NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
1973 |
1ba6   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
!! intrares, sequential, (i,i+2), (i,i+3), (i,i+4) !! (i,i+3) !! intraresidue restraints. !! no intrares, sequential, (i,i+3) assign (resid 1 and name HA )(resid 2 and name HN ) 0.0 0.0 2.7 ! s assign (resid 1 and name HB1 )(resid 2 and name HN ) 0.0 0.0 5.0 ! w assign (resid 1 and name HB2 )(resid 2 and name HN ) 0.0 0.0 5.0 ! w assign (resid 2 and name HB* )(resid 2 and name HN ) 0.0 0.0 4.2 ! s+1.5 assign (resid 2 and name HN )(resid 2 and name HA ) 0.0 0.0 2.7 ! s assign (resid 2 and name HN )(resid 2 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 2 and name HN )(resid 3 and name HN ) 0.0 0.0 3.5 ! m assign (resid 2 and name HA )(resid 2 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 3 and name HB1 )(resid 3 and name HA ) 0.0 0.0 3.5 ! m assign (resid 3 and name HB2 )(resid 3 and name HA ) 0.0 0.0 3.5 ! m assign (resid 3 and name HG* )(resid 3 and name HA ) 0.0 0.0 6.0 ! w+1 assign (resid 3 and name HN )(resid 2 and name HA ) 0.0 0.0 2.7 ! s assign (resid 3 and name HN )(resid 2 and name HB* ) 0.0 0.0 5.0 ! m+1.5 assign (resid 3 and name HN )(resid 3 and name HA ) 0.0 0.0 2.7 ! s assign (resid 3 and name HN )(resid 3 and name HB1 ) 0.0 0.0 3.5 ! m overlap assign (resid 3 and name HN )(resid 3 and name HB2 ) 0.0 0.0 3.5 ! m overlap assign (resid 3 and name HN )(resid 3 and name HG* ) 0.0 0.0 4.5 ! m+1 assign (resid 3 and name HN )(resid 4 and name HN ) 0.0 0.0 3.5 ! m assign (resid 4 and name HB1 )(resid 4 and name HA ) 0.0 0.0 2.7 ! s assign (resid 4 and name HB2 )(resid 4 and name HA ) 0.0 0.0 2.7 ! s assign (resid 4 and name HB2 )(resid 4 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 4 and name HD* )(resid 2 and name HB* ) 0.0 0.0 8.9 ! w+1.5 +2.4 assign (resid 4 and name HD* )(resid 4 and name HA ) 0.0 0.0 4.7 ! s+2 assign (resid 4 and name HD* )(resid 4 and name HB1 ) 0.0 0.0 4.7 ! s+2 assign (resid 4 and name HD* )(resid 4 and name HB2 ) 0.0 0.0 4.7 ! s+2 assign (resid 4 and name HN )(resid 2 and name HB* ) 0.0 0.0 6.5 ! w+1.5, i,i+2 assign (resid 4 and name HN )(resid 3 and name HA ) 0.0 0.0 2.8 ! s assign (resid 4 and name HN )(resid 4 and name HA ) 0.0 0.0 2.8 ! s assign (resid 4 and name HN )(resid 4 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 4 and name HN )(resid 4 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 4 and name HN )(resid 4 and name HD* ) 0.0 0.0 5.5 ! m+2 assign (resid 5 and name HN )(resid 5 and name HA ) 0.0 0.0 2.7 ! s assign (resid 5 and name HN )(resid 5 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 5 and name HN )(resid 5 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 5 and name HN )(resid 5 and name HG* ) 0.0 0.0 4.5 ! m+1 assign (resid 5 and name HN )(resid 4 and name HA ) 0.0 0.0 2.7 ! s assign (resid 5 and name HN )(resid 4 and name HB1 ) 0.0 0.0 5.0 ! w assign (resid 5 and name HN )(resid 4 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 6 and name HB1 )(resid 6 and name HA ) 0.0 0.0 2.7 ! s assign (resid 6 and name HB2 )(resid 6 and name HA ) 0.0 0.0 2.7 ! s assign (resid 6 and name HB2 )(resid 6 