NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
|
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572360 |
2mh3   |
19614 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
assign ( resid 55 and name HN ) ( resid 56 and name HG2 ) 4.79 4.79 0.00 peak 2 assign ( resid 155 and name HN ) ( resid 156 and name HG2 ) 4.79 4.79 0.00 peak 2 assign ( resid 55 and name HN ) ( resid 56 and name HB+ ) 5.14 5.14 0.00 peak 3 assign ( resid 155 and name HN ) ( resid 156 and name HB+ ) 5.14 5.14 0.00 peak 3 assign ( resid 54 and name HB1 ) ( resid 55 and name HN ) 3.81 3.81 0.00 peak 4 assign ( resid 154 and name HB1 ) ( resid 155 and name HN ) 3.81 3.81 0.00 peak 4 assign ( resid 55 and name HN ) ( resid 55 and name HB+ ) 3.09 3.09 0.00 peak 6 assign ( resid 155 and name HN ) ( resid 155 and name HB+ ) 3.09 3.09 0.00 peak 6 assign ( resid 54 and name HN ) ( resid 55 and name HN ) 3.90 3.90 0.00 peak 7 assign ( resid 154 and name HN ) ( resid 155 and name HN ) 3.90 3.90 0.00 peak 7 assign ( resid 73 and name HB+ ) ( resid 74 and name HN ) 3.96 3.96 0.00 peak 56 assign ( resid 173 and name HB+ ) ( resid 174 and name HN ) 3.96 3.96 0.00 peak 56 assign ( resid 74 and name HN ) ( resid 74 and name HE+ ) 4.72 4.72 0.00 peak 58 assign ( resid 174 and name HN ) ( resid 174 and name HE+ ) 4.72 4.72 0.00 peak 58 assign ( resid 36 and name HN ) ( resid 37 and name HA ) 5.25 5.25 0.00 peak 74 assign ( resid 136 and name HN ) ( resid 137 and name HA ) 5.25 5.25 0.00 peak 74 assign ( resid 36 and name HN ) ( resid 37 and name HB+ ) 5.07 5.07 0.00 peak 77 assign ( resid 136 and name HN ) ( resid 137 and name HB+ ) 5.07 5.07 0.00 peak 77 assign ( resid 36 and name HN ) ( resid 36 and name HG+ ) 4.40 4.40 0.00 peak 79 assign ( resid 136 and name HN ) ( resid 136 and name HG+ ) 4.40 4.40 0.00 peak 79 assign ( resid 87 and name HN ) ( resid 88 and name HN ) 4.07 4.07 0.00 peak 83 assign ( resid 187 and name HN ) ( resid 188 and name HN ) 4.07 4.07 0.00 peak 83 assign ( resid 36 and name HA ) ( resid 37 and name HN ) 2.94 2.94 0.00 peak 87 assign ( resid 136 and name HA ) ( resid 137 and name HN ) 2.94 2.94 0.00 peak 87 assign ( resid 88 and name HN ) ( resid 89 and name HD+ ) 4.02 4.02 0.00 peak 89 assign ( resid 188 and name HN ) ( resid 189 and name HD+ ) 4.02 4.02 0.00 peak 89 assign ( resid 36 and name HB+ ) ( resid 37 and name HN ) 3.78 3.78 0.00 peak 91 assign ( resid 136 and name HB+ ) ( resid 137 and name HN ) 3.78 3.78 0.00 peak 91 assign ( resid 36 and name HG+ ) ( resid 37 and name HN ) 4.17 4.17 0.00 peak 93 assign ( resid 136 and name HG+ ) ( resid 137 and name HN ) 4.17 4.17 0.00 peak 93 assign ( resid 84 and name HG2+ ) ( resid 88 and name HN ) 5.27 5.27 0.00 peak 94 assign ( resid 184 and name HG2+ ) ( resid 188 and name HN ) 5.27 5.27 0.00 peak 94 assign ( resid 70 and name HN ) ( resid 71 and name HN ) 4.03 4.03 0.00 peak 97 assign ( resid 170 and name HN ) ( resid 171 and name HN ) 4.03 4.03 0.00 peak 97 assign ( resid 68 and name HA ) ( resid 70 and name HN ) 4.39 4.39 0.00 peak 100 assign ( resid 168 and name HA ) ( resid 170 and name HN ) 4.39 4.39 0.00 peak 100 assign ( resid 37 and name HA ) ( resid 38 and name HN ) 3.31 3.31 0.00 peak 101 assign ( resid 137 and name HA ) ( resid 138 and name HN ) 3.31 3.31 0.00 peak 101 assign ( resid 38 and name HN ) ( resid 38 and name HB+ ) 3.40 3.40 0.00 peak 103 assign ( resid 138 and name HN ) ( resid 138 and name HB+ ) 3.40 3.40 0.00 peak 103 assign ( resid 39 and name HN ) ( resid 39 and name HE+ ) 5.18 5.18 0.00 peak 106 assign ( resid 139 and name HN ) ( resid 139 and name HE+ ) 5.18 5.18 0.00 peak 106 assign ( resid 39 and name HN ) ( resid 43 and name HG+ ) 5.45 5.45 0.00 peak 108 assign ( resid 139 and name HN ) ( resid 143 and name HG+ ) 5.45 5.45 0.00 peak 108 assign ( resid 39 and name HN ) ( resid 43 and name HB+ ) 4.62 4.62 0.00 peak 109 assign ( resid 139 and name HN ) ( resid 143 and name HB+ ) 4.62 4.62 0.00 peak 109 assign ( resid 39 and name HN ) ( resid 39 and name HG1 ) 4.03 4.03 0.00 peak 111 assign ( resid 139 and name HN ) ( resid 139 and name HG1 ) 4.03 4.03 0.00 peak 111 assign ( resid 38 and name HA ) ( resid 39 and name HN ) 3.27 3.27 0.00 peak 114 assign ( resid 138 and name HA ) ( resid 139 and name HN ) 3.27 3.27 0.00 peak 114 assign ( resid 38 and name HB+ ) ( resid 39 and name HN ) 4.00 4.00 0.00 peak 116 assign ( resid 138 and name HB+ ) ( resid 139 and name HN ) 4.00 4.00 0.00 peak 116 assign ( resid 39 and name HN ) ( resid 41 and name HN ) 5.50 5.50 0.00 peak 118 assign ( resid 139 and name HN ) ( resid 141 and name HN ) 5.50 5.50 0.00 peak 118 assign ( resid 60 and name HN ) ( resid 61 and name HN ) 4.16 4.16 0.00 peak 119 assign ( resid 160 and name HN ) ( resid 161 and name HN ) 4.16 4.16 0.00 peak 119 assign ( resid 41 and name HN ) ( resid 42 and name HG+ ) 4.87 4.87 0.00 peak 127 assign ( resid 141 and name HN ) ( resid 142 and name HG+ ) 4.87 4.87 0.00 peak 127 assign ( resid 60 and name HN ) ( resid 63 and name HB2 ) 5.50 5.50 0.00 peak 127 assign ( resid 160 and name HN ) ( resid 163 and name HB2 ) 5.50 5.50 0.00 peak 127 assign ( resid 41 and name HN ) ( resid 41 and name HB ) 3.10 3.10 0.00 peak 129 assign ( resid 141 and name HN ) ( resid 141 and name HB ) 3.10 3.10 0.00 peak 129 assign ( resid 41 and name HN ) ( resid 41 and name HG12 ) 4.61 4.61 0.00 peak 130 assign ( resid 141 and name HN ) ( resid 141 and name HG12 ) 4.61 4.61 0.00 peak 130 assign ( resid 42 and name HN ) ( resid 42 and name HG+ ) 3.60 3.60 0.00 peak 135 assign ( resid 142 and name HN ) ( resid 142 and name HG+ ) 3.60 3.60 0.00 peak 135 assign ( resid 42 and name HN ) ( resid 42 and name HB+ ) 3.11 3.11 0.00 peak 136 assign ( resid 142 and name HN ) ( resid 142 and name HB+ ) 3.11 3.11 0.00 peak 136 assign ( resid 41 and name HG2+ ) ( resid 42 and name HN ) 3.55 3.55 0.00 peak 140 assign ( resid 141 and name HG2+ ) ( resid 142 and name HN ) 3.55 3.55 0.00 peak 140 assign ( resid 41 and name HN ) ( resid 42 and name HN ) 3.68 3.68 0.00 peak 146 assign ( resid 141 and name HN ) ( resid 142 and name HN ) 3.68 3.68 0.00 peak 146 assign ( resid 74 and name HN ) ( resid 75 and name HN ) 3.89 3.89 0.00 peak 147 assign ( resid 174 and name HN ) ( resid 175 and name HN ) 3.89 3.89 0.00 peak 147 assign ( resid 52 and name HN ) ( resid 52 and name HB+ ) 3.36 3.36 0.00 peak 156 assign ( resid 152 and name HN ) ( resid 152 and name HB+ ) 3.36 3.36 0.00 peak 156 assign ( resid 50 and name HG2+ ) ( resid 52 and name HN ) 5.50 5.50 0.00 peak 158 assign ( resid 150 and name HG2+ ) ( resid 152 and name HN ) 5.50 5.50 0.00 peak 158 assign ( resid 43 and name HN ) ( resid 44 and name HN ) 3.62 3.62 0.00 peak 159 assign ( resid 143 and name HN ) ( resid 144 and name HN ) 3.62 3.62 0.00 peak 159 assign ( resid 44 and name HN ) ( resid 45 and name HD+ ) 5.00 5.00 0.00 peak 164 assign ( resid 144 and name HN ) ( resid 145 and name HD+ ) 5.00 5.00 0.00 peak 164 assign ( resid 42 and name HG+ ) ( resid 44 and name HN ) 5.50 5.50 0.00 peak 167 assign ( resid 142 and name HG+ ) ( resid 144 and name HN ) 5.50 5.50 0.00 peak 167 assign ( resid 43 and name HG+ ) ( resid 44 and name HN ) 4.08 4.08 0.00 peak 168 assign ( resid 143 and name HG+ ) ( resid 144 and name HN ) 4.08 4.08 0.00 peak 168 assign ( resid 44 and name HN ) ( resid 44 and name HB+ ) 3.12 3.12 0.00 peak 169 assign ( resid 144 and name HN ) ( resid 144 and name HB+ ) 3.12 3.12 0.00 peak 169 assign ( resid 50 and name HN ) ( resid 50 and name HB ) 3.51 3.51 0.00 peak 169 assign ( resid 150 and name HN ) ( resid 150 and name HB ) 3.51 3.51 0.00 peak 169 assign ( resid 44 and name HN ) ( resid 44 and name HG1 ) 4.87 4.87 0.00 peak 170 assign ( resid 144 and name HN ) ( resid 144 and name HG1 ) 4.87 4.87 0.00 peak 170 assign ( resid 48 and name HB+ ) ( resid 50 and name HN ) 5.27 5.27 0.00 peak 170 assign ( resid 148 and name HB+ ) ( resid 150 and name HN ) 5.27 5.27 0.00 peak 170 assign ( resid 43 and name HG+ ) ( resid 45 and name HN ) 4.76 4.76 0.00 peak 173 assign ( resid 143 and name HG+ ) ( resid 145 and name HN ) 4.76 4.76 0.00 peak 173 assign ( resid 44 and name HB+ ) ( resid 45 and name HN ) 3.30 3.30 0.00 peak 174 assign ( resid 144 and name HB+ ) ( resid 145 and name HN ) 3.30 3.30 0.00 peak 174 assign ( resid 45 and name HN ) ( resid 45 and name HB+ ) 3.46 3.46 0.00 peak 174 assign ( resid 145 and name HN ) ( resid 145 and name HB+ ) 3.46 3.46 0.00 peak 174 assign ( resid 43 and name HA ) ( resid 46 and name HN ) 3.79 3.79 0.00 peak 183 assign ( resid 143 and name HA ) ( resid 146 and name HN ) 3.79 3.79 0.00 peak 183 assign ( resid 50 and name HA ) ( resid 52 and name HN ) 4.98 4.98 0.00 peak 185 assign ( resid 150 and name HA ) ( resid 152 and name HN ) 4.98 4.98 0.00 peak 185 assign ( resid 45 and name HD+ ) ( resid 46 and name HN ) 4.74 4.74 0.00 peak 187 assign ( resid 145 and name HD+ ) ( resid 146 and name HN ) 4.74 4.74 0.00 peak 187 assign ( resid 46 and name HN ) ( resid 46 and name HD+ ) 5.19 5.19 0.00 peak 187 assign ( resid 146 and name HN ) ( resid 146 and name HD+ ) 5.19 5.19 0.00 peak 187 assign ( resid 45 and name HB+ ) ( resid 46 and name HN ) 3.36 3.36 0.00 peak 188 assign ( resid 145 and name HB+ ) ( resid 146 and name HN ) 3.36 3.36 0.00 peak 188 assign ( resid 46 and name HN ) ( resid 46 and name HB+ ) 3.56 3.56 0.00 peak 188 assign ( resid 146 and name HN ) ( resid 146 and name HB+ ) 3.56 3.56 0.00 peak 188 assign ( resid 45 and name HG1 ) ( resid 46 and name HN ) 4.40 4.40 0.00 peak 189 assign ( resid 145 and name HG1 ) ( resid 146 and name HN ) 4.40 4.40 0.00 peak 189 assign ( resid 51 and name HD22 ) ( resid 52 and name HN ) 5.50 5.50 0.00 peak 194 assign ( resid 151 and name HD22 ) ( resid 152 and name HN ) 5.50 5.50 0.00 peak 194 assign ( resid 43 and name HG+ ) ( resid 47 and name HN ) 5.49 5.49 0.00 peak 195 assign ( resid 143 and name HG+ ) ( resid 147 and name HN ) 5.49 5.49 0.00 peak 195 assign ( resid 46 and name HB+ ) ( resid 47 and name HN ) 3.14 3.14 0.00 peak 196 assign ( resid 146 and name HB+ ) ( resid 147 and name HN ) 3.14 3.14 0.00 peak 196 assign ( resid 46 and name HD+ ) ( resid 47 and name HN ) 4.49 4.49 0.00 peak 202 assign ( resid 146 and name HD+ ) ( resid 147 and name HN ) 4.49 4.49 0.00 peak 202 assign ( resid 47 and name HN ) ( resid 47 and name HD+ ) 5.05 5.05 0.00 peak 202 assign ( resid 147 and name HN ) ( resid 147 and name HD+ ) 5.05 5.05 0.00 peak 202 assign ( resid 47 and name HN ) ( resid 48 and name HN ) 3.56 3.56 0.00 peak 205 assign ( resid 147 and name HN ) ( resid 148 and name HN ) 3.56 3.56 0.00 peak 205 assign ( resid 48 and name HN ) ( resid 51 and name HD22 ) 5.32 5.32 0.00 peak 206 assign ( resid 148 and name HN ) ( resid 151 and name HD22 ) 5.32 5.32 0.00 peak 206 assign ( resid 48 and name HN ) ( resid 52 and name HG+ ) 5.50 5.50 0.00 peak 209 assign ( resid 148 and name HN ) ( resid 152 and name HG+ ) 5.50 5.50 0.00 peak 209 assign ( resid 48 and name HN ) ( resid 48 and name HB+ ) 3.04 3.04 0.00 peak 211 assign ( resid 148 and name HN ) ( resid 148 and name HB+ ) 3.04 3.04 0.00 peak 211 assign ( resid 49 and name HN ) ( resid 50 and name HD1+ ) 5.11 5.11 0.00 peak 219 assign ( resid 149 and name HN ) ( resid 150 and name HD1+ ) 5.11 5.11 0.00 peak 219 assign ( resid 49 and name HN ) ( resid 50 and name HA ) 5.50 5.50 0.00 peak 221 assign ( resid 149 and name HN ) ( resid 150 and name HA ) 5.50 5.50 0.00 peak 221 assign ( resid 56 and name HN ) ( resid 59 and name HN ) 5.29 5.29 0.00 peak 226 assign ( resid 156 and name HN ) ( resid 159 and name HN ) 5.29 5.29 0.00 peak 226 assign ( resid 56 and name HN ) ( resid 56 and name HG2 ) 3.88 3.88 0.00 peak 231 assign ( resid 156 and name HN ) ( resid 156 and name HG2 ) 3.88 3.88 0.00 peak 231 assign ( resid 56 and name HB+ ) ( resid 57 and name HN ) 4.42 4.42 0.00 peak 236 assign ( resid 156 and name HB+ ) ( resid 157 and name HN ) 4.42 4.42 0.00 peak 236 assign ( resid 57 and name HN ) ( resid 57 and name HB+ ) 3.49 3.49 0.00 peak 237 assign ( resid 157 and name HN ) ( resid 157 and name HB+ ) 3.49 3.49 0.00 peak 237 assign ( resid 56 and name HG2 ) ( resid 57 and name HN ) 4.76 4.76 0.00 peak 239 assign ( resid 156 and name HG2 ) ( resid 157 and name HN ) 4.76 4.76 0.00 peak 239 assign ( resid 57 and name HN ) ( resid 58 and name HN ) 4.11 4.11 0.00 peak 241 assign ( resid 157 and name HN ) ( resid 158 and name HN ) 4.11 4.11 0.00 peak 241 assign ( resid 61 and name HN ) ( resid 62 and name HN ) 3.75 3.75 0.00 peak 243 assign ( resid 161 and name HN ) ( resid 162 and name HN ) 3.75 3.75 0.00 peak 243 assign ( resid 54 and name HA ) ( resid 58 and name HN ) 4.63 4.63 0.00 peak 250 assign ( resid 154 and name HA ) ( resid 158 and name HN ) 4.63 4.63 0.00 peak 250 assign ( resid 58 and name HN ) ( resid 80 and name HG2+ ) 3.52 3.52 0.00 peak 258 assign ( resid 158 and name HN ) ( resid 180 and name HG2+ ) 3.52 