NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
1977 |
1bah   |
cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (resid 2 and name HB2 ) (resid 2 and name HA ) 2.89 0.72 0.72 assign (resid 2 and name HB2 ) (resid 2 and name HB3 ) 1.90 0.48 0.47 assign (resid 2 and name HB3 ) (resid 2 and name HA ) 2.72 0.68 0.68 assign (resid 2 and name HN ) (resid 2 and name HA ) 3.17 0.79 0.79 assign (resid 2 and name HN ) (resid 2 and name HB2 ) 2.62 0.65 0.66 assign (resid 2 and name HN ) (resid 2 and name HB3 ) 2.95 0.74 0.74 assign (resid 3 and name HG1 ) (resid 3 and name HG2* ) 5.16 3.36 1.29 assign (resid 3 and name HG2* ) (resid 3 and name HG1 ) 3.57 1.77 0.89 assign (resid 3 and name HN ) (resid 3 and name HA ) 3.43 0.86 0.86 assign (resid 3 and name HN ) (resid 3 and name HG1 ) 3.09 0.77 0.78 assign (resid 3 and name HN ) (resid 3 and name HG2* ) 3.38 1.58 0.84 assign (resid 4 and name HB2 ) (resid 4 and name HA ) 2.64 0.66 0.66 assign (resid 4 and name HB3 ) (resid 4 and name HA ) 2.65 0.66 0.67 assign (resid 4 and name HN ) (resid 4 and name HA ) 3.16 0.79 0.79 assign (resid 4 and name HN ) (resid 4 and name HB2 ) 3.04 0.76 0.76 assign (resid 4 and name HN ) (resid 4 and name HB3 ) 2.93 0.73 0.73 assign (resid 5 and name HB ) (resid 5 and name HA ) 3.10 0.78 0.77 assign (resid 5 and name HG* ) (resid 5 and name HA ) 3.14 1.34 0.79 assign (resid 5 and name HG* ) (resid 5 and name HB ) 2.92 1.12 0.73 assign (resid 5 and name HN ) (resid 5 and name HA ) 2.87 0.72 0.71 assign (resid 5 and name HN ) (resid 5 and name HB ) 2.60 0.65 0.65 assign (resid 5 and name HN ) (resid 5 and name HG* ) 3.37 1.57 0.84 assign (resid 6 and name HB3 ) (resid 6 and name HA ) 2.59 0.64 0.65 assign (resid 6 and name HB2 ) (resid 6 and name HA ) 2.80 0.70 0.70 assign (resid 6 and name HN ) (resid 6 and name HA ) 3.21 0.80 0.80 assign (resid 6 and name HN ) (resid 6 and name HB3 ) 2.77 0.69 0.69 assign (resid 7 and name HB3 ) (resid 7 and name HA ) 2.87 0.72 0.72 assign (resid 7 and name HB2 ) (resid 7 and name HA ) 2.63 0.66 0.65 assign (resid 7 and name HN ) (resid 7 and name HA ) 3.22 0.80 0.81 assign (resid 7 and name HN ) (resid 7 and name HB3 ) 3.80 0.95 0.96 assign (resid 7 and name HN ) (resid 7 and name HB2 ) 4.42 1.10 1.11 assign (resid 8 and name HB ) (resid 8 and name HA ) 3.27 0.81 0.82 assign (resid 8 and name HG2* ) (resid 8 and name HA ) 3.10 1.30 0.77 assign (resid 8 and name HG2* ) (resid 8 and name HB ) 2.69 0.89 0.67 assign (resid 8 and name HN ) (resid 8 and name HA ) 3.10 0.78 0.77 assign (resid 8 and name HN ) (resid 8 and name HB ) 3.23 0.80 0.81 assign (resid 8 and name HN ) (resid 8 and name HG2* ) 3.71 1.91 0.92 assign (resid 9 and name HB ) (resid 9 and name HA ) 3.27 0.82 0.82 assign (resid 9 and name HG2* ) (resid 9 and name HA ) 2.97 1.17 0.75 assign (resid 9 and name HG2* ) (resid 9 and name HB ) 3.06 1.26 0.76 assign (resid 9 and name HN ) (resid 9 and name HA ) 2.90 0.72 0.73 assign (resid 9 and name HN ) (resid 9 and name HG2* ) 3.33 1.53 0.83 assign (resid 10 and name HN ) (resid 10 and name HA ) 2.47 0.62 0.62 assign (resid 10 and name HN ) (resid 10 and name HB* ) 4.25 2.45 1.06 assign (resid 11 and name HB* ) (resid 11 and name HA ) 2.73 0.93 0.68 assign (resid 11 and name HB* ) (resid 11 and name HE* ) 4.35 2.55 1.08 assign (resid 11 and name HG* ) (resid 11 and name HA ) 3.25 1.45 0.81 assign (resid 11 and name HG* ) (resid 11 and name HD* ) 3.65 1.85 0.91 assign (resid 11 and name HN ) (resid 11 and name HA ) 3.15 0.79 0.79 assign (resid 11 and name HN ) (resid 11 and name HB* ) 2.96 1.16 0.74 assign (resid 11 and name HN ) (resid 11 and name HG* ) 3.88 2.08 0.98 assign (resid 12 and name HB3 ) (resid 12 and name HA ) 2.84 0.71 0.71 assign (resid 12 and name HB2 ) (resid 12 and name HA ) 2.59 0.64 0.65 assign (resid 12 and name HG* ) (resid 12 and name HA ) 2.98 1.18 0.75 assign (resid 12 and name HN ) (resid 12 and name HA ) 2.51 0.62 0.63 assign (resid 12 and name HN ) (resid 12 and name HB2 ) 2.42 0.60 0.61 assign (resid 12 and name HN ) (resid 12 and name HG* ) 3.19 1.39 0.80 assign (resid 13 and name HB* ) (resid 13 and name HA ) 2.97 1.17 0.75 assign (resid 13 and name HG* ) (resid 13 and name HA ) 3.39 1.59 0.85 assign (resid 13 and name HG* ) (resid 13 and name HB* ) 3.12 1.32 0.78 assign (resid 13 and name HN ) (resid 13 and name HA ) 2.91 0.72 0.73 assign (resid 13 and name HN ) (resid 13 and name HB* ) 2.98 1.18 0.74 assign (resid 13 