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 6 and name HN )(resid 5 and name HA ) 0.0 0.0 2.7 ! s assign (resid 6 and name HN )(resid 5 and name HB2 ) 0.0 0.0 5.0 ! w assign (resid 6 and name HN )(resid 5 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 6 and name HN )(resid 5 and name HN ) 0.0 0.0 3.5 ! m assign (resid 6 and name HN )(resid 6 and name HA ) 0.0 0.0 2.7 ! s assign (resid 6 and name HN )(resid 6 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 6 and name HN )(resid 6 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 7 and name HB1 )(resid 7 and name HA ) 0.0 0.0 3.5 ! m assign (resid 7 and name HB2 )(resid 7 and name HA ) 0.0 0.0 3.5 ! m assign (resid 7 and name HN )(resid 7 and name HA ) 0.0 0.0 2.7 ! s assign (resid 7 and name HN )(resid 7 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 7 and name HN )(resid 7 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 7 and name HN )(resid 6 and name HA ) 0.0 0.0 2.7 ! s assign (resid 7 and name HN )(resid 6 and name HN ) 0.0 0.0 3.5 ! m assign (resid 8 and name HB* )(resid 8 and name HA ) 0.0 0.0 4.5 ! m+1 assign (resid 8 and name HN )(resid 7 and name HA ) 0.0 0.0 2.7 ! s assign (resid 8 and name HN )(resid 7 and name HB1 ) 0.0 0.0 5.0 ! w assign (resid 8 and name HN )(resid 7 and name HB2 ) 0.0 0.0 5.0 ! w assign (resid 8 and name HN )(resid 8 and name HA ) 0.0 0.0 2.7 ! s assign (resid 8 and name HN )(resid 8 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 9 and name HN )(resid 9 and name HA1 ) 0.0 0.0 3.5 ! m assign (resid 9 and name HN )(resid 9 and name HA2 ) 0.0 0.0 3.5 ! m assign (resid 9 and name HN )(resid 8 and name HA ) 0.0 0.0 2.7 ! s assign (resid 11 and name HN )(resid 10 and name HA ) 0.0 0.0 5.0 ! w overlap assign (resid 10 and name HN )(resid 11 and name HB1 ) 0.0 0.0 5.0 ! w assign (resid 10 and name HN )(resid 11 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 10 and name HN )(resid 11 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 10 and name HN )(resid 10 and name HA ) 0.0 0.0 2.7 ! s assign (resid 10 and name HN )(resid 10 and name HB* ) 0.0 0.0 2.7 ! s !assign (resid 11 and name HB1 )(resid 10 and name HA ) 0.0 0.0 5.0 ! m to w, uncertain 3/98 !assign (resid 11 and name HB2 )(resid 10 and name HA ) 0.0 0.0 3.5 ! m uncertain 3/98 assign (resid 11 and name HG* )(resid 10 and name HA ) 0.0 0.0 6.0 ! w+1 assign (resid 11 and name HN )(resid 11 and name HA ) 0.0 0.0 2.7 ! s assign (resid 11 and name HN )(resid 11 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 11 and name HN )(resid 11 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 11 and name HN )(resid 11 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 11 and name HN )(resid 10 and name HB* ) 0.0 0.0 6.0 ! w+1 assign (resid 12 and name HN )(resid 12 and name HA ) 0.0 0.0 2.7 ! s assign (resid 12 and name HN )(resid 12 and name HB ) 0.0 0.0 2.7 ! s assign (resid 12 and name HN )(resid 12 and name HG* ) 0.0 0.0 5.9 ! m+2.4 !assign (resid 13 and name HA )(resid 13 and name HA ) 0.0 0.0 3.5 ! w/m assign (resid 13 and name HD2 )(resid 13 and name HA ) 0.0 0.0 3.5 ! w assign (resid 13 and name HD2 )(resid 15 and name HB* ) 0.0 0.0 6.0 ! vw+1 assign (resid 13 and