Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
588513 | 2mvj RC | 25270 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign ( resid 21 and name HN )
( resid 22 and name HN )
3.04 1.24 0.00 peak 2 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD1# )
( resid 21 and name HN )
6.00 4.20 0.00 peak 4 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD2# )
( resid 21 and name HN )
6.00 4.20 0.00 peak 4 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HB# )
( resid 21 and name HN )
5.00 3.20 0.00 peak 5 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB2 )
( resid 21 and name HN )
4.06 2.26 0.00 peak 6 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB1 )
( resid 21 and name HN )
3.38 1.58 0.00 peak 7 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HB2 )
( resid 21 and name HN )
5.61 3.81 0.00 peak 8 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HB1 )
( resid 21 and name HN )
4.91 3.11 0.00 peak 9 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 21 and name HN )
( resid 21 and name HA# )
2.60 0.80 0.00 peak 13 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 21 and name HN )
( resid 22 and name HA )
5.51 3.71 0.00 peak 15 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HN )
( resid 15 and name HN )
4.86 3.06 0.00 peak 18 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB1 )
( resid 13 and name HN )
4.26 2.46 0.00 peak 22 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB2 )
( resid 13 and name HN )
4.26 2.46 0.00 peak 23 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HG )
( resid 13 and name HN )
5.92 4.12 0.00 peak 24 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HA )
( resid 13 and name HN )
4.40 2.60 0.00 peak 28 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HN )
( resid 16 and name HG1# )
4.45 2.65 0.00 peak 29 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HN )
( resid 14 and name HN )
3.46 1.66 0.00 peak 30 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HA )
( resid 14 and name HN )
4.62 2.82 0.00 peak 32 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HN )
( resid 15 and name HA )
4.88 3.08 0.00 peak 35 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HN )
( resid 15 and name HG1# )
4.82 3.02 0.00 peak 38 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HN )
( resid 15 and name HG1# )
5.82 4.02 0.00 peak 39 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HD# )
( resid 5 and name HN )
4.70 2.90 0.00 peak 43 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HN )
( resid 5 and name HN )
3.29 1.49 0.00 peak 44 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HN )
( resid 6 and name HG2# )
6.00 4.20 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HN )
( resid 5 and name HG2# )
3.97 2.17 0.00 peak 48 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HN )
( resid 8 and name HB2 )
5.49 3.69 0.00 peak 51 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HB# )
( resid 5 and name HN )
3.82 2.02 0.00 peak 53 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HN )
( resid 5 and name HB )
3.36 1.56 0.00 peak 56 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HA )
( resid 22 and name HN )
4.14 2.34 0.00 peak 60 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 22 and name HN )
3.83 2.03 0.00 peak 61 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 22 and name HN )
( resid 22 and name HB# )
2.93 1.13 0.00 peak 63 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB2 )
( resid 22 and name HN )
5.43 3.63 0.00 peak 65 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB1 )
( resid 22 and name HN )
4.99 3.19 0.00 peak 66 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HN )
( resid 19 and name HN )
3.22 1.42 0.00 peak 69 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 19 and name HN )
4.36 2.56 0.00 peak 72 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 19 and name HN )
3.85 2.05 0.00 peak 73 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 19 and name HG1 )
3.34 1.54 0.00 peak 74 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 19 and name HG2 )
3.84 2.04 0.00 peak 75 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 19 and name HB1 )
3.13 1.33 0.00 peak 76 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 19 and name HB2 )
3.71 1.91 0.00 peak 77 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 19 and name HN )
6.00 4.20 0.00 peak 80 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HB# )
( resid 19 and name HN )
3.48 1.68 0.00 peak 83 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HN )
( resid 10 and name HB1 )
3.71 1.91 0.00 peak 85 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 10 and name HN )
3.48 1.68 0.00 peak 86 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 21 and name HN )
4.12 2.32 0.00 peak 89 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HN )
( resid 11 and name HB1 )
4.96 3.16 0.00 peak 93 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HN )
( resid 11 and name HB2 )
5.37 3.57 0.00 peak 94 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HN )
( resid 21 and name HN )
3.03 1.23 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HN )
( resid 22 and name HN )
4.04 2.24 0.00 peak 96 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 20 and name HN )
3.57 1.77 0.00 peak 98 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 20 and name HN )
4.08 2.28 0.00 peak 99 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 20 and name HN )
