NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
24886 |
2k5e   |
15833 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (resid 2 and name HA ) (resid 3 and name HN ) 2.94 1.14 0.59 assign (resid 2 and name HB ) (resid 3 and name HN ) 4.12 2.32 0.82 assign (resid 2 and name HG2* ) (resid 3 and name HN ) 4.31 2.51 0.86 assign (resid 3 and name HN ) (resid 3 and name HB1 ) 3.97 2.17 0.79 assign (resid 3 and name HN ) (resid 3 and name HB2 ) 3.49 1.69 0.70 assign (resid 3 and name HN ) (resid 3 and name HG* ) 3.75 1.95 0.75 assign (resid 3 and name HG* ) (resid 3 and name HE22 ) 4.03 2.23 0.81 assign (resid 3 and name HB2 ) (resid 3 and name HE21 ) 5.25 3.45 1.05 assign (resid 3 and name HG* ) (resid 3 and name HE21 ) 3.45 1.65 0.69 assign (resid 3 and name HN ) (resid 4 and name HN ) 4.61 2.81 0.92 assign (resid 3 and name HA ) (resid 4 and name HN ) 2.48 0.68 0.50 assign (resid 3 and name HB1 ) (resid 4 and name HN ) 3.23 1.43 0.65 assign (resid 3 and name HB2 ) (resid 4 and name HN ) 4.08 2.28 0.82 assign (resid 3 and name HG* ) (resid 4 and name HN ) 3.97 2.17 0.79 assign (resid 4 and name HN ) (resid 4 and name HB2 ) 2.71 0.91 0.54 assign (resid 4 and name HN ) (resid 4 and name HB1 ) 3.53 1.73 0.71 assign (resid 4 and name HN ) (resid 4 and name HG2 ) 3.85 2.05 0.77 assign (resid 4 and name HN ) (resid 4 and name HG1 ) 3.85 2.05 0.77 assign (resid 4 and name HN ) (resid 4 and name HD* ) 4.86 3.06 0.97 assign (resid 4 and name HN ) (resid 5 and name HN ) 3.07 1.27 0.61 assign (resid 4 and name HA ) (resid 5 and name HN ) 3.54 1.74 0.71 assign (resid 4 and name HB2 ) (resid 5 and name HN ) 3.58 1.78 0.72 assign (resid 4 and name HB1 ) (resid 5 and name HN ) 3.75 1.95 0.75 assign (resid 4 and name HG1 ) (resid 5 and name HN ) 5.25 3.45 1.05 assign (resid 4 and name HD* ) (resid 5 and name HN ) 5.33 3.53 1.07 assign (resid 5 and name HN ) (resid 5 and name HB2 ) 3.16 1.36 0.63 assign (resid 5 and name HN ) (resid 5 and name HB1 ) 3.94 2.14 0.79 assign (resid 5 and name HN ) (resid 5 and name HD* ) 3.03 1.23 0.61 assign (resid 5 and name HN ) (resid 5 and name HE* ) 4.98 3.18 1.00 assign (resid 5 and name HN ) (resid 6 and name HN ) 4.33 2.53 0.87 assign (resid 5 and name HA ) (resid 6 and name HN ) 2.55 0.75 0.51 assign (resid 5 and name HB1 ) (resid 6 and name HN ) 3.67 1.87 0.73 assign (resid 5 and name HD* ) (resid 6 and name HN ) 4.64 2.84 0.93 assign (resid 6 and name HN ) (resid 6 and name HG2* ) 3.25 1.45 0.65 assign (resid 6 and name HN ) (resid 7 and name HN ) 4.70 2.90 0.94 assign (resid 6 and name HA ) (resid 7 and name HN ) 2.70 0.90 0.54 assign (resid 7 and name HN ) (resid 7 and name HB2 ) 3.74 1.94 0.75 assign (resid 7 and name HN ) (resid 7 and name HB1 ) 2.97 1.17 0.59 assign (resid 7 and name HN ) (resid 7 and name HG1 ) 3.29 1.49 0.66 assign (resid 7 and name HN ) (resid 7 and name HG2 ) 3.00 1.20 0.60 assign (resid 7 and name HN ) (resid 58 and name HG ) 5.57 3.77 1.11 assign (resid 7 and name HN ) (resid 7 and name HD1 ) 5.30 3.50 1.06 assign (resid 7 and name HN ) (resid 7 and name HE2 ) 5.04 3.24 1.01 assign (resid 7 and name HN ) (resid 8 and name HN ) 3.22 1.42 0.64 assign (resid 7 and name HB2 ) (resid 8 and name HN ) 4.29 2.49 0.86 assign (resid 7 and name HB1 ) (resid 8 and name HN ) 4.36 2.56 0.87 assign (resid 7 and name HG1 ) (resid 8 and name HN ) 3.51 1.71 0.70 assign (resid 7 and name HG2 ) (resid 8 and name HN ) 3.46 1.66 0.69 assign (resid 7 and name HD2 ) (resid 8 and name HN ) 5.26 3.46 1.05 assign (resid 7 and name HD1 ) (resid 8 and name HN ) 5.47 3.67 1.09 assign (resid 8 and name HN ) (resid 8 and name HB2 ) 3.21 1.41 0.64 assign (resid 8 and name HN ) (resid 8 and name HB1 ) 3.33 1.53 0.67 assign (resid 8 and name HN ) (resid 9 and name HN ) 2.89 1.09 0.58 assign (resid 8 and name HA ) (resid 9 and name HN ) 3.55 1.75 0.71 assign (resid 8 and name HB2 ) (resid 9 and name HN ) 4.19 2.39 0.84 assign (resid 8 and name HB1 ) (resid 9 and name HN ) 3.16 1.36 0.63 assign (resid 9 and name HN ) (resid 9 and name HB2 ) 3.60 1.80 0.72 assign (resid 9 and name HN ) (resid 9 and name HB1 ) 3.06 1.26 0.61 assign (resid 9 and name HN ) (resid 9 and name HG2 ) 3.26 1.46 0.65 assign (resid 9 and name HN ) (resid 9 and name HE* ) 4.47 2.67 0.89 assign (resid 9 and name HN ) (resid 10 and name HN ) 4.68 2.88 0.94 assign (resid 9 and name HA ) (resid 10 and name HN ) 2.58 0.78 0.52 assign (resid 9 and name HB2 ) (resid 10 and name HN ) 3.64 1.84 0.73 assign (resid 9 and name HG2 ) (resid 10 and name HN ) 3.94 2.14 0.79 assign (resid 9 and name HG1 ) (resid 10 and name HN ) 3.94 2.14 0.79 assign (resid 10 and name HN ) (resid 10 and name HG2* ) 2.68 0.88 0.54 assign (resid 10 and name HN ) (resid 11 and name HN ) 4.69 2.89 0.94 assign (resid 10 and name HA ) (resid 11 and name HN ) 2.74 0.94 0.55 assign (resid 10 and name HB ) (resid 11 and name HN ) 2.80 1.00 0.56 assign (resid 11 and name HN ) (resid 11 and name HB1 ) 3.71 1.91 0.74 assign (resid 11 and name HN ) (resid 11 and name HB2 ) 3.08 1.28 0.62 assign (resid 11 and name HN ) (resid 11 and name HD* ) 3.00 1.20 0.60 assign (resid 11 and name HN ) (resid 11 and name HE* ) 4.49 2.69 0.90 assign (resid 11 and name HN ) (resid 12 and name HN ) 3.22 1.42 0.64 assign (resid 11 and name HB1 ) (resid 12 and name HN ) 3.79 1.99 0.76 assign (resid 11 and name HB2 ) (resid 12 and name HN ) 3.46 1.66 0.69 assign (resid 11 and name HD* ) (resid 12 and name HN ) 4.49 2.69 0.90 assign (resid 12 and name HN ) (resid 12 and name HB* ) 2.65 0.85 0.53 assign (resid 12 and name HN ) (resid 14 and name HN ) 4.27 2.47 0.85 assign (resid 11 and name HN ) (resid 13 and name HN ) 4.61 2.81 0.92 assign (resid 11 and name HA ) (resid 13 and name HN ) 5.52 3.72 1.10 assign (resid 12 and name HN ) (resid 13 and name HN ) 3.21 1.41 0.64 assign (resid 12 and name HB* ) (resid 13 and name HN ) 2.81 1.01 0.56 assign (resid 13 and name HN ) (resid 13 and name HB2 ) 2.89 1.09 0.58 assign (resid 13 and name HN ) (resid 13 and name HG1 ) 3.11 1.31 0.62 assign (resid 13 and name HN ) (resid 14 and name HN ) 2.98 1.18 0.60 assign (resid 13 and name HN ) (resid 15 and name HN ) 4.30 2.50 0.86 assign (resid 13 and name HN ) (resid 13 and name HE21 ) 5.91 4.11 1.18 assign (resid 13 and name HA ) (resid 13 and name HE21 ) 4.82 3.02 0.96 assign (resid 13 and name HB2 ) (resid 13 and name HE21 ) 4.39 2.59 0.88 assign (resid 13 and name HB1 ) (resid 13 and name HE21 ) 4.13 2.33 0.83 assign (resid 13 and name HG2 ) (resid 13 and name HE21 ) 3.03 1.23 0.61 assign (resid 13 and name HA ) (resid 13 and name HE22 ) 5.67 3.87 1.13 assign (resid 9 and name HB1 ) (resid 13 and name HE22 ) 5.09 3.29 1.02 assign (resid 13 and name HB2 ) (resid 13 and name HE22 ) 5.31 3.51 1.06 assign (resid 13 and name HB1 ) (resid 13 and name HE22 ) 4.44 2.64 0.89 assign (resid 13 and name HG2 ) (resid 13 and name HE22 ) 3.81 2.01 0.76 assign (resid 13 and name HB2 ) (resid 14 and name HN ) 3.41 1.61 0.68 assign (resid 9 and name HE* ) (resid 14 and name HN ) 3.47 1.67 0.69 assign (resid 13 and name HB1 ) (resid 14 and name HN ) 3.86 2.06 0.77 assign (resid 13 and name HG2 ) (resid 14 and name HN ) 5.06 3.26 1.01 assign (resid 45 and name HB2 ) (resid 47 and name HN ) 6.50 4.70 1.30 assign (resid 14 and name HN ) (resid 14 and name HB* ) 2.66 0.86 0.53 assign (resid 14 and name HN ) (resid 16 and name HN ) 4.21 2.41 0.84 assign (resid 11 and name HA ) (resid 15 and name HN ) 4.49 2.69 0.90 assign (resid 14 and name HN ) (resid 15 and name HN ) 2.88 1.08 0.58 assign (resid 14 and name HB* ) (resid 15 and name HN ) 2.93 1.13 0.59 assign (resid 15 and name HN ) (resid 15 and name HB2 ) 2.89 1.09 0.58 assign (resid 15 and name HN ) (resid 15 and name HG ) 3.00 1.20 0.60 assign (resid 15 and name HN ) (resid 15 and name HD1* ) 3.69 1.89 0.74 assign (resid 15 and name HN ) (resid 15 and name HD2* ) 3.95 2.15 0.79 assign (resid 12 and name HA ) (resid 16 and name HN ) 4.16 2.36 0.83 assign (resid 15 and name HN ) (resid 16 and name HN ) 3.07 1.27 0.61 assign (resid 15 and name HB1 ) (resid 16 and name HN ) 3.62 1.82 0.72 assign (resid 15 and name HB2 ) (resid 16 and name HN ) 3.29 1.49 0.66 assign (resid 15 and name HG ) (resid 16 and name HN ) 4.88 3.08 0.98 assign (resid 15 and name HD1* ) (resid 16 and name HN ) 4.93 3.13 0.99 assign (resid 15 and name HD2* ) (resid 16 and name HN ) 5.01 3.21 1.00 assign (resid 16 and name HN ) (resid 16 and name HB2 ) 2.86 1.06 0.57 assign (resid 16 and name HN ) (resid 16 and name HG* ) 3.01 1.21 0.60 assign (resid 16 and name HG* ) (resid 16 and name HE22 ) 3.58 1.78 0.72 assign (resid 16 and name HN ) (resid 17 and name HN ) 2.77 0.97 0.55 assign (resid 14 and name HA ) (resid 17 and name HN ) 3.30 1.50 0.66 assign (resid 16 and name HB2 ) (resid 17 and name HN ) 3.86 2.06 0.77 assign (resid 16 and name HB1 ) (resid 17 and name HN ) 3.98 2.18 0.80 assign (resid 16 and name HG* ) (resid 17 and name HN ) 4.38 2.58 0.88 assign (resid 17 and name HN ) (resid 17 and name HB ) 2.83 1.03 0.57 assign (resid 17 and name HN ) (resid 17 and name HG2* ) 3.80 2.00 0.76 assign (resid 17 and name HN ) (resid 18 and name HN ) 2.94 1.14 0.59 assign (resid 17 and name HB ) (resid 18 and name HN ) 3.33 1.53 0.67 assign (resid 17 and name HG2* ) (resid 18 and name HN ) 3.57 1.77 0.71 assign (resid 18 and name HN ) (resid 18 and name HB1 ) 3.77 1.97 0.75 assign (resid 18 and name HN ) (resid 18 and name HB2 ) 3.51 1.71 0.70 assign (resid 16 and name HN ) (resid 18 and name HN ) 5.58 3.78 1.12 assign (resid 18 and name HN ) (resid 21 and name HN ) 4.41 2.61 0.88 assign (resid 20 and name HN ) (resid 21 and name HN ) 3.26 1.46 0.65 assign (resid 21 and name HN ) (resid 21 and name HB ) 2.68 0.88 0.54 assign (resid 21 and name HN ) (resid 22 and name HN ) 3.06 1.26 0.61 assign (resid 21 and name HB ) (resid 22 and name HN ) 3.11 1.31 0.62 assign (resid 21 and name HG1* ) (resid 22 and name HN ) 3.60 1.80 0.72 assign (resid 22 and name HN ) (resid 22 and name HB* ) 2.53 0.73 0.51 assign (resid 22 and name HN ) (resid 23 and name HN ) 3.18 1.38 0.64 assign (resid 21 and name HA ) (resid 23 and name HN ) 5.44 3.64 1.09 assign (resid 23 and name HN ) (resid 26 and name HD1 ) 5.64 3.84 1.13 assign (resid 23 and name HN ) (resid 23 and name HA1 ) 2.84 1.04 0.57 assign (resid 21 and name HA ) (resid 24 and name HN ) 3.62 1.82 0.72 assign (resid 22 and name HN ) (resid 24 and name HN ) 4.23 2.43 0.85 assign (resid 24 and name HN ) (resid 27 and name HB2 ) 6.07 4.27 1.21 assign (resid 23 and name HN ) (resid 24 and name HN ) 3.04 1.24 0.61 assign (resid 23 and name HA1 ) (resid 24 and name HN ) 3.32 1.52 0.66 assign (resid 24 and name HN ) (resid 24 and name HB ) 2.72 0.92 0.54 assign (resid 24 and name HN ) (resid 24 and name HG2* ) 2.60 0.80 0.52 assign (resid 24 and name HN ) (resid 24 and name HG1* ) 3.92 2.12 0.78 assign (resid 24 and name HN ) (resid 25 and name HN ) 2.86 1.06 0.57 assign (resid 21 and name HA ) (resid 25 and name HN ) 4.27 2.47 0.85 assign (resid 22 and name HA ) (resid 25 and name HN ) 4.10 2.30 0.82 assign (resid 23 and name HA2 ) (resid 25 and name HN ) 5.13 3.33 1.03 assign (resid 25 and name HN ) (resid 27 and name HB1 ) 5.92 4.12 1.18 assign (resid 24 and name HB ) (resid 25 and name HN ) 3.01 1.21 0.60 assign (resid 24 and name HG2* ) (resid 25 and name HN ) 3.87 2.07 0.77 assign (resid 24 and name HG1* ) (resid 25 and name HN ) 3.32 1.52 0.66 assign (resid 25 and name HN ) (resid 25 and name HB1 ) 3.67 1.87 0.73 assign (resid 25 and name HN ) (resid 25 and name HB2 ) 2.83 1.03 0.57 assign (resid 25 and name HN ) (resid 25 and name HG ) 2.86 1.06 0.57 assign (resid 25 and name HN ) (resid 25 and name HD2* ) 3.42 1.62 0.68 assign (resid 22 and name HA ) (resid 26 and name HN ) 4.19 2.39 0.84 assign (resid 23 and name HA2 ) (resid 26 and name HN ) 3.86 2.06 0.77 assign (resid 23 and name HA1 ) (resid 26 and name HN ) 5.68 3.88 1.14 assign (resid 26 and name HN ) (resid 27 and name HB1 ) 6.16 4.36 1.23 assign (resid 24 and name HN ) (resid 26 and name HN ) 4.47 2.67 0.89 assign (resid 26 and name HN ) (resid 31 and name HA2 ) 5.78 3.98 1.16 assign (resid 25 and name HN ) (resid 26 and name HN ) 3.10 1.30 0.62 assign (resid 25 and name HB1 ) (resid 26 and name HN ) 3.67 1.87 0.73 assign (resid 25 and name HB2 ) (resid 26 and name HN ) 2.93 1.13 0.59 assign (resid 26 and name HN ) (resid 26 and name HB2 ) 3.14 1.34 0.63 assign (resid 25 and name HG ) (resid 26 and name HN ) 5.51 3.71 1.10 assign (resid 25 and name HD2* ) (resid 26 and name HN ) 4.68 2.88 0.94 assign (resid 25 and name HD1* ) (resid 26 and name HN ) 4.32 2.52 0.86 assign (resid 26 and name HN ) (resid 26 and name HG1 ) 3.29 1.49 0.66 assign (resid 26 and name HN ) (resid 26 and name HG2 ) 3.90 2.10 0.78 assign (resid 26 and name HN ) (resid 26 and name HD1 ) 4.67 2.87 0.93 assign (resid 26 and name HN ) (resid 28 and name HN ) 4.58 2.78 0.92 assign (resid 23 and name HA2 ) (resid 27 and name HN ) 4.79 2.99 0.96 assign (resid 25 and name HN ) (resid 27 and name HN ) 4.33 2.53 0.87 assign (resid 25 and name HA ) (resid 27 and name HN ) 4.36 2.56 0.87 assign (resid 26 and name HN ) (resid 27 and name HN ) 3.05 1.25 0.61 assign (resid 26 and name HB2 ) (resid 27 and name HN ) 3.19 1.39 0.64 assign (resid 26 and name HB1 ) (resid 27 and name HN ) 3.80 2.00 0.76 assign (resid 26 and name HG1 ) (resid 27 and name HN ) 5.11 3.31 1.02 assign (resid 26 and name HG2 ) (resid 27 and name HN ) 5.36 3.56 1.07 assign (resid 26 and name HD1 ) (resid 27 and name HN ) 6.03 4.23 1.21 assign (resid 27 and name HN ) (resid 27 and name HB1 ) 2.81 1.01 0.56 assign (resid 27 and name HN ) (resid 27 and name HB2 ) 2.84 1.04 0.57 assign (resid 27 and name HN ) (resid 28 and name HN ) 3.12 1.32 0.62 assign (resid 24 and name HA ) (resid 28 and name HN ) 5.26 3.46 1.05 assign (resid 25 and name HA ) (resid 28 and name HN ) 3.82 2.02 0.76 assign (resid 26 and name HA ) (resid 28 and name HN ) 4.37 2.57 0.87 assign (resid 27 and name HB1 ) (resid 28 and name HN ) 3.86 2.06 0.77 assign (resid 28 and name HN ) (resid 28 and name HB2 ) 3.02 1.22 0.60 assign (resid 28 and name HN ) (resid 28 and name HD* ) 2.89 1.09 0.58 assign (resid 28 and name HN ) (resid 28 and name HE* ) 5.15 3.35 1.03 assign (resid 28 and name HN ) (resid 29 and name HN ) 2.93 1.13 0.59 assign (resid 28 and name HA ) (resid 29 and name HN ) 3.48 1.68 0.70 assign (resid 28 and name HB1 ) (resid 29 and name HN ) 4.42 2.62 0.88 assign (resid 28 and name HB2 ) (resid 29 and name HN ) 4.32 2.52 0.86 assign (resid 28 and name HD* ) (resid 29 and name HN ) 4.83 3.03 0.97 assign (resid 29 and name HN ) (resid 29 and name HA ) 2.52 0.72 0.50 assign (resid 29 and name HN ) (resid 29 and name HB2 ) 3.38 1.58 0.68 assign (resid 29 and name HN ) (resid 29 and name HB1 ) 3.97 2.17 0.79 assign (resid 29 and name HN ) (resid 30 and name HN ) 3.13 1.33 0.63 assign (resid 29 and name HB2 ) (resid 29 and name HD22 ) 3.73 1.93 0.75 assign (resid 29 and name HB1 ) (resid 29 and name HD22 ) 3.83 2.03 0.77 assign (resid 29 and name HA ) (resid 29 and name HD21 ) 5.38 3.58 1.08 assign (resid 29 and name HB2 ) (resid 29 and name HD21 ) 3.28 1.48 0.66 assign (resid 29 and name HB1 ) (resid 29 and name HD21 ) 3.49 1.69 0.70 assign (resid 29 and name HA ) (resid 30 and name HN ) 3.20 1.40 0.64 assign (resid 29 and name HB2 ) (resid 30 and name HN ) 4.74 2.94 0.95 assign (resid 30 and name HN ) (resid 30 and name HB2 ) 3.22 1.42 0.64 assign (resid 30 and name HN ) (resid 30 and name HG ) 2.92 1.12 0.58 assign (resid 30 and name HN ) (resid 30 and name HD2* ) 4.05 2.25 0.81 assign (resid 30 and name HN ) (resid 30 and name HD1* ) 4.04 2.24 0.81 assign (resid 30 and name HN ) (resid 31 and name HN ) 3.24 1.44 0.65 assign (resid 30 and name HA ) (resid 31 and name HN ) 3.19 1.39 0.64 assign (resid 30 and name HB2 ) (resid 31 and name HN ) 3.94 2.14 0.79 assign (resid 30 and name HG ) (resid 31 and name HN ) 5.59 3.79 1.12 assign (resid 30 and name HD1* ) (resid 31 and name HN ) 5.78 3.98 1.16 assign (resid 31 and name HN ) (resid 31 and name HA1 ) 2.91 1.11 0.58 assign (resid 31 and name HN ) (resid 31 and name HA2 ) 2.95 1.15 0.59 assign (resid 31 and name HN ) (resid 32 and name HN ) 2.90 1.10 0.58 assign (resid 31 and name HA1 ) (resid 32 and name HN ) 3.27 1.47 0.65 assign (resid 31 and name HA2 ) (resid 32 and name HN ) 3.41 1.61 0.68 assign (resid 32 and name HN ) (resid 32 and name HB* ) 2.92 1.12 0.58 assign (resid 32 and name HN ) (resid 33 and name HN ) 3.35 1.55 0.67 assign (resid 32 and name HA ) (resid 33 and name HN ) 3.49 1.69 0.70 assign (resid 32 and name HB* ) (resid 33 and name HN ) 3.57 1.77 0.71 assign (resid 33 and name HN ) (resid 33 and name HB ) 3.71 1.91 0.74 assign (resid 33 and name HN ) (resid 33 and name HG2* ) 3.32 1.52 0.66 assign (resid 33 and name HN ) (resid 33 and name HG11 ) 3.33 1.53 0.67 assign (resid 33 and name HN ) (resid 33 and name HG12 ) 3.18 1.38 0.64 assign (resid 33 and name HN ) (resid 33 and name HD1* ) 3.91 2.11 0.78 assign (resid 33 and name HN ) (resid 34 and name HN ) 3.37 1.57 0.67 assign (resid 33 and name HB ) (resid 34 and name HN ) 3.97 2.17 0.79 assign (resid 33 and name HG2* ) (resid 34 and name HN ) 4.19 2.39 0.84 assign (resid 33 and name HG11 ) (resid 34 and name HN ) 4.25 2.45 0.85 assign (resid 33 and name HG12 ) (resid 34 and name HN ) 4.36 2.56 0.87 assign (resid 33 and name HD1* ) (resid 34 and name HN ) 4.24 2.44 0.85 assign (resid 34 and name HN ) (resid 34 and name HA2 ) 2.92 1.12 0.58 assign (resid 34 and name HN ) (resid 34 and name HA1 ) 2.76 0.96 0.55 assign (resid 34 and name HN ) (resid 35 and name HN ) 3.26 1.46 0.65 assign (resid 34 and name HA2 ) (resid 35 and name HN ) 3.35 1.55 0.67 assign (resid 33 and name HA ) (resid 35 and name HN ) 3.86 2.06 0.77 assign (resid 35 and name HN ) (resid 35 and name HB* ) 2.90 1.10 0.58 assign (resid 35 and name HN ) (resid 36 and name HN ) 3.06 1.26 0.61 assign (resid 35 and name HA ) (resid 36 and name HN ) 3.56 1.76 0.71 assign (resid 35 and name HB* ) (resid 36 and name HN ) 3.18 1.38 0.64 assign (resid 36 and name HN ) (resid 36 and name HB1 ) 3.80 2.00 0.76 assign (resid 36 and name HN ) (resid 36 and name HB2 ) 3.80 2.00 0.76 assign (resid 36 and name HN ) (resid 36 and name HG1 ) 3.14 1.34 0.63 assign (resid 36 and name HN ) (resid 36 and name HG2 ) 3.63 1.83 0.73 assign (resid 36 and name HN ) (resid 37 and name HN ) 3.35 1.55 0.67 assign (resid 36 and name HA ) (resid 37 and name HN ) 3.22 1.42 0.64 assign (resid 36 and name HB1 ) (resid 37 and name HN ) 4.86 3.06 0.97 assign (resid 36 and name HE* ) (resid 37 and name HN ) 5.38 3.58 1.08 assign (resid 36 and name HG1 ) (resid 37 and name HN ) 4.21 2.41 0.84 assign (resid 38 and name HN ) (resid 39 and name HN ) 2.81 1.01 0.56 assign (resid 33 and name HA ) (resid 38 and name HN ) 3.75 1.95 0.75 assign (resid 21 and name HN ) (resid 21 and name HG2* ) 2.75 0.95 0.55 assign (resid 38 and name HN ) (resid 38 and name HB* ) 3.02 1.22 0.60 assign (resid 37 and name HN ) (resid 38 and name HN ) 3.35 1.55 0.67 assign (resid 38 and name HA ) (resid 39 and name HN ) 3.30 1.50 0.66 assign (resid 38 and name HB* ) (resid 39 and name HN ) 3.42 1.62 0.68 assign (resid 39 and name HN ) (resid 39 and name HB2 ) 3.04 1.24 0.61 assign (resid 39 and name HN ) (resid 39 and name HG2 ) 3.37 1.57 0.67 assign (resid 39 and name HN ) (resid 39 and name HG1 ) 3.76 1.96 0.75 assign (resid 39 and name HN ) (resid 39 and name HE21 ) 4.74 2.94 0.95 assign (resid 39 and name HB2 ) (resid 39 and name HE21 ) 4.74 2.94 0.95 assign (resid 39 and name HB1 ) (resid 39 and name HE21 ) 4.56 2.76 0.91 assign (resid 39 and name HG2 ) (resid 39 and name HE21 ) 3.36 1.56 0.67 assign (resid 39 and name HG1 ) (resid 39 and name HE21 ) 3.54 1.74 0.71 assign (resid 39 and name HN ) (resid 39 and name HE22 ) 6.50 4.70 1.30 assign (resid 39 and name HA ) (resid 39 and name HE22 ) 5.29 3.49 1.06 assign (resid 39 and name HB2 ) (resid 39 and name HE22 ) 5.21 3.41 1.04 assign (resid 39 and name HB1 ) (resid 39 and name HE22 ) 5.00 3.20 1.00 assign (resid 39 and name HN ) (resid 40 and name HN ) 3.20 1.40 0.64 assign (resid 39 and name HB2 ) (resid 40 and name HN ) 3.81 2.01 0.76 assign (resid 39 and name HB1 ) (resid 40 and name HN ) 3.80 2.00 0.76 assign (resid 39 and name HG2 ) (resid 40 and name HN ) 4.58 2.78 0.92 assign (resid 39 and name HG1 ) (resid 40 and name HN ) 5.04 3.24 1.01 assign (resid 40 and name HN ) (resid 40 and name HB2 ) 3.16 1.36 0.63 assign (resid 40 and name HN ) (resid 40 and name HB1 ) 3.70 1.90 0.74 assign (resid 40 and name HN ) (resid 40 and name HD21 ) 4.23 2.43 0.85 assign (resid 40 and name HB2 ) (resid 40 and name HD21 ) 3.06 1.26 0.61 assign (resid 40 and name HN ) (resid 40 and name HD22 ) 4.77 2.97 0.95 assign (resid 40 and name HA ) (resid 40 and name HD22 ) 4.92 3.12 0.98 assign (resid 40 and name HB2 ) (resid 40 and name HD22 ) 3.71 1.91 0.74 assign (resid 40 and name HN ) (resid 41 and name HN ) 2.96 1.16 0.59 assign (resid 40 and name HA ) (resid 41 and name HN ) 3.52 1.72 0.70 assign (resid 41 and name HN ) (resid 41 and name HB* ) 2.85 1.05 0.57 assign (resid 41 and name HN ) (resid 42 and name HN ) 4.61 2.81 0.92 assign (resid 41 and name HA ) (resid 42 and name HN ) 2.63 0.83 0.53 assign (resid 41 and name HB* ) (resid 42 and name HN ) 3.61 1.81 0.72 assign (resid 41 and name HG2 ) (resid 42 and name HN ) 3.90 2.10 0.78 assign (resid 41 and name HG1 ) (resid 42 and name HN ) 3.90 2.10 0.78 assign (resid 42 and name HN ) (resid 42 and name HB2 ) 3.82 2.02 0.76 assign (resid 42 and name HN ) (resid 42 and name HB1 ) 3.82 2.02 0.76 assign (resid 42 and name HN ) (resid 43 and name HN ) 4.68 2.88 0.94 assign (resid 42 and name HA ) (resid 43 and name HN ) 2.90 1.10 0.58 assign (resid 43 and name HN ) (resid 43 and name HB2 ) 3.05 1.25 0.61 assign (resid 43 and name HN ) (resid 43 and name HB1 ) 3.65 1.85 0.73 assign (resid 43 and name HN ) (resid 43 and name HG ) 2.76 0.96 0.55 assign (resid 43 and name HN ) (resid 43 and name HD2* ) 3.55 1.75 0.71 assign (resid 43 and name HN ) (resid 43 and name HD1* ) 3.86 2.06 0.77 assign (resid 43 and name HB2 ) (resid 44 and name HN ) 3.10 1.30 0.62 assign (resid 7 and name HD1 ) (resid 44 and name HN ) 5.06 3.26 1.01 assign (resid 43 and name HG ) (resid 44 and name HN ) 5.39 3.59 