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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
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27407 |
2rm4 ![]() ![]() |
11009 | cing | 1-original | 4 | XPLOR/CNS | distance | NOE | simple |
!T6 assign(resid 6 and name HN )(resid 5 and name HA ) 0.0 0.0 2.7 !Q8 assign(resid 8 and name HN )(resid 9 and name HN ) 0.0 0.0 2.7 assign(resid 8 and name HN )(resid 8 and name HA ) 0.0 0.0 3.2 assign(resid 8 and name HN )(resid 7 and name HA ) 0.0 0.0 2.7 assign(resid 8 and name HN )(resid 7 and name HB+ ) 0.0 0.0 3.5 ! D9 assign(resid 9 and name HN )(resid 9 and name HA ) 2.7 0.0 5.0 assign(resid 9 and name HN )(resid 8 and name HA ) 0.0 0.0 3.2 assign(resid 9 and name HN )(resid 8 and name HB1 ) 3.2 0.0 1.8 assign(resid 9 and name HN )(resid 8 and name HB2 ) 3.2 0.0 1.8 assign(resid 9 and name HN )(resid 10 and name HN ) 0.0 0.0 2.7 ! W10 assign(resid 10 and name HN )(resid 10 and name HA ) 2.7 0.0 5.0 assign(resid 10 and name HN )(resid 9 and name HA ) 2.7 0.0 5.0 assign(resid 10 and name HN )(resid 9 and name HB+ ) 2.7 0.0 5.0 assign(resid 10 and name HN )(resid 11 and name HN ) 0.0 0.0 2.7 assign(resid 10 and name HN )(resid 10 and name HD1 ) 2.7 0.0 5.0 assign(resid 10 and name HN )(resid 33 and name HD1+ ) 0.0 0.0 4.7 assign(resid 10 and name HE1 )(resid 69 and name HD2+ ) 0.0 0.0 5.0 assign(resid 10 and name HZ3 )(resid 69 and name HD2+ ) 0.0 0.0 3.2 assign(resid 10 and name HE3 )(resid 69 and name HD2+ ) 0.0 0.0 5.0 assign(resid 10 and name HE3 )(resid 30 and name HD1+ ) 3.2 0.0 1.8 !assign(resid 10 and name HZ3 )(resid 30 and name HD1+ ) 0.0 0.0 4.0 assign(resid 10 and name HD1 )(resid 33 and name HD1+ ) 0.0 0.0 4.0 assign(resid 10 and name HE1 )(resid 5 and name HA ) 0.0 0.0 4.0 !assign(resid 10 and name HZ3 )(resid 15 and name HA ) 3.2 0.0 5.0 !I11 assign(resid 11 and name HN )(resid 12 and name HN ) 3.2 0.0 5.0 assign(resid 11 and name HN )(resid 10 and name HA ) 3.2 0.0 5.0 assign(resid 11 and name HN )(resid 11 and name HA ) 2.7 0.0 5.0 assign(resid 11 and name HN )(resid 8 and name HA ) 0.0 0.0 3.5 assign(resid 11 and name HN )(resid 33 and name HD1+ ) 0.0 0.0 4.0 assign(resid 11 and name HN )(resid 9 and name HA ) 0.0 0.0 4.0 !assign(resid 11 and name HD )(resid xx and name HN ) 0.0 0.0 3.2 assign(resid 11 and name HG2+ )(resid 31 and name HA ) 0.0 0.0 3.2 assign(resid 11 and name HD1+ )(resid 33 and name HN ) 0.0 0.0 4.0 assign(resid 11 and name HD1+ )(resid 32 and name HA ) 0.0 0.0 3.5 assign(resid 11 and name HN )(resid 10 and name HD1 ) 4.0 0.0 5.0 assign(resid 11 and name HN )(resid 10 and name HE3 ) 4.0 0.0 5.0 !G12 assign(resid 12 and name HN )(resid 13 and name HN ) 0.0 0.0 3.2 assign(resid 12 and name HN )(resid 11 and name HA ) 0.0 0.0 2.7 assign(resid 12 and name HN )(resid 12 and name HA2 ) 0.0 0.0 2.7 assign(resid 12 and name HN )(resid 30 and name HB ) 0.0 0.0 5.0 !C13 assign(resid 13 and name HN )(resid 30 and name HN ) 0.0 0.0 4.0 assign(resid 13 and name HN )(resid 30 and