and name HN ) (resid 13 and name HG* ) 3.45 1.65 0.86 assign (resid 14 and name HB* ) (resid 14 and name HA ) 2.91 1.11 0.73 assign (resid 14 and name HD1 ) (resid 14 and name HA ) 2.77 0.69 0.69 assign (resid 14 and name HD1 ) (resid 14 and name HB* ) 3.10 1.30 0.78 assign (resid 14 and name HE1 ) (resid 14 and name HA ) 3.69 0.92 0.92 assign (resid 14 and name HE1 ) (resid 14 and name HD1 ) 2.53 0.63 0.64 assign (resid 14 and name HE1 ) (resid 14 and name HZ2 ) 2.87 0.72 0.72 assign (resid 14 and name HZ3 ) (resid 14 and name HE3 ) 2.47 0.62 0.61 assign (resid 14 and name HZ3 ) (resid 14 and name HH2 ) 1.97 0.49 0.50 assign (resid 14 and name HH2 ) (resid 14 and name HZ2 ) 2.27 0.57 0.57 assign (resid 14 and name HN ) (resid 14 and name HA ) 2.95 0.73 0.74 assign (resid 14 and name HN ) (resid 14 and name HB* ) 2.83 1.03 0.70 assign (resid 15 and name HB2 ) (resid 15 and name HA ) 2.85 0.72 0.71 assign (resid 15 and name HB2 ) (resid 15 and name HB3 ) 2.23 0.56 0.56 assign (resid 15 and name HB3 ) (resid 15 and name HA ) 2.52 0.63 0.63 assign (resid 15 and name HN ) (resid 15 and name HA ) 3.60 0.90 0.89 assign (resid 15 and name HN ) (resid 15 and name HB2 ) 3.52 0.88 0.88 assign (resid 16 and name HB ) (resid 16 and name HA ) 3.34 0.84 0.83 assign (resid 16 and name HG* ) (resid 16 and name HA ) 3.17 1.37 0.79 assign (resid 16 and name HG* ) (resid 16 and name HB ) 2.96 1.16 0.74 assign (resid 16 and name HN ) (resid 16 and name HA ) 2.75 0.69 0.69 assign (resid 16 and name HN ) (resid 16 and name HB ) 2.64 0.66 0.66 assign (resid 16 and name HN ) (resid 16 and name HG* ) 3.39 1.59 0.84 assign (resid 17 and name HB2 ) (resid 17 and name HA ) 2.92 0.73 0.73 assign (resid 17 and name HB2 ) (resid 17 and name HB3 ) 1.90 0.48 0.47 assign (resid 17 and name HB3 ) (resid 17 and name HA ) 2.85 0.71 0.72 assign (resid 17 and name HN ) (resid 17 and name HA ) 3.20 0.80 0.80 assign (resid 17 and name HN ) (resid 17 and name HB2 ) 2.84 0.71 0.71 assign (resid 17 and name HN ) (resid 17 and name HB3 ) 3.21 0.80 0.80 assign (resid 18 and name HB* ) (resid 18 and name HA ) 2.89 1.09 0.72 assign (resid 18 and name HG* ) (resid 18 and name HA ) 3.12 1.32 0.78 assign (resid 18 and name HN ) (resid 18 and name HA ) 2.97 0.74 0.74 assign (resid 18 and name HN ) (resid 18 and name HB* ) 2.66 0.86 0.67 assign (resid 18 and name HN ) (resid 18 and name HG* ) 3.39 1.59 0.84 assign (resid 19 and name HB* ) (resid 19 and name HA ) 2.70 0.90 0.67 assign (resid 19 and name HB* ) (resid 19 and name HE ) 3.15 1.35 0.79 assign (resid 19 and name HG* ) (resid 19 and name HE ) 3.10 1.30 0.77 assign (resid 19 and name HD* ) (resid 19 and name HA ) 3.33 1.53 0.83 assign (resid 19 and name HD* ) (resid 19 and name HE ) 3.30 1.50 0.82 assign (resid 19 and name HN ) (resid 19 and name HA ) 2.83 0.71 0.70 assign (resid 19 and name HN ) (resid 19 and name HG* ) 3.00 1.20 0.75 assign (resid 20 and name HB* ) (resid 20 and name HA ) 2.73 0.93 0.69 assign (resid 20 and name HG ) (resid 20 and name HA ) 3.16 0.79 0.79 assign (resid 20 and name HG ) (resid 20 and name HB* ) 2.42 0.62 0.60 assign (resid 20 and name HD* ) (resid 20 and name HA ) 3.28 1.48 0.81 assign (resid 20 and name HD* ) (resid 20 and name HB* ) 3.40 1.60 0.85 assign (resid 20 and name HN ) (resid 20 and name HA ) 2.90 0.73 0.72 assign (resid 20 and name HN ) (resid 20 and name HB* ) 2.77 0.97 0.69 assign (resid 20 and name HN ) (resid 20 and name HG ) 3.39 0.85 0.85 assign (resid 20 and name HN ) (resid 20 and name HD* ) 4.38 2.58 1.10 assign (resid 21 and name HB* ) (resid 21 and name HA ) 3.00 1.20 0.75 assign (resid 21 and name HB2 ) (resid 21 and name HB3 ) 2.24 0.56 0.56 assign (resid 21 and name HD2 ) (resid 21 and name HB* ) 3.44 1.64 0.87 assign (resid 21 and name HN ) (resid 21 and name HB* ) 3.06 1.26 0.77 assign (resid 21 and name HN ) (resid 21 and name HD1 ) 4.17 1.04 1.04 assign (resid 22 and name HB2 ) (resid 22 and name HA ) 3.07 0.76 0.77 assign (resid 22 and name HB3 ) (resid 22 and name HA ) 2.77 0.69 0.69 assign (resid 22 and name HN ) (resid 22 and name HA ) 2.52 0.63 0.63 assign (resid 23 and name HB ) (resid 23 and name HA ) 2.97 0.74 0.74 assign (resid 23 and name HB ) (resid 23 and name HG1 ) 4.06 2.01 1.02 assign (resid 23 and name HG2* ) (resid 23 and name HA ) 3.71 1.91 0.93 assign (resid 23 and name HG2* ) (resid 23 and name HB ) 3.16 1.36 0.79 assign (resid 23 and name HG2* ) (resid 23 and name HG1 ) 4.72 2.92 