1.08 assign (resid 43 and name HD2* ) (resid 44 and name HN ) 4.71 2.91 0.94 assign (resid 43 and name HD1* ) (resid 44 and name HN ) 4.75 2.95 0.95 assign (resid 44 and name HN ) (resid 44 and name HB2 ) 2.95 1.15 0.59 assign (resid 44 and name HN ) (resid 44 and name HB1 ) 2.98 1.18 0.60 assign (resid 44 and name HN ) (resid 44 and name HG2 ) 4.57 2.77 0.91 assign (resid 43 and name HN ) (resid 45 and name HN ) 4.49 2.69 0.90 assign (resid 43 and name HA ) (resid 45 and name HN ) 4.79 2.99 0.96 assign (resid 44 and name HN ) (resid 45 and name HN ) 2.96 1.16 0.59 assign (resid 44 and name HB2 ) (resid 45 and name HN ) 4.03 2.23 0.81 assign (resid 44 and name HB1 ) (resid 45 and name HN ) 3.15 1.35 0.63 assign (resid 44 and name HG2 ) (resid 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(resid 45 and name HE22 ) 3.96 2.16 0.79 assign (resid 45 and name HG1 ) (resid 45 and name HE22 ) 3.51 1.71 0.70 assign (resid 43 and name HA ) (resid 46 and name HN ) 3.98 2.18 0.80 assign (resid 44 and name HN ) (resid 46 and name HN ) 4.49 2.69 0.90 assign (resid 44 and name HA ) (resid 46 and name HN ) 5.71 3.91 1.14 assign (resid 45 and name HB1 ) (resid 46 and name HN ) 3.55 1.75 0.71 assign (resid 45 and name HB2 ) (resid 46 and name HN ) 3.42 1.62 0.68 assign (resid 45 and name HG1 ) (resid 46 and name HN ) 4.57 2.77 0.91 assign (resid 43 and name HA ) (resid 47 and name HN ) 4.35 2.55 0.87 assign (resid 44 and name HA ) (resid 47 and name HN ) 4.03 2.23 0.81 assign (resid 45 and name HN ) (resid 47 and name HN ) 4.53 2.73 0.91 assign (resid 45 and name HA ) (resid 47 and name HN ) 4.84 3.04 0.97 assign (resid 46 and name HA1 ) (resid 47 and name HN ) 3.42 1.62 0.68 assign (resid 47 and name HN ) (resid 47 and name HB* ) 2.56 0.76 0.51 assign (resid 44 and name HA ) (resid 48 and name HN ) 4.04 2.24 0.81 assign (resid 45 and name HA ) (resid 48 and name HN ) 3.94 2.14 0.79 assign (resid 46 and name HA1 ) (resid 48 and name HN ) 5.10 3.30 1.02 assign (resid 46 and name HA2 ) (resid 48 and name HN ) 5.02 3.22 1.00 assign (resid 47 and name HN ) (resid 48 and name HN ) 3.01 1.21 0.60 assign (resid 47 and name HB* ) (resid 48 and name HN ) 2.70 0.90 0.54 assign (resid 48 and name HN ) (resid 48 and name HB2 ) 2.74 0.94 0.55 assign (resid 48 and name HN ) (resid 48 and name HD21 ) 4.15 2.35 0.83 assign (resid 48 and name HN ) (resid 49 and name HN ) 3.02 1.22 0.60 assign (resid 48 and name HN ) (resid 50 and name HN ) 4.46 2.66 0.89 assign (resid 48 and name HN ) (resid 48 and name HD22 ) 4.90 3.10 0.98 assign (resid 48 and name HB1 ) (resid 48 and name HD22 ) 4.09 2.29 0.82 assign (resid 48 and name HB2 ) (resid 48 and name HD22 ) 3.65 1.85 0.73 assign (resid 48 and name HA ) (resid 48 and name HD21 ) 4.70 2.90 0.94 assign (resid 48 and name HB1 ) (resid 48 and name HD21 ) 3.42 1.62 0.68 assign (resid 48 and name HB2 ) (resid 48 and name HD21 ) 3.01 1.21 0.60 assign (resid 45 and name HA ) (resid 49 and name HN ) 4.27 2.47 0.85 assign (resid 46 and name HA2 ) (resid 49 and name HN ) 3.69 1.89 0.74 assign (resid 47 and name HN ) (resid 49 and name HN ) 4.08 2.28 0.82 assign (resid 47 and name HA ) (resid 49 and name HN ) 4.67 2.87 0.93 assign (resid 48 and name HB2 ) (resid 49 and name HN ) 3.16 1.36 0.63 assign (resid 48 and name HD21 ) (resid 49 and name HN ) 4.75 2.95 0.95 assign (resid 49 and name HN ) (resid 49 and name HA ) 2.93 1.13 0.59 assign (resid 49 and name HN ) (resid 49 and name HB* ) 2.48 0.68 0.50 assign (resid 49 and name HN ) (resid 50 and name HN ) 3.05 1.25 0.61 assign (resid 46 and name HA1 ) (resid 50 and name HN ) 5.19 3.39 1.04 assign (resid 46 and name HA2 ) (resid 50 and name HN ) 4.32 2.52 0.86 assign (resid 47 and name HA ) (resid 50 and name HN ) 3.64 1.84 0.73 assign (resid 3 and name HN ) (resid 3 and name HE21 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assign (resid 53 and name HB1 ) (resid 53 and name HD22 ) 3.72 1.92 0.74 assign (resid 53 and name HB2 ) (resid 53 and name HD22 ) 3.82 2.02 0.76 assign (resid 53 and name HN ) (resid 53 and name HD21 ) 5.04 3.24 1.01 assign (resid 53 and name HA ) (resid 53 and name HD21 ) 4.48 2.68 0.90 assign (resid 53 and name HB1 ) (resid 53 and name HD21 ) 3.29 1.49 0.66 assign (resid 53 and name HB2 ) (resid 53 and name HD21 ) 3.02 1.22 0.60 assign (resid 53 and name HB1 ) (resid 54 and name HN ) 4.60 2.80 0.92 assign (resid 54 and name HN ) (resid 54 and name HB ) 2.69 0.89 0.54 assign (resid 54 and name HN ) (resid 54 and name HG1* ) 2.72 0.92 0.54 assign (resid 54 and name HN ) (resid 54 and name HG2* ) 3.98 2.18 0.80 assign (resid 54 and name HN ) (resid 55 and name HN ) 3.11 1.31 0.62 assign (resid 54 and name HN ) (resid 56 and name HN ) 4.62 2.82 0.92 assign (resid 54 and name HB ) (resid 55 and name HN ) 4.38 2.58 0.88 assign (resid 54 and name HG1* ) (resid 55 and name HN ) 2.75 0.95 0.55 assign (resid 54 and name HG2* ) (resid 55 and name HN ) 4.10 2.30 0.82 assign (resid 55 and name HN ) (resid 58 and name HD1* ) 4.54 2.74 0.91 assign (resid 55 and name HN ) (resid 55 and name HB2 ) 2.75 0.95 0.55 assign (resid 55 and name HN ) (resid 55 and name HG2 ) 3.53 1.73 0.71 assign (resid 54 and name HA ) (resid 56 and name HN ) 4.55 2.75 0.91 assign (resid 55 and name HN ) (resid 56 and name HN ) 2.84 1.04 0.57 assign (resid 55 and name HB2 ) (resid 56 and name HN ) 3.42 1.62 0.68 assign (resid 55 and name HB1 ) (resid 56 and name HN ) 3.71 1.91 0.74 assign (resid 55 and name HG2 ) (resid 56 and name HN ) 5.01 3.21 1.00 assign (resid 55 and name HG1 ) (resid 56 and name HN ) 5.01 3.21 1.00 assign (resid 56 and name HN ) (resid 56 and name HB2 ) 3.37 1.57 0.67 assign (resid 56 and name HN ) (resid 56 and name HB1 ) 3.37 1.57 0.67 assign (resid 56 and name HN ) (resid 57 and name HN ) 2.88 1.08 0.58 assign (resid 56 and name HN ) (resid 58 and name HN ) 4.47 2.67 0.89 assign (resid 54 and name HA ) (resid 57 and name HN ) 3.49 1.69 0.70 assign (resid 55 and name HN ) (resid 57 and name HN ) 4.34 2.54 0.87 assign (resid 55 and name HA ) (resid 57 and name HN ) 4.63 2.83 0.93 assign (resid 56 and name HB2 ) (resid 57 and name HN ) 3.77 1.97 0.75 assign (resid 56 and name HB1 ) (resid 57 and name HN ) 3.77 1.97 0.75 assign (resid 57 and name HN ) (resid 57 and name HB ) 2.85 1.05 0.57 assign (resid 57 and name HN ) (resid 57 and name HG12 ) 3.85 2.05 0.77 assign (resid 57 and name HN ) (resid 57 and name HG11 ) 2.83 1.03 0.57 assign (resid 57 and name HN ) (resid 57 and name HD1* ) 3.40 1.60 0.68 assign (resid 57 and name HN ) (resid 58 and name HN ) 3.04 1.24 0.61 assign (resid 54 and name HA ) (resid 58 and name HN ) 4.31 2.51 0.86 assign (resid 55 and name HA ) (resid 58 and name HN ) 3.53 1.73 0.71 assign (resid 57 and name HB ) (resid 58 and name HN ) 3.00 1.20 0.60 assign (resid 57 and name HG2* ) (resid 58 and name HN ) 3.58 1.78 0.72 assign (resid 57 and name HG12 ) (resid 58 and name HN ) 5.14 3.34 1.03 assign (resid 57 and name HG11 ) (resid 58 and name HN ) 4.62 2.82 0.92 assign (resid 58 and name HN ) (resid 58 and name HB2 ) 2.95 1.15 0.59 assign (resid 58 and name HN ) (resid 58 and name HB1 ) 3.64 1.84 0.73 assign (resid 58 and name HN ) (resid 58 and name HG ) 2.81 1.01 0.56 assign (resid 58 and name HN ) (resid 58 and name HD2* ) 3.75 1.95 0.75 assign (resid 54 and name HG2* ) (resid 58 and name HN ) 4.10 2.30 0.82 assign (resid 58 and name HN ) (resid 59 and name HN ) 3.12 1.32 0.62 assign (resid 58 and name HN ) (resid 60 and name HN ) 4.90 3.10 0.98 assign (resid 55 and name HA ) (resid 59 and name HN ) 4.34 2.54 0.87 assign (resid 56 and name HA ) (resid 59 and name HN ) 3.93 2.13 0.79 assign (resid 57 and name HN ) (resid 59 and name HN ) 4.30 2.50 0.86 assign (resid 57 and name HA ) (resid 59 and name HN ) 5.23 3.43 1.05 assign (resid 58 and name HB2 ) (resid 59 and name HN ) 3.15 1.35 0.63 assign (resid 58 and name HB1 ) (resid 59 and name HN ) 3.74 1.94 0.75 assign (resid 58 and name HG ) (resid 59 and name HN ) 4.77 2.97 0.95 assign (resid 58 and name HD2* ) (resid 59 and name HN ) 4.98 3.18 1.00 assign (resid 58 and name HD1* ) (resid 59 and name HN ) 4.72 2.92 0.94 assign (resid 59 and name HN ) (resid 59 and name HB2 ) 2.78 0.98 0.56 assign (resid 59 and name HN ) (resid 59 and name HB1 ) 2.82 1.02 0.56 assign (resid 59 and name HN ) (resid 59 and name HD* ) 4.65 2.85 0.93 assign (resid 59 and name HN ) (resid 60 and name HN ) 3.12 1.32 0.62 assign (resid 56 and name HA ) (resid 60 and name HN ) 4.69 2.89 0.94 assign (resid 57 and name HA ) (resid 60 and name HN ) 3.93 2.13 0.79 assign (resid 58 and name HA ) (resid 60 and name HN ) 4.89 3.09 0.98 assign (resid 59 and name HB2 ) (resid 60 and name HN ) 4.08 2.28 0.82 assign (resid 59 and name HB1 ) (resid 60 and name HN ) 3.07 1.27 0.61 assign (resid 59 and name HG2 ) (resid 60 and name HN ) 4.04 2.24 0.81 assign (resid 59 and name HD* ) (resid 60 and name HN ) 4.98 3.18 1.00 assign (resid 60 and name HN ) (resid 60 and name HB2 ) 2.95 1.15 0.59 assign (resid 60 and name HN ) (resid 60 and name HB1 ) 3.33 1.53 0.67 assign (resid 60 and name HN ) (resid 61 and name HN ) 3.08 1.28 0.62 assign (resid 58 and name HA ) (resid 61 and name HN ) 3.51 1.71 0.70 assign (resid 59 and name HN ) (resid 61 and name HN ) 4.55 2.75 0.91 assign (resid 59 and name HA ) (resid 61 and name HN ) 5.09 3.29 1.02 assign (resid 60 and name HB2 ) (resid 61 and name HN ) 3.48 1.68 0.70 assign (resid 60 and name HB1 ) (resid 61 and name HN ) 3.75 1.95 0.75 assign (resid 61 and name HN ) (resid 61 and name HB1 ) 3.65 1.85 0.73 assign (resid 61 and name HN ) (resid 61 and name HB2 ) 2.98 1.18 0.60 assign (resid 61 and name HN ) (resid 61 and name HG ) 2.77 0.97 0.55 assign (resid 57 and name HG2* ) (resid 61 and name HN ) 4.13 2.33 0.83 assign (resid 61 and name HN ) (resid 61 and name HD1* ) 3.79 1.99 0.76 assign (resid 58 and name HA ) (resid 62 and name HN ) 3.82 2.02 0.76 assign (resid 60 and name HN ) (resid 62 and name HN ) 4.40 2.60 0.88 assign (resid 61 and name HN ) (resid 62 and name HN ) 2.98 1.18 0.60 assign (resid 61 and name HB1 ) (resid 62 and name HN ) 3.47 1.67 0.69 assign (resid 61 and name HB2 ) (resid 62 and name HN ) 3.06 1.26 0.61 assign (resid 61 and name HG ) (resid 62 and name HN ) 4.47 2.67 0.89 assign (resid 61 and name HD2* ) (resid 62 and name HN ) 4.78 2.98 0.96 assign (resid 61 and name HD1* ) (resid 62 and name HN ) 4.43 2.63 0.89 assign (resid 62 and name HN ) (resid 62 and name HB1 ) 3.55 1.75 0.71 assign (resid 62 and name HN ) (resid 62 and name HB2 ) 2.81 1.01 0.56 assign (resid 62 and name HN ) (resid 62 and name HD22 ) 4.32 2.52 0.86 assign (resid 62 and name HN ) (resid 62 and name HD21 ) 3.76 1.96 0.75 assign (resid 62 and name HN ) (resid 64 and name HN ) 4.45 2.65 0.89 assign (resid 62 and name HB2 ) (resid 62 and name HD22 ) 3.46 1.66 0.69 assign (resid 62 and name HA ) (resid 62 and name HD21 ) 4.56 2.76 0.91 assign (resid 62 and name HB2 ) (resid 62 and name HD21 ) 3.14 1.34 0.63 assign (resid 59 and name HA ) (resid 63 and name HN ) 4.59 2.79 0.92 assign (resid 60 and name HA ) (resid 63 and name HN ) 3.66 1.86 0.73 assign (resid 61 and name HN ) (resid 63 and name HN ) 4.17 2.37 0.83 assign (resid 61 and name HA ) (resid 63 and name HN ) 4.25 2.45 0.85 assign (resid 62 and name HN ) (resid 63 and name HN ) 2.96 1.16 0.59 assign (resid 62 and name HB2 ) (resid 63 and name HN ) 3.57 1.77 0.71 assign (resid 62 and name HD22 ) (resid 63 and name HN ) 6.32 4.52 1.26 assign (resid 62 and name HD21 ) (resid 63 and name HN ) 5.80 4.00 1.16 assign (resid 63 and name HN ) (resid 63 and name HB* ) 2.44 0.64 0.49 assign (resid 63 and name HN ) (resid 64 and name HN ) 2.93 1.13 0.59 assign (resid 60 and name HA ) (resid 64 and name HN ) 5.36 3.56 1.07 assign (resid 61 and name HA ) (resid 64 and name HN ) 3.92 2.12 0.78 assign (resid 62 and name HA ) (resid 64 and name HN ) 4.05 2.25 0.81 assign (resid 63 and name HB* ) (resid 64 and name HN ) 3.05 1.25 0.61 assign (resid 64 and name HN ) (resid 64 and name HB1 ) 3.67 1.87 0.73 assign (resid 64 and name HN ) (resid 64 and name HB2 ) 2.80 1.00 0.56 assign (resid 64 and name HN ) (resid 64 and name HG ) 2.70 0.90 0.54 assign (resid 64 and name HN ) (resid 64 and name HD2* ) 3.42 1.62 0.68 assign (resid 64 and name HN ) (resid 64 and name HD1* ) 3.58 1.78 0.72 assign (resid 64 and name HN ) (resid 65 and name HN ) 3.03 1.23 0.61 assign (resid 64 and name HB1 ) (resid 65 and name HN ) 4.01 2.21 0.80 assign (resid 64 and name HB2 ) (resid 65 and name HN ) 3.27 1.47 0.65 assign (resid 64 and name HG ) (resid 65 and name HN ) 4.31 2.51 0.86 assign (resid 64 and name HD1* ) (resid 65 and name HN ) 4.59 2.79 0.92 assign (resid 65 and name HN ) (resid 65 and name HB* ) 2.51 0.71 0.50 assign (resid 65 and name HN ) (resid 66 and name HN ) 2.95 1.15 0.59 assign (resid 65 and name HB* ) (resid 66 and name HN ) 3.11 1.31 0.62 assign (resid 66 and name HN ) (resid 66 and name HB2 ) 2.54 0.74 0.51 assign (resid 66 and name HN ) (resid 66 and name HB1 ) 3.62 1.82 0.72 assign (resid 66 and name HN ) (resid 66 and name HD1* ) 3.93 2.13 0.79 assign (resid 66 and name HN ) (resid 67 and name HN ) 3.11 1.31 0.62 assign (resid 66 and name HB2 ) (resid 67 and name HN ) 3.41 1.61 0.68 assign (resid 66 and name HB1 ) (resid 67 and name HN ) 3.42 1.62 0.68 assign (resid 66 and name HD2* ) (resid 67 and name HN ) 4.59 2.79 0.92 assign (resid 66 and name HD1* ) (resid 67 and name HN ) 4.43 2.63 0.89 assign (resid 67 and name HN ) (resid 67 and name HB* ) 3.27 1.47 0.65 assign (resid 67 and name HN ) (resid 67 and name HG2 ) 3.68 1.88 0.74 assign (resid 67 and name HN ) (resid 67 and name HG1 ) 3.68 1.88 0.74 assign (resid 67 and name HN ) (resid 68 and name HN ) 4.00 2.20 0.80 assign (resid 12 and name HN ) (resid 39 and name HA ) 3.20 1.40 0.64 assign (resid 67 and name HB* ) (resid 68 and name 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and name HN ) (resid 43 and name HG ) 4.96 3.16 0.99 assign (resid 9 and name HN ) (resid 54 and name HG2* ) 6.13 4.33 1.23 assign (resid 9 and name HN ) (resid 58 and name HD1* ) 6.50 4.70 1.30 assign (resid 9 and name HN ) (resid 43 and name HD1* ) 4.10 2.30 0.82 assign (resid 10 and name HN ) (resid 14 and name HN ) 4.36 2.56 0.87 assign (resid 11 and name HN ) (resid 43 and name HD2* ) 4.09 2.29 0.82 assign (resid 11 and name HN ) (resid 39 and name HA ) 4.81 3.01 0.96 assign (resid 11 and name HN ) (resid 42 and name HA ) 3.78 1.98 0.76 assign (resid 12 and name HN ) (resid 39 and name HB2 ) 5.20 3.40 1.04 assign (resid 12 and name HN ) (resid 39 and name HB1 ) 4.11 2.31 0.82 assign (resid 12 and name HN ) (resid 13 and name HG1 ) 4.78 2.98 0.96 assign (resid 12 and name HN ) (resid 13 and name HB2 ) 4.85 3.05 0.97 assign (resid 10 and name HA ) (resid 12 and name HN ) 4.42 2.62 0.88 assign (resid 10 and name HB ) (resid 12 and name HN ) 3.15 1.35 0.63 assign (resid 10 and name HN 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(resid 14 and name HN ) 4.65 2.85 0.93 assign (resid 9 and name HB2 ) (resid 14 and name HN ) 4.36 2.56 0.87 assign (resid 15 and name HN ) (resid 21 and name HG1* ) 3.92 2.12 0.78 assign (resid 12 and name HB* ) (resid 15 and name HN ) 5.01 3.21 1.00 assign (resid 9 and name HE* ) (resid 15 and name HN ) 5.15 3.35 1.03 assign (resid 15 and name HN ) (resid 16 and name HB2 ) 4.99 3.19 1.00 assign (resid 15 and name HN ) (resid 16 and name HG* ) 5.96 4.16 1.19 assign (resid 12 and name HB* ) (resid 16 and name HN ) 4.68 2.88 0.94 assign (resid 16 and name HN ) (resid 17 and name HG2* ) 5.82 4.02 1.16 assign (resid 13 and name HB2 ) (resid 16 and name HN ) 5.65 3.85 1.13 assign (resid 15 and name HA ) (resid 16 and name HE21 ) 4.57 2.77 0.91 assign (resid 37 and name HA2 ) (resid 39 and name HE21 ) 5.21 3.41 1.04 assign (resid 16 and name HN ) (resid 17 and name HB ) 5.05 3.25 1.01 assign (resid 15 and name HN ) (resid 17 and name HN ) 4.25 2.45 0.85 assign (resid 5 and name HZ ) (resid 17 and name HN ) 5.33 3.53 1.07 assign (resid 17 and name HN ) (resid 18 and name HA ) 5.88 4.08 1.18 assign (resid 17 and name HN ) (resid 21 and name HG2* ) 3.92 2.12 0.78 assign (resid 14 and name HB* ) (resid 17 and name HN ) 4.52 2.72 0.90 assign (resid 9 and name HE* ) (resid 17 and name HN ) 4.73 2.93 0.95 assign (resid 17 and name HN ) (resid 21 and name HB ) 5.30 3.50 1.06 assign (resid 18 and name HN ) (resid 21 and name HG2* ) 3.06 1.26 0.61 assign (resid 5 and name HZ ) (resid 18 and name HN ) 4.20 2.40 0.84 assign (resid 14 and name HA ) (resid 18 and name HN ) 5.03 3.23 1.01 assign (resid 16 and name HA ) (resid 18 and name HN ) 5.44 3.64 1.09 assign (resid 18 and name HN ) (resid 19 and name HD1 ) 5.57 3.77 1.11 assign (resid 18 and name HN ) (resid 21 and name HB ) 3.93 2.13 0.79 assign (resid 18 and name HN ) (resid 64 and name HD1* ) 4.58 2.78 0.92 assign (resid 15 and name HD2* ) (resid 18 and name HN ) 5.52 3.72 1.10 assign (resid 14 and name HB* ) (resid 18 and name HN ) 5.18 3.38 1.04 assign (resid 18 and name HN ) (resid 61 and name HD2* ) 5.77 3.97 1.15 assign (resid 21 and name HN ) (resid 25 and name HN ) 6.15 4.35 1.23 assign (resid 18 and name HB1 ) (resid 21 and name HN ) 4.06 2.26 0.81 assign (resid 15 and name HA ) (resid 22 and name HN ) 4.33 2.53 0.87 assign (resid 19 and name HA ) (resid 21 and name HN ) 3.92 2.12 0.78 assign (resid 33 and name HG2* ) (resid 38 and name HN ) 4.63 2.83 0.93 assign (resid 21 and name HN ) (resid 64 and name HD2* ) 4.90 3.10 0.98 assign (resid 21 and name HN ) (resid 64 and name HD1* ) 3.49 1.69 0.70 assign (resid 21 and name HN ) (resid 24 and name HG2* ) 4.05 2.25 0.81 assign (resid 21 and name HN ) (resid 22 and name HB* ) 4.66 2.86 0.93 assign (resid 21 and name HN ) (resid 61 and name HD2* ) 4.30 2.50 0.86 assign (resid 15 and name HD2* ) (resid 22 and name HN ) 3.15 1.35 0.63 assign (resid 22 and name HN ) (resid 25 and name HD1* ) 5.04 3.24 1.01 assign (resid 20 and name HA2 ) (resid 23 and name HN ) 4.08 2.28 0.82 assign (resid 23 and name HN ) (resid 24 and name HB ) 5.17 3.37 1.03 assign (resid 23 and name HN ) (resid 26 and name HB2 ) 5.35 3.55 1.07 assign (resid 23 and name HN ) (resid 24 and name HG2* ) 4.38 2.58 0.88 assign (resid 24 and name HN ) (resid 64 and name HD2* ) 4.41 2.61 0.88 assign (resid 24 and name HN ) (resid 64 and name HD1* ) 4.49 2.69 0.90 assign (resid 24 and name HN ) (resid 61 and name HD2* ) 4.25 2.45 0.85 assign (resid 21 and name HG1* ) (resid 25 and name HN ) 3.91 2.11 0.78 assign (resid 25 and name HN ) (resid 61 and name HD2* ) 3.96 2.16 0.79 assign (resid 22 and name HB* ) (resid 26 and name HN ) 4.85 3.05 0.97 assign (resid 25 and name HD2* ) (resid 27 and name HN ) 5.88 4.08 1.18 assign (resid 27 and name HN ) (resid 28 and name HA ) 5.40 3.60 1.08 assign (resid 27 and name HN ) (resid 29 and name HN ) 4.38 2.58 0.88 assign (resid 28 and name HN ) (resid 30 and name HN ) 3.96 2.16 0.79 assign (resid 25 and name HB2 ) (resid 28 and name HN ) 5.74 3.94 1.15 assign (resid 28 and name HN ) (resid 30 and name HG ) 4.45 2.65 0.89 assign (resid 28 and name HN ) (resid 52 and name HD1* ) 5.05 3.25 1.01 assign (resid 24 and name HG1* ) (resid 28 and name HN ) 5.15 3.35 1.03 assign (resid 28 and name HN ) (resid 30 and name HD1* ) 4.77 2.97 0.95 assign (resid 25 and name HD2* ) (resid 28 and name HN ) 5.08 3.28 1.02 assign (resid 29 and name HN ) (resid 30 and name HG ) 4.36 2.56 0.87 assign (resid 29 and name HN ) (resid 52 and name HD1* ) 4.82 3.02 0.96 assign (resid 29 and name HD21 ) (resid 52 and name HD2* ) 5.90 4.10 1.18 assign (resid 26 and name HA ) (resid 29 and name HN ) 3.95 2.15 0.79 assign (resid 27 and name HA ) (resid 29 and name HN ) 3.97 2.17 0.79 assign (resid 26 and name HA ) (resid 30 and name HN ) 3.66 1.86 0.73 assign (resid 25 and name HA ) (resid 30 and name HN ) 5.14 3.34 1.03 assign (resid 28 and name HB2 ) (resid 30 and name HN ) 4.54 2.74 0.91 assign (resid 30 and name HN ) (resid 52 and name HD1* ) 5.01 3.21 1.00 assign (resid 25 and name HB2 ) (resid 30 and name HN ) 5.02 3.22 1.00 assign (resid 31 and name HN ) (resid 32 and name HB* ) 4.86 3.06 0.97 assign (resid 29 and name HA ) (resid 31 and name HN ) 3.96 2.16 0.79 assign (resid 31 and name HN ) (resid 33 and name HN ) 6.50 4.70 1.30 assign (resid 26 and name HN ) (resid 31 and name HN ) 5.63 3.83 1.13 assign (resid 32 and name HN ) (resid 34 and name HN ) 4.75 2.95 0.95 assign (resid 30 and name HA ) (resid 32 and name HN ) 4.21 2.41 0.84 assign (resid 32 and name HN ) (resid 35 and name HB* ) 5.83 4.03 1.17 assign (resid 32 and name HN ) (resid 33 and name HB ) 6.47 4.67 1.29 assign (resid 30 and name HB1 ) (resid 32 and name HN ) 5.14 3.34 1.03 assign (resid 32 and name HN ) (resid 33 and name HG12 ) 5.19 3.39 1.04 assign (resid 32 and name HN ) (resid 33 and name HG2* ) 4.71 2.91 0.94 assign (resid 30 and name HB2 ) (resid 33 and name HN ) 5.42 3.62 1.08 assign (resid 35 and name HN ) (resid 36 and name HB2 ) 6.12 4.32 1.22 assign (resid 35 and name HN ) (resid 36 and name HE* ) 6.50 4.70 1.30 assign (resid 35 and name HN ) (resid 38 and name HB* ) 5.25 3.45 1.05 assign (resid 33 and name HG11 ) (resid 35 and name HN ) 6.50 4.70 1.30 assign (resid 35 and name HA ) (resid 37 and name HN ) 4.22 2.42 0.84 assign (resid 36 and name HE* ) (resid 38 and name HN ) 4.36 2.56 0.87 assign (resid 38 and name HN ) (resid 41 and name HB* ) 6.50 4.70 1.30 assign (resid 37 and name HN ) (resid 38 and name HB* ) 5.17 3.37 1.03 assign (resid 15 and name HD1* ) (resid 39 and name HE21 ) 4.35 2.55 0.87 assign (resid 33 and name HG2* ) (resid 39 and name HE21 ) 5.39 3.59 1.08 assign (resid 15 and name HD1* ) (resid 39 and name HE22 ) 4.18 2.38 0.84 assign (resid 10 and name HG2* ) (resid 40 and name HN ) 5.84 4.04 1.17 assign (resid 12 and name HB* ) (resid 40 and name HD21 ) 5.91 4.11 1.18 assign (resid 12 and name HB* ) (resid 40 and name HD22 ) 5.15 3.35 1.03 assign (resid 10 and name HG2* ) (resid 40 and name HD22 ) 6.50 4.70 1.30 assign (resid 38 and name HA ) (resid 40 and name HN ) 4.14 2.34 0.83 assign (resid 37 and name HA1 ) (resid 40 and name HD21 ) 4.99 3.19 1.00 assign (resid 12 and name HN ) (resid 40 and name HN ) 5.31 3.51 1.06 assign (resid 11 and name HD* ) (resid 41 and name HN ) 4.04 2.24 0.81 assign (resid 42 and name HN ) (resid 45 and name HE22 ) 5.30 3.50 1.06 assign (resid 11 and name