name HB ) 0.0 0.0 3.2 assign(resid 13 and name HN )(resid 30 and name HG2+ ) 0.0 0.0 4.8 assign(resid 13 and name HA )(resid 29 and name HD2+ ) 0.0 0.0 4.0 !A14 assign(resid 14 and name HN )(resid 13 and name HA ) 0.0 0.0 2.7 assign(resid 14 and name HN )(resid 14 and name HA ) 0.0 0.0 3.2 assign(resid 14 and name HN )(resid 71 and name HN ) 0.0 0.0 3.5 assign(resid 14 and name HN )(resid 69 and name HD2+ ) 0.0 0.0 4.8 !assign(resid 14 and name HN )(resid xx and name HN ) 0.0 0.0 4.0 !V15 assign(resid 15 and name HN )(resid 14 and name HA ) 0.0 0.0 2.7 assign(resid 15 and name HN )(resid 15 and name HA ) 0.0 0.0 3.2 assign(resid 15 and name HN )(resid 28 and name HN ) 0.0 0.0 3.5 assign(resid 15 and name HG1+ )(resid 70 and name HN ) 0.0 0.0 4.0 !S16 assign(resid 16 and name HN )(resid 17 and name HN ) 3.2 0.0 5.0 !assign(resid 16 and name HN )(resid xx and name HN ) 3.2 0.0 5.0 assign(resid 16 and name HN )(resid 15 and name HA ) 0.0 0.0 2.7 assign(resid 16 and name HN )(resid 16 and name HA ) 0.0 0.0 3.2 assign(resid 16 and name HN )(resid 70 and name HN ) 3.2 0.0 5.0 assign(resid 16 and name HN )(resid 69 and name HA ) 0.0 0.0 4.0 assign(resid 16 and name HA )(resid 27 and name HA ) 0.0 0.0 2.7 assign(resid 16 and name HN )(resid 68 and name HB1 ) 0.0 0.0 5.0 assign(resid 16 and name HN )(resid 17 and name HD1+ ) 0.0 0.0 4.0 !I17 assign(resid 17 and name HN )(resid 16 and name HA ) 0.0 0.0 2.7 assign(resid 17 and name HN )(resid 26 and name HN ) 0.0 0.0 3.5 assign(resid 17 and name HN )(resid 27 and name HA ) 0.0 0.0 4.0 assign(resid 17 and name HN )(resid 27 and name HG+ ) 3.2 0.0 5.8 assign(resid 17 and name HN )(resid 25 and name HG1+ ) 0.0 0.0 4.0 !A18 assign(resid 18 and name HN )(resid 17 and name HA ) 0.0 0.0 2.7 assign(resid 18 and name HN )(resid 19 and name HN ) 3.2 0.0 5.0 assign(resid 18 and name HN )(resid 66 and name HN ) 0.0 0.0 3.5 assign(resid 18 and name HB+ )(resid 66 and name HN ) 0.0 0.0 4.0 assign(resid 18 and name HB+ )(resid 66 and name HB+ ) 0.0 0.0 4.8 assign(resid 18 and name HN )(resid 17 and name HD1+ ) 3.5 0.0 5.8 !C19 assign(resid 19 and name HN )(resid 18 and name HA ) 0.0 0.0 2.7 !assign(resid 19 and name HN )(resid 19 and name HB2 ) 0.0 0.0 2.7 !assign(resid 19 and name HN )(resid 19 and name HB1 ) 0.0 0.0 3.2 !D20 assign(resid 20 and name HN )(resid 19 and name HN ) 3.2 0.0 5.0 assign(resid 20 and name HN )(resid 19 and name HA ) 0.0 0.0 2.7 assign(resid 20 and name HN )(resid 20 and name HA ) 0.0 0.0 3.2 assign(resid 20 and name HN )(resid 20 and name HB+ ) 0.0 0.0 3.5 assign(resid 20 and name HN )(resid 64 and name HA ) 3.2 0.0 5.0 !E21 assign(resid 21 and name HN )(resid 22 and name HN ) 0.0 0.0 4.0 assign(resid 21 and name HN )(resid 20 and name HA ) 0.0 0.0 2.7 assign(resid 21 and name HN )(resid 21 and name HA ) 0.0 0.0 3.2 assign(resid 21 and name HN )(resid 21 and name HB+ ) 0.0 0.0 3.5 assign(resid 21 and name HN )(resid 20 and name HB+ ) 0.0 0.0 3.5 assign(resid 21 and name HN )(resid 21 and name HG+ ) 0.0 0.0 4.0 !assign(resid 21 and name HA )(resid 23 and name HN ) 0.0 0.0 4.0 !V22 assign(resid 22 and name HN )(resid 23 and name HN ) 0.0 0.0 2.7 assign(resid 22 and name HN )(resid 22 and name HA ) 2.7 0.0 5.0 assign(resid 22 and name HN )(resid 21 and name HA ) 3.2 0.0 5.0 assign(resid 22 and name HN )(resid 20 and name HB+ ) 0.0 0.0 4.8 !L23 assign(resid 23 and name HN )(resid 24 and name HN ) 0.0 0.0 3.2 assign(resid 23 and name HN )(resid 23 and name HA ) 0.0 0.0 3.2 assign(resid 23 and name HN )(resid 22 and name HA ) 0.0 0.0 4.0 assign(resid 23 and name HN )(resid 22 and name HB ) 0.0 0.0 3.2 assign(resid 23 and name HN )(resid 19 and name HB1 ) 0.0 0.0 5.0 assign(resid 23 and name HN )(resid 19 and name HB2 ) 0.0 0.0 4.0 !G24 assign(resid 24 and name HN )(resid 25 and name HN ) 3.2 0.0 5.0 assign(resid 24 and name HN )(resid 24 and name HA2 ) 0.0 0.0 2.7 assign(resid 24 and name HN )(resid 24 and name HA1 ) 0.0 0.0 3.5 !V25 assign(resid 25 and name HN )(resid 46 and name HN ) 0.0 0.0 3.5 assign(resid 25 and name HN )(resid 24 and name HA1 ) 0.0 0.0 2.7 assign(resid 25 and name HN )(resid 24 and name HA2 ) 0.0 0.0 3.2 !F26 assign(resid 26 and name HN )(resid 25 and name HA ) 0.0 0.0 2.7 assign(resid 26 and name HN )(resid 26 and name HA ) 0.0 0.0 3.2 assign(resid 26 and name HN )(resid 17 and name HB ) 0.0 0.0 3.2 !Q27 assign(resid 27 and name HN )(resid 44 and name HN ) 0.0 0.0 3.5 assign(resid 27 and name HN )(resid 26 and name HA ) 0.0 0.0 2.7 assign(resid 27 and name HN )(resid 45 and name HA ) 0.0 0.0 4.0 assign(resid 27 and name HN )(resid 43 and name HA ) 0.0 0.0 5.0 assign(resid 27 and name HN )(resid 26 and name HB1 ) 0.0 0.0 4.0 assign(resid 27 and name HN )(resid 26 and name HB2 ) 0.0 0.0 4.0 assign(resid 27 and name HN )(resid 26 and name HD2 ) 3.2 0.0 0.8 assign(resid 27 and name HG+ )(resid 16 and name HA ) 0.0 0.0 4.0 assign(resid 27 and name HG+ )(resid 27 and name HE21 ) 0.0 0.0 3.5 assign(resid 27 and name HG+ )(resid 27 and name HE22 ) 2.7 0.0 4.0 assign(resid 27 and name HE21 )(resid 25 and name HG1+ ) 0.0 0.0 3.2 assign(resid 27 and name HE22 )(resid 25 and name HG1+ ) 3.2 0.0 5.0 !G28 assign(resid 28 and name HN )(resid 29 and name HN ) 3.2 0.0 5.0 assign(resid 28 and name HN )(resid 27 and name HA ) 0.0 0.0 2.7 assign(resid 28 and name HN )(resid 28 and name HA2 ) 0.0 0.0 3.2 assign(resid 28 and name HN )(resid 28 and name HA1 ) 0.0 0.0 3.2 assign(resid 28 and name HN )(resid 16 and name HA ) 0.0 0.0 4.0 assign(resid 28 and name HN )(resid 40 and name HD1+ ) 0.0 0.0 4.7 assign(resid 28 and name HN )(resid 15 and name HG2+ ) 0.0 0.0 4.7 !L29 assign(resid 29 and name HN )(resid 41 and name HN ) 0.0 0.0 3.5 assign(resid 29 and name HN )(resid 29 and name HA ) 0.0 0.0 3.2 assign(resid 29 and name HDd+ )(resid 42 and name HD+ ) 0.0 0.0 4.2 !I30 assign(resid 30 and name HN )(resid 30 and name HA ) 0.0 0.0 3.2 assign(resid 30 and name HN )(resid 29 and name HA ) 0.0 0.0 2.7 assign(resid 30 and name HN )(resid 12 and name HN ) 2.7 0.0 5.0 assign(resid 30 