and name HA2 ) 3.0 0.7 1.0 assign (resid 59 and name HA1 )(resid 60 and name H ) 4.4 1.4 2.4 assign (resid 60 and name H )(resid 60 and name HA ) 2.9 0.6 0.7 assign (resid 60 and name H )(resid 60 and name HB1 ) 2.9 0.6 0.7 assign (resid 60 and name H )(resid 60 and name HB2 ) 3.6 1.3 1.7 assign (resid 60 and name H )(resid 61 and name H ) 2.7 0.4 0.5 assign (resid 61 and name H )(resid 61 and name HA1 ) 3.0 0.7 0.9 assign (resid 61 and name H )(resid 61 and name HA2 ) 3.0 0.7 0.9 assign (resid 61 and name H )(resid 62 and name H ) 2.6 0.6 1.2 assign (resid 61 and name HA1 )(resid 62 and name H ) 3.0 0.7 1.0 assign (resid 61 and name HA2 )(resid 62 and name H ) 3.5 1.2 1.5 assign (resid 62 and name H )(resid 62 and name HB ) 4.0 1.3 2.0 assign (resid 62 and name H )(resid 62 and name HG2* ) 3.8 1.1 1.8 assign (resid 62 and name HA )(resid 62 and name HB ) 4.1 1.4 2.6 assign (resid 62 and name HB )(resid 62 and name HG2* ) 3.8 1.4 1.8 assign (resid 62 and name H )(resid 63 and name H ) 3.7 1.1 1.9 assign (resid 62 and name HB )(resid 63 and name H ) 3.2 1.0 1.2 assign (resid 62 and name HG2* )(resid 63 and name H ) 4.1 1.3 2.2 assign (resid 63 and name H )(resid 63 and name HA ) 3.5 1.3 1.5 assign (resid 63 and name H )(resid 63 and name HD1* ) 4.2 1.3 2.2 assign (resid 63 and name H )(resid 63 and name HG2* ) 3.8 1.1 1.8 assign (resid 63 and name HA )(resid 63 and name HD1* ) 4.4 1.3 2.4 assign (resid 63 and name HB )(resid 63 and name HG2* ) 3.8 1.3 2.0 assign (resid 63 and name HG11 )(resid 63 and name HD1* ) 3.7 1.2 1.8 assign (resid 63 and name HG12 )(resid 63 and name HD1* ) 4.0 1.5 2.0 assign (resid 63 and name HG2* )(resid 64 and name H ) 3.8 1.2 1.5 assign (resid 63 and name HD1* )(resid 67 and name HA ) 4.4 1.4 2.5 assign (resid 63 and name HD1* )(resid 67 and name HB1 ) 3.9 1.2 2.1 assign (resid 63 and name HD1* )(resid 67 and name HG1 ) 4.3 1.3 2.4 assign (resid 63 and name HD1* )(resid 67 and name HG2 ) 4.3 1.3 2.4 assign (resid 63 and name HG2* )(resid 68 and name H ) 3.7 1.1 1.8 assign (resid 63 and name HG2* )(resid 68 and name HA ) 3.8 1.3 1.6 assign (resid 63 and name HG2* )(resid 68 and name HD2 ) 4.0 1.3 2.0 assign (resid 64 and name HA )(resid 64 and name HB1 ) 3.9 1.4 2.0 assign (resid 64 and name HA )(resid 65 and name H ) 3.4 1.1 1.3 assign (resid 65 and name HA )(resid 65 and name HE1 ) 3.6 1.2 1.7 assign (resid 65 and name H )(resid 66 and name HD1 ) 3.7 1.4 1.8 assign (resid 65 and name HE1 )(resid 68 and name HE1 ) 3.0 0.7 1.2 assign (resid 65 and name HD1 )(resid 69 and name H ) 4.1 1.3 2.3 assign (resid 66 and name HA )(resid 66 and name HG2 ) 3.7 1.1 1.8 assign (resid 66 