3.52 0.00 peak 258 assign ( resid 58 and name HE+ ) ( resid 59 and name HN ) 5.15 5.15 0.00 peak 259 assign ( resid 158 and name HE+ ) ( resid 159 and name HN ) 5.15 5.15 0.00 peak 259 assign ( resid 59 and name HN ) ( resid 59 and name HB ) 3.46 3.46 0.00 peak 266 assign ( resid 159 and name HN ) ( resid 159 and name HB ) 3.46 3.46 0.00 peak 266 assign ( resid 59 and name HN ) ( resid 60 and name HN ) 3.85 3.85 0.00 peak 269 assign ( resid 159 and name HN ) ( resid 160 and name HN ) 3.85 3.85 0.00 peak 269 assign ( resid 57 and name HN ) ( resid 59 and name HN ) 4.95 4.95 0.00 peak 270 assign ( resid 157 and name HN ) ( resid 159 and name HN ) 4.95 4.95 0.00 peak 270 assign ( resid 59 and name HN ) ( resid 61 and name HN ) 5.39 5.39 0.00 peak 270 assign ( resid 159 and name HN ) ( resid 161 and name HN ) 5.39 5.39 0.00 peak 270 assign ( resid 61 and name HN ) ( resid 61 and name HB ) 3.53 3.53 0.00 peak 271 assign ( resid 161 and name HN ) ( resid 161 and name HB ) 3.53 3.53 0.00 peak 271 assign ( resid 61 and name HN ) ( resid 61 and name HG12 ) 4.08 4.08 0.00 peak 272 assign ( resid 161 and name HN ) ( resid 161 and name HG12 ) 4.08 4.08 0.00 peak 272 assign ( resid 85 and name HG2+ ) ( resid 157 and name HN ) 3.59 3.59 0.00 peak 273 assign ( resid 57 and name HN ) ( resid 185 and name HG2+ ) 3.59 3.59 0.00 peak 273 assign ( resid 71 and name HN ) ( resid 72 and name HA ) 5.21 5.21 0.00 peak 280 assign ( resid 171 and name HN ) ( resid 172 and name HA ) 5.21 5.21 0.00 peak 280 assign ( resid 170 and name HB+ ) ( resid 171 and name HN ) 3.72 3.72 0.00 peak 281 assign ( resid 64 and name HN ) ( resid 65 and name HB+ ) 4.99 4.99 0.00 peak 288 assign ( resid 164 and name HN ) ( resid 165 and name HB+ ) 4.99 4.99 0.00 peak 288 assign ( resid 64 and name HN ) ( resid 64 and name HB+ ) 3.04 3.04 0.00 peak 289 assign ( resid 164 and name HN ) ( resid 164 and name HB+ ) 3.04 3.04 0.00 peak 289 assign ( resid 63 and name HB1 ) ( resid 64 and name HN ) 3.83 3.83 0.00 peak 292 assign ( resid 163 and name HB1 ) ( resid 164 and name HN ) 3.83 3.83 0.00 peak 292 assign ( resid 63 and name HB2 ) ( resid 64 and name HN ) 3.75 3.75 0.00 peak 293 assign ( resid 163 and name HB2 ) ( resid 164 and name HN ) 3.75 3.75 0.00 peak 293 assign ( resid 61 and name HN ) ( resid 64 and name HN ) 5.18 5.18 0.00 peak 297 assign ( resid 161 and name HN ) ( resid 164 and name HN ) 5.18 5.18 0.00 peak 297 assign ( resid 64 and name HN ) ( resid 65 and name HN ) 3.59 3.59 0.00 peak 300 assign ( resid 164 and name HN ) ( resid 165 and name HN ) 3.59 3.59 0.00 peak 300 assign ( resid 63 and name HA ) ( resid 65 and name HN ) 4.81 4.81 0.00 peak 302 assign ( resid 163 and name HA ) ( resid 165 and name HN ) 4.81 4.81 0.00 peak 302 assign ( resid 65 and name HN ) ( resid 67 and name HN ) 4.78 4.78 0.00 peak 304 assign ( resid 165 and name HN ) ( resid 167 and name HN ) 4.78 4.78 0.00 peak 304 assign ( resid 63 and name HB1 ) ( resid 65 and name HN ) 5.50 5.50 0.00 peak 308 assign ( resid 163 and name HB1 ) ( resid 165 and name HN ) 5.50 5.50 0.00 peak 308 assign ( resid 63 and name HB2 ) ( resid 65 and name HN ) 5.50 5.50 0.00 peak 309 assign ( resid 163 and name HB2 ) ( resid 165 and name HN ) 5.50 5.50 0.00 peak 309 assign ( resid 65 and name HN ) ( resid 65 and name HB+ ) 3.21 3.21 0.00 peak 310 assign ( resid 165 and name HN ) ( resid 165 and name HB+ ) 3.21 3.21 0.00 peak 310 assign ( resid 64 and name HB+ ) ( resid 65 and name HN ) 3.46 3.46 0.00 peak 311 assign ( resid 164 and name HB+ ) ( resid 165 and name HN ) 3.46 3.46 0.00 peak 311 assign ( resid 66 and name HN ) ( resid 66 and name HB+ ) 3.40 3.40 0.00 peak 315 assign ( resid 166 and name HN ) ( resid 166 and name HB+ ) 3.40 3.40 0.00 peak 315 assign ( resid 65 and name HB+ ) ( resid 66 and name HN ) 3.47 3.47 0.00 peak 316 assign ( resid 165 and name HB+ ) ( resid 166 and name HN ) 3.47 3.47 0.00 peak 316 assign ( resid 66 and name HN ) ( resid 66 and name HG+ ) 3.28 3.28 0.00 peak 317 assign ( resid 166 and name HN ) ( resid 166 and name HG+ ) 3.28 3.28 0.00 peak 317 assign ( resid 92 and name HN ) ( resid 92 and name HG2 ) 3.65 3.65 0.00 peak 319 assign ( resid 192 and name HN ) ( resid 192 and name HG2 ) 3.65 3.65 0.00 peak 319 assign ( resid 91 and name HB1 ) ( resid 92 and name HN ) 4.14 4.14 0.00 peak 323 assign ( resid 191 and name HB1 ) ( resid 192 and name HN ) 4.14 4.14 0.00 peak 323 assign ( resid 91 and name HD1+ ) ( resid 192 and name HN ) 4.10 4.10 0.00 peak 326 assign ( resid 92 and name HN ) ( resid 191 and name HD1+ ) 4.10 4.10 0.00 peak 326 assign ( resid 90 and name HA ) ( resid 92 and name HN ) 4.29 4.29 0.00 peak 327 assign ( resid 190 and name HA ) ( resid 192 and name HN ) 4.29 4.29 0.00 peak 327 assign ( resid 65 and name HB+ ) ( resid 67 and name HN ) 3.57 3.57 0.00 peak 333 assign ( resid 165 and name HB+ ) ( resid 167 and name HN ) 3.57 3.57 0.00 peak 333 assign ( resid 67 and name HN ) ( resid 67 and name HB+ ) 3.70 3.70 0.00 peak 333 assign ( resid 167 and name HN ) ( resid 167 and name HB+ ) 3.70 3.70 0.00 peak 333 assign ( resid 67 and name HN ) ( resid 67 and name HG+ ) 3.29 3.29 0.00 peak 334 assign ( resid 167 and name HN ) ( resid 167 and name HG+ ) 3.29 3.29 0.00 peak 334 assign ( resid 66 and name HE+ ) ( resid 67 and name HN ) 5.50 5.50 0.00 peak 337 assign ( resid 166 and name HE+ ) ( resid 167 and name HN ) 5.50 5.50 0.00 peak 337 assign ( resid 67 and name HN ) ( resid 68 and name HB+ ) 5.45 5.45 0.00 peak 338 assign ( resid 167 and name HN ) ( resid 168 and name HB+ ) 5.45 5.45 0.00 peak 338 assign ( resid 66 and name HA ) ( resid 67 and name HN ) 3.34 3.34 0.00 peak 341 assign ( resid 166 and name HA ) ( resid 167 and name HN ) 3.34 3.34 0.00 peak 341 assign ( resid 66 and name HN ) ( resid 67 and name HN ) 3.52 3.52 0.00 peak 344 assign ( resid 166 and name HN ) ( resid 167 and name HN ) 3.52 3.52 0.00 peak 344 assign ( resid 68 and name HN ) ( resid 72 and name HN ) 4.91 4.91 0.00 peak 347 assign ( resid 168 and name HN ) ( resid 172 and name HN ) 4.91 4.91 0.00 peak 347 assign ( resid 68 and name HN ) ( resid 68 and name HB+ ) 3.22 3.22 0.00 peak 350 assign ( resid 168 and name HN ) ( resid 168 and name HB+ ) 3.22 3.22 0.00 peak 350 assign ( resid 67 and name HB+ ) ( resid 68 and name HN ) 3.46 3.46 0.00 peak 351 assign ( resid 167 and name HB+ ) ( resid 168 and name HN ) 3.46 3.46 0.00 peak 351 assign ( resid 67 and name HG+ ) ( resid 68 and name HN ) 4.03 4.03 0.00 peak 352 assign ( resid 167 and name HG+ ) ( resid 168 and name HN ) 4.03 4.03 0.00 peak 352 assign ( resid 68 and name HA ) ( resid 69 and name HN ) 3.41 3.41 0.00 peak 356 assign ( resid 168 and name HA ) ( resid 169 and name HN ) 3.41 3.41 0.00 peak 356 assign ( resid 68 and name HB+ ) ( resid 70 and name HN ) 4.78 4.78 0.00 peak 358 assign ( resid 168 and name HB+ ) ( resid 170 and name HN ) 4.78 4.78 0.00 peak 358 assign ( resid 70 and name HN ) ( resid 71 and name HG+ ) 4.66 4.66 0.00 peak 359 assign ( resid 170 and name HN ) ( resid 171 and name HG+ ) 4.66 4.66 0.00 peak 359 assign ( resid 83 and name HN ) ( resid 84 and name HN ) 4.01 4.01 0.00 peak 360 assign ( resid 183 and name HN ) ( resid 184 and name HN ) 4.01 4.01 0.00 peak 360 assign ( resid 86 and name HN ) ( resid 87 and name HN ) 4.00 4.00 0.00 peak 365 assign ( resid 186 and name HN ) ( resid 187 and name HN ) 4.00 4.00 0.00 peak 365 assign ( resid 71 and name HD+ ) ( resid 72 and name HN ) 3.54 3.54 0.00 peak 373 assign ( resid 171 and name HD+ ) ( resid 172 and name HN ) 3.54 3.54 0.00 peak 373 assign ( resid 90 and name HN ) ( resid 90 and name HB1 ) 3.59 3.59 0.00 peak 374 assign ( resid 190 and name HN ) ( resid 190 and name HB1 ) 3.59 3.59 0.00 peak 374 assign ( resid 90 and name HN ) ( resid 90 and name HB2 ) 3.44 3.44 0.00 peak 376 assign ( resid 190 and name HN ) ( resid 190 and name HB2 ) 3.44 3.44 0.00 peak 376 assign ( resid 85 and name HB ) ( resid 87 and name HN ) 4.99 4.99 0.00 peak 377 assign ( resid 185 and name HB ) ( resid 187 and name HN ) 4.99 4.99 0.00 peak 377 assign ( resid 86 and name HB+ ) ( resid 87 and name HN ) 3.50 3.50 0.00 peak 378 assign ( resid 186 and name HB+ ) ( resid 187 and name HN ) 3.50 3.50 0.00 peak 378 assign ( resid 73 and name HN ) ( resid 73 and name HB+ ) 3.85 3.85 0.00 peak 387 assign ( resid 173 and name HN ) ( resid 173 and name HB+ ) 3.85 3.85 0.00 peak 387 assign ( resid 72 and name HB1 ) ( resid 73 and name HN ) 4.83 4.83 0.00 peak 388 assign ( resid 172 and name HB1 ) ( resid 173 and name HN ) 4.83 4.83 0.00 peak 388 assign ( resid 72 and name HB2 ) ( resid 73 and name HN ) 4.83 4.83 0.00 peak 389 assign ( resid 172 and name HB2 ) ( resid 173 and name HN ) 4.83 4.83 0.00 peak 389 assign ( resid 74 and name HA ) ( resid 75 and name HN ) 3.08 3.08 0.00 peak 401 assign ( resid 174 and name HA ) ( resid 175 and name HN ) 3.08 3.08 0.00 peak 401 assign ( resid 73 and name HB+ ) ( resid 75 and name HN ) 5.50 5.50 0.00 peak 402 assign ( resid 173 and name HB+ ) ( resid 175 and name HN ) 5.50 5.50 0.00 peak 402 assign ( resid 75 and name HN ) ( resid 75 and name HB1 ) 3.48 3.48 0.00 peak 406 assign ( resid 175 and name HN ) ( resid 175 and name HB1 ) 3.48 3.48 0.00 peak 406 assign ( resid 76 and name HN ) ( resid 79 and name HB1 ) 4.31 4.31 0.00 peak 409 assign ( resid 176 and name HN ) ( resid 179 and name HB1 ) 4.31 4.31 0.00 peak 409 assign ( resid 76 and name HN ) ( resid 79 and name HB2 ) 4.31 4.31 0.00 peak 410 assign ( resid 176 and name HN ) ( resid 179 and name HB2 ) 4.31 4.31 0.00 peak 410 assign ( resid 76 and name HN ) ( resid 76 and name HG2 ) 3.99 3.99 0.00 peak 411 assign ( resid 176 and name HN ) ( resid 176 and name HG2 ) 3.99 3.99 0.00 peak 411 assign ( resid 76 and name HN ) ( resid 76 and name HB2 ) 3.87 3.87 0.00 peak 412 assign ( resid 176 and name HN ) ( resid 176 and name HB2 ) 3.87 3.87 0.00 peak 412 assign ( resid 75 and name HB1 ) ( resid 76 and name HN ) 4.12 4.12 0.00 peak 413 assign ( resid 175 and name HB1 ) ( resid 176 and name HN ) 4.12 4.12 0.00 peak 413 assign ( resid 75 and name HG ) ( resid 76 and name HN ) 4.69 4.69 0.00 peak 413 assign ( resid 175 and name HG ) ( resid 176 and name HN ) 4.69 4.69 0.00 peak 413 assign ( resid 75 and name HB2 ) ( resid 76 and name HN ) 4.65 4.65 0.00 peak 414 assign ( resid 175 and name HB2 ) ( resid 176 and name HN ) 4.65 4.65 0.00 peak 414 assign ( resid 75 and name HA ) ( resid 76 and name HN ) 3.42 3.42 0.00 peak 416 assign ( resid 175 and name HA ) ( resid 176 and name HN ) 3.42 3.42 0.00 peak 416 assign ( resid 76 and name HN ) ( resid 79 and name HN ) 4.73 4.73 0.00 peak 419 assign ( resid 176 and name HN ) ( resid 179 and name HN ) 4.73 4.73 0.00 peak 419 assign ( resid 77 and name HN ) ( resid 78 and name HN ) 4.32 4.32 0.00 peak 420 assign ( resid 177 and name HN ) ( resid 178 and name HN ) 4.32 4.32 0.00 peak 420 assign ( resid 77 and name HN ) ( resid 77 and name HE+ ) 4.89 4.89 0.00 peak 425 assign ( resid 177 and name HN ) ( resid 177 and name HE+ ) 4.89 4.89 0.00 peak 425 assign ( resid 76 and name HB1 ) ( resid 77 and name HN ) 3.68 3.68 0.00 peak 426 assign ( resid 176 and name HB1 ) ( resid 177 and name HN ) 3.68 3.68 0.00 peak 426 assign ( resid 46 and name HG1 ) ( resid 177 and name HN ) 5.12 5.12 0.00 peak 428 assign ( resid 77 and name HN ) ( resid 146 and name HG1 ) 5.12 5.12 0.00 peak 428 assign ( resid 77 and name HN ) ( resid 77 and name HD+ ) 5.47 5.47 0.00 peak 428 assign ( resid 177 and name HN ) ( resid 177 and name HD+ ) 5.47 5.47 0.00 peak 428 assign ( resid 77 and name HN ) ( resid 77 and name HG1 ) 4.48 4.48 0.00 peak 430 assign ( resid 177 and name HN ) ( resid 177 and name HG1 ) 4.48 4.48 0.00 peak 430 assign ( resid 50 and name HD1+ ) ( resid 177 and name HN ) 4.19 4.19 0.00 peak 431 assign ( resid 77 and name HN ) ( resid 150 and name HD1+ ) 4.19 4.19 0.00 peak 431 assign ( resid 76 and name HB1 ) ( resid 78 and name HN ) 4.15 4.15 0.00 peak 433 assign ( resid 176 and name HB1 ) ( resid 178 and name HN ) 4.15 4.15 0.00 peak 433 assign ( resid 77 and name HG2 ) ( resid 78 and name HN ) 4.36 4.36 0.00 peak 436 assign ( resid 177 and name HG2 ) ( resid 178 and name HN ) 4.36 4.36 0.00 peak 436 assign ( resid 78 and name HN ) ( resid 78 and name HB+ ) 3.43 3.43 0.00 peak 437 assign ( resid 178 and name HN ) ( resid 178 and name HB+ ) 3.43 3.43 0.00 peak 437 assign ( resid 50 and name HD1+ ) ( resid 178 and name HN ) 3.81 3.81 0.00 peak 438 assign ( resid 78 and name HN ) ( resid 150 and name HD1+ ) 3.81 3.81 0.00 peak 438 assign ( resid 78 and name HN ) ( resid 79 and name HN ) 3.89 3.89 0.00 peak 442 assign ( resid 178 and name HN ) ( resid 179 and name HN ) 3.89 3.89 0.00 peak 442 assign ( resid 79 and name HN ) ( resid 81 and name HN ) 4.48 4.48 0.00 peak 443 assign ( resid 179 and name HN ) ( resid 181 and name HN ) 4.48 4.48 0.00 peak 443 assign ( resid 79 and name HN ) ( resid 80 and name HN ) 3.79 3.79 0.00 peak 444 assign ( resid 179 and name HN ) ( resid 180 and name HN ) 3.79 3.79 0.00 peak 444 assign ( resid 79 and name HN ) ( resid 80 and name HA ) 5.44 5.44 0.00 peak 448 assign ( resid 179 and name HN ) ( resid 180 and name HA ) 5.44 5.44 0.00 peak 448 assign ( resid 79 and name HN ) ( resid 79 and name HB1 ) 3.92 3.92 0.00 peak 449 assign ( resid 179 and name HN ) ( resid 179 and name HB1 ) 3.92 3.92 0.00 peak 449 assign ( resid 79 and name HN ) ( resid 79 and name HB2 ) 3.92 3.92 0.00 peak 450 assign ( resid 179 and name HN ) ( resid 179 and name HB2 ) 3.92 3.92 0.00 peak 450 assign ( resid 76 and name HB1 ) ( resid 79 and name HN ) 4.02 4.02 0.00 peak 451 assign ( resid 176 and name HB1 ) ( resid 179 and name HN ) 4.02 4.02 0.00 peak 451 assign ( resid 76 and name HB2 ) ( resid 79 and name HN ) 3.94 3.94 0.00 peak 452 assign ( resid 176 and name HB2 ) ( resid 179 and name HN ) 3.94 3.94 0.00 peak 452 assign ( resid 46 and name HG1 ) ( resid 179 and name HN ) 5.50 5.50 0.00 peak 453 assign ( resid 79 and name HN ) ( resid 146 and name HG1 ) 5.50 5.50 0.00 peak 453 assign ( resid 78 and name HB+ ) ( resid 79 and name HN ) 3.71 3.71 0.00 peak 455 assign ( resid 178 and name HB+ ) ( resid 179 and name HN ) 3.71 3.71 0.00 peak 455 assign ( resid 90 and name HN ) ( resid 90 and name HD22 ) 4.91 4.91 0.00 peak 457 assign ( resid 190 and name HN ) ( resid 190 and name HD22 ) 4.91 4.91 0.00 peak 457 assign ( resid 91 and name HN ) ( resid 92 and name HN ) 3.65 3.65 0.00 peak 461 assign ( resid 191 and name HN ) ( resid 192 and name HN ) 3.65 3.65 0.00 peak 461 assign ( resid 90 and name HA ) ( resid 93 and name HN ) 3.89 3.89 0.00 peak 463 assign ( resid 190 and name HA ) ( resid 193 and name HN ) 3.89 3.89 0.00 peak 463 assign ( resid 90 and name HB1 ) ( resid 91 and name HN ) 3.98 3.98 0.00 peak 465 assign ( resid 190 and name HB1 ) ( resid 191 and name HN ) 3.98 3.98 0.00 peak 465 assign ( resid 90 and name HB2 ) ( resid 91 and name HN ) 3.92 3.92 0.00 peak 466 assign ( resid 190 and name HB2 ) ( resid 191 and name HN ) 3.92 3.92 0.00 peak 466 assign ( resid 91 and name HN ) ( resid 91 and name HG ) 3.27 3.27 0.00 peak 468 assign ( resid 191 and name HN ) ( resid 191 and name HG ) 3.27 3.27 0.00 peak 468 assign ( resid 91 and name HN ) ( resid 91 and name HD1+ ) 3.52 3.52 0.00 peak 469 assign ( resid 191 and name HN ) ( resid 191 and name HD1+ ) 3.52 3.52 0.00 peak 469 assign ( resid 90 and name HB1 ) ( resid 92 and name HN ) 5.50 5.50 0.00 peak 470 assign ( resid 190 and name HB1 ) ( resid 192 and name HN ) 5.50 5.50 0.00 peak 470 assign ( resid 90 and name HB2 ) ( resid 93 and name HN ) 5.50 5.50 0.00 peak 474 assign ( resid 190 and name HB2 ) ( resid 193 and name HN ) 5.50 5.50 0.00 peak 474 assign ( resid 92 and name HG2 ) ( resid 93 and name HN ) 4.97 4.97 0.00 peak 475 assign ( resid 192 and name HG2 ) ( resid 193 and name HN ) 4.97 4.97 0.00 peak 475 assign ( resid 92 and name HB+ ) ( resid 93 and name HN ) 3.26 3.26 0.00 peak 476 assign ( resid 192 and name HB+ ) ( resid 193 and name HN ) 3.26 3.26 0.00 peak 476 assign ( resid 93 and name HN ) ( resid 93 and name HB+ ) 3.15 3.15 0.00 peak 477 assign ( resid 193 and name HN ) ( resid 193 and name HB+ ) 3.15 3.15 0.00 peak 477 assign ( resid 93 and name HN ) ( resid 93 and name HG+ ) 3.02 3.02 0.00 peak 478 assign ( resid 193 and name HN ) ( resid 193 and name HG+ ) 3.02 3.02 0.00 peak 478 assign ( resid 93 and name HN ) ( resid 94 and name HB+ ) 4.12 4.12 0.00 peak 479 assign ( resid 193 and name HN ) ( resid 194 and name HB+ ) 4.12 4.12 0.00 peak 479 assign ( resid 93 and name HN ) ( resid 94 and name HN ) 2.88 2.88 0.00 peak 484 assign ( resid 193 and name HN ) ( resid 194 and name HN ) 2.88 2.88 0.00 peak 484 assign ( resid 93 and name HD+ ) ( resid 94 and name HN ) 4.59 4.59 0.00 peak 487 assign ( resid 193 and name HD+ ) ( resid 194 and name HN ) 4.59 4.59 0.00 peak 487 assign ( resid 93 and name HB+ ) ( resid 94 and name HN ) 4.08 4.08 0.00 peak 490 assign ( resid 193 and name HB+ ) ( resid 194 and name HN ) 4.08 4.08 0.00 peak 490 assign ( resid 94 and name HN ) ( resid 94 and name HB+ ) 2.64 2.64 0.00 peak 491 assign ( resid 194 and name HN ) ( resid 194 and name HB+ ) 2.64 2.64 0.00 peak 491 assign ( resid 91 and name HD2+ ) ( resid 94 and name HN ) 5.43 5.43 0.00 peak 492 assign ( resid 191 and name HD2+ ) ( resid 194 and name HN ) 5.43 5.43 0.00 peak 492 assign ( resid 95 and name HN ) ( resid 95 and name HB+ ) 3.35 3.35 0.00 peak 495 assign ( resid 195 and name HN ) ( resid 195 and name HB+ ) 3.35 3.35 0.00 peak 495 assign ( resid 94 and name HB+ ) ( resid 95 and name HN ) 3.55 3.55 0.00 peak 497 assign ( resid 194 and name HB+ ) ( resid 195 and name HN ) 3.55 3.55 0.00 peak 497 assign ( resid 94 and name HN ) ( resid 95 and name HN ) 3.01 3.01 0.00 peak 501 assign ( resid 194 and name HN ) ( resid 195 and name HN ) 3.01 3.01 0.00 peak 501 assign ( resid 53 and name HN ) ( resid 54 and name HN ) 3.92 3.92 0.00 peak 502 assign ( resid 153 and name HN ) ( resid 154 and name HN ) 3.92 3.92 0.00 peak 502 assign ( resid 53 and name HN ) ( resid 55 and name HN ) 4.60 4.60 0.00 peak 504 assign ( resid 153 and name HN ) ( resid 155 and name HN ) 4.60 4.60 0.00 peak 504 assign ( resid 52 and name HG+ ) ( resid 53 and name HN ) 4.29 4.29 0.00 peak 505 assign ( resid 152 and name HG+ ) ( resid 153 and name HN ) 4.29 4.29 0.00 peak 505 assign ( resid 152 and name HB+ ) ( resid 153 and name HN ) 3.36 3.36 0.00 peak 506 assign ( resid 53 and name HN ) ( resid 54 and name HB2 ) 4.72 4.72 0.00 peak 508 assign ( resid 153 and name HN ) ( resid 154 and name HB2 ) 4.72 4.72 0.00 peak 508 assign ( resid 51 and name HB+ ) ( resid 53 and name HN ) 5.10 5.10 0.00 peak 512 assign ( resid 151 and name HB+ ) ( resid 153 and name HN ) 5.10 5.10 0.00 peak 512 assign ( resid 50 and name HA ) ( resid 53 and name HN ) 3.89 3.89 0.00 peak 516 assign ( resid 150 and name HA ) ( resid 153 and name HN ) 3.89 3.89 0.00 peak 516 assign ( resid 50 and name HG2+ ) ( resid 51 and name HN ) 3.43 3.43 0.00 peak 517 assign ( resid 150 and name HG2+ ) ( resid 151 and name HN ) 3.43 3.43 0.00 peak 517 assign ( resid 51 and name HN ) ( resid 52 and name HG+ ) 4.67 4.67 0.00 peak 518 assign ( resid 151 and name HN ) ( resid 152 and name HG+ ) 4.67 4.67 0.00 peak 518 assign ( resid 51 and name HN ) ( resid 52 and name HB+ ) 4.78 4.78 0.00 peak 519 assign ( resid 151 and name HN ) ( resid 152 and name HB+ ) 4.78 4.78 0.00 peak 519 assign ( resid 51 and name HN ) ( resid 51 and name HB+ ) 3.41 3.41 0.00 peak 521 assign ( resid 151 and name HN ) ( resid 151 and name HB+ ) 3.41 3.41 0.00 peak 521 assign ( resid 82 and name HN ) ( resid 83 and name HN ) 3.70 3.70 0.00 peak 526 assign ( resid 182 and name HN ) ( resid 183 and name HN ) 3.70 3.70 0.00 peak 526 assign ( resid 79 and name HA ) ( resid 83 and name HN ) 4.45 4.45 0.00 peak 527 assign ( resid 179 and name HA ) ( resid 183 and name HN ) 4.45 4.45 0.00 peak 527 assign ( resid 80 and name HA ) ( resid 83 and name HN ) 4.77 4.77 0.00 peak 528 assign ( resid 180 and name HA ) ( resid 183 and name HN ) 4.77 4.77 0.00 peak 528 assign ( resid 83 and name HN ) ( resid 84 and name HG2+ ) 5.50 5.50 0.00 peak 532 assign ( resid 183 and name HN ) ( resid 184 and name HG2+ ) 5.50 5.50 0.00 peak 532 assign ( resid 89 and name HN ) ( resid 89 and name HD+ ) 4.06 4.06 0.00 peak 534 assign ( resid 189 and name HN ) ( resid 189 and name HD+ ) 4.06 4.06 0.00 peak 534 assign ( resid 89 and name HN ) ( resid 89 and name HB+ ) 3.15 3.15 0.00 peak 535 assign ( resid 189 and name HN ) ( resid 189 and name HB+ ) 3.15 3.15 0.00 peak 535 assign ( resid 69 and name HN ) ( resid 69 and name HB+ ) 3.50 3.50 0.00 peak 538 assign ( resid 169 and name HN ) ( resid 169 and name HB+ ) 3.50 3.50 0.00 peak 538 assign ( resid 89 and name HN ) ( resid 90 and name HN ) 3.73 3.73 0.00 peak 540 assign ( resid 189 and name HN ) ( resid 190 and name HN ) 3.73 3.73 0.00 peak 540 assign ( resid 80 and name HN ) ( resid 81 and name HN ) 3.71 3.71 0.00 peak 542 assign ( resid 180 and name HN ) ( resid 181 and name HN ) 3.71 3.71 0.00 peak 542 assign ( resid 52 and name HN ) ( resid 55 and name HN ) 5.01 5.01 0.00 peak 550 assign ( resid 152 and name HN ) ( resid 155 and name HN ) 5.01 5.01 0.00 peak 550 assign ( resid 51 and name HB+ ) ( resid 52 and name HN ) 3.78 3.78 0.00 peak 551 assign ( resid 151 and name HB+ ) ( resid 152 and name HN ) 3.78 3.78 0.00 peak 551 assign ( resid 54 and name HN ) ( resid 54 and name HB2 ) 3.88 3.88 0.00 peak 554 assign ( resid 154 and name HN ) ( resid 154 and name HB2 ) 3.88 3.88 0.00 peak 554 assign ( resid 51 and name HA ) ( resid 54 and name HN ) 4.24 4.24 0.00 peak 560 assign ( resid 151 and name HA ) ( resid 154 and name HN ) 4.24 4.24 0.00 peak 560 assign ( resid 50 and name HA ) ( resid 54 and name HN ) 4.49 4.49 0.00 peak 562 assign ( resid 150 and name HA ) ( resid 154 and name HN ) 4.49 4.49 0.00 peak 562 assign ( resid 85 and name HN ) ( resid 85 and name HB ) 3.79 3.79 0.00 peak 568 assign ( resid 185 and name HN ) ( resid 185 and name HB ) 3.79 3.79 0.00 peak 568 assign ( resid 57 and name HB+ ) ( resid 185 and name HN ) 4.71 4.71 0.00 peak 569 assign ( resid 85 and name HN ) ( resid 157 and name HB+ ) 4.71 4.71 0.00 peak 569 assign ( resid 84 and name HB ) ( resid 85 and name HN ) 4.00 4.00 0.00 peak 572 assign ( resid 184 and name HB ) ( resid 185 and name HN ) 4.00 4.00 0.00 peak 572 assign ( resid 83 and name HN ) ( resid 85 and name HN ) 4.76 4.76 0.00 peak 575 assign ( resid 183 and name HN ) ( resid 185 and name HN ) 4.76 4.76 0.00 peak 575 assign ( resid 79 and name HB1 ) ( resid 80 and name HN ) 4.22 4.22 0.00 peak 578 assign ( resid 179 and name HB1 ) ( resid 180 and name HN ) 4.22 4.22 0.00 peak 578 assign ( resid 79 and name HB2 ) ( resid 80 and name HN ) 4.22 4.22 0.00 peak 579 assign ( resid 179 and name HB2 ) ( resid 180 and name HN ) 4.22 4.22 0.00 peak 579 assign ( resid 82 and name HN ) ( resid 82 and name HB2 ) 3.48 3.48 0.00 peak 581 assign ( resid 182 and name HN ) ( resid 182 and name HB2 ) 3.48 3.48 0.00 peak 581 assign ( resid 80 and name HN ) ( resid 80 and name HB ) 3.71 3.71 0.00 peak 582 assign ( resid 180 and name HN ) ( resid 180 and name HB ) 3.71 3.71 0.00 peak 582 assign ( resid 82 and name HN ) ( resid 82 and name HB1 ) 3.86 3.86 0.00 peak 582 assign ( resid 182 and name HN ) ( resid 182 and name HB1 ) 3.86 3.86 0.00 peak 582 assign ( resid 81 and name HN ) ( resid 82 and name HN ) 4.25 4.25 0.00 peak 590 assign ( resid 181 and name HN ) ( resid 182 and name HN ) 4.25 4.25 0.00 peak 590 assign ( resid 86 and name HN ) ( resid 86 and name HB+ ) 3.26 3.26 0.00 peak 595 assign ( resid 186 and name HN ) ( resid 186 and name HB+ ) 3.26 3.26 0.00 peak 595 assign ( resid 85 and name HG1+ ) ( resid 86 and name HN ) 4.03 4.03 0.00 peak 597 assign ( resid 185 and name HG1+ ) ( resid 186 and name HN ) 4.03 4.03 0.00 peak 597 assign ( resid 85 and name HG2+ ) ( resid 86 and name HN ) 3.65 3.65 0.00 peak 598 assign ( resid 185 and name HG2+ ) ( resid 186 and name HN ) 3.65 3.65 0.00 peak 598 assign ( resid 86 and name HN ) ( resid 86 and name HE+ ) 4.83 4.83 0.00 peak 601 assign ( resid 186 and name HN ) ( resid 186 and name HE+ ) 4.83 4.83 0.00 peak 601 assign ( resid 85 and name HN ) ( resid 86 and name HN ) 3.93 3.93 0.00 peak 603 assign ( resid 185 and name HN ) ( resid 186 and name HN ) 3.93 3.93 0.00 peak 603 assign ( resid 95 and name HA ) ( resid 95 and name HE21 ) 4.84 4.84 0.00 peak 621 assign ( resid 195 and name HA ) ( resid 195 and name HE21 ) 4.84 4.84 0.00 peak 621 assign ( resid 95 and name HB+ ) ( resid 95 and name HE21 ) 4.42 4.42 0.00 peak 623 assign ( resid 195 and name HB+ ) ( resid 195 and name HE21 ) 4.42 4.42 0.00 peak 623 assign ( resid 93 and name HG+ ) ( resid 95 and name HE21 ) 5.50 5.50 0.00 peak 624 assign ( resid 193 and name HG+ ) ( resid 195 and name HE21 ) 5.50 5.50 0.00 peak 624 assign ( resid 94 and name HB+ ) ( resid 95 and name HE21 ) 4.54 4.54 0.00 peak 625 assign ( resid 194 and name HB+ ) ( resid 195 and name HE21 ) 4.54 4.54 0.00 peak 625 assign ( resid 86 and name HB+ ) ( resid 90 and name HD21 ) 5.28 5.28 0.00 peak 626 assign ( resid 186 and name HB+ ) ( resid 190 and name HD21 ) 5.28 5.28 0.00 peak 626 assign ( resid 65 and name HB+ ) ( resid 90 and name HD21 ) 5.50 5.50 0.00 peak 627 assign ( resid 165 and name HB+ ) ( resid 190 and name HD21 ) 5.50 5.50 0.00 peak 627 assign ( resid 90 and name HD21 ) ( resid 91 and name HG ) 5.17 5.17 0.00 peak 628 assign ( resid 190 and name HD21 ) ( resid 191 and name HG ) 5.17 5.17 0.00 peak 628 assign ( resid 87 and name HA ) ( resid 90 and name HD21 ) 3.79 3.79 0.00 peak 630 assign ( resid 187 and name HA ) ( resid 190 and name HD21 ) 3.79 3.79 0.00 peak 630 assign ( resid 64 and name HA ) ( resid 192 and name