name HD2 )(resid 15 and name HG* ) 0.0 0.0 6.0 ! vw+1 assign (resid 13 and name HN )(resid 13 and name HA ) 0.0 0.0 2.7 ! s assign (resid 13 and name HN )(resid 13 and name HB* ) 0.0 0.0 2.7 ! s assign (resid 13 and name HN )(resid 13 and name HD2 ) 0.0 0.0 5.0 !vvw assign (resid 13 and name HN )(resid 14 and name HN ) 0.0 0.0 2.7 ! s assign (resid 13 and name HN )(resid 12 and name HA ) 0.0 0.0 2.7 ! s assign (resid 13 and name HN )(resid 12 and name HB ) 0.0 0.0 3.5 ! m assign (resid 13 and name HN )(resid 12 and name HG* ) 0.0 0.0 5.9 ! m+2.4 assign (resid 13 and name HN )(resid 12 and name HN ) 0.0 0.0 5.0 ! w assign (resid 14 and name HB1 )(resid 14 and name HA ) 0.0 0.0 2.7 ! s assign (resid 14 and name HB2 )(resid 14 and name HA ) 0.0 0.0 2.7 ! s assign (resid 14 and name HB2 )(resid 14 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 14 and name HN )(resid 13 and name HA ) 0.0 0.0 2.7 ! s assign (resid 14 and name HN )(resid 13 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 14 and name HN )(resid 14 and name HA ) 0.0 0.0 3.5 ! m assign (resid 14 and name HN )(resid 14 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 14 and name HN )(resid 14 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 15 and name HA )(resid 15 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 15 and name HA )(resid 15 and name HG* ) 0.0 0.0 3.5 ! m assign (resid 15 and name HA )(resid 17 and name HN ) 0.0 0.0 6.0 ! w assign (resid 15 and name HN )(resid 15 and name HA ) 0.0 0.0 2.7 ! s assign (resid 15 and name HN )(resid 15 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 15 and name HN )(resid 15 and name HG* ) 0.0 0.0 4.5 ! m+1 assign (resid 15 and name HN )(resid 14 and name HA ) 0.0 0.0 2.7 ! s assign (resid 15 and name HN )(resid 14 and name HB1 ) 0.0 0.0 5.0 ! vw assign (resid 15 and name HN )(resid 14 and name HB2 ) 0.0 0.0 5.0 ! w assign (resid 15 and name HN )(resid 14 and name HN ) 0.0 0.0 5.0 ! w !assign (resid 15 and name HN )(resid 16 and name HA ) 0.0 0.0 3.5 ! m overlap, incorrect 3/98 assign (resid 15 and name HN )(resid 16 and name HN ) 0.0 0.0 3.5 ! m assign (resid 16 and name HA )(resid 16 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 16 and name HB2 )(resid 16 and name HA ) 0.0 0.0 5.0 ! w assign (resid 16 and name HA )(resid 16 and name HD1 ) 0.0 0.0 5.0 ! w assign (resid 16 and name HA )(resid 16 and name HD2 ) 0.0 0.0 5.0 ! w assign (resid 16 and name HA )(resid 16 and name HG* ) 0.0 0.0 4.5 ! m+1 assign (resid 16 and name HN )(resid 15 and name HA ) 0.0 0.0 3.5 ! m assign (resid 16 and name HN )(resid 17 and name HN ) 0.0 0.0 2.7 ! s assign (resid 16 and name HN )(resid 16 and name HA ) 0.0 0.0 2.7 ! s assign (resid 16 and name HN )(resid 16 and name HB1 ) 0.0 0.0 3.5 ! m overlap assign (resid 16 and name HN )(resid 16 and name HB2 ) 0.0 0.0 2.7 ! s assign (resid 16 and name HN )(resid 16 and name HD1 ) 0.0 0.0 3.5 ! m assign (resid 16 and name HN )(resid 16 and name HD2 ) 0.0 0.0 5.0 ! w assign (resid 16 and name HN )(resid 16 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 17 and name HA )(resid 17 and name HB* ) 0.0 0.0 6.0 ! w+1 assign (resid 17 and name HA )(resid 17 and name HD1* ) 