and name HB1 )(resid 67 and name H ) 3.2 0.9 1.5 assign (resid 66 and name HA )(resid 69 and name HD2* ) 4.4 1.4 2.4 assign (resid 67 and name H )(resid 67 and name HG2 ) 3.1 0.8 1.4 assign (resid 67 and name HG1 )(resid 70 and name HG2* ) 4.4 1.4 2.3 assign (resid 68 and name H )(resid 68 and name HA ) 3.2 1.1 1.4 assign (resid 68 and name H )(resid 68 and name HB1 ) 3.3 1.0 1.4 assign (resid 68 and name HA )(resid 68 and name HB1 ) 3.3 1.0 1.4 assign (resid 68 and name HA )(resid 68 and name HD2 ) 3.3 1.0 1.4 assign (resid 68 and name HB1 )(resid 68 and name HD1 ) 3.0 0.7 1.0 assign (resid 68 and name H )(resid 69 and name H ) 2.9 0.6 0.7 assign (resid 68 and name HA )(resid 69 and name HA ) 3.5 1.3 1.7 assign (resid 68 and name HA )(resid 71 and name HE* ) 4.1 1.4 2.0 assign (resid 68 and name HD2 )(resid 71 and name HE* ) 4.3 1.4 2.0 assign (resid 68 and name HE2 )(resid 71 and name HE* ) 3.5 1.2 1.6 assign (resid 68 and name HE2 )(resid 72 and name HE* ) 3.6 1.3 1.9 assign (resid 69 and name H )(resid 69 and name HA ) 2.9 0.5 0.8 assign (resid 69 and name H )(resid 69 and name HB1 ) 4.0 1.3 2.0 assign (resid 69 and name H )(resid 69 and name HB2 ) 3.7 1.4 2.0 assign (resid 69 and name H )(resid 69 and name HD1* ) 4.5 1.5 2.0 assign (resid 69 and name H )(resid 69 and name HD2* ) 4.5 1.4 2.0 assign (resid 69 and name HA )(resid 69 and name HB2 ) 3.8 1.3 1.8 assign (resid 69 and name HA )(resid 69 and name HD1* ) 4.1 1.4 2.0 assign (resid 69 and name HA )(resid 69 and name HD2* ) 4.4 1.4 2.0 assign (resid 69 and name HB1 )(resid 69 and name HD1* ) 4.3 1.3 2.2 assign (resid 69 and name HB1 )(resid 69 and name HD2* ) 3.6 1.3 1.6 assign (resid 69 and name HB2 )(resid 69 and name HD2* ) 3.5 1.3 1.5 assign (resid 69 and name HG )(resid 69 and name HD2* ) 3.1 1.2 1.2 assign (resid 69 and name H )(resid 70 and name H ) 3.1 1.0 1.2 assign (resid 69 and name HB1 )(resid 70 and name H ) 3.3 1.0 1.3 assign (resid 69 and name HG )(resid 72 and name HA ) 3.9 1.2 2.0 assign (resid 70 and name H )(resid 70 and name HA ) 3.0 0.6 0.7 assign (resid 70 and name H )(resid 70 and name HB ) 3.6 1.3 1.7 assign (resid 70 and name HA )(resid 70 and name HG2* ) 3.5 1.3 1.5 assign (resid 70 and name H )(resid 72 and name H ) 3.2 0.9 1.5 assign (resid 70 and name HA )(resid 73 and name HB* ) 4.6 1.5 2.0 assign (resid 71 and name HG1 )(resid 71 and name HE* ) 3.7 1.3 1.8 assign (resid 71 and name HG2 )(resid 71 and name HE* ) 4.0 1.4 2.0 assign (resid 71 and name HE* )(resid 75 and name HG1 ) 3.9 1.3 2.1 assign (resid 72 and name H )(resid 72 and name HA ) 3.1 0.8 1.0 assign (resid 72 and name HA )(resid 72 and name HE* ) 3.8 