4.75 2.95 0.00 peak 100 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HG2 )
( resid 20 and name HN )
4.79 2.99 0.00 peak 102 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HB1 )
( resid 20 and name HN )
2.87 1.07 0.00 peak 103 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HB2 )
( resid 20 and name HN )
3.50 1.70 0.00 peak 104 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 20 and name HN )
6.00 4.20 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG2# )
( resid 20 and name HN )
4.60 2.80 0.00 peak 108 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HN )
( resid 4 and name HD# )
3.43 1.63 0.00 peak 112 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HN )
( resid 17 and name HN )
3.34 1.54 0.00 peak 114 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 17 and name HN )
4.97 3.17 0.00 peak 115 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HN )
4.56 2.76 0.00 peak 117 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 12 and name HN )
5.37 3.57 0.00 peak 120 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HB1 )
( resid 12 and name HN )
3.88 2.08 0.00 peak 122 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 12 and name HG )
4.23 2.43 0.00 peak 123 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 12 and name HB1 )
3.71 1.91 0.00 peak 124 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HB )
( resid 17 and name HN )
4.06 2.26 0.00 peak 127 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 17 and name HB1 )
2.81 1.01 0.00 peak 128 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 17 and name HB2 )
3.96 2.16 0.00 peak 129 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 17 and name HG1 )
4.42 2.62 0.00 peak 129 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 17 and name HG2 )
4.42 2.62 0.00 peak 130 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 18 and name HB# )
5.17 3.37 0.00 peak 131 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 17 and name HN )
3.91 2.11 0.00 peak 132 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG2# )
( resid 17 and name HN )
3.77 1.97 0.00 peak 133 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HB# )
( resid 4 and name HN )
3.55 1.75 0.00 peak 137 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HN )
( resid 4 and name HB# )
3.04 1.24 0.00 peak 138 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HA )
( resid 12 and name HN )
5.07 3.27 0.00 peak 140 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 13 and name HA1 )
5.70 3.90 0.00 peak 141 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 18 and name HA )
5.36 3.56 0.00 peak 142 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 17 and name HN )
4.67 2.87 0.00 peak 143 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 17 and name HD# )
4.72 2.92 0.00 peak 144 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 15 and name HD1# )
6.00 4.20 0.00 peak 149 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 12 and name HB2 )
3.71 1.91 0.00 peak 150 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HD1# )
( resid 16 and name HN )
5.10 3.30 0.00 peak 155 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 16 and name HN )
3.72 1.92 0.00 peak 156 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HN )
( resid 16 and name HG2# )
3.79 1.99 0.00 peak 157 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HN )
( resid 16 and name HG1# )
3.04 1.24 0.00 peak 158 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG1# )
( resid 16 and name HN )
5.58 3.78 0.00 peak 159 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HN )
( resid 16 and name HB )
3.10 1.30 0.00 peak 162 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HA1 )
( resid 16 and name HN )
4.56 2.76 0.00 peak 164 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 16 and name HN )
3.65 1.85 0.00 peak 166 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 22 and name HA )
( resid 23 and name HN )
3.56 1.76 0.00 peak 168 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HA )
( resid 23 and name HN )
4.29 2.49 0.00 peak 169 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 23 and name HN )
5.42 3.62 0.00 peak 170 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 21 and name HA# )
( resid 23 and name HN )
4.31 2.51 0.00 peak 171 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 22 and name HB# )
( resid 23 and name HN )
3.53 1.73 0.00 peak 172 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HN )
( resid 23 and name HB2 )
3.53 1.73 0.00 peak 173 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HN )
( resid 23 and name HB1 )
3.53 1.73 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB2 )
( resid 23 and name HN )
5.86 4.06 0.00 peak 176 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HN )
( resid 3 and name HD# )
4.53 2.73 0.00 peak 180 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HN )
( resid 4 and name HN )
4.23 2.43 0.00 peak 181 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HN )
( resid 4 and name HD# )
5.87 4.07 0.00 peak 183 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 8 and name HN )
4.25 2.45 0.00 peak 185 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HN )
( resid 3 and name HB# )
3.38 1.58 0.00 peak 188 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 8 and name HB2 )
2.84 1.04 0.00 peak 194 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 8 and name HB1 )