0.0 0.0 6.5 ! w+1.5 assign (resid 17 and name HA )(resid 17 and name HD2* ) 0.0 0.0 6.5 ! w+1.5 assign (resid 17 and name HN )(resid 14 and name HA ) 0.0 0.0 5.0 ! w assign (resid 17 and name HN )(resid 17 and name HA ) 0.0 0.0 3.5 ! m assign (resid 17 and name HN )(resid 17 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 17 and name HN )(resid 17 and name HD2* ) 0.0 0.0 6.5 ! w+1.5 assign (resid 17 and name HN )(resid 16 and name HA ) 0.0 0.0 5.0 ! w assign (resid 18 and name HA )(resid 18 and name HB ) 0.0 0.0 2.7 ! s assign (resid 18 and name HA )(resid 18 and name HG1* ) 0.0 0.0 5.0 ! m+1.5 assign (resid 18 and name HA )(resid 18 and name HG2* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 18 and name HB )(resid 18 and name HG2* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 18 and name HN )(resid 18 and name HA ) 0.0 0.0 5.0 ! w assign (resid 18 and name HN )(resid 17 and name HA ) 0.0 0.0 5.0 ! w assign (resid 18 and name HN )(resid 17 and name HN ) 0.0 0.0 5.0 ! w assign (resid 18 and name HN )(resid 18 and name HA ) 0.0 0.0 2.7 ! s assign (resid 18 and name HN )(resid 18 and name HB ) 0.0 0.0 3.5 ! s to m as viol assign (resid 18 and name HN )(resid 18 and name HG1* ) 0.0 0.0 2.7 ! s assign (resid 18 and name HN )(resid 18 and name HG2* ) 0.0 0.0 2.7 ! s assign (resid 19 and name HB* )(resid 19 and name HA ) 0.0 0.0 3.7 ! s+1 assign (resid 19 and name HB* )(resid 16 and name HA ) 0.0 0.0 4.5 ! m+1 assign (resid 19 and name HD* )(resid 19 and name HA ) 0.0 0.0 5.1 ! s+2 assign (resid 19 and name HD* )(resid 19 and name HB* ) 0.0 0.0 5.1 ! s+2+1 assign (resid 19 and name HD* )(resid 18 and name HG1* ) 0.0 0.0 6.2 ! s+2+1.5 assign (resid 19 and name HD* )(resid 24 and name HG1* ) 0.0 0.0 8.5 ! w+2+1.5 assign (resid 19 and name HN )(resid 19 and name HA ) 0.0 0.0 2.7 ! s assign (resid 19 and name HN )(resid 19 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 19 and name HN )(resid 19 and name HD* ) 0.0 0.0 5.5 ! m+2.0 assign (resid 19 and name HN )(resid 18 and name HA ) 0.0 0.0 5.0 ! w assign (resid 19 and name HN )(resid 18 and name HN ) 0.0 0.0 3.5 ! m assign (resid 20 and name HB* )(resid 17 and name HA ) 0.0 0.0 2.7 ! s assign (resid 20 and name HB* )(resid 20 and name HA ) 0.0 0.0 2.7 ! s assign (resid 20 and name HD* )(resid 20 and name HA ) 0.0 0.0 4.7 ! s+2 assign (resid 20 and name HD* )(resid 20 and name HB* ) 0.0 0.0 6.7 ! s+2+1 !assign (resid 20 and name HD* )(resid 18 and name HG1* ) 0.0 0.0 7.0 ! m+1.5+2 not there assign (resid 20 and name HD* )(resid 18 and name HG2* ) 0.0 0.0 8.5 ! w+1.5+2 assign (resid 20 and name HD* )(resid 24 and name HG1* ) 0.0 0.0 6.2 ! s+2+1.5 assign (resid 20 and name HD* )(resid 24 and name HG2* ) 0.0 0.0 8.5 ! w+3.5 assign (resid 20 and name HN )(resid 17 and name HA ) 0.0 0.0 5.0 ! w assign (resid 20 and name HN )(resid 19 and name HN ) 0.0 0.0 2.7 ! s overlap assign (resid 20 and name HN )(resid 20 and name HA ) 0.0 0.0 2.7 ! s overlap assign (resid 20 and name HN )(resid 20 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 20 and name HN )(resid 20 and name HD* ) 0.0 0.0 7.0 ! w +2 assign (resid 21 and name HA )(resid 21 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 