and name HN )(resid 40 and name HG2+ ) 0.0 0.0 4.0 assign(resid 30 and name HA )(resid 40 and name HG2+ ) 0.0 0.0 3.5 assign(resid 30 and name HG2+ )(resid 11 and name HA ) 0.0 0.0 4.0 assign(resid 30 and name HD1+ )(resid 10 and name HB1 ) 0.0 0.0 4.0 !K31 assign(resid 31 and name HN )(resid 32 and name HN ) 0.0 0.0 2.7 assign(resid 31 and name HN )(resid 30 and name HA ) 0.0 0.0 2.7 assign(resid 31 and name HN )(resid 31 and name HA ) 2.7 0.0 5.0 assign(resid 31 and name HN )(resid 40 and name HA ) 0.0 0.0 3.2 assign(resid 31 and name HN )(resid 40 and name HG2+ ) 0.0 0.0 4.7 !Q32 assign(resid 32 and name HN )(resid 39 and name HN ) 0.0 0.0 3.5 assign(resid 32 and name HN )(resid 32 and name HA ) 0.0 0.0 3.2 assign(resid 32 and name HN )(resid 31 and name HA ) 0.0 0.0 4.0 assign(resid 32 and name HN )(resid 39 and name HB ) 0.0 0.0 4.0 assign(resid 32 and name HN )(resid 30 and name HG2+ ) 0.0 0.0 4.0 assign(resid 32 and name HN )(resid 30 and name HA ) 0.0 0.0 4.0 assign(resid 32 and name HG+ )(resid 32 and name HE22 ) 2.7 0.0 4.0 assign(resid 32 and name HG+ )(resid 32 and name HE21 ) 0.0 0.0 3.5 !I33 assign(resid 32 and name HN )(resid 33 and name HN ) 3.2 0.0 5.0 assign(resid 33 and name HN )(resid 33 and name HA ) 0.0 0.0 3.2 assign(resid 33 and name HN )(resid 32 and name HA ) 0.0 0.0 2.7 !S34 assign(resid 34 and name HN )(resid 37 and name HN ) 0.0 0.0 3.5 assign(resid 34 and name HN )(resid 34 and name HA ) 0.0 0.0 3.2 assign(resid 34 and name HN )(resid 33 and name HA ) 0.0 0.0 2.7 !assign(resid 34 and name HN )(resid 33 and name HG1+ ) 0.0 0.0 3.5 !assign(resid 34 and name HN )(resid 33 and name HD1+ ) 3.2 0.0 5.0 assign(resid 34 and name HN )(resid 38 and name HA ) 0.0 0.0 3.2 assign(resid 34 and name HN )(resid 37 and name HG+ ) 3.2 0.0 5.0 !A35 assign(resid 35 and name HN )(resid 36 and name HN ) 0.0 0.0 3.5 assign(resid 35 and name HN )(resid 35 and name HA ) 2.7 0.0 5.0 assign(resid 35 and name HN )(resid 34 and name HB1 ) 0.0 0.0 4.0 assign(resid 35 and name HN )(resid 34 and name HB2 ) 0.0 0.0 2.7 assign(resid 35 and name HA )(resid 33 and name HGu ) 0.0 0.0 5.7 assign(resid 35 and name HA )(resid 37 and name HN ) 3.2 0.0 5.0 !E36 assign(resid 36 and name HN )(resid 37 and name HN ) 0.0 0.0 2.7 assign(resid 36 and name HN )(resid 36 and name HA ) 0.0 0.0 3.2 assign(resid 36 and name HN )(resid 35 and name HA ) 2.7 0.0 5.0 assign(resid 36 and name HN )(resid 34 and name HB1 ) 3.2 0.0 5.0 assign(resid 36 and name HN )(resid 34 and name HB2 ) 0.0 0.0 3.2 !E37 assign(resid 37 and name HN )(resid 38 and name HN ) 3.2 0.0 5.0 assign(resid 37 and name HN )(resid 37 and name HA ) 0.0 0.0 3.2 !I38 assign(resid 38 and name HN )(resid 38 and name HA ) 0.0 0.0 3.2 assign(resid 38 and name HN )(resid 37 and name HA ) 0.0 0.0 2.7 assign(resid 38 and name HN )(resid 59 and name HN ) 0.0 0.0 3.5 assign(resid 38 and name HN )(resid 61 and name HN ) 3.2 0.0 5.0 !assign(resid 38 and name HN )(resid 59 and name HD2+ ) 0.0 0.0 5.8 !T39 assign(resid 39 and name HN )(resid 39 and name HA ) 0.0 0.0 3.2 assign(resid 39 and name HN )(resid 38 and name HA ) 0.0 0.0 2.7 assign(resid 39 and name HA )(resid 58 and name HA ) 0.0 0.0 2.7 assign(resid 39 and name HN )(resid 38 and name HG2+ ) 0.0 0.0 4.0 assign(resid 39 and name HN )(resid 32 and name HB+ ) 0.0 0.0 4.8 assign(resid 39 and name HN )(resid 33 and name HD1+ ) 0.0 0.0 5.8 assign(resid 39 and name HA )(resid 58 and name HG1+ ) 0.0 0.0 4.0 assign(resid 39 and name HB )(resid 32 and name HB+ ) 0.0 0.0 3.5 !I40 assign(resid 40 and name HN )(resid 40 and name HA ) 2.7 0.0 5.0 assign(resid 40 and name HN )(resid 39 and name HA ) 0.0 0.0 2.7 assign(resid 40 and name HN )(resid 57 and name HN ) 0.0 0.0 3.5 assign(resid 40 and name HN )(resid 57 and name HB ) 0.0 0.0 3.2 assign(resid 40 and name HN )(resid 58 and name HA ) 0.0 0.0 4.0 assign(resid 40 and name HG2+ )(resid 29 and name HA ) 0.0 0.0 4.8 assign(resid 40 and name HG2+ )(resid 58 and name HA ) 3.2 0.0 5.8 assign(resid 40 and name HD1+ )(resid 26 and name HE2 ) 0.0 0.0 4.0 assign(resid 40 and name HD1+ )(resid 26 and name HD2 ) 0.0 0.0 4.0 !V41 assign(resid 41 and name HN )(resid 42 and name HN ) 3.2 0.0 5.0 assign(resid 41 and name HN )(resid 41 and name HA ) 2.7 0.0 5.0 assign(resid 41 and name HN )(resid 40 and name HA ) 0.0 0.0 2.7 assign(resid 41 and name HN )(resid 30 and name HA ) 0.0 0.0 4.0 assign(resid 41 and name HN )(resid 40 and name HG2+ ) 2.7 0.0 4.8 assign(resid 41 and name HG2+ )(resid 30 and name HN ) 3.2 0.0 5.7 !R42 assign(resid 42 and name HN )(resid 42 and name HA ) 0.0 0.0 2.7 assign(resid 42 and name HN )(resid 41 and name HA ) 0.0 0.0 3.2 assign(resid 42 and name HN )(resid 41 and name HB ) 0.0 0.0 2.7 assign(resid 42 and name HN )(resid 42 and name HG+ ) 0.0 0.0 4.0 assign(resid 42 and name HN )(resid 42 and name HD+ ) 0.0 0.0 4.0 !A43 assign(resid 43 and name HN )(resid 44 and name HN ) 3.2 0.0 5.0 assign(resid 43 and name HN )(resid 42 and name HN ) 0.0 0.0 3.2 assign(resid 43 and name HN )(resid 43 and name HA ) 2.7 0.0 5.0 assign(resid 43 and name HN )(resid 42 and name HA ) 0.0 0.0 2.7 !assign(resid 43 and name HA )(resid 28 and name HA1 ) 0.0 0.0 3.2 !assign(resid 43 and name HA )(resid 28 and name HA2 ) 0.0 0.0 2.7 !assign(resid 43 and name HN )(resid 57 and name HG2+ ) 0.0 0.0 4.7 !assign(resid 43 and name HN )(resid 55 and name HA ) 0.0 0.0 5.0 assign(resid 43 and name HN )(resid 50 and name HDd+ ) 0.0 0.0 4.0 !F44 assign(resid 44 and name HN )(resid 44 and name HA ) 2.7 0.0 5.0 assign(resid 44 and name HN )(resid 43 and name HA ) 0.0 0.0 2.7 assign(resid 44 and name HN )(resid 45 and name HN ) 3.2 0.0 5.0 assign(resid 44 and name HA )(resid 49 and name HA ) 0.0 0.0 2.7 assign(resid 44 and name HN )(resid 44 and name HD2 ) 3.2 0.0 5.0 assign(resid 44 and name HN )(resid 44 and name HD1 ) 4.0 0.0 5.0 assign(resid 44 and name HN )(resid 40 and name HD1+ ) 0.0 0.0 4.7 assign(resid 44 and name HN )(resid 57 and name HG2+ ) 5.0 0.0 5.5 !R45 assign(resid 45 and name HN )(resid 46 and name HN ) 