1.19 assign (resid 23 and name HN ) (resid 23 and name HA ) 3.48 0.87 0.87 assign (resid 23 and name HN ) (resid 23 and name HB ) 3.32 0.83 0.84 assign (resid 23 and name HN ) (resid 23 and name HG2* ) 3.32 1.52 0.84 assign (resid 24 and name HB* ) (resid 24 and name HA ) 2.76 0.96 0.69 assign (resid 24 and name HB* ) (resid 24 and name HG ) 4.08 2.28 1.02 assign (resid 24 and name HN ) (resid 24 and name HA ) 3.09 0.77 0.77 assign (resid 24 and name HN ) (resid 24 and name HB* ) 3.01 1.21 0.75 assign (resid 24 and name HN ) (resid 24 and name HG ) 4.50 1.13 1.12 assign (resid 25 and name HB* ) (resid 25 and name HA ) 3.69 1.89 0.93 assign (resid 25 and name HG* ) (resid 25 and name HA ) 3.32 1.52 0.83 assign (resid 25 and name HG* ) (resid 25 and name HE ) 3.34 1.54 0.84 assign (resid 25 and name HD* ) (resid 25 and name HA ) 3.08 1.28 0.77 assign (resid 25 and name HD* ) (resid 25 and name HE ) 2.59 0.79 0.65 assign (resid 25 and name HN ) (resid 25 and name HA ) 3.08 0.77 0.77 assign (resid 25 and name HN ) (resid 25 and name HB* ) 3.13 1.33 0.78 assign (resid 25 and name HN ) (resid 25 and name HG* ) 4.02 2.22 1.00 assign (resid 25 and name HN ) (resid 25 and name HD* ) 3.36 1.56 0.84 assign (resid 26 and name HA1 ) (resid 26 and name HA2 ) 2.66 0.86 0.67 assign (resid 26 and name HN ) (resid 26 and name HA* ) 3.71 1.91 0.92 assign (resid 27 and name HB* ) (resid 27 and name HA ) 3.38 1.58 0.85 assign (resid 27 and name HG* ) (resid 27 and name HA ) 3.51 1.71 0.87 assign (resid 27 and name HG* ) (resid 27 and name HE* ) 3.66 1.86 0.91 assign (resid 27 and name HD* ) (resid 27 and name HE* ) 3.39 1.59 0.85 assign (resid 27 and name HN ) (resid 27 and name HA ) 3.31 0.83 0.83 assign (resid 27 and name HN ) (resid 27 and name HB* ) 3.16 1.36 0.79 assign (resid 27 and name HN ) (resid 27 and name HG* ) 3.89 2.09 0.97 assign (resid 27 and name HN ) (resid 27 and name HD* ) 5.33 3.53 1.33 assign (resid 28 and name HB2 ) (resid 28 and name HB3 ) 2.11 0.53 0.53 assign (resid 28 and name HB3 ) (resid 28 and name HA ) 2.65 0.66 0.66 assign (resid 28 and name HN ) (resid 28 and name HA ) 3.46 0.86 0.87 assign (resid 28 and name HN ) (resid 28 and name HB3 ) 2.87 0.72 0.71 assign (resid 29 and name HB3 ) (resid 29 and name HA ) 2.78 0.70 0.69 assign (resid 29 and name HB3 ) (resid 29 and name HB2 ) 1.95 0.49 0.48 assign (resid 29 and name HB3 ) (resid 29 and name HG* ) 2.75 0.95 0.69 assign (resid 29 and name HB2 ) (resid 29 and name HA ) 2.81 0.70 0.71 assign (resid 29 and name HB2 ) (resid 29 and name HG* ) 2.37 0.57 0.60 assign (resid 29 and name HG* ) (resid 29 and name HA ) 2.92 1.12 0.73 assign (resid 29 and name HN ) (resid 29 and name HA ) 3.39 0.85 0.84 assign (resid 29 and name HN ) (resid 29 and name HB3 ) 2.90 0.73 0.72 assign (resid 29 and name HN ) (resid 29 and name HB2 ) 3.22 0.81 0.80 assign (resid 30 and name HB3 ) (resid 30 and name HA ) 2.80 0.70 0.69 assign (resid 30 and name HB3 ) (resid 30 and name HB2 ) 1.74 0.43 0.44 assign (resid 30 and name HB2 ) (resid 30 and name HA ) 2.57 0.64 0.64 assign (resid 30 and name HN ) (resid 30 and name HA ) 2.76 0.69 0.69 assign (resid 30 and name HN ) (resid 30 and name HB3 ) 3.69 0.92 0.92 assign (resid 30 and name HN ) (resid 30 and name HB2 ) 3.76 0.94 0.94 assign (resid 31 and name HB2 ) (resid 31 and name HA ) 2.82 0.71 0.70 assign (resid 31 and name HB3 ) (resid 31 and name HA ) 2.65 0.66 0.67 assign (resid 31 and name HG* ) (resid 31 and name HA ) 2.92 1.12 0.74 assign (resid 31 and name HG* ) (resid 31 and name HE* ) 3.18 1.38 0.80 assign (resid 31 and name HD* ) (resid 31 and name HA ) 3.92 2.12 0.98 assign (resid 31 and name HN ) (resid 31 and name HA ) 2.38 0.59 0.60 assign (resid 31 and name HN ) (resid 31 and name HB2 ) 3.36 0.84 0.84 assign (resid 31 and name HN ) (resid 31 and name HB3 ) 2.95 0.74 0.73 assign (resid 31 and name HN ) (resid 31 and name HG* ) 3.07 1.27 0.77 assign (resid 31 and name HN ) (resid 31 and name HD* ) 3.88 2.08 0.97 assign (resid 32 and name HB2 ) (resid 32 and name HA ) 2.71 0.68 0.68 assign (resid 32 and name HB3 ) (resid 32 and name HA ) 2.93 0.73 0.74 assign (resid 32 and name HG* ) (resid 32 and name HA ) 3.34 1.54 0.83 assign (resid 32 and name HD* ) (resid 32 and name HA ) 3.67 1.87 0.92 assign (resid 32 and name HN ) (resid 32 and name HA ) 2.97 0.74 0.75 assign (resid 32 and name HN ) (resid 32 and name HG* ) 3.84 2.04 0.96 assign (resid 32 and name HN ) (resid 32 and name