1.5 1.8 assign (resid 72 and name H )(resid 73 and name H ) 2.9 0.6 0.7 assign (resid 72 and name HA )(resid 73 and name H ) 4.3 1.3 2.3 assign (resid 72 and name HE* )(resid 73 and name H ) 4.9 1.6 2.9 assign (resid 72 and name HA )(resid 75 and name HG1 ) 3.8 1.3 1.9 assign (resid 72 and name HE* )(resid 75 and name H ) 4.1 1.3 2.2 assign (resid 72 and name HE* )(resid 75 and name HA ) 4.5 1.3 2.3 assign (resid 73 and name H )(resid 73 and name HA ) 2.9 0.5 0.6 assign (resid 73 and name H )(resid 73 and name HB* ) 3.6 1.1 1.5 assign (resid 73 and name H )(resid 74 and name H ) 3.1 0.8 1.1 assign (resid 73 and name HB* )(resid 74 and name H ) 4.3 1.4 2.5 assign (resid 73 and name HB* )(resid 74 and name HG2 ) 4.4 1.4 2.4 assign (resid 73 and name H )(resid 75 and name HB2 ) 3.9 1.2 2.0 assign (resid 73 and name HA )(resid 75 and name H ) 3.7 1.1 1.9 assign (resid 73 and name HB* )(resid 75 and name H ) 4.3 1.4 2.1 assign (resid 73 and name HA )(resid 76 and name HE* ) 4.2 1.4 2.2 assign (resid 74 and name H )(resid 74 and name HA ) 2.9 0.5 0.6 assign (resid 74 and name H )(resid 74 and name HD1 ) 4.2 1.3 2.2 assign (resid 74 and name H )(resid 74 and name HG2 ) 3.5 1.3 1.5 assign (resid 75 and name H )(resid 75 and name HG1 ) 3.6 1.3 1.7 assign (resid 75 and name HA )(resid 75 and name HB1 ) 3.4 1.3 1.6 assign (resid 75 and name HA )(resid 75 and name HD2 ) 3.6 1.3 1.7 assign (resid 75 and name HA )(resid 75 and name HG1 ) 3.7 1.1 1.8 assign (resid 75 and name HG1 )(resid 75 and name HD1 ) 2.5 0.3 0.4 assign (resid 75 and name HG1 )(resid 75 and name HE2 ) 3.1 0.8 1.1 assign (resid 75 and name H )(resid 76 and name HE* ) 3.7 1.3 1.8 assign (resid 75 and name H )(resid 76 and name HG1 ) 4.2 1.4 2.2 assign (resid 75 and name H )(resid 76 and name HG2 ) 4.0 1.1 2.0 assign (resid 75 and name HB1 )(resid 76 and name HE* ) 4.7 1.5 2.7 assign (resid 75 and name HG1 )(resid 76 and name HA ) 3.9 1.2 2.1 assign (resid 76 and name H )(resid 76 and name HB1 ) 3.2 0.9 1.4 assign (resid 76 and name H )(resid 76 and name HG1 ) 3.8 1.2 1.8 assign (resid 76 and name H )(resid 76 and name HE* ) 3.9 1.2 1.9 assign (resid 76 and name HA )(resid 76 and name HB1 ) 3.3 1.0 1.4 assign (resid 76 and name HA )(resid 76 and name HB2 ) 3.3 1.0 1.4 assign (resid 76 and name HA )(resid 76 and name HE* ) 4.1 1.3 2 assign (resid 76 and name HA )(resid 76 and name HG1 ) 4.0 1.2 2 assign (resid 76 and name HA )(resid 76 and name HG2 ) 3.6 1.2 1.7 assign (resid 76 and name HG1 )(resid 76 and name HE* ) 4.1 1.3 2.1 assign (resid 76 and name HG2 )(resid 76 and name HE* ) 3.5 1.2 1.5
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