HE22 ) 4.51 4.51 0.00 peak 638 assign ( resid 92 and name HE22 ) ( resid 164 and name HA ) 4.51 4.51 0.00 peak 638 assign ( resid 56 and name HG2 ) ( resid 56 and name HE22 ) 3.51 3.51 0.00 peak 640 assign ( resid 156 and name HG2 ) ( resid 156 and name HE22 ) 3.51 3.51 0.00 peak 640 assign ( resid 92 and name HG2 ) ( resid 92 and name HE22 ) 3.64 3.64 0.00 peak 641 assign ( resid 192 and name HG2 ) ( resid 192 and name HE22 ) 3.64 3.64 0.00 peak 641 assign ( resid 56 and name HB+ ) ( resid 56 and name HE22 ) 3.68 3.68 0.00 peak 642 assign ( resid 156 and name HB+ ) ( resid 156 and name HE22 ) 3.68 3.68 0.00 peak 642 assign ( resid 92 and name HB+ ) ( resid 92 and name HE22 ) 4.27 4.27 0.00 peak 643 assign ( resid 192 and name HB+ ) ( resid 192 and name HE22 ) 4.27 4.27 0.00 peak 643 assign ( resid 64 and name HB+ ) ( resid 192 and name HE22 ) 4.02 4.02 0.00 peak 645 assign ( resid 92 and name HE22 ) ( resid 164 and name HB+ ) 4.02 4.02 0.00 peak 645 assign ( resid 85 and name HG1+ ) ( resid 156 and name HE22 ) 5.36 5.36 0.00 peak 646 assign ( resid 56 and name HE22 ) ( resid 185 and name HG1+ ) 5.36 5.36 0.00 peak 646 assign ( resid 51 and name HB+ ) ( resid 51 and name HD21 ) 3.41 3.41 0.00 peak 649 assign ( resid 151 and name HB+ ) ( resid 151 and name HD21 ) 3.41 3.41 0.00 peak 649 assign ( resid 48 and name HA ) ( resid 51 and name HD21 ) 4.17 4.17 0.00 peak 652 assign ( resid 148 and name HA ) ( resid 151 and name HD21 ) 4.17 4.17 0.00 peak 652 assign ( resid 51 and name HN ) ( resid 51 and name HD21 ) 4.49 4.49 0.00 peak 655 assign ( resid 151 and name HN ) ( resid 151 and name HD21 ) 4.49 4.49 0.00 peak 655 assign ( resid 47 and name HD+ ) ( resid 51 and name HD21 ) 5.25 5.25 0.00 peak 657 assign ( resid 147 and name HD+ ) ( resid 151 and name HD21 ) 5.25 5.25 0.00 peak 657 assign ( resid 47 and name HB+ ) ( resid 51 and name HD21 ) 4.90 4.90 0.00 peak 658 assign ( resid 147 and name HB+ ) ( resid 151 and name HD21 ) 4.90 4.90 0.00 peak 658 assign ( resid 48 and name HB+ ) ( resid 51 and name HD21 ) 4.53 4.53 0.00 peak 659 assign ( resid 148 and name HB+ ) ( resid 151 and name HD21 ) 4.53 4.53 0.00 peak 659 assign ( resid 50 and name HG2+ ) ( resid 51 and name HD21 ) 5.31 5.31 0.00 peak 660 assign ( resid 150 and name HG2+ ) ( resid 151 and name HD21 ) 5.31 5.31 0.00 peak 660 assign ( resid 92 and name HG2 ) ( resid 92 and name HE21 ) 3.54 3.54 0.00 peak 662 assign ( resid 192 and name HG2 ) ( resid 192 and name HE21 ) 3.54 3.54 0.00 peak 662 assign ( resid 92 and name HG1 ) ( resid 92 and name HE21 ) 3.48 3.48 0.00 peak 663 assign ( resid 192 and name HG1 ) ( resid 192 and name HE21 ) 3.48 3.48 0.00 peak 663 assign ( resid 56 and name HB+ ) ( resid 56 and name HE21 ) 3.33 3.33 0.00 peak 664 assign ( resid 156 and name HB+ ) ( resid 156 and name HE21 ) 3.33 3.33 0.00 peak 664 assign ( resid 92 and name HB+ ) ( resid 92 and name HE21 ) 3.92 3.92 0.00 peak 665 assign ( resid 192 and name HB+ ) ( resid 192 and name HE21 ) 3.92 3.92 0.00 peak 665 assign ( resid 64 and name HB+ ) ( resid 192 and name HE21 ) 4.19 4.19 0.00 peak 668 assign ( resid 92 and name HE21 ) ( resid 164 and name HB+ ) 4.19 4.19 0.00 peak 668 assign ( resid 85 and name HG1+ ) ( resid 156 and name HE21 ) 5.50 5.50 0.00 peak 669 assign ( resid 56 and name HE21 ) ( resid 185 and name HG1+ ) 5.50 5.50 0.00 peak 669 assign ( resid 56 and name HN ) ( resid 56 and name HE21 ) 4.51 4.51 0.00 peak 679 assign ( resid 156 and name HN ) ( resid 156 and name HE21 ) 4.51 4.51 0.00 peak 679 assign ( resid 51 and name HN ) ( resid 51 and name HD22 ) 4.68 4.68 0.00 peak 682 assign ( resid 151 and name HN ) ( resid 151 and name HD22 ) 4.68 4.68 0.00 peak 682 assign ( resid 48 and name HA ) ( resid 51 and name HD22 ) 4.32 4.32 0.00 peak 688 assign ( resid 148 and name HA ) ( resid 151 and name HD22 ) 4.32 4.32 0.00 peak 688 assign ( resid 51 and name HB+ ) ( resid 51 and name HD22 ) 3.52 3.52 0.00 peak 690 assign ( resid 151 and name HB+ ) ( resid 151 and name HD22 ) 3.52 3.52 0.00 peak 690 assign ( resid 48 and name HB+ ) ( resid 51 and name HD22 ) 5.50 5.50 0.00 peak 692 assign ( resid 148 and name HB+ ) ( resid 151 and name HD22 ) 5.50 5.50 0.00 peak 692 assign ( resid 86 and name HB+ ) ( resid 90 and name HD22 ) 4.26 4.26 0.00 peak 695 assign ( resid 186 and name HB+ ) ( resid 190 and name HD22 ) 4.26 4.26 0.00 peak 695 assign ( resid 95 and name HB+ ) ( resid 95 and name HE22 ) 4.77 4.77 0.00 peak 695 assign ( resid 195 and name HB+ ) ( resid 195 and name HE22 ) 4.77 4.77 0.00 peak 695 assign ( resid 94 and name HB+ ) ( resid 95 and name HE22 ) 4.09 4.09 0.00 peak 697 assign ( resid 194 and name HB+ ) ( resid 195 and name HE22 ) 4.09 4.09 0.00 peak 697 assign ( resid 91 and name HD2+ ) ( resid 95 and name HE22 ) 4.84 4.84 0.00 peak 699 assign ( resid 191 and name HD2+ ) ( resid 195 and name HE22 ) 4.84 4.84 0.00 peak 699 assign ( resid 90 and name HB1 ) ( resid 90 and name HD22 ) 3.75 3.75 0.00 peak 700 assign ( resid 190 and name HB1 ) ( resid 190 and name HD22 ) 3.75 3.75 0.00 peak 700 assign ( resid 90 and name HB2 ) ( resid 90 and name HD22 ) 3.61 3.61 0.00 peak 701 assign ( resid 190 and name HB2 ) ( resid 190 and name HD22 ) 3.61 3.61 0.00 peak 701 assign ( resid 87 and name HA ) ( resid 90 and name HD22 ) 3.80 3.80 0.00 peak 707 assign ( resid 187 and name HA ) ( resid 190 and name HD22 ) 3.80 3.80 0.00 peak 707 assign ( resid 54 and name HN ) ( resid 54 and name HD1+ ) 4.09 4.09 0.00 peak 727 assign ( resid 154 and name HN ) ( resid 154 and name HD1+ ) 4.09 4.09 0.00 peak 727 assign ( resid 56 and name HN ) ( resid 57 and name HN ) 4.07 4.07 0.00 peak 728 assign ( resid 156 and name HN ) ( resid 157 and name HN ) 4.07 4.07 0.00 peak 728 assign ( resid 61 and name HN ) ( resid 63 and name HN ) 4.76 4.76 0.00 peak 729 assign ( resid 161 and name HN ) ( resid 163 and name HN ) 4.76 4.76 0.00 peak 729 assign ( resid 63 and name HN ) ( resid 63 and name HB1 ) 3.57 3.57 0.00 peak 733 assign ( resid 163 and name HN ) ( resid 163 and name HB1 ) 3.57 3.57 0.00 peak 733 assign ( resid 63 and name HN ) ( resid 63 and name HB2 ) 3.40 3.40 0.00 peak 734 assign ( resid 163 and name HN ) ( resid 163 and name HB2 ) 3.40 3.40 0.00 peak 734 assign ( resid 63 and name HN ) ( resid 64 and name HB+ ) 4.28 4.28 0.00 peak 735 assign ( resid 163 and name HN ) ( resid 164 and name HB+ ) 4.28 4.28 0.00 peak 735 assign ( resid 66 and name HB+ ) ( resid 67 and name HN ) 4.03 4.03 0.00 peak 736 assign ( resid 166 and name HB+ ) ( resid 167 and name HN ) 4.03 4.03 0.00 peak 736 assign ( resid 91 and name HA ) ( resid 95 and name HE22 ) 4.68 4.68 0.00 peak 741 assign ( resid 191 and name HA ) ( resid 195 and name HE22 ) 4.68 4.68 0.00 peak 741 assign ( resid 95 and name HN ) ( resid 95 and name HE22 ) 5.32 5.32 0.00 peak 742 assign ( resid 195 and name HN ) ( resid 195 and name HE22 ) 5.32 5.32 0.00 peak 742 assign ( resid 56 and name HN ) ( resid 56 and name HE22 ) 5.48 5.48 0.00 peak 746 assign ( resid 156 and name HN ) ( resid 156 and name HE22 ) 5.48 5.48 0.00 peak 746 assign ( resid 88 and name HN ) ( resid 89 and name HN ) 4.06 4.06 0.00 peak 13 assign ( resid 188 and name HN ) ( resid 189 and name HN ) 4.06 4.06 0.00 peak 13 assign ( resid 87 and name HN ) ( resid 89 and name HN ) 5.20 5.20 0.00 peak 23 assign ( resid 187 and name HN ) ( resid 189 and name HN ) 5.20 5.20 0.00 peak 23 assign ( resid 76 and name HN ) ( resid 80 and name HN ) 5.05 5.05 0.00 peak 30 assign ( resid 176 and name HN ) ( resid 180 and name HN ) 5.05 5.05 0.00 peak 30 assign ( resid 78 and name HN ) ( resid 80 and name HN ) 5.47 5.47 0.00 peak 30 assign ( resid 178 and name HN ) ( resid 180 and name HN ) 5.47 5.47 0.00 peak 30 assign ( resid 87 and name HA ) ( resid 89 and name HN ) 4.65 4.65 0.00 peak 35 assign ( resid 187 and name HA ) ( resid 189 and name HN ) 4.65 4.65 0.00 peak 35 assign ( resid 55 and name HA ) ( resid 57 and name HN ) 5.02 5.02 0.00 peak 43 assign ( resid 155 and name HA ) ( resid 157 and name HN ) 5.02 5.02 0.00 peak 43 assign ( resid 59 and name HB ) ( resid 61 and name HN ) 5.50 5.50 0.00 peak 43 assign ( resid 159 and name HB ) ( resid 161 and name HN ) 5.50 5.50 0.00 peak 43 assign ( resid 76 and name HN ) ( resid 79 and name HA ) 5.50 5.50 0.00 peak 47 assign ( resid 176 and name HN ) ( resid 179 and name HA ) 5.50 5.50 0.00 peak 47 assign ( resid 78 and name HN ) ( resid 79 and name HA ) 5.50 5.50 0.00 peak 47 assign ( resid 178 and name HN ) ( resid 179 and name HA ) 5.50 5.50 0.00 peak 47 assign ( resid 81 and name HA ) ( resid 83 and name HN ) 5.48 5.48 0.00 peak 52 assign ( resid 181 and name HA ) ( resid 183 and name HN ) 5.48 5.48 0.00 peak 52 assign ( resid 68 and name HB2 ) ( resid 69 and name HN ) 4.45 4.45 0.00 peak 62 assign ( resid 168 and name HB2 ) ( resid 169 and name HN ) 4.45 4.45 0.00 peak 62 assign ( resid 82 and name HG2 ) ( resid 83 and name HN ) 4.75 4.75 0.00 peak 63 assign ( resid 182 and name HG2 ) ( resid 183 and name HN ) 4.75 4.75 0.00 peak 63 assign ( resid 56 and name HG1 ) ( resid 57 and name HN ) 4.59 4.59 0.00 peak 65 assign ( resid 156 and name HG1 ) ( resid 157 and name HN ) 4.59 4.59 0.00 peak 65 assign ( resid 82 and name HB2 ) ( resid 83 and name HN ) 4.40 4.40 0.00 peak 69 assign ( resid 182 and name HB2 ) ( resid 183 and name HN ) 4.40 4.40 0.00 peak 69 assign ( resid 76 and name HB2 ) ( resid 77 and name HN ) 4.09 4.09 0.00 peak 73 assign ( resid 176 and name HB2 ) ( resid 177 and name HN ) 4.09 4.09 0.00 peak 73 assign ( resid 54 and name HN ) ( resid 54 and name HB1 ) 4.00 4.00 0.00 peak 74 assign ( resid 154 and name HN ) ( resid 154 and name HB1 ) 4.00 4.00 0.00 peak 74 assign ( resid 77 and name HB+ ) ( resid 78 and name HN ) 4.16 4.16 0.00 peak 76 assign ( resid 177 and name HB+ ) ( resid 178 and name HN ) 4.16 4.16 0.00 peak 76 assign ( resid 77 and name HN ) ( resid 77 and name HB+ ) 3.87 3.87 0.00 peak 77 assign ( resid 177 and name HN ) ( resid 177 and name HB+ ) 3.87 3.87 0.00 peak 77 assign ( resid 46 and name HG1 ) ( resid 178 and name HN ) 4.22 4.22 0.00 peak 85 assign ( resid 78 and name HN ) ( resid 146 and name HG1 ) 4.22 4.22 0.00 peak 85 assign ( resid 46 and name HG2 ) ( resid 178 and name HN ) 4.60 4.60 0.00 peak 91 assign ( resid 78 and name HN ) ( resid 146 and name HG2 ) 4.60 4.60 0.00 peak 91 assign ( resid 83 and name HN ) ( resid 86 and name HG1 ) 4.71 4.71 0.00 peak 92 assign ( resid 183 and name HN ) ( resid 186 and name HG1 ) 4.71 4.71 0.00 peak 92 assign ( resid 77 and name HG1 ) ( resid 78 and name HN ) 4.18 4.18 0.00 peak 100 assign ( resid 177 and name HG1 ) ( resid 178 and name HN ) 4.18 4.18 0.00 peak 100 assign ( resid 61 and name HN ) ( resid 61 and name HG11 ) 4.08 4.08 0.00 peak 101 assign ( resid 161 and name HN ) ( resid 161 and name HG11 ) 4.08 4.08 0.00 peak 101 assign ( resid 61 and name HN ) ( resid 84 and name HG2+ ) 4.90 4.90 0.00 peak 105 assign ( resid 161 and name HN ) ( resid 184 and name HG2+ ) 4.90 4.90 0.00 peak 105 assign ( resid 61 and name HN ) ( resid 61 and name HG2+ ) 4.10 4.10 0.00 peak 110 assign ( resid 161 and name HN ) ( resid 161 and name HG2+ ) 4.10 4.10 0.00 peak 110 assign ( resid 54 and name HN ) ( resid 54 and name HD2+ ) 4.99 4.99 0.00 peak 111 assign ( resid 154 and name HN ) ( resid 154 and name HD2+ ) 4.99 4.99 0.00 peak 111 assign ( resid 76 and name HN ) ( resid 80 and name HD1+ ) 4.32 4.32 0.00 peak 115 assign ( resid 176 and name HN ) ( resid 180 and name HD1+ ) 4.32 4.32 0.00 peak 115 assign ( resid 80 and name HG1+ ) ( resid 81 and name HN ) 4.65 4.65 0.00 peak 122 assign ( resid 180 and name HG1+ ) ( resid 181 and name HN ) 4.65 4.65 0.00 peak 122 assign ( resid 80 and name HN ) ( resid 80 and name HG1+ ) 4.26 4.26 0.00 peak 123 assign ( resid 180 and name HN ) ( resid 180 and name HG1+ ) 4.26 4.26 0.00 peak 123 assign ( resid 61 and name HG2+ ) ( resid 64 and name HN ) 4.86 4.86 0.00 peak 130 assign ( resid 161 and name HG2+ ) ( resid 164 and name HN ) 4.86 4.86 0.00 peak 130 assign ( resid 61 and name HG2+ ) ( resid 63 and name HN ) 5.18 5.18 0.00 peak 131 assign ( resid 161 and name HG2+ ) ( resid 163 and name HN ) 5.18 5.18 0.00 peak 131 assign ( resid 50 and name HN ) ( resid 50 and name HD1+ ) 3.41 3.41 0.00 peak 138 assign ( resid 150 and name HN ) ( resid 150 and name HD1+ ) 3.41 3.41 0.00 peak 138 assign ( resid 54 and name HD2+ ) ( resid 55 and name HN ) 4.25 4.25 0.00 peak 141 assign ( resid 154 and name HD2+ ) ( resid 155 and name HN ) 4.25 4.25 0.00 peak 141 assign ( resid 65 and name HD1+ ) ( resid 90 and name HD21 ) 4.65 4.65 0.00 peak 156 assign ( resid 165 and name HD1+ ) ( resid 190 and name HD21 ) 4.65 4.65 0.00 peak 156 assign ( resid 65 and name HD2+ ) ( resid 90 and name HD21 ) 4.65 4.65 0.00 peak 156 assign ( resid 165 and name HD2+ ) ( resid 190 and name HD21 ) 4.65 4.65 0.00 peak 156 assign ( resid 59 and name HN ) ( resid 80 and name