HD* ) 3.93 2.13 0.99 assign (resid 33 and name HB* ) (resid 33 and name HA ) 3.18 1.38 0.79 assign (resid 33 and name HG* ) (resid 33 and name HA ) 3.40 1.60 0.86 assign (resid 33 and name HG* ) (resid 33 and name HB* ) 3.23 1.43 0.80 assign (resid 33 and name HN ) (resid 33 and name HA ) 3.13 0.79 0.78 assign (resid 33 and name HN ) (resid 33 and name HB* ) 2.70 0.90 0.67 assign (resid 33 and name HN ) (resid 33 and name HG* ) 3.74 1.94 0.94 assign (resid 34 and name HB* ) (resid 34 and name HA ) 3.01 1.21 0.75 assign (resid 34 and name HG* ) (resid 34 and name HA ) 5.02 3.22 1.25 assign (resid 34 and name HD* ) (resid 34 and name HA ) 4.72 2.92 1.18 assign (resid 34 and name HN ) (resid 34 and name HA ) 2.87 0.72 0.72 assign (resid 34 and name HN ) (resid 34 and name HB* ) 2.91 1.11 0.73 assign (resid 35 and name HB3 ) (resid 35 and name HA ) 2.94 0.74 0.73 assign (resid 35 and name HB3 ) (resid 35 and name HB2 ) 2.22 0.55 0.56 assign (resid 35 and name HB2 ) (resid 35 and name HA ) 2.91 0.73 0.73 assign (resid 35 and name HN ) (resid 35 and name HA ) 3.48 0.87 0.87 assign (resid 35 and name HN ) (resid 35 and name HB3 ) 3.11 0.78 0.78 assign (resid 35 and name HN ) (resid 35 and name HB2 ) 3.36 0.84 0.84 assign (resid 36 and name HB2 ) (resid 36 and name HA ) 2.77 0.70 0.69 assign (resid 36 and name HB2 ) (resid 36 and name HB3 ) 2.09 0.52 0.53 assign (resid 36 and name HB3 ) (resid 36 and name HA ) 2.65 0.66 0.66 assign (resid 36 and name HD* ) (resid 36 and name HA ) 2.99 1.19 0.74 assign (resid 36 and name HD* ) (resid 36 and name HB2 ) 2.84 1.04 0.72 assign (resid 36 and name HD* ) (resid 36 and name HB3 ) 2.81 1.01 0.71 assign (resid 36 and name HE* ) (resid 36 and name HB3 ) 4.12 2.32 1.03 assign (resid 36 and name HE* ) (resid 36 and name HD* ) 3.12 1.32 0.79 assign (resid 36 and name HN ) (resid 36 and name HA ) 3.21 0.80 0.80 assign (resid 36 and name HN ) (resid 36 and name HB2 ) 3.17 0.79 0.79 assign (resid 36 and name HN ) (resid 36 and name HB3 ) 3.44 0.86 0.86 assign (resid 36 and name HN ) (resid 36 and name HD* ) 3.55 1.75 0.89 assign (resid 37 and name HB* ) (resid 37 and name HA ) 2.94 1.14 0.73 assign (resid 37 and name HN ) (resid 37 and name HA ) 2.84 0.71 0.71 assign (resid 37 and name HN ) (resid 37 and name HB* ) 3.06 1.26 0.77 assign (resid 3 and name HN ) (resid 2 and name HA ) 2.52 0.63 0.63 assign (resid 3 and name HN ) (resid 2 and name HB2 ) 3.75 0.93 0.94 assign (resid 3 and name HN ) (resid 2 and name HB3 ) 3.50 0.87 0.88 assign (resid 4 and name HN ) (resid 3 and name HA ) 2.69 0.68 0.67 assign (resid 4 and name HN ) (resid 3 and name HB ) 2.59 0.65 0.65 assign (resid 4 and name HN ) (resid 3 and name HG1 ) 4.08 1.02 1.02 assign (resid 4 and name HN ) (resid 3 and name HG2* ) 4.03 2.23 1.01 assign (resid 4 and name HN ) (resid 3 and name HN ) 4.47 1.12 1.12 assign (resid 5 and name HN ) (resid 4 and name HA ) 3.34 0.84 0.83 assign (resid 5 and name HN ) (resid 4 and name HB2 ) 4.30 1.08 1.07 assign (resid 5 and name HN ) (resid 4 and name HB3 ) 4.19 1.05 1.05 assign (resid 4 and name HN ) (resid 5 and name HB ) 4.23 1.06 1.05 assign (resid 4 and name HN ) (resid 5 and name HG* ) 4.49 2.69 1.13 assign (resid 4 and name HN ) (resid 5 and name HN ) 2.95 0.74 0.74 assign (resid 6 and name HN ) (resid 5 and name HA ) 2.17 0.54 0.55 assign (resid 6 and name HN ) (resid 5 and name HB ) 3.75 0.94 0.94 assign (resid 6 and name HN ) (resid 5 and name HG* ) 3.62 1.82 0.91 assign (resid 6 and name HN ) (resid 5 and name HN ) 3.68 0.92 0.92 assign (resid 7 and name HN ) (resid 6 and name HA ) 2.37 0.60 0.59 assign (resid 7 and name HN ) (resid 6 and name HB3 ) 3.12 0.78 0.79 assign (resid 7 and name HN ) (resid 6 and name HB2 ) 3.02 0.76 0.75 assign (resid 6 and name HN ) (resid 7 and name HN ) 4.35 1.08 1.09 assign (resid 8 and name HN ) (resid 7 and name HA ) 2.53 0.63 0.63 assign (resid 8 and name HN ) (resid 7 and name HB3 ) 3.20 0.80 0.80 assign (resid 8 and name HN ) (resid 7 and name HB2 ) 3.00 0.75 0.75 assign (resid 8 and name HN ) (resid 7 and name HN ) 4.04 1.01 1.01 assign (resid 9 and name HN ) (resid 8 and name HA ) 3.14 0.79 0.78 assign (resid 9 and name HN ) (resid 8 and name HB ) 2.99 0.75 0.75 assign (resid 8 and name HN ) (resid 9 and name HN ) 2.53 0.63 0.64 assign (resid 10 and name HN ) (resid 9 and name HB ) 3.35 0.84 0.84 assign (resid 10 and name HN ) (resid 9 and name HG2* ) 4.80 3.00 1.19 assign (resid 11 and name HN ) (resid 10 and name HA ) 2.46 0.62 0.61 assign (resid 11 and name HN ) (resid 10 and name HB* ) 4.43 2.63 1.11 assign (resid 10 and name HN ) (resid 11 and name HN ) 4.81 1.20 1.20 assign (resid 12 and name HN ) (resid 11 and name HG* ) 4.35 2.55 1.09 assign (resid 11 and name HN ) (resid 12 and name HN ) 3.95 2.00 0.99 assign (resid 13 and name HN ) (resid 12 and name HB2 ) 2.91 0.73 0.72 assign (resid 12 and name HN ) (resid 13 and name HN ) 3.25 0.81 0.81 assign (resid 14 and name HN ) (resid 13 and name HA ) 3.34 0.84 0.83 assign (resid 14 and name HN ) (resid 13 and name HG* ) 4.76 2.96 1.18 assign (resid 14 and name HN ) (resid 13 and name HN ) 2.89 0.72 0.72 assign (resid 14 and name HB* ) (resid 15 and name HA ) 4.04 2.24 1.01 assign (resid 15 and name HN ) (resid 14 and name HB* ) 3.74 1.94 0.94 assign (resid 14 and name HN ) (resid 15 and name HN ) 3.51 0.88 0.87 assign (resid 16 and name HN ) (resid 15 and name HA ) 3.18 0.80 0.79 assign (resid 15 and name HN ) (resid 16 and name HN ) 2.32 0.58 0.58 assign (resid 17 and name HN ) (resid 16 and name HA ) 3.79 0.95 0.95 assign (resid 17 and name HN ) (resid 16 and name HB ) 2.86 0.71 0.72 assign (resid 16 and name HG* ) (resid 17 and name HA ) 4.26 2.46 1.06 assign (resid 17 and name HN ) (resid 16 and name HG* ) 3.99 2.19 1.00 assign (resid 17 and name HN ) (resid 16 and name HN ) 3.07 0.77 0.77 assign (resid 18 and name HN ) (resid 17 and name HA ) 3.74 0.94 0.93 assign (resid 18 and name HN ) (resid 17 and name HB2 ) 3.07 0.77 0.76 assign (resid 18 and name HN ) (resid 17 and name HB3 ) 3.70 0.92 0.93 assign (resid 17 and name HN ) (resid 18 and name HN ) 3.13 0.78 0.79 assign (resid 19 and name HN ) (resid 18 and name HA ) 3.32 0.83 0.83 assign (resid 19 and name HN ) (resid 18 and name HG* ) 3.65 1.85 0.92 assign (resid 18 and name HN ) (resid 19 and name HN ) 3.10 0.78 0.77 assign (resid 20 and name HN ) (resid 19 and name HB* ) 3.79 1.99 0.94 assign (resid 19 and name HN ) (resid 20 and name HD* ) 6.51 4.71 1.63 assign (resid 20 and name HN ) (resid 19 and name HN ) 3.33 0.83 0.83 assign (resid 21 and name HD2 ) (resid 20 and name HA ) 4.28 1.07 1.07 assign (resid 21 and name HN ) (resid 20 and name HA ) 3.35 0.84 0.84 assign (resid 21 and name HD2 ) (resid 20 and name HB* ) 3.56 1.76 0.89 assign (resid 21 and name HN ) (resid 20 and name HB* ) 3.09 1.29 0.77 assign (resid 21 and name HD2 ) (resid 20 and name HG ) 3.43 0.86 0.86 assign (resid 21 and name HN ) (resid 20 and name HG ) 3.54 0.89 0.88 assign (resid 21 and name HD2 ) (resid 20 and name HD* ) 4.90 3.10 1.22 assign (resid 21 and name HN ) (resid 20 and name HD* ) 4.63 2.83 1.15 assign (resid 20 and name HN ) (resid 21 and name HN ) 3.03 0.76 0.75 assign (resid 22 and name HN ) (resid 21 and name HA ) 4.19 1.05 1.04 assign (resid 21 and name HB2 ) (resid 22 and name HA ) 3.66 1.86 0.94 assign (resid 22 and name HN ) (resid 21 and name HB* ) 3.40 1.60 0.85 assign (resid 21 and name HN ) (resid 22 and name HN ) 2.57 0.65 0.64 assign (resid 23 and name HN ) (resid 22 and name HA ) 2.90 0.72 0.73 assign (resid 22 and name HN ) (resid 23 and name HN ) 3.37 0.84 0.84 assign (resid 24 and name HN ) (resid 23 and name HA ) 2.52 0.63 0.63 assign (resid 24 and name HN ) (resid 23 and name HB ) 2.99 0.75 0.75 assign (resid 24 and name HN ) (resid 23 and name HG2* ) 4.13 2.33 1.03 assign (resid 24 and name HN ) (resid 23 and name HN ) 3.96 0.99 0.99 assign (resid 25 and name HN ) (resid 24 and name HA ) 4.03 1.00 1.01 assign (resid 24 and name HN ) (resid 25 and name HD* ) 4.61 2.81 1.15 assign (resid 24 and name HN ) (resid 25 and name HN ) 2.79 0.99 0.70 assign (resid 26 and name HN ) (resid 25 and name HA ) 2.46 0.62 0.61 assign (resid 26 and name HN ) (resid 25 and name HB* ) 4.22 2.42 1.06 assign (resid 26 and name HN ) (resid 25 and name HG* ) 4.31 2.51 1.08 assign (resid 26 and name HN ) (resid 25 and name HD* ) 4.73 2.93 1.19 assign (resid 27 and name HN ) (resid 26 and name HA* ) 2.87 1.07 0.72 assign (resid 27 and name HN ) (resid 26 and name HN ) 4.34 1.08 1.09 assign (resid 28 and name HN ) (resid 27 and name HA ) 2.56 0.64 0.64 assign (resid 28 and name HN ) (resid 27 and name HB* ) 3.08 1.28 0.77 assign (resid 28 and name HN ) (resid 27 and name HG* ) 3.98 2.18 1.00 assign (resid 28 and name HN ) (resid 27 and name HD* ) 6.91 5.11 1.72 assign (resid 27 and name HN ) (resid 28 and name HN ) 4.25 1.06 1.06 assign (resid 29 and name HN ) (resid 28 