HN ) (resid 42 and name HN ) 5.78 3.98 1.16 assign (resid 42 and name HN ) (resid 44 and name HN ) 6.35 4.55 1.27 assign (resid 10 and name HB ) (resid 41 and name HN ) 4.09 2.29 0.82 assign (resid 39 and name HA ) (resid 41 and name HN ) 4.29 2.49 0.86 assign (resid 38 and name HB* ) (resid 41 and name HN ) 4.50 2.70 0.90 assign (resid 42 and name HN ) (resid 45 and name HB2 ) 3.21 1.41 0.64 assign (resid 10 and name HA ) (resid 42 and name HN ) 4.48 2.68 0.90 assign (resid 10 and name HA ) (resid 43 and name HN ) 3.53 1.73 0.71 assign (resid 7 and name HA ) (resid 43 and name HN ) 4.67 2.87 0.93 assign (resid 9 and name HA ) (resid 43 and name HN ) 5.51 3.71 1.10 assign (resid 10 and name HG2* ) (resid 43 and name HN ) 4.72 2.92 0.94 assign (resid 44 and name HN ) (resid 54 and name HG1* ) 4.84 3.04 0.97 assign (resid 7 and name HG1 ) (resid 44 and name HN ) 5.21 3.41 1.04 assign (resid 7 and name HA ) (resid 44 and name HN ) 3.83 2.03 0.77 assign (resid 8 and name HA ) (resid 44 and name HN ) 4.69 2.89 0.94 assign (resid 42 and name HA ) (resid 44 and name HN ) 4.59 2.79 0.92 assign (resid 45 and name HN ) (resid 47 and name HB* ) 5.32 3.52 1.06 assign (resid 45 and name HN ) (resid 54 and name HG2* ) 4.89 3.09 0.98 assign (resid 43 and name HB2 ) (resid 45 and name HN ) 5.34 3.54 1.07 assign (resid 45 and name HN ) (resid 46 and name HA1 ) 5.61 3.81 1.12 assign (resid 45 and name HN ) (resid 48 and name HD21 ) 5.10 3.30 1.02 assign (resid 42 and name HN ) (resid 45 and name HN ) 4.33 2.53 0.87 assign (resid 11 and name HE* ) (resid 46 and name HN ) 3.57 1.77 0.71 assign (resid 11 and name HZ ) (resid 46 and name HN ) 4.04 2.24 0.81 assign (resid 11 and name HD* ) (resid 46 and name HN ) 4.70 2.90 0.94 assign (resid 41 and name HB* ) (resid 46 and name HN ) 4.67 2.87 0.93 assign (resid 41 and name HG2 ) (resid 46 and name HN ) 4.84 3.04 0.97 assign (resid 46 and name HN ) (resid 47 and name HB* ) 4.75 2.95 0.95 assign (resid 30 and name HD1* ) (resid 46 and name HN ) 6.41 4.61 1.28 assign (resid 14 and name HN ) (resid 21 and name HG1* ) 5.22 3.42 1.04 assign (resid 43 and name HB1 ) (resid 47 and name HN ) 6.02 4.22 1.20 assign (resid 47 and name HN ) (resid 54 and name HG2* ) 5.77 3.97 1.15 assign (resid 47 and name HN ) (resid 54 and name HB ) 4.63 2.83 0.93 assign (resid 47 and name HN ) (resid 49 and name HB* ) 4.61 2.81 0.92 assign (resid 47 and name HN ) (resid 57 and name HD1* ) 4.01 2.21 0.80 assign (resid 48 and name HN ) (resid 54 and name HG2* ) 5.42 3.62 1.08 assign (resid 48 and name HN ) (resid 49 and name HB* ) 4.36 2.56 0.87 assign (resid 48 and name HN ) (resid 54 and name HB ) 4.37 2.57 0.87 assign (resid 11 and name HE* ) (resid 47 and name HN ) 4.36 2.56 0.87 assign (resid 11 and name HZ ) (resid 47 and name HN ) 4.14 2.34 0.83 assign (resid 45 and name HN ) (resid 48 and name HD22 ) 6.41 4.61 1.28 assign (resid 48 and name HD22 ) (resid 49 and name HN ) 6.50 4.70 1.30 assign (resid 45 and name HA ) (resid 48 and name HD22 ) 5.34 3.54 1.07 assign (resid 45 and name HA ) (resid 48 and name HD21 ) 3.80 2.00 0.76 assign (resid 48 and name HN ) (resid 57 and name HD1* ) 5.51 3.71 1.10 assign (resid 44 and name HG2 ) (resid 48 and name HD22 ) 3.47 1.67 0.69 assign (resid 44 and name HG1 ) (resid 48 and name HD22 ) 3.60 1.80 0.72 assign (resid 47 and name HB* ) (resid 48 and name HD22 ) 5.53 3.73 1.11 assign (resid 44 and name HG2 ) (resid 48 and name HD21 ) 3.59 1.79 0.72 assign (resid 44 and name HG1 ) (resid 48 and name HD21 ) 3.78 1.98 0.76 assign (resid 47 and name HB* ) (resid 48 and name HD21 ) 4.64 2.84 0.93 assign (resid 47 and name HB* ) (resid 49 and name HN ) 4.47 2.67 0.89 assign (resid 30 and name HD2* ) (resid 49 and name HN ) 5.87 4.07 1.17 assign (resid 47 and name HB* ) (resid 50 and name HN ) 4.69 2.89 0.94 assign (resid 50 and name HN ) (resid 52 and name HD1* ) 4.72 2.92 0.94 assign (resid 50 and name HN ) (resid 52 and name HG ) 4.47 2.67 0.89 assign (resid 30 and name HD2* ) (resid 50 and name HN ) 4.73 2.93 0.95 assign (resid 3 and name HE21 ) (resid 58 and name HD2* ) 5.14 3.34 1.03 assign (resid 51 and name HN ) (resid 52 and name HG ) 4.18 2.38 0.84 assign (resid 49 and name HB* ) (resid 51 and name HN ) 4.25 2.45 0.85 assign (resid 52 and name HN ) (resid 57 and name HD1* ) 5.51 3.71 1.10 assign (resid 50 and name HB2 ) (resid 52 and name HN ) 4.31 2.51 0.86 assign (resid 50 and name HB1 ) (resid 52 and name HN ) 4.37 2.57 0.87 assign (resid 50 and name HN ) (resid 52 and name HN ) 3.87 2.07 0.77 assign (resid 53 and name HN ) (resid 57 and name HD1* ) 4.41 2.61 0.88 assign (resid 53 and name HD22 ) (resid 55 and name HB1 ) 4.09 2.29 0.82 assign (resid 53 and name HD22 ) (resid 55 and name HB2 ) 3.57 1.77 0.71 assign (resid 53 and name HD22 ) (resid 54 and name HG1* ) 5.08 3.28 1.02 assign (resid 53 and name HD22 ) (resid 55 and name HG1 ) 4.67 2.87 0.93 assign (resid 53 and name HD21 ) (resid 55 and name HB1 ) 4.74 2.94 0.95 assign (resid 53 and name HD21 ) (resid 55 and name HB2 ) 4.42 2.62 0.88 assign (resid 53 and name HN ) (resid 55 and name HN ) 5.69 3.89 1.14 assign (resid 53 and name HD21 ) (resid 55 and name HN ) 5.67 3.87 1.13 assign (resid 54 and name HN ) (resid 57 and name HD1* ) 4.72 2.92 0.94 assign (resid 47 and name HB* ) (resid 54 and name HN ) 3.26 1.46 0.65 assign (resid 44 and name HA ) (resid 54 and name HN ) 4.38 2.58 0.88 assign (resid 11 and name HN ) (resid 41 and name HN ) 4.20 2.40 0.84 assign (resid 11 and name HN ) (resid 12 and name HB* ) 4.57 2.77 0.91 assign (resid 63 and name HN ) (resid 66 and name HD1* ) 4.14 2.34 0.83 assign (resid 56 and name HN ) (resid 57 and name HG11 ) 4.35 2.55 0.87 assign (resid 54 and name HG2* ) (resid 56 and name HN ) 5.85 4.05 1.17 assign (resid 56 and name HN ) (resid 58 and name HD1* ) 6.34 4.54 1.27 assign (resid 56 and name HN ) (resid 57 and name HD1* ) 5.05 3.25 1.01 assign (resid 52 and name HD1* ) (resid 57 and name HN ) 6.28 4.48 1.26 assign (resid 57 and name HN ) (resid 58 and name HG ) 4.71 2.91 0.94 assign (resid 57 and name HN ) (resid 58 and name HB2 ) 5.20 3.40 1.04 assign (resid 53 and name HB1 ) (resid 56 and name HN ) 3.62 1.82 0.72 assign (resid 53 and name HA ) (resid 56 and name HN ) 4.87 3.07 0.97 assign (resid 28 and name HE* ) (resid 56 and name HN ) 5.29 3.49 1.06 assign (resid 53 and name HD22 ) (resid 56 and name HN ) 4.85 3.05 0.97 assign (resid 56 and name HN ) (resid 59 and name HN ) 5.49 3.69 1.10 assign (resid 63 and name HN ) (resid 65 and name HN ) 5.73 3.93 1.15 assign (resid 57 and name HN ) (resid 60 and name HN ) 5.13 3.33 1.03 assign (resid 60 and name HN ) (resid 61 and name HG ) 4.70 2.90 0.94 assign (resid 24 and name HG1* ) (resid 60 and name HN ) 4.08 2.28 0.82 assign (resid 57 and name HG2* ) (resid 60 and name HN ) 4.89 3.09 0.98 assign (resid 61 and name HN ) (resid 64 and name HD1* ) 5.37 3.57 1.07 assign (resid 24 and name HG1* ) (resid 61 and name HN ) 3.56 1.76 0.71 assign (resid 5 and name HB2 ) (resid 62 and name HN ) 4.71 2.91 0.94 assign (resid 62 and name HN ) (resid 63 and name HB* ) 4.32 2.52 0.86 assign (resid 58 and name HB1 ) (resid 62 and name HN ) 4.67 2.87 0.93 assign (resid 24 and name HG1* ) (resid 62 and name HN ) 4.91 3.11 0.98 assign (resid 5 and name HB2 ) (resid 62 and name HD22 ) 3.87 2.07 0.77 assign (resid 5 and name HB1 ) (resid 62 and name HD22 ) 4.12 2.32 0.82 assign (resid 3 and name HB1 ) (resid 62 and name HD22 ) 4.25 2.45 0.85 assign (resid 3 and name HB2 ) (resid 62 and name HD22 ) 4.86 3.06 0.97 assign (resid 4 and name HB1 ) (resid 62 and name HD22 ) 6.50 4.70 1.30 assign (resid 58 and name HB1 ) (resid 62 and name HD22 ) 3.88 2.08 0.78 assign (resid 58 and name HD2* ) (resid 62 and name HD22 ) 3.84 2.04 0.77 assign (resid 5 and name HB2 ) (resid 62 and name HD21 ) 4.13 2.33 0.83 assign (resid 5 and name HB1 ) (resid 62 and name HD21 ) 4.99 3.19 1.00 assign (resid 3 and name HG* ) (resid 62 and name HD21 ) 5.43 3.63 1.09 assign (resid 3 and name HB1 ) (resid 62 and name HD21 ) 4.44 2.64 0.89 assign (resid 58 and name HB2 ) (resid 62 and name HD21 ) 4.35 2.55 0.87 assign (resid 58 and name HB1 ) (resid 62 and name HD21 ) 3.61 1.81 0.72 assign (resid 61 and name HB2 ) (resid 62 and name HD21 ) 5.66 3.86 1.13 assign (resid 58 and name HD1* ) (resid 62 and name HD21 ) 5.01 3.21 1.00 assign (resid 58 and name HD2* ) (resid 62 and name HD21 ) 3.95 2.15 0.79 assign (resid 58 and name HA ) (resid 62 and name HD22 ) 5.01 3.21 1.00 assign (resid 58 and name HA ) (resid 62 and name HD21 ) 4.85 3.05 0.97 assign (resid 59 and name HA ) (resid 62 and name HD21 ) 4.28 2.48 0.86 assign (resid 5 and name HN ) (resid 62 and name HD21 ) 4.51 2.71 0.90 assign (resid 4 and name HN ) (resid 62 and name HD21 ) 6.14 4.34 1.23 assign (resid 61 and name HN ) (resid 62 and name HD21 ) 6.39 4.59 1.28 assign (resid 5 and name HD* ) (resid 62 and name HN ) 4.08 2.28 0.82 assign (resid 28 and name HE* ) (resid 60 and name HN ) 5.39 3.59 1.08 assign (resid 5 and name HD* ) (resid 61 and name HN ) 5.95 4.15 1.19 assign (resid 63 and name HN ) (resid 64 and name HB2 ) 5.18 3.38 1.04 assign (resid 63 and name HN ) (resid 64 and name HG ) 4.36 2.56 0.87 assign (resid 54 and name HG1* ) (resid 56 and name HN ) 5.56 3.76 1.11 assign (resid 24 and name HG2* ) (resid 64 and name HN ) 4.60 2.80 0.92 assign (resid 64 and name HN ) (resid 66 and name HN ) 4.91 3.11 0.98 assign (resid 66 and name HN ) (resid 68 and name HD2 ) 5.69 3.89 1.14 assign (resid 64 and name HA ) (resid 66 and name HN ) 4.30 2.50 0.86 assign (resid 68 and name HN ) (resid 68 and name HD2 ) 4.86 3.06 0.97 assign (resid 67 and name HN ) (resid 68 and name HD2 ) 5.07 3.27 1.01 assign (resid 25 and name HB1 ) (resid 31 and name HN ) 5.43 3.63 1.09 assign (resid 25 and name HB2 ) (resid 31 and name HN ) 6.10 4.30 1.22 assign (resid 26 and name HB2 ) (resid 31 and name HN ) 6.50 4.70 1.30 assign (resid 47 and name HB* ) (resid 52 and name HN ) 3.75 1.95 0.75 assign (resid 54 and name HG2* ) (resid 57 and name HN ) 4.58 2.78 0.92 assign (resid 26 and name HE ) (resid 27 and name HN ) 6.38 4.58 1.28 assign (resid 26 and name HB2 ) (resid 26 and name HE ) 4.16 2.36 0.83 assign (resid 59 and name HN ) (resid 59 and name HE ) 6.45 4.65 1.29 assign (resid 59 and name HB1 ) (resid 59 and name HE ) 3.64 1.84 0.73 assign (resid 59 and name HB2 ) (resid 59 and name HE ) 3.92 2.12 0.78 assign (resid 59 and name HG1 ) (resid 59 and name HE ) 4.02 2.22 0.80 assign (resid 59 and name HG2 ) (resid 59 and name HE ) 3.20 1.40 0.64 assign (resid 9 and name HN ) (resid 43 and name HN ) 4.56 2.76 0.91 assign (resid 11 and name HN ) (resid 43 and name HN ) 5.18 3.38 1.04 assign (resid 43 and name HN ) (resid 44 and name HN ) 3.32 1.52 0.66 assign (resid 13 and name HN ) (resid 13 and name HE22 ) 6.27 4.47 1.25 assign (resid 46 and name HN ) (resid 48 and name HN ) 4.77 2.97 0.95 assign (resid 53 and name HD22 ) (resid 55 and name HN ) 4.41 2.61 0.88 assign (resid 44 and name HN ) (resid 54 and name HG2* ) 3.16 1.36 0.63 assign (resid 3 and name HN ) (resid 6 and name HG2* ) 6.01 4.21 1.20 assign (resid 3 and name HE21 ) (resid 7 and name HN ) 5.84 4.04 1.17 assign (resid 3 and name HE21 ) (resid 4 and name HN ) 5.26 3.46 1.05 assign (resid 4 and name HN ) (resid 5 and name HE* ) 5.82 4.02 1.16 assign (resid 4 and name HN ) (resid 62 and name HD22 ) 4.84 3.04 0.97 assign (resid 4 and name HN ) (resid 17 and name HG2* ) 6.25 4.45 1.25 assign (resid 5 and name HN ) (resid 17 and name HG2* ) 5.53 3.73 1.11 assign (resid 8 and name HN ) (resid 44 and name HN ) 5.54 3.74 1.11 assign (resid 8 and name HN ) (resid 43 and name HN ) 5.65 3.85 1.13 assign (resid 9 and name HN ) (resid 44 and name HN ) 5.74 3.94 1.15 assign (resid 10 and name HN ) (resid 10 and name HG1 ) 4.58 2.78 0.92 assign (resid 12 and name HN ) (resid 33 and name HD1* ) 5.16 3.36 1.03 assign (resid 14 and name HN ) (resid 43 and name HD1* ) 4.93 3.13 0.99 assign (resid 14 and name HN ) (resid 43 and name HD2* ) 5.44 3.64 1.09 assign (resid 43 and name HD2* ) (resid 47 and name HN ) 5.82 4.02 1.16 assign (resid 9 and name HE* ) (resid 16 and name HN ) 6.19 4.39 1.24 assign (resid 13 and name HB1 ) (resid 16 and name HN ) 6.50 4.70 1.30 assign (resid 12 and name HB* ) (resid 16 and name HE21 ) 4.84 3.04 0.97 assign (resid 12 and name HB* ) (resid 39 and name HE21 ) 4.33 2.53 0.87 assign (resid 15 and name HB1 ) (resid 16 and name HE22 ) 4.78 2.98 0.96 assign (resid 5 and name HZ ) (resid 21 and name HN ) 5.34 3.54 1.07 assign (resid 22 and name HB* ) (resid 24 and name HN ) 4.41 2.61 0.88 assign (resid 24 and name HN ) (resid 25 and name HB2 ) 5.48 3.68 1.10 assign (resid 24 and name HN ) (resid 26 and name HB2 ) 5.81 4.01 1.16 assign (resid 27 and name HN ) (resid 28 and name HB2 ) 4.75 2.95 0.95 assign (resid 26 and name HE ) (resid 31 and name HA1 ) 6.12 4.32 1.22 assign (resid 26 and name HN ) (resid 29 and name HN ) 5.69 3.89 1.14 assign (resid 29 and name HN ) (resid 29 and name HD21 ) 5.50 3.70 1.10 assign (resid 30 and name HN ) (resid 32 and name HN ) 4.79 2.99 0.96 assign (resid 31 and name HN ) (resid 33 and name HG2* ) 5.04 3.24 1.01 assign (resid 32 and name HB* ) (resid 35 and name HN ) 4.85 3.05 0.97 assign (resid 35 and name HA ) (resid 38 and name HN ) 6.33 4.53 1.27 assign (resid 37 and name HA1 ) (resid 39 and name HN ) 4.22 2.42 0.84 assign (resid 12 and name HB* ) (resid 39 and name HN ) 4.84 3.04 0.97 assign (resid 33 and name HG2* ) (resid 39 and name HN ) 5.59 3.79 1.12 assign (resid 33 and name HD1* ) (resid 39 and name HN ) 6.00 4.20 1.20 assign (resid 12 and name HB* ) (resid 39 and name HE22 ) 4.94 3.14 0.99 assign (resid 38 and name HB* ) (resid 39 and name HE22 ) 5.27 3.47 1.05 assign (resid 38 and name HB* ) (resid 39 and name HE21 ) 6.21 4.41 1.24 assign (resid 21 and name HG1* ) (resid 39 and name HE22 ) 6.32 4.52 1.26 assign (resid 34 and name HA2 ) (resid 39 and name HE22 ) 5.65 3.85 1.13 assign (resid 11 and name HA ) (resid 39 and name HE22 ) 5.70 3.90 1.14 assign (resid 34 and name HA1 ) (resid 39 and name HE22 ) 6.29 4.49 1.26 assign (resid 34 and name HA2 ) (resid 39 and name HE21 ) 5.11 3.31 1.02 assign (resid 33 and name HA ) (resid 39 and name HE21 ) 5.43 3.63 1.09 assign (resid 39 and name HB2 ) (resid 40 and name HD22 ) 4.82 3.02 0.96 assign (resid 39 and name HG1 ) (resid 40 and name HD22 ) 5.99 4.19 1.20 assign (resid 39 and name HG2 ) (resid 40 and name HD21 ) 6.29 4.49 1.26 assign (resid 39 and name HB2 ) (resid 40 and name HD21 ) 4.96 3.16 0.99 assign (resid 10 and name HG2* ) (resid 40 and name HD21 ) 6.50 4.70 1.30 assign (resid 6 and name HN ) (resid 58 and name HB1 ) 6.50 4.70 1.30 assign (resid 33 and name HB ) (resid 41 and name HN ) 5.95 4.15 1.19 assign (resid 36 and name HE* ) (resid 41 and name HN ) 6.50 4.70 1.30 assign (resid 39 and name HB2 ) (resid 41 and name HN ) 6.50 4.70 1.30 assign (resid 37 and name HA2 ) (resid 40 and name HD22 ) 6.20 4.40 1.24 assign (resid 39 and name HN ) (resid 41 and name HN ) 4.12 2.32 0.82 assign (resid 12 and name HN ) (resid 41 and name HN ) 5.09 3.29 1.02 assign (resid 11 and name HE* ) (resid 41 and name HN ) 5.54 3.74 1.11 assign (resid 11 and name HB2 ) (resid 41 and name HN ) 4.93 3.13 0.99 assign (resid 43 and name HN ) (resid 44 and name HB1 ) 5.02 3.22 1.00 assign (resid 9 and name HG1 ) (resid 43 and name HN ) 4.90 3.10 0.98 assign (resid 9 and name HB1 ) (resid 43 and name HN ) 5.75 3.95 1.15 assign (resid 42 and name HN ) (resid 46 and name HN ) 4.64 2.84 0.93 assign (resid 43 and name HN ) (resid 46 and name HN ) 4.93 3.13 0.99 assign (resid 11 and name HE* ) (resid 43 and name HN ) 5.38 3.58 1.08 assign (resid 44 and name HN ) (resid 45 and name HA ) 5.50 3.70 1.10 assign (resid 42 and name HB2 ) (resid 45 and name HN ) 4.45 2.65 0.89 assign (resid 42 and name HB1 ) (resid 45 and name HN ) 4.45 2.65 0.89 assign (resid 43 and name HB1 ) (resid 46 and name HN ) 6.17 4.37 1.23 assign (resid 46 and name HN ) (resid 54 and name HG2* ) 6.50 4.70 1.30 assign (resid 30 and name HD2* ) (resid 46 and name HN ) 6.00 4.20 1.20 assign (resid 41 and name HA ) (resid 45 and name HE22 ) 5.02 3.22 1.00 assign (resid 47 and name HN ) (resid 50 and name HN ) 5.21 3.41 1.04 assign (resid 47 and name HN ) (resid 48 and name HA ) 5.55 3.75 1.11 assign (resid 47 and name HN ) (resid 48 and name HB2 ) 4.85 3.05 0.97 assign (resid 46 and name HN ) (resid 47 and name HA ) 5.49 3.69 1.10 assign (resid 44 and name HB1 ) (resid 46 and name HN ) 5.30 3.50 1.06 assign (resid 48 and name HN ) (resid 52 and name HG ) 6.50 4.70 1.30 assign (resid 48 and name HN ) (resid 54 and name HG1* ) 5.26 3.46 1.05 assign (resid 44 and name HG2 ) (resid 48 and name HN ) 4.94 3.14 0.99 assign (resid 45 and name HG2 ) (resid 48 and name HN ) 6.32 4.52 1.26 assign (resid 48 and name HN ) (resid 53 and name HA ) 5.65 3.85 1.13 assign (resid 44 and name HB2 ) (resid 48 and name HD22 ) 4.94 3.14 0.99 assign (resid 48 and name HD22 ) (resid 54 and name HG1* ) 5.16 3.36 1.03 assign (resid 48 and name HD21 ) (resid 54 and name HG1* ) 5.15 3.35 1.03 assign (resid 48 and name HN ) (resid 51 and name HN ) 5.28 3.48 1.06 assign (resid 48 and name HB1 ) (resid 51 and name HN ) 5.45 3.65 1.09 assign (resid 47 and name HB* ) (resid 51 and name HN ) 5.15 3.35 1.03 assign (resid 53 and name HN ) (resid 56 and name HN ) 4.82 3.02 0.96 assign (resid 53 and name HD22 ) (resid 55 and name HG2 ) 4.67 2.87 0.93 assign (resid 53 and name HB1 ) (resid 55 and name HN ) 4.72 2.92 0.94 assign (resid 53 and name HB2 ) (resid 55 and name HN ) 4.69 2.89 0.94 assign (resid 28 and name HE* ) (resid 57 and name HN ) 4.51 2.71 0.90 assign (resid 59 and name HE ) (resid 60 and name HN ) 4.77 2.97 0.95 assign (resid 62 and name HA ) (resid 65 and name HN ) 4.25 2.45 0.85 assign (resid 64 and name HA ) (resid 67 and name HN ) 4.71 2.91 0.94 assign (resid 10 and name HG1 ) (resid 12 and name HN ) 6.50 4.70 1.30 assign (resid 23 and name HN ) (resid 25 and name HN ) 4.57 2.77 0.91 assign (resid 35 and name HN ) (resid 37 and name HN ) 6.37 4.57 1.27 assign (resid 35 and name HN ) (resid 36 and name HG2 ) 5.66 3.86 1.13 assign (resid 35 and name HN ) (resid 36 and name HG1 ) 5.37 3.57 1.07 assign (resid 36 and name HN ) (resid 38 and name HB* ) 5.73 3.93 1.15 assign (resid 6 and name HG2* ) (resid 9 and name HN ) 4.82 3.02 0.96 assign (resid 16 and name HA ) (resid 16 and name HE22 ) 5.24 3.44 1.05 assign (resid 16 and name HN ) (resid 16 and name HE22 ) 4.71 2.91 0.94 assign (resid 18 and name HB1 ) (resid 20 and name HN ) 6.50 4.70 1.30 assign (resid 38 and name HN ) (resid 39 and name HG2 ) 4.92 3.12 0.98 assign (resid 33 and name HD1* ) (resid 39 and name HE22 ) 6.32 4.52 1.26 assign (resid 33 and name HD1* ) (resid 35 and name HN ) 6.04 4.24 1.21 assign (resid 31 and name HA2 ) (resid 34 and name HN ) 4.32 2.52 0.86 assign (resid 32 and name HA ) (resid 34 and name HN ) 4.33 2.53 0.87 assign (resid 33 and name HA ) (resid 36 and name HN ) 3.94 2.14 0.79 assign (resid 10 and name HN ) (resid 13 and name HB2 ) 3.07 1.27 0.61 assign (resid 59 and name HA ) (resid 62 and name HD22 ) 5.30 3.50 1.06 assign (resid 62 and name HA ) (resid 62 and name HD22 ) 4.78 2.98 0.96 assign (resid 2 and name HA ) (resid 2 and name HG2* ) 3.38 1.58 0.68 assign (resid 3 and name HA ) (resid 3 and name HB1 ) 2.96 1.16 0.59 assign (resid 3 and name HA ) (resid 3 and name HG* ) 3.26 1.46 0.65 assign (resid 3 and name HB1 ) (resid 3 and name HE21 ) 4.92 3.12 0.98 assign (resid 3 and name HB2 ) (resid 3 and name HG* ) 2.88 1.08 0.58 assign (resid 4 and name HA ) (resid 4 and name HB1 ) 2.94 1.14 0.59 assign (resid 4 and name HA ) (resid 4 and name HG2 ) 3.78 1.98 0.76 assign (resid 4 and name HA ) (resid 4 and name HG1 ) 3.78 1.98 0.76 assign (resid 4 and name HA ) (resid 4 and name HE* ) 4.97 3.17 0.99 assign (resid 4 and name HB2 ) (resid 4 and name HD* ) 3.76 1.96 0.75 assign (resid 4 and name HG2 ) (resid 5 and name HN ) 5.25 3.45 1.05 assign (resid 4 and name HA ) (resid 4 and name HD* ) 4.16 2.36 0.83 assign (resid 4 and name HB1 ) (resid 4 and name HD* ) 3.33 1.53 0.67 assign (resid 4 and name HN ) (resid 4 and name HE* ) 5.93 4.13 1.19 assign (resid 4 and name HB2 ) (resid 4 and name HE* ) 3.98 2.18 0.80 assign (resid 4 and name HB1 ) (resid 4 and name HE* ) 2.99 1.19 0.60 assign (resid 4 and name HG2 ) (resid 4 and name HE* ) 3.72 1.92 0.74 assign (resid 4 and name HG1 ) (resid 4 and name HE* ) 3.72 1.92 0.74 assign (resid 4 and name HD* ) (resid 4 and name HE* ) 2.72 0.92 0.54 assign (resid 5 and name HA ) (resid 5 and name HD* ) 4.64 2.84 0.93 assign (resid 5 and name HB2 ) (resid 6 and name HN ) 4.55 2.75 0.91 assign (resid 6 and name HA ) (resid 6 and name HB ) 2.86 1.06 0.57 assign (resid 6 and name HA ) (resid 6 and name HG2* ) 3.29 1.49 0.66 assign (resid 6 and name HN ) (resid 6 and name HB ) 4.18 2.38 0.84 assign (resid 6 and name HB ) (resid 7 and name HN ) 3.84 2.04 0.77 assign (resid 6 and name HG2* ) (resid 7 and name HN ) 3.91 2.11 0.78 assign (resid 7 and name HA ) (resid 43 and name HB2 ) 3.31 1.51 0.66 assign (resid 7 and name HA ) (resid 7 and name HG1 ) 3.99 2.19 0.80 assign (resid 7 and name HA ) (resid 7 and name HG2 ) 3.89 2.09 0.78 assign (resid 7 and name HA ) (resid 58 and name HG ) 6.06 4.26 1.21 assign (resid 7 and name HB1 ) (resid 58 and name HG ) 4.57 2.77 0.91 assign (resid 7 and name HN ) (resid 7 and name HD2 ) 5.03 3.23 1.01 assign (resid 7 and name HA ) (resid 7 and name HD2 ) 5.73 3.93 1.15 assign (resid 7 and name HB1 ) (resid 7 and name HD2 ) 3.95 2.15 0.79 assign (resid 7 and name HA ) (resid 7 and name HD1 ) 4.90 3.10 0.98 assign (resid 7 and name HB2 ) (resid 7 and name HD1 ) 3.66 1.86 0.73 assign (resid 7 and name HB1 ) (resid 7 and name HD1 ) 3.48 1.68 0.70 assign (resid 7 and name HB1 ) (resid 7 and name HE2 ) 4.51 2.71 0.90 assign (resid 7 and name HG2 ) (resid 7 and name HE2 ) 3.50 1.70 0.70 assign (resid 9 and name HA ) (resid 9 and name HG2 ) 3.83 2.03 0.77 assign (resid 8 and name HB1 ) (resid 9 and name HA ) 4.32 2.52 0.86 assign (resid 9 and name HA ) (resid 9 and name HE* ) 4.16 2.36 0.83 assign (resid 9 and name HB1 ) (resid 10 and name HN ) 4.09 2.29 0.82 assign (resid 9 and name HG2 ) (resid 43 and name HN ) 5.21 3.41 1.04 assign (resid 9 and name HN ) (resid 9 and name HG1 ) 4.10 2.30 0.82 