3.13 1.33 0.00 peak 194 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HG1 )
( resid 8 and name HN )
4.21 2.41 0.00 peak 196 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 9 and name HB# )
4.63 2.83 0.00 peak 196 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 8 and name HD2# )
4.48 2.68 0.00 peak 197 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 8 and name HD1# )
4.48 2.68 0.00 peak 198 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 11 and name HB2 )
5.51 3.71 0.00 peak 199 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HG2# )
( resid 8 and name HN )
5.43 3.63 0.00 peak 200 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 11 and name HB1 )
5.47 3.67 0.00 peak 204 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 9 and name HA )
4.84 3.04 0.00 peak 206 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 21 and name HA# )
( resid 24 and name HN )
6.00 4.20 0.00 peak 211 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 24 and name HN )
( resid 24 and name HD# )
4.51 2.71 0.00 peak 212 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HB1 )
( resid 24 and name HN )
4.03 2.23 0.00 peak 213 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HG2# )
( resid 7 and name HN )
4.07 2.27 0.00 peak 217 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HN )
( resid 7 and name HG2 )
4.87 3.07 0.00 peak 218 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HN )
( resid 7 and name HB1 )
3.92 2.12 0.00 peak 220 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 7 and name HN )
4.98 3.18 0.00 peak 224 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HB )
( resid 7 and name HN )
5.38 3.58 0.00 peak 225 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 12 and name HN )
3.48 1.68 0.00 peak 228 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 11 and name HD# )
4.24 2.44 0.00 peak 229 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 18 and name HN )
3.30 1.50 0.00 peak 233 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HN )
( resid 18 and name HN )
4.12 2.32 0.00 peak 235 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HN )
( resid 9 and name HN )
5.70 3.90 0.00 peak 236 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 12 and name HN )
5.32 3.52 0.00 peak 237 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HA )
( resid 9 and name HN )
4.67 2.87 0.00 peak 239 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HB1 )
( resid 9 and name HN )
4.21 2.41 0.00 peak 243 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HB2 )
( resid 9 and name HN )
3.49 1.69 0.00 peak 244 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 9 and name HB# )
2.90 1.10 0.00 peak 246 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HG2# )
( resid 9 and name HN )
5.28 3.48 0.00 peak 247 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 12 and name HD1# )
6.00 4.20 0.00 peak 249 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 12 and name HD2# )
6.00 4.20 0.00 peak 249 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 11 and name HN )
3.71 1.91 0.00 peak 253 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HA )
( resid 11 and name HN )
5.70 3.90 0.00 peak 255 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 12 and name HA )
5.71 3.91 0.00 peak 256 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 11 and name HB1 )
2.97 1.17 0.00 peak 257 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 11 and name HB2 )
3.07 1.27 0.00 peak 258 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HB1 )
( resid 11 and name HN )
3.12 1.32 0.00 peak 259 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HG1 )
( resid 11 and name HN )
5.56 3.76 0.00 peak 261 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HB# )
( resid 11 and name HN )
4.70 2.90 0.00 peak 262 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HN )
( resid 18 and name HB# )
2.61 0.81 0.00 peak 269 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 18 and name HN )
5.92 4.12 0.00 peak 271 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HN )
( resid 19 and name HG1 )
4.58 2.78 0.00 peak 274 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 18 and name HN )
4.60 2.80 0.00 peak 275 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 18 and name HN )
3.83 2.03 0.00 peak 276 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 7 and name HN )
3.25 1.45 0.00 peak 280 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HN )
( resid 6 and name HN )
3.44 1.64 0.00 peak 281 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HB )
( resid 6 and name HN )
3.48 1.68 0.00 peak 284 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 6 and name HN )
4.85 3.05 0.00 peak 285 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 6 and name HN )
5.27 3.47 0.00 peak 286 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 6 and name HB )
3.18 1.38 0.00 peak 287 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 6 and name HG1# )
3.32 1.52 0.00 peak 288 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 6 and name HG1# )
4.63 2.83 0.00 peak 289 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 6 and name HG2# )
3.92 2.12 0.00 peak 290 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HN )
( resid 6 and name HD1# )
4.22 2.42 0.00 peak 291 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 16 and name HN )
3.17 1.37 0.00 peak 295 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HN )
( resid 15 and name HN )
3.21 1.41 0.00 peak 296 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 15 and name HB )
3.10 1.30 0.00 peak 299 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 15 and name HG1# )
3.38 1.58 0.00 peak 300 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 16 and name HG1# )
4.64 2.84 0.00 peak 301 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 15 and name HG1# )
3.83 2.03 0.00 peak 302 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 15 and name HG2# )
3.82 2.02 0.00 peak 304 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 15 and name HD1# )
4.15 2.35 0.00 peak 305 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 16 and name HB )
5.23 3.43 0.00 peak 306 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HN )
( resid 16 and name HA )
4.99 3.19 0.00 peak 309 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HA1 )
( resid 15 and name HN )
5.53 3.73 0.00 peak 310 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 24 and name HA )
( resid 25 and name HN )
3.17 1.37 0.00 peak 312 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 15 and name HN )
5.79 3.99 0.00 peak 315 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 8 and name HN )
4.94 3.14 0.00 peak 319 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HB2 )
( resid 12 and name HN )
3.42 1.62 0.00 peak 321 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 22 and name HB# )
4.43 2.63 0.00 peak 322 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HB1 )
( resid 18 and name HA )
5.00 3.20 0.00 peak 1 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 18 and name HA )
4.56 2.76 0.00 peak 2 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HA )
( resid 23 and name HD# )
5.76 3.96 0.00 peak 8 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 15 and name HB )
3.98 2.18 0.00 peak 17 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HA )
6.00 4.20 0.00 peak 18 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HA )
( resid 23 and name HD# )
3.79 1.99 0.00 peak 19 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 11 and name HD# )
4.71 2.91 0.00 peak 22 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 11 and name HB2 )
3.62 1.82 0.00 peak 23 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 3 and name HD# )
3.85 2.05 0.00 peak 27 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 4 and name HD# )
3.91 2.11 0.00 peak 28 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 4 and name HE# )
6.00 4.20 0.00 peak 29 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 6 and name HG1# )
5.90 4.10 0.00 peak 33 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 4 and name HB# )
2.82 1.02 0.00 peak 40 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HA )
( resid 5 and name HG2# )
6.00 4.20 0.00 peak 45 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 22 and name HB# )
4.41 2.61 0.00 peak 47 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HB# )
( resid 19 and name HA )
4.41 2.61 0.00 peak 52 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HA )
( resid 11 and name HA )
5.07 3.27 0.00 peak 59 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HA )
( resid 11 and name HD# )
3.59 1.79 0.00 peak 65 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HB1 )
( resid 11 and name HA )
4.60 2.80 0.00 peak 68 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 6 and name HB )
4.21 2.41 0.00 peak 69 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HB2 )
( resid 11 and name HA )
6.00 4.20 0.00 peak 70 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 16 and name HA )
6.00 4.20 0.00 peak 94 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 19 and name HA )
6.00 4.20 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HB )
( resid 6 and name HG1# )
4.18 2.38 0.00 peak 98 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HB )
( resid 6 and name HA )
4.60 2.80 0.00 peak 102 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HB# )
( resid 5 and name HB )
6.00 4.20 0.00 peak 103 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 15 and name HD1# )
3.94 2.14 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HA )
( resid 6 and name HD1# )
4.98 3.18 0.00 peak 114 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HD1# )
( resid 10 and name HE# )
6.00 4.20 0.00 peak 121 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 15 and name HG2# )
5.42 3.62 0.00 peak 122 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 15 and name HG2# )
4.40 2.60 0.00 peak 123 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 15 and name HG1# )
3.26 1.46 0.00 peak 129 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 18 and name HB# )
3.25 1.45 0.00 peak 140 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB1 )
( resid 16 and name HG1# )
4.80 3.00 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD2# )
( resid 11 and name HD# )
4.34 2.54 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD1# )
( resid 11 and name HD# )
4.34 2.54 0.00 peak 181 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HG )
4.53 2.73 0.00 peak 205 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 12 and name HG )
4.04 2.24 0.00 peak 208 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HG )
( resid 9 and name HA )
4.19 2.39 0.00 peak 210 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HD# )
( resid 24 and name HG1 )
6.00 4.20 0.00 peak 221 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HD# )
( resid 24 and name HG2 )
6.00 4.20 0.00 peak 221 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 6 and name HG1# )
3.54 1.74 0.00 peak 222 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 15 and name HG1# )
5.53 3.73 0.00 peak 225 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 15 and name HG1# )
5.38 3.58 0.00 peak 226 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 15 and name HG1# )
3.44 1.64 0.00 peak 233 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HB# )
( resid 19 and name HG2 )
4.75 2.95 0.00 peak 247 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 18 and name HB# )
( resid 19 and name HG1 )
4.45 2.65 0.00 peak 248 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 19 and name HG1 )
4.64 2.84 0.00 peak 254 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 19 and name HG2 )
3.86 2.06 0.00 peak 257 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 19 and name HG2 )
6.00 4.20 0.00 peak 258 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 19 and name HG2 )
5.10 3.30 0.00 peak 259 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 19 and name HB2 )
4.89 3.09 0.00 peak 267 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HG2# )
( resid 7 and name HB2 )
5.64 3.84 0.00 peak 271 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 2 and name HB# )
( resid 4 and name HE# )
4.94 3.14 0.00 peak 278 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HB2 )
( resid 11 and name HD# )
6.00 4.20 0.00 peak 333 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HB1 )
( resid 11 and name HD# )
6.00 4.20 0.00 peak 333 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HA1 )
( resid 16 and name HB )
4.41 2.61 0.00 peak 334 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HA1 )
( resid 16 and name HG1# )
4.33 2.53 0.00 peak 335 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HA1 )
( resid 16 and name HG2# )
5.46 3.66 0.00 peak 336 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HA# )
( resid 17 and name HB1 )
4.07 2.27 0.00 peak 338 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB2 )
( resid 21 and name HA# )
6.00 4.20 0.00 peak 339 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD1# )
( resid 21 and name HA# )
6.00 4.20 0.00 peak 340 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD2# )
( resid 21 and name HA# )
6.00 4.20 0.00 peak 340 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HD1# )
4.41 2.61 0.00 peak 351 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HB2 )
( resid 12 and name HG )
6.00 4.20 0.00 peak 356 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 8 and name HD1# )
3.93 2.13 0.00 peak 357 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 15 and name HD1# )
4.22 2.42 0.00 peak 2 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 15 and name HD1# )
3.11 1.31 0.00 peak 3 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HB )
( resid 15 and name HD1# )
2.86 1.06 0.00 peak 5 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 15 and name HD1# )
3.02 1.22 0.00 peak 8 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HD1# )
( resid 16 and name HA )
5.59 3.79 0.00 peak 14 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HB2 )
( resid 15 and name HD1# )
5.25 3.45 0.00 peak 15 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HD1# )
( resid 19 and name HG1 )
6.00 4.20 0.00 peak 16 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 6 and name HD1# )
3.51 1.71 0.00 peak 20 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HB# )
( resid 6 and name HD1# )
3.89 2.09 0.00 peak 22 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HB )
( resid 6 and name HD1# )
2.82 1.02 0.00 peak 24 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HB )
( resid 6 and name HD1# )
4.68 2.88 0.00 peak 26 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 6 and name HD1# )
3.80 2.00 0.00 peak 27 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HB# )
( resid 6 and name HG2# )
5.77 3.97 0.00 peak 32 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HG2# )
( resid 7 and name HA )
3.71 1.91 0.00 peak 35 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 6 and name HG2# )
3.04 1.24 0.00 peak 36 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 15 and name HG2# )
2.77 0.97 0.00 peak 41 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 16 and name HA )
3.76 1.96 0.00 peak 42 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 19 and name HG2 )
3.71 1.91 0.00 peak 44 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 9 and name HB# )
2.85 1.05 0.00 peak 59 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HD# )
( resid 18 and name HB# )
5.80 4.00 0.00 peak 62 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HB# )
( resid 10 and name HE# )
4.72 2.92 0.00 peak 63 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HD1# )
( resid 18 and name HB# )
5.66 3.86 0.00 peak 67 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HG2# )
( resid 9 and name HB# )
5.29 3.49 0.00 peak 69 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HE# )
( resid 5 and name HB )
4.29 2.49 0.00 peak 72 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HA )
( resid 1 and name HE# )
4.87 3.07 0.00 peak 73 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HE# )
( resid 5 and name HA )
5.77 3.97 0.00 peak 74 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HE# )
( resid 5 and name HG2# )
3.82 2.02 0.00 peak 80 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 17 and name HA )
3.85 2.05 0.00 peak 85 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 16 and name HG1# )
3.25 1.45 0.00 peak 86 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG1# )
( resid 19 and name HG1 )
6.00 4.20 0.00 peak 87 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 20 and name HD2# )
5.82 4.02 0.00 peak 92 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HA )
( resid 5 and name HG2# )
2.98 1.18 0.00 peak 98 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG2# )
( resid 19 and name HG1 )
6.00 4.20 0.00 peak 101 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 16 and name HG2# )
2.94 1.14 0.00 peak 104 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HG2# )
( resid 17 and name HD# )
5.47 3.67 0.00 peak 107 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HG# )
( resid 5 and name HG2# )
5.48 3.68 0.00 peak 111 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HD# )
( resid 5 and name HG2# )
5.99 4.19 0.00 peak 114 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HE# )
( resid 5 and name HG2# )
6.00 4.20 0.00 peak 115 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HB )
( resid 16 and name HG1# )
5.07 3.27 0.00 peak 133 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB1 )
( resid 12 and name HD2# )
3.52 1.72 0.00 peak 136 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HB2 )
( resid 20 and name HD2# )
2.77 0.97 0.00 peak 139 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HD1# )
( resid 16 and name HG1# )
5.74 3.94 0.00 peak 143 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HD2# )
4.41 2.61 0.00 peak 146 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HD# )
( resid 8 and name HD1# )
5.84 4.04 0.00 peak 148 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HE# )
( resid 8 and name HD1# )
6.00 4.20 0.00 peak 150 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HD# )
( resid 8 and name HD2# )
5.84 4.04 0.00 peak 152 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HE# )
( resid 8 and name HD2# )
6.00 4.20 0.00 peak 153 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 16 and name HA )
( resid 20 and name HD1# )
5.82 4.02 0.00 peak 157 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 8 and name HD2# )
3.93 2.13 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HE# )
( resid 8 and name HD1# )
5.56 3.76 0.00 peak 164 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 17 and name HG1 )
4.00 2.20 0.00 peak 198 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HG1 )
( resid 17 and name HD# )
2.84 1.04 0.00 peak 199 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 17 and name HG2 )
4.00 2.20 0.00 peak 201 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HG2 )
( resid 17 and name HD# )
2.84 1.04 0.00 peak 202 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HA )
( resid 8 and name HG )
5.99 4.19 0.00 peak 203 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 15 and name HG1# )
3.46 1.66 0.00 peak 212 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HA )
( resid 15 and name HG1# )
3.50 1.70 0.00 peak 213 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 20 and name HG )
6.00 4.20 0.00 peak 214 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 6 and name HG1# )
3.64 1.84 0.00 peak 222 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HD# )
( resid 20 and name HD1# )
5.84 4.04 0.00 peak 247 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB1 )
( resid 12 and name HD1# )
3.52 1.72 0.00 peak 257 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB2 )
( resid 12 and name HD1# )
3.52 1.72 0.00 peak 258 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 20 and name HB2 )
5.30 3.50 0.00 peak 261 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HG2# )
( resid 8 and name HB1 )
6.00 4.20 0.00 peak 262 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HB1 )
6.00 4.20 0.00 peak 266 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HB# )
( resid 6 and name HB )
4.73 2.93 0.00 peak 280 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 3 and name HA )
( resid 3 and name HB# )
2.82 1.02 0.00 peak 288 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 11 and name HB1 )
4.15 2.35 0.00 peak 293 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HA )
( resid 6 and name HB )
3.02 1.22 0.00 peak 307 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HA )
( resid 19 and name HG1 )
3.36 1.56 0.00 peak 317 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 15 and name HG2# )
( resid 19 and name HG1 )
3.58 1.78 0.00 peak 320 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 1 and name HB# )
( resid 1 and name HG# )
2.79 0.99 0.00 peak 335 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 2 and name HB# )
( resid 5 and name HG2# )
4.85 3.05 0.00 peak 363 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 6 and name HG2# )
( resid 10 and name HB1 )
5.05 3.25 0.00 peak 365 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HD# )
( resid 8 and name HD# )
4.63 2.83 0.00 peak 148 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 4 and name HE# )
( resid 8 and name HD# )
4.98 3.18 0.00 peak 150 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 5 and name HA )
( resid 8 and name HD# )
4.05 2.25 0.00 peak 184 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 7 and name HE# )
( resid 8 and name HD# )
4.51 2.71 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HN )
( resid 8 and name HD# )
3.86 2.06 0.00 peak 197 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HA )
( resid 8 and name HD# )
3.15 1.35 0.00 peak 161 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD# )
( resid 9 and name HA )
4.52 2.72 0.00 peak 176 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD# )
( resid 11 and name HN )
5.75 3.95 0.00 peak 264 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD# )
( resid 11 and name HA )
5.59 3.79 0.00 peak 169 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD# )
( resid 11 and name HB1 )
4.41 2.61 0.00 peak 284 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 8 and name HD# )
( resid 11 and name HD# )
3.69 1.89 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HN )
( resid 12 and name HD# )
5.11 3.31 0.00 peak 249 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 9 and name HA )
( resid 12 and name HD# )
3.83 2.03 0.00 peak 4 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 10 and name HG# )
( resid 11 and name HN )
4.81 3.01 0.00 peak 261 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 12 and name HB# )
5.73 3.93 0.00 peak 263 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HN )
( resid 12 and name HD# )
4.68 2.88 0.00 peak 265 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HB1 )
( resid 12 and name HD# )
4.75 2.95 0.00 peak 171 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 11 and name HD# )
( resid 12 and name HD# )
3.10 1.30 0.00 peak 146 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 12 and name HB# )
3.24 1.44 0.00 peak 150 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 12 and name HD# )
3.64 1.84 0.00 peak 118 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 9 and name HA )
3.93 2.13 0.00 peak 325 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HN )
( resid 11 and name HA )
3.80 2.00 0.00 peak 119 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HA )
( resid 12 and name HD# )
2.62 0.82 0.00 peak 89 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB# )
( resid 12 and name HD# )
1.56 -0.24 0.00 peak 136 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB2 )
( resid 12 and name HD2# )
3.52 1.72 0.00 peak 136 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB# )
( resid 13 and name HN )
3.71 1.91 0.00 peak 23 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB# )
( resid 13 and name HA1 )
5.81 4.01 0.00 peak 337 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HB# )
( resid 15 and name HD1# )
5.81 4.01 0.00 peak 354 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HD# )
( resid 15 and name HN )
4.75 2.95 0.00 peak 303 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 12 and name HD# )
( resid 15 and name HD1# )
2.83 1.03 0.00 peak 7 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 13 and name HN )
( resid 11 and name HA )
5.26 3.46 0.00 peak 327 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 14 and name HN )
( resid 10 and name HA )
4.12 2.32 0.00 peak 41 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HA )
( resid 17 and name HG# )
3.35 1.55 0.00 peak 201 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HB1 )
( resid 20 and name HD# )
5.60 3.80 0.00 peak 381 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HG# )
( resid 17 and name HD# )
2.41 0.61 0.00 peak 202 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HG# )
( resid 18 and name HA )
5.81 4.01 0.00 peak 200 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HD# )
( resid 20 and name HD# )
4.49 2.69 0.00 peak 247 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 17 and name HN )
( resid 13 and name HA1 )
5.88 4.08 0.00 peak 318 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HN )
( resid 20 and name HD# )
4.90 3.10 0.00 peak 79 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HB2 )
( resid 20 and name HD# )
4.96 3.16 0.00 peak 347 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 19 and name HG1 )
( resid 20 and name HD# )
5.83 4.03 0.00 peak 95 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HA )
( resid 20 and name HD# )
2.51 0.71 0.00 peak 91 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HA )
( resid 23 and name HB# )
5.24 3.44 0.00 peak 9 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD# )
( resid 21 and name HN )
5.23 3.43 0.00 peak 4 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD# )
( resid 22 and name HN )
5.65 3.85 0.00 peak 64 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD# )
( resid 23 and name HN )
5.44 3.64 0.00 peak 175 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD# )
( resid 23 and name HB# )
3.74 1.94 0.00 peak 94 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 20 and name HD# )
( resid 23 and name HD# )
5.56 3.76 0.00 peak 147 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HN )
( resid 23 and name HB# )
2.86 1.06 0.00 peak 174 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 23 and name HN )
( resid 24 and name HG# )
5.81 4.01 0.00 peak 176 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 24 and name HN )
( resid 24 and name HB# )
3.16 1.36 0.00 peak 215 volume 0.00 ppm1 0.000 ppm2 0.000
assign ( resid 24 and name HN )
( resid 24 and name HG# )
3.57 1.77 0.00 peak 216 volume 0.00 ppm1 0.000 ppm2 0.000