HG2+ ) 5.28 5.28 0.00 peak 157 assign ( resid 159 and name HN ) ( resid 180 and name HG2+ ) 5.28 5.28 0.00 peak 157 assign ( resid 91 and name HN ) ( resid 91 and name HD2+ ) 3.94 3.94 0.00 peak 160 assign ( resid 191 and name HN ) ( resid 191 and name HD2+ ) 3.94 3.94 0.00 peak 160 assign ( resid 91 and name HD2+ ) ( resid 92 and name HN ) 5.26 5.26 0.00 peak 162 assign ( resid 191 and name HD2+ ) ( resid 192 and name HN ) 5.26 5.26 0.00 peak 162 assign ( resid 62 and name HD2+ ) ( resid 72 and name HN ) 4.93 4.93 0.00 peak 166 assign ( resid 162 and name HD2+ ) ( resid 172 and name HN ) 4.93 4.93 0.00 peak 166 assign ( resid 62 and name HD2+ ) ( resid 63 and name HN ) 4.80 4.80 0.00 peak 168 assign ( resid 162 and name HD2+ ) ( resid 163 and name HN ) 4.80 4.80 0.00 peak 168 assign ( resid 43 and name HN ) ( resid 43 and name HB+ ) 3.37 3.37 0.00 peak 172 assign ( resid 143 and name HN ) ( resid 143 and name HB+ ) 3.37 3.37 0.00 peak 172 assign ( resid 43 and name HB+ ) ( resid 44 and name HN ) 3.69 3.69 0.00 peak 173 assign ( resid 143 and name HB+ ) ( resid 144 and name HN ) 3.69 3.69 0.00 peak 173 assign ( resid 80 and name HB ) ( resid 81 and name HN ) 3.76 3.76 0.00 peak 176 assign ( resid 180 and name HB ) ( resid 181 and name HN ) 3.76 3.76 0.00 peak 176 assign ( resid 40 and name HG2 ) ( resid 41 and name HN ) 4.53 4.53 0.00 peak 177 assign ( resid 140 and name HG2 ) ( resid 141 and name HN ) 4.53 4.53 0.00 peak 177 assign ( resid 65 and name HN ) ( resid 66 and name HB+ ) 4.88 4.88 0.00 peak 185 assign ( resid 165 and name HN ) ( resid 166 and name HB+ ) 4.88 4.88 0.00 peak 185 assign ( resid 47 and name HN ) ( resid 47 and name HB+ ) 3.33 3.33 0.00 peak 188 assign ( resid 147 and name HN ) ( resid 147 and name HB+ ) 3.33 3.33 0.00 peak 188 assign ( resid 62 and name HB1 ) ( resid 63 and name HN ) 3.82 3.82 0.00 peak 191 assign ( resid 162 and name HB1 ) ( resid 163 and name HN ) 3.82 3.82 0.00 peak 191 assign ( resid 50 and name HB ) ( resid 51 and name HN ) 3.35 3.35 0.00 peak 193 assign ( resid 150 and name HB ) ( resid 151 and name HN ) 3.35 3.35 0.00 peak 193 assign ( resid 39 and name HN ) ( resid 39 and name HB1 ) 3.70 3.70 0.00 peak 194 assign ( resid 139 and name HN ) ( resid 139 and name HB1 ) 3.70 3.70 0.00 peak 194 assign ( resid 89 and name HB+ ) ( resid 90 and name HN ) 3.17 3.17 0.00 peak 195 assign ( resid 189 and name HB+ ) ( resid 190 and name HN ) 3.17 3.17 0.00 peak 195 assign ( resid 39 and name HN ) ( resid 39 and name HB2 ) 3.70 3.70 0.00 peak 200 assign ( resid 139 and name HN ) ( resid 139 and name HB2 ) 3.70 3.70 0.00 peak 200 assign ( resid 71 and name HN ) ( resid 71 and name HB+ ) 3.43 3.43 0.00 peak 201 assign ( resid 171 and name HN ) ( resid 171 and name HB+ ) 3.43 3.43 0.00 peak 201 assign ( resid 74 and name HN ) ( resid 74 and name HB+ ) 3.50 3.50 0.00 peak 202 assign ( resid 174 and name HN ) ( resid 174 and name HB+ ) 3.50 3.50 0.00 peak 202 assign ( resid 45 and name HN ) ( resid 45 and name HG1 ) 3.45 3.45 0.00 peak 203 assign ( resid 145 and name HN ) ( resid 145 and name HG1 ) 3.45 3.45 0.00 peak 203 assign ( resid 91 and name HN ) ( resid 91 and name HB1 ) 3.61 3.61 0.00 peak 206 assign ( resid 191 and name HN ) ( resid 191 and name HB1 ) 3.61 3.61 0.00 peak 206 assign ( resid 57 and name HB+ ) ( resid 59 and name HN ) 4.40 4.40 0.00 peak 207 assign ( resid 157 and name HB+ ) ( resid 159 and name HN ) 4.40 4.40 0.00 peak 207 assign ( resid 36 and name HN ) ( resid 36 and name HD+ ) 5.08 5.08 0.00 peak 208 assign ( resid 136 and name HN ) ( resid 136 and name HD+ ) 5.08 5.08 0.00 peak 208 assign ( resid 39 and name HN ) ( resid 39 and name HD+ ) 5.47 5.47 0.00 peak 208 assign ( resid 139 and name HN ) ( resid 139 and name HD+ ) 5.47 5.47 0.00 peak 208 assign ( resid 39 and name HD+ ) ( resid 42 and name HN ) 4.23 4.23 0.00 peak 209 assign ( resid 139 and name HD+ ) ( resid 142 and name HN ) 4.23 4.23 0.00 peak 209 assign ( resid 45 and name HN ) ( resid 45 and name HG2 ) 3.93 3.93 0.00 peak 210 assign ( resid 145 and name HN ) ( resid 145 and name HG2 ) 3.93 3.93 0.00 peak 210 assign ( resid 57 and name HB+ ) ( resid 58 and name HN ) 3.54 3.54 0.00 peak 211 assign ( resid 157 and name HB+ ) ( resid 158 and name HN ) 3.54 3.54 0.00 peak 211 assign ( resid 39 and name HD+ ) ( resid 41 and name HN ) 4.33 4.33 0.00 peak 212 assign ( resid 139 and name HD+ ) ( resid 141 and name HN ) 4.33 4.33 0.00 peak 212 assign ( resid 56 and name HN ) ( resid 57 and name HB+ ) 4.89 4.89 0.00 peak 215 assign ( resid 156 and name HN ) ( resid 157 and name HB+ ) 4.89 4.89 0.00 peak 215 assign ( resid 86 and name HN ) ( resid 86 and name HG1 ) 3.82 3.82 0.00 peak 220 assign ( resid 186 and name HN ) ( resid 186 and name HG1 ) 3.82 3.82 0.00 peak 220 assign ( resid 65 and name HN ) ( resid 65 and name HG ) 3.86 3.86 0.00 peak 221 assign ( resid 165 and name HN ) ( resid 165 and name HG ) 3.86 3.86 0.00 peak 221 assign ( resid 67 and name HN ) ( resid 67 and name HD+ ) 4.05 4.05 0.00 peak 222 assign ( resid 167 and name HN ) ( resid 167 and name HD+ ) 4.05 4.05 0.00 peak 222 assign ( resid 41 and name HG12 ) ( resid 42 and name HN ) 4.00 4.00 0.00 peak 225 assign ( resid 141 and name HG12 ) ( resid 142 and name HN ) 4.00 4.00 0.00 peak 225 assign ( resid 54 and name HB2 ) ( resid 55 and name HN ) 3.88 3.88 0.00 peak 226 assign ( resid 154 and name HB2 ) ( resid 155 and name HN ) 3.88 3.88 0.00 peak 226 assign ( resid 71 and name HG+ ) ( resid 72 and name HN ) 3.56 3.56 0.00 peak 231 assign ( resid 171 and name HG+ ) ( resid 172 and name HN ) 3.56 3.56 0.00 peak 231 assign ( resid 68 and name HN ) ( resid 71 and name HG+ ) 4.33 4.33 0.00 peak 233 assign ( resid 168 and name HN ) ( resid 171 and name HG+ ) 4.33 4.33 0.00 peak 233 assign ( resid 74 and name HN ) ( resid 75 and name HB2 ) 3.87 3.87 0.00 peak 237 assign ( resid 174 and name HN ) ( resid 175 and name HB2 ) 3.87 3.87 0.00 peak 237 assign ( resid 66 and name HG+ ) ( resid 67 and name HN ) 4.61 4.61 0.00 peak 238 assign ( resid 166 and name HG+ ) ( resid 167 and name HN ) 4.61 4.61 0.00 peak 238 assign ( resid 65 and name HN ) ( resid 66 and name HG+ ) 3.94 3.94 0.00 peak 239 assign ( resid 165 and name HN ) ( resid 166 and name HG+ ) 3.94 3.94 0.00 peak 239 assign ( resid 39 and name HN ) ( resid 39 and name HG2 ) 3.48 3.48 0.00 peak 240 assign ( resid 139 and name HN ) ( resid 139 and name HG2 ) 3.48 3.48 0.00 peak 240 assign ( resid 75 and name HN ) ( resid 75 and name HB2 ) 3.46 3.46 0.00 peak 242 assign ( resid 175 and name HN ) ( resid 175 and name HB2 ) 3.46 3.46 0.00 peak 242 assign ( resid 86 and name HN ) ( resid 86 and name HG2 ) 4.17 4.17 0.00 peak 244 assign ( resid 186 and name HN ) ( resid 186 and name HG2 ) 4.17 4.17 0.00 peak 244 assign ( resid 62 and name HN ) ( resid 62 and name HB2 ) 3.71 3.71 0.00 peak 251 assign ( resid 162 and name HN ) ( resid 162 and name HB2 ) 3.71 3.71 0.00 peak 251 assign ( resid 62 and name HB2 ) ( resid 63 and name HN ) 3.82 3.82 0.00 peak 252 assign ( resid 162 and name HB2 ) ( resid 163 and name HN ) 3.82 3.82 0.00 peak 252 assign ( resid 65 and name HN ) ( resid 67 and name HG+ ) 4.91 4.91 0.00 peak 254 assign ( resid 165 and name HN ) ( resid 167 and name HG+ ) 4.91 4.91 0.00 peak 254 assign ( resid 78 and name HB+ ) ( resid 149 and name HN ) 4.39 4.39 0.00 peak 260 assign ( resid 49 and name HN ) ( resid 178 and name HB+ ) 4.39 4.39 0.00 peak 260 assign ( resid 41 and name HG11 ) ( resid 42 and name HN ) 4.91 4.91 0.00 peak 265 assign ( resid 141 and name HG11 ) ( resid 142 and name HN ) 4.91 4.91 0.00 peak 265 assign ( resid 58 and name HN ) ( resid 84 and name HG2+ ) 5.28 5.28 0.00 peak 273 assign ( resid 158 and name HN ) ( resid 184 and name HG2+ ) 5.28 5.28 0.00 peak 273 assign ( resid 85 and name HN ) ( resid 85 and name HG1+ ) 3.81 3.81 0.00 peak 280 assign ( resid 185 and name HN ) ( resid 185 and name HG1+ ) 3.81 3.81 0.00 peak 280 assign ( resid 90 and name HB1 ) ( resid 90 and name HD21 ) 3.36 3.36 0.00 peak 284 assign ( resid 190 and name HB1 ) ( resid 190 and name HD21 ) 3.36 3.36 0.00 peak 284 assign ( resid 65 and name HN ) ( resid 66 and name HE+ ) 4.52 4.52 0.00 peak 286 assign ( resid 165 and name HN ) ( resid 166 and name HE+ ) 4.52 4.52 0.00 peak 286 assign ( resid 44 and name HN ) ( resid 44 and name HE+ ) 4.52 4.52 0.00 peak 289 assign ( resid 144 and name HN ) ( resid 144 and name HE+ ) 4.52 4.52 0.00 peak 289 assign ( resid 67 and name HN ) ( resid 67 and name HE+ ) 4.69 4.69 0.00 peak 295 assign ( resid 167 and name HN ) ( resid 167 and name HE+ ) 4.69 4.69 0.00 peak 295 assign ( resid 51 and name HN ) ( resid 51 and name HB1 ) 3.91 3.91 0.00 peak 296 assign ( resid 151 and name HN ) ( resid 151 and name HB1 ) 3.91 3.91 0.00 peak 296 assign ( resid 51 and name HN ) ( resid 51 and name HB2 ) 3.84 3.84 0.00 peak 299 assign ( resid 151 and name HN ) ( resid 151 and name HB2 ) 3.84 3.84 0.00 peak 299 assign ( resid 51 and name HB2 ) ( resid 52 and name HN ) 4.25 4.25 0.00 peak 301 assign ( resid 151 and name HB2 ) ( resid 152 and name HN ) 4.25 4.25 0.00 peak 301 assign ( resid 68 and name HB1 ) ( resid 71 and name HN ) 4.17 4.17 0.00 peak 302 assign ( resid 168 and name HB1 ) ( resid 171 and name HN ) 4.17 4.17 0.00 peak 302 assign ( resid 42 and name HN ) ( resid 42 and name HG2 ) 3.60 3.60 0.00 peak 307 assign ( resid 142 and name HN ) ( resid 142 and name HG2 ) 3.60 3.60 0.00 peak 307 assign ( resid 91 and name HN ) ( resid 92 and name HG2 ) 5.25 5.25 0.00 peak 317 assign ( resid 191 and name HN ) ( resid 192 and name HG2 ) 5.25 5.25 0.00 peak 317 assign ( resid 56 and name HN ) ( resid 56 and name HG1 ) 4.04 4.04 0.00 peak 321 assign ( resid 156 and name HN ) ( resid 156 and name HG1 ) 4.04 4.04 0.00 peak 321 assign ( resid 56 and name HN ) ( resid 56 and name HB+ ) 3.43 3.43 0.00 peak 326 assign ( resid 156 and name HN ) ( resid 156 and name HB+ ) 3.43 3.43 0.00 peak 326 assign ( resid 82 and name HG1 ) ( resid 86 and name HN ) 4.41 4.41 0.00 peak 327 assign ( resid 182 and name HG1 ) ( resid 186 and name HN ) 4.41 4.41 0.00 peak 327 assign ( resid 41 and name HN ) ( resid 43 and name HG+ ) 4.97 4.97 0.00 peak 330 assign ( resid 141 and name HN ) ( resid 143 and name HG+ ) 4.97 4.97 0.00 peak 330 assign ( resid 52 and name HN ) ( resid 52 and name HB1 ) 3.76 3.76 0.00 peak 335 assign ( resid 152 and name HN ) ( resid 152 and name HB1 ) 3.76 3.76 0.00 peak 335 assign ( resid 52 and name HB1 ) ( resid 53 and name HN ) 3.91 3.91 0.00 peak 336 assign ( resid 152 and name HB1 ) ( resid 153 and name HN ) 3.91 3.91 0.00 peak 336 assign ( resid 85 and name HB ) ( resid 86 and name HN ) 3.67 3.67 0.00 peak 339 assign ( resid 185 and name HB ) ( resid 186 and name HN ) 3.67 3.67 0.00 peak 339 assign ( resid 92 and name HN ) ( resid 92 and name HB1 ) 3.63 3.63 0.00 peak 340 assign ( resid 192 and name HN ) ( resid 192 and name HB1 ) 3.63 3.63 0.00 peak 340 assign ( resid 92 and name HB1 ) ( resid 92 and name HE22 ) 4.35 4.35 0.00 peak 341 assign ( resid 192 and name HB1 ) ( resid 192 and name HE22 ) 4.35 4.35 0.00 peak 341 assign ( resid 42 and name HN ) ( resid 42 and name HB2 ) 3.53 3.53 0.00 peak 346 assign ( resid 142 and name HN ) ( resid 142 and name HB2 ) 3.53 3.53 0.00 peak 346 assign ( resid 92 and name HB2 ) ( resid 93 and name HN ) 3.83 3.83 0.00 peak 348 assign ( resid 192 and name HB2 ) ( resid 193 and name HN ) 3.83 3.83 0.00 peak 348 assign ( resid 92 and name HN ) ( resid 92 and name HB2 ) 3.52 3.52 0.00 peak 349 assign ( resid 192 and name HN ) ( resid 192 and name HB2 ) 3.52 3.52 0.00 peak 349 assign ( resid 52 and name HB2 ) ( resid 53 and name HN ) 3.91 3.91 0.00 peak 352 assign ( resid 152 and name HB2 ) ( resid 153 and name HN ) 3.91 3.91 0.00 peak 352 assign ( resid 93 and name HD+ ) ( resid 95 and name HN ) 4.78 4.78 0.00 peak 355 assign ( resid 193 and name HD+ ) ( resid 195 and name HN ) 4.78 4.78 0.00 peak 355 assign ( resid 93 and name HN ) ( resid 93 and name HD+ ) 4.24 4.24 0.00 peak 357 assign ( resid 193 and name HN ) ( resid 193 and name HD+ ) 4.24 4.24 0.00 peak 357 assign ( resid 42 and name HN ) ( resid 45 and name HD+ ) 4.74 4.74 0.00 peak 360 assign ( resid 142 and name HN ) ( resid 145 and name HD+ ) 4.74 4.74 0.00 peak 360 assign ( resid 71 and name HN ) ( resid 71 and name HD+ ) 4.08 4.08 0.00 peak 366 assign ( resid 171 and name HN ) ( resid 171 and name HD+ ) 4.08 4.08 0.00 peak 366 assign ( resid 86 and name HN ) ( resid 89 and name HD+ ) 5.50 5.50 0.00 peak 367 assign ( resid 186 and name HN ) ( resid 189 and name HD+ ) 5.50 5.50 0.00 peak 367 assign ( resid 72 and name HA ) ( resid 74 and name HN ) 4.28 4.28 0.00 peak 373 assign ( resid 172 and name HA ) ( resid 174 and name HN ) 4.28 4.28 0.00 peak 373 assign ( resid 72 and name HA ) ( resid 75 and name HN ) 5.50 5.50 0.00 peak 376 assign ( resid 172 and name HA ) ( resid 175 and