NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
11410 |
1rgw   |
5696 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign (resid 2 and name HN ) (resid 2 and name HB# ) 3.17 1.37 0 assign (resid 3 and name HN ) (resid 3 and name HB# ) 4.05 2.25 0 assign (resid 4 and name HN ) (resid 4 and name HB# ) 3.61 1.81 0 assign (resid 5 and name HN ) (resid 5 and name HB ) 3.57 1.77 0 assign (resid 6 and name HN ) (resid 6 and name HB ) 3.73 1.93 0 assign (resid 6 and name HN ) (resid 6 and name HG2#) 4.64 2.84 0 assign (resid 7 and name HN ) (resid 7 and name HB# ) 3.55 1.75 0 assign (resid 7 and name HN ) (resid 7 and name HG ) 4.45 2.65 0 assign (resid 8 and name HN ) (resid 8 and name HB ) 3.86 2.06 0 assign (resid 17 and name HN ) (resid 17 and name HB2 ) 4.03 2.23 0 assign (resid 18 and name HN ) (resid 18 and name HB# ) 3.83 2.03 0 assign (resid 18 and name HA ) (resid 19 and name HN ) 2.92 1.12 0 assign (resid 21 and name HN ) (resid 21 and name HB2 ) 3.45 1.65 0 assign (resid 23 and name HN ) (resid 23 and name HB2 ) 3.93 2.13 0 assign (resid 23 and name HN ) (resid 23 and name HB1 ) 3.44 1.64 0 assign (resid 25 and name HN ) (resid 25 and name HG# ) 3.86 2.06 0 assign (resid 25 and name HN ) (resid 25 and name HB2 ) 4.11 2.31 0 assign (resid 25 and name HN ) (resid 25 and name HB1 ) 3.82 2.02 0 assign (resid 27 and name HN ) (resid 27 and name HB2 ) 3.17 1.37 0 assign (resid 27 and name HN ) (resid 27 and name HB1 ) 2.94 1.14 0 assign (resid 28 and name HN ) (resid 28 and name HB ) 3.90 2.10 0 assign (resid 28 and name HN ) (resid 28 and name HG2#) 3.81 2.01 0 assign (resid 30 and name HN ) (resid 30 and name HB1 ) 3.84 2.04 0 assign (resid 31 and name HN ) (resid 31 and name HD# ) 4.77 2.97 0 assign (resid 31 and name HN ) (resid 31 and name HB# ) 3.94 2.14 0 assign (resid 33 and name HN ) (resid 33 and name HB ) 3.28 1.48 0 assign (resid 36 and name HN ) (resid 36 and name HB# ) 3.73 1.93 0 assign (resid 38 and name HN ) (resid 38 and name HB# ) 3.24 1.44 0 assign (resid 40 and name HN ) (resid 40 and name HG2 ) 3.88 2.08 0 assign (resid 40 and name HN ) (resid 40 and name HB1 ) 3.55 1.75 0 assign (resid 41 and name HN ) (resid 41 and name HB# ) 3.74 1.94 0 assign (resid 42 and name HN ) (resid 42 and name HG2 ) 4.04 2.24 0 assign (resid 69 and name HN ) (resid 69 and name HG12) 3.17 1.37 0 assign (resid 43 and name HN ) (resid 43 and name HB2 ) 3.34 1.54 0 assign (resid 44 and name HN ) (resid 44 and name HB# ) 3.85 2.05 0 assign (resid 45 and name HA ) (resid 46 and name HN ) 2.76 0.96 0 assign (resid 47 and name HN ) (resid 47 and name HB2 ) 3.48 1.68 0 assign (resid 47 and name HN ) (resid 47 and name HB1 ) 3.91 2.11 0 assign (resid 48 and name HN ) (resid 48 and name HG ) 4.22 2.42 0 assign (resid 48 and name HN ) (resid 48 and name HD2#) 3.56 1.76 0 assign (resid 49 and name HN ) (resid 49 and name HB ) 3.26 1.46 0 assign (resid 49 and name HA ) (resid 50 and name HN ) 2.83 1.03 0 assign (resid 50 and name HN ) (resid 50 and name HB ) 3.91 2.11 0 assign (resid 50 and name HN ) (resid 50 and name HG1#) 3.77 1.97 0 assign (resid 51 and name HN ) (resid 51 and name HB# ) 3.24 1.44 0 assign (resid 52 and name HN ) (resid 52 and name HB ) 3.48 1.68 0 assign (resid 52 and name HN ) (resid 52 and name HG1#) 4.52 2.72 0 assign (resid 55 and name HN ) (resid 55 and name HB ) 3.16 1.36 0 assign (resid 56 and name HN ) (resid 56 and name HB2 ) 3.54 1.74 0 assign (resid 58 and name HN ) (resid 58 and name HB# ) 3.04 1.24 0 assign (resid 59 and name HN ) (resid 59 and name HB ) 3.98 2.18 0 assign (resid 59 and name HN ) (resid 59 and name HG2#) 3.82 2.02 0 assign (resid 60 and name HN ) (resid 60 and name HG# ) 3.57 1.77 0 assign (resid 60 and name HN ) (resid 60 and name HB# ) 3.16 1.36 0 assign (resid 60 and name HA ) (resid 61 and name HN ) 3.05 1.25 0 assign (resid 61 and name HN ) (resid 61 and name HG2#) 3.16 1.36 0 assign (resid 63 and name HN ) (resid 63 and name HB# ) 3.26 1.46 0 assign (resid 63 and name HN ) (resid 63 and name HD1#) 4.71 2.91 0 assign (resid 64 and name HN ) (resid 64 and name HG# ) 3.47 1.67 0 assign (resid 64 and name HN ) (resid 64 and name HB1 ) 3.80 2.00 0 assign (resid 65 and name HN ) (resid 65 and name HB# ) 2.89 1.09 0 assign (resid 66 and name HN ) (resid 66 and name HB# ) 3.26 1.46 0 assign (resid 67 and name HN ) (resid 67 and name HB2 ) 3.27 1.47 0 assign (resid 67 and name HB2 ) (resid 68 and name HN ) 3.96 2.16 0 assign (resid 68 and name HN ) (resid 68 and name HG# ) 3.92 2.12 0 assign (resid 68 and name HN ) (resid 68 and name HD# ) 4.76 2.96 0 assign (resid 69 and name HN ) (resid 69 and name HB ) 3.26 1.46 0 assign (resid 69 and name HN ) (resid 69 and name HG11) 3.71 1.91 0 assign (resid 69 and name HN ) (resid 69 and name HD1#) 4.12 2.32 0 assign (resid 70 and name HN ) (resid 70 and name HE# ) 4.70 2.90 0 assign (resid 70 and name HN ) (resid 70 and name HG2 ) 4.10 2.30 0 assign (resid 71 and name HN ) (resid 71 and name HB1 ) 3.81 2.01 0 assign (resid 24 and name HA ) (resid 25 and name HN ) 3.32 1.52 0 assign (resid 72 and name HN ) (resid 72 and name HB# ) 3.24 1.44 0 assign (resid 76 and name HN ) (resid 76 and name HB2 ) 3.77 1.97 0 assign (resid 77 and name HN ) (resid 77 and name HB# ) 3.87 2.07 0 assign (resid 78 and name HN ) (resid 78 and name HB2 ) 3.83 2.03 0 assign (resid 78 and name HN ) (resid 78 and name HG ) 4.06 2.26 0 assign (resid 78 and name HN ) (resid 78 and name HD1#) 4.42 2.62 0 assign (resid 78 and name HN ) (resid 78 and name HD2#) 4.41 2.61 0 assign (resid 79 and name HN ) (resid 79 and name HB ) 3.43 1.63 0 assign (resid 79 and name HN ) (resid 79 and name HG2#) 3.64 1.84 0 assign (resid 82 and name HN ) (resid 82 and name HB# ) 3.95 2.15 0 assign (resid 31 and name HG# ) (resid 32 and name HN ) 4.50 2.70 0 assign (resid 82 and name HA ) (resid 83 and name HN ) 3.15 1.35 0 assign (resid 83 and name HN ) (resid 83 and name HB# ) 3.51 1.71 0 assign (resid 84 and name HN ) (resid 84 and name HG# ) 4.69 2.89 0 assign (resid 85 and name HN ) (resid 85 and name HG# ) 4.44 2.64 0 assign (resid 17 and name HN ) (resid 17 and name HG ) 4.40 2.60 0 assign (resid 21 and name HN ) (resid 21 and name HB1 ) 4.13 2.33 0 assign (resid 27 and name HN ) (resid 27 and name HG ) 3.73 1.93 0 assign (resid 29 and name HN ) (resid 29 and name HB ) 3.34 1.54 0 assign (resid 29 and name HN ) (resid 29 and name HG12) 3.77 1.97 0 assign (resid 29 and name HN ) (resid 29 and name HG11) 3.61 1.81 0 assign (resid 16 and name HN ) (resid 29 and name HG2#) 3.75 1.95 0 assign (resid 29 and name HN ) (resid 29 and name HD1#) 4.31 2.51 0 assign (resid 32 and name HN ) (resid 32 and name HA ) 2.86 1.06 0 assign (resid 32 and name HN ) (resid 32 and name HB ) 3.47 1.67 0 assign (resid 32 and name HN ) (resid 32 and name HG12) 4.10 2.30 0 assign (resid 32 and name HN ) (resid 32 and name HG11) 4.32 2.52 0 assign (resid 32 and name HN ) (resid 32 and name HG2#) 4.31 2.51 0 assign (resid 32 and name HD1#) (resid 45 and name HN ) 3.61 1.81 0 assign (resid 40 and name HN ) (resid 40 and name HG1 ) 4.19 2.39 0 assign (resid 42 and name HN ) (resid 42 and name HB1 ) 3.75 1.95 0 assign (resid 42 and name HN ) (resid 42 and name HG1 ) 4.16 2.36 0 assign (resid 43 and name HN ) (resid 43 and name HB1 ) 3.86 2.06 0 assign (resid 45 and name HN ) (resid 45 and name HB# ) 2.89 1.09 0 assign (resid 45 and name HN ) (resid 45 and name HG2 ) 4.00 2.20 0 assign (resid 48 and name HN ) (resid 48 and name HB1 ) 3.43 1.63 0 assign (resid 49 and name HN ) (resid 49 and name HG2#) 3.24 1.44 0 assign (resid 50 and name HN ) (resid 50 and name HG2#) 3.07 1.27 0 assign (resid 52 and name HN ) (resid 52 and name HG2#) 4.15 2.35 0 assign (resid 56 and name HN ) (resid 56 and name HB1 ) 3.28 1.48 0 assign (resid 64 and name HN ) (resid 64 and name HB2 ) 3.14 1.34 0 assign (resid 67 and name HN ) (resid 67 and name HB1 ) 3.73 1.93 0 assign (resid 69 and name HN ) (resid 69 and name HG2#) 3.96 2.16 0 assign (resid 70 and name HN ) (resid 70 and name HG1 ) 4.54 2.74 0 assign (resid 70 and name HN ) (resid 70 and name HD# ) 4.17 2.37 0 assign (resid 76 and name HN ) (resid 76 and name HB1 ) 4.09 2.29 0 assign (resid 76 and name HN ) (resid 76 and name HD1#) 4.63 2.83 0 assign (resid 80 and name HN ) (resid 80 and name HG ) 4.14 2.34 0 assign (resid 80 and name HN ) (resid 80 and name HD1#) 3.67 1.87 0 assign (resid 82 and name HN ) (resid 82 and name HD# ) 3.32 1.52 0 assign (resid 84 and name HN ) (resid 84 and name HD# ) 4.94 3.14 0 assign (resid 7 and name HN ) (resid 7 and name HD2#) 4.46 2.66 0 assign (resid 42 and name HN ) (resid 42 and name HB2 ) 3.46 1.66 0 assign (resid 62 and name HN ) (resid 62 and name HB2 ) 3.52 1.72 0 assign (resid 62 and name HN ) (resid 62 and name HB1 ) 3.60 1.80 0 assign (resid 2 and name HA ) (resid 3 and name HN ) 2.95 1.15 0 assign (resid 3 and name HA ) (resid 4 and name HN ) 2.94 1.14 0 assign (resid 4 and name HA ) (resid 5 and name HN ) 2.89 1.09 0 assign (resid 5 and name HA ) (resid 6 and name HN ) 3.04 1.24 0 assign (resid 6 and name HA ) (resid 7 and name HN ) 3.04 1.24 0 assign (resid 7 and name HA ) (resid 8 and name HN ) 3.19 1.39 0 assign (resid 8 and name HA ) (resid 9 and name HN ) 3.06 1.26 0 assign (resid 17 and name HA ) (resid 18 and name HN ) 2.97 1.17 0 assign (resid 27 and name HA ) (resid 28 and name HN ) 2.80 1.00 0 assign (resid 28 and name HA ) (resid 29 and name HN ) 3.03 1.23 0 assign (resid 29 and name HA ) (resid 30 and name HN ) 2.96 1.16 0 assign (resid 31 and name HA ) (resid 32 and name HN ) 2.93 1.13 0 assign (resid 38 and name HN ) (resid 39 and name HN ) 3.85 2.05 0 assign (resid 41 and name HN ) (resid 42 and name HN ) 4.42 2.62 0 assign (resid 69 and name HN ) (resid 70 and name HN ) 3.42 1.62 0 assign (resid 43 and name HA ) (resid 44 and name HN ) 3.06 1.26 0 assign (resid 40 and name HB1 ) (resid 41 and name HN ) 4.08 2.28 0 assign (resid 43 and name HB1 ) (resid 44 and name HN ) 4.17 2.37 0 assign (resid 43 and name HD1#) (resid 44 and name HN ) 4.24 2.44 0 assign (resid 48 and name HA ) (resid 49 and name HN ) 2.62 0.82 0 assign (resid 50 and name HA ) (resid 51 and name HN ) 3.54 1.74 0 assign (resid 51 and name HA ) (resid 52 and name HN ) 2.92 1.12 0 assign (resid 53 and name HA ) (resid 54 and name HN ) 3.40 1.60 0 assign (resid 55 and name HA ) (resid 56 and name HN ) 2.78 0.98 0 assign (resid 22 and name HN ) (resid 23 and name HN ) 3.42 1.62 0 assign (resid 21 and name HN ) (resid 22 and name HN ) 3.91 2.11 0 assign (resid 23 and name HN ) (resid 24 and name HN ) 3.49 1.69 0 assign (resid 24 and name HN ) (resid 25 and name HN ) 3.95 2.15 0 assign (resid 30 and name HN ) (resid 31 and name HN ) 3.23 1.43 0 assign (resid 16 and name HN ) (resid 31 and name HN ) 3.70 1.90 0 assign (resid 46 and name HN ) (resid 47 and name HN ) 3.58 1.78 0 assign (resid 50 and name HN ) (resid 51 and name HN ) 3.09 1.29 0 assign (resid 57 and name HN ) (resid 58 and name HN ) 3.50 1.70 0 assign (resid 58 and name HN ) (resid 59 and name HN ) 4.09 2.29 0 assign (resid 53 and name HN ) (resid 54 and name HN ) 3.83 2.03 0 assign (resid 54 and name HN ) (resid 55 and name HN ) 3.59 1.79 0 assign (resid 64 and name HN ) (resid 65 and name HN ) 3.28 1.48 0 assign (resid 63 and name HN ) (resid 64 and name HN ) 3.59 1.79 0 assign (resid 68 and name HN ) (resid 69 and name HN ) 3.49 1.69 0 assign (resid 70 and name HN ) (resid 71 and name HN ) 3.51 1.71 0 assign (resid 71 and name HN ) (resid 72 and name HN ) 4.39 2.59 0 assign (resid 22 and name HN ) (resid 61 and name HA ) 3.59 1.79 0 assign (resid 28 and name HB ) (resid 29 and name HN ) 3.43 1.63 0 assign (resid 50 and name HN ) (resid 80 and name HA ) 3.49 1.69 0 assign (resid 28 and name HA ) (resid 49 and name HN ) 3.58 1.78 0 assign (resid 53 and name HN ) (resid 78 and name HA ) 4.30 2.50 0 assign (resid 53 and name HN ) (resid 77 and name HB# ) 4.37 2.57 0 assign (resid 56 and name HA ) (resid 57 and name HN ) 2.94 1.14 0 assign (resid 61 and name HA ) (resid 62 and name HN ) 3.19 1.39 0 assign (resid 61 and name HB ) (resid 62 and name HN ) 3.34 1.54 0 assign (resid 61 and name HB ) (resid 63 and name HN ) 4.03 2.23 0 assign (resid 62 and name HB1 ) (resid 63 and name HN ) 3.52 1.72 0 assign (resid 61 and name HB ) (resid 64 and name HN ) 4.40 2.60 0 assign (resid 71 and name HA ) (resid 72 and name HN ) 3.26 1.46 0 assign (resid 67 and name HA ) (resid 70 and name HN ) 4.03 2.23 0 assign (resid 75 and name HA ) (resid 76 and name HN ) 3.14 1.34 0 assign (resid 76 and name HA ) (resid 77 and name HN ) 3.01 1.21 0 assign (resid 77 and name HB# ) (resid 78 and name HN ) 4.31 2.51 0 assign (resid 77 and name HA ) (resid 78 and name HN ) 3.01 1.21 0 assign (resid 78 and name HA ) (resid 79 and name HN ) 3.05 1.25 0 assign (resid 79 and name HA ) (resid 80 and name HN ) 3.11 1.31 0 assign (resid 80 and name HA ) (resid 81 and name HN ) 3.01 1.21 0 assign (resid 81 and name HA ) (resid 82 and name HN ) 2.87 1.07 0 assign (resid 84 and name HA ) (resid 85 and name HN ) 3.23 1.43 0 assign (resid 3 and name HB# ) (resid 4 and name HN ) 3.31 1.51 0 assign (resid 19 and name HA1 ) (resid 20 and name HN ) 3.54 1.74 0 assign (resid 26 and name HA ) (resid 27 and name HN ) 2.74 0.94 0 assign (resid 17 and name HA ) (resid 30 and name HN ) 3.58 1.78 0 assign (resid 15 and name HA ) (resid 33 and name HN ) 4.18 2.38 0 assign (resid 51 and name HN ) (resid 79 and name HB ) 3.46 1.66 0 assign (resid 58 and name HB# ) (resid 59 and name HN ) 3.92 2.12 0 assign (resid 74 