3.2 0.0 5.0 assign(resid 45 and name HN )(resid 48 and name HN ) 0.0 0.0 3.5 assign(resid 45 and name HN )(resid 44 and name HA ) 0.0 0.0 2.7 assign(resid 45 and name HN )(resid 45 and name HA ) 0.0 0.0 3.2 assign(resid 45 and name HN )(resid 49 and name HA ) 2.7 0.0 5.0 assign(resid 45 and name HN )(resid 44 and name HD1 ) 3.2 0.0 5.0 !N46 assign(resid 46 and name HN )(resid 46 and name HA ) 0.0 0.0 2.7 assign(resid 46 and name HN )(resid 45 and name HA ) 0.0 0.0 2.7 assign(resid 46 and name HN )(resid 26 and name HA ) 0.0 0.0 4.0 assign(resid 46 and name HN )(resid 25 and name HG2+ ) 0.0 0.0 5.7 assign(resid 46 and name HD21 )(resid 25 and name HG2+ ) 0.0 0.0 5.0 assign(resid 46 and name HD22 )(resid 25 and name HG2+ ) 3.2 0.0 5.0 !G47 assign(resid 47 and name HN )(resid 46 and name HN ) 2.7 0.0 5.0 assign(resid 47 and name HN )(resid 48 and name HN ) 0.0 0.0 2.7 assign(resid 47 and name HN )(resid 47 and name HA2 ) 0.0 0.0 2.7 assign(resid 47 and name HN )(resid 47 and name HA1 ) 2.7 0.0 5.0 assign(resid 47 and name HN )(resid 25 and name HN ) 3.2 0.0 5.0 assign(resid 47 and name HN )(resid 25 and name HB ) 2.7 0.0 5.0 assign(resid 47 and name HN )(resid 46 and name HA ) 0.0 0.0 3.2 assign(resid 47 and name HN )(resid 26 and name HA ) 4.0 0.0 5.0 !V48 assign(resid 48 and name HN )(resid 48 and name HA ) 2.7 0.0 5.0 !assign(resid 48 and name HN )(resid 47 and name HAd ) 0.0 0.0 2.7 !assign(resid 48 and name HN )(resid 47 and name HAu ) 2.7 0.0 5.0 !assign(resid 48 and name HN )(resid 49 and name HD1 ) 0.0 0.0 4.0 assign(resid 48 and name HN )(resid 44 and name HD1 ) 0.0 0.0 5.0 !P49 assign(resid 49 and name HD1 )(resid 48 and name HG2+ ) 0.0 0.0 4.0 !L50 assign(resid 50 and name HN )(resid 49 and name HA ) 0.0 0.0 2.7 assign(resid 50 and name HN )(resid 50 and name HA ) 0.0 0.0 3.2 assign(resid 50 and name HN )(resid 44 and name HA ) 0.0 0.0 4.0 assign(resid 50 and name HN )(resid 45 and name HN ) 3.2 0.0 5.0 assign(resid 50 and name HN )(resid 50 and name HG ) 0.0 0.0 2.7 assign(resid 50 and name HN )(resid 44 and name HD2 ) 4.0 0.0 1.0 !A55 assign(resid 55 and name HN )(resid 56 and name HN ) 3.2 0.0 5.0 assign(resid 55 and name HN )(resid 55 and name HA ) 0.0 0.0 3.2 assign(resid 55 and name HN )(resid 55 and name HB+ ) 0.0 0.0 3.5 assign(resid 55 and name HN )(resid 43 and name HN ) 4.0 0.0 1.0 assign(resid 55 and name HN )(resid 42 and name HN ) 4.0 0.0 1.0 !E56 assign(resid 56 and name HN )(resid 57 and name HN ) 3.2 0.0 5.0 assign(resid 56 and name HN )(resid 56 and name HA ) 2.7 0.0 5.0 assign(resid 56 and name HN )(resid 55 and name HA ) 0.0 0.0 2.7 assign(resid 56 and name HA )(resid 41 and name HG1+ ) 0.0 0.0 4.0 !assign(resid 56 and name HA )(resid 56 and name HG2 ) 0.0 0.0 2.7 !V57 assign(resid 57 and name HN )(resid 58 and name HN ) 3.2 0.0 5.0 assign(resid 57 and name HN )(resid 57 and name HA ) 2.7 0.0 5.0 assign(resid 57 and name HN )(resid 56 and name HA ) 0.0 0.0 2.7 !assign(resid 57 and name HN )(resid 56 and name HG1 ) 3.2 0.0 5.0 assign(resid 57 and name HN )(resid 40 and name HG1+ ) 0.0 0.0 4.0 assign(resid 57 and name HG1+ )(resid 26 and name HE1 ) 0.0 0.0 4.7 assign(resid 57 and name HG1+ )(resid 26 and name HD1 ) 0.0 0.0 4.7 !V58 assign(resid 58 and name HN )(resid 59 and name HN ) 3.2 0.0 5.0 assign(resid 58 and name HN )(resid 58 and name HA ) 2.7 0.0 5.0 assign(resid 58 and name HN )(resid 57 and name HA ) 0.0 0.0 2.7 assign(resid 58 and name HN )(resid 59 and name HD1+ ) 0.0 0.0 4.8 !L59 assign(resid 59 and name HN )(resid 59 and name HA ) 2.7 0.0 5.0 assign(resid 59 and name HN )(resid 58 and name HA ) 0.0 0.0 2.7 assign(resid 59 and name HN )(resid 39 and name HA ) 0.0 0.0 4.0 assign(resid 59 and name HN )(resid 58 and name HG1+ ) 0.0 0.0 3.5 assign(resid 59 and name HD2+ )(resid 26 and name HD1 ) 4.0 0.0 1.0 assign(resid 59 and name HD2+ )(resid 26 and name HE1 ) 4.0 0.0 1.0 assign(resid 59 and name HD2+ )(resid 26 and name HBu ) 0.0 0.0 4.0 !K60 assign(resid 60 and name HN )(resid 61 and name HN ) 3.2 0.0 5.0 assign(resid 60 and name HN )(resid 63 and name HN ) 3.2 0.0 5.0 assign(resid 60 and name HN )(resid 60 and name HA ) 2.7 0.0 5.0 assign(resid 60 and name HN )(resid 59 and name HA ) 0.0 0.0 2.7 assign(resid 60 and name HN )(resid 59 and name HD2+ ) 0.0 0.0 4.0 assign(resid 60 and name HA )(resid 37 and name HA ) 0.0 0.0 2.7 assign(resid 60 and name HN )(resid 63 and name HB+ ) 0.0 0.0 4.8 !C61 assign(resid 61 and name HN )(resid 62 and name HN ) 2.7 0.0 5.0 assign(resid 61 and name HN )(resid 61 and name HA ) 0.0 0.0 3.2 assign(resid 61 and name HN )(resid 60 and name HA ) 0.0 0.0 2.7 assign(resid 61 and name HN )(resid 37 and name HA ) 0.0 0.0 2.7 assign(resid 61 and name HN )(resid 64 and name HD1+ ) 3.2 0.0 1.5 !T62 assign(resid 62 and name HN )(resid 63 and name HN ) 0.0 0.0 3.2 assign(resid 62 and name HN )(resid 62 and name HA ) 2.7 0.0 5.0 assign(resid 62 and name HN )(resid 61 and name HA ) 3.2 0.0 5.0 assign(resid 62 and name HN )(resid 60 and name HB+ ) 0.0 0.0 4.0 assign(resid 62 and name HN )(resid 64 and name HD1+ ) 4.0 0.0 5.0 !D63 assign(resid 63 and name HN )(resid 64 and name HN ) 0.0 0.0 2.7 assign(resid 63 and name HN )(resid 63 and name HA ) 0.0 0.0 3.2 assign(resid 63 and name HN )(resid 62 and name HA ) 3.2 0.0 5.0 assign(resid 63 and name HN )(resid 63 and name HB+ ) 0.0 0.0 3.5 assign(resid 63 and name HN )(resid 62 and name HB ) 3.2 0.0 5.0 assign(resid 63 and name HN )(resid 60 and name HB+ ) 0.0 0.0 4.0 assign(resid 63 and name HN )(resid 60 and name HA ) 3.2 0.0 5.0 assign(resid 63 and name HN )(resid 61 and name HA ) 3.2 0.0 5.0 !I64 assign(resid 64 and name HN )(resid 65 and name HN ) 3.2 0.0 5.0 assign(resid 64 and name HN )(resid 63 and name HA ) 2.7 0.0 5.0 assign(resid 64 and name HN )(resid 64 and name HA ) 0.0 0.0 3.2 assign(resid 64 and name HN )(resid 61 and name HA ) 0.0 0.0 3.5 assign(resid 64 and name HA )(resid 19 and name HA ) 0.0 0.0 3.2 !R65 assign(resid 65 and name HN )(resid 66 and name HN ) 0.0 0.0 2.7 assign(resid 65 and name HN )(resid 65 and name HA ) 2.7 0.0 5.0 assign(resid 65 and name HN )(resid 64 and name HA ) 0.0 0.0 2.7 assign(resid 65 and name HN )(resid 19 and name HA ) 0.0 0.0 3.5 assign(resid 65 and name HN )(resid 20 and name HN ) 0.0 0.0 4.0 assign(resid 65 and name HN )(resid 64 and name HG2+ ) 0.0 0.0 3.5 assign(resid 65 and name HA )(resid 65 and name HD+ ) 0.0 0.0 3.5 !S66 assign(resid 66 and name HN )(resid 67 and name HN ) 3.2 0.0 5.0 assign(resid 66 and name HN )(resid 66 and name HA ) 2.7 0.0 5.0 assign(resid 66 and name HN )(resid 65 and name HA ) 2.7 0.0 5.0 assign(resid 66 and name HN )(resid 19 and name HA ) 0.0 0.0 5.0 assign(resid 66 and name HN )(resid 64 and name HG2+ ) 0.0 0.0 4.0 assign(resid 66 and name HN )(resid 17 and name HG2+ ) 0.0 0.0 4.8 assign(resid 66 and name HN )(resid 65 and name HB+ ) 0.0 0.0 3.5 assign(resid 66 and name HA )(resid 67 and name HG11 ) 0.0 0.0 4.0 !I67 assign(resid 67 and name HN )(resid 68 and name HN ) 3.2 0.0 5.0 assign(resid 67 and name HN )(resid 67 and name HA ) 2.7 0.0 5.0 assign(resid 67 and name HN )(resid 66 and name HA ) 0.0 0.0 2.7 assign(resid 67 and name HG2+ )(resid 16 and name HA ) 0.0 0.0 5.8 assign(resid 67 and name HG2+ )(resid 15 and name HA ) 0.0 0.0 5.8 !D68 assign(resid 68 and name HN )(resid 68 and name HA ) 2.7 0.0 5.0 assign(resid 68 and name HN )(resid 67 and name HA ) 0.0 0.0 2.7 assign(resid 68 and name HN )(resid 17 and name HA ) 0.0 0.0 4.0 assign(resid 68 and name HN )(resid 16 and name HB1 ) 0.0 0.0 5.0 !L69 assign(resid 69 and name HN )(resid 69 and name HA ) 2.7 0.0 5.0 assign(resid 69 and name HN )(resid 68 and name HA ) 0.0 0.0 2.7 assign(resid 69 and name HN )(resid 69 and name HG ) 0.0 0.0 3.2 assign(resid 69 and name HA )(resid 15 and name HA ) 0.0 0.0 2.7 assign(resid 69 and name HA )(resid 15 and name HB ) 0.0 0.0 3.2 assign(resid 69 and name HD2+ )(resid 10 and name HA ) 0.0 0.0 4.8 !I70 assign(resid 70 and name HN )(resid 69 and name HN ) 3.2 0.0 5.0 assign(resid 70 and name HN )(resid 71 and name HN ) 0.0 0.0 3.2 assign(resid 70 and name HN )(resid 70 and name HA ) 2.7 0.0 5.0 assign(resid 70 and name HN )(resid 69 and name HA ) 0.0 0.0 2.7 assign(resid 70 and name HN )(resid 15 and name HA ) 0.0 0.0 3.2 assign(resid 70 and name HG2+ )(resid 15 and name HA ) 2.7 0.0 5.0 !E71 assign(resid 71 and name HN )(resid 71 and name HA ) 2.7 0.0 5.0 assign(resid 71 and name HN )(resid 70 and name HA ) 2.7 0.0 5.0 assign(resid 71 and name HN )(resid 14 and name HB+ ) 0.0 0.0 4.8 assign(resid 71 and name HN )(resid 15 and name HA ) 3.2 0.0 1.8 assign(resid 71 and name HA )(resid 72 and name HD+ ) 0.0 0.0 3.5 assign(resid 71 and name HN )(resid 72 and name HD1 ) 3.2 0.0 5.0 assign(resid 71 and name HN )(resid 72 and name HD2 ) 3.2 0.0 5.0 ! xxx !assign(resid xx and name HN )(resid xx and name HA ) 2.7 0.0 5.0 !assign(resid xx and name HN )(resid xx and name HA ) 3.2 0.0 5.0 !assign(resid xx and name HN )(resid xx and name HN ) 3.2 0.0 5.0 !L102 !G103
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