assign (resid 9 and name HA ) (resid 9 and name HG1 ) 4.18 2.38 0.84 assign (resid 9 and name HG1 ) (resid 13 and name HB2 ) 4.13 2.33 0.83 assign (resid 9 and name HB2 ) (resid 9 and name HE* ) 3.04 1.24 0.61 assign (resid 9 and name HB1 ) (resid 9 and name HE* ) 2.85 1.05 0.57 assign (resid 9 and name HG2 ) (resid 9 and name HE* ) 3.40 1.60 0.68 assign (resid 9 and name HG1 ) (resid 9 and name HE* ) 3.06 1.26 0.61 assign (resid 9 and name HE* ) (resid 10 and name HN ) 4.20 2.40 0.84 assign (resid 10 and name HA ) (resid 10 and name HB ) 2.96 1.16 0.59 assign (resid 10 and name HN ) (resid 10 and name HB ) 3.93 2.13 0.79 assign (resid 10 and name HA ) (resid 10 and name HG2* ) 2.78 0.98 0.56 assign (resid 10 and name HG2* ) (resid 11 and name HN ) 3.94 2.14 0.79 assign (resid 11 and name HA ) (resid 11 and name HD* ) 3.61 1.81 0.72 assign (resid 11 and name HA ) (resid 11 and name HE* ) 4.75 2.95 0.95 assign (resid 11 and name HA ) (resid 14 and name HN ) 3.99 2.19 0.80 assign (resid 11 and name HA ) (resid 14 and name HB* ) 3.21 1.41 0.64 assign (resid 12 and name HA ) (resid 15 and name HN ) 3.81 2.01 0.76 assign (resid 12 and name HA ) (resid 15 and name HB2 ) 3.30 1.50 0.66 assign (resid 13 and name HA ) (resid 13 and name HB1 ) 3.01 1.21 0.60 assign (resid 13 and name HA ) (resid 13 and name HG2 ) 3.06 1.26 0.61 assign (resid 15 and name HA ) (resid 16 and name HN ) 3.57 1.77 0.71 assign (resid 13 and name HA ) (resid 16 and name HB2 ) 3.73 1.93 0.75 assign (resid 13 and name HA ) (resid 16 and name HB1 ) 4.83 3.03 0.97 assign (resid 13 and name HN ) (resid 13 and name HB1 ) 3.60 1.80 0.72 assign (resid 13 and name HB1 ) (resid 13 and name HG2 ) 2.93 1.13 0.59 assign (resid 13 and name HN ) (resid 13 and name HG2 ) 3.64 1.84 0.73 assign (resid 13 and name HA ) (resid 13 and name HG1 ) 3.50 1.70 0.70 assign (resid 13 and name HB2 ) (resid 13 and name HG1 ) 2.82 1.02 0.56 assign (resid 13 and name HG1 ) (resid 14 and name HN ) 4.78 2.98 0.96 assign (resid 15 and name HA ) (resid 15 and name HG ) 3.24 1.44 0.65 assign (resid 15 and name HA ) (resid 15 and name HD1* ) 3.95 2.15 0.79 assign (resid 13 and name HA ) (resid 16 and name HN ) 4.00 2.20 0.80 assign (resid 12 and name HA ) (resid 15 and name HB1 ) 4.06 2.26 0.81 assign (resid 15 and name HN ) (resid 15 and name HB1 ) 3.54 1.74 0.71 assign (resid 11 and name HD* ) (resid 15 and name HG ) 4.65 2.85 0.93 assign (resid 15 and name HB1 ) (resid 15 and name HD1* ) 2.95 1.15 0.59 assign (resid 15 and name HB2 ) (resid 15 and name HD1* ) 2.93 1.13 0.59 assign (resid 15 and name HA ) (resid 15 and name HD2* ) 2.76 0.96 0.55 assign (resid 15 and name HB1 ) (resid 15 and name HD2* ) 2.91 1.11 0.58 assign (resid 15 and name HB2 ) (resid 15 and name HD2* ) 3.30 1.50 0.66 assign (resid 16 and name HA ) (resid 16 and name HB1 ) 2.94 1.14 0.59 assign (resid 16 and name HA ) (resid 16 and name HG* ) 3.05 1.25 0.61 assign (resid 16 and name HA ) (resid 16 and name HE21 ) 6.50 4.70 1.30 assign (resid 16 and name HN ) (resid 16 and name HB1 ) 3.73 1.93 0.75 assign (resid 16 and name HB2 ) (resid 16 and name HG* ) 2.96 1.16 0.59 assign (resid 16 and name HB1 ) (resid 16 and name HG* ) 2.99 1.19 0.60 assign (resid 17 and name HA ) (resid 17 and name HG2* ) 2.77 0.97 0.55 assign (resid 18 and name HA ) (resid 21 and name HN ) 5.38 3.58 1.08 assign (resid 18 and name HB2 ) (resid 18 and name HD2 ) 3.78 1.98 0.76 assign (resid 18 and name HB2 ) (resid 21 and name HN ) 4.91 3.11 0.98 assign (resid 18 and name HA ) (resid 19 and name HD2 ) 2.85 1.05 0.57 assign (resid 18 and name HA ) (resid 19 and name HD1 ) 2.85 1.05 0.57 assign (resid 21 and name HA ) (resid 21 and name HG1* ) 3.06 1.26 0.61 assign (resid 21 and name HA ) (resid 24 and name HB ) 3.44 1.64 0.69 assign (resid 21 and name HN ) (resid 21 and name HG1* ) 3.80 2.00 0.76 assign (resid 21 and name HA ) (resid 21 and name HG2* ) 3.01 1.21 0.60 assign (resid 21 and name HG2* ) (resid 22 and name HN ) 3.95 2.15 0.79 assign (resid 22 and name HA ) (resid 25 and name HB2 ) 3.98 2.18 0.80 assign (resid 22 and name HB* ) (resid 23 and name HN ) 2.65 0.85 0.53 assign (resid 23 and name HA2 ) (resid 26 and name HB1 ) 4.05 2.25 0.81 assign (resid 23 and name HA1 ) (resid 26 and name HB1 ) 5.67 3.87 1.13 assign (resid 24 and name HA ) (resid 24 and name HG2* ) 2.61 0.81 0.52 assign (resid 24 and name HA ) (resid 24 and name HG1* ) 2.97 1.17 0.59 assign (resid 24 and name HA ) (resid 27 and name HN ) 4.00 2.20 0.80 assign (resid 25 and name HA ) (resid 25 and name HG ) 3.79 1.99 0.76 assign (resid 25 and name HA ) (resid 25 and name HD2* ) 2.75 0.95 0.55 assign (resid 25 and name HA ) (resid 28 and name HB2 ) 3.93 2.13 0.79 assign (resid 22 and name HA ) (resid 25 and name HB1 ) 5.49 3.69 1.10 assign (resid 25 and name HB2 ) (resid 25 and name HG ) 2.92 1.12 0.58 assign (resid 25 and name HB1 ) (resid 25 and name HD2* ) 3.26 1.46 0.65 assign (resid 25 and name HB2 ) (resid 25 and name HD2* ) 3.34 1.54 0.67 assign (resid 25 and name HN ) (resid 25 and name HD1* ) 3.56 1.76 0.71 assign (resid 25 and name HA ) (resid 25 and name HD1* ) 3.99 2.19 0.80 assign (resid 25 and name HB1 ) (resid 25 and name HD1* ) 3.14 1.34 0.63 assign (resid 25 and name HB2 ) (resid 25 and name HD1* ) 2.71 0.91 0.54 assign (resid 26 and name HA ) (resid 26 and name HB1 ) 2.98 1.18 0.60 assign (resid 26 and name HA ) (resid 26 and name HG1 ) 3.47 1.67 0.69 assign (resid 26 and name HA ) (resid 26 and name HG2 ) 3.40 1.60 0.68 assign (resid 26 and name HA ) (resid 26 and name HD1 ) 4.68 2.88 0.94 assign (resid 26 and name HA ) (resid 26 and name HD2 ) 4.94 3.14 0.99 assign (resid 23 and name HA2 ) (resid 26 and name HB2 ) 3.74 1.94 0.75 assign (resid 23 and name HA1 ) (resid 26 and name HB2 ) 4.36 2.56 0.87 assign (resid 26 and name HB2 ) (resid 26 and name HD2 ) 3.76 1.96 0.75 assign (resid 42 and name HB2 ) (resid 44 and name HB1 ) 5.44 3.64 1.09 assign (resid 26 and name HN ) (resid 26 and name HB1 ) 3.67 1.87 0.73 assign (resid 26 and name HB2 ) (resid 26 and name HG1 ) 2.85 1.05 0.57 assign (resid 26 and name HB2 ) (resid 26 and name HD1 ) 3.57 1.77 0.71 assign (resid 26 and name HB1 ) (resid 26 and name HD1 ) 3.57 1.77 0.71 assign (resid 26 and name HG1 ) (resid 26 and name HD2 ) 2.99 1.19 0.60 assign (resid 24 and name HA ) (resid 27 and name HB1 ) 4.11 2.31 0.82 assign (resid 24 and name HA ) (resid 27 and name HB2 ) 3.99 2.19 0.80 assign (resid 27 and name HB2 ) (resid 28 and name HN ) 4.14 2.34 0.83 assign (resid 28 and name HA ) (resid 28 and name HD* ) 3.25 1.45 0.65 assign (resid 25 and name HA ) (resid 28 and name HB1 ) 4.75 2.95 0.95 assign (resid 28 and name HN ) (resid 28 and name HB1 ) 3.72 1.92 0.74 assign (resid 29 and name HB1 ) (resid 30 and name HN ) 4.74 2.94 0.95 assign (resid 30 and name HA ) (resid 30 and name HB1 ) 3.01 1.21 0.60 assign (resid 30 and name HN ) (resid 30 and name HB1 ) 3.74 1.94 0.75 assign (resid 30 and name HB1 ) (resid 31 and name HN ) 4.51 2.71 0.90 assign (resid 30 and name HA ) (resid 30 and name HG ) 4.15 2.35 0.83 assign (resid 30 and name HA ) (resid 30 and name HD2* ) 2.96 1.16 0.59 assign (resid 30 and name HB2 ) (resid 30 and name HD2* ) 3.33 1.53 0.67 assign (resid 30 and name HB1 ) (resid 30 and name HD2* ) 3.16 1.36 0.63 assign (resid 30 and name HA ) (resid 30 and name HD1* ) 3.95 2.15 0.79 assign (resid 30 and name HB2 ) (resid 30 and name HD1* ) 2.64 0.84 0.53 assign (resid 30 and name HB1 ) (resid 30 and name HD1* ) 2.75 0.95 0.55 assign (resid 29 and name HN ) (resid 30 and name HD1* ) 5.95 4.15 1.19 assign (resid 32 and name HA ) (resid 32 and name HB* ) 2.82 1.02 0.56 assign (resid 33 and name HA ) (resid 33 and name HG2* ) 2.99 1.19 0.60 assign (resid 33 and name HA ) (resid 33 and name HG12 ) 3.91 2.11 0.78 assign (resid 33 and name HA ) (resid 33 and name HD1* ) 4.36 2.56 0.87 assign (resid 33 and name HB ) (resid 33 and name HD1* ) 3.35 1.55 0.67 assign (resid 33 and name HG2* ) (resid 33 and name HD1* ) 2.81 1.01 0.56 assign (resid 33 and name HG11 ) (resid 34 and name HA1 ) 4.82 3.02 0.96 assign (resid 33 and name HG2* ) (resid 33 and name HG11 ) 3.24 1.44 0.65 assign (resid 33 and name HG2* ) (resid 33 and name HG12 ) 3.21 1.41 0.64 assign (resid 11 and name HA ) (resid 33 and name HD1* ) 4.45 2.65 0.89 assign (resid 35 and name HA ) (resid 35 and name HB* ) 2.76 0.96 0.55 assign (resid 36 and name HA ) (resid 36 and name HG2 ) 4.13 2.33 0.83 assign (resid 36 and name HB2 ) (resid 37 and name HN ) 4.70 2.90 0.94 assign (resid 36 and name HA ) (resid 36 and name HG1 ) 3.64 1.84 0.73 assign (resid 36 and name HG1 ) (resid 36 and name HE* ) 2.40 0.60 0.48 assign (resid 36 and name HB1 ) (resid 36 and name HG2 ) 2.40 0.60 0.48 assign (resid 36 and name HG2 ) (resid 37 and name HN ) 4.83 3.03 0.97 assign (resid 36 and name HN ) (resid 36 and name HE* ) 4.87 3.07 0.97 assign (resid 36 and name HA ) (resid 36 and name HE* ) 4.39 2.59 0.88 assign (resid 36 and name HB1 ) (resid 36 and name HE* ) 5.12 3.32 1.02 assign (resid 36 and name HG2 ) (resid 36 and name HE* ) 3.70 1.90 0.74 assign (resid 36 and name HE* ) (resid 39 and name HN ) 6.50 4.70 1.30 assign (resid 39 and name HA ) (resid 39 and name HG2 ) 3.71 1.91 0.74 assign (resid 39 and name HA ) (resid 39 and name HG1 ) 3.94 2.14 0.79 assign (resid 39 and name HA ) (resid 39 and name HE21 ) 5.13 3.33 1.03 assign (resid 39 and name HN ) (resid 39 and name HB1 ) 3.65 1.85 0.73 assign (resid 40 and name HB2 ) (resid 41 and name HN ) 4.16 2.36 0.83 assign (resid 40 and name HB1 ) (resid 41 and name HN ) 4.38 2.58 0.88 assign (resid 41 and name HA ) (resid 41 and name HG2 ) 3.82 2.02 0.76 assign (resid 41 and name HA ) (resid 41 and name HG1 ) 3.82 2.02 0.76 assign (resid 41 and name HN ) (resid 41 and name HG2 ) 4.50 2.70 0.90 assign (resid 41 and name HN ) (resid 41 and name HG1 ) 4.50 2.70 0.90 assign (resid 43 and name HA ) (resid 43 and name HG ) 3.75 1.95 0.75 assign (resid 43 and name HA ) (resid 43 and name HD2* ) 2.88 1.08 0.58 assign (resid 43 and name HA ) (resid 43 and name HD1* ) 4.21 2.41 0.84 assign (resid 43 and name HD1* ) (resid 58 and name HA ) 4.52 2.72 0.90 assign (resid 43 and name HB2 ) (resid 43 and name HD1* ) 3.21 1.41 0.64 assign (resid 43 and name HB1 ) (resid 43 and name HD1* ) 3.26 1.46 0.65 assign (resid 43 and name HB1 ) (resid 44 and name HN ) 3.97 2.17 0.79 assign (resid 11 and name HN ) (resid 43 and name HG ) 5.75 3.95 1.15 assign (resid 43 and name HB2 ) (resid 43 and name HD2* ) 3.66 1.86 0.73 assign (resid 43 and name HB1 ) (resid 43 and name HD2* ) 3.16 1.36 0.63 assign (resid 44 and name HA ) (resid 54 and name HB ) 3.08 1.28 0.62 assign (resid 44 and name HA ) (resid 44 and name HG2 ) 3.56 1.76 0.71 assign (resid 44 and name HB1 ) (resid 44 and name HG2 ) 2.99 1.19 0.60 assign (resid 44 and name HN ) (resid 44 and name HG1 ) 4.77 2.97 0.95 assign (resid 44 and name HA ) (resid 44 and name HG1 ) 3.56 1.76 0.71 assign (resid 45 and name HA ) (resid 45 and name HG2 ) 3.07 1.27 0.61 assign (resid 45 and name HA ) (resid 45 and name HG1 ) 3.49 1.69 0.70 assign (resid 45 and name HA ) (resid 48 and name HB1 ) 4.48 2.68 0.90 assign (resid 45 and name HA ) (resid 48 and name HB2 ) 3.54 1.74 0.71 assign (resid 45 and name HB1 ) (resid 45 and name HG2 ) 2.78 0.98 0.56 assign (resid 45 and name HB2 ) (resid 45 and name HG2 ) 2.97 1.17 0.59 assign (resid 45 and name HG2 ) (resid 46 and name HN ) 4.97 3.17 0.99 assign (resid 45 and name HB2 ) (resid 45 and name HG1 ) 2.52 0.72 0.50 assign (resid 46 and name HA1 ) (resid 49 and name HN ) 4.80 3.00 0.96 assign (resid 46 and name HA1 ) (resid 49 and name HB* ) 4.09 2.29 0.82 assign (resid 47 and name HA ) (resid 50 and name HB2 ) 4.24 2.44 0.85 assign (resid 44 and name HA ) (resid 47 and name HB* ) 3.21 1.41 0.64 assign (resid 48 and name HA ) (resid 48 and name HB1 ) 2.83 1.03 0.57 assign (resid 48 and name HA ) (resid 48 and name HD22 ) 4.51 2.71 0.90 assign (resid 48 and name HN ) (resid 48 and name HB1 ) 3.65 1.85 0.73 assign (resid 48 and name HB1 ) (resid 49 and name HN ) 3.64 1.84 0.73 assign (resid 46 and name HA2 ) (resid 49 and name HB* ) 3.08 1.28 0.62 assign (resid 50 and name HA ) (resid 52 and name HN ) 4.82 3.02 0.96 assign (resid 47 and name HA ) (resid 50 and name HB1 ) 4.45 2.65 0.89 assign (resid 52 and name HN ) (resid 52 and name HB1 ) 3.83 2.03 0.77 assign (resid 52 and name HB2 ) (resid 52 and name HD1* ) 3.16 1.36 0.63 assign (resid 52 and name HN ) (resid 52 and name HD2* ) 3.79 1.99 0.76 assign (resid 52 and name HA ) (resid 52 and name HD2* ) 2.80 1.00 0.56 assign (resid 52 and name HB1 ) (resid 52 and name HD2* ) 2.99 1.19 0.60 assign (resid 52 and name HB2 ) (resid 52 and name HD2* ) 3.25 1.45 0.65 assign (resid 52 and name HA ) (resid 52 and name HD1* ) 4.53 2.73 0.91 assign (resid 52 and name HB1 ) (resid 52 and name HD1* ) 3.32 1.52 0.66 assign (resid 52 and name HD1* ) (resid 53 and name HN ) 4.74 2.94 0.95 assign (resid 53 and name HA ) (resid 54 and name HN ) 2.54 0.74 0.51 assign (resid 53 and name HB2 ) (resid 54 and name HN ) 4.52 2.72 0.90 assign (resid 54 and name HA ) (resid 54 and name HB ) 2.84 1.04 0.57 assign (resid 54 and name HA ) (resid 54 and name HG1* ) 3.34 1.54 0.67 assign (resid 54 and name HA ) (resid 54 and name HG2* ) 2.69 0.89 0.54 assign (resid 54 and name HA ) (resid 57 and name HB ) 3.17 1.37 0.63 assign (resid 44 and name HN ) (resid 54 and name HB ) 4.88 3.08 0.98 assign (resid 55 and name HA ) (resid 55 and name HB1 ) 2.99 1.19 0.60 assign (resid 55 and name HA ) (resid 55 and name HG2 ) 3.69 1.89 0.74 assign (resid 55 and name HA ) (resid 55 and name HG1 ) 3.69 1.89 0.74 assign (resid 55 and name HA ) (resid 58 and name HB2 ) 3.14 1.34 0.63 assign (resid 55 and name HN ) (resid 55 and name HB1 ) 3.59 1.79 0.72 assign (resid 55 and name HN ) (resid 55 and name HG1 ) 3.53 1.73 0.71 assign (resid 56 and name HA ) (resid 59 and name HB2 ) 3.94 2.14 0.79 assign (resid 56 and name HA ) (resid 59 and name HB1 ) 3.40 1.60 0.68 assign (resid 57 and name HA ) (resid 57 and name HG2* ) 3.03 1.23 0.61 assign (resid 57 and name HA ) (resid 57 and name HG12 ) 3.38 1.58 0.68 assign (resid 57 and name HA ) (resid 57 and name HG11 ) 3.55 1.75 0.71 assign (resid 57 and name HA ) (resid 60 and name HB2 ) 3.77 1.97 0.75 assign (resid 57 and name HA ) (resid 60 and name HB1 ) 4.50 2.70 0.90 assign (resid 57 and name HN ) (resid 57 and name HG2* ) 4.10 2.30 0.82 assign (resid 57 and name HG2* ) (resid 57 and name HG12 ) 3.24 1.44 0.65 assign (resid 57 and name HG2* ) (resid 57 and name HG11 ) 3.74 1.94 0.75 assign (resid 57 and name HA ) (resid 57 and name HD1* ) 4.33 2.53 0.87 assign (resid 57 and name HB ) (resid 57 and name HD1* ) 3.10 1.30 0.62 assign (resid 57 and name HD1* ) (resid 58 and name HN ) 4.86 3.06 0.97 assign (resid 58 and name HA ) (resid 58 and name HG ) 3.56 1.76 0.71 assign (resid 58 and name HA ) (resid 61 and name HB1 ) 4.02 2.22 0.80 assign (resid 58 and name HA ) (resid 61 and name HB2 ) 3.37 1.57 0.67 assign (resid 55 and name HA ) (resid 58 and name HB1 ) 4.34 2.54 0.87 assign (resid 54 and name HG2* ) (resid 58 and name HG ) 2.87 1.07 0.57 assign (resid 58 and name HA ) (resid 58 and name HD2* ) 2.82 1.02 0.56 assign (resid 58 and name HB2 ) (resid 58 and name HD2* ) 3.46 1.66 0.69 assign (resid 58 and name HB1 ) (resid 58 and name HD2* ) 3.21 1.41 0.64 assign (resid 58 and name HN ) (resid 58 and name HD1* ) 3.81 2.01 0.76 assign (resid 58 and name HA ) (resid 58 and name HD1* ) 4.12 2.32 0.82 assign (resid 58 and name HB2 ) (resid 58 and name HD1* ) 2.84 1.04 0.57 assign (resid 58 and name HB1 ) (resid 58 and name HD1* ) 3.00 1.20 0.60 assign (resid 59 and name HA ) (resid 59 and name HB2 ) 2.94 1.14 0.59 assign (resid 59 and name HA ) (resid 59 and name HG2 ) 3.40 1.60 0.68 assign (resid 59 and name HA ) (resid 59 and name HG1 ) 3.11 1.31 0.62 assign (resid 59 and name HA ) (resid 59 and name HD* ) 4.35 2.55 0.87 assign (resid 59 and name HA ) (resid 62 and name HN ) 4.05 2.25 0.81 assign (resid 59 and name HA ) (resid 62 and name HB1 ) 4.64 2.84 0.93 assign (resid 59 and name HA ) (resid 62 and name HB2 ) 3.59 1.79 0.72 assign (resid 26 and name HB1 ) (resid 26 and name HE ) 3.66 1.86 0.73 assign (resid 59 and name HB1 ) (resid 59 and name HD* ) 3.51 1.71 0.70 assign (resid 59 and name HN ) (resid 59 and name HG2 ) 4.56 2.76 0.91 assign (resid 59 and name HN ) (resid 59 and name HG1 ) 4.68 2.88 0.94 assign (resid 59 and name HB2 ) (resid 59 and name HG1 ) 2.83 1.03 0.57 assign (resid 59 and name HG1 ) (resid 60 and name HN ) 4.67 2.87 0.93 assign (resid 59 and name HB2 ) (resid 59 and name HD* ) 3.26 1.46 0.65 assign (resid 60 and name HA ) (resid 63 and name HB* ) 2.93 1.13 0.59 assign (resid 61 and name HA ) (resid 61 and name HG ) 3.50 1.70 0.70 assign (resid 61 and name HA ) (resid 61 and name HD2* ) 2.76 0.96 0.55 assign (resid 61 and name HB1 ) (resid 61 and name HD2* ) 3.46 1.66 0.69 assign (resid 61 and name HB1 ) (resid 61 and name HD1* ) 3.26 1.46 0.65 assign (resid 61 and name HB2 ) (resid 61 and name HD2* ) 3.65 1.85 0.73 assign (resid 61 and name HB2 ) (resid 61 and name HD1* ) 3.18 1.38 0.64 assign (resid 61 and name HN ) (resid 61 and name HD2* ) 4.23 2.43 0.85 assign (resid 61 and name HA ) (resid 61 and name HD1* ) 3.97 2.17 0.79 assign (resid 57 and name HG2* ) (resid 61 and name HD1* ) 2.71 0.91 0.54 assign (resid 62 and name HA ) (resid 62 and name HB1 ) 2.95 1.15 0.59 assign (resid 62 and name HB1 ) (resid 62 and name HD22 ) 4.09 2.29 0.82 assign (resid 62 and name HB1 ) (resid 62 and name HD21 ) 3.44 1.64 0.69 assign (resid 62 and name HB1 ) (resid 63 and name HN ) 4.37 2.57 0.87 assign (resid 64 and name HA ) (resid 64 and name HG ) 3.46 1.66 0.69 assign (resid 61 and name HA ) (resid 64 and name HB2 ) 4.95 3.15 0.99 assign (resid 64 and name HA ) (resid 64 and name HD2* ) 2.62 0.82 0.52 assign (resid 64 and name HB1 ) (resid 64 and name HD2* ) 2.96 1.16 0.59 assign (resid 64 and name HB2 ) (resid 64 and name HD2* ) 3.33 1.53 0.67 assign (resid 64 and name HD2* ) (resid 65 and name HN ) 4.73 2.93 0.95 assign (resid 64 and name HA ) (resid 64 and name HD1* ) 4.06 2.26 0.81 assign (resid 61 and name HD2* ) (resid 64 and name HD1* ) 3.10 1.30 0.62 assign (resid 64 and name HB1 ) (resid 64 and name HD1* ) 3.42 1.62 0.68 assign (resid 64 and name HB2 ) (resid 64 and name HD1* ) 3.15 1.35 0.63 assign (resid 38 and name HA ) (resid 41 and name HN ) 3.34 1.54 0.67 assign (resid 65 and name HA ) (resid 66 and name HN ) 3.47 1.67 0.69 assign (resid 66 and name HA ) (resid 66 and name HG ) 3.55 1.75 0.71 assign (resid 66 and name HB2 ) (resid 66 and name HD2* ) 3.67 1.87 0.73 assign (resid 66 and name HN ) (resid 66 and name HG ) 3.53 1.73 0.71 assign (resid 66 and name HG ) (resid 67 and name HN ) 4.76 2.96 0.95 assign (resid 66 and name HN ) (resid 66 and name HD2* ) 3.94 2.14 0.79 assign (resid 66 and name HA ) (resid 66 and name HD2* ) 2.78 0.98 0.56 assign (resid 66 and name HB1 ) (resid 66 and name HD2* ) 3.11 1.31 0.62 assign (resid 66 and name HA ) (resid 66 and name HD1* ) 3.86 2.06 0.77 assign (resid 66 and name HB1 ) (resid 66 and name HD1* ) 2.74 0.94 0.55 assign (resid 66 and name HB2 ) (resid 66 and name HD1* ) 2.94 1.14 0.59 assign (resid 67 and name HA ) (resid 67 and name HB* ) 2.65 0.85 0.53 assign (resid 67 and name HA ) (resid 67 and name HG2 ) 3.82 2.02 0.76 assign (resid 67 and name HA ) (resid 67 and name HG1 ) 3.82 2.02 0.76 assign (resid 67 and name HA ) (resid 68 and name HN ) 3.18 1.38 0.64 assign (resid 68 and name HN ) (resid 68 and name HB2 ) 3.91 2.11 0.78 assign (resid 50 and name HA ) (resid 50 and name HD2 ) 4.36 2.56 0.87 assign (resid 3 and name HA ) (resid 5 and name HN ) 4.39 2.59 0.88 assign (resid 2 and name HA ) (resid 3 and name HA ) 6.50 4.70 1.30 assign (resid 2 and name HB ) (resid 3 and name HA ) 6.50 4.70 1.30 assign (resid 3 and name HA ) (resid 4 and name HA ) 6.50 4.70 1.30 assign (resid 3 and name HA ) (resid 4 and name HB2 ) 4.68 2.88 0.94 assign (resid 3 and name HB2 ) (resid 6 and name HG2* ) 5.41 3.61 1.08 assign (resid 4 and name HA ) (resid 6 and name HG2* ) 6.19 4.39 1.24 assign (resid 3 and name HA ) (resid 4 and name HB1 ) 5.97 4.17 1.19 assign (resid 3 and name HA ) (resid 4 and name HD* ) 6.46 4.66 1.29 assign (resid 4 and name HA ) (resid 5 and name HD* ) 4.88 3.08 0.98 assign (resid 4 and name HB1 ) (resid 5 and name HD* ) 4.19 2.39 0.84 assign (resid 4 and name HB2 ) (resid 5 and name HE* ) 4.84 3.04 0.97 assign (resid 4 and name HB1 ) (resid 5 and name HE* ) 4.87 3.07 0.97 assign (resid 4 and name HD* ) (resid 5 and name HD* ) 5.35 3.55 1.07 assign (resid 5 and name HB1 ) (resid 58 and name HA ) 5.23 3.43 1.05 assign (resid 5 and name HB2 ) (resid 14 and name HB* ) 6.07 4.27 1.21 assign (resid 5 and name HB2 ) (resid 58 and name HG ) 6.50 4.70 1.30 assign (resid 5 and name HB2 ) (resid 61 and name HG ) 6.50 4.70 1.30 assign (resid 5 and name HB2 ) (resid 61 and name HB2 ) 4.49 2.69 0.90 assign (resid 5 and name HB1 ) (resid 61 and name HB2 ) 4.37 2.57 0.87 assign (resid 5 and name HD* ) (resid 61 and name HB2 ) 4.41 2.61 0.88 assign (resid 5 and name HD* ) (resid 24 and name HG1* ) 6.15 4.35 1.23 assign (resid 5 and name HZ ) (resid 14 and name HB* ) 6.49 4.69 1.30 assign (resid 5 and name HB2 ) (resid 43 and name HD1* ) 4.94 3.14 0.99 assign (resid 5 and name HB2 ) (resid 61 and name HD1* ) 4.07 2.27 0.81 assign (resid 5 and name HB2 ) (resid 61 and name HB1 ) 4.45 2.65 0.89 assign (resid 5 and name HB1 ) (resid 58 and name HD1* ) 5.29 3.49 1.06 assign (resid 5 and name HB1 ) (resid 43 and name HD1* ) 4.45 2.65 0.89 assign (resid 5 and name HB1 ) (resid 61 and name HD1* ) 3.99 2.19 0.80 assign (resid 5 and name HB1 ) (resid 61 and name HB1 ) 4.92 3.12 0.98 assign (resid 5 and name HD* ) (resid 58 and name HD2* ) 4.89 3.09 0.98 assign (resid 5 and name HE* ) (resid 25 and name HD1* ) 6.06 4.26 1.21 assign (resid 6 and name HA ) (resid 58 and name HD1* ) 3.43 1.63 0.69 assign (resid 6 and name HA ) (resid 43 and name HD1* ) 4.53 2.73 0.91 assign (resid 6 and name HA ) (resid 58 and name HD2* ) 3.30 1.50 0.66 assign (resid 6 and name HB ) (resid 43 and name HD1* ) 6.08 4.28 1.22 assign (resid 6 and name HB ) (resid 58 and name HD2* ) 6.50 4.70 1.30 assign (resid 6 and name HG2* ) (resid 58 and name HD2* ) 4.90 3.10 0.98 assign (resid 6 and name HB ) (resid 7 and name HG2 ) 5.35 3.55 1.07 assign (resid 6 and name HG2* ) (resid 9 and name HB2 ) 4.09 2.29 0.82 assign (resid 5 and name HA ) (resid 6 and name HG2* ) 3.73 1.93 0.75 assign (resid 6 and name HB ) (resid 8 and name HN ) 4.23 2.43 0.85 assign (resid 7 and name HB2 ) (resid 44 and name HN ) 4.85 3.05 0.97 assign (resid 7 and name HB1 ) (resid 44 and name HN ) 4.91 3.11 0.98 assign (resid 6 and name HA ) (resid 7 and name HA ) 4.40 2.60 0.88 assign (resid 6 and name HA ) (resid 7 and name HB1 ) 5.02 3.22 1.00 assign (resid 7 and name HA ) (resid 54 and name HG1* ) 4.40 2.60 0.88 assign (resid 7 and name HD2 ) (resid 54 and name HG1* ) 4.26 2.46 0.85 assign (resid 7 and name HA ) (resid 54 and name HG2* ) 2.91 1.11 0.58 assign (resid 7 and name HA ) (resid 43 and name HD1* ) 3.65 1.85 0.73 assign (resid 7 and name HA ) (resid 58 and name HD2* ) 3.26 1.46 0.65 assign (resid 7 and name HB2 ) (resid 54 and name HG2* ) 3.40 1.60 0.68 assign (resid 7 and name HB2 ) (resid 58 and name HD2* ) 5.05 3.25 1.01 assign (resid 7 and name HG2 ) (resid 58 and name HD1* ) 4.62 2.82 0.92 assign (resid 7 and name HD2 ) (resid 54 and name HG2* ) 5.57 3.77 1.11 assign (resid 7 and name HD2 ) (resid 58 and name HD1* ) 6.01 4.21 1.20 assign (resid 4 and name HE* ) (resid 17 and name HG2* ) 3.95 2.15 0.79 assign (resid 60 and name HB2 ) (resid 63 and name HB* ) 5.72 3.92 1.14 assign (resid 7 and name HG2 ) (resid 8 and name HB2 ) 5.43 3.63 1.09 assign (resid 6 and name HG2* ) (resid 8 and name HA ) 5.33 3.53 1.07 assign (resid 8 and name HA ) (resid 44 and name HB1 ) 4.65 2.85 0.93 assign (resid 8 and name HB2 ) (resid 9 and name HA ) 5.44 3.64 1.09 assign (resid 6 and name HN ) (resid 9 and name HB2 ) 4.61 2.81 0.92 assign (resid 6 and name HN ) (resid 9 and name HG2 ) 4.69 2.89 0.94 assign (resid 6 and name HN ) (resid 9 and name HG1 ) 4.76 2.96 0.95 assign (resid 6 and name HN ) (resid 9 and name HA ) 6.00 4.20 1.20 assign (resid 8 and name HN ) (resid 9 and name HA ) 5.17 3.37 1.03 assign (resid 9 and name HG2 ) (resid 14 and name HB* ) 4.51 2.71 0.90 assign (resid 9 and name HG2 ) (resid 43 and name HG ) 4.68 2.88 0.94 assign (resid 9 and name HG1 ) (resid 43 and name HG ) 4.70 2.90 0.94 assign (resid 9 and name HB2 ) (resid 14 and name HB* ) 4.42 2.62 0.88 assign (resid 9 and name HB2 ) (resid 43 and name HD1* ) 4.59 2.79 0.92 assign (resid 9 and name HG2 ) (resid 43 and name HD1* ) 4.23 2.43 0.85 assign (resid 9 and name HG1 ) (resid 43 and name HD1* ) 4.18 2.38 0.84 assign (resid 9 and name HE* ) (resid 14 and name HB* ) 3.30 1.50 0.66 assign (resid 9 and name HE* ) (resid 14 and name HA ) 2.93 1.13 0.59 assign (resid 5 and name HD* ) (resid 9 and name HE* ) 3.35 1.55 0.67 assign (resid 10 and name HG2* ) (resid 42 and name HN ) 4.58 2.78 0.92 assign (resid 10 and name HA ) (resid 13 and name HN ) 4.80 3.00 0.96 assign (resid 9 and name HA ) (resid 10 and name HG2* ) 3.58 1.78 0.72 assign (resid 10 and name HG2* ) (resid 13 and name HB1 ) 5.14 3.34 1.03 assign (resid 10 and name HG2* ) (resid 13 and name HB2 ) 4.26 2.46 0.85 assign (resid 10 and name HG2* ) (resid 13 and name HG1 ) 4.58 2.78 0.92 assign (resid 9 and name HG1 ) (resid 10 and name HG2* ) 6.50 4.70 1.30 assign (resid 11 and name HA ) (resid 15 and name HD1* ) 4.34 2.54 0.87 assign (resid 11 and name HA ) (resid 43 and name HD1* ) 4.64 2.84 0.93 assign (resid 11 and name HB1 ) (resid 38 and name HB* ) 4.85 3.05 0.97 assign (resid 11 and name HB2 ) (resid 15 and name HD1* ) 4.38 2.58 0.88 assign (resid 11 and name HB2 ) (resid 33 and name HG2* ) 4.81 3.01 0.96 assign (resid 11 and name HA ) (resid 43 and name HD2* ) 3.35 1.55 0.67 assign (resid 11 and name HB1 ) (resid 43 and name HD2* ) 5.27 3.47 1.05 assign (resid 11 and name HZ ) (resid 49 and name HB* ) 6.50 4.70 1.30 assign (resid 12 and name HA ) (resid 15 and name HD1* ) 3.09 1.29 0.62 assign (resid 12 and name HA ) (resid 15 and name HG ) 4.36 2.56 0.87 assign (resid 12 and name HB* ) (resid 15 and name HG ) 5.67 3.87 1.13 assign (resid 12 and name HB* ) (resid 39 and name HB2 ) 3.46 1.66 0.69 assign (resid 12 and name HB* ) (resid 39 and name HB1 ) 3.36 1.56 0.67 assign (resid 12 and name HB* ) (resid 13 and name HG2 ) 4.82 3.02 0.96 assign (resid 12 and name HB* ) (resid 13 and name HG1 ) 3.98 2.18 0.80 assign (resid 12 and name HB* ) (resid 39 and name HG1 ) 4.23 2.43 0.85 assign (resid 12 and name HA ) (resid 39 and name HB1 ) 4.39 2.59 0.88 assign (resid 12 and name HA ) (resid 39 and name HG1 ) 5.33 3.53 1.07 assign (resid 12 and name HA ) (resid 16 and name HG* ) 5.00 3.20 1.00 assign (resid 12 and name HB* ) (resid 13 and name HA ) 4.00 2.20 0.80 assign (resid 12 and name HA ) (resid 14 and name HN ) 4.56 2.76 0.91 assign (resid 10 and name HN ) (resid 13 and name HB1 ) 3.78 1.98 0.76 assign (resid 10 and name HN ) (resid 13 and name HG2 ) 4.46 2.66 0.89 assign (resid 10 and name HN ) (resid 13 and name HG1 ) 5.00 3.20 1.00 assign (resid 38 and name HA ) (resid 39 and name HG2 ) 5.47 3.67 1.09 assign (resid 9 and name HA ) (resid 13 and name HG1 ) 5.52 3.72 1.10 assign (resid 12 and name HA ) (resid 13 and name HA ) 4.89 3.09 0.98 assign (resid 9 and name HA ) (resid 13 and name HB1 ) 5.65 3.85 1.13 assign (resid 13 and name HB1 ) (resid 14 and name HA ) 5.92 4.12 1.18 assign (resid 9 and name HA ) (resid 13 and name HB2 ) 4.92 3.12 0.98 assign (resid 13 and name HA ) (resid 16 and name HG* ) 3.72 1.92 0.74 assign (resid 15 and name HA ) (resid 22 and name HB* ) 4.70 2.90 0.94 assign (resid 12 and name HB* ) (resid 13 and name HB2 ) 5.03 3.23 1.01 assign (resid 12 and name HB* ) (resid 13 and name HB1 ) 5.56 3.76 1.11 assign (resid 10 and name HG2* ) (resid 13 and name HG2 ) 4.66 2.86 0.93 assign (resid 5 and name HE* ) (resid 14 and name HA ) 3.02 1.22 0.60 assign (resid 5 and name HD* ) (resid 14 and name HA ) 3.60 1.80 0.72 assign (resid 5 and name HZ ) (resid 14 and name HA ) 5.05 3.25 1.01 assign (resid 5 and name HE* ) (resid 14 and name HB* ) 3.24 1.44 0.65 assign (resid 5 and name HD* ) (resid 14 and name HB* ) 3.38 1.58 0.68 assign (resid 13 and name HA ) (resid 14 and name HA ) 5.32 3.52 1.06 assign (resid 14 and name HA ) (resid 15 and name HA ) 5.96 4.16 1.19 assign (resid 9 and name HG1 ) (resid 14 and name HB* ) 4.25 2.45 0.85 assign (resid 13 and name HB2 ) (resid 14 and name HB* ) 4.57 2.77 0.91 assign (resid 14 and name HA ) (resid 17 and name HG2* ) 3.95 2.15 0.79 assign (resid 14 and name HB* ) (resid 43 and name HD1* ) 3.29 1.49 0.66 assign (resid 14 and name HA ) (resid 43 and name HD1* ) 5.01 3.21 1.00 assign (resid 15 and name HA ) (resid 21 and name HG1* ) 3.04 1.24 0.61 assign (resid 15 and name HB1 ) (resid 21 and name HG1* ) 4.48 2.68 0.90 assign (resid 15 and name HA ) (resid 25 and name HD1* ) 3.89 2.09 0.78 assign (resid 13 and name HB2 ) (resid 15 and name HB2 ) 6.50 4.70 1.30 assign (resid 15 and name HD1* ) (resid 33 and name HG11 ) 4.03 2.23 0.81 assign (resid 15 and name HD2* ) (resid 22 and name HB* ) 2.73 0.93 0.55 assign (resid 15 and name HD2* ) (resid 21 and name HG2* ) 4.18 2.38 0.84 assign (resid 15 and name HD2* ) (resid 25 and name HG ) 3.97 2.17 0.79 assign (resid 15 and name HD1* ) (resid 25 and name HG ) 5.29 3.49 1.06 assign (resid 15 and name HD1* ) (resid 21 and name HB ) 6.50 4.70 1.30 assign (resid 15 and name HD2* ) (resid 21 and name HB ) 3.33 1.53 0.67 assign (resid 15 and name HD2* ) (resid 22 and name HA ) 2.97 1.17 0.59 assign (resid 12 and name HA ) (resid 15 and name HD2* ) 5.23 3.43 1.05 assign (resid 15 and name HB1 ) (resid 16 and name HA ) 4.95 3.15 0.99 assign (resid 15 and name HD2* ) (resid 21 and name HN ) 4.82 3.02 0.96 assign (resid 15 and name HA ) (resid 16 and name HA ) 5.25 3.45 1.05 assign (resid 5 and name HZ ) (resid 17 and name HA ) 5.38 3.58 1.08 assign (resid 5 and name HE* ) (resid 17 and name HA ) 5.55 3.75 1.11 assign (resid 16 and name HN ) (resid 17 and name HA ) 5.98 4.18 1.20 assign (resid 5 and name HE* ) (resid 17 and name HB ) 3.29 1.49 0.66 assign (resid 5 and name HZ ) (resid 17 and name HB ) 3.60 1.80 0.72 assign (resid 5 and name HZ ) (resid 17 and name HG2* ) 3.47 1.67 0.69 assign (resid 5 and name HE* ) (resid 17 and name HG2* ) 3.87 2.07 0.77 assign (resid 17 and name HA ) (resid 18 and name HA ) 4.77 2.97 0.95 assign (resid 14 and name HA ) (resid 17 and name HA ) 5.25 3.45 1.05 assign (resid 16 and name HA ) (resid 17 and name HA ) 5.63 3.83 1.13 assign (resid 14 and name HA ) (resid 17 and name HB ) 3.59 1.79 0.72 assign (resid 17 and name HB ) (resid 18 and name HB1 ) 6.50 4.70 1.30 assign (resid 17 and name HB ) (resid 18 and name HB2 ) 5.12 3.32 1.02 assign (resid 16 and name HB2 ) (resid 17 and name HA ) 4.85 3.05 0.97 assign (resid 16 and name HB1 ) (resid 17 and name HA ) 4.71 2.91 0.94 assign (resid 17 and name HB ) (resid 21 and name HG2* ) 3.99 2.19 0.80 assign (resid 14 and name HB* ) (resid 17 and name HB ) 4.44 2.64 0.89 assign (resid 9 and name HE* ) (resid 17 and name HB ) 4.70 2.90 0.94 assign (resid 17 and name HG2* ) (resid 21 and name HG2* ) 3.90 2.10 0.78 assign (resid 4 and name HB1 ) (resid 17 and name HG2* ) 3.66 1.86 0.73 assign (resid 4 and name HD* ) (resid 17 and name HG2* ) 3.99 2.19 0.80 assign (resid 5 and name HZ ) (resid 18 and name HB1 ) 3.96 2.16 0.79 assign (resid 5 and name HZ ) (resid 18 and name HB2 ) 3.67 1.87 0.73 assign (resid 18 and name HB1 ) (resid 19 and name HD2 ) 4.65 2.85 0.93 assign (resid 18 and name HB2 ) (resid 19 and name HD2 ) 4.76 2.96 0.95 assign (resid 18 and name HB1 ) (resid 19 and name HD1 ) 4.65 2.85 0.93 assign (resid 18 and name HB1 ) (resid 21 and name HG2* ) 3.11 1.31 0.62 assign (resid 17 and name HG2* ) (resid 18 and name HB1 ) 4.51 2.71 0.90 assign (resid 18 and name HB1 ) (resid 64 and name HD1* ) 3.81 2.01 0.76 assign (resid 18 and name HB2 ) (resid 21 and name HG2* ) 3.28 1.48 0.66 assign (resid 17 and name HG2* ) (resid 18 and name HB2 ) 3.64 1.84 0.73 assign (resid 18 and name HB2 ) (resid 64 and name HD1* ) 3.97 2.17 0.79 assign (resid 17 and name HG2* ) (resid 18 and name HD2 ) 5.54 3.74 1.11 assign (resid 18 and name HD2 ) (resid 64 and name HD1* ) 6.50 4.70 1.30 assign (resid 18 and name HB1 ) (resid 64 and name HB1 ) 4.78 2.98 0.96 assign (resid 19 and name HB2 ) (resid 20 and name HA1 ) 4.95 3.15 0.99 assign (resid 19 and name HB1 ) (resid 20 and name HA1 ) 6.09 4.29 1.22 assign (resid 56 and name HA ) (resid 59 and name HG1 ) 5.93 4.13 1.19 assign (resid 18 and name HA ) (resid 19 and name HB2 ) 5.69 3.89 1.14 assign (resid 18 and name HA ) (resid 19 and name HA ) 4.40 2.60 0.88 assign (resid 18 and name HA ) (resid 19 and name HG2 ) 4.88 3.08 0.98 assign (resid 18 and name HA ) (resid 19 and name HG1 ) 4.88 3.08 0.98 assign (resid 18 and name HD2 ) (resid 19 and name HD2 ) 5.34 3.54 1.07 assign (resid 18 and name HN ) (resid 19 and name HD2 ) 5.57 3.77 1.11 assign (resid 5 and name HE* ) (resid 21 and name HG2* ) 3.08 1.28 0.62 assign (resid 5 and name HZ ) (resid 21 and name HG2* ) 3.06 1.26 0.61 assign (resid 5 and name HE* ) (resid 21 and name HG1* ) 4.09 2.29 0.82 assign (resid 5 and name HZ ) (resid 21 and name HG1* ) 5.10 3.30 1.02 assign (resid 20 and name HA1 ) (resid 21 and name HA ) 4.63 2.83 0.93 assign (resid 15 and name HA ) (resid 21 and name HG2* ) 3.62 1.82 0.72 assign (resid 17 and name HB ) (resid 21 and name HG1* ) 6.50 4.70 1.30 assign (resid 18 and name HA ) (resid 21 and name HG2* ) 4.42 2.62 0.88 assign (resid 21 and name HA ) (resid 25 and name HG ) 5.22 3.42 1.04 assign (resid 14 and name HB* ) (resid 21 and name HA ) 5.47 3.67 1.09 assign (resid 21 and name HA ) (resid 61 and name HG ) 5.77 3.97 1.15 assign (resid 21 and name HA ) (resid 22 and name HB* ) 5.22 3.42 1.04 assign (resid 21 and name HA ) (resid 24 and name HG2* ) 3.47 1.67 0.69 assign (resid 21 and name HA ) (resid 25 and name HD1* ) 4.82 3.02 0.96 assign (resid 21 and name HA ) (resid 64 and name HD2* ) 4.28 2.48 0.86 assign (resid 21 and name HA ) (resid 64 and name HD1* ) 3.16 1.36 0.63 assign (resid 21 and name HB ) (resid 64 and name HD1* ) 5.03 3.23 1.01 assign (resid 21 and name HB ) (resid 25 and name HD1* ) 5.06 3.26 1.01 assign (resid 14 and name HB* ) (resid 21 and name HB ) 5.03 3.23 1.01 assign (resid 15 and name HG ) (resid 21 and name HB ) 5.47 3.67 1.09 assign (resid 21 and name HB ) (resid 24 and name HB ) 5.15 3.35 1.03 assign (resid 21 and name HG1* ) (resid 24 and name HB ) 4.35 2.55 0.87 assign (resid 21 and name HG1* ) (resid 25 and name HG ) 3.27 1.47 0.65 assign (resid 15 and name HG ) (resid 21 and name HG1* ) 3.68 1.88 0.74 assign (resid 14 and name HB* ) (resid 21 and name HG1* ) 2.95 1.15 0.59 assign (resid 21 and name HG1* ) (resid 22 and name HB* ) 4.34 2.54 0.87 assign (resid 21 and name HG1* ) (resid 61 and name HB2 ) 5.46 3.66 1.09 assign (resid 15 and name HD2* ) (resid 21 and name HG1* ) 2.87 1.07 0.57 assign (resid 21 and name HG1* ) (resid 25 and name HD1* ) 2.64 0.84 0.53 assign (resid 21 and name HG2* ) (resid 64 and name HD1* ) 2.87 1.07 0.57 assign (resid 14 and name HB* ) (resid 21 and name HG2* ) 3.48 1.68 0.70 assign (resid 9 and name HE* ) (resid 21 and name HG2* ) 5.18 3.38 1.04 assign (resid 21 and name HG2* ) (resid 24 and name HB ) 5.49 3.69 1.10 assign (resid 21 and name HA ) (resid 61 and name HD2* ) 3.11 1.31 0.62 assign (resid 21 and name HB ) (resid 61 and name HD2* ) 4.51 2.71 0.90 assign (resid 21 and name HG1* ) (resid 61 and name HD2* ) 2.89 1.09 0.58 assign (resid 21 and name HG2* ) (resid 61 and name HD2* ) 2.85 1.05 0.57 assign (resid 21 and name HG1* ) (resid 22 and name HA ) 3.80 2.00 0.76 assign (resid 22 and name HB* ) (resid 25 and name HD1* ) 4.93 3.13 0.99 assign (resid 22 and name HB* ) (resid 25 and name HB2 ) 5.75 3.95 1.15 assign (resid 23 and name HA1 ) (resid 26 and name HD1 ) 4.88 3.08 0.98 assign (resid 23 and name HA2 ) (resid 26 and name HG1 ) 4.85 3.05 0.97 assign (resid 23 and name HA2 ) (resid 24 and name HG2* ) 5.21 3.41 1.04 assign (resid 22 and name HB* ) (resid 23 and name HA1 ) 4.45 2.65 0.89 assign (resid 23 and name HA1 ) (resid 26 and name HG1 ) 5.97 4.17 1.19 assign (resid 23 and name HA1 ) (resid 24 and name HG2* ) 4.63 2.83 0.93 assign (resid 24 and name HA ) (resid 64 and name HD2* ) 4.87 3.07 0.97 assign (resid 24 and name HA ) (resid 61 and name HD2* ) 4.60 2.80 0.92 assign (resid 24 and name HB ) (resid 25 and name HD2* ) 4.58 2.78 0.92 assign (resid 33 and name HG2* ) (resid 36 and name HG1 ) 5.14 3.34 1.03 assign (resid 24 and name HB ) (resid 64 and name HD1* ) 4.39 2.59 0.88 assign (resid 24 and name HB ) (resid 61 and name HD2* ) 3.18 1.38 0.64 assign (resid 24 and name HG2* ) (resid 64 and name HD1* ) 3.08 1.28 0.62 assign (resid 24 and name HG2* ) (resid 61 and name HD2* ) 3.04 1.24 0.61 assign (resid 24 and name HG1* ) (resid 57 and name HG2* ) 3.12 1.32 0.62 assign (resid 24 and name HG1* ) (resid 57 and name HB ) 4.93 3.13 0.99 assign (resid 24 and name HG1* ) (resid 61 and name HG ) 3.63 1.83 0.73 assign (resid 24 and name HG2* ) (resid 60 and name HB1 ) 3.84 2.04 0.77 assign (resid 24 and name HG2* ) (resid 60 and name HB2 ) 5.41 3.61 1.08 assign (resid 24 and name HG1* ) (resid 61 and name HA ) 4.41 2.61 0.88 assign (resid 24 and name HA ) (resid 28 and name HD* ) 4.73 2.93 0.95 assign (resid 24 and name HG1* ) (resid 28 and name HD* ) 3.58 1.78 0.72 assign (resid 24 and name HG1* ) (resid 28 and name HE* ) 3.57 1.77 0.71 assign (resid 24 and name HA ) (resid 26 and name HN ) 4.96 3.16 0.99 assign (resid 22 and name HN ) (resid 24 and name HB ) 5.72 3.92 1.14 assign (resid 24 and name HB ) (resid 26 and name HN ) 6.39 4.59 1.28 assign (resid 25 and name HA ) (resid 28 and name HE* ) 5.81 4.01 1.16 assign (resid 25 and name HA ) (resid 28 and name HD* ) 4.14 2.34 0.83 assign (resid 22 and name HA ) (resid 25 and name HG ) 5.04 3.24 1.01 assign (resid 22 and name HA ) (resid 25 and name HD2* ) 5.66 3.86 1.13 assign (resid 21 and name HA ) (resid 25 and name HD2* ) 5.83 4.03 1.17 assign (resid 22 and name HA ) (resid 25 and name HD1* ) 3.63 1.83 0.73 assign (resid 24 and name HG1* ) (resid 25 and name HA ) 3.56 1.76 0.71 assign (resid 25 and name HA ) (resid 30 and name HG ) 6.50 4.70 1.30 assign (resid 25 and name HA ) (resid 30 and name HB2 ) 4.04 2.24 0.81 assign (resid 24 and name HB ) (resid 25 and name HA ) 4.78 2.98 0.96 assign (resid 25 and name HB1 ) (resid 30 and name HD1* ) 4.69 2.89 0.94 assign (resid 15 and name HD2* ) (resid 25 and name HB1 ) 6.00 4.20 1.20 assign (resid 25 and name HB1 ) (resid 30 and name HB2 ) 3.94 2.14 0.79 assign (resid 25 and name HB1 ) (resid 30 and name HB1 ) 3.33 1.53 0.67 assign (resid 25 and name HB2 ) (resid 30 and name HB1 ) 4.37 2.57 0.87 assign (resid 25 and name HB2 ) (resid 30 and name HB2 ) 4.46 2.66 0.89 assign (resid 24 and name HG1* ) (resid 25 and name HG ) 4.09 2.29 0.82 assign (resid 24 and name HG1* ) (resid 25 and name HD2* ) 2.97 1.17 0.59 assign (resid 15 and name HD1* ) (resid 25 and name HD1* ) 3.00 1.20 0.60 assign (resid 15 and name HD2* ) (resid 25 and name HD1* ) 2.91 1.11 0.58 assign (resid 25 and name HD2* ) (resid 30 and name HB1 ) 3.85 2.05 0.77 assign (resid 14 and name HB* ) (resid 25 and name HD2* ) 4.15 2.35 0.83 assign (resid 25 and name HD2* ) (resid 61 and name HG ) 4.41 2.61 0.88 assign (resid 14 and name HB* ) (resid 25 and name HD1* ) 3.72 1.92 0.74 assign (resid 25 and name HA ) (resid 57 and name HG2* ) 4.36 2.56 0.87 assign (resid 25 and name HD2* ) (resid 57 and name HG2* ) 2.92 1.12 0.58 assign (resid 25 and name HD2* ) (resid 61 and name HD2* ) 3.33 1.53 0.67 assign (resid 25 and name HD1* ) (resid 61 and name HD2* ) 3.83 2.03 0.77 assign (resid 11 and name HD* ) (resid 25 and name HD2* ) 4.02 2.22 0.80 assign (resid 11 and name HE* ) (resid 25 and name HD2* ) 3.36 1.56 0.67 assign (resid 11 and name HD* ) (resid 25 and name HD1* ) 3.37 1.57 0.67 assign (resid 11 and name HE* ) (resid 25 and name HD1* ) 3.71 1.91 0.74 assign (resid 24 and name HN ) (resid 25 and name HD2* ) 5.37 3.57 1.07 assign (resid 26 and name HB2 ) (resid 28 and name HN ) 5.66 3.86 1.13 assign (resid 67 and name HB* ) (resid 68 and name HD2 ) 6.06 4.26 1.21 assign (resid 26 and name HA ) (resid 31 and name HN ) 3.49 1.69 0.70 assign (resid 26 and name HA ) (resid 27 and name HA ) 5.00 3.20 1.00 assign (resid 26 and name HA ) (resid 29 and name HA ) 4.13 2.33 0.83 assign (resid 26 and name HG1 ) (resid 31 and name HA1 ) 5.60 3.80 1.12 assign (resid 26 and name HG2 ) (resid 31 and name HA1 ) 4.55 2.75 0.91 assign (resid 23 and name HA2 ) (resid 26 and name HD1 ) 5.02 3.22 1.00 assign (resid 23 and name HA2 ) (resid 26 and name HD2 ) 5.78 3.98 1.16 assign (resid 26 and name HA ) (resid 30 and name HB1 ) 5.80 4.00 1.16 assign (resid 26 and name HA ) (resid 30 and name HG ) 6.24 4.44 1.25 assign (resid 15 and name HD1* ) (resid 26 and name HD2 ) 5.85 4.05 1.17 assign (resid 28 and name HA ) (resid 30 and name HN ) 6.41 4.61 1.28 assign (resid 28 and name HA ) (resid 29 and name HB2 ) 4.59 2.79 0.92 assign (resid 27 and name HB1 ) (resid 28 and name HA ) 5.16 3.36 1.03 assign (resid 28 and name HA ) (resid 30 and name HG ) 5.18 3.38 1.04 assign (resid 28 and name HA ) (resid 52 and name HD1* ) 3.76 1.96 0.75 assign (resid 28 and name HB1 ) (resid 30 and name HG ) 3.85 2.05 0.77 assign (resid 28 and name HB1 ) (resid 52 and name HD1* ) 3.42 1.62 0.68 assign (resid 28 and name HB1 ) (resid 30 and name HD1* ) 3.92 2.12 0.78 assign (resid 28 and name HB2 ) (resid 30 and name HG ) 3.84 2.04 0.77 assign (resid 28 and name HB2 ) (resid 52 and name HD1* ) 3.70 1.90 0.74 assign (resid 28 and name HA ) (resid 30 and name HD2* ) 5.77 3.97 1.15 assign (resid 28 and name HA ) (resid 57 and name HD1* ) 6.36 4.56 1.27 assign (resid 28 and name HB1 ) (resid 30 and name HD2* ) 4.61 2.81 0.92 assign (resid 28 and name HB2 ) (resid 30 and name HD2* ) 4.93 3.13 0.99 assign (resid 28 and name HB2 ) (resid 57 and name HD1* ) 5.16 3.36 1.03 assign (resid 29 and name HA ) (resid 52 and name HD1* ) 5.63 3.83 1.13 assign (resid 29 and name HB2 ) (resid 52 and name HD1* ) 4.77 2.97 0.95 assign (resid 29 and name HB1 ) (resid 52 and name HD1* ) 4.73 2.93 0.95 assign (resid 28 and name HN ) (resid 29 and name HA ) 4.89 3.09 0.98 assign (resid 11 and name HE* ) (resid 30 and name HB1 ) 4.45 2.65 0.89 assign (resid 11 and name HE* ) (resid 30 and name HB2 ) 4.64 2.84 0.93 assign (resid 11 and name HE* ) (resid 30 and name HG ) 5.50 3.70 1.10 assign (resid 28 and name HD* ) (resid 30 and name HG ) 5.88 4.08 1.18 assign (resid 11 and name HE* ) (resid 30 and name HD2* ) 3.79 1.99 0.76 assign (resid 11 and name HZ ) (resid 30 and name HD2* ) 4.07 2.27 0.81 assign (resid 11 and name HD* ) (resid 30 and name HD1* ) 4.85 3.05 0.97 assign (resid 11 and name HE* ) (resid 30 and name HD1* ) 3.62 1.82 0.72 assign (resid 11 and name HZ ) (resid 30 and name HD1* ) 3.84 2.04 0.77 assign (resid 5 and name HE* ) (resid 58 and name HD2* ) 6.50 4.70 1.30 assign (resid 11 and name HD* ) (resid 30 and name HD2* ) 6.50 4.70 1.30 assign (resid 25 and name HA ) (resid 30 and name HB1 ) 4.89 3.09 0.98 assign (resid 30 and name HD2* ) (resid 50 and name HB1 ) 4.17 2.37 0.83 assign (resid 30 and name HD2* ) (resid 50 and name HB2 ) 3.90 2.10 0.78 assign (resid 28 and name HB2 ) (resid 30 and name HD1* ) 3.75 1.95 0.75 assign (resid 5 and name HB2 ) (resid 58 and name HD2* ) 3.53 1.73 0.71 assign (resid 5 and name HB1 ) (resid 58 and name HD2* ) 3.42 1.62 0.68 assign (resid 30 and name HA ) (resid 52 and name HD1* ) 5.34 3.54 1.07 assign (resid 30 and name HD2* ) (resid 52 and name HD1* ) 3.16 1.36 0.63 assign (resid 30 and name HD1* ) (resid 52 and name HD1* ) 3.16 1.36 0.63 assign (resid 43 and name HD2* ) (resid 58 and name HD2* ) 3.93 2.13 0.79 assign (resid 26 and name HG2 ) (resid 31 and name HA2 ) 4.67 2.87 0.93 assign (resid 30 and name HB2 ) (resid 31 and name HA2 ) 6.50 4.70 1.30 assign (resid 25 and name HB2 ) (resid 31 and name HA2 ) 5.30 3.50 1.06 assign (resid 26 and name HB1 ) (resid 31 and name HA2 ) 5.88 4.08 1.18 assign (resid 25 and name HD1* ) (resid 31 and name HA2 ) 5.30 3.50 1.06 assign (resid 32 and name HA ) (resid 35 and name HB* ) 3.95 2.15 0.79 assign (resid 33 and name HG2* ) (resid 35 and name HN ) 5.03 3.23 1.01 assign (resid 33 and name HD1* ) (resid 38 and name HN ) 6.50 4.70 1.30 assign (resid 26 and name HN ) (resid 33 and name HD1* ) 5.27 3.47 1.05 assign (resid 32 and name HA ) (resid 33 and name HA ) 4.92 3.12 0.98 assign (resid 33 and name HB ) (resid 38 and name HB* ) 5.56 3.76 1.11 assign (resid 30 and name HB2 ) (resid 33 and name HG12 ) 5.03 3.23 1.01 assign (resid 33 and name HD1* ) (resid 38 and name HB* ) 5.73 3.93 1.15 assign (resid 15 and name HD1* ) (resid 33 and name HD1* ) 4.02 2.22 0.80 assign (resid 14 and name HB* ) (resid 33 and name HD1* ) 5.63 3.83 1.13 assign (resid 15 and name HB1 ) (resid 33 and name HD1* ) 6.01 4.21 1.20 assign (resid 37 and name HA2 ) (resid 40 and name HN ) 5.01 3.21 1.00 assign (resid 19 and name HA ) (resid 20 and name HA1 ) 5.43 3.63 1.09 assign (resid 33 and name HD1* ) (resid 34 and name HA2 ) 5.03 3.23 1.01 assign (resid 20 and name HA1 ) (resid 64 and name HD2* ) 3.46 1.66 0.69 assign (resid 35 and name HB* ) (resid 36 and name HB1 ) 6.50 4.70 1.30 assign (resid 20 and name HA1 ) (resid 21 and name HG2* ) 5.08 3.28 1.02 assign (resid 15 and name HD1* ) (resid 34 and name HA2 ) 5.39 3.59 1.08 assign (resid 34 and name HA2 ) (resid 38 and name HB* ) 5.46 3.66 1.09 assign (resid 37 and name HA1 ) (resid 40 and name HN ) 5.23 3.43 1.05 assign (resid 11 and name HB1 ) (resid 38 and name HA ) 6.48 4.68 1.30 assign (resid 36 and name HB1 ) (resid 38 and name HB* ) 6.50 4.70 1.30 assign (resid 36 and name HE* ) (resid 38 and name HB* ) 5.04 3.24 1.01 assign (resid 11 and name HB2 ) (resid 39 and name HA ) 3.34 1.54 0.67 assign (resid 11 and name HB1 ) (resid 39 and name HA ) 3.87 2.07 0.77 assign (resid 11 and name HB1 ) (resid 39 and name HG1 ) 6.50 4.70 1.30 assign (resid 11 and name HB1 ) (resid 39 and name HG2 ) 6.50 4.70 1.30 assign (resid 12 and name HB* ) (resid 39 and name HA ) 3.70 1.90 0.74 assign (resid 38 and name HB* ) (resid 39 and name HA ) 4.60 2.80 0.92 assign (resid 15 and name HD1* ) (resid 39 and name HA ) 4.89 3.09 0.98 assign (resid 33 and name HD1* ) (resid 39 and name HA ) 4.05 2.25 0.81 assign (resid 12 and name HB* ) (resid 39 and name HG2 ) 4.23 2.43 0.85 assign (resid 15 and name HD1* ) (resid 39 and name HG2 ) 6.13 4.33 1.23 assign (resid 10 and name HG2* ) (resid 40 and name HA ) 3.43 1.63 0.69 assign (resid 10 and name HG2* ) (resid 40 and name HB2 ) 5.31 3.51 1.06 assign (resid 39 and name HB2 ) (resid 40 and name HB1 ) 6.50 4.70 1.30 assign (resid 10 and name HB ) (resid 40 and name HA ) 3.08 1.28 0.62 assign (resid 41 and name HG1 ) (resid 46 and name HN ) 4.84 3.04 0.97 assign (resid 40 and name HN ) (resid 41 and name HB* ) 4.79 2.99 0.96 assign (resid 11 and name HD* ) (resid 41 and name HB* ) 4.34 2.54 0.87 assign (resid 11 and name HE* ) (resid 41 and name HB* ) 4.13 2.33 0.83 assign (resid 11 and name HD* ) (resid 41 and name HG2 ) 4.77 2.97 0.95 assign (resid 11 and name HE* ) (resid 41 and name HG2 ) 4.87 3.07 0.97 assign (resid 11 and name HD* ) (resid 41 and name HG1 ) 4.77 2.97 0.95 assign (resid 38 and name HA ) (resid 41 and name HB* ) 4.36 2.56 0.87 assign (resid 10 and name HG2* ) (resid 41 and name HA ) 4.51 2.71 0.90 assign (resid 38 and name HB* ) (resid 41 and name HG2 ) 5.02 3.22 1.00 assign (resid 38 and name HB* ) (resid 41 and name HG1 ) 5.02 3.22 1.00 assign (resid 43 and name HA ) (resid 44 and name HA ) 5.04 3.24 1.01 assign (resid 43 and name HA ) (resid 46 and name HA1 ) 4.56 2.76 0.91 assign (resid 7 and name HA ) (resid 43 and name HB1 ) 4.03 2.23 0.81 assign (resid 42 and name HA ) (resid 43 and name HA ) 5.50 3.70 1.10 assign (resid 10 and name HA ) (resid 43 and name HA ) 6.50 4.70 1.30 assign (resid 14 and name HB* ) (resid 43 and name HD2* ) 3.13 1.33 0.63 assign (resid 43 and name HB2 ) (resid 58 and name HD2* ) 4.32 2.52 0.86 assign (resid 43 and name HB1 ) (resid 58 and name HD2* ) 4.40 2.60 0.88 assign (resid 43 and name HB1 ) (resid 57 and name HD1* ) 5.32 3.52 1.06 assign (resid 43 and name HB2 ) (resid 57 and name HG2* ) 5.79 3.99 1.16 assign (resid 43 and name HB2 ) (resid 57 and name HD1* ) 6.28 4.48 1.26 assign (resid 43 and name HD2* ) (resid 61 and name HD1* ) 3.29 1.49 0.66 assign (resid 43 and name HD2* ) (resid 57 and name HD1* ) 3.72 1.92 0.74 assign (resid 43 and name HD1* ) (resid 61 and name HD1* ) 3.18 1.38 0.64 assign (resid 43 and name HD1* ) (resid 57 and name HG2* ) 3.55 1.75 0.71 assign (resid 25 and name HD1* ) (resid 43 and name HD2* ) 3.78 1.98 0.76 assign (resid 44 and name HA ) (resid 54 and name HG1* ) 3.57 1.77 0.71 assign (resid 7 and name HB1 ) (resid 44 and name HB2 ) 4.10 2.30 0.82 assign (resid 7 and name HG2 ) (resid 44 and name HB2 ) 5.12 3.32 1.02 assign (resid 44 and name HB1 ) (resid 54 and name HG1* ) 4.78 2.98 0.96 assign (resid 7 and name HG1 ) (resid 44 and name HB1 ) 4.60 2.80 0.92 assign (resid 7 and name HD1 ) (resid 44 and name HB1 ) 3.90 2.10 0.78 assign (resid 7 and name HB1 ) (resid 44 and name HA ) 5.11 3.31 1.02 assign (resid 43 and name HB2 ) (resid 44 and name HA ) 5.40 3.60 1.08 assign (resid 7 and name HB2 ) (resid 44 and name HA ) 4.44 2.64 0.89 assign (resid 44 and name HG1 ) (resid 54 and name HG1* ) 3.76 1.96 0.75 assign (resid 44 and name HG1 ) (resid 54 and name HG2* ) 4.42 2.62 0.88 assign (resid 45 and name HA ) (resid 49 and name HB* ) 4.76 2.96 0.95 assign (resid 44 and name HG2 ) (resid 45 and name HA ) 4.62 2.82 0.92 assign (resid 41 and name HG2 ) (resid 45 and name HB1 ) 4.44 2.64 0.89 assign (resid 45 and name HB1 ) (resid 46 and name HA2 ) 4.81 3.01 0.96 assign (resid 42 and name HN ) (resid 45 and name HB1 ) 4.24 2.44 0.85 assign (resid 42 and name HN ) (resid 45 and name HG2 ) 5.15 3.35 1.03 assign (resid 45 and name HN ) (resid 46 and name HA2 ) 5.50 3.70 1.10 assign (resid 47 and name HA ) (resid 52 and name HN ) 4.16 2.36 0.83 assign (resid 11 and name HE* ) (resid 46 and name HA1 ) 3.62 1.82 0.72 assign (resid 11 and name HZ ) (resid 46 and name HA1 ) 3.50 1.70 0.70 assign (resid 11 and name HE* ) (resid 46 and name HA2 ) 3.96 2.16 0.79 assign (resid 11 and name HZ ) (resid 46 and name HA2 ) 3.77 1.97 0.75 assign (resid 45 and name HB2 ) (resid 46 and name HA2 ) 5.99 4.19 1.20 assign (resid 46 and name HA1 ) (resid 47 and name HB* ) 5.72 3.92 1.14 assign (resid 47 and name HA ) (resid 52 and name HD1* ) 3.38 1.58 0.68 assign (resid 30 and name HD1* ) (resid 47 and name HA ) 3.94 2.14 0.79 assign (resid 47 and name HA ) (resid 52 and name HB1 ) 4.65 2.85 0.93 assign (resid 47 and name HA ) (resid 52 and name HB2 ) 3.35 1.55 0.67 assign (resid 47 and name HA ) (resid 52 and name HG ) 4.34 2.54 0.87 assign (resid 47 and name HB* ) (resid 52 and name HG ) 4.82 3.02 0.96 assign (resid 44 and name HB2 ) (resid 47 and name HB* ) 5.25 3.45 1.05 assign (resid 47 and name HB* ) (resid 54 and name HB ) 2.86 1.06 0.57 assign (resid 47 and name HB* ) (resid 52 and name HD1* ) 3.99 2.19 0.80 assign (resid 30 and name HD2* ) (resid 47 and name HA ) 3.71 1.91 0.74 assign (resid 47 and name HA ) (resid 48 and name HA ) 5.04 3.24 1.01 assign (resid 47 and name HB* ) (resid 48 and name HA ) 4.04 2.24 0.81 assign (resid 48 and name HB1 ) (resid 49 and name HB* ) 4.63 2.83 0.93 assign (resid 47 and name HB* ) (resid 48 and name HB1 ) 5.36 3.56 1.07 assign (resid 48 and name HB1 ) (resid 49 and name HA ) 4.58 2.78 0.92 assign (resid 41 and name HB* ) (resid 49 and name HB* ) 5.91 4.11 1.18 assign (resid 64 and name HD1* ) (resid 65 and name HB* ) 4.96 3.16 0.99 assign (resid 50 and name HB2 ) (resid 52 and name HG ) 3.70 1.90 0.74 assign (resid 50 and name HB2 ) (resid 52 and name HB2 ) 5.33 3.53 1.07 assign (resid 50 and name HB2 ) (resid 52 and name HD1* ) 3.41 1.61 0.68 assign (resid 30 and name HD1* ) (resid 50 and name HB2 ) 5.64 3.84 1.13 assign (resid 50 and name HB1 ) (resid 52 and name HG ) 3.65 1.85 0.73 assign (resid 50 and name HB1 ) (resid 52 and name HB2 ) 4.92 3.12 0.98 assign (resid 50 and name HB1 ) (resid 52 and name HD1* ) 3.43 1.63 0.69 assign (resid 29 and name HB1 ) (resid 50 and name HB2 ) 5.79 3.99 1.16 assign (resid 30 and name HA ) (resid 50 and name HD2 ) 5.01 3.21 1.00 assign (resid 30 and name HA ) (resid 50 and name HB1 ) 5.46 3.66 1.09 assign (resid 30 and name HA ) (resid 33 and name HN ) 4.90 3.10 0.98 assign (resid 49 and name HB* ) (resid 50 and name HD2 ) 3.33 1.53 0.67 assign (resid 52 and name HB1 ) (resid 57 and name HD1* ) 3.94 2.14 0.79 assign (resid 51 and name HA* ) (resid 52 and name HD2* ) 4.32 2.52 0.86 assign (resid 51 and name HA* ) (resid 52 and name HB2 ) 5.38 3.58 1.08 assign (resid 51 and name HA* ) (resid 52 and name HG ) 4.87 3.07 0.97 assign (resid 29 and name HB2 ) (resid 52 and name HD2* ) 4.91 3.11 0.98 assign (resid 50 and name HB2 ) (resid 52 and name HD2* ) 5.21 3.41 1.04 assign (resid 48 and name HA ) (resid 51 and name HA* ) 4.54 2.74 0.91 assign (resid 50 and name HN ) (resid 51 and name HA* ) 4.58 2.78 0.92 assign (resid 28 and name HD* ) (resid 52 and name HD2* ) 3.38 1.58 0.68 assign (resid 28 and name HD* ) (resid 52 and name HD1* ) 3.47 1.67 0.69 assign (resid 50 and name HB1 ) (resid 52 and name HD2* ) 4.15 2.35 0.83 assign (resid 52 and name HA ) (resid 53 and name HB1 ) 4.98 3.18 1.00 assign (resid 52 and name HA ) (resid 53 and name HB2 ) 4.65 2.85 0.93 assign (resid 53 and name HB2 ) (resid 56 and name HN ) 4.51 2.71 0.90 assign (resid 53 and name HB2 ) (resid 55 and name HB2 ) 5.97 4.17 1.19 assign (resid 53 and name HB1 ) (resid 55 and name HB2 ) 6.50 4.70 1.30 assign (resid 54 and name HG2* ) (resid 57 and name HD1* ) 3.65 1.85 0.73 assign (resid 54 and name HG2* ) (resid 58 and name HD2* ) 3.81 2.01 0.76 assign (resid 47 and name HB* ) (resid 54 and name HA ) 2.93 1.13 0.59 assign (resid 36 and name HG1 ) (resid 38 and name HB* ) 3.19 1.39 0.64 assign (resid 54 and name HB ) (resid 57 and name HB ) 5.50 3.70 1.10 assign (resid 7 and name HD1 ) (resid 54 and name HG1* ) 3.78 1.98 0.76 assign (resid 47 and name HB* ) (resid 54 and name HG2* ) 3.21 1.41 0.64 assign (resid 7 and name HD1 ) (resid 54 and name HG2* ) 3.90 2.10 0.78 assign (resid 44 and name HB2 ) (resid 54 and name HG2* ) 3.62 1.82 0.72 assign (resid 54 and name HG1* ) (resid 58 and name HG ) 4.67 2.87 0.93 assign (resid 7 and name HB1 ) (resid 54 and name HG1* ) 3.69 1.89 0.74 assign (resid 7 and name HB2 ) (resid 54 and name HG1* ) 3.74 1.94 0.75 assign (resid 44 and name HB2 ) (resid 54 and name HG1* ) 3.72 1.92 0.74 assign (resid 24 and name HB ) (resid 61 and name HG ) 5.01 3.21 1.00 assign (resid 54 and name HA ) (resid 58 and name HG ) 4.56 2.76 0.91 assign (resid 44 and name HA ) (resid 54 and name HA ) 4.26 2.46 0.85 assign (resid 24 and name HB ) (resid 61 and name HA ) 4.66 2.86 0.93 assign (resid 47 and name HA ) (resid 54 and name HA ) 5.41 3.61 1.08 assign (resid 53 and name HA ) (resid 54 and name HA ) 4.52 2.72 0.90 assign (resid 53 and name HA ) (resid 54 and name HB ) 4.67 2.87 0.93 assign (resid 53 and name HA ) (resid 54 and name HG1* ) 4.11 2.31 0.82 assign (resid 44 and name HA ) (resid 54 and name HG2* ) 2.89 1.09 0.58 assign (resid 47 and name HN ) (resid 54 and name HA ) 5.65 3.85 1.13 assign (resid 55 and name HB1 ) (resid 59 and name HN ) 5.15 3.35 1.03 assign (resid 54 and name HG1* ) (resid 55 and name HG2 ) 3.66 1.86 0.73 assign (resid 54 and name HG1* ) (resid 55 and name HG1 ) 3.66 1.86 0.73 assign (resid 54 and name HG1* ) (resid 55 and name HB1 ) 4.68 2.88 0.94 assign (resid 55 and name HA ) (resid 58 and name HG ) 3.88 2.08 0.78 assign (resid 54 and name HG1* ) (resid 55 and name HA ) 3.53 1.73 0.71 assign (resid 55 and name HA ) (resid 58 and name HD1* ) 3.05 1.25 0.61 assign (resid 55 and name HA ) (resid 58 and name HD2* ) 5.03 3.23 1.01 assign (resid 54 and name HA ) (resid 57 and name HD1* ) 3.00 1.20 0.60 assign (resid 54 and name HA ) (resid 57 and name HG12 ) 4.73 2.93 0.95 assign (resid 56 and name HA ) (resid 58 and name HB2 ) 5.83 4.03 1.17 assign (resid 56 and name HA ) (resid 59 and name HG2 ) 5.45 3.65 1.09 assign (resid 56 and name HA ) (resid 57 and name HG11 ) 5.70 3.90 1.14 assign (resid 56 and name HB2 ) (resid 57 and name HG11 ) 5.15 3.35 1.03 assign (resid 56 and name HB1 ) (resid 57 and name HG11 ) 5.15 3.35 1.03 assign (resid 57 and name HA ) (resid 61 and name HG ) 4.91 3.11 0.98 assign (resid 57 and name HB ) (resid 58 and name HG ) 4.41 2.61 0.88 assign (resid 57 and name HG2* ) (resid 61 and name HG ) 3.19 1.39 0.64 assign (resid 24 and name HG1* ) (resid 57 and name HA ) 3.96 2.16 0.79 assign (resid 54 and name HG2* ) (resid 57 and name HB ) 3.77 1.97 0.75 assign (resid 57 and name HA ) (resid 58 and name HA ) 5.50 3.70 1.10 assign (resid 28 and name HE* ) (resid 56 and name HA ) 6.00 4.20 1.20 assign (resid 56 and name HA ) (resid 59 and name HE ) 4.70 2.90 0.94 assign (resid 28 and name HE* ) (resid 56 and name HB2 ) 4.34 2.54 0.87 assign (resid 28 and name HE* ) (resid 56 and name HB1 ) 4.34 2.54 0.87 assign (resid 24 and name HG1* ) (resid 57 and name HG12 ) 4.48 2.68 0.90 assign (resid 52 and name HD1* ) (resid 57 and name HG12 ) 4.75 2.95 0.95 assign (resid 52 and name HD1* ) (resid 57 and name HG11 ) 4.92 3.12 0.98 assign (resid 52 and name HD1* ) (resid 57 and name HD1* ) 3.13 1.33 0.63 assign (resid 47 and name HB* ) (resid 57 and name HD1* ) 2.95 1.15 0.59 assign (resid 47 and name HB* ) (resid 57 and name HG11 ) 4.88 3.08 0.98 assign (resid 47 and name HB* ) (resid 57 and name HG12 ) 5.40 3.60 1.08 assign (resid 54 and name HA ) (resid 57 and name HG11 ) 4.32 2.52 0.86 assign (resid 28 and name HB1 ) (resid 57 and name HD1* ) 4.61 2.81 0.92 assign (resid 47 and name HA ) (resid 57 and name HD1* ) 3.86 2.06 0.77 assign (resid 28 and name HE* ) (resid 57 and name HA ) 3.89 2.09 0.78 assign (resid 28 and name HD* ) (resid 57 and name HA ) 4.74 2.94 0.95 assign (resid 28 and name HD* ) (resid 57 and name HG2* ) 4.28 2.48 0.86 assign (resid 28 and name HE* ) (resid 57 and name HG2* ) 4.80 3.00 0.96 assign (resid 28 and name HD* ) (resid 57 and name HG12 ) 4.76 2.96 0.95 assign (resid 28 and name HE* ) (resid 57 and name HG11 ) 4.73 2.93 0.95 assign (resid 28 and name HD* ) (resid 57 and name HG11 ) 4.83 3.03 0.97 assign (resid 28 and name HD* ) (resid 57 and name HD1* ) 4.22 2.42 0.84 assign (resid 57 and name HA ) (resid 61 and name HN ) 5.05 3.25 1.01 assign (resid 56 and name HN ) (resid 57 and name HB ) 5.52 3.72 1.10 assign (resid 58 and name HB2 ) (resid 62 and name HD22 ) 4.80 3.00 0.96 assign (resid 30 and name HD2* ) (resid 47 and name HN ) 5.30 3.50 1.06 assign (resid 59 and name HG2 ) (resid 60 and name HA ) 4.72 2.92 0.94 assign (resid 24 and name HG1* ) (resid 60 and name HA ) 4.47 2.67 0.89 assign (resid 60 and name HA ) (resid 61 and name HG ) 5.79 3.99 1.16 assign (resid 7 and name HG1 ) (resid 8 and name HB1 ) 5.10 3.30 1.02 assign (resid 60 and name HB2 ) (resid 61 and name HG ) 5.43 3.63 1.09 assign (resid 24 and name HG1* ) (resid 60 and name HB2 ) 3.26 1.46 0.65 assign (resid 24 and name HG1* ) (resid 60 and name HB1 ) 3.15 1.35 0.63 assign (resid 60 and name HB1 ) (resid 63 and name HB* ) 5.25 3.45 1.05 assign (resid 57 and name HG2* ) (resid 60 and name HB2 ) 4.79 2.99 0.96 assign (resid 57 and name HG2* ) (resid 60 and name HB1 ) 4.92 3.12 0.98 assign (resid 60 and name HB1 ) (resid 61 and name HD2* ) 5.27 3.47 1.05 assign (resid 61 and name HA ) (resid 64 and name HD1* ) 3.23 1.43 0.65 assign (resid 61 and name HA ) (resid 64 and name HD2* ) 4.28 2.48 0.86 assign (resid 24 and name HG2* ) (resid 61 and name HA ) 3.55 1.75 0.71 assign (resid 24 and name HG1* ) (resid 61 and name HD2* ) 2.94 1.14 0.59 assign (resid 25 and name HD2* ) (resid 61 and name HD1* ) 3.74 1.94 0.75 assign (resid 61 and name HD2* ) (resid 64 and name HG ) 4.16 2.36 0.83 assign (resid 25 and name HG ) (resid 61 and name HD2* ) 4.17 2.37 0.83 assign (resid 57 and name HB ) (resid 61 and name HD1* ) 5.50 3.70 1.10 assign (resid 61 and name HA ) (resid 63 and name HB* ) 4.83 3.03 0.97 assign (resid 61 and name HA ) (resid 64 and name HG ) 3.31 1.51 0.66 assign (resid 62 and name HB1 ) (resid 63 and name HB* ) 5.58 3.78 1.12 assign (resid 62 and name HB1 ) (resid 65 and name HB* ) 5.91 4.11 1.18 assign (resid 28 and name HE* ) (resid 60 and name HA ) 5.93 4.13 1.19 assign (resid 28 and name HE* ) (resid 60 and name HB1 ) 4.14 2.34 0.83 assign (resid 5 and name HE* ) (resid 61 and name HB1 ) 4.78 2.98 0.96 assign (resid 5 and name HD* ) (resid 61 and name HB1 ) 4.11 2.31 0.82 assign (resid 5 and name HE* ) (resid 61 and name HB2 ) 5.53 3.73 1.11 assign (resid 60 and name HN ) (resid 61 and name HB2 ) 5.82 4.02 1.16 assign (resid 5 and name HE* ) (resid 61 and name HD2* ) 4.36 2.56 0.87 assign (resid 5 and name HD* ) (resid 61 and name HD2* ) 4.62 2.82 0.92 assign (resid 5 and name HE* ) (resid 61 and name HD1* ) 4.11 2.31 0.82 assign (resid 5 and name HD* ) (resid 61 and name HD1* ) 3.69 1.89 0.74 assign (resid 5 and name HA ) (resid 61 and name HD1* ) 5.34 3.54 1.07 assign (resid 63 and name HA ) (resid 66 and name HB2 ) 3.37 1.57 0.67 assign (resid 25 and name HD2* ) (resid 61 and name HA ) 5.55 3.75 1.11 assign (resid 63 and name HA ) (resid 66 and name HN ) 4.40 2.60 0.88 assign (resid 63 and name HA ) (resid 65 and name HN ) 4.40 2.60 0.88 assign (resid 24 and name HG2* ) (resid 64 and name HD2* ) 2.77 0.97 0.55 assign (resid 21 and name HG2* ) (resid 64 and name HD2* ) 4.17 2.37 0.83 assign (resid 38 and name HA ) (resid 39 and name HE21 ) 6.13 4.33 1.23 assign (resid 64 and name HN ) (resid 65 and name HA ) 6.50 4.70 1.30 assign (resid 65 and name HN ) (resid 66 and name HB2 ) 4.56 2.76 0.91 assign (resid 37 and name HA1 ) (resid 38 and name HA ) 5.00 3.20 1.00 assign (resid 64 and name HA ) (resid 65 and name HA ) 5.39 3.59 1.08 assign (resid 5 and name HA ) (resid 9 and name HE* ) 3.13 1.33 0.63 assign (resid 5 and name HD* ) (resid 9 and name HG2 ) 5.34 3.54 1.07 assign (resid 5 and name HD* ) (resid 9 and name HG1 ) 5.58 3.78 1.12 assign (resid 6 and name HN ) (resid 9 and name HE* ) 3.52 1.72 0.70 assign (resid 9 and name HG2 ) (resid 14 and name HN ) 5.30 3.50 1.06 assign (resid 9 and name HG1 ) (resid 14 and name HA ) 5.39 3.59 1.08 assign (resid 9 and name HG2 ) (resid 14 and name HA ) 6.50 4.70 1.30 assign (resid 11 and name HB1 ) (resid 39 and name HB1 ) 5.55 3.75 1.11 assign (resid 11 and name HB1 ) (resid 39 and name HE21 ) 4.94 3.14 0.99 assign (resid 11 and name HZ ) (resid 43 and name HD1* ) 6.50 4.70 1.30 assign (resid 11 and name HB1 ) (resid 15 and name HD1* ) 3.88 2.08 0.78 assign (resid 11 and name HB1 ) (resid 15 and name HD2* ) 6.50 4.70 1.30 assign (resid 15 and name HD2* ) (resid 16 and name HE22 ) 6.50 4.70 1.30 assign (resid 15 and name HD2* ) (resid 39 and name HE21 ) 6.50 4.70 1.30 assign (resid 15 and name HD2* ) (resid 39 and name HE22 ) 6.50 4.70 1.30 assign (resid 15 and name HG ) (resid 25 and name HD1* ) 3.68 1.88 0.74 assign (resid 21 and name HG2* ) (resid 25 and name HD1* ) 4.32 2.52 0.86 assign (resid 21 and name HG1* ) (resid 25 and name HB2 ) 4.18 2.38 0.84 assign (resid 25 and name HA ) (resid 30 and name HD1* ) 3.52 1.72 0.70 assign (resid 25 and name HA ) (resid 57 and name HD1* ) 4.97 3.17 0.99 assign (resid 25 and name HA ) (resid 61 and name HD2* ) 5.36 3.56 1.07 assign (resid 15 and name HG ) (resid 25 and name HD2* ) 4.71 2.91 0.94 assign (resid 21 and name HG1* ) (resid 25 and name HD2* ) 3.00 1.20 0.60 assign (resid 25 and name HD2* ) (resid 43 and name HD2* ) 3.37 1.57 0.67 assign (resid 25 and name HD1* ) (resid 43 and name HD1* ) 4.76 2.96 0.95 assign (resid 25 and name HD2* ) (resid 43 and name HD1* ) 3.77 1.97 0.75 assign (resid 30 and name HB1 ) (resid 33 and name HG2* ) 3.86 2.06 0.77 assign (resid 25 and name HD1* ) (resid 30 and name HD1* ) 3.79 1.99 0.76 assign (resid 54 and name HG1* ) (resid 58 and name HD2* ) 4.58 2.78 0.92 assign (resid 25 and name HD2* ) (resid 30 and name HD1* ) 3.11 1.31 0.62 assign (resid 27 and name HB1 ) (resid 28 and name HD* ) 4.42 2.62 0.88 assign (resid 27 and name HB2 ) (resid 28 and name HD* ) 4.60 2.80 0.92 assign (resid 28 and name HD* ) (resid 52 and name HB1 ) 5.24 3.44 1.05 assign (resid 28 and name HD* ) (resid 52 and name HB2 ) 6.50 4.70 1.30 assign (resid 28 and name HE* ) (resid 52 and name HD2* ) 4.74 2.94 0.95 assign (resid 28 and name HE* ) (resid 52 and name HD1* ) 4.63 2.83 0.93 assign (resid 50 and name HB2 ) (resid 52 and name HB1 ) 5.91 4.11 1.18 assign (resid 30 and name HA ) (resid 33 and name HG2* ) 4.08 2.28 0.82 assign (resid 30 and name HA ) (resid 33 and name HG12 ) 5.71 3.91 1.14 assign (resid 11 and name HZ ) (resid 30 and name HB2 ) 5.61 3.81 1.12 assign (resid 28 and name HB2 ) (resid 30 and name HB1 ) 5.14 3.34 1.03 assign (resid 28 and name HB2 ) (resid 30 and name HB2 ) 4.67 2.87 0.93 assign (resid 46 and name HA2 ) (resid 47 and name HB* ) 6.31 4.51 1.26 assign (resid 30 and name HD1* ) (resid 46 and name HA1 ) 4.60 2.80 0.92 assign (resid 30 and name HD2* ) (resid 46 and name HA2 ) 4.57 2.77 0.91 assign (resid 30 and name HD2* ) (resid 46 and name HA1 ) 4.01 2.21 0.80 assign (resid 30 and name HD2* ) (resid 47 and name HB* ) 5.51 3.71 1.10 assign (resid 30 and name HD2* ) (resid 50 and name HD2 ) 4.07 2.27 0.81 assign (resid 30 and name HD1* ) (resid 50 and name HD2 ) 5.16 3.36 1.03 assign (resid 43 and name HB1 ) (resid 57 and name HG2* ) 4.43 2.63 0.89 assign (resid 54 and name HG2* ) (resid 57 and name HG2* ) 4.69 2.89 0.94 assign (resid 30 and name HD2* ) (resid 57 and name HG12 ) 5.72 3.92 1.14 assign (resid 58 and name HD2* ) (resid 61 and name HB1 ) 5.97 4.17 1.19 assign (resid 30 and name HD1* ) (resid 57 and name HD1* ) 2.94 1.14 0.59 assign (resid 11 and name HD* ) (resid 33 and name HB ) 5.19 3.39 1.04 assign (resid 30 and name HD1* ) (resid 33 and name HG2* ) 4.01 2.21 0.80 assign (resid 30 and name HD2* ) (resid 33 and name HG2* ) 5.71 3.91 1.14 assign (resid 30 and name HD1* ) (resid 50 and name HB1 ) 5.52 3.72 1.10 assign (resid 58 and name HA ) (resid 61 and name HD1* ) 3.28 1.48 0.66 assign (resid 57 and name HG2* ) (resid 58 and name HA ) 3.62 1.82 0.72 assign (resid 7 and name HA ) (resid 58 and name HD1* ) 3.33 1.53 0.67 assign (resid 7 and name HB1 ) (resid 58 and name HD2* ) 4.07 2.27 0.81 assign (resid 30 and name HD2* ) (resid 52 and name HG ) 4.64 2.84 0.93 assign (resid 7 and name HB1 ) (resid 58 and name HD1* ) 3.01 1.21 0.60 assign (resid 30 and name HD1* ) (resid 57 and name HG2* ) 3.82 2.02 0.76 assign (resid 58 and name HD2* ) (resid 61 and name HD1* ) 2.74 0.94 0.55 assign (resid 30 and name HD2* ) (resid 57 and name HD1* ) 3.13 1.33 0.63 assign (resid 54 and name HG1* ) (resid 58 and name HD1* ) 2.99 1.19 0.60 assign (resid 58 and name HA ) (resid 61 and name HD2* ) 4.91 3.11 0.98 assign (resid 11 and name HD* ) (resid 33 and name HG2* ) 4.67 2.87 0.93 assign (resid 11 and name HE* ) (resid 33 and name HG2* ) 4.52 2.72 0.90 assign (resid 36 and name HE* ) (resid 37 and name HA1 ) 5.56 3.76 1.11 assign (resid 33 and name HA ) (resid 36 and name HE* ) 4.42 2.62 0.88 assign (resid 33 and name HA ) (resid 36 and name HG2 ) 5.06 3.26 1.01 assign (resid 33 and name HD1* ) (resid 36 and name HE* ) 6.50 4.70 1.30 assign (resid 33 and name HD1* ) (resid 39 and name HB2 ) 6.50 4.70 1.30 assign (resid 30 and name HB1 ) (resid 33 and name HD1* ) 4.10 2.30 0.82 assign (resid 15 and name HA ) (resid 21 and name HB ) 2.96 1.16 0.59 assign (resid 14 and name HN ) (resid 15 and name HB2 ) 4.64 2.84 0.93 assign (resid 21 and name HG2* ) (resid 25 and name HG ) 4.89 3.09 0.98 assign (resid 22 and name HA ) (resid 24 and name HN ) 4.80 3.00 0.96 assign (resid 23 and name HA1 ) (resid 27 and name HN ) 5.80 4.00 1.16 assign (resid 14 and name HA ) (resid 16 and name HN ) 4.32 2.52 0.86 assign (resid 23 and name HA1 ) (resid 25 and name HN ) 5.23 3.43 1.05 assign (resid 30 and name HD2* ) (resid 31 and name HN ) 4.66 2.86 0.93 assign (resid 33 and name HG2* ) (resid 46 and name HA1 ) 4.30 2.50 0.86 assign (resid 33 and name HG2* ) (resid 46 and name HA2 ) 5.92 4.12 1.18 assign (resid 28 and name HE* ) (resid 52 and name HB1 ) 6.50 4.70 1.30 assign (resid 28 and name HA ) (resid 52 and name HD2* ) 4.51 2.71 0.90 assign (resid 5 and name HE* ) (resid 9 and name HE* ) 3.78 1.98 0.76 assign (resid 9 and name HE* ) (resid 13 and name HE21 ) 4.42 2.62 0.88 assign (resid 9 and name HE* ) (resid 43 and name HD2* ) 6.11 4.31 1.22 assign (resid 13 and name HB2 ) (resid 43 and name HD2* ) 6.20 4.40 1.24 assign (resid 5 and name HD* ) (resid 43 and name HD1* ) 4.26 2.46 0.85 assign (resid 5 and name HE* ) (resid 43 and name HD1* ) 5.74 3.94 1.15 assign (resid 11 and name HD* ) (resid 43 and name HD1* ) 6.22 4.42 1.24 assign (resid 11 and name HE* ) (resid 43 and name HD2* ) 3.71 1.91 0.74 assign (resid 11 and name HD* ) (resid 43 and name HD2* ) 3.81 2.01 0.76 assign (resid 15 and name HD1* ) (resid 21 and name HG1* ) 4.34 2.54 0.87 assign (resid 21 and name HG1* ) (resid 24 and name HG1* ) 4.91 3.11 0.98 assign (resid 21 and name HG1* ) (resid 24 and name HG2* ) 4.88 3.08 0.98 assign (resid 9 and name HE* ) (resid 17 and name HG2* ) 3.49 1.69 0.70 assign (resid 3 and name HG* ) (resid 5 and name HN ) 4.84 3.04 0.97 assign (resid 10 and name HG2* ) (resid 10 and name HG1 ) 3.59 1.79 0.72 assign (resid 10 and name HG2* ) (resid 39 and name HA ) 6.42 4.62 1.28 assign (resid 10 and name HG2* ) (resid 42 and name HA ) 3.53 1.73 0.71 assign (resid 10 and name HG2* ) (resid 40 and name HB1 ) 4.47 2.67 0.89 assign (resid 10 and name HA ) (resid 42 and name HA ) 3.02 1.22 0.60 assign (resid 11 and name HB2 ) (resid 39 and name HB1 ) 5.01 3.21 1.00 assign (resid 11 and name HB1 ) (resid 41 and name HB* ) 6.45 4.65 1.29 assign (resid 10 and name HA ) (resid 11 and name HA ) 4.86 3.06 0.97 assign (resid 9 and name HG2 ) (resid 13 and name HB2 ) 5.08 3.28 1.02 assign (resid 9 and name HG1 ) (resid 13 and name HB1 ) 4.29 2.49 0.86 assign (resid 11 and name HB1 ) (resid 12 and name HB* ) 4.81 3.01 0.96 assign (resid 10 and name HB ) (resid 12 and name HB* ) 3.94 2.14 0.79 assign (resid 12 and name HB* ) (resid 40 and name HA ) 4.20 2.40 0.84 assign (resid 10 and name HG1 ) (resid 12 and name HB* ) 4.36 2.56 0.87 assign (resid 10 and name HN ) (resid 12 and name HB* ) 5.33 3.53 1.07 assign (resid 39 and name HG2 ) (resid 40 and name HA ) 6.50 4.70 1.30 assign (resid 10 and name HA ) (resid 13 and name HG1 ) 6.04 4.24 1.21 assign (resid 13 and name HG1 ) (resid 40 and name HA ) 6.50 4.70 1.30 assign (resid 10 and name HG1 ) (resid 13 and name HG1 ) 4.90 3.10 0.98 assign (resid 10 and name HG1 ) (resid 13 and name HG2 ) 4.60 2.80 0.92 assign (resid 14 and name HB* ) (resid 61 and name HD1* ) 3.63 1.83 0.73 assign (resid 15 and name HD2* ) (resid 21 and name HA ) 5.64 3.84 1.13 assign (resid 15 and name HD2* ) (resid 26 and name HD2 ) 6.05 4.25 1.21 assign (resid 42 and name HN ) (resid 45 and name HG1 ) 4.53 2.73 0.91 assign (resid 15 and name HB1 ) (resid 16 and name HG* ) 4.34 2.54 0.87 assign (resid 12 and name HB* ) (resid 16 and name HG* ) 4.30 2.50 0.86 assign (resid 43 and name HB1 ) (resid 44 and name HB2 ) 5.27 3.47 1.05 assign (resid 6 and name HG2* ) (resid 9 and name HB1 ) 3.91 2.11 0.78 assign (resid 9 and name HB1 ) (resid 43 and name HD1* ) 4.57 2.77 0.91 assign (resid 59 and name HB1 ) (resid 60 and name HB2 ) 4.53 2.73 0.91 assign (resid 4 and name HA ) (resid 9 and name HE* ) 6.19 4.39 1.24 assign (resid 3 and name HB1 ) (resid 4 and name HA ) 4.88 3.08 0.98 assign (resid 4 and name HB2 ) (resid 9 and name HE* ) 5.90 4.10 1.18 assign (resid 4 and name HB1 ) (resid 9 and name HE* ) 5.04 3.24 1.01 assign (resid 4 and name HA ) (resid 17 and name HG2* ) 5.24 3.44 1.05 assign (resid 4 and name HB2 ) (resid 17 and name HG2* ) 4.50 2.70 0.90 assign (resid 4 and name HD* ) (resid 5 and name HE* ) 5.03 3.23 1.01 assign (resid 7 and name HE2 ) (resid 54 and name HG1* ) 4.52 2.72 0.90 assign (resid 5 and name HB1 ) (resid 14 and name HB* ) 4.94 3.14 0.99 assign (resid 6 and name HB ) (resid 58 and name HD1* ) 4.82 3.02 0.96 assign (resid 7 and name HG1 ) (resid 8 and name HA ) 4.98 3.18 1.00 assign (resid 7 and name HB2 ) (resid 44 and name HG1 ) 5.25 3.45 1.05 assign (resid 7 and name HB2 ) (resid 54 and name HB ) 5.48 3.68 1.10 assign (resid 7 and name HB1 ) (resid 54 and name HB ) 5.16 3.36 1.03 assign (resid 7 and name HA ) (resid 54 and name HB ) 5.29 3.49 1.06 assign (resid 7 and name HA ) (resid 43 and name HD2* ) 4.73 2.93 0.95 assign (resid 7 and name HE2 ) (resid 58 and name HD1* ) 5.52 3.72 1.10 assign (resid 7 and name HD1 ) (resid 44 and name HG1 ) 5.30 3.50 1.06 assign (resid 7 and name HD1 ) (resid 44 and name HG2 ) 5.04 3.24 1.01 assign (resid 7 and name HD2 ) (resid 44 and name HG1 ) 5.09 3.29 1.02 assign (resid 7 and name HB1 ) (resid 7 and name HE1 ) 4.51 2.71 0.90 assign (resid 7 and name HG2 ) (resid 7 and name HE1 ) 3.50 1.70 0.70 assign (resid 7 and name HE1 ) (resid 54 and name HG1* ) 4.52 2.72 0.90 assign (resid 7 and name HE1 ) (resid 58 and name HD1* ) 5.52 3.72 1.10 assign (resid 7 and name HN ) (resid 7 and name HE1 ) 5.04 3.24 1.01 assign (resid 4 and name HE* ) (resid 5 and name HD* ) 5.10 3.30 1.02 assign (resid 9 and name HB1 ) (resid 43 and name HG ) 5.01 3.21 1.00 assign (resid 9 and name HB1 ) (resid 14 and name HB* ) 6.13 4.33 1.23 assign (resid 6 and name HA ) (resid 9 and name HB1 ) 5.38 3.58 1.08 assign (resid 9 and name HE* ) (resid 13 and name HN ) 5.37 3.57 1.07 assign (resid 9 and name HE* ) (resid 43 and name HD1* ) 4.03 2.23 0.81 assign (resid 9 and name HE* ) (resid 61 and name HD1* ) 4.67 2.87 0.93 assign (resid 10 and name HG2* ) (resid 12 and name HB* ) 4.42 2.62 0.88 assign (resid 10 and name HG2* ) (resid 41 and name HN ) 4.79 2.99 0.96 assign (resid 9 and name HN ) (resid 10 and name HG2* ) 5.95 4.15 1.19 assign (resid 10 and name HG2* ) (resid 11 and name HD* ) 6.37 4.57 1.27 assign (resid 10 and name HG2* ) (resid 12 and name HN ) 4.49 2.69 0.90 assign (resid 12 and name HA ) (resid 39 and name HE21 ) 6.50 4.70 1.30 assign (resid 11 and name HB2 ) (resid 12 and name HB* ) 4.71 2.91 0.94 assign (resid 11 and name HB2 ) (resid 12 and name HA ) 5.05 3.25 1.01 assign (resid 11 and name HB1 ) (resid 12 and name HA ) 5.11 3.31 1.02 assign (resid 12 and name HA ) (resid 39 and name HG2 ) 6.06 4.26 1.21 assign (resid 15 and name HA ) (resid 64 and name HD1* ) 5.83 4.03 1.17 assign (resid 15 and name HA ) (resid 61 and name HD2* ) 6.19 4.39 1.24 assign (resid 15 and name HD1* ) (resid 39 and name HG1 ) 5.33 3.53 1.07 assign (resid 13 and name HB1 ) (resid 14 and name HB* ) 4.70 2.90 0.94 assign (resid 9 and name HG1 ) (resid 13 and name HG1 ) 5.78 3.98 1.16 assign (resid 10 and name HG1 ) (resid 13 and name HB1 ) 5.30 3.50 1.06 assign (resid 14 and name HB* ) (resid 25 and name HN ) 6.25 4.45 1.25 assign (resid 10 and name HN ) (resid 14 and name HB* ) 4.75 2.95 0.95 assign (resid 11 and name HN ) (resid 14 and name HB* ) 5.08 3.28 1.02 assign (resid 14 and name HB* ) (resid 61 and name HD2* ) 4.17 2.37 0.83 assign (resid 14 and name HB* ) (resid 15 and name HD2* ) 4.53 2.73 0.91 assign (resid 14 and name HB* ) (resid 43 and name HG ) 3.70 1.90 0.74 assign (resid 14 and name HA ) (resid 61 and name HD1* ) 5.06 3.26 1.01 assign (resid 15 and name HB2 ) (resid 21 and name HG1* ) 4.93 3.13 0.99 assign (resid 12 and name HB* ) (resid 15 and name HB2 ) 4.69 2.89 0.94 assign (resid 15 and name HB2 ) (resid 16 and name HA ) 5.31 3.51 1.06 assign (resid 15 and name HA ) (resid 18 and name HN ) 4.81 3.01 0.96 assign (resid 15 and name HA ) (resid 16 and name HE22 ) 5.90 4.10 1.18 assign (resid 15 and name HD2* ) (resid 25 and name HN ) 4.76 2.96 0.95 assign (resid 12 and name HN ) (resid 15 and name HD1* ) 4.82 3.02 0.96 assign (resid 66 and name HD1* ) (resid 68 and name HN ) 5.26 3.46 1.05 assign (resid 63 and name HB* ) (resid 66 and name HD1* ) 3.49 1.69 0.70 assign (resid 12 and name HB* ) (resid 15 and name HD1* ) 4.08 2.28 0.82 assign (resid 15 and name HD2* ) (resid 33 and name HD1* ) 4.16 2.36 0.83 assign (resid 12 and name HB* ) (resid 15 and name HB1 ) 5.35 3.55 1.07 assign (resid 16 and name HB2 ) (resid 17 and name HB ) 5.80 4.00 1.16 assign (resid 17 and name HB ) (resid 18 and name HA ) 4.81 3.01 0.96 assign (resid 9 and name HE* ) (resid 17 and name HA ) 5.40 3.60 1.08 assign (resid 17 and name HA ) (resid 21 and name HG2* ) 5.80 4.00 1.16 assign (resid 18 and name HB2 ) (resid 61 and name HD2* ) 5.88 4.08 1.18 assign (resid 18 and name HB2 ) (resid 64 and name HB1 ) 6.06 4.26 1.21 assign (resid 18 and name HB2 ) (resid 64 and name HB2 ) 4.97 3.17 0.99 assign (resid 16 and name HB2 ) (resid 17 and name HG2* ) 5.91 4.11 1.18 assign (resid 5 and name HA ) (resid 17 and name HG2* ) 4.71 2.91 0.94 assign (resid 17 and name HG2* ) (resid 18 and name HA ) 5.46 3.66 1.09 assign (resid 18 and name HB2 ) (resid 19 and name HD1 ) 4.76 2.96 0.95 assign (resid 18 and name HD2 ) (resid 19 and name HD1 ) 5.34 3.54 1.07 assign (resid 20 and name HA2 ) (resid 21 and name HA ) 5.38 3.58 1.08 assign (resid 19 and name HA ) (resid 20 and name HA2 ) 5.31 3.51 1.06 assign (resid 19 and name HB2 ) (resid 20 and name HA2 ) 5.46 3.66 1.09 assign (resid 20 and name HA2 ) (resid 21 and name HG2* ) 5.21 3.41 1.04 assign (resid 20 and name HA2 ) (resid 24 and name HG2* ) 5.14 3.34 1.03 assign (resid 20 and name HA2 ) (resid 64 and name HD1* ) 4.18 2.38 0.84 assign (resid 20 and name HA1 ) (resid 64 and name HG ) 5.99 4.19 1.20 assign (resid 20 and name HA1 ) (resid 21 and name HB ) 5.67 3.87 1.13 assign (resid 21 and name HA ) (resid 61 and name HD1* ) 4.72 2.92 0.94 assign (resid 21 and name HG1* ) (resid 61 and name HD1* ) 3.65 1.85 0.73 assign (resid 21 and name HA ) (resid 64 and name HG ) 5.15 3.35 1.03 assign (resid 21 and name HG2* ) (resid 64 and name HG ) 4.63 2.83 0.93 assign (resid 15 and name HB2 ) (resid 21 and name HB ) 5.45 3.65 1.09 assign (resid 21 and name HG2* ) (resid 61 and name HA ) 4.78 2.98 0.96 assign (resid 21 and name HA ) (resid 61 and name HA ) 5.18 3.38 1.04 assign (resid 21 and name HA ) (resid 24 and name HA ) 5.32 3.52 1.06 assign (resid 14 and name HA ) (resid 21 and name HG1* ) 4.52 2.72 0.90 assign (resid 14 and name HA ) (resid 21 and name HG2* ) 4.30 2.50 0.86 assign (resid 18 and name HN ) (resid 21 and name HA ) 5.65 3.85 1.13 assign (resid 5 and name HD* ) (resid 21 and name HG1* ) 4.75 2.95 0.95 assign (resid 18 and name HN ) (resid 21 and name HG1* ) 5.17 3.37 1.03 assign (resid 21 and name HG2* ) (resid 24 and name HN ) 5.29 3.49 1.06 assign (resid 21 and name HG1* ) (resid 24 and name HN ) 4.61 2.81 0.92 assign (resid 15 and name HN ) (resid 21 and name HG2* ) 4.98 3.18 1.00 assign (resid 21 and name HN ) (resid 22 and name HA ) 5.42 3.62 1.08 assign (resid 22 and name HB* ) (resid 25 and name HN ) 5.23 3.43 1.05 assign (resid 23 and name HA2 ) (resid 26 and name HE ) 5.22 3.42 1.04 assign (resid 22 and name HB* ) (resid 26 and name HD2 ) 5.64 3.84 1.13 assign (resid 22 and name HB* ) (resid 23 and name HA2 ) 4.41 2.61 0.88 assign (resid 21 and name HB ) (resid 22 and name HA ) 5.13 3.33 1.03 assign (resid 21 and name HB ) (resid 22 and name HB* ) 4.34 2.54 0.87 assign (resid 22 and name HB* ) (resid 26 and name HG1 ) 4.53 2.73 0.91 assign (resid 23 and name HA2 ) (resid 26 and name HG2 ) 5.51 3.71 1.10 assign (resid 22 and name HB* ) (resid 33 and name HD1* ) 5.54 3.74 1.11 assign (resid 24 and name HB ) (resid 25 and name HG ) 4.67 2.87 0.93 assign (resid 24 and name HG2* ) (resid 61 and name HG ) 4.12 2.32 0.82 assign (resid 24 and name HG2* ) (resid 63 and name HB* ) 4.64 2.84 0.93 assign (resid 21 and name HG2* ) (resid 24 and name HG2* ) 3.91 2.11 0.78 assign (resid 24 and name HA ) (resid 61 and name HG ) 5.83 4.03 1.17 assign (resid 20 and name HA1 ) (resid 24 and name HG2* ) 3.90 2.10 0.78 assign (resid 24 and name HA ) (resid 28 and name HE* ) 5.48 3.68 1.10 assign (resid 36 and name HG1 ) (resid 38 and name HN ) 4.93 3.13 0.99 assign (resid 24 and name HG2* ) (resid 61 and name HN ) 4.65 2.85 0.93 assign (resid 24 and name HG1* ) (resid 27 and name HN ) 4.91 3.11 0.98 assign (resid 25 and name HA ) (resid 29 and name HN ) 6.50 4.70 1.30 assign (resid 25 and name HA ) (resid 31 and name HN ) 6.50 4.70 1.30 assign (resid 11 and name HE* ) (resid 25 and name HB1 ) 5.17 3.37 1.03 assign (resid 24 and name HA ) (resid 25 and name HA ) 4.96 3.16 0.99 assign (resid 21 and name HA ) (resid 24 and name HG1* ) 4.43 2.63 0.89 assign (resid 24 and name HG1* ) (resid 25 and name HB2 ) 5.25 3.45 1.05 assign (resid 24 and name HG1* ) (resid 61 and name HB2 ) 4.29 2.49 0.86 assign (resid 24 and name HG1* ) (resid 25 and name HB1 ) 5.09 3.29 1.02 assign (resid 25 and name HG ) (resid 43 and name HD2* ) 5.59 3.79 1.12 assign (resid 24 and name HB ) (resid 25 and name HD1* ) 4.58 2.78 0.92 assign (resid 14 and name HB* ) (resid 25 and name HG ) 5.29 3.49 1.06 assign (resid 25 and name HG ) (resid 61 and name HG ) 5.79 3.99 1.16 assign (resid 25 and name HB1 ) (resid 26 and name HA ) 4.65 2.85 0.93 assign (resid 25 and name HD2* ) (resid 26 and name HA ) 6.50 4.70 1.30 assign (resid 26 and name HA ) (resid 33 and name HG2* ) 6.50 4.70 1.30 assign (resid 25 and name HN ) (resid 26 and name HA ) 5.54 3.74 1.11 assign (resid 26 and name HB2 ) (resid 30 and name HN ) 5.59 3.79 1.12 assign (resid 22 and name HB* ) (resid 26 and name HD1 ) 4.44 2.64 0.89 assign (resid 22 and name HB* ) (resid 26 and name HB2 ) 4.88 3.08 0.98 assign (resid 26 and name HB2 ) (resid 27 and name HA ) 6.05 4.25 1.21 assign (resid 26 and name HB1 ) (resid 27 and name HA ) 6.41 4.61 1.28 assign (resid 59 and name HD* ) (resid 60 and name HA ) 5.59 3.79 1.12 assign (resid 26 and name HN ) (resid 26 and name HD2 ) 4.61 2.81 0.92 assign (resid 28 and name HB1 ) (resid 30 and name HN ) 4.88 3.08 0.98 assign (resid 25 and name HA ) (resid 28 and name HA ) 5.78 3.98 1.16 assign (resid 28 and name HA ) (resid 29 and name HB1 ) 5.00 3.20 1.00 assign (resid 28 and name HB2 ) (resid 57 and name HG12 ) 5.18 3.38 1.04 assign (resid 29 and name HB2 ) (resid 30 and name HD2* ) 5.10 3.30 1.02 assign (resid 29 and name HB1 ) (resid 30 and name HD2* ) 5.22 3.42 1.04 assign (resid 11 and name HZ ) (resid 30 and name HG ) 5.41 3.61 1.08 assign (resid 29 and name HA ) (resid 30 and name HA ) 5.13 3.33 1.03 assign (resid 28 and name HB1 ) (resid 30 and name HB2 ) 5.29 3.49 1.06 assign (resid 30 and name HG ) (resid 52 and name HD1* ) 4.33 2.53 0.87 assign (resid 30 and name HB1 ) (resid 52 and name HD1* ) 5.12 3.32 1.02 assign (resid 25 and name HB2 ) (resid 30 and name HD1* ) 4.34 2.54 0.87 assign (resid 30 and name HD1* ) (resid 47 and name HN ) 4.58 2.78 0.92 assign (resid 30 and name HD1* ) (resid 54 and name HN ) 6.50 4.70 1.30 assign (resid 54 and name HN ) (resid 58 and name HD1* ) 6.50 4.70 1.30 assign (resid 31 and name HA1 ) (resid 33 and name HN ) 5.23 3.43 1.05 assign (resid 31 and name HA2 ) (resid 33 and name HN ) 5.14 3.34 1.03 assign (resid 26 and name HA ) (resid 31 and name HA2 ) 4.36 2.56 0.87 assign (resid 30 and name HA ) (resid 31 and name HA2 ) 4.84 3.04 0.97 assign (resid 26 and name HA ) (resid 31 and name HA1 ) 4.56 2.76 0.91 assign (resid 30 and name HA ) (resid 31 and name HA1 ) 5.30 3.50 1.06 assign (resid 31 and name HA2 ) (resid 32 and name HA ) 5.16 3.36 1.03 assign (resid 30 and name HB1 ) (resid 31 and name HA2 ) 5.05 3.25 1.01 assign (resid 30 and name HB2 ) (resid 31 and name HA1 ) 5.51 3.71 1.10 assign (resid 32 and name HB* ) (resid 38 and name HB* ) 6.38 4.58 1.28 assign (resid 32 and name HB* ) (resid 33 and name HG2* ) 5.79 3.99 1.16 assign (resid 32 and name HA ) (resid 33 and name HG12 ) 6.36 4.56 1.27 assign (resid 32 and name HA ) (resid 33 and name HG2* ) 5.23 3.43 1.05 assign (resid 11 and name HB1 ) (resid 33 and name HG2* ) 4.46 2.66 0.89 assign (resid 32 and name HB* ) (resid 33 and name HA ) 5.52 3.72 1.10 assign (resid 33 and name HG2* ) (resid 36 and name HE* ) 4.80 3.00 0.96 assign (resid 33 and name HG2* ) (resid 41 and name HB* ) 4.65 2.85 0.93 assign (resid 15 and name HD1* ) (resid 33 and name HG2* ) 4.44 2.64 0.89 assign (resid 30 and name HB2 ) (resid 33 and name HG2* ) 4.76 2.96 0.95 assign (resid 11 and name HD* ) (resid 33 and name HD1* ) 4.86 3.06 0.97 assign (resid 11 and name HE* ) (resid 33 and name HD1* ) 5.11 3.31 1.02 assign (resid 11 and name HZ ) (resid 33 and name HD1* ) 5.05 3.25 1.01 assign (resid 20 and name HA1 ) (resid 64 and name HB1 ) 5.28 3.48 1.06 assign (resid 35 and name HB* ) (resid 36 and name HB2 ) 5.40 3.60 1.08 assign (resid 32 and name HB* ) (resid 35 and name HB* ) 5.15 3.35 1.03 assign (resid 33 and name HA ) (resid 35 and name HB* ) 5.85 4.05 1.17 assign (resid 34 and name HA1 ) (resid 35 and name HB* ) 6.09 4.29 1.22 assign (resid 34 and name HA2 ) (resid 35 and name HB* ) 5.33 3.53 1.07 assign (resid 34 and name HA1 ) (resid 35 and name HA ) 4.91 3.11 0.98 assign (resid 35 and name HB* ) (resid 37 and name HN ) 4.77 2.97 0.95 assign (resid 35 and name HN ) (resid 36 and name HB1 ) 5.18 3.38 1.04 assign (resid 35 and name HN ) (resid 36 and name HA ) 4.74 2.94 0.95 assign (resid 35 and name HA ) (resid 36 and name HA ) 4.80 3.00 0.96 assign (resid 35 and name HA ) (resid 36 and name HB1 ) 5.79 3.99 1.16 assign (resid 36 and name HA ) (resid 37 and name HA1 ) 5.07 3.27 1.01 assign (resid 33 and name HA ) (resid 36 and name HB1 ) 5.10 3.30 1.02 assign (resid 33 and name HA ) (resid 36 and name HG1 ) 5.11 3.31 1.02 assign (resid 36 and name HG2 ) (resid 38 and name HB* ) 5.21 3.41 1.04 assign (resid 37 and name HA1 ) (resid 38 and name HB* ) 4.95 3.15 0.99 assign (resid 36 and name HE* ) (resid 37 and name HA2 ) 5.98 4.18 1.20 assign (resid 37 and name HA2 ) (resid 39 and name HB2 ) 6.19 4.39 1.24 assign (resid 37 and name HA2 ) (resid 38 and name HB* ) 4.68 2.88 0.94 assign (resid 33 and name HG2* ) (resid 38 and name HB* ) 3.74 1.94 0.75 assign (resid 65 and name HA ) (resid 66 and name HD2* ) 6.03 4.23 1.21 assign (resid 33 and name HG2* ) (resid 38 and name HA ) 6.07 4.27 1.21 assign (resid 38 and name HB* ) (resid 41 and name HB* ) 4.21 2.41 0.84 assign (resid 11 and name HB2 ) (resid 38 and name HB* ) 4.68 2.88 0.94 assign (resid 11 and name HB2 ) (resid 38 and name HA ) 5.62 3.82 1.12 assign (resid 33 and name HA ) (resid 38 and name HB* ) 3.84 2.04 0.77 assign (resid 38 and name HB* ) (resid 46 and name HA1 ) 4.51 2.71 0.90 assign (resid 33 and name HA ) (resid 38 and name HA ) 5.20 3.40 1.04 assign (resid 38 and name HB* ) (resid 46 and name HA2 ) 5.41 3.61 1.08 assign (resid 11 and name HD* ) (resid 38 and name HB* ) 4.82 3.02 0.96 assign (resid 38 and name HB* ) (resid 40 and name HN ) 4.65 2.85 0.93 assign (resid 11 and name HD* ) (resid 39 and name HA ) 4.78 2.98 0.96 assign (resid 11 and name HA ) (resid 39 and name HA ) 5.11 3.31 1.02 assign (resid 33 and name HG2* ) (resid 39 and name HG2 ) 5.75 3.95 1.15 assign (resid 40 and name HA ) (resid 40 and name HD21 ) 4.00 2.20 0.80 assign (resid 10 and name HB ) (resid 40 and name HB1 ) 5.29 3.49 1.06 assign (resid 39 and name HB1 ) (resid 40 and name HA ) 4.72 2.92 0.94 assign (resid 39 and name HB2 ) (resid 40 and name HA ) 4.56 2.76 0.91 assign (resid 40 and name HB1 ) (resid 41 and name HB* ) 5.50 3.70 1.10 assign (resid 11 and name HN ) (resid 41 and name HA ) 5.51 3.71 1.10 assign (resid 40 and name HN ) (resid 41 and name HA ) 5.07 3.27 1.01 assign (resid 41 and name HB* ) (resid 45 and name HN ) 6.03 4.23 1.21 assign (resid 11 and name HD* ) (resid 41 and name HA ) 4.69 2.89 0.94 assign (resid 40 and name HA ) (resid 41 and name HA ) 4.81 3.01 0.96 assign (resid 40 and name HB1 ) (resid 41 and name HA ) 4.75 2.95 0.95 assign (resid 41 and name HG1 ) (resid 45 and name HB1 ) 4.44 2.64 0.89 assign (resid 11 and name HD* ) (resid 43 and name HA ) 4.60 2.80 0.92 assign (resid 11 and name HE* ) (resid 43 and name HA ) 3.62 1.82 0.72 assign (resid 11 and name HZ ) (resid 43 and name HA ) 3.98 2.18 0.80 assign (resid 11 and name HD* ) (resid 43 and name HG ) 5.76 3.96 1.15 assign (resid 11 and name HZ ) (resid 43 and name HG ) 6.39 4.59 1.28 assign (resid 43 and name HB2 ) (resid 44 and name HB2 ) 4.81 3.01 0.96 assign (resid 43 and name HB2 ) (resid 44 and name HB1 ) 5.16 3.36 1.03 assign (resid 44 and name HA ) (resid 45 and name HG1 ) 6.06 4.26 1.21 assign (resid 5 and name HA ) (resid 43 and name HD1* ) 5.27 3.47 1.05 assign (resid 10 and name HB ) (resid 43 and name HD2* ) 5.99 4.19 1.20 assign (resid 13 and name HN ) (resid 43 and name HD2* ) 6.39 4.59 1.28 assign (resid 43 and name HD2* ) (resid 46 and name HN ) 6.40 4.60 1.28 assign (resid 3 and name HB2 ) (resid 4 and name HA ) 5.45 3.65 1.09 assign (resid 7 and name HD1 ) (resid 44 and name HB2 ) 4.63 2.83 0.93 assign (resid 44 and name HG1 ) (resid 45 and name HG2 ) 5.76 3.96 1.15 assign (resid 44 and name HG1 ) (resid 45 and name HA ) 5.08 3.28 1.02 assign (resid 44 and name HG2 ) (resid 46 and name HN ) 6.11 4.31 1.22 assign (resid 44 and name HG2 ) (resid 47 and name HN ) 6.50 4.70 1.30 assign (resid 44 and name HN ) (resid 45 and name HB2 ) 4.93 3.13 0.99 assign (resid 41 and name HA ) (resid 45 and name HB2 ) 5.05 3.25 1.01 assign (resid 44 and name HB1 ) (resid 45 and name HA ) 4.52 2.72 0.90 assign (resid 44 and name HB2 ) (resid 45 and name HA ) 5.89 4.09 1.18 assign (resid 43 and name HB1 ) (resid 46 and name HA1 ) 6.00 4.20 1.20 assign (resid 16 and name HG* ) (resid 21 and name HG1* ) 6.40 4.60 1.28 assign (resid 15 and name HB2 ) (resid 16 and name HG* ) 4.49 2.69 0.90 assign (resid 45 and name HB1 ) (resid 46 and name HA1 ) 5.13 3.33 1.03 assign (resid 41 and name HB* ) (resid 46 and name HA1 ) 5.22 3.42 1.04 assign (resid 45 and name HB2 ) (resid 46 and name HA1 ) 5.20 3.40 1.04 assign (resid 41 and name HG1 ) (resid 46 and name HA1 ) 5.36 3.56 1.07 assign (resid 41 and name HG2 ) (resid 46 and name HA1 ) 5.36 3.56 1.07 assign (resid 41 and name HA ) (resid 45 and name HG1 ) 5.17 3.37 1.03 assign (resid 46 and name HA2 ) (resid 50 and name HD2 ) 4.83 3.03 0.97 assign (resid 11 and name HD* ) (resid 46 and name HA1 ) 4.69 2.89 0.94 assign (resid 46 and name HA1 ) (resid 50 and name HD2 ) 5.31 3.51 1.06 assign (resid 46 and name HA2 ) (resid 47 and name HA ) 5.02 3.22 1.00 assign (resid 47 and name HB* ) (resid 54 and name HG1* ) 3.63 1.83 0.73 assign (resid 47 and name HB* ) (resid 52 and name HB2 ) 3.19 1.39 0.64 assign (resid 7 and name HB2 ) (resid 47 and name HB* ) 5.50 3.70 1.10 assign (resid 44 and name HG2 ) (resid 47 and name HB* ) 5.18 3.38 1.04 assign (resid 47 and name HB* ) (resid 48 and name HB2 ) 4.71 2.91 0.94 assign (resid 48 and name HB2 ) (resid 49 and name HA ) 4.77 2.97 0.95 assign (resid 47 and name HB* ) (resid 53 and name HA ) 4.18 2.38 0.84 assign (resid 11 and name HE* ) (resid 47 and name HB* ) 5.88 4.08 1.18 assign (resid 28 and name HD* ) (resid 47 and name HB* ) 6.42 4.62 1.28 assign (resid 48 and name HB2 ) (resid 50 and name HN ) 5.49 3.69 1.10 assign (resid 44 and name HN ) (resid 47 and name HB* ) 4.91 3.11 0.98 assign (resid 48 and name HN ) (resid 49 and name HA ) 5.47 3.67 1.09 assign (resid 46 and name HN ) (resid 49 and name HB* ) 4.88 3.08 0.98 assign (resid 48 and name HB2 ) (resid 49 and name HB* ) 4.38 2.58 0.88 assign (resid 30 and name HD2* ) (resid 49 and name HB* ) 4.92 3.12 0.98 assign (resid 50 and name HB1 ) (resid 52 and name HB1 ) 5.45 3.65 1.09 assign (resid 46 and name HA2 ) (resid 50 and name HB2 ) 5.27 3.47 1.05 assign (resid 50 and name HB2 ) (resid 51 and name HA* ) 5.12 3.32 1.02 assign (resid 48 and name HB1 ) (resid 51 and name HA* ) 5.83 4.03 1.17 assign (resid 30 and name HD2* ) (resid 52 and name HD2* ) 4.66 2.86 0.93 assign (resid 52 and name HD2* ) (resid 57 and name HD1* ) 5.18 3.38 1.04 assign (resid 52 and name HD1* ) (resid 53 and name HA ) 6.05 4.25 1.21 assign (resid 29 and name HD21 ) (resid 52 and name HD1* ) 5.55 3.75 1.11 assign (resid 44 and name HB1 ) (resid 54 and name HG2* ) 4.39 2.59 0.88 assign (resid 7 and name HB1 ) (resid 54 and name HG2* ) 3.30 1.50 0.66 assign (resid 54 and name HG2* ) (resid 55 and name HA ) 4.60 2.80 0.92 assign (resid 54 and name HG1* ) (resid 57 and name HN ) 5.16 3.36 1.03 assign (resid 54 and name HG1* ) (resid 58 and name HN ) 4.88 3.08 0.98 assign (resid 54 and name HN ) (resid 55 and name HA ) 5.33 3.53 1.07 assign (resid 54 and name HN ) (resid 55 and name HB2 ) 5.01 3.21 1.00 assign (resid 54 and name HN ) (resid 55 and name HB1 ) 6.50 4.70 1.30 assign (resid 7 and name HB2 ) (resid 44 and name HG2 ) 5.62 3.82 1.12 assign (resid 56 and name HA ) (resid 59 and name HD* ) 4.23 2.43 0.85 assign (resid 53 and name HB1 ) (resid 56 and name HB2 ) 4.40 2.60 0.88 assign (resid 53 and name HB1 ) (resid 56 and name HA ) 5.51 3.71 1.10 assign (resid 53 and name HB1 ) (resid 56 and name HB1 ) 4.40 2.60 0.88 assign (resid 56 and name HA ) (resid 58 and name HN ) 4.89 3.09 0.98 assign (resid 55 and name HN ) (resid 56 and name HB1 ) 5.41 3.61 1.08 assign (resid 55 and name HN ) (resid 56 and name HB2 ) 5.41 3.61 1.08 assign (resid 56 and name HN ) (resid 57 and name HA ) 5.52 3.72 1.10 assign (resid 54 and name HA ) (resid 57 and name HG2* ) 4.28 2.48 0.86 assign (resid 28 and name HB1 ) (resid 57 and name HG12 ) 5.30 3.50 1.06 assign (resid 25 and name HG ) (resid 57 and name HG2* ) 4.99 3.19 1.00 assign (resid 57 and name HB ) (resid 58 and name HB2 ) 4.95 3.15 0.99 assign (resid 57 and name HG2* ) (resid 61 and name HB2 ) 4.66 2.86 0.93 assign (resid 47 and name HB* ) (resid 57 and name HG2* ) 4.85 3.05 0.97 assign (resid 30 and name HD1* ) (resid 57 and name HG12 ) 4.59 2.79 0.92 assign (resid 43 and name HD2* ) (resid 57 and name HG2* ) 3.68 1.88 0.74 assign (resid 24 and name HG1* ) (resid 57 and name HD1* ) 5.18 3.38 1.04 assign (resid 54 and name HG1* ) (resid 57 and name HD1* ) 5.50 3.70 1.10 assign (resid 52 and name HB2 ) (resid 57 and name HD1* ) 3.78 1.98 0.76 assign (resid 52 and name HG ) (resid 57 and name HD1* ) 5.06 3.26 1.01 assign (resid 54 and name HB ) (resid 57 and name HD1* ) 4.65 2.85 0.93 assign (resid 55 and name HB1 ) (resid 58 and name HB2 ) 4.72 2.92 0.94 assign (resid 50 and name HB2 ) (resid 57 and name HD1* ) 5.52 3.72 1.10 assign (resid 5 and name HB2 ) (resid 58 and name HA ) 5.09 3.29 1.02 assign (resid 11 and name HA ) (resid 43 and name HA ) 4.93 3.13 0.99 assign (resid 28 and name HE* ) (resid 57 and name HD1* ) 5.09 3.29 1.02 assign (resid 11 and name HZ ) (resid 57 and name HD1* ) 5.41 3.61 1.08 assign (resid 58 and name HB2 ) (resid 62 and name HN ) 5.65 3.85 1.13 assign (resid 58 and name HD1* ) (resid 62 and name HN ) 6.41 4.61 1.28 assign (resid 30 and name HD1* ) (resid 48 and name HN ) 6.50 4.70 1.30 assign (resid 58 and name HD2* ) (resid 61 and name HN ) 5.02 3.22 1.00 assign (resid 8 and name HN ) (resid 58 and name HD2* ) 5.12 3.32 1.02 assign (resid 3 and name HE21 ) (resid 58 and name HD1* ) 4.65 2.85 0.93 assign (resid 58 and name HD1* ) (resid 62 and name HD22 ) 4.68 2.88 0.94 assign (resid 54 and name HB ) (resid 58 and name HD1* ) 4.75 2.95 0.95 assign (resid 55 and name HB1 ) (resid 58 and name HD1* ) 4.81 3.01 0.96 assign (resid 25 and name HG ) (resid 30 and name HD1* ) 4.37 2.57 0.87 assign (resid 7 and name HG1 ) (resid 58 and name HD1* ) 4.29 2.49 0.86 assign (resid 30 and name HD1* ) (resid 43 and name HD2* ) 5.32 3.52 1.06 assign (resid 58 and name HB1 ) (resid 59 and name HA ) 4.93 3.13 0.99 assign (resid 58 and name HD1* ) (resid 59 and name HA ) 5.75 3.95 1.15 assign (resid 56 and name HA ) (resid 59 and name HA ) 5.81 4.01 1.16 assign (resid 42 and name HB1 ) (resid 44 and name HB1 ) 5.44 3.64 1.09 assign (resid 3 and name HB1 ) (resid 6 and name HB ) 6.06 4.26 1.21 assign (resid 59 and name HB1 ) (resid 60 and name HA ) 6.29 4.49 1.26 assign (resid 58 and name HN ) (resid 59 and name HA ) 5.37 3.57 1.07 assign (resid 60 and name HA ) (resid 62 and name HN ) 4.84 3.04 0.97 assign (resid 61 and name HB2 ) (resid 63 and name HN ) 5.21 3.41 1.04 assign (resid 60 and name HB1 ) (resid 63 and name HN ) 5.35 3.55 1.07 assign (resid 60 and name HA ) (resid 61 and name HA ) 5.27 3.47 1.05 assign (resid 61 and name HA ) (resid 62 and name HA ) 5.03 3.23 1.01 assign (resid 59 and name HN ) (resid 60 and name HB1 ) 6.04 4.24 1.21 assign (resid 24 and name HG1* ) (resid 61 and name HD1* ) 4.82 3.02 0.96 assign (resid 21 and name HG2* ) (resid 61 and name HD1* ) 4.83 3.03 0.97 assign (resid 5 and name HZ ) (resid 61 and name HD2* ) 5.15 3.35 1.03 assign (resid 5 and name HZ ) (resid 61 and name HD1* ) 5.69 3.89 1.14 assign (resid 58 and name HN ) (resid 61 and name HD1* ) 4.78 2.98 0.96 assign (resid 23 and name HN ) (resid 61 and name HD2* ) 6.13 4.33 1.23 assign (resid 26 and name HN ) (resid 61 and name HD2* ) 6.50 4.70 1.30 assign (resid 14 and name HN ) (resid 61 and name HD1* ) 5.70 3.90 1.14 assign (resid 61 and name HN ) (resid 63 and name HB* ) 4.65 2.85 0.93 assign (resid 63 and name HB* ) (resid 64 and name HA ) 3.87 2.07 0.77 assign (resid 63 and name HA ) (resid 64 and name HA ) 5.04 3.24 1.01 assign (resid 63 and name HB* ) (resid 64 and name HG ) 3.72 1.92 0.74 assign (resid 61 and name HD2* ) (resid 63 and name HB* ) 6.16 4.36 1.23 assign (resid 63 and name HB* ) (resid 64 and name HB1 ) 6.50 4.70 1.30 assign (resid 63 and name HA ) (resid 64 and name HD2* ) 5.75 3.95 1.15 assign (resid 62 and name HB2 ) (resid 63 and name HA ) 4.84 3.04 0.97 assign (resid 49 and name HB* ) (resid 50 and name HB2 ) 4.72 2.92 0.94 assign (resid 62 and name HB2 ) (resid 63 and name HB* ) 5.13 3.33 1.03 assign (resid 61 and name HB1 ) (resid 64 and name HD1* ) 5.07 3.27 1.01 assign (resid 21 and name HG1* ) (resid 64 and name HD1* ) 3.90 2.10 0.78 assign (resid 63 and name HB* ) (resid 64 and name HD1* ) 5.28 3.48 1.06 assign (resid 63 and name HB* ) (resid 64 and name HD2* ) 3.85 2.05 0.77 assign (resid 61 and name HB2 ) (resid 64 and name HD1* ) 4.58 2.78 0.92 assign (resid 24 and name HB ) (resid 64 and name HD2* ) 4.51 2.71 0.90 assign (resid 20 and name HA1 ) (resid 64 and name HD1* ) 3.76 1.96 0.75 assign (resid 20 and name HA2 ) (resid 64 and name HD2* ) 3.68 1.88 0.74 assign (resid 5 and name HZ ) (resid 64 and name HD1* ) 4.54 2.74 0.91 assign (resid 64 and name HB2 ) (resid 65 and name HA ) 5.34 3.54 1.07 assign (resid 22 and name HN ) (resid 64 and name HD1* ) 5.05 3.25 1.01 assign (resid 61 and name HN ) (resid 64 and name HD2* ) 5.47 3.67 1.09 assign (resid 11 and name HD* ) (resid 38 and name HA ) 4.78 2.98 0.96 assign (resid 66 and name HD2* ) (resid 68 and name HN ) 5.43 3.63 1.09 assign (resid 63 and name HA ) (resid 66 and name HG ) 3.76 1.96 0.75 assign (resid 63 and name HA ) (resid 66 and name HD1* ) 3.43 1.63 0.69 assign (resid 28 and name HA ) (resid 30 and name HD1* ) 6.35 4.55 1.27 assign (resid 2 and name HG2* ) (resid 3 and name HA ) 4.65 2.85 0.93 assign (resid 11 and name HA ) (resid 25 and name HD2* ) 6.50 4.70 1.30 assign (resid 11 and name HA ) (resid 33 and name HG2* ) 6.50 4.70 1.30 assign (resid 11 and name HA ) (resid 25 and name HD1* ) 4.45 2.65 0.89 assign (resid 11 and name HB2 ) (resid 43 and name HD2* ) 5.02 3.22 1.00 assign (resid 11 and name HB1 ) (resid 33 and name HD1* ) 5.29 3.49 1.06 assign (resid 11 and name HB2 ) (resid 33 and name HD1* ) 6.11 4.31 1.22 assign (resid 15 and name HG ) (resid 33 and name HD1* ) 5.05 3.25 1.01 assign (resid 25 and name HB1 ) (resid 33 and name HD1* ) 4.97 3.17 0.99 assign (resid 25 and name HB2 ) (resid 33 and name HD1* ) 5.45 3.65 1.09 assign (resid 33 and name HD1* ) (resid 39 and name HE21 ) 6.33 4.53 1.27 assign (resid 31 and name HA2 ) (resid 33 and name HG12 ) 6.50 4.70 1.30 assign (resid 12 and name HA ) (resid 39 and name HB2 ) 5.54 3.74 1.11 assign (resid 33 and name HB ) (resid 39 and name HG2 ) 6.50 4.70 1.30 assign (resid 25 and name HB1 ) (resid 33 and name HG2* ) 5.39 3.59 1.08 assign (resid 25 and name HB2 ) (resid 33 and name HG2* ) 5.28 3.48 1.06 assign (resid 11 and name HZ ) (resid 33 and name HG2* ) 4.78 2.98 0.96 assign (resid 11 and name HB1 ) (resid 33 and name HB ) 5.79 3.99 1.16 assign (resid 32 and name HA ) (resid 35 and name HN ) 3.98 2.18 0.80 assign (resid 32 and name HB* ) (resid 34 and name HN ) 6.50 4.70 1.30 assign (resid 32 and name HB* ) (resid 36 and name HN ) 6.50 4.70 1.30 assign (resid 35 and name HB* ) (resid 36 and name HG2 ) 5.69 3.89 1.14 assign (resid 35 and name HB* ) (resid 36 and name HG1 ) 5.93 4.13 1.19 assign (resid 7 and name HA ) (resid 43 and name HG ) 5.21 3.41 1.04 assign (resid 11 and name HD* ) (resid 15 and name HD1* ) 4.14 2.34 0.83 assign (resid 15 and name HB2 ) (resid 16 and name HE22 ) 6.50 4.70 1.30 assign (resid 15 and name HB2 ) (resid 39 and name HE21 ) 6.50 4.70 1.30 assign (resid 18 and name HB2 ) (resid 20 and name HN ) 5.69 3.89 1.14 assign (resid 11 and name HB1 ) (resid 25 and name HD1* ) 5.09 3.29 1.02 assign (resid 25 and name HD1* ) (resid 33 and name HG11 ) 4.78 2.98 0.96 assign (resid 24 and name HG2* ) (resid 64 and name HG ) 3.54 1.74 0.71 assign (resid 24 and name HG1* ) (resid 64 and name HG ) 4.56 2.76 0.91 assign (resid 5 and name HE* ) (resid 65 and name HB* ) 3.49 1.69 0.70 assign (resid 63 and name HA ) (resid 66 and name HB1 ) 4.86 3.06 0.97 assign (resid 25 and name HD2* ) (resid 30 and name HB2 ) 3.71 1.91 0.74 assign (resid 51 and name HN ) (resid 52 and name HD1* ) 5.20 3.40 1.04 assign (resid 51 and name HN ) (resid 52 and name HD2* ) 5.39 3.59 1.08 assign (resid 31 and name HA2 ) (resid 35 and name HN ) 6.43 4.63 1.29 assign (resid 8 and name HA ) (resid 9 and name HB1 ) 6.50 4.70 1.30 assign (resid 11 and name HD* ) (resid 15 and name HD2* ) 5.42 3.62 1.08 assign (resid 62 and name HA ) (resid 65 and name HB* ) 4.23 2.43 0.85 assign (resid 18 and name HA ) (resid 18 and name HD2 ) 5.07 3.27 1.01 assign (resid 5 and name HD* ) (resid 62 and name HA ) 3.69 1.89 0.74 assign (resid 4 and name HB2 ) (resid 5 and name HD* ) 4.15 2.35 0.83 assign (resid 5 and name HD* ) (resid 21 and name HG2* ) 5.23 3.43 1.05 assign (resid 5 and name HA ) (resid 5 and name HE* ) 5.10 3.30 1.02 assign (resid 5 and name HZ ) (resid 64 and name HB2 ) 5.44 3.64 1.09 assign (resid 5 and name HZ ) (resid 64 and name HB1 ) 5.33 3.53 1.07 assign (resid 11 and name HZ ) (resid 30 and name HB1 ) 4.75 2.95 0.95 assign (resid 11 and name HE* ) (resid 41 and name HG1 ) 4.87 3.07 0.97 assign (resid 11 and name HZ ) (resid 43 and name HD2* ) 5.01 3.21 1.00 assign (resid 28 and name HA ) (resid 28 and name HE* ) 5.23 3.43 1.05 assign (resid 28 and name HE* ) (resid 60 and name HB2 ) 4.17 2.37 0.83 assign (resid 28 and name HD* ) (resid 57 and name HB ) 5.72 3.92 1.14 assign (resid 25 and name HD2* ) (resid 28 and name HD* ) 4.97 3.17 0.99 assign (resid 28 and name HE* ) (resid 57 and name HG12 ) 4.73 2.93 0.95 assign (resid 18 and name HD2 ) (resid 65 and name HA ) 4.84 3.04 0.97 assign (resid 18 and name HD2 ) (resid 65 and name HB* ) 5.29 3.49 1.06 assign (resid 18 and name HD2 ) (resid 64 and name HB1 ) 5.42 3.62 1.08 assign (resid 5 and name HE* ) (resid 62 and name HA ) 5.04 3.24 1.01 assign (resid 5 and name HE* ) (resid 64 and name HD1* ) 4.85 3.05 0.97 assign (resid 5 and name HE* ) (resid 64 and name HB1 ) 5.28 3.48 1.06 assign (resid 50 and name HD2 ) (resid 52 and name HD1* ) 5.24 3.44 1.05 assign (resid 5 and name HZ ) (resid 18 and name HD2 ) 5.58 3.78 1.12 assign (resid 5 and name HE* ) (resid 24 and name HG1* ) 6.06 4.26 1.21 assign (resid 5 and name HD* ) (resid 62 and name HD22 ) 3.98 2.18 0.80 assign (resid 11 and name HE* ) (resid 57 and name HG2* ) 6.01 4.21 1.20 assign (resid 11 and name HE* ) (resid 57 and name HD1* ) 6.33 4.53 1.27 assign (resid 3 and name HA ) (resid 4 and name HG* ) 5.91 4.11 1.18 assign (resid 3 and name HB1 ) (resid 4 and name HG* ) 6.27 4.47 1.25 assign (resid 4 and name HN ) (resid 4 and name HG* ) 3.08 1.28 0.62 assign (resid 4 and name HA ) (resid 4 and name HG* ) 3.19 1.39 0.64 assign (resid 4 and name HG* ) (resid 4 and name HE* ) 3.22 1.42 0.64 assign (resid 4 and name HG* ) (resid 5 and name HN ) 4.56 2.76 0.91 assign (resid 4 and name HG* ) (resid 5 and name HE* ) 5.58 3.78 1.12 assign (resid 4 and name HG* ) (resid 17 and name HG2* ) 4.58 2.78 0.92 assign (resid 7 and name HA ) (resid 7 and name HE* ) 4.95 3.15 0.99 assign (resid 7 and name HA ) (resid 42 and name HB* ) 5.49 3.69 1.10 assign (resid 7 and name HB2 ) (resid 7 and name HE* ) 5.03 3.23 1.01 assign (resid 7 and name HG1 ) (resid 7 and name HE* ) 3.54 1.74 0.71 assign (resid 7 and name HE* ) (resid 8 and name HN ) 5.86 4.06 1.17 assign (resid 7 and name HE* ) (resid 54 and name HG1* ) 3.90 2.10 0.78 assign (resid 7 and name HE* ) (resid 54 and name HG2* ) 4.48 2.68 0.90 assign (resid 7 and name HE* ) (resid 55 and name HN ) 6.21 4.41 1.24 assign (resid 7 and name HE* ) (resid 58 and name HD1* ) 4.65 2.85 0.93 assign (resid 8 and name HA ) (resid 42 and name HB* ) 3.30 1.50 0.66 assign (resid 8 and name HB1 ) (resid 42 and name HB* ) 6.19 4.39 1.24 assign (resid 9 and name HG1 ) (resid 42 and name HB* ) 6.27 4.47 1.25 assign (resid 10 and name HA ) (resid 42 and name HB* ) 4.04 2.24 0.81 assign (resid 10 and name HG2* ) (resid 42 and name HB* ) 4.07 2.27 0.81 assign (resid 11 and name HZ ) (resid 41 and name HG* ) 6.11 4.31 1.22 assign (resid 18 and name HN ) (resid 19 and name HD* ) 4.77 2.97 0.95 assign (resid 18 and name HA ) (resid 19 and name HG* ) 4.26 2.46 0.85 assign (resid 18 and name HA ) (resid 19 and name HD* ) 2.48 0.68 0.50 assign (resid 18 and name HB2 ) (resid 19 and name HD* ) 4.15 2.35 0.83 assign (resid 18 and name HB1 ) (resid 19 and name HD* ) 4.01 2.21 0.80 assign (resid 18 and name HD2 ) (resid 19 and name HD* ) 4.59 2.79 0.92 assign (resid 19 and name HG* ) (resid 20 and name HA2 ) 5.86 4.06 1.17 assign (resid 19 and name HG* ) (resid 20 and name HA1 ) 5.26 3.46 1.05 assign (resid 19 and name HG* ) (resid 21 and name HN ) 5.79 3.99 1.16 assign (resid 38 and name HA ) (resid 41 and name HG* ) 4.58 2.78 0.92 assign (resid 41 and name HN ) (resid 41 and name HG* ) 3.92 2.12 0.78 assign (resid 41 and name HA ) (resid 41 and name HG* ) 3.32 1.52 0.66 assign (resid 41 and name HA ) (resid 42 and name HB* ) 4.87 3.07 0.97 assign (resid 41 and name HG* ) (resid 45 and name HN ) 5.52 3.72 1.10 assign (resid 41 and name HG* ) (resid 45 and name HB2 ) 4.19 2.39 0.84 assign (resid 41 and name HG* ) (resid 45 and name HB1 ) 3.83 2.03 0.77 assign (resid 41 and name HG* ) (resid 45 and name HG2 ) 6.27 4.47 1.25 assign (resid 41 and name HG* ) (resid 45 and name HG1 ) 4.81 3.01 0.96 assign (resid 42 and name HN ) (resid 42 and name HB* ) 3.11 1.31 0.62 assign (resid 42 and name HB* ) (resid 43 and name HN ) 3.21 1.41 0.64 assign (resid 42 and name HB* ) (resid 43 and name HB2 ) 5.44 3.64 1.09 assign (resid 42 and name HB* ) (resid 44 and name HN ) 3.56 1.76 0.71 assign (resid 42 and name HB* ) (resid 44 and name HB1 ) 4.62 2.82 0.92 assign (resid 42 and name HB* ) (resid 45 and name HN ) 3.87 2.07 0.77 assign (resid 42 and name HB* ) (resid 45 and name HB2 ) 5.25 3.45 1.05 assign (resid 42 and name HB* ) (resid 45 and name HG2 ) 6.06 4.26 1.21 assign (resid 52 and name HB1 ) (resid 56 and name HB* ) 6.00 4.20 1.20 assign (resid 53 and name HB1 ) (resid 56 and name HB* ) 3.80 2.00 0.76 assign (resid 54 and name HN ) (resid 55 and name HG* ) 5.38 3.58 1.08 assign (resid 54 and name HB ) (resid 55 and name HG* ) 6.27 4.47 1.25 assign (resid 54 and name HG1* ) (resid 55 and name HG* ) 3.08 1.28 0.62 assign (resid 54 and name HG2* ) (resid 55 and name HG* ) 4.38 2.58 0.88 assign (resid 55 and name HN ) (resid 55 and name HG* ) 2.85 1.05 0.57 assign (resid 55 and name HN ) (resid 56 and name HB* ) 4.61 2.81 0.92 assign (resid 55 and name HA ) (resid 55 and name HG* ) 3.16 1.36 0.63 assign (resid 55 and name HG* ) (resid 58 and name HB2 ) 5.83 4.03 1.17 assign (resid 55 and name HG* ) (resid 58 and name HD1* ) 4.07 2.27 0.81 assign (resid 55 and name HG* ) (resid 58 and name HD2* ) 6.27 4.47 1.25 assign (resid 56 and name HN ) (resid 56 and name HB* ) 2.77 0.97 0.55 assign (resid 56 and name HB* ) (resid 57 and name HN ) 3.12 1.32 0.62 assign (resid 56 and name HB* ) (resid 57 and name HG11 ) 4.40 2.60 0.88 assign (resid 56 and name HB* ) (resid 57 and name HD1* ) 5.63 3.83 1.13 assign (resid 67 and name HN ) (resid 67 and name HG* ) 3.22 1.42 0.64 assign (resid 67 and name HA ) (resid 67 and name HG* ) 3.28 1.48 0.66 assign (resid 67 and name HG* ) (resid 68 and name HN ) 4.73 2.93 0.95 assign (resid 68 and name HN ) (resid 68 and name HB* ) 3.11 1.31 0.62 assign (resid 68 and name HA ) (resid 68 and name HB* ) 2.52 0.72 0.50 assign (resid 10 and name O ) (resid 14 and name HN ) 2.00 0.20 0.40 assign (resid 10 and name O ) (resid 14 and name N ) 3.00 1.20 0.60 assign (resid 11 and name O ) (resid 15 and name HN ) 2.00 0.20 0.40 assign (resid 11 and name O ) (resid 15 and name N ) 3.00 1.20 0.60 assign (resid 12 and name O ) (resid 16 and name HN ) 2.00 0.20 0.40 assign (resid 12 and name O ) (resid 16 and name N ) 3.00 1.20 0.60 assign (resid 13 and name O ) (resid 17 and name HN ) 2.00 0.20 0.40 assign (resid 13 and name O ) (resid 17 and name N ) 3.00 1.20 0.60 assign (resid 20 and name O ) (resid 24 and name HN ) 2.00 0.20 0.40 assign (resid 20 and name O ) (resid 24 and name N ) 3.00 1.20 0.60 assign (resid 21 and name O ) (resid 25 and name HN ) 2.00 0.20 0.40 assign (resid 21 and name O ) (resid 25 and name N ) 3.00 1.20 0.60 assign (resid 22 and name O ) (resid 26 and name HN ) 2.00 0.20 0.40 assign (resid 22 and name O ) (resid 26 and name N ) 3.00 1.20 0.60 assign (resid 23 and name O ) (resid 27 and name HN ) 2.00 0.20 0.40 assign (resid 23 and name O ) (resid 27 and name N ) 3.00 1.20 0.60 assign (resid 42 and name O ) (resid 46 and name HN ) 2.00 0.20 0.40 assign (resid 42 and name O ) (resid 46 and name N ) 3.00 1.20 0.60 assign (resid 43 and name O ) (resid 47 and name HN ) 2.00 0.20 0.40 assign (resid 43 and name O ) (resid 47 and name N ) 3.00 1.20 0.60 assign (resid 44 and name O ) (resid 48 and name HN ) 2.00 0.20 0.40 assign (resid 44 and name O ) (resid 48 and name N ) 3.00 1.20 0.60 assign (resid 45 and name O ) (resid 49 and name HN ) 2.00 0.20 0.40 assign (resid 45 and name O ) (resid 49 and name N ) 3.00 1.20 0.60 assign (resid 46 and name O ) (resid 50 and name HN ) 2.00 0.20 0.40 assign (resid 46 and name O ) (resid 50 and name N ) 3.00 1.20 0.60 assign (resid 54 and name O ) (resid 58 and name HN ) 2.00 0.20 0.40 assign (resid 54 and name O ) (resid 58 and name N ) 3.00 1.20 0.60 assign (resid 55 and name O ) (resid 59 and name HN ) 2.00 0.20 0.40 assign (resid 55 and name O ) (resid 59 and name N ) 3.00 1.20 0.60 assign (resid 57 and name O ) (resid 61 and name HN ) 2.00 0.20 0.40 assign (resid 57 and name O ) (resid 61 and name N ) 3.00 1.20 0.60 assign (resid 58 and name O ) (resid 62 and name HN ) 2.00 0.20 0.40 assign (resid 58 and name O ) (resid 62 and name N ) 3.00 1.20 0.60
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