and name HA ) 2.65 0.66 0.66 assign (resid 29 and name HN ) (resid 28 and name HB2 ) 3.12 0.78 0.78 assign (resid 29 and name HN ) (resid 28 and name HB3 ) 3.91 0.98 0.98 assign (resid 30 and name HN ) (resid 29 and name HA ) 2.74 0.68 0.69 assign (resid 30 and name HN ) (resid 29 and name HB3 ) 4.36 2.50 1.09 assign (resid 30 and name HN ) (resid 29 and name HB2 ) 3.78 0.94 0.95 assign (resid 30 and name HN ) (resid 29 and name HG* ) 4.80 3.00 1.21 assign (resid 30 and name HN ) (resid 29 and name HN ) 4.72 1.18 1.18 assign (resid 31 and name HN ) (resid 30 and name HA ) 2.73 0.68 0.68 assign (resid 30 and name HN ) (resid 31 and name HN ) 3.49 0.87 0.87 assign (resid 32 and name HN ) (resid 31 and name HA ) 3.05 0.76 0.77 assign (resid 32 and name HN ) (resid 31 and name HB2 ) 3.99 1.00 1.00 assign (resid 32 and name HN ) (resid 31 and name HB3 ) 3.92 0.98 0.98 assign (resid 32 and name HN ) (resid 31 and name HG* ) 4.38 2.58 1.09 assign (resid 31 and name HN ) (resid 32 and name HA ) 4.07 1.02 1.01 assign (resid 31 and name HN ) (resid 32 and name HN ) 3.08 0.81 0.77 assign (resid 33 and name HG* ) (resid 32 and name HA ) 5.31 3.51 1.33 assign (resid 33 and name HN ) (resid 32 and name HA ) 2.54 0.63 0.64 assign (resid 33 and name HN ) (resid 32 and name HN ) 4.53 1.13 1.13 assign (resid 34 and name HN ) (resid 33 and name HA ) 2.43 0.60 0.61 assign (resid 34 and name HN ) (resid 33 and name HG* ) 3.78 1.98 0.94 assign (resid 34 and name HN ) (resid 33 and name HN ) 3.66 0.92 0.91 assign (resid 35 and name HN ) (resid 34 and name HA ) 2.69 0.67 0.68 assign (resid 36 and name HB2 ) (resid 35 and name HA ) 3.84 0.96 0.96 assign (resid 36 and name HD* ) (resid 35 and name HA ) 3.63 1.83 0.91 assign (resid 36 and name HN ) (resid 35 and name HA ) 2.63 0.66 0.66 assign (resid 36 and name HN ) (resid 35 and name HB3 ) 3.67 0.92 0.92 assign (resid 36 and name HN ) (resid 35 and name HB2 ) 3.29 0.82 0.82 assign (resid 35 and name HN ) (resid 36 and name HB2 ) 4.09 1.02 1.02 assign (resid 37 and name HN ) (resid 36 and name HA ) 2.56 0.64 0.64 assign (resid 37 and name HN ) (resid 36 and name HD* ) 4.10 2.30 1.02 assign (resid 35 and name HN ) (resid 2 and name HA ) 4.07 1.02 1.02 assign (resid 5 and name HN ) (resid 3 and name HB ) 2.84 0.71 0.71 assign (resid 5 and name HB ) (resid 3 and name HG1 ) 3.68 0.92 0.92 assign (resid 5 and name HN ) (resid 3 and name HG1 ) 3.23 0.81 0.81 assign (resid 13 and name HG* ) (resid 3 and name HG1 ) 4.79 2.99 1.20 assign (resid 33 and name HG* ) (resid 3 and name HG1 ) 4.47 2.67 1.12 assign (resid 33 and name HN ) (resid 3 and name HG1 ) 3.54 0.88 0.89 assign (resid 5 and name HN ) (resid 3 and name HG2* ) 4.26 2.46 1.06 assign (resid 17 and name HN ) (resid 3 and name HG2* ) 4.33 2.53 1.08 assign (resid 21 and name HD2 ) (resid 3 and name HG2* ) 3.56 1.76 0.89 assign (resid 33 and name HN ) (resid 3 and name HN ) 4.98 1.24 1.25 assign (resid 3 and name HN ) (resid 34 and name HA ) 3.25 0.81 0.81 assign (resid 32 and name HB2 ) (resid 4 and name HA ) 2.63 0.66 0.66 assign (resid 32 and name HG* ) (resid 4 and name HA ) 3.88 2.08 0.98 assign (resid 32 and name HD* ) (resid 4 and name HA ) 3.63 1.83 0.91 assign (resid 33 and name HG* ) (resid 5 and name HB ) 4.13 2.33 1.03 assign (resid 33 and name HN ) (resid 5 and name HB ) 3.56 0.89 0.89 assign (resid 33 and name HN ) (resid 5 and name HG* ) 3.98 2.18 1.00 assign (resid 33 and name HG* ) (resid 5 and name HG* ) 4.12 2.32 1.02 assign (resid 33 and name HN ) (resid 6 and name HA ) 3.88 0.97 0.96 assign (resid 6 and name HB3 ) (resid 32 and name HA ) 3.62 0.90 0.91 assign (resid 6 and name HB2 ) (resid 32 and name HA ) 3.72 0.93 0.93 assign (resid 13 and name HG* ) (resid 7 and name HA ) 3.66 1.86 0.92 assign (resid 13 and name HG* ) (resid 7 and name HB3 ) 3.35 1.55 0.84 assign (resid 33 and name HG* ) (resid 7 and name HB3 ) 3.78 1.98 0.94 assign (resid 13 and name HG* ) (resid 7 and name HB2 ) 4.00 2.20 1.00 assign (resid 33 and name HG* ) (resid 7 and name HB2 ) 4.12 2.32 1.03 assign (resid 7 and name HN ) (resid 31 and name HB2 ) 4.32 1.08 1.08 assign (resid 7 and name HN ) (resid 31 and name HB3 ) 3.79 0.95 0.95 assign (resid 7 and name HN ) (resid 31 and name HG* ) 5.00 3.20 1.25 assign (resid 31 and name HN ) (resid 7 and name HN ) 5.08 1.27 1.27 assign (resid 7 and name HN ) (resid 32 and name HA ) 3.23 0.81 0.80 assign (resid 7 and name HN ) (resid 32 and name HB2 ) 3.60 0.90 0.89 