21 and name HA )(resid 24 and name HG1* ) 0.0 0.0 6.5 ! w+1.5 assign (resid 21 and name HN )(resid 21 and name HA ) 0.0 0.0 2.7 ! s assign (resid 21 and name HN )(resid 21 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 21 and name HN )(resid 22 and name HN ) 0.0 0.0 2.7 ! s assign (resid 21 and name HN )(resid 20 and name HA ) 0.0 0.0 5.0 ! w assign (resid 21 and name HN )(resid 20 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 21 and name HN )(resid 20 and name HD* ) 0.0 0.0 7.0 ! w+2 assign (resid 21 and name HN )(resid 18 and name HA ) 0.0 0.0 5.0 ! w assign (resid 21 and name HN )(resid 17 and name HA ) 0.0 0.0 5.0 ! w assign (resid 22 and name HG1 )(resid 22 and name HA ) 0.0 0.0 2.7 ! s assign (resid 22 and name HG2 )(resid 22 and name HA ) 0.0 0.0 2.7 ! s assign (resid 22 and name HG2 )(resid 22 and name HG1 ) 0.0 0.0 2.7 ! s assign (resid 22 and name HG1 )(resid 22 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 22 and name HG2 )(resid 22 and name HB2 ) 0.0 0.0 2.7 ! s assign (resid 22 and name HB1 )(resid 19 and name HA ) 0.0 0.0 5.0 ! w assign (resid 22 and name HB2 )(resid 19 and name HA ) 0.0 0.0 5.0 ! w assign (resid 22 and name HB1 )(resid 22 and name HA ) 0.0 0.0 2.7 ! s assign (resid 22 and name HB2 )(resid 22 and name HA ) 0.0 0.0 2.7 ! s assign (resid 22 and name HN )(resid 21 and name HA ) 0.0 0.0 3.5 ! m assign (resid 22 and name HN )(resid 23 and name HN ) 0.0 0.0 3.5 ! m assign (resid 22 and name HN )(resid 22 and name HA ) 0.0 0.0 2.7 ! s assign (resid 22 and name HN )(resid 22 and name HG1 ) 0.0 0.0 3.5 ! m assign (resid 22 and name HN )(resid 22 and name HG2 ) 0.0 0.0 3.5 ! m assign (resid 22 and name HN )(resid 18 and name HA ) 0.0 0.0 5.0 ! w assign (resid 23 and name HB1 )(resid 23 and name HA ) 0.0 0.0 2.7 ! s assign (resid 23 and name HB2 )(resid 23 and name HA ) 0.0 0.0 2.7 ! s assign (resid 23 and name HB1 )(resid 20 and name HA ) 0.0 0.0 5.0 ! w assign (resid 23 and name HB2 )(resid 20 and name HA ) 0.0 0.0 5.0 ! w assign (resid 23 and name HN )(resid 21 and name HB* ) 0.0 0.0 6.0 ! w+1 assign (resid 23 and name HN )(resid 23 and name HA ) 0.0 0.0 2.7 ! s assign (resid 23 and name HN )(resid 23 and name HB1 ) 0.0 0.0 3.5 ! m assign (resid 23 and name HN )(resid 23 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 23 and name HN )(resid 22 and name HB* ) 0.0 0.0 6.0 ! w+1 assign (resid 23 and name HN )(resid 20 and name HA ) 0.0 0.0 5.0 ! w assign (resid 23 and name HN )(resid 24 and name HG1* ) 0.0 0.0 6.5 ! w+1.5 assign (resid 24 and name HA )(resid 24 and name HB ) 0.0 0.0 2.7 ! s assign (resid 24 and name HA )(resid 24 and name HG1* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 24 and name HA )(resid 24 and name HG2* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 24 and name HB )(resid 24 and name HG1* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 24 and name HN )(resid 21 and name HA ) 0.0 0.0 3.5 ! m assign (resid 24 and name HN )(resid 21 and name HB* ) 0.0 0.0 6.0 ! w+1 assign (resid 24 and name HN )(resid 23 and name HA ) 0.0 0.0 3.5 ! m assign (resid 24 and name HN )(resid 23 and name HB1 ) 0.0 0.0 5.0 ! w assign (resid 24 and name HN )(resid 23 and name HB2 ) 0.0 0.0 5.0 ! w assign (resid 24 and name HN )(resid 20 and name HA ) 0.0 0.0 5.0 ! w assign (resid 24 and name HN )(resid 24 and name HA ) 0.0 0.0 2.7 ! s assign (resid 24 and name HN )(resid 24 and name HB ) 0.0 0.0 3.5 ! s to m as viol assign (resid 24 and name HN )(resid 24 and name HG1* ) 0.0 0.0 5.0 ! m+1.5 assign (resid 24 and name HN )(resid 24 and name HG2* ) 0.0 0.0 5.0 ! m+1.5 assign (resid 25 and name HA2 )(resid 25 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 25 and name HN )(resid 22 and name HA ) 0.0 0.0 3.5 ! m assign (resid 25 and name HN )(resid 25 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 25 and name HN )(resid 25 and name HA2 ) 0.0 0.0 2.7 ! s assign (resid 25 and name HN )(resid 26 and name HN ) 0.0 0.0 3.5 ! m assign (resid 25 and name HN )(resid 24 and name HA ) 0.0 0.0 3.5 ! m assign (resid 25 and name HN )(resid 24 and name HB ) 0.0 0.0 3.5 ! s to m assign (resid 25 and name HN )(resid 24 and name HG1* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 25 and name HN )(resid 24 and name HG2* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 25 and name HN )(resid 24 and name HN ) 0.0 0.0 2.7 ! s assign (resid 26 and name HB* )(resid 26 and name HA ) 0.0 0.0 4.5 ! m+1 assign (resid 26 and name HN )(resid 23 and name HA ) 0.0 0.0 2.7 ! s assign (resid 26 and name HN )(resid 25 and name HA1 ) 0.0 0.0 3.5 ! m assign (resid 26 and name HN )(resid 26 and name HA ) 0.0 0.0 2.7 ! s overlap assign (resid 26 and name HN )(resid 26 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 27 and name HB1 )(resid 27 and name HA ) 0.0 0.0 2.7 ! s assign (resid 27 and name HB2 )(resid 27 and name HA ) 0.0 0.0 2.7 ! s assign (resid 27 and name HB1 )(resid 24 and name HA ) 0.0 0.0 5.0 ! w assign (resid 27 and name HB2 )(resid 24 and name HA ) 0.0 0.0 5.0 ! w assign (resid 27 and name HB2 )(resid 27 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 27 and name HB2 )(resid 28 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 27 and name HD21 )(resid 27 and name HB1 ) 0.0 0.0 3.5 ! m/w assign (resid 27 and name HD21 )(resid 27 and name HB2 ) 0.0 0.0 3.5 ! m/w assign (resid 27 and name HD22 )(resid 27 and name HA ) 0.0 0.0 5.0 ! w assign (resid 27 and name HD22 )(resid 27 and name HB1 ) 0.0 0.0 3.5 ! s to m assign (resid 27 and name HD22 )(resid 27 and name HB2 ) 0.0 0.0 3.5 ! m assign (resid 27 and name HN )(resid 27 and name HA ) 0.0 0.0 2.7 ! s overlap assign (resid 27 and name HN )(resid 27 and name HD22 ) 0.0 0.0 5.0 ! w overlap assign (resid 27 and name HN )(resid 27 and name HB1 ) 0.0 0.0 3.5 ! m overlap assign (resid 27 and name HN )(resid 27 and name HB2 ) 0.0 0.0 3.5 ! m overlap assign (resid 27 and name HN )(resid 26 and name HA ) 0.0 0.0 3.5 ! m overlap assign (resid 27 and name HN )(resid 24 and name HA ) 0.0 0.0 5.0 ! w assign (resid 28 and name HA )(resid 28 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 28 and name HA )(resid 28 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 28 and name HE* )(resid 28 and name HD* ) 0.0 0.0 4.7 ! s+1+1 assign (resid 28 and name HE* )(resid 28 and name HG* ) 0.0 0.0 4.7 ! s+1+1 assign (resid 28 and name HN )(resid 