name HN ) 5.50 5.50 0.00 peak 376 assign ( resid 68 and name HA ) ( resid 72 and name HN ) 5.50 5.50 0.00 peak 380 assign ( resid 168 and name HA ) ( resid 172 and name HN ) 5.50 5.50 0.00 peak 380 assign ( resid 63 and name HA ) ( resid 66 and name HN ) 4.31 4.31 0.00 peak 389 assign ( resid 163 and name HA ) ( resid 166 and name HN ) 4.31 4.31 0.00 peak 389 assign ( resid 51 and name HA ) ( resid 51 and name HD21 ) 4.74 4.74 0.00 peak 392 assign ( resid 151 and name HA ) ( resid 151 and name HD21 ) 4.74 4.74 0.00 peak 392 assign ( resid 40 and name HA ) ( resid 43 and name HN ) 4.09 4.09 0.00 peak 395 assign ( resid 140 and name HA ) ( resid 143 and name HN ) 4.09 4.09 0.00 peak 395 assign ( resid 51 and name HA ) ( resid 53 and name HN ) 4.58 4.58 0.00 peak 396 assign ( resid 151 and name HA ) ( resid 153 and name HN ) 4.58 4.58 0.00 peak 396 assign ( resid 42 and name HA ) ( resid 45 and name HN ) 3.70 3.70 0.00 peak 407 assign ( resid 142 and name HA ) ( resid 145 and name HN ) 3.70 3.70 0.00 peak 407 assign ( resid 42 and name HA ) ( resid 44 and name HN ) 4.39 4.39 0.00 peak 408 assign ( resid 142 and name HA ) ( resid 144 and name HN ) 4.39 4.39 0.00 peak 408 assign ( resid 94 and name HA ) ( resid 95 and name HN ) 3.47 3.47 0.00 peak 410 assign ( resid 194 and name HA ) ( resid 195 and name HN ) 3.47 3.47 0.00 peak 410 assign ( resid 93 and name HN ) ( resid 94 and name HA ) 4.82 4.82 0.00 peak 411 assign ( resid 193 and name HN ) ( resid 194 and name HA ) 4.82 4.82 0.00 peak 411 assign ( resid 73 and name HA ) ( resid 74 and name HN ) 3.09 3.09 0.00 peak 412 assign ( resid 173 and name HA ) ( resid 174 and name HN ) 3.09 3.09 0.00 peak 412 assign ( resid 69 and name HA ) ( resid 70 and name HN ) 3.55 3.55 0.00 peak 425 assign ( resid 169 and name HA ) ( resid 170 and name HN ) 3.55 3.55 0.00 peak 425 assign ( resid 43 and name HA ) ( resid 47 and name HN ) 4.65 4.65 0.00 peak 430 assign ( resid 143 and name HA ) ( resid 147 and name HN ) 4.65 4.65 0.00 peak 430 assign ( resid 92 and name HA ) ( resid 93 and name HN ) 3.45 3.45 0.00 peak 435 assign ( resid 192 and name HA ) ( resid 193 and name HN ) 3.45 3.45 0.00 peak 435 assign ( resid 92 and name HA ) ( resid 92 and name HE22 ) 4.55 4.55 0.00 peak 437 assign ( resid 192 and name HA ) ( resid 192 and name HE22 ) 4.55 4.55 0.00 peak 437 assign ( resid 56 and name HA ) ( resid 59 and name HN ) 4.16 4.16 0.00 peak 444 assign ( resid 156 and name HA ) ( resid 159 and name HN ) 4.16 4.16 0.00 peak 444 assign ( resid 91 and name HA ) ( resid 94 and name HN ) 4.43 4.43 0.00 peak 449 assign ( resid 191 and name HA ) ( resid 194 and name HN ) 4.43 4.43 0.00 peak 449 assign ( resid 66 and name HA ) ( resid 68 and name HN ) 4.49 4.49 0.00 peak 450 assign ( resid 166 and name HA ) ( resid 168 and name HN ) 4.49 4.49 0.00 peak 450 assign ( resid 41 and name HA ) ( resid 43 and name HN ) 4.52 4.52 0.00 peak 456 assign ( resid 141 and name HA ) ( resid 143 and name HN ) 4.52 4.52 0.00 peak 456 assign ( resid 41 and name HA ) ( resid 44 and name HN ) 4.19 4.19 0.00 peak 462 assign ( resid 141 and name HA ) ( resid 144 and name HN ) 4.19 4.19 0.00 peak 462 assign ( resid 47 and name HA ) ( resid 50 and name HN ) 4.73 4.73 0.00 peak 462 assign ( resid 147 and name HA ) ( resid 150 and name HN ) 4.73 4.73 0.00 peak 462 assign ( resid 82 and name HA ) ( resid 85 and name HN ) 3.95 3.95 0.00 peak 463 assign ( resid 182 and name HA ) ( resid 185 and name HN ) 3.95 3.95 0.00 peak 463 assign ( resid 61 and name HA ) ( resid 64 and name HN ) 3.84 3.84 0.00 peak 465 assign ( resid 161 and name HA ) ( resid 164 and name HN ) 3.84 3.84 0.00 peak 465 assign ( resid 62 and name HA ) ( resid 66 and name HN ) 4.19 4.19 0.00 peak 466 assign ( resid 162 and name HA ) ( resid 166 and name HN ) 4.19 4.19 0.00 peak 466 assign ( resid 82 and name HA ) ( resid 86 and name HN ) 4.74 4.74 0.00 peak 466 assign ( resid 182 and name HA ) ( resid 186 and name HN ) 4.74 4.74 0.00 peak 466 assign ( resid 62 and name HA ) ( resid 65 and name HN ) 4.55 4.55 0.00 peak 468 assign ( resid 162 and name HA ) ( resid 165 and name HN ) 4.55 4.55 0.00 peak 468 assign ( resid 37 and name HN ) ( resid 37 and name HB1 ) 4.17 4.17 0.00 peak 471 assign ( resid 137 and name HN ) ( resid 137 and name HB1 ) 4.17 4.17 0.00 peak 471 assign ( resid 37 and name HN ) ( resid 37 and name HB2 ) 4.17 4.17 0.00 peak 477 assign ( resid 137 and name HN ) ( resid 137 and name HB2 ) 4.17 4.17 0.00 peak 477 assign ( resid 40 and name HD2 ) ( resid 41 and name HN ) 4.47 4.47 0.00 peak 485 assign ( resid 140 and name HD2 ) ( resid 141 and name HN ) 4.47 4.47 0.00 peak 485 assign ( resid 93 and name HN ) ( resid 95 and name HE22 ) 5.27 5.27 0.00 peak 500 assign ( resid 193 and name HN ) ( resid 195 and name HE22 ) 5.27 5.27 0.00 peak 500 assign ( resid 58 and name HN ) ( resid 59 and name HN ) 4.23 4.23 0.00 peak 518 assign ( resid 158 and name HN ) ( resid 159 and name HN ) 4.23 4.23 0.00 peak 518 assign ( resid 65 and name HN ) ( resid 66 and name HN ) 3.48 3.48 0.00 peak 525 assign ( resid 165 and name HN ) ( resid 166 and name HN ) 3.48 3.48 0.00 peak 525 assign ( resid 92 and name HN ) ( resid 93 and name HN ) 3.82 3.82 0.00 peak 525 assign ( resid 192 and name HN ) ( resid 193 and name HN ) 3.82 3.82 0.00 peak 525 assign ( resid 92 and name HN ) ( resid 94 and name HN ) 4.26 4.26 0.00 peak 532 assign ( resid 192 and name HN ) ( resid 194 and name HN ) 4.26 4.26 0.00 peak 532 assign ( resid 90 and name HN ) ( resid 92 and name HN ) 4.00 4.00 0.00 peak 533 assign ( resid 190 and name HN ) ( resid 192 and name HN ) 4.00 4.00 0.00 peak 533 assign ( resid 95 and name HN ) ( resid 95 and name HE21 ) 4.20 4.20 0.00 peak 536 assign ( resid 195 and name HN ) ( resid 195 and name HE21 ) 4.20 4.20 0.00 peak 536 assign ( resid 93 and name HN ) ( resid 95 and name HE21 ) 4.45 4.45 0.00 peak 537 assign ( resid 193 and name HN ) ( resid 195 and name HE21 ) 4.45 4.45 0.00 peak 537 assign ( resid 44 and name HN ) ( resid 45 and name HN ) 2.97 2.97 0.00 peak 544 assign ( resid 144 and name HN ) ( resid 145 and name HN ) 2.97 2.97 0.00 peak 544 assign ( resid 48 and name HN ) ( resid 49 and name HN ) 3.50 3.50 0.00 peak 548 assign ( resid 148 and name HN ) ( resid 149 and name HN ) 3.50 3.50 0.00 peak 548 assign ( resid 84 and name HN ) ( resid 85 and name HN ) 4.14 4.14 0.00 peak 552 assign ( resid 184 and name HN ) ( resid 185 and name HN ) 4.14 4.14 0.00 peak 552 assign ( resid 50 and name HN ) ( resid 51 and name HN ) 3.91 3.91 0.00 peak 558 assign ( resid 150 and name HN ) ( resid 151 and name HN ) 3.91 3.91 0.00 peak 558 assign ( resid 88 and name HN ) ( resid 90 and name HN ) 4.31 4.31 0.00 peak 570 assign ( resid 188 and name HN ) ( resid 190 and name HN ) 4.31 4.31 0.00 peak 570 assign ( resid 73 and name HN ) ( resid 74 and name HN ) 4.18 4.18 0.00 peak 573 assign ( resid 173 and name HN ) ( resid 174 and name HN ) 4.18 4.18 0.00 peak 573 assign ( resid 68 and name HN ) ( resid 71 and name HN ) 5.07 5.07 0.00 peak 575 assign ( resid 168 and name HN ) ( resid 171 and name HN ) 5.07 5.07 0.00 peak 575 assign ( resid 42 and name HN ) ( resid 44 and name HN ) 3.99 3.99 0.00 peak 577 assign ( resid 142 and name HN ) ( resid 144 and name HN ) 3.99 3.99 0.00 peak 577 assign ( resid 50 and name HN ) ( resid 52 and name HN ) 4.32 4.32 0.00 peak 579 assign ( resid 150 and name HN ) ( resid 152 and name HN ) 4.32 4.32 0.00 peak 579 assign ( resid 68 and name HN ) ( resid 69 and name HN ) 4.39 4.39 0.00 peak 583 assign ( resid 168 and name HN ) ( resid 169 and name HN ) 4.39 4.39 0.00 peak 583 assign ( resid 55 and name HN ) ( resid 57 and name HN ) 4.77 4.77 0.00 peak 596 assign ( resid 155 and name HN ) ( resid 157 and name HN ) 4.77 4.77 0.00 peak 596 assign ( resid 75 and name HN ) ( resid 76 and name HN ) 4.58 4.58 0.00 peak 601 assign ( resid 175 and name HN ) ( resid 176 and name HN ) 4.58 4.58 0.00 peak 601 assign ( resid 75 and name HA ) ( resid 79 and name HN ) 5.50 5.50 0.00 peak 628 assign ( resid 175 and name HA ) ( resid 179 and name HN ) 5.50 5.50 0.00 peak 628 assign ( resid 51 and name HB1 ) ( resid 51 and name HD22 ) 4.09 4.09 0.00 peak 640 assign ( resid 151 and name HB1 ) ( resid 151 and name HD22 ) 4.09 4.09 0.00 peak 640 assign ( resid 92 and name HB1 ) ( resid 92 and name HE21 ) 4.73 4.73 0.00 peak 650 assign ( resid 192 and name HB1 ) ( resid 192 and name HE21 ) 4.73 4.73 0.00 peak 650 assign ( resid 50 and name HB ) ( resid 51 and name HD22 ) 4.62 4.62 0.00 peak 656 assign ( resid 150 and name HB ) ( resid 151 and name HD22 ) 4.62 4.62 0.00 peak 656 assign ( resid 77 and name HG2 ) ( resid 79 and name HN ) 5.50 5.50 0.00 peak 665 assign ( resid 177 and name HG2 ) ( resid 179 and name HN ) 5.50 5.50 0.00 peak 665 assign ( resid 91 and name HG ) ( resid 192 and name HE21 ) 5.04 5.04 0.00 peak 666 assign ( resid 92 and name HE21 ) ( resid 191 and name HG ) 5.04 5.04 0.00 peak 666 assign ( resid 77 and name HG1 ) ( resid 79 and name HN ) 5.50 5.50 0.00 peak 667 assign ( resid 177 and name HG1 ) ( resid 179 and name HN ) 5.50 5.50 0.00 peak 667 assign ( resid 85 and name HG2+ ) ( resid 156 and name HE21 ) 5.19 5.19 0.00 peak 673 assign ( resid 56 and name HE21 ) ( resid 185 and name HG2+ ) 5.19 5.19 0.00 peak 673 assign ( resid 91 and name HD2+ ) ( resid 192 and name HE21 ) 4.76 4.76 0.00 peak 681 assign ( resid 92 and name HE21 ) ( resid 191 and name HD2+ ) 4.76 4.76 0.00 peak 681 assign ( resid 39 and name HA ) ( resid 42 and name HN ) 4.66 4.66 0.00 peak 693 assign ( resid 139 and name HA ) ( resid 142 and name HN ) 4.66 4.66 0.00 peak 693 assign ( resid 39 and name HA ) ( resid 41 and name HN ) 4.69 4.69 0.00 peak 695 assign ( resid 139 and name HA ) ( resid 141 and name HN ) 4.69 4.69 0.00 peak 695 assign ( resid 90 and name HA ) ( resid 94 and name HN ) 5.13 5.13 0.00 peak 695 assign ( resid 190 and name HA ) ( resid 194 and name HN ) 5.13 5.13 0.00 peak 695 assign ( resid 68 and name HA ) ( resid 69 and name HB+ ) 4.25 4.25 0.00 peak 711 assign ( resid 168 and name HA ) ( resid 169 and name HB+ ) 4.25 4.25 0.00 peak 711 assign ( resid 39 and name HA ) ( resid 42 and name HG2 ) 5.30 5.30 0.00 peak 726 assign ( resid 139 and name HA ) ( resid 142 and name HG2 ) 5.30 5.30 0.00 peak 726 assign ( resid 39 and name HA ) ( resid 42 and name HB2 ) 4.95 4.95 0.00 peak 729 assign ( resid 139 and name HA ) ( resid 142 and name HB2 ) 4.95 4.95 0.00 peak 729 assign ( resid 39 and name HA ) ( resid 40 and name HG1 ) 4.62 4.62 0.00 peak 730 assign ( resid 139 and name HA ) ( resid 140 and name HG1 ) 4.62 4.62 0.00 peak 730 assign ( resid 39 and name HA ) ( resid 40 and name HG2 ) 4.62 4.62 0.00 peak 732 assign ( resid 139 and name HA ) ( resid 140 and name HG2 ) 4.62 4.62 0.00 peak 732 assign ( resid 36 and name HG+ ) ( resid 37 and name HA ) 4.47 4.47 0.00 peak 737 assign ( resid 136 and name HG+ ) ( resid 137 and name HA ) 4.47 4.47 0.00 peak 737 assign ( resid 63 and name HA ) ( resid 66 and name HG+ ) 4.60 4.60 0.00 peak 738 assign ( resid 163 and name HA ) ( resid 166 and name HG+ ) 4.60 4.60 0.00 peak 738 assign ( resid 63 and name HA ) ( resid 64 and name HB+ ) 5.01 5.01 0.00 peak 739 assign ( resid 163 and name HA ) ( resid 164 and name HB+ ) 5.01 5.01 0.00 peak 739 assign ( resid 61 and name HD1+ ) ( resid 84 and name HB ) 4.67 4.67 0.00 peak 743 assign ( resid 161 and name HD1+ ) ( resid 184 and name HB ) 4.67 4.67 0.00 peak 743 assign ( resid 82 and name HA ) ( resid 85 and name HG1+ ) 4.12 4.12 0.00 peak 748 assign ( resid 182 and name HA ) ( resid 185 and name HG1+ ) 4.12 4.12 0.00 peak 748 assign ( resid 77 and name HA ) ( resid 80 and name HG1+ ) 4.44 4.44 0.00 peak 754 assign ( resid 177 and name HA ) ( resid 180 and name HG1+ ) 4.44 4.44 0.00 peak 754 assign ( resid 41 and name HA ) ( resid 41 and name HG2+ ) 3.27 3.27 0.00 peak 756 assign ( resid 141 and name HA ) ( resid 141 and name HG2+ ) 3.27 3.27 0.00 peak 756 assign ( resid 75 and name HA ) ( resid 80 and name HD1+ ) 4.17 4.17 0.00 peak 779 assign ( resid 175 and name HA ) ( resid 180 and name HD1+ ) 4.17 4.17 0.00 peak 779 assign ( resid 91 and name HD1+ ) ( resid 192 and name HA ) 4.75 4.75 0.00 peak 794 assign ( resid 92 and name HA ) ( resid 191 and name HD1+ ) 4.75 4.75 0.00 peak 794 assign ( resid 62 and name HD2+ ) ( resid 66 and name HA ) 4.94 4.94 0.00 peak 796 assign ( resid 162 and name HD2+ ) ( resid 166 and name HA ) 4.94 4.94 0.00 peak 796 assign ( resid 54 and name HB1 ) ( resid 55 and name HB+ ) 4.27 4.27 0.00 peak 798 assign ( resid 154 and name HB1 ) ( resid 155 and name HB+ ) 4.27 4.27 0.00 peak 798 assign ( resid 45 and name HB+ ) ( resid 45 and name HD+ ) 3.25 3.25 0.00 peak 805 assign ( resid 145 and name HB+ ) ( resid 145 and name HD+ ) 3.25 3.25 0.00 peak 805 assign ( resid 47 and name HB+ ) ( resid 47 and name HD+ ) 3.52 3.52 0.00 peak 805 assign ( resid 