and name HB# ) (resid 75 and name HN ) 4.04 2.24 0 assign (resid 4 and name HA ) (resid 80 and name HN ) 4.09 2.29 0 assign (resid 2 and name HA ) (resid 82 and name HN ) 4.20 2.40 0 assign (resid 18 and name HG# ) (resid 19 and name HN ) 4.16 2.36 0 assign (resid 18 and name HB# ) (resid 19 and name HN ) 3.74 1.94 0 assign (resid 3 and name HN ) (resid 80 and name HD2#) 4.38 2.58 0 assign (resid 5 and name HN ) (resid 78 and name HB2 ) 4.32 2.52 0 assign (resid 32 and name HG2#) (resid 33 and name HN ) 3.50 1.70 0 assign (resid 66 and name HB# ) (resid 67 and name HN ) 3.50 1.70 0 assign (resid 8 and name HG2#) (resid 9 and name HN ) 3.84 2.04 0 assign (resid 15 and name HN ) (resid 38 and name HB# ) 4.54 2.74 0 assign (resid 16 and name HB2 ) (resid 17 and name HN ) 4.54 2.74 0 assign (resid 17 and name HB1 ) (resid 18 and name HN ) 3.78 1.98 0 assign (resid 20 and name HN ) (resid 25 and name HB1 ) 4.23 2.43 0 assign (resid 21 and name HN ) (resid 21 and name HD2 ) 3.36 1.56 0 assign (resid 21 and name HB2 ) (resid 22 and name HN ) 4.22 2.42 0 assign (resid 22 and name HN ) (resid 61 and name HG2#) 3.88 2.08 0 assign (resid 23 and name HB2 ) (resid 24 and name HN ) 4.59 2.79 0 assign (resid 26 and name HB2 ) (resid 27 and name HN ) 3.82 2.02 0 assign (resid 27 and name HD2#) (resid 28 and name HN ) 3.74 1.94 0 assign (resid 27 and name HG ) (resid 28 and name HN ) 4.35 2.55 0 assign (resid 29 and name HG2#) (resid 31 and name HN ) 3.42 1.62 0 assign (resid 36 and name HN ) (resid 39 and name HB# ) 3.13 1.33 0 assign (resid 32 and name HG2#) (resid 39 and name HN ) 3.68 1.88 0 assign (resid 27 and name HB2 ) (resid 28 and name HN ) 4.58 2.78 0 assign (resid 16 and name HB1 ) (resid 30 and name HN ) 4.92 3.12 0 assign (resid 5 and name HG1#) (resid 43 and name HN ) 4.15 2.35 0 assign (resid 45 and name HG2 ) (resid 46 and name HN ) 4.42 2.62 0 assign (resid 45 and name HB# ) (resid 46 and name HN ) 4.10 2.30 0 assign (resid 29 and name HG2#) (resid 46 and name HN ) 3.89 2.09 0 assign (resid 29 and name HB ) (resid 47 and name HN ) 3.67 1.87 0 assign (resid 47 and name HB1 ) (resid 48 and name HN ) 3.67 1.87 0 assign (resid 48 and name HN ) (resid 48 and name HB2 ) 2.94 1.14 0 assign (resid 28 and name HG2#) (resid 49 and name HN ) 3.74 1.94 0 assign (resid 50 and name HB ) (resid 51 and name HN ) 3.82 2.02 0 assign (resid 50 and name HG2#) (resid 51 and name HN ) 3.23 1.43 0 assign (resid 51 and name HB# ) (resid 52 and name HN ) 3.29 1.49 0 assign (resid 52 and name HG2#) (resid 53 and name HN ) 3.61 1.81 0 assign (resid 51 and name HB# ) (resid 54 and name HN ) 3.78 1.98 0 assign (resid 55 and name HG1#) (resid 56 and name HN ) 3.37 1.57 0 assign (resid 56 and name HB2 ) (resid 57 and name HN ) 4.13 2.33 0 assign (resid 56 and name HB2 ) (resid 58 and name HN ) 3.96 2.16 0 assign (resid 61 and name HN ) (resid 64 and name HB2 ) 3.24 1.44 0 assign (resid 60 and name HG# ) (resid 61 and name HN ) 4.56 2.76 0 assign (resid 61 and name HG2#) (resid 62 and name HN ) 4.09 2.29 0 assign (resid 63 and name HG ) (resid 64 and name HN ) 3.55 1.75 0 assign (resid 64 and name HB1 ) (resid 65 and name HN ) 3.88 2.08 0 assign (resid 64 and name HB2 ) (resid 65 and name HN ) 3.55 1.75 0 assign (resid 65 and name HB# ) (resid 66 and name HN ) 3.37 1.57 0 assign (resid 70 and name HB# ) (resid 71 and name HN ) 4.29 2.49 0 assign (resid 71 and name HN ) (resid 72 and name HB# ) 3.42 1.62 0 assign (resid 29 and name HN ) (resid 49 and name HG2#) 4.04 2.24 0 assign (resid 75 and name HB2 ) (resid 76 and name HN ) 3.97 2.17 0 assign (resid 76 and name HD1#) (resid 77 and name HN ) 3.61 1.81 0 assign (resid 79 and name HN ) (resid 80 and name HD2#) 4.01 2.21 0 assign (resid 80 and name HD1#) (resid 81 and name HN ) 3.97 2.17 0 assign (resid 80 and name HB# ) (resid 81 and name HN ) 3.42 1.62 0 assign (resid 81 and name HB# ) (resid 83 and name HN ) 4.24 2.44 0 assign (resid 82 and name HD# ) (resid 83 and name HN ) 4.57 2.77 0 assign (resid 2 and name HB# ) (resid 3 and name HN ) 3.42 1.62 0 assign (resid 67 and name HN ) (resid 68 and name HN ) 3.44 1.64 0 assign (resid 16 and name HN ) (resid 30 and name HN ) 4.49 2.69 0 assign (resid 15 and name HA ) (resid 16 and name HN ) 3.23 1.43 0 assign (resid 20 and name HA1 ) (resid 21 and name HN ) 3.28 1.48 0 assign (resid 20 and name HA2 ) (resid 21 and name HN ) 3.55 1.75 0 assign (resid 19 and name HA2 ) (resid 20 and name HN ) 3.29 1.49 0 assign (resid 30 and name HB1 ) (resid 31 and name HN ) 4.03 2.23 0 assign (resid 30 and name HB2 ) (resid 31 and name HN ) 4.27 2.47 0 assign (resid 22 and name HN ) (resid 62 and name HN ) 4.35 2.55 0 assign (resid 53 and name HN ) (resid 77 and name HN ) 4.52 2.72 0 assign (resid 3 and name HN ) (resid 80 and name HN ) 3.85 2.05 0 assign (resid 9 and name HN ) (resid 13 and name HH2 ) 4.52 2.72 0 assign (resid 64 and name HA ) (resid 67 and name HN ) 3.63 1.83 0 assign (resid 52 and name HN ) (resid 55 and name HB ) 4.29 2.49 0 assign (resid 5 and name HN ) (resid 78 and name HN ) 3.96 2.16 0 assign (resid 7 and name HN ) (resid 77 and name HA ) 4.17 2.37 0 assign (resid 3 and name HN ) (resid 81 and name HA ) 3.74 1.94 0 assign (resid 6 and name HA ) (resid 78 and name HN ) 4.15 2.35 0 assign (resid 51 and name HN ) (resid 79 and name HN ) 3.52 1.72 0 assign (resid 21 and name HN ) (resid 21 and name HG# ) 4.01 2.21 0 assign (resid 37 and name HN ) (resid 37 and name HG# ) 4.64 2.84 0 assign (resid 66 and name HN ) (resid 67 and name HN ) 3.47 1.67 0 assign (resid 16 and name HN ) (resid 16 and name HB1 ) 3.55 1.75 0 assign (resid 15 and name HB2 ) (resid 16 and name HN ) 3.51 1.71 0 assign (resid 16 and name HN ) (resid 16 and name HD1 ) 4.60 2.80 0 assign (resid 16 and name HN ) (resid 16 and name HG# ) 4.05 2.25 0 assign (resid 8 and name HN ) (resid 8 and name HG2#) 3.95 2.15 0 assign (resid 57 and name HN ) (resid 57 and name HG1 ) 4.00 2.20 0 assign (resid 23 and name HN ) (resid 25 and name HN ) 4.33 2.53 0 assign (resid 48 and name HN ) (resid 81 and name HN ) 3.71 1.91 0 assign (resid 59 and name HN ) (resid 60 and name HN ) 3.61 1.81 0 assign (resid 61 and name HN ) (resid 64 and name HN ) 4.48 2.68 0 assign (resid 20 and name HN ) (resid 25 and name HB2 ) 4.83 3.03 0 assign (resid 43 and name HB2 ) (resid 44 and name HN ) 4.62 2.82 0 assign (resid 3 and name HN ) (resid 79 and name HG2#) 4.29 2.49 0 assign (resid 10 and name HA ) (resid 11 and name HN ) 3.54 1.74 0 assign (resid 23 and name HB2 ) (resid 25 and name HN ) 4.49 2.69 0 assign (resid 39 and name HN ) (resid 39 and name HB# ) 2.87 1.07 0 assign (resid 40 and name HB2 ) (resid 41 and name HN ) 4.65 2.85 0 assign (resid 29 and name HG2#) (resid 47 and name HN ) 3.99 2.19 0 assign (resid 29 and name HN ) (resid 