assign (resid 7 and name HN ) (resid 32 and name HG* ) 4.61 2.81 1.15 assign (resid 7 and name HN ) (resid 32 and name HD* ) 5.77 3.97 1.44 assign (resid 33 and name HN ) (resid 7 and name HN ) 5.06 1.26 1.27 assign (resid 8 and name HN ) (resid 12 and name HB2 ) 3.76 0.94 0.95 assign (resid 8 and name HN ) (resid 12 and name HG* ) 5.02 3.22 1.26 assign (resid 11 and name HN ) (resid 9 and name HB ) 3.28 0.82 0.82 assign (resid 12 and name HN ) (resid 9 and name HG2* ) 4.61 2.81 1.15 assign (resid 9 and name HN ) (resid 12 and name HG* ) 4.14 2.34 1.04 assign (resid 9 and name HN ) (resid 12 and name HN ) 4.25 1.06 1.07 assign (resid 9 and name HN ) (resid 13 and name HG* ) 5.25 3.45 1.31 assign (resid 13 and name HN ) (resid 10 and name HA ) 4.38 1.09 1.10 assign (resid 28 and name HN ) (resid 10 and name HA ) 3.70 0.93 0.92 assign (resid 10 and name HB* ) (resid 27 and name HA ) 5.08 3.28 1.27 assign (resid 28 and name HN ) (resid 10 and name HB* ) 3.15 1.35 0.78 assign (resid 27 and name HN ) (resid 10 and name HB* ) 4.88 3.08 1.22 assign (resid 11 and name HN ) (resid 14 and name HN ) 5.38 1.34 1.35 assign (resid 15 and name HN ) (resid 12 and name HA ) 5.22 1.30 1.31 assign (resid 16 and name HB ) (resid 13 and name HA ) 2.78 0.69 0.70 assign (resid 16 and name HG* ) (resid 13 and name HA ) 3.96 2.16 0.99 assign (resid 16 and name HN ) (resid 13 and name HA ) 4.00 1.00 1.00 assign (resid 17 and name HN ) (resid 13 and name HA ) 3.97 0.99 0.99 assign (resid 33 and name HG* ) (resid 13 and name HA ) 3.64 1.84 0.91 assign (resid 16 and name HN ) (resid 13 and name HB* ) 3.92 2.12 0.98 assign (resid 13 and name HB* ) (resid 33 and name HA ) 3.43 1.63 0.85 assign (resid 33 and name HG* ) (resid 13 and name HB* ) 3.57 1.77 0.89 assign (resid 13 and name HG* ) (resid 27 and name HA ) 4.16 2.36 1.04 assign (resid 27 and name HN ) (resid 13 and name HG* ) 4.34 2.54 1.09 assign (resid 28 and name HN ) (resid 13 and name HG* ) 4.37 2.57 1.09 assign (resid 13 and name HG* ) (resid 33 and name HA ) 3.12 1.32 0.78 assign (resid 13 and name HG* ) (resid 33 and name HB* ) 3.12 1.32 0.78 assign (resid 33 and name HG* ) (resid 13 and name HG* ) 2.75 0.95 0.69 assign (resid 34 and name HN ) (resid 13 and name HG* ) 3.92 2.12 0.98 assign (resid 13 and name HN ) (resid 33 and name HG* ) 4.82 3.02 1.20 assign (resid 17 and name HB2 ) (resid 14 and name HA ) 3.66 0.92 0.91 assign (resid 17 and name HB3 ) (resid 14 and name HA ) 4.13 1.04 1.03 assign (resid 17 and name HN ) (resid 14 and name HA ) 2.57 0.65 0.64 assign (resid 14 and name HA ) (resid 24 and name HA ) 4.48 1.12 1.12 assign (resid 26 and name HN ) (resid 14 and name HA ) 4.38 1.09 1.10 assign (resid 14 and name HB* ) (resid 24 and name HB* ) 3.99 2.19 1.00 assign (resid 14 and name HE1 ) (resid 25 and name HA ) 4.50 1.12 1.13 assign (resid 14 and name HE1 ) (resid 26 and name HN ) 3.79 0.95 0.94 assign (resid 26 and name HN ) (resid 14 and name HH2 ) 3.43 0.86 0.86 assign (resid 14 and name HN ) (resid 16 and name HN ) 2.97 0.74 0.74 assign (resid 18 and name HB* ) (resid 15 and name HA ) 3.15 1.35 0.78 assign (resid 18 and name HG* ) (resid 15 and name HA ) 4.02 2.22 1.00 assign (resid 18 and name HN ) (resid 15 and name HA ) 3.42 0.86 0.85 assign (resid 19 and name HN ) (resid 15 and name HA ) 3.22 0.80 0.81 assign (resid 17 and name HN ) (resid 15 and name HN ) 3.82 0.96 0.95 assign (resid 18 and name HN ) (resid 16 and name HA ) 4.41 1.10 1.11 assign (resid 19 and name HB* ) (resid 16 and name HA ) 3.41 1.61 0.85 assign (resid 19 and name HD* ) (resid 16 and name HA ) 5.01 3.21 1.25 assign (resid 19 and name HN ) (resid 16 and name HA ) 3.11 0.77 0.78 assign (resid 20 and name HB* ) (resid 16 and name HA ) 3.92 2.12 0.98 assign (resid 33 and name HG* ) (resid 16 and name HB ) 3.59 1.79 0.90 assign (resid 18 and name HN ) (resid 16 and name HG* ) 5.57 3.77 1.40 assign (resid 33 and name HG* ) (resid 16 and name HG* ) 3.69 1.89 0.93 assign (resid 18 and name HN ) (resid 16 and name HN ) 4.65 1.16 1.17 assign (resid 16 and name HN ) (resid 19 and name HG* ) 5.26 3.46 1.31 assign (resid 16 and name HN ) (resid 33 and name HG* ) 5.29 3.49 1.32 assign (resid 19 and name HN ) (resid 17 and name HA ) 4.81 1.20 1.21 assign (resid 20 and name HB* ) (resid 17 and name HA ) 4.05 2.25 1.01 assign (resid 20 and name HG ) (resid 17 and name HA ) 3.90 0.98 0.97 assign (resid 20 and name HD* ) (resid 17 and name HA ) 5.71 3.91 1.43 