27 and name HA ) 0.0 0.0 2.7 ! s assign (resid 28 and name HN )(resid 27 and name HB1 ) 0.0 0.0 3.5 ! m overlap assign (resid 28 and name HN )(resid 27 and name HB2 ) 0.0 0.0 3.5 ! m overlap assign (resid 28 and name HN )(resid 28 and name HA ) 0.0 0.0 2.7 ! s assign (resid 28 and name HN )(resid 28 and name HB* ) 0.0 0.0 3.7 ! s+1 assign (resid 28 and name HN )(resid 28 and name HD* ) 0.0 0.0 6.0 ! w+1 assign (resid 28 and name HN )(resid 28 and name HG* ) 0.0 0.0 3.7 ! s+1 overlap assign (resid 29 and name HA2 )(resid 29 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 29 and name HN )(resid 29 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 29 and name HN )(resid 29 and name HA2 ) 0.0 0.0 2.7 ! s assign (resid 29 and name HN )(resid 28 and name HA ) 0.0 0.0 2.7 ! s assign (resid 29 and name HN )(resid 28 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 29 and name HN )(resid 28 and name HG* ) 0.0 0.0 4.5 ! m+1 assign (resid 29 and name HN )(resid 28 and name HN ) 0.0 0.0 2.7 ! s assign (resid 30 and name HN )(resid 30 and name HA ) 0.0 0.0 2.7 ! s assign (resid 30 and name HB* )(resid 27 and name HA ) 0.0 0.0 6.5 ! w+1.5 assign (resid 30 and name HN )(resid 30 and name HB* ) 0.0 0.0 4.2 ! s+1.5 assign (resid 30 and name HN )(resid 29 and name HA1 ) 0.0 0.0 3.5 ! m/s !assign (resid 30 and name HN )(resid 29 and name HA2 ) 0.0 0.0 ? !overlapped assign (resid 30 and name HN )(resid 31 and name HN ) 0.0 0.0 3.5 ! m assign (resid 31 and name HA )(resid 31 and name HG11 ) 0.0 0.0 6.0 ! w+1 assign (resid 31 and name HB )(resid 31 and name HA ) 0.0 0.0 2.7 ! s assign (resid 31 and name HG12 )(resid 31 and name HA ) 0.0 0.0 5.0 ! w assign (resid 31 and name HN )(resid 30 and name HA ) 0.0 0.0 3.5 ! s-m overlap assign (resid 31 and name HN )(resid 30 and name HB* ) 0.0 0.0 5.0 ! m+1.5 assign (resid 31 and name HN )(resid 31 and name HA ) 0.0 0.0 2.7 ! s assign (resid 31 and name HN )(resid 31 and name HB ) 0.0 0.0 2.7 ! s assign (resid 31 and name HN )(resid 31 and name HG11 ) 0.0 0.0 3.5 ! m assign (resid 31 and name HN )(resid 31 and name HG12 ) 0.0 0.0 3.5 ! m assign (resid 31 and name HN )(resid 32 and name HN ) 0.0 0.0 3.5 ! m assign (resid 31 and name HN )(resid 28 and name HA ) 0.0 0.0 5.0 ! w overlap assign (resid 32 and name HB )(resid 32 and name HA ) 0.0 0.0 2.7 ! s assign (resid 32 and name HN )(resid 31 and name HA ) 0.0 0.0 3.5 ! s-m as always viol assign (resid 32 and name HN )(resid 31 and name HB ) 0.0 0.0 3.5 ! m overlap assign (resid 32 and name HN )(resid 32 and name HA ) 0.0 0.0 2.7 ! s assign (resid 32 and name HN )(resid 32 and name HB ) 0.0 0.0 2.7 ! s assign (resid 32 and name HA )(resid 32 and name HG11 ) 0.0 0.0 5.0 ! vw assign (resid 32 and name HA )(resid 34 and name HN ) 0.0 0.0 6.0 ! vw assign (resid 32 and name HA )(resid 32 and name HG12 ) 0.0 0.0 5.0 ! w assign (resid 33 and name HN )(resid 32 and name HA ) 0.0 0.0 3.5 ! m/s assign (resid 33 and name HN )(resid 30 and name HA ) 0.0 0.0 5.0 ! w assign (resid 33 and name HN )(resid 33 and name HA* ) 0.0 0.0 3.7 ! s+1 assign (resid 33 and name HN )(resid 32 and name HG* ) 0.0 0.0 3.7 ! s+1? assign (resid 33 and name HN )(resid 32 and name HN ) 0.0 0.0 3.5 ! m assign (resid 33 and name HN )(resid 34 and name HN ) 0.0 0.0 3.5 ! m assign (resid 34 and name HN )(resid 33 and name HA* ) 0.0 0.0 3.7 ! s+1 assign (resid 34 and name HN )(resid 34 and name HA ) 0.0 0.0 2.7 ! s assign (resid 34 and name HB* )(resid 31 and name HA ) 0.0 0.0 4.7 ! m+1 assign (resid 34 and name HN )(resid 34 and name HB* ) 0.0 0.0 4.5 ! m+1 assign (resid 34 and name HN )(resid 34 and name HD* ) 0.0 0.0 6.0 ! m+2.5 assign (resid 35 and name HB1 )(resid 35 and name HA ) 0.0 0.0 5.0 ! w assign (resid 35 and name HB2 )(resid 35 and name HA ) 0.0 0.0 3.5 ! m assign (resid 35 and name HB2 )(resid 35 and name HB1 ) 0.0 0.0 2.7 ! s assign (resid 35 and name HN )(resid 34 and name HA ) 0.0 0.0 2.7 ! s assign (resid 35 and name HN )(resid 34 and name HN ) 0.0 0.0 3.5 ! m assign (resid 35 and name HN )(resid 35 and name HA ) 0.0 0.0 2.7 ! s assign (resid 35 and name HN )(resid 35 and name HB1 ) 0.0 0.0 5.0 ! w assign (resid 35 and name HN )(resid 35 and name HB2 ) 0.0 0.0 5.0 ! w assign (resid 35 and name HN )(resid 35 and name HG* ) 0.0 0.0 6.0 ! w+1 assign (resid 36 and name HA )(resid 36 and name HB ) 0.0 0.0 2.7 ! s assign (resid 36 and name HA )(resid 36 and name HG* ) 0.0 0.0 5.1 ! s+2.4 assign (resid 36 and name HN )(resid 35 and name HA ) 0.0 0.0 2.7 ! s assign (resid 36 and name HN )(resid 36 and name HA ) 0.0 0.0 2.7 ! s overlap assign (resid 36 and name HN )(resid 36 and name HB ) 0.0 0.0 2.7 ! s assign (resid 36 and name HN )(resid 36 and name HG* ) 0.0 0.0 5.1 ! s+2.4 assign (resid 37 and name HN )(resid 37 and name HA* ) 0.0 0.0 3.7 ! s+1 overlap assign (resid 37 and name HN )(resid 36 and name HA ) 0.0 0.0 3.7 ! s-m overlap assign (resid 37 and name HN )(resid 36 and name HB ) 0.0 0.0 3.5 ! m assign (resid 37 and name HN )(resid 36 and name HG* ) 0.0 0.0 5.1 ! s+2.4 assign (resid 37 and name HN )(resid 36 and name HN ) 0.0 0.0 2.7 ! s overlap assign (resid 37 and name HN )(resid 38 and name HN ) 0.0 0.0 2.7 ! s overlap assign (resid 38 and name HA2 )(resid 38 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 38 and name HN )(resid 38 and name HA1 ) 0.0 0.0 2.7 ! s assign (resid 38 and name HN )(resid 38 and name HA2 ) 0.0 0.0 2.7 ! s assign (resid 38 and name HN )(resid 39 and name HN ) 0.0 0.0 2.7 ! s assign (resid 39 and name HA )(resid 39 and name HG* ) 0.0 0.0 5.1 ! s+2.4 assign (resid 39 and name HB )(resid 39 and name HA ) 0.0 0.0 3.5 ! m assign (resid 39 and name HN )(resid 38 and name HA2 ) 0.0 0.0 2.7 ! s assign (resid 39 and name HN )(resid 39 and name HA ) 0.0 0.0 2.7 ! s assign (resid 39 and name HN )(resid 39 and name HB ) 0.0 0.0 2.7 ! s assign (resid 39 and name HN )(resid 39 and name HG* ) 0.0 0.0 5.9 ! overlap assign (resid 39 and name HN )(resid 40 and name HN ) 0.0 0.0 2.7 ! s assign (resid 40 and name HA )(resid 40 and name HG* ) 0.0 0.0 7.4 ! w+2.4 assign (resid 40 and name HB )(resid 40 and name HA ) 0.0 0.0 3.5 ! m assign (resid 40 and name HN )(resid 39 and name HA ) 0.0 0.0 2.7 ! s assign (resid 40 and name HN )(resid 40 and name HA ) 0.0 0.0 2.7 ! s assign (resid 40 and name HN )(resid 40 and name HB ) 0.0 0.0 3.5 ! m !
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