147 and name HB+ ) ( resid 147 and name HD+ ) 3.52 3.52 0.00 peak 805 assign ( resid 44 and name HA ) ( resid 44 and name HB+ ) 3.01 3.01 0.00 peak 806 assign ( resid 144 and name HA ) ( resid 144 and name HB+ ) 3.01 3.01 0.00 peak 806 assign ( resid 93 and name HA ) ( resid 93 and name HG+ ) 3.45 3.45 0.00 peak 816 assign ( resid 193 and name HA ) ( resid 193 and name HG+ ) 3.45 3.45 0.00 peak 816 assign ( resid 45 and name HA ) ( resid 45 and name HG1 ) 3.19 3.19 0.00 peak 820 assign ( resid 145 and name HA ) ( resid 145 and name HG1 ) 3.19 3.19 0.00 peak 820 assign ( resid 45 and name HG1 ) ( resid 45 and name HD+ ) 2.94 2.94 0.00 peak 821 assign ( resid 145 and name HG1 ) ( resid 145 and name HD+ ) 2.94 2.94 0.00 peak 821 assign ( resid 86 and name HA ) ( resid 86 and name HD+ ) 3.82 3.82 0.00 peak 824 assign ( resid 186 and name HA ) ( resid 186 and name HD+ ) 3.82 3.82 0.00 peak 824 assign ( resid 44 and name HA ) ( resid 44 and name HD+ ) 3.80 3.80 0.00 peak 826 assign ( resid 144 and name HA ) ( resid 144 and name HD+ ) 3.80 3.80 0.00 peak 826 assign ( resid 45 and name HG2 ) ( resid 45 and name HD+ ) 2.85 2.85 0.00 peak 830 assign ( resid 145 and name HG2 ) ( resid 145 and name HD+ ) 2.85 2.85 0.00 peak 830 assign ( resid 46 and name HG2 ) ( resid 50 and name HA ) 5.39 5.39 0.00 peak 833 assign ( resid 146 and name HG2 ) ( resid 150 and name HA ) 5.39 5.39 0.00 peak 833 assign ( resid 65 and name HA ) ( resid 65 and name HG ) 3.42 3.42 0.00 peak 837 assign ( resid 165 and name HA ) ( resid 165 and name HG ) 3.42 3.42 0.00 peak 837 assign ( resid 77 and name HG2 ) ( resid 150 and name HA ) 4.61 4.61 0.00 peak 842 assign ( resid 50 and name HA ) ( resid 177 and name HG2 ) 4.61 4.61 0.00 peak 842 assign ( resid 36 and name HA ) ( resid 36 and name HG+ ) 3.33 3.33 0.00 peak 850 assign ( resid 136 and name HA ) ( resid 136 and name HG+ ) 3.33 3.33 0.00 peak 850 assign ( resid 38 and name HB+ ) ( resid 39 and name HG2 ) 4.72 4.72 0.00 peak 854 assign ( resid 138 and name HB+ ) ( resid 139 and name HG2 ) 4.72 4.72 0.00 peak 854 assign ( resid 82 and name HA ) ( resid 86 and name HG2 ) 4.77 4.77 0.00 peak 859 assign ( resid 182 and name HA ) ( resid 186 and name HG2 ) 4.77 4.77 0.00 peak 859 assign ( resid 77 and name HA ) ( resid 77 and name HG1 ) 3.87 3.87 0.00 peak 862 assign ( resid 177 and name HA ) ( resid 177 and name HG1 ) 3.87 3.87 0.00 peak 862 assign ( resid 65 and name HA ) ( resid 67 and name HG+ ) 4.92 4.92 0.00 peak 863 assign ( resid 165 and name HA ) ( resid 167 and name HG+ ) 4.92 4.92 0.00 peak 863 assign ( resid 67 and name HG+ ) ( resid 71 and name HD+ ) 4.55 4.55 0.00 peak 867 assign ( resid 167 and name HG+ ) ( resid 171 and name HD+ ) 4.55 4.55 0.00 peak 867 assign ( resid 61 and name HA ) ( resid 84 and name HG2+ ) 4.71 4.71 0.00 peak 891 assign ( resid 161 and name HA ) ( resid 184 and name HG2+ ) 4.71 4.71 0.00 peak 891 assign ( resid 89 and name HD+ ) ( resid 92 and name HB2 ) 4.86 4.86 0.00 peak 898 assign ( resid 189 and name HD+ ) ( resid 192 and name HB2 ) 4.86 4.86 0.00 peak 898 assign ( resid 43 and name HA ) ( resid 43 and name HG+ ) 3.43 3.43 0.00 peak 907 assign ( resid 143 and name HA ) ( resid 143 and name HG+ ) 3.43 3.43 0.00 peak 907 assign ( resid 82 and name HA ) ( resid 85 and name HB ) 3.97 3.97 0.00 peak 919 assign ( resid 182 and name HA ) ( resid 185 and name HB ) 3.97 3.97 0.00 peak 919 assign ( resid 89 and name HA ) ( resid 92 and name HB2 ) 3.74 3.74 0.00 peak 931 assign ( resid 189 and name HA ) ( resid 192 and name HB2 ) 3.74 3.74 0.00 peak 931 assign ( resid 77 and name HA ) ( resid 80 and name HB ) 3.31 3.31 0.00 peak 939 assign ( resid 177 and name HA ) ( resid 180 and name HB ) 3.31 3.31 0.00 peak 939 assign ( resid 40 and name HA ) ( resid 43 and name HB+ ) 4.52 4.52 0.00 peak 941 assign ( resid 140 and name HA ) ( resid 143 and name HB+ ) 4.52 4.52 0.00 peak 941 assign ( resid 52 and name HA ) ( resid 56 and name HG2 ) 5.30 5.30 0.00 peak 950 assign ( resid 152 and name HA ) ( resid 156 and name HG2 ) 5.30 5.30 0.00 peak 950 assign ( resid 56 and name HA ) ( resid 56 and name HG2 ) 4.10 4.10 0.00 peak 952 assign ( resid 156 and name HA ) ( resid 156 and name HG2 ) 4.10 4.10 0.00 peak 952 assign ( resid 42 and name HA ) ( resid 42 and name HG1 ) 4.06 4.06 0.00 peak 956 assign ( resid 142 and name HA ) ( resid 142 and name HG1 ) 4.06 4.06 0.00 peak 956 assign ( resid 82 and name HA ) ( resid 82 and name HG2 ) 4.13 4.13 0.00 peak 958 assign ( resid 182 and name HA ) ( resid 182 and name HG2 ) 4.13 4.13 0.00 peak 958 assign ( resid 56 and name HG1 ) ( resid 59 and name HB ) 5.39 5.39 0.00 peak 960 assign ( resid 156 and name HG1 ) ( resid 159 and name HB ) 5.39 5.39 0.00 peak 960 assign ( resid 56 and name HA ) ( resid 56 and name HG1 ) 4.01 4.01 0.00 peak 961 assign ( resid 156 and name HA ) ( resid 156 and name HG1 ) 4.01 4.01 0.00 peak 961 assign ( resid 68 and name HB1 ) ( resid 71 and name HD+ ) 4.78 4.78 0.00 peak 963 assign ( resid 168 and name HB1 ) ( resid 171 and name HD+ ) 4.78 4.78 0.00 peak 963 assign ( resid 42 and name HG2 ) ( resid 45 and name HD+ ) 4.60 4.60 0.00 peak 965 assign ( resid 142 and name HG2 ) ( resid 145 and name HD+ ) 4.60 4.60 0.00 peak 965 assign ( resid 68 and name HB2 ) ( resid 71 and name HD+ ) 4.38 4.38 0.00 peak 966 assign ( resid 168 and name HB2 ) ( resid 171 and name HD+ ) 4.38 4.38 0.00 peak 966 assign ( resid 82 and name HA ) ( resid 86 and name HE+ ) 5.04 5.04 0.00 peak 991 assign ( resid 182 and name HA ) ( resid 186 and name HE+ ) 5.04 5.04 0.00 peak 991 assign ( resid 77 and name HA ) ( resid 77 and name HE+ ) 4.08 4.08 0.00 peak 993 assign ( resid 177 and name HA ) ( resid 177 and name HE+ ) 4.08 4.08 0.00 peak 993 assign ( resid 44 and name HA ) ( resid 44 and name HE+ ) 4.81 4.81 0.00 peak 995 assign ( resid 144 and name HA ) ( resid 144 and name HE+ ) 4.81 4.81 0.00 peak 995 assign ( resid 51 and name HB1 ) ( resid 55 and name HB+ ) 4.95 4.95 0.00 peak 998 assign ( resid 151 and name HB1 ) ( resid 155 and name HB+ ) 4.95 4.95 0.00 peak 998 assign ( resid 90 and name HB2 ) ( resid 91 and name HA ) 5.22 5.22 0.00 peak 998 assign ( resid 190 and name HB2 ) ( resid 191 and name HA ) 5.22 5.22 0.00 peak 998 assign ( resid 48 and name HA ) ( resid 51 and name HB2 ) 4.24 4.24 0.00 peak 999 assign ( resid 148 and name HA ) ( resid 151 and name HB2 ) 4.24 4.24 0.00 peak 999 assign ( resid 51 and name HB2 ) ( resid 52 and name HA ) 4.80 4.80 0.00 peak 999 assign ( resid 151 and name HB2 ) ( resid 152 and name HA ) 4.80 4.80 0.00 peak 999 assign ( resid 60 and name HA ) ( resid 63 and name HB1 ) 4.40 4.40 0.00 peak 1000 assign ( resid 160 and name HA ) ( resid 163 and name HB1 ) 4.40 4.40 0.00 peak 1000 assign ( resid 63 and name HB1 ) ( resid 64 and name HA ) 4.96 4.96 0.00 peak 1000 assign ( resid 163 and name HB1 ) ( resid 164 and name HA ) 4.96 4.96 0.00 peak 1000 assign ( resid 74 and name HE+ ) ( resid 75 and name HA ) 4.74 4.74 0.00 peak 1004 assign ( resid 174 and name HE+ ) ( resid 175 and name HA ) 4.74 4.74 0.00 peak 1004 assign ( resid 36 and name HA ) ( resid 36 and name HE+ ) 4.51 4.51 0.00 peak 1005 assign ( resid 136 and name HA ) ( resid 136 and name HE+ ) 4.51 4.51 0.00 peak 1005 assign ( resid 93 and name HA ) ( resid 93 and name HD+ ) 3.87 3.87 0.00 peak 1008 assign ( resid 193 and name HA ) ( resid 193 and name HD+ ) 3.87 3.87 0.00 peak 1008 assign ( resid 43 and name HA ) ( resid 46 and name HD+ ) 4.14 4.14 0.00 peak 1010 assign ( resid 143 and name HA ) ( resid 146 and name HD+ ) 4.14 4.14 0.00 peak 1010 assign ( resid 45 and name HA ) ( resid 45 and name HD+ ) 4.17 4.17 0.00 peak 1011 assign ( resid 145 and name HA ) ( resid 145 and name HD+ ) 4.17 4.17 0.00 peak 1011 assign ( resid 85 and name HA ) ( resid 86 and name HA ) 5.00 5.00 0.00 peak 1014 assign ( resid 185 and name HA ) ( resid 186 and name HA ) 5.00 5.00 0.00 peak 1014 assign ( resid 46 and name HA ) ( resid 46 and name HD+ ) 4.18 4.18 0.00 peak 1017 assign ( resid 146 and name HA ) ( resid 146 and name HD+ ) 4.18 4.18 0.00 peak 1017 assign ( resid 84 and name HA ) ( resid 87 and name HB1 ) 4.32 4.32 0.00 peak 1018 assign ( resid 184 and name HA ) ( resid 187 and name HB1 ) 4.32 4.32 0.00 peak 1018 assign ( resid 84 and name HA ) ( resid 87 and name HB2 ) 4.32 4.32 0.00 peak 1020 assign ( resid 184 and name HA ) ( resid 187 and name HB2 ) 4.32 4.32 0.00 peak 1020 assign ( resid 86 and name HA ) ( resid 89 and name HD+ ) 4.62 4.62 0.00 peak 1020 assign ( resid 186 and name HA ) ( resid 189 and name HD+ ) 4.62 4.62 0.00 peak 1020 assign ( resid 42 and name HA ) ( resid 45 and name HD+ ) 3.91 3.91 0.00 peak 1060 assign ( resid 142 and name HA ) ( resid 145 and name HD+ ) 3.91 3.91 0.00 peak 1060 assign ( resid 71 and name HA ) ( resid 71 and name HD+ ) 4.29 4.29 0.00 peak 1063 assign ( resid 171 and name HA ) ( resid 171 and name HD+ ) 4.29 4.29 0.00 peak 1063 assign ( resid 44 and name HA ) ( resid 47 and name HD+ ) 4.29 4.29 0.00 peak 1068 assign ( resid 144 and name HA ) ( resid 147 and name HD+ ) 4.29 4.29 0.00 peak 1068 assign ( resid 41 and name HA ) ( resid 45 and name HD+ ) 4.64 4.64 0.00 peak 1070 assign ( resid 141 and name HA ) ( resid 145 and name HD+ ) 4.64 4.64 0.00 peak 1070 assign ( resid 46 and name HD+ ) ( resid 47 and name HA ) 4.93 4.93 0.00 peak 1070 assign ( resid 146 and name HD+ ) ( resid 147 and name HA ) 4.93 4.93 0.00 peak 1070 assign ( resid 47 and name HA ) ( resid 47 and name HD+ ) 4.91 4.91 0.00 peak 1071 assign ( resid 147 and name HA ) ( resid 147 and name HD+ ) 4.91 4.91 0.00 peak 1071 assign ( resid 89 and name HA ) ( resid 89 and name HD+ ) 3.92 3.92 0.00 peak 1072 assign ( resid 189 and name HA ) ( resid 189 and name HD+ ) 3.92 3.92 0.00 peak 1072 assign ( resid 80 and name HA ) ( resid 83 and name HA ) 5.45 5.45 0.00 peak 1090 assign ( resid 180 and name HA ) ( resid 183 and name HA ) 5.45 5.45 0.00 peak 1090 assign ( resid 56 and name HA ) ( resid 59 and name HB ) 2.91 2.91 0.00 peak 1092 assign ( resid 156 and name HA ) ( resid 159 and name HB ) 2.91 2.91 0.00 peak 1092 assign ( resid 51 and name HA ) ( resid 55 and name HB+ ) 4.62 4.62 0.00 peak 1108 assign ( resid 151 and name HA ) ( resid 155 and name HB+ ) 4.62 4.62 0.00 peak 1108 assign ( resid 66 and name HA ) ( resid 68 and name HA ) 5.43 5.43 0.00 peak 1110 assign ( resid 166 and name HA ) ( resid 168 and name HA ) 5.43 5.43 0.00 peak 1110 assign ( resid 67 and name HA ) ( resid 68 and name HA ) 4.84 4.84 0.00 peak 1116 assign ( resid 167 and name HA ) ( resid 168 and name HA ) 4.84 4.84 0.00 peak 1116 assign ( resid 68 and name HA ) ( resid 69 and name HA ) 4.43 4.43 0.00 peak 1117 assign ( resid 168 and name HA ) ( resid 169 and name HA ) 4.43 4.43 0.00 peak 1117 assign ( resid 63 and name HA ) ( resid 66 and name HA ) 4.14 4.14 0.00 peak 1124 assign ( resid 163 and name HA ) ( resid 166 and name HA ) 4.14 4.14 0.00 peak 1124 assign ( resid 39 and name HA ) ( resid 40 and name HD1 ) 3.70 3.70 0.00 peak 1126 assign ( resid 139 and name HA ) ( resid 140 and name HD1 ) 3.70 3.70 0.00 peak 1126 assign ( resid 71 and name HD+ ) ( resid 72 and name HA ) 4.67 4.67 0.00 peak 1156 assign ( resid 171 and name HD+ ) ( resid 172 and name HA ) 4.67 4.67 0.00 peak 1156 assign ( resid 90 and name HA ) ( resid 93 and name HD+ ) 4.17 4.17 0.00 peak 1164 assign ( resid 190 and name HA ) ( resid 193 and name HD+ ) 4.17 4.17 0.00 peak 1164 assign ( resid 52 and name HA ) ( resid 55 and name HN ) 4.13 4.13 0.00 peak 1170 assign ( resid 152 and name HA ) ( resid 155 and name HN ) 4.13 4.13 0.00 peak 1170 assign ( resid 89 and name HA ) ( resid 92 and name HN ) 4.53 4.53 0.00 peak 1181 assign ( resid 189 and name HA ) ( resid 192 and name HN ) 4.53 4.53 0.00 peak 1181 assign ( resid 91 and name HA ) ( resid 95 and name HE21 ) 4.70 4.70 0.00 peak 1183 assign ( resid 191 and name HA ) ( resid 195 and name HE21 ) 4.70 4.70 0.00 peak 1183 assign ( resid 47 and name HD+ ) ( resid 51 and name HD22 ) 4.17 4.17 0.00 peak 1191 assign ( resid 147 and name HD+ ) ( resid 151 and name HD22 ) 4.17 4.17 0.00 peak 1191 assign ( resid 39 and name HN ) ( resid 40 and name HA ) 5.50 5.50 0.00 peak 1198 assign ( resid 139 and name HN ) ( resid 140 and name HA ) 5.50 5.50 0.00 peak 1198 assign ( resid 39 and name HN ) ( resid 40 and name HD2 ) 4.86 4.86 0.00 peak 1201 assign ( resid 139 and name HN ) ( resid 140 and name HD2 ) 4.86 4.86 0.00 peak 1201 assign ( resid 48 and name HA ) ( resid 51 and name HN ) 3.92 3.92 0.00 peak 1206 assign ( resid 148 and name HA ) ( resid 151 and name HN ) 3.92 3.92 0.00 peak 1206 assign ( resid 43 and name HN ) ( resid 44 and name HA ) 5.18 5.18 0.00 peak 1211 assign ( resid 143 and name HN ) ( resid 144 and name HA ) 5.18 5.18 0.00 peak 1211 assign ( resid 40 and name HD2 ) ( resid 42 and name HN ) 5.50 5.50 0.00 peak 1217 assign ( resid 140 and name HD2 ) ( resid 