assign (resid 20 and name HN ) (resid 17 and name HA ) 3.62 0.90 0.91 assign (resid 21 and name HB* ) (resid 17 and name HA ) 4.50 2.70 1.13 assign (resid 21 and name HD2 ) (resid 17 and name HA ) 3.60 0.90 0.89 assign (resid 21 and name HN ) (resid 17 and name HA ) 3.59 0.90 0.90 assign (resid 23 and name HG2* ) (resid 17 and name HA ) 6.93 5.13 1.74 assign (resid 23 and name HG2* ) (resid 17 and name HB2 ) 3.88 2.08 0.97 assign (resid 17 and name HN ) (resid 21 and name HN ) 4.94 1.24 1.23 assign (resid 17 and name HN ) (resid 33 and name HG* ) 5.30 3.50 1.32 assign (resid 21 and name HN ) (resid 18 and name HA ) 4.30 1.08 1.07 assign (resid 23 and name HN ) (resid 18 and name HA ) 2.63 0.66 0.66 assign (resid 18 and name HB* ) (resid 22 and name HA ) 5.16 3.36 1.29 assign (resid 23 and name HN ) (resid 18 and name HB* ) 3.86 2.06 0.97 assign (resid 18 and name HG* ) (resid 22 and name HA ) 3.77 1.97 0.95 assign (resid 23 and name HN ) (resid 18 and name HG* ) 3.28 1.48 0.81 assign (resid 20 and name HN ) (resid 18 and name HN ) 3.43 0.86 0.85 assign (resid 18 and name HN ) (resid 21 and name HN ) 4.47 1.12 1.12 assign (resid 18 and name HN ) (resid 23 and name HN ) 3.93 0.98 0.98 assign (resid 21 and name HN ) (resid 19 and name HN ) 5.32 1.33 1.33 assign (resid 20 and name HN ) (resid 22 and name HN ) 4.90 1.23 1.22 assign (resid 23 and name HN ) (resid 21 and name HB* ) 4.46 2.66 1.12 assign (resid 23 and name HG2* ) (resid 21 and name HB* ) 3.92 2.12 0.98 assign (resid 21 and name HD2 ) (resid 23 and name HG2* ) 5.44 3.64 1.37 assign (resid 21 and name HD2 ) (resid 35 and name HB3 ) 3.88 0.97 0.97 assign (resid 21 and name HD2 ) (resid 35 and name HB2 ) 4.58 1.14 1.15 assign (resid 21 and name HN ) (resid 23 and name HG2* ) 4.57 2.77 1.14 assign (resid 21 and name HN ) (resid 23 and name HN ) 4.07 1.02 1.01 assign (resid 37 and name HN ) (resid 23 and name HG2* ) 4.02 1.00 1.01 assign (resid 23 and name HG2* ) (resid 25 and name HE ) 3.22 1.42 0.81 assign (resid 25 and name HN ) (resid 23 and name HG2* ) 3.96 2.16 0.99 assign (resid 23 and name HG2* ) (resid 35 and name HA ) 4.71 2.91 1.18 assign (resid 36 and name HN ) (resid 23 and name HG2* ) 4.31 2.51 1.07 assign (resid 24 and name HN ) (resid 26 and name HN ) 4.58 1.14 1.15 assign (resid 26 and name HA* ) (resid 35 and name HA ) 3.65 1.85 0.91 assign (resid 36 and name HE* ) (resid 26 and name HA* ) 5.64 3.84 1.41 assign (resid 36 and name HN ) (resid 26 and name HA* ) 4.21 2.41 1.05 assign (resid 36 and name HD* ) (resid 26 and name HA* ) 4.22 2.42 1.06 assign (resid 26 and name HN ) (resid 35 and name HA ) 5.14 1.29 1.28 assign (resid 26 and name HN ) (resid 36 and name HB3 ) 3.99 1.00 0.99 assign (resid 26 and name HN ) (resid 36 and name HD* ) 5.16 3.36 1.29 assign (resid 26 and name HN ) (resid 36 and name HE* ) 5.50 3.70 1.37 assign (resid 36 and name HD* ) (resid 27 and name HB* ) 4.06 2.26 1.02 assign (resid 36 and name HE* ) (resid 27 and name HB* ) 3.46 1.66 0.86 assign (resid 36 and name HD* ) (resid 27 and name HG* ) 4.11 2.31 1.03 assign (resid 36 and name HE* ) (resid 27 and name HG* ) 3.78 1.98 0.95 assign (resid 36 and name HE* ) (resid 27 and name HD* ) 3.99 2.19 1.00 assign (resid 27 and name HN ) (resid 33 and name HG* ) 5.02 3.22 1.25 assign (resid 27 and name HN ) (resid 34 and name HN ) 3.30 0.83 0.82 assign (resid 27 and name HN ) (resid 35 and name HA ) 3.73 0.93 0.93 assign (resid 27 and name HN ) (resid 36 and name HD* ) 4.17 2.37 1.04 assign (resid 27 and name HN ) (resid 36 and name HE* ) 3.93 2.13 0.98 assign (resid 32 and name HN ) (resid 28 and name HA ) 3.92 0.98 0.98 assign (resid 33 and name HA ) (resid 28 and name HA ) 3.86 0.97 0.96 assign (resid 33 and name HG* ) (resid 28 and name HA ) 4.69 2.89 1.17 assign (resid 34 and name HN ) (resid 28 and name HA ) 3.82 0.95 0.96 assign (resid 34 and name HN ) (resid 28 and name HB2 ) 4.10 1.03 1.02 assign (resid 31 and name HN ) (resid 29 and name HA ) 3.95 0.99 0.98 assign (resid 36 and name HE* ) (resid 29 and name HB2 ) 5.25 3.45 1.31 assign (resid 36 and name HE* ) (resid 29 and name HG* ) 5.88 4.08 1.47 assign (resid 29 and name HN ) (resid 31 and name HN ) 3.16 0.79 0.79 assign (resid 29 and name HN ) (resid 32 and name HN ) 3.20 0.80 0.80 assign (resid 29 and name HN ) (resid 33 and name HA ) 3.56 0.89 0.89 assign (resid 32 and name HN ) (resid 30 and name HA ) 4.44 1.11 1.11
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