47 and name HN ) 4.48 2.68 0 assign (resid 65 and name HN ) (resid 66 and name HN ) 3.41 1.61 0 assign (resid 18 and name HN ) (resid 30 and name HN ) 4.47 2.67 0 assign (resid 27 and name HN ) (resid 28 and name HN ) 4.34 2.54 0 assign (resid 29 and name HN ) (resid 46 and name HN ) 4.74 2.94 0 assign (resid 52 and name HN ) (resid 55 and name HN ) 3.64 1.84 0 assign (resid 33 and name HG2#) (resid 36 and name HN ) 4.38 2.58 0 assign (resid 61 and name HG2#) (resid 64 and name HN ) 4.55 2.75 0 assign (resid 60 and name HN ) (resid 64 and name HB1 ) 5.02 3.22 0 assign (resid 57 and name HG2#) (resid 58 and name HN ) 4.50 2.70 0 assign (resid 78 and name HB2 ) (resid 79 and name HN ) 3.87 2.07 0 assign (resid 69 and name HG2#) (resid 70 and name HN ) 4.10 2.30 0 assign (resid 48 and name HN ) (resid 81 and name HB# ) 4.21 2.41 0 assign (resid 50 and name HN ) (resid 79 and name HG2#) 4.60 2.80 0 assign (resid 45 and name HN ) (resid 45 and name HE22) 4.57 2.77 0 assign (resid 6 and name HG2#) (resid 75 and name HD22) 4.37 2.57 0 assign (resid 45 and name HE21) (resid 69 and name HG2#) 3.43 1.63 0 assign (resid 67 and name HA ) (resid 68 and name HN ) 3.57 1.77 0 assign (resid 49 and name HA ) (resid 81 and name HN ) 4.61 2.81 0 assign (resid 83 and name HB# ) (resid 84 and name HN ) 4.76 2.96 0 assign (resid 20 and name HA2 ) (resid 62 and name HN ) 4.26 2.46 0 assign (resid 29 and name HG2#) (resid 30 and name HN ) 3.69 1.89 0 assign (resid 48 and name HN ) (resid 48 and name HD1#) 3.68 1.88 0 assign (resid 27 and name HD1#) (resid 65 and name HN ) 4.01 2.21 0 assign (resid 18 and name HN ) (resid 29 and name HA ) 4.69 2.89 0 assign (resid 62 and name HN ) (resid 63 and name HN ) 3.81 2.01 0 assign (resid 65 and name HN ) (resid 67 and name HN ) 4.59 2.79 0 assign (resid 7 and name HN ) (resid 76 and name HN ) 3.97 2.17 0 assign (resid 63 and name HB# ) (resid 64 and name HN ) 4.08 2.28 0 assign (resid 67 and name HB1 ) (resid 68 and name HN ) 4.21 2.41 0 assign (resid 68 and name HB# ) (resid 69 and name HN ) 3.53 1.73 0 assign (resid 66 and name HA ) (resid 68 and name HN ) 4.79 2.99 0 assign (resid 5 and name HN ) (resid 5 and name HG1#) 3.63 1.83 0 assign (resid 43 and name HN ) (resid 43 and name HD1#) 3.78 1.98 0 assign (resid 49 and name HN ) (resid 49 and name HG1#) 3.53 1.73 0 assign (resid 55 and name HN ) (resid 55 and name HG2#) 3.11 1.31 0 assign (resid 63 and name HN ) (resid 63 and name HD2#) 5.17 3.37 0 assign (resid 80 and name HN ) (resid 80 and name HD2#) 3.37 1.57 0 assign (resid 39 and name HA ) (resid 41 and name HN ) 4.58 2.78 0 assign (resid 53 and name HA ) (resid 77 and name HN ) 4.56 2.76 0 assign (resid 18 and name HB# ) (resid 18 and name HE22) 5.02 3.22 0 assign (resid 13 and name HB1 ) (resid 15 and name HD# ) 4.14 2.34 0 assign (resid 56 and name HB1 ) (resid 56 and name HD22) 3.83 2.03 0 assign (resid 67 and name HB2 ) (resid 67 and name HD21) 3.55 1.75 0 assign (resid 67 and name HB2 ) (resid 67 and name HD22) 3.89 2.09 0 assign (resid 67 and name HB1 ) (resid 67 and name HD22) 3.96 2.16 0 assign (resid 3 and name HD# ) (resid 82 and name HD# ) 3.76 1.96 0 assign (resid 63 and name HD1#) (resid 67 and name HD21) 4.12 2.32 0 assign (resid 23 and name HN ) (resid 23 and name HD# ) 3.95 2.15 0 assign (resid 3 and name HE# ) (resid 82 and name HD# ) 3.64 1.84 0 assign (resid 3 and name HE# ) (resid 80 and name HB# ) 4.28 2.48 0 assign (resid 3 and name HE# ) (resid 80 and name HD2#) 3.13 1.33 0 assign (resid 3 and name HE# ) (resid 5 and name HB ) 4.40 2.60 0 assign (resid 3 and name HA ) (resid 3 and name HD# ) 3.48 1.68 0 assign (resid 2 and name HA ) (resid 3 and name HD# ) 3.93 2.13 0 assign (resid 63 and name HG ) (resid 67 and name HD21) 4.00 2.20 0 assign (resid 3 and name HD# ) (resid 5 and name HB ) 4.54 2.74 0 assign (resid 42 and name HB1 ) (resid 42 and name HE21) 4.55 2.75 0 assign (resid 3 and name HD# ) (resid 80 and name HD2#) 3.75 1.95 0 assign (resid 3 and name HD# ) (resid 5 and name HG1#) 3.34 1.54 0 assign (resid 15 and name HA ) (resid 15 and name HD# ) 4.23 2.43 0 assign (resid 29 and name HA ) (resid 46 and name HA2 ) 3.97 2.17 0 assign (resid 2 and name HA ) (resid 81 and name HA ) 4.69 2.89 0 assign (resid 15 and name HA ) (resid 16 and name HA ) 3.94 2.14 0 assign (resid 15 and name HA ) (resid 32 and name HG11) 4.58 2.78 0 assign (resid 15 and name HA ) (resid 38 and name HB# ) 4.54 2.74 0 assign (resid 17 and name HA ) (resid 17 and name HD2#) 4.74 2.94 0 assign (resid 17 and name HA ) (resid 29 and name HA ) 4.42 2.62 0 assign (resid 21 and name HA ) (resid 21 and name HD2 ) 4.17 2.37 0 assign (resid 49 and name HA ) (resid 80 and name HA ) 4.14 2.34 0 assign (resid 28 and name HA ) (resid 48 and name HA ) 4.41 2.61 0 assign (resid 66 and name HA ) (resid 66 and name HG# ) 3.64 1.84 0 assign (resid 69 and name HA ) (resid 69 and name HG11) 4.07 2.27 0 assign (resid 6 and name HA ) (resid 77 and name HA ) 3.95 2.15 0 assign (resid 52 and name HA ) (resid 78 and name HA ) 4.64 2.84 0 assign (resid 54 and name HN ) (resid 55 and name HA ) 4.95 3.15 0 assign (resid 15 and name HB1 ) (resid 16 and name HN ) 3.94 2.14 0 assign (resid 15 and name HB1 ) (resid 38 and name HB# ) 3.59 1.79 0 assign (resid 80 and name HB# ) (resid 80 and name HD2#) 2.76 0.96 0 assign (resid 47 and name HB1 ) (resid 80 and name HB# ) 3.92 2.12 0 assign (resid 17 and name HB2 ) (resid 17 and name HD2#) 2.97 1.17 0 assign (resid 17 and name HB2 ) (resid 18 and name HN ) 4.35 2.55 0 assign (resid 17 and name HB1 ) (resid 17 and name HD2#) 3.41 1.61 0 assign (resid 50 and name HA ) (resid 57 and name HG1 ) 3.70 1.90 0 assign (resid 78 and name HB2 ) (resid 78 and name HD1#) 3.76 1.96 0 assign (resid 78 and name HB1 ) (resid 78 and name HD1#) 3.41 1.61 0 assign (resid 48 and name HA ) (resid 48 and name HD1#) 4.49 2.69 0 assign (resid 27 and name HD1#) (resid 65 and name HB# ) 2.79 0.99 0 assign (resid 69 and name HG2#) (resid 76 and name HD2#) 3.63 1.83 0 assign (resid 69 and name HA ) (resid 69 and name HG2#) 3.36 1.56 0 assign (resid 66 and name HN ) (resid 66 and name HG# ) 4.10 2.30 0 assign (resid 49 and name HA ) (resid 49 and name HG2#) 3.39 1.59 0 assign (resid 68 and name HB# ) (resid 68 and name HG# ) 2.96 1.16 0 assign (resid 68 and name HN ) (resid 68 and name HB# ) 3.09 1.29 0 assign (resid 22 and name HN ) (resid 22 and name HB2 ) 3.97 2.17 0 assign (resid 43 and name HB2 ) (resid 43 and name HD1#) 3.08 1.28 0 assign (resid 43 and name HB1 ) (resid 43 and name HD2#) 3.18 1.38 0 assign (resid 52 and name HG2#) (resid 53 and name HB2 ) 4.67 2.87 0 assign (resid 8 and name HA ) (resid 8 and name HG2#) 3.56 1.76 0 assign (resid 7 and name HD2#) (resid 13 and name HB2 ) 4.03 2.23 0 assign (resid 15 and name HB2 ) (resid 29 and name HG2#) 3.53 1.73 0 assign (resid 17 and name HB2 ) (resid 17 and name HD1#) 3.12 1.32 0 assign (resid 17 and name HB1 ) (resid 17 and name HD1#) 3.08 1.28 0 assign (resid 18 and name HA ) (resid 18 and name HG# ) 3.01 1.21 0 assign (resid 21 and name HB2 ) (resid 21 and name HD2 ) 2.71 0.91 0 assign (resid 47 and name HB2 ) (resid 80 and name HB# ) 4.11 2.31 0 assign (resid 82 and name HA ) (resid 82 and name HE# ) 2.99 1.19 0 assign (resid 25 and name HA ) (resid 25 and name HG# ) 4.07 2.27 0 assign (resid 5 and name HB ) (resid 6 and name HN ) 4.22 2.42 0 assign (resid 19 and name HA1 ) (resid 25 and name HG# ) 3.74 1.94 0 assign (resid 25 and name HB1 ) (resid 26 and name HD1 ) 4.12 2.32 0 assign (resid 26 and name HB1 ) (resid 48 and name HD1#) 3.99 2.19 0 assign (resid 25 and name HA ) (resid 26 and name HD2 ) 3.23 1.43 0 assign (resid 53 and name HA ) (resid 77 and name HB# ) 3.12 1.32 0 assign (resid 25 and name HA ) (resid 26 and name HD1 ) 3.29 1.49 0 assign (resid 28 and name HG2#) (resid 48 and name HA ) 3.25 1.45 0 assign (resid 28 and name HA ) (resid 28 and name HG2#) 3.20 1.40 0 assign (resid 28 and name HB ) (resid 48 and name HA ) 5.50 3.70 0 assign (resid 45 and name HA ) (resid 45 and name HG1 ) 3.28 1.48 0 assign (resid 29 and name HG2#) (resid 29 and name HD1#) 3.05 1.25 0 assign (resid 29 and name HG2#) (resid 29 and name HG12) 3.29 1.49 0 assign (resid 29 and name HG2#) (resid 46 and name HA1 ) 3.15 1.35 0 assign (resid 29 and name HA ) (resid 29 and name HG2#) 3.28 1.48 0 assign (resid 49 and name HG1#) (resid 80 and name HB# ) 3.34 1.54 0 assign (resid 29 and name HA ) (resid 29 and name HG11) 4.23 2.43 0 assign (resid 29 and name HD1#) (resid 49 and name HG1#) 4.37 2.57 0 assign (resid 29 and name HA ) (resid 29 and name HD1#) 3.53 1.73 0 assign (resid 32 and name HG2#) (resid 39 and name HA ) 3.09 1.29 0 assign (resid 32 and name HG2#) (resid 32 and name HG12) 3.60 1.80 0 assign (resid 32 and name HA ) (resid 32 and name HG12) 3.98 2.18 0 assign (resid 32 and name HA ) (resid 32 and name HG11) 3.24 1.44 0 assign (resid 32 and name HD1#) (resid 44 and name HA ) 3.43 1.63 0 assign (resid 32 and name HB ) (resid 32 and name HD1#) 3.46 1.66 0 assign (resid 33 and name HA ) (resid 33 and name HG2#) 3.32 1.52 0 assign (resid 37 and name HG# ) (resid 37 and name HE2 ) 3.40 1.60 0 assign (resid 16 and name HB1 ) (resid 18 and name HG# ) 3.43 1.63 0 assign (resid 37 and name HB2 ) (resid 38 and name HN ) 3.96 2.16 0 assign (resid 32 and name HG2#) (resid 38 and name HB# ) 3.24 1.44 0 assign (resid 32 and name HG2#) (resid 39 and name HB# ) 2.85 1.05 0 assign (resid 40 and name HN ) (resid 40 and name HB2 ) 4.07 2.27 0 assign (resid 40 and name HA ) (resid 40 and name HG1 ) 3.80 2.00 0 assign (resid 40 and name HB1 ) (resid 41 and name HB# ) 3.55 1.75 0 assign (resid 29 and name HG2#) (resid 45 and name HB# ) 3.21 1.41 0 assign (resid 45 and name HN ) (resid 45 and name HG1 ) 3.92 2.12 0 assign (resid 45 and name HB# ) (resid 45 and name HG2 ) 2.94 1.14 0 assign (resid 45 and name HA ) (resid 45 and name HG2 ) 4.23 2.43 0 assign (resid 47 and name HB1 ) (resid 80 and name HD1#) 3.96 2.16 0 assign (resid 62 and name HA ) (resid 65 and name HB# ) 3.78 1.98 0 assign (resid 29 and name HG11) (resid 49 and name HG1#) 4.20 2.40 0 assign (resid 50 and name HA ) (resid 50 and name HG1#) 3.03 1.23 0 assign (resid 49 and name HA ) (resid 49 and name HG1#) 2.93 1.13 0 assign (resid 52 and name HA ) (resid 52 and name HG2#) 3.46 1.66 0 assign (resid 64 and name HB1 ) (resid 65 and name HB# ) 3.64 1.84 0 assign (resid 52 and name HG2#) (resid 68 and name HB# ) 3.49 1.69 0 assign (resid 65 and name HA ) (resid 68 and name HB# ) 3.08 1.28 0 assign (resid 55 and name HA ) (resid 55 and name HG1#) 3.01 1.21 0 assign (resid 57 and name HA ) (resid 57 and name HG2#) 3.06 1.26 0 assign (resid 57 and name HN ) (resid 57 and name HG2#) 3.23 1.43 0 assign (resid 57 and name HG2#) (resid 57 and name HG1 ) 3.05 1.25 0 assign (resid 58 and name HA ) (resid 58 and name HB# ) 2.74 0.94 0 assign (resid 61 and name HA ) (resid 61 and name HG2#) 3.20 1.40 0 assign (resid 22 and name HB2 ) (resid 61 and name HG2#) 3.64 1.84 0 assign (resid 62 and name HB2 ) (resid 63 and name HN ) 4.12 2.32 0 assign (resid 63 and name HB# ) (resid 63 and name HD1#) 3.55 1.75 0 assign (resid 63 and name HB# ) (resid 63 and name HD2#) 3.42 1.62 0 assign (resid 63 and name HA ) (resid 63 and name HD1#) 3.15 1.35 0 assign (resid 63 and name HB# ) (resid 63 and name HG ) 2.40 0.60 0 assign (resid 64 and name HB2 ) (resid 64 and name HG# ) 2.65 0.85 0 assign (resid 64 and name HA ) (resid 64 and name HG# ) 3.75 1.95 0 assign (resid 60 and name HG# ) (resid 64 and name HB2 ) 4.46 2.66 0 assign (resid 61 and name HN ) (resid 64 and name HB1 ) 3.60 1.80 0 assign (resid 63 and name HA ) (resid 66 and name HB# ) 3.32 1.52 0 assign (resid 64 and name HN ) (resid 66 and name HB# ) 4.62 2.82 0 assign (resid 64 and name HA ) (resid 67 and name HB2 ) 3.67 1.87 0 assign (resid 64 and name HA ) (resid 67 and name HB1 ) 3.98 2.18 0 assign (resid 68 and name HG# ) (resid 68 and name HD# ) 2.95 1.15 0 assign (resid 68 and name HA ) (resid 68 and name HG# ) 3.63 1.83 0 assign (resid 68 and name HA ) (resid 68 and name HD# ) 3.59 1.79 0 assign (resid 68 and name HG# ) (resid 68 and name HE# ) 3.42 1.62 0 assign (resid 68 and name HB# ) (resid 68 and name HE# ) 3.64 1.84 0 assign (resid 69 and name HB ) (resid 69 and name HD1#) 3.45 1.65 0 assign (resid 69 and name HB ) (resid 70 and name HN ) 3.71 1.91 0 assign (resid 70 and name HG2 ) (resid 70 and name HD# ) 2.55 0.75 0 assign (resid 70 and name HG1 ) (resid 70 and name HD# ) 2.86 1.06 0 assign (resid 70 and name HN ) (resid 70 and name HB# ) 3.24 1.44 0 assign (resid 74 and name HA ) (resid 74 and name HB# ) 2.98 1.18 0 assign (resid 76 and name HB2 ) (resid 76 and name HD2#) 3.67 1.87 0 assign (resid 2 and name HB# ) (resid 80 and name HD2#) 3.94 2.14 0 assign (resid 5 and name HG2#) (resid 43 and name HD1#) 2.91 1.11 0 assign (resid 76 and name HB1 ) (resid 76 and name HD2#) 3.75 1.95 0 assign (resid 76 and name HA ) (resid 76 and name HD1#) 3.24 1.44 0 assign (resid 72 and name HB# ) (resid 76 and name HB1 ) 3.90 2.10 0 assign (resid 78 and name HB1 ) (resid 78 and name HD2#) 3.42 1.62 0 assign (resid 78 and name HA ) (resid 78 and name HD1#) 3.25 1.45 0 assign (resid 52 and name HA ) (resid 78 and name HD1#) 3.22 1.42 0 assign (resid 50 and name HB ) (resid 79 and name HB ) 4.64 2.84 0 assign (resid 79 and name HA ) (resid 79 and name HG2#) 3.33 1.53 0 assign (resid 80 and name HA ) (resid 80 and name HG ) 3.79 1.99 0 assign (resid 80 and name HB# ) (resid 80 and name HD1#) 2.73 0.93 0 assign (resid 81 and name HB# ) (resid 