142 and name HN ) 5.50 5.50 0.00 peak 1217 assign ( resid 40 and name HA ) ( resid 42 and name HN ) 4.72 4.72 0.00 peak 1218 assign ( resid 140 and name HA ) ( resid 142 and name HN ) 4.72 4.72 0.00 peak 1218 assign ( resid 45 and name HN ) ( resid 45 and name HD+ ) 3.98 3.98 0.00 peak 1225 assign ( resid 145 and name HN ) ( resid 145 and name HD+ ) 3.98 3.98 0.00 peak 1225 assign ( resid 79 and name HA ) ( resid 81 and name HN ) 4.68 4.68 0.00 peak 1227 assign ( resid 179 and name HA ) ( resid 181 and name HN ) 4.68 4.68 0.00 peak 1227 assign ( resid 77 and name HA ) ( resid 81 and name HN ) 4.52 4.52 0.00 peak 1229 assign ( resid 177 and name HA ) ( resid 181 and name HN ) 4.52 4.52 0.00 peak 1229 assign ( resid 40 and name HA ) ( resid 44 and name HN ) 4.37 4.37 0.00 peak 1232 assign ( resid 140 and name HA ) ( resid 144 and name HN ) 4.37 4.37 0.00 peak 1232 assign ( resid 59 and name HB ) ( resid 60 and name HN ) 3.72 3.72 0.00 peak 1248 assign ( resid 159 and name HB ) ( resid 160 and name HN ) 3.72 3.72 0.00 peak 1248 assign ( resid 89 and name HD+ ) ( resid 90 and name HN ) 4.94 4.94 0.00 peak 1258 assign ( resid 189 and name HD+ ) ( resid 190 and name HN ) 4.94 4.94 0.00 peak 1258 assign ( resid 55 and name HB+ ) ( resid 56 and name HN ) 3.47 3.47 0.00 peak 1260 assign ( resid 155 and name HB+ ) ( resid 156 and name HN ) 3.47 3.47 0.00 peak 1260 assign ( resid 93 and name HA ) ( resid 95 and name HN ) 4.01 4.01 0.00 peak 1263 assign ( resid 193 and name HA ) ( resid 195 and name HN ) 4.01 4.01 0.00 peak 1263 assign ( resid 54 and name HN ) ( resid 55 and name HB+ ) 4.57 4.57 0.00 peak 1275 assign ( resid 154 and name HN ) ( resid 155 and name HB+ ) 4.57 4.57 0.00 peak 1275 assign ( resid 76 and name HN ) ( resid 76 and name HG1 ) 3.99 3.99 0.00 peak 1284 assign ( resid 176 and name HN ) ( resid 176 and name HG1 ) 3.99 3.99 0.00 peak 1284 assign ( resid 54 and name HN ) ( resid 54 and name HG ) 4.07 4.07 0.00 peak 1294 assign ( resid 154 and name HN ) ( resid 154 and name HG ) 4.07 4.07 0.00 peak 1294 assign ( resid 82 and name HG1 ) ( resid 83 and name HN ) 5.19 5.19 0.00 peak 1297 assign ( resid 182 and name HG1 ) ( resid 183 and name HN ) 5.19 5.19 0.00 peak 1297 assign ( resid 83 and name HN ) ( resid 85 and name HB ) 5.46 5.46 0.00 peak 1300 assign ( resid 183 and name HN ) ( resid 185 and name HB ) 5.46 5.46 0.00 peak 1300 assign ( resid 89 and name HN ) ( resid 92 and name HB2 ) 4.73 4.73 0.00 peak 1302 assign ( resid 189 and name HN ) ( resid 192 and name HB2 ) 4.73 4.73 0.00 peak 1302 assign ( resid 36 and name HN ) ( resid 36 and name HB+ ) 3.62 3.62 0.00 peak 1305 assign ( resid 136 and name HN ) ( resid 136 and name HB+ ) 3.62 3.62 0.00 peak 1305 assign ( resid 36 and name HE+ ) ( resid 37 and name HN ) 4.91 4.91 0.00 peak 1308 assign ( resid 136 and name HE+ ) ( resid 137 and name HN ) 4.91 4.91 0.00 peak 1308 assign ( resid 42 and name HG2 ) ( resid 43 and name HN ) 4.41 4.41 0.00 peak 1309 assign ( resid 142 and name HG2 ) ( resid 143 and name HN ) 4.41 4.41 0.00 peak 1309 assign ( resid 42 and name HG1 ) ( resid 43 and name HN ) 4.87 4.87 0.00 peak 1310 assign ( resid 142 and name HG1 ) ( resid 143 and name HN ) 4.87 4.87 0.00 peak 1310 assign ( resid 43 and name HN ) ( resid 43 and name HG+ ) 3.56 3.56 0.00 peak 1311 assign ( resid 143 and name HN ) ( resid 143 and name HG+ ) 3.56 3.56 0.00 peak 1311 assign ( resid 42 and name HB1 ) ( resid 43 and name HN ) 3.92 3.92 0.00 peak 1312 assign ( resid 142 and name HB1 ) ( resid 143 and name HN ) 3.92 3.92 0.00 peak 1312 assign ( resid 43 and name HN ) ( resid 44 and name HB+ ) 4.23 4.23 0.00 peak 1314 assign ( resid 143 and name HN ) ( resid 144 and name HB+ ) 4.23 4.23 0.00 peak 1314 assign ( resid 68 and name HN ) ( resid 68 and name HB1 ) 3.93 3.93 0.00 peak 1318 assign ( resid 168 and name HN ) ( resid 168 and name HB1 ) 3.93 3.93 0.00 peak 1318 assign ( resid 42 and name HN ) ( resid 42 and name HG1 ) 3.90 3.90 0.00 peak 1320 assign ( resid 142 and name HN ) ( resid 142 and name HG1 ) 3.90 3.90 0.00 peak 1320 assign ( resid 41 and name HB ) ( resid 42 and name HN ) 4.12 4.12 0.00 peak 1322 assign ( resid 141 and name HB ) ( resid 142 and name HN ) 4.12 4.12 0.00 peak 1322 assign ( resid 52 and name HN ) ( resid 52 and name HG+ ) 3.47 3.47 0.00 peak 1325 assign ( resid 152 and name HN ) ( resid 152 and name HG+ ) 3.47 3.47 0.00 peak 1325 assign ( resid 52 and name HN ) ( resid 52 and name HB2 ) 3.76 3.76 0.00 peak 1327 assign ( resid 152 and name HN ) ( resid 152 and name HB2 ) 3.76 3.76 0.00 peak 1327 assign ( resid 53 and name HN ) ( resid 56 and name HG2 ) 4.66 4.66 0.00 peak 1331 assign ( resid 153 and name HN ) ( resid 156 and name HG2 ) 4.66 4.66 0.00 peak 1331 assign ( resid 44 and name HE+ ) ( resid 45 and name HN ) 4.96 4.96 0.00 peak 1332 assign ( resid 144 and name HE+ ) ( resid 145 and name HN ) 4.96 4.96 0.00 peak 1332 assign ( resid 40 and name HG1 ) ( resid 41 and name HN ) 4.53 4.53 0.00 peak 1343 assign ( resid 140 and name HG1 ) ( resid 141 and name HN ) 4.53 4.53 0.00 peak 1343 assign ( resid 39 and name HE+ ) ( resid 41 and name HN ) 4.90 4.90 0.00 peak 1344 assign ( resid 139 and name HE+ ) ( resid 141 and name HN ) 4.90 4.90 0.00 peak 1344 assign ( resid 82 and name HN ) ( resid 82 and name HG2 ) 4.21 4.21 0.00 peak 1348 assign ( resid 182 and name HN ) ( resid 182 and name HG2 ) 4.21 4.21 0.00 peak 1348 assign ( resid 82 and name HN ) ( resid 82 and name HG1 ) 5.50 5.50 0.00 peak 1349 assign ( resid 182 and name HN ) ( resid 182 and name HG1 ) 5.50 5.50 0.00 peak 1349 assign ( resid 61 and name HB ) ( resid 62 and name HN ) 3.72 3.72 0.00 peak 1352 assign ( resid 161 and name HB ) ( resid 162 and name HN ) 3.72 3.72 0.00 peak 1352 assign ( resid 62 and name HN ) ( resid 63 and name HB2 ) 4.76 4.76 0.00 peak 1354 assign ( resid 162 and name HN ) ( resid 163 and name HB2 ) 4.76 4.76 0.00 peak 1354 assign ( resid 90 and name HN ) ( resid 92 and name HB2 ) 4.84 4.84 0.00 peak 1355 assign ( resid 190 and name HN ) ( resid 192 and name HB2 ) 4.84 4.84 0.00 peak 1355 assign ( resid 62 and name HN ) ( resid 62 and name HB1 ) 3.71 3.71 0.00 peak 1356 assign ( resid 162 and name HN ) ( resid 162 and name HB1 ) 3.71 3.71 0.00 peak 1356 assign ( resid 74 and name HE+ ) ( resid 75 and name HN ) 3.97 3.97 0.00 peak 1359 assign ( resid 174 and name HE+ ) ( resid 175 and name HN ) 3.97 3.97 0.00 peak 1359 assign ( resid 91 and name HN ) ( resid 92 and name HB2 ) 4.75 4.75 0.00 peak 1361 assign ( resid 191 and name HN ) ( resid 192 and name HB2 ) 4.75 4.75 0.00 peak 1361 assign ( resid 64 and name HN ) ( resid 66 and name HE+ ) 4.44 4.44 0.00 peak 1362 assign ( resid 164 and name HN ) ( resid 166 and name HE+ ) 4.44 4.44 0.00 peak 1362 assign ( resid 66 and name HN ) ( resid 66 and name HE+ ) 4.43 4.43 0.00 peak 1373 assign ( resid 166 and name HN ) ( resid 166 and name HE+ ) 4.43 4.43 0.00 peak 1373 assign ( resid 92 and name HN ) ( resid 92 and name HG1 ) 3.88 3.88 0.00 peak 1381 assign ( resid 192 and name HN ) ( resid 192 and name HG1 ) 3.88 3.88 0.00 peak 1381 assign ( resid 92 and name HN ) ( resid 93 and name HB+ ) 5.48 5.48 0.00 peak 1384 assign ( resid 192 and name HN ) ( resid 193 and name HB+ ) 5.48 5.48 0.00 peak 1384 assign ( resid 89 and name HB+ ) ( resid 92 and name HN ) 4.84 4.84 0.00 peak 1385 assign ( resid 189 and name HB+ ) ( resid 192 and name HN ) 4.84 4.84 0.00 peak 1385 assign ( resid 77 and name HB+ ) ( resid 79 and name HN ) 4.55 4.55 0.00 peak 1399 assign ( resid 177 and name HB+ ) ( resid 179 and name HN ) 4.55 4.55 0.00 peak 1399 assign ( resid 47 and name HB+ ) ( resid 51 and name HD22 ) 5.01 5.01 0.00 peak 1400 assign ( resid 147 and name HB+ ) ( resid 151 and name HD22 ) 5.01 5.01 0.00 peak 1400 assign ( resid 74 and name HE+ ) ( resid 76 and name HA ) 4.97 4.97 0.00 peak 1439 assign ( resid 174 and name HE+ ) ( resid 176 and name HA ) 4.97 4.97 0.00 peak 1439 assign ( resid 39 and name HA ) ( resid 39 and name HE+ ) 4.14 4.14 0.00 peak 1442 assign ( resid 139 and name HA ) ( resid 139 and name HE+ ) 4.14 4.14 0.00 peak 1442 assign ( resid 90 and name HA ) ( resid 93 and name HG+ ) 4.08 4.08 0.00 peak 1448 assign ( resid 190 and name HA ) ( resid 193 and name HG+ ) 4.08 4.08 0.00 peak 1448 assign ( resid 63 and name HA ) ( resid 66 and name HE+ ) 4.32 4.32 0.00 peak 1454 assign ( resid 163 and name HA ) ( resid 166 and name HE+ ) 4.32 4.32 0.00 peak 1454 assign ( resid 40 and name HA ) ( resid 43 and name HG+ ) 3.51 3.51 0.00 peak 1459 assign ( resid 140 and name HA ) ( resid 143 and name HG+ ) 3.51 3.51 0.00 peak 1459 assign ( resid 74 and name HA ) ( resid 74 and name HE+ ) 3.93 3.93 0.00 peak 1462 assign ( resid 174 and name HA ) ( resid 174 and name HE+ ) 3.93 3.93 0.00 peak 1462 assign ( resid 42 and name HA ) ( resid 42 and name HG2 ) 3.78 3.78 0.00 peak 1464 assign ( resid 142 and name HA ) ( resid 142 and name HG2 ) 3.78 3.78 0.00 peak 1464 assign ( resid 79 and name HA ) ( resid 82 and name HB1 ) 3.87 3.87 0.00 peak 1467 assign ( resid 179 and name HA ) ( resid 182 and name HB1 ) 3.87 3.87 0.00 peak 1467 assign ( resid 42 and name HA ) ( resid 42 and name HE+ ) 3.72 3.72 0.00 peak 1468 assign ( resid 142 and name HA ) ( resid 142 and name HE+ ) 3.72 3.72 0.00 peak 1468 assign ( resid 68 and name HB1 ) ( resid 69 and name HA ) 4.60 4.60 0.00 peak 1478 assign ( resid 168 and name HB1 ) ( resid 169 and name HA ) 4.60 4.60 0.00 peak 1478 assign ( resid 52 and name HA ) ( resid 52 and name HG+ ) 3.20 3.20 0.00 peak 1479 assign ( resid 152 and name HA ) ( resid 152 and name HG+ ) 3.20 3.20 0.00 peak 1479 assign ( resid 68 and name HB2 ) ( resid 69 and name HA ) 5.50 5.50 0.00 peak 1486 assign ( resid 168 and name HB2 ) ( resid 169 and name HA ) 5.50 5.50 0.00 peak 1486 assign ( resid 92 and name HA ) ( resid 92 and name HG2 ) 3.94 3.94 0.00 peak 1490 assign ( resid 192 and name HA ) ( resid 192 and name HG2 ) 3.94 3.94 0.00 peak 1490 assign ( resid 92 and name HA ) ( resid 92 and name HG1 ) 4.09 4.09 0.00 peak 1491 assign ( resid 192 and name HA ) ( resid 192 and name HG1 ) 4.09 4.09 0.00 peak 1491 assign ( resid 64 and name HA ) ( resid 66 and name HE+ ) 3.98 3.98 0.00 peak 1496 assign ( resid 164 and name HA ) ( resid 166 and name HE+ ) 3.98 3.98 0.00 peak 1496 assign ( resid 56 and name HA ) ( resid 58 and name HE+ ) 5.50 5.50 0.00 peak 1497 assign ( resid 156 and name HA ) ( resid 158 and name HE+ ) 5.50 5.50 0.00 peak 1497 assign ( resid 60 and name HA ) ( resid 63 and name HB2 ) 4.15 4.15 0.00 peak 1501 assign ( resid 160 and name HA ) ( resid 163 and name HB2 ) 4.15 4.15 0.00 peak 1501 assign ( resid 66 and name HA ) ( resid 66 and name HE+ ) 4.22 4.22 0.00 peak 1506 assign ( resid 166 and name HA ) ( resid 166 and name HE+ ) 4.22 4.22 0.00 peak 1506 assign ( resid 67 and name HE+ ) ( resid 83 and name HA ) 5.50 5.50 0.00 peak 1507 assign ( resid 167 and name HE+ ) ( resid 183 and name HA ) 5.50 5.50 0.00 peak 1507 assign ( resid 82 and name HG2 ) ( resid 83 and name HA ) 4.49 4.49 0.00 peak 1510 assign ( resid 182 and name HG2 ) ( resid 183 and name HA ) 4.49 4.49 0.00 peak 1510 assign ( resid 56 and name HG1 ) ( resid 57 and name HA ) 4.69 4.69 0.00 peak 1512 assign ( resid 156 and name HG1 ) ( resid 157 and name HA ) 4.69 4.69 0.00 peak 1512 assign ( resid 41 and name HA ) ( resid 44 and name HB+ ) 3.39 3.39 0.00 peak 1513 assign ( resid 141 and name HA ) ( resid 144 and name HB+ ) 3.39 3.39 0.00 peak 1513 assign ( resid 41 and name HA ) ( resid 44 and name HE+ ) 4.05 4.05 0.00 peak 1514 assign ( resid 141 and name HA ) ( resid 144 and name HE+ ) 4.05 4.05 0.00 peak 1514 assign ( resid 56 and name HG2 ) ( resid 57 and name HA ) 4.80 4.80 0.00 peak 1516 assign ( resid 156 and name HG2 ) ( resid 157 and name HA ) 4.80 4.80 0.00 peak 1516 assign ( resid 82 and name HA ) ( resid 82 and name HG1 ) 3.95 3.95 0.00 peak 1522 assign ( resid 182 and name HA ) ( resid 182 and name HG1 ) 3.95 3.95 0.00 peak 1522 assign ( resid 89 and name HA ) ( resid 92 and name HG1 ) 4.34 4.34 0.00 peak 1522 assign ( resid 189 and name HA ) ( resid 192 and name HG1 ) 4.34 4.34 0.00 peak 1522 assign ( resid 62 and name HA ) ( resid 67 and name HE+ ) 4.83 4.83 0.00 peak 1524 assign ( resid 162 and name HA ) ( resid 167 and name HE+ ) 4.83 4.83 0.00 peak 1524 assign ( resid 85 and name HB ) ( resid 86 and name HA ) 4.44 4.44 0.00 peak 1536 assign ( resid 185 and name HB ) ( resid 186 and name HA ) 4.44 4.44 0.00 peak 1536 assign ( resid 39 and name HE+ ) ( resid 40 and name HD1 ) 4.10 4.10 0.00 peak 1543 assign ( resid 139 and name HE+ ) ( resid 140 and name HD1 ) 4.10 4.10 0.00 peak 1543 assign ( resid 39 and name HE+ ) ( resid 40 and name HD2 ) 4.51 4.51 0.00 peak 1549 assign ( resid 139 and name HE+ ) ( resid 140 and name HD2 ) 4.51 4.51 0.00 peak 1549 assign ( resid 39 and name HB1 ) ( resid 40 and name HD2 ) 4.41 4.41 0.00 peