NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | program | type | subtype | subsubtype |
380031 | 1i8h | cing | 3-converted-DOCR | XPLOR/CNS | distance | general distance | ambi |
assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 6 and name HZ2 )) 2.000 0.200 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 6 and name HD1 )) 2.000 0.200 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 6 and name HB2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 3 and name HD1 )) (( segid " B" and resid 6 and name HE1 )) 4.500 2.500 1.000 assi (( segid " B" and resid 3 and name HB1 )) (( segid " B" and resid 6 and name HE1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 3 and name HB2 )) (( segid " B" and resid 6 and name HE1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 3 and name HG1 )) (( segid " B" and resid 6 and name HE1 )) 4.500 2.500 1.000 assi (( segid " B" and resid 3 and name HG2 )) (( segid " B" and resid 6 and name HE1 )) 4.500 2.500 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 32 and name HG2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 32 and name HG1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 32 and name HB2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HE1 )) (( segid " B" and resid 32 and name HB1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 29 and name HE1 )) (( segid " B" and resid 29 and name HD1 )) 2.000 0.200 1.000 assi (( segid " B" and resid 29 and name HE1 )) (( segid " B" and resid 29 and name HZ2 )) 2.000 0.200 1.000 assi (( segid " B" and resid 29 and name HE1 )) (( segid " B" and resid 29 and name HH2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 29 and name HE1 )) (( segid " B" and resid 29 and name HB1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 20 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 8 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 22 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HE3 )) (( segid " B" and resid 7 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 20 and name HD2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 6 and name HZ3 )) (( segid " B" and resid 7 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 19 and name HD2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 6 and name HA )) (( segid " B" and resid 7 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 21 and name HA )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HB2 )) (( segid " B" and resid 7 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HB1 )) (( segid " B" and resid 7 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 7 and name HN )) ( segid " B" and resid 7 and name HG# ) 5.000 2.500 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 7 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 7 and name HN )) (( segid " B" and resid 7 and name HB1 )) 3.000 1.200 1.000 assi ( segid " B" and resid 2 and name HD1#) (( segid " B" and resid 7 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 28 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 20 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 20 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 28 and name HN )) (( segid " B" and resid 29 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 27 and name HN )) (( segid " B" and resid 28 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 20 and name HN )) (( segid " B" and resid 21 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 6 and name HE3 )) (( segid " B" and resid 20 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 6 and name HZ3 )) (( segid " B" and resid 20 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 27 and name HA )) (( segid " B" and resid 28 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 20 and name HN )) (( segid " B" and resid 20 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 20 and name HA )) (( segid " B" and resid 28 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 19 and name HA )) (( segid " B" and resid 20 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 7 and name HA )) (( segid " B" and resid 20 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 8 and name HA )) (( segid " B" and resid 20 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 27 and name HB2 )) (( segid " B" and resid 28 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 27 and name HB1 )) (( segid " B" and resid 28 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 20 and name HN )) (( segid " B" and resid 20 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 19 and name HB1 )) (( segid " B" and resid 28 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 19 and name HB2 )) (( segid " B" and resid 20 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 20 and name HN )) (( segid " B" and resid 20 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 28 and name HN )) (( segid " B" and resid 28 and name HG2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HG2 )) (( segid " B" and resid 20 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 9 and name HG1 )) (( segid " B" and resid 20 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 12 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 13 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 11 and name HA )) (( segid " B" and resid 12 and name HN )) 3.000 1.200 1.000 assi ( segid " B" and resid 11 and name HB# ) (( segid " B" and resid 12 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HD1 )) 4.500 2.500 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HD2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HG1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HB1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 12 and name HN )) (( segid " B" and resid 12 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 18 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 10 and name HN )) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 15 and name HN )) 5.000 2.500 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 16 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 10 and name HA )) (( segid " B" and resid 11 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 11 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 17 and name HA )) 3.000 1.200 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 11 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 11 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 10 and name HG1 )) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 10 and name HG2 )) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 10 and name HB1 )) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 10 and name HB2 )) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 11 and name HN )) (( segid " B" and resid 17 and name HB )) 4.000 2.000 1.000 assi ( segid " B" and resid 10 and name HE# ) (( segid " B" and resid 11 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 11 and name HN )) ( segid " B" and resid 17 and name HG1#) 5.000 2.500 1.000 assi (( segid " B" and resid 11 and name HN )) ( segid " B" and resid 17 and name HG2#) 5.000 2.500 1.000 assi (( segid " B" and resid 18 and name HN )) (( segid " B" and resid 19 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 19 and name HN )) ( segid " B" and resid 19 and name HD# ) 4.000 2.000 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 19 and name HA )) 3.000 1.200 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 29 and name HA )) 4.000 2.000 1.000 assi (( segid " B" and resid 18 and name HA )) (( segid " B" and resid 19 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 19 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 19 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 18 and name HB2 )) (( segid " B" and resid 19 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 19 and name HN )) (( segid " B" and resid 28 and name HG2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 7 and name HA )) (( segid " B" and resid 8 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 8 and name HN )) (( segid " B" and resid 8 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 8 and name HN )) (( segid " B" and resid 8 and name HE1 )) 5.000 2.500 1.000 assi (( segid " B" and resid 8 and name HN )) (( segid " B" and resid 8 and name HE2 )) 5.000 2.500 1.000 assi (( segid " B" and resid 7 and name HG2 )) (( segid " B" and resid 8 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 7 and name HG1 )) (( segid " B" and resid 8 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 7 and name HB1 )) (( segid " B" and resid 8 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 8 and name HN )) (( segid " B" and resid 8 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 8 and name HN )) (( segid " B" and resid 8 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 18 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 10 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 19 and name HA )) 3.000 1.200 1.000 assi (( segid " B" and resid 8 and name HA )) (( segid " B" and resid 9 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 20 and name HB1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HD2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 8 and name HB2 )) (( segid " B" and resid 9 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 8 and name HB1 )) (( segid " B" and resid 9 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 8 and name HD2 )) (( segid " B" and resid 9 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 8 and name HD1 )) (( segid " B" and resid 9 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HG2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HG1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 9 and name HN )) (( segid " B" and resid 9 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 39 and name HN )) (( segid " B" and resid 39 and name HA2 )) 2.000 0.200 1.000 assi (( segid " B" and resid 39 and name HN )) (( segid " B" and resid 39 and name HA1 )) 2.000 0.200 1.000 assi (( segid " B" and resid 2 and name HN )) (( segid " B" and resid 2 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 1 and name HA )) (( segid " B" and resid 2 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 2 and name HN )) (( segid " B" and resid 2 and name HB2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 2 and name HN )) ( segid " B" and resid 2 and name HD1#) 4.500 2.500 1.000 assi (( segid " B" and resid 2 and name HN )) ( segid " B" and resid 2 and name HD2#) 4.500 2.500 1.000 assi (( segid " B" and resid 5 and name HN )) (( segid " B" and resid 6 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 4 and name HA )) (( segid " B" and resid 5 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 5 and name HN )) (( segid " B" and resid 5 and name HA2 )) 2.000 0.200 1.000 assi (( segid " B" and resid 4 and name HB2 )) (( segid " B" and resid 5 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 4 and name HG2 )) (( segid " B" and resid 5 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 4 and name HG1 )) (( segid " B" and resid 5 and name HN )) 5.000 2.500 1.000 assi (( segid " B" and resid 4 and name HB1 )) (( segid " B" and resid 5 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 18 and name HN )) ( segid " B" and resid 18 and name HD# ) 4.000 2.000 1.000 assi (( segid " B" and resid 18 and name HN )) ( segid " B" and resid 18 and name HE# ) 4.000 2.000 1.000 assi (( segid " B" and resid 10 and name HA )) (( segid " B" and resid 18 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 18 and name HN )) (( segid " B" and resid 18 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 17 and name HA )) (( segid " B" and resid 18 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 8 and name HA )) (( segid " B" and resid 18 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HA )) (( segid " B" and resid 18 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 18 and name HN )) (( segid " B" and resid 18 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 18 and name HN )) (( segid " B" and resid 18 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 17 and name HB )) (( segid " B" and resid 18 and name HN )) 3.000 1.200 1.000 assi ( segid " B" and resid 10 and name HE# ) (( segid " B" and resid 18 and name HN )) 5.000 2.500 1.000 assi ( segid " B" and resid 17 and name HG1#) (( segid " B" and resid 18 and name HN )) 4.000 2.000 1.000 assi ( segid " B" and resid 17 and name HG2#) (( segid " B" and resid 18 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 9 and name HB2 )) (( segid " B" and resid 18 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 9 and name HB1 )) (( segid " B" and resid 18 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 22 and name HE1 )) (( segid " B" and resid 22 and name HD2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 16 and name HN )) (( segid " B" and resid 17 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 17 and name HN )) (( segid " B" and resid 17 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 16 and name HA )) (( segid " B" and resid 17 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 16 and name HD1 )) (( segid " B" and resid 17 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 17 and name HN )) (( segid " B" and resid 17 and name HB )) 3.000 1.200 1.000 assi (( segid " B" and resid 16 and name HG1 )) (( segid " B" and resid 17 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 16 and name HB2 )) (( segid " B" and resid 17 and name HN )) 4.500 2.500 1.000 assi (( segid " B" and resid 16 and name HG2 )) (( segid " B" and resid 17 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 17 and name HN )) ( segid " B" and resid 17 and name HG1#) 4.000 2.000 1.000 assi (( segid " B" and resid 17 and name HN )) ( segid " B" and resid 17 and name HG2#) 4.000 2.000 1.000 assi (( segid " B" and resid 30 and name HN )) (( segid " B" and resid 31 and name HN )) 4.000 2.000 1.000 assi ( segid " B" and resid 19 and name HD# ) (( segid " B" and resid 31 and name HN )) 5.000 2.500 1.000 assi ( segid " B" and resid 19 and name HE# ) (( segid " B" and resid 31 and name HN )) 5.000 2.500 1.000 assi (( segid " B" and resid 30 and name HA )) (( segid " B" and resid 31 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HD2 )) 5.000 2.500 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HD1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 32 and name HD2 )) 4.500 2.500 1.000 assi (( segid " B" and resid 30 and name HG2 )) (( segid " B" and resid 31 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 30 and name HB1 )) (( segid " B" and resid 31 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 30 and name HB2 )) (( segid " B" and resid 31 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HB2 )) 3.000 1.200 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HG2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 31 and name HN )) (( segid " B" and resid 31 and name HG1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 38 and name HN )) (( segid " B" and resid 39 and name HA2 )) 4.000 2.000 1.000 assi (( segid " B" and resid 38 and name HN )) (( segid " B" and resid 39 and name HA1 )) 4.000 2.000 1.000 assi (( segid " B" and resid 36 and name HA )) (( segid " B" and resid 38 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 38 and name HN )) (( segid " B" and resid 38 and name HB1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 37 and name HB1 )) (( segid " B" and resid 38 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 37 and name HB2 )) (( segid " B" and resid 38 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 33 and name HN )) (( segid " B" and resid 34 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 33 and name HA )) (( segid " B" and resid 34 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 34 and name HN )) (( segid " B" and resid 34 and name HA1 )) 2.000 0.200 1.000 assi (( segid " B" and resid 34 and name HN )) (( segid " B" and resid 34 and name HA2 )) 2.000 0.200 1.000 assi (( segid " B" and resid 33 and name HB1 )) (( segid " B" and resid 34 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 33 and name HB2 )) (( segid " B" and resid 34 and name HN )) 3.000 1.200 1.000 assi (( segid " B" and resid 32 and name HG2 )) (( segid " B" and resid 34 and name HN )) 4.000 2.000 1.000 assi (( segid " B" and resid 29 and name HN )) (( segid " B" and resid 30 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 29 and name HN )) (( segid " B" and resid 29 and name HD1 )) 3.000 1.200 1.000 assi (( segid " B" and resid 29 and name HN )) (( segid " B" and resid 29 and name HA )) 2.000 0.200 1.000 assi (( segid " B" and resid 28 and name HA )) (( segid " B" and resid 29 and name HN )) 2.000 0.200 1.000 assi (( segid " B" and resid 36 and name HN )) (( segid " B" and resid 36 and name HB2 )) 3.000 1.200 1.000 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