82 and name HN ) 3.17 1.37 0 assign (resid 82 and name HB# ) (resid 82 and name HG# ) 2.78 0.98 0 assign (resid 82 and name HA ) (resid 82 and name HD# ) 3.14 1.34 0 assign (resid 82 and name HG# ) (resid 82 and name HD# ) 2.73 0.93 0 assign (resid 31 and name HB# ) (resid 31 and name HD# ) 3.88 2.08 0 assign (resid 82 and name HG# ) (resid 82 and name HE# ) 3.48 1.68 0 assign (resid 82 and name HA ) (resid 82 and name HG# ) 4.23 2.43 0 assign (resid 63 and name HA ) (resid 66 and name HG# ) 3.44 1.64 0 assign (resid 16 and name HB2 ) (resid 16 and name HD1 ) 4.07 2.27 0 assign (resid 17 and name HA ) (resid 17 and name HD1#) 3.11 1.31 0 assign (resid 6 and name HA ) (resid 6 and name HG2#) 3.47 1.67 0 assign (resid 33 and name HA ) (resid 34 and name HD1 ) 3.52 1.72 0 assign (resid 60 and name HA ) (resid 60 and name HG# ) 3.74 1.94 0 assign (resid 57 and name HA ) (resid 60 and name HG# ) 3.59 1.79 0 assign (resid 18 and name HB# ) (resid 30 and name HB1 ) 3.78 1.98 0 assign (resid 3 and name HE# ) (resid 5 and name HG1#) 3.30 1.50 0 assign (resid 72 and name HB# ) (resid 76 and name HD1#) 2.86 1.06 0 assign (resid 47 and name HB2 ) (resid 80 and name HD1#) 3.69 1.89 0 assign (resid 47 and name HB2 ) (resid 48 and name HN ) 4.14 2.34 0 assign (resid 36 and name HB# ) (resid 38 and name HN ) 4.55 2.75 0 assign (resid 57 and name HG2#) (resid 60 and name HB# ) 4.10 2.30 0 assign (resid 60 and name HB# ) (resid 61 and name HN ) 3.99 2.19 0 assign (resid 33 and name HA ) (resid 34 and name HD2 ) 3.66 1.86 0 assign (resid 35 and name HA1 ) (resid 36 and name HA ) 4.62 2.82 0 assign (resid 16 and name HB2 ) (resid 18 and name HG# ) 4.86 3.06 0 assign (resid 56 and name HB1 ) (resid 57 and name HN ) 4.64 2.84 0 assign (resid 22 and name HA ) (resid 61 and name HG2#) 4.51 2.71 0 assign (resid 26 and name HG1 ) (resid 48 and name HD1#) 3.81 2.01 0 assign (resid 40 and name HB2 ) (resid 41 and name HB# ) 4.40 2.60 0 assign (resid 29 and name HD1#) (resid 49 and name HG2#) 3.22 1.42 0 assign (resid 69 and name HG2#) (resid 76 and name HD1#) 3.63 1.83 0 assign (resid 19 and name HA1 ) (resid 20 and name HA2 ) 4.22 2.42 0 assign (resid 55 and name HG1#) (resid 56 and name HB1 ) 4.48 2.68 0 assign (resid 15 and name HB2 ) (resid 43 and name HD2#) 4.64 2.84 0 assign (resid 15 and name HB1 ) (resid 43 and name HD2#) 3.76 1.96 0 assign (resid 19 and name HA1 ) (resid 25 and name HB2 ) 4.40 2.60 0 assign (resid 27 and name HA ) (resid 27 and name HG ) 3.96 2.16 0 assign (resid 27 and name HA ) (resid 27 and name HD2#) 3.08 1.28 0 assign (resid 84 and name HB1 ) (resid 84 and name HG# ) 2.96 1.16 0 assign (resid 37 and name HB1 ) (resid 38 and name HA ) 4.45 2.65 0 assign (resid 72 and name HB# ) (resid 76 and name HB2 ) 4.16 2.36 0 assign (resid 48 and name HA ) (resid 48 and name HG ) 3.51 1.71 0 assign (resid 62 and name HA ) (resid 65 and name HN ) 4.71 2.91 0 assign (resid 60 and name HB# ) (resid 65 and name HB# ) 3.61 1.81 0 assign (resid 67 and name HA ) (resid 70 and name HB# ) 3.30 1.50 0 assign (resid 70 and name HA ) (resid 70 and name HG1 ) 4.06 2.26 0 assign (resid 80 and name HA ) (resid 80 and name HD2#) 3.41 1.61 0 assign (resid 78 and name HA ) (resid 78 and name HG ) 4.01 2.21 0 assign (resid 16 and name HB1 ) (resid 31 and name HN ) 3.90 2.10 0 assign (resid 57 and name HN ) (resid 60 and name HB# ) 4.42 2.62 0 assign (resid 6 and name HG2#) (resid 75 and name HB2 ) 3.77 1.97 0 assign (resid 70 and name HA ) (resid 70 and name HG2 ) 3.90 2.10 0 assign (resid 38 and name HA ) (resid 43 and name HG ) 4.40 2.60 0 assign (resid 27 and name HB2 ) (resid 57 and name HG1 ) 4.47 2.67 0 assign (resid 13 and name HB1 ) (resid 13 and name HD1 ) 3.64 1.84 0 assign (resid 13 and name HD1 ) (resid 69 and name HB ) 4.46 2.66 0 assign (resid 13 and name HD1 ) (resid 69 and name HG2#) 3.30 1.50 0 assign (resid 13 and name HD1 ) (resid 69 and name HD1#) 4.47 2.67 0 assign (resid 3 and name HE# ) (resid 80 and name HG ) 4.38 2.58 0 assign (resid 13 and name HB1 ) (resid 15 and name HN ) 4.60 2.80 0 assign (resid 45 and name HB# ) (resid 45 and name HE21) 4.63 2.83 0 assign (resid 13 and name HB2 ) (resid 15 and name HD# ) 4.09 2.29 0 assign (resid 13 and name HB2 ) (resid 45 and name HE21) 3.78 1.98 0 assign (resid 17 and name HD1#) (resid 66 and name HE21) 3.78 1.98 0 assign (resid 17 and name HD2#) (resid 66 and name HE21) 4.20 2.40 0 assign (resid 45 and name HE21) (resid 69 and name HD1#) 2.94 1.14 0 assign (resid 45 and name HE21) (resid 78 and name HD1#) 3.55 1.75 0 assign (resid 15 and name HD# ) (resid 43 and name HD2#) 3.92 2.12 0 assign (resid 45 and name HE21) (resid 78 and name HD2#) 3.51 1.71 0 assign (resid 15 and name HD# ) (resid 29 and name HD1#) 3.73 1.93 0 assign (resid 13 and name HD1 ) (resid 76 and name HD2#) 4.40 2.60 0 assign (resid 17 and name HD1#) (resid 66 and name HE22) 4.66 2.86 0 assign (resid 32 and name HD1#) (resid 44 and name HN ) 4.54 2.74 0 assign (resid 50 and name HG1#) (resid 81 and name HE21) 4.55 2.75 0 assign (resid 3 and name HD# ) (resid 80 and name HD1#) 4.23 2.43 0 assign (resid 15 and name HD# ) (resid 17 and name HD1#) 3.47 1.67 0 assign (resid 15 and name HD# ) (resid 17 and name HD2#) 3.72 1.92 0 assign (resid 13 and name HD1 ) (resid 76 and name HD1#) 4.89 3.09 0 assign (resid 32 and name HG2#) (resid 36 and name HN ) 4.57 2.77 0 assign (resid 72 and name HN ) (resid 76 and name HD1#) 4.74 2.94 0 assign (resid 50 and name HG2#) (resid 81 and name HE22) 4.74 2.94 0 assign (resid 13 and name HZ2 ) (resid 76 and name HD1#) 4.73 2.93 0 assign (resid 47 and name HN ) (resid 80 and name HD2#) 4.80 3.00 0 assign (resid 63 and name HD2#) (resid 64 and name HN ) 4.84 3.04 0 assign (resid 63 and name HD2#) (resid 67 and name HD22) 4.60 2.80 0 assign (resid 13 and name HZ2 ) (resid 76 and name HB1 ) 4.27 2.47 0 assign (resid 13 and name HZ2 ) (resid 76 and name HD2#) 4.58 2.78 0 assign (resid 13 and name HZ2 ) (resid 76 and name HB2 ) 4.72 2.92 0 assign (resid 50 and name HG1#) (resid 51 and name HN ) 4.18 2.38 0 assign (resid 52 and name HD1#) (resid 69 and name HN ) 4.30 2.50 0 assign (resid 28 and name HG2#) (resid 29 and name HN ) 3.71 1.91 0 assign (resid 4 and name HN ) (resid 5 and name HG1#) 4.33 2.53 0 assign (resid 48 and name HN ) (resid 80 and name HD1#) 4.00 2.20 0 assign (resid 78 and name HD1#) (resid 79 and name HN ) 4.05 2.25 0 assign (resid 37 and name HB1 ) (resid 38 and name HN ) 4.44 2.64 0 assign (resid 10 and name HB1 ) (resid 11 and name HN ) 4.03 2.23 0 assign (resid 13 and name HZ2 ) (resid 72 and name HB# ) 3.51 1.71 0 assign (resid 16 and name HG# ) (resid 31 and name HN ) 3.63 1.83 0 assign (resid 17 and name HB2 ) (resid 66 and name HE22) 4.38 2.58 0 assign (resid 7 and name HG ) (resid 13 and name HE3 ) 4.42 2.62 0 assign (resid 66 and name HE21) (resid 70 and name HD# ) 4.71 2.91 0 assign (resid 3 and name HN ) (resid 3 and name HD# ) 3.54 1.74 0 assign (resid 3 and name HD# ) (resid 82 and name HN ) 4.25 2.45 0 assign (resid 3 and name HD# ) (resid 4 and name HN ) 3.90 2.10 0 assign (resid 15 and name HD# ) (resid 16 and name HN ) 4.28 2.48 0 assign (resid 47 and name HN ) (resid 48 and name HN ) 4.30 2.50 0 assign (resid 31 and name HN ) (resid 32 and name HN ) 4.84 3.04 0 assign (resid 64 and name HA ) (resid 67 and name HD21) 4.65 2.85 0 assign (resid 13 and name HH2 ) (resid 73 and name HB# ) 3.99 2.19 0 assign (resid 9 and name HA1 ) (resid 13 and name HH2 ) 4.14 2.34 0 assign (resid 13 and name HZ2 ) (resid 73 and name HB# ) 4.29 2.49 0 assign (resid 21 and name HA ) (resid 25 and name HN ) 4.11 2.31 0 assign (resid 34 and name HA ) (resid 36 and name HN ) 4.47 2.67 0 assign (resid 71 and name HB1 ) (resid 72 and name HN ) 4.78 2.98 0 assign (resid 74 and name HA ) (resid 74 and name HD# ) 3.66 1.86 0 assign (resid 15 and name HD# ) (resid 29 and name HA ) 4.44 2.64 0 assign (resid 25 and name HN ) (resid 26 and name HD1 ) 4.86 3.06 0 assign (resid 28 and name HB ) (resid 47 and name HN ) 4.75 2.95 0 assign (resid 57 and name HA ) (resid 59 and name HN ) 4.64 2.84 0 assign (resid 53 and name HA ) (resid 55 and name HN ) 4.53 2.73 0 assign (resid 52 and name HA ) (resid 55 and name HN 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name HA ) 4.49 2.69 0 assign (resid 16 and name HN ) (resid 17 and name HA ) 4.65 2.85 0 assign (resid 6 and name HA ) (resid 76 and name HN ) 4.60 2.80 0 assign (resid 52 and name HN ) (resid 56 and name HA ) 4.40 2.60 0 assign (resid 4 and name HA ) (resid 79 and name HN ) 4.74 2.94 0 assign (resid 51 and name HN ) (resid 56 and name HA ) 4.39 2.59 0 assign (resid 15 and name HD# ) (resid 17 and name HG ) 4.08 2.28 0 assign (resid 15 and name HD# ) (resid 38 and name HB# ) 3.20 1.40 0 assign (resid 45 and name HE21) (resid 69 and name HG11) 4.07 2.27 0 assign (resid 2 and name HB# ) (resid 3 and name HD# ) 4.49 2.69 0 assign (resid 3 and name HD# ) (resid 80 and name HB# ) 4.78 2.98 0 assign (resid 7 and name HB# ) (resid 13 and name HZ3 ) 4.75 2.95 0 assign (resid 7 and name HG ) (resid 13 and name HZ3 ) 4.97 3.17 0 assign (resid 42 and name HB2 ) (resid 42 and name HE21) 4.52 2.72 0 assign (resid 49 and name HA ) (resid 80 and name HD2#) 3.62 1.82 0 assign (resid 49 and name HA ) (resid 80 and name HD1#) 3.98 2.18 0 assign (resid 38 and name HA ) (resid 43 and name HD2#) 3.54 1.74 0 assign (resid 32 and name HD1#) (resid 39 and name HA ) 4.35 2.55 0 assign (resid 69 and name HA ) (resid 76 and name HD1#) 3.64 1.84 0 assign (resid 50 and name HG2#) (resid 79 and name HB ) 3.67 1.87 0 assign (resid 32 and name HD1#) (resid 45 and name HA ) 4.02 2.22 0 assign (resid 26 and name HD2 ) (resid 48 and name HD1#) 3.87 2.07 0 assign (resid 5 and name HG2#) (resid 6 and name HB ) 4.12 2.32 0 assign (resid 69 and name HA ) (resid 69 and name HD1#) 4.15 2.35 0 assign (resid 66 and name HA ) (resid 69 and name HD1#) 3.48 1.68 0 assign (resid 17 and name HD2#) (resid 66 and name HA ) 4.01 2.21 0 assign (resid 32 and name HG11) (resid 38 and name HA ) 3.35 1.55 0 assign (resid 32 and name HG2#) (resid 38 and name HA ) 4.12 2.32 0 assign (resid 33 and name HG2#) (resid 36 and name HB# ) 3.76 1.96 0 assign (resid 33 and name HG2#) (resid 34 and name HD1 ) 3.33 1.53 0 assign 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name HE1 ) (resid 72 and name HB# ) 4.51 2.71 0 assign (resid 52 and name HB ) (resid 53 and name HN ) 5.04 3.24 0 assign (resid 51 and name HB# ) (resid 53 and name HN ) 4.85 3.05 0 assign (resid 20 and name HN ) (resid 25 and name HN ) 4.08 2.28 0 assign (resid 20 and name HN ) (resid 21 and name HN ) 4.45 2.65 0 assign (resid 40 and name HN ) (resid 41 and name HN ) 3.78 1.98 0 assign (resid 36 and name HN ) (resid 39 and name HN ) 4.42 2.62 0 assign (resid 60 and name HN ) (resid 61 and name HN ) 4.75 2.95 0 assign (resid 69 and name HG11) (resid 76 and name HD2#) 3.93 2.13 0 assign (resid 72 and name HB# ) (resid 76 and name HD2#) 4.16 2.36 0 assign (resid 78 and name HB2 ) (resid 78 and name HD2#) 3.38 1.58 0 assign (resid 76 and name HG ) (resid 78 and name HD2#) 3.64 1.84 0 assign (resid 7 and name HD2#) (resid 76 and name HD2#) 4.01 2.21 0 assign (resid 32 and name HD1#) (resid 38 and name HB# ) 3.62 1.82 0 assign (resid 38 and name HB# ) (resid 43 and name HD2#) 3.19 1.39 0 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and name HN ) 4.59 2.79 0 assign (resid 64 and name HN ) (resid 65 and name HB# ) 4.44 2.64 0 assign (resid 48 and name HN ) (resid 80 and name HB# ) 4.54 2.74 0 assign (resid 52 and name HD1#) (resid 68 and name HN ) 4.57 2.77 0 assign (resid 29 and name HG11) (resid 47 and name HN ) 4.85 3.05 0 assign (resid 52 and name HB ) (resid 55 and name HN ) 4.79 2.99 0 assign (resid 38 and name HB# ) (resid 39 and name HN ) 3.46 1.66 0 assign (resid 7 and name HN ) (resid 76 and name HB2 ) 4.51 2.71 0 assign (resid 29 and name HD1#) (resid 30 and name HN ) 4.63 2.83 0 assign (resid 76 and name HB1 ) (resid 77 and name HN ) 4.65 2.85 0 assign (resid 76 and name HG ) (resid 77 and name HN ) 4.20 2.40 0 assign (resid 76 and name HG ) (resid 78 and name HN ) 4.38 2.58 0 assign (resid 63 and name HD1#) (resid 67 and name HN ) 4.51 2.71 0 assign (resid 2 and name HB# ) (resid 80 and name HN ) 4.37 2.57 0 assign (resid 6 and name HG2#) (resid 7 and name HN ) 3.75 1.95 0 assign (resid 50 and name 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assign (resid 19 and name HA1 ) (resid 25 and name HB1 ) 3.23 1.43 0 assign (resid 50 and name HB ) (resid 79 and name HG2#) 3.71 1.91 0 assign (resid 26 and name HB1 ) (resid 28 and name HG2#) 3.85 2.05 0 assign (resid 43 and name HA ) (resid 43 and name HD1#) 3.26 1.46 0 assign (resid 52 and name HA ) (resid 52 and name HG1#) 3.77 1.97 0 assign (resid 20 and name HA2 ) (resid 25 and name HB1 ) 3.78 1.98 0 assign (resid 2 and name HB# ) (resid 81 and name HA ) 3.95 2.15 0 assign (resid 51 and name HB# ) (resid 56 and name HA ) 3.28 1.48 0 assign (resid 26 and name HA ) (resid 28 and name HG2#) 4.27 2.47 0 assign (resid 69 and name HA ) (resid 72 and name HB# ) 3.75 1.95 0 assign (resid 69 and name HA ) (resid 69 and name HG12) 3.71 1.91 0 assign (resid 25 and name HB1 ) (resid 26 and name HD2 ) 4.43 2.63 0 assign (resid 63 and name HG ) (resid 64 and name HA ) 4.29 2.49 0 assign (resid 63 and name HA ) (resid 63 and name HG ) 3.36 1.56 0 assign (resid 66 and name HA ) (resid 70 and name HD# ) 4.36 2.56 0 assign (resid 5 and name HA ) (resid 5 and name HG1#) 3.44 1.64 0 assign (resid 27 and name HD1#) (resid 57 and name HB ) 3.19 1.39 0 assign (resid 29 and name HG2#) (resid 30 and name HA ) 4.34 2.54 0 assign (resid 3 and name HA ) (resid 3 and name HB# ) 2.90 1.10 0 assign (resid 37 and name HA ) (resid 40 and name HB2 ) 4.56 2.76 0 assign (resid 23 and name HA ) (resid 23 and name HD# ) 3.80 2.00 0 assign (resid 52 and name HA ) (resid 53 and name HN ) 2.99 1.19 0 assign (resid 50 and name HG2#) (resid 80 and name HA ) 3.72 1.92 0 assign (resid 80 and name HA ) (resid 80 and name HD1#) 3.95 2.15 0 assign (resid 4 and name HA ) (resid 80 and name HD2#) 4.14 2.34 0 assign (resid 28 and name HA ) (resid 49 and name HG2#) 3.84 2.04 0 assign (resid 63 and name HG ) (resid 67 and name HD22) 4.19 2.39 0 assign (resid 20 and name HN ) (resid 25 and name HG# ) 4.20 2.40 0 assign (resid 13 and name HB1 ) (resid 45 and name HE21) 3.94 2.14 0 assign (resid 7 and name HB# ) (resid 76 and name HN ) 4.65 2.85 0 assign (resid 79 and name HG2#) (resid 80 and name HN ) 3.48 1.68 0 assign (resid 17 and name HD1#) (resid 18 and name HN ) 4.95 3.15 0 assign (resid 51 and name HB# ) (resid 79 and name HN ) 3.80 2.00 0 assign (resid 27 and name HN ) (resid 28 and name HG2#) 3.97 2.17 0 assign (resid 5 and name HG1#) (resid 42 and name HN ) 4.85 3.05 0 assign (resid 76 and name HN ) (resid 76 and name HG ) 4.92 3.12 0 assign (resid 33 and name HN ) (resid 33 and name HG2#) 4.19 2.39 0 assign (resid 13 and name HE1 ) (resid 69 and name HG2#) 4.54 2.74 0 assign (resid 21 and name HN ) (resid 62 and name HN ) 4.55 2.75 0 assign (resid 36 and name HB# ) (resid 39 and name HB# ) 4.16 2.36 0 assign (resid 64 and name HB1 ) (resid 68 and name HE# ) 3.69 1.89 0 assign (resid 63 and name HD2#) (resid 64 and name HA ) 4.36 2.56 0 assign (resid 50 and name HG2#) (resid 79 and name HG2#) 3.16 1.36 0 assign (resid 76 and name HD2#) (resid 78 and name HD2#) 3.61 1.81 0 assign (resid 70 and name HD# ) (resid 76 and name HD2#) 4.53 2.73 0 assign (resid 69 and name HA ) (resid 76 and name HD2#) 4.62 2.82 0 assign (resid 4 and name HA ) (resid 79 and name HG2#) 4.47 2.67 0 assign (resid 6 and name HG2#) (resid 77 and name HA ) 4.37 2.57 0 assign (resid 4 and name HA ) (resid 5 and name HG1#) 4.42 2.62 0 assign (resid 28 and name HA ) (resid 48 and name HD2#) 4.59 2.79 0 assign (resid 51 and name HA ) (resid 52 and name HG2#) 4.64 2.84 0 assign (resid 48 and name HA ) (resid 49 and name HG2#) 4.10 2.30 0 assign (resid 6 and name HG2#) (resid 76 and name HA ) 4.39 2.59 0 assign (resid 6 and name HG2#) (resid 76 and name HN ) 4.09 2.29 0 assign (resid 56 and name HD22) (resid 58 and name HN ) 4.23 2.43 0 assign (resid 50 and name HN ) (resid 79 and name HN ) 4.31 2.51 0 assign (resid 69 and name HB ) (resid 70 and name HE# ) 4.53 2.73 0 assign (resid 22 and name HN ) (resid 23 and name HD# ) 4.68 2.88 0 assign (resid 78 and name HB1 ) (resid 79 and name HN ) 3.81 2.01 0 assign (resid 84 and name HB1 ) (resid 85 and name HA ) 4.31 2.51 0 assign (resid 15 and name HB2 ) (resid 38 and name HB# ) 4.30 2.50 0 assign (resid 70 and name HG2 ) (resid 70 and name HE# ) 4.00 2.20 0 assign (resid 50 and name HG1#) (resid 79 and name HB ) 4.47 2.67 0 assign (resid 15 and name HB2 ) (resid 32 and name HD1#) 4.26 2.46 0 assign (resid 15 and name HB2 ) (resid 17 and name HD1#) 4.34 2.54 0 assign (resid 15 and name HB2 ) (resid 29 and name HD1#) 4.46 2.66 0 assign (resid 3 and name HB# ) (resid 80 and name HD2#) 4.68 2.88 0 assign (resid 26 and name HB2 ) (resid 48 and name HD2#) 3.87 2.07 0 assign (resid 47 and name HB1 ) (resid 80 and name HD2#) 4.07 2.27 0 assign (resid 15 and name HB1 ) (resid 29 and name HD1#) 4.14 2.34 0 assign (resid 5 and name HB ) (resid 43 and name HD1#) 3.94 2.14 0 assign (resid 52 and name HD1#) (resid 68 and name HB# ) 3.49 1.69 0 assign (resid 59 and name HA ) (resid 60 and name HB# ) 4.69 2.89 0 assign (resid 25 and name HB2 ) (resid 26 and name HD1 ) 3.96 2.16 0 assign (resid 63 and name HA ) (resid 63 and name HD2#) 3.83 2.03 0 assign (resid 61 and name HN ) (resid 64 and name HG# ) 4.81 3.01 0 assign (resid 29 and name HB ) (resid 46 and name HN ) 3.31 1.51 0 assign (resid 29 and name HB ) (resid 30 and name HN ) 4.19 2.39 0 assign (resid 18 and name HN ) (resid 18 and name HG# ) 3.82 2.02 0 assign (resid 53 and name HB1 ) (resid 55 and name HG2#) 4.86 3.06 0 assign (resid 60 and name HG# ) (resid 64 and name HB1 ) 3.12 1.32 0 assign (resid 51 and name HB# ) (resid 56 and name HB2 ) 4.60 2.80 0 assign (resid 15 and name HB2 ) (resid 32 and name HG2#) 5.50 3.70 0 assign (resid 2 and name HB# ) (resid 81 and name HG# ) 3.98 2.18 0 assign (resid 33 and name HG2#) (resid 34 and name HG2 ) 4.73 2.93 0 assign (resid 61 and name HG2#) (resid 64 and name HB2 ) 4.04 2.24 0 assign (resid 66 and name HB# ) (resid 66 and name HG# ) 2.52 0.72 0 assign (resid 7 and name HD2#) (resid 13 and name HB1 ) 4.81 3.01 0 assign (resid 68 and name HB# ) (resid 68 and name HD# ) 3.44 1.64 0 assign (resid 69 and name HB ) (resid 70 and name HD# ) 3.60 1.80 0 assign (resid 64 and name HG# ) (resid 65 and name HN ) 5.34 3.54 0 assign (resid 23 and name HB1 ) (resid 24 and name HN ) 5.50 3.70 0 assign (resid 47 and name HB1 ) (resid 81 and name HN ) 4.69 2.89 0 assign (resid 59 and name HG2#) (resid 60 and name HA ) 4.19 2.39 0 assign (resid 61 and name HN ) (resid 65 and name HN ) 4.73 2.93 0 assign (resid 6 and name HA ) (resid 7 and name HB# ) 4.70 2.90 0 assign (resid 41 and name HB# ) (resid 42 and name HN ) 3.70 1.90 0 assign (resid 80 and name HD2#) (resid 81 and name HN ) 4.48 2.68 0 assign (resid 3 and name HD# ) (resid 80 and name HG ) 4.76 2.96 0 assign (resid 3 and name HE# ) (resid 80 and name HD1#) 3.79 1.99 0 assign (resid 15 and name HA ) (resid 32 and name HG2#) 4.80 3.00 0 assign (resid 36 and name HB# ) (resid 39 and name HN ) 4.78 2.98 0 assign ( resid 3 and name o ) ( resid 80 and name n ) 3.0 0.5 0.5 assign ( resid 3 and name o ) ( resid 80 and name hn) 2.1 0.6 0.5 assign ( resid 80 and name o ) ( resid 3 and name n ) 3.0 0.5 0.5 assign ( resid 80 and name o ) ( resid 3 and name hn) 2.1 0.6 0.5 assign ( resid 1 and name o ) ( resid 82 and name n ) 3.0 0.5 0.5 assign ( resid 1 and name o ) ( resid 82 and name hn) 2.1 0.6 0.5 assign ( resid 78 and name o ) ( resid 5 and name n ) 3.0 0.5 0.5 assign ( resid 78 and name o ) ( resid 5 and name hn) 2.1 0.6 0.5 assign ( resid 14 and name o ) ( resid 33 and name n ) 3.0 0.5 0.5 assign ( resid 14 and name o ) ( resid 33 and name hn) 2.1 0.6 0.5 assign ( resid 28 and name o ) ( resid 18 and name n ) 3.0 0.5 0.5 assign ( resid 28 and name o ) ( resid 18 and name hn) 2.1 0.6 0.5 assign ( resid 48 and name o ) ( resid 81 and name n ) 3.0 0.5 0.5 assign ( resid 48 and name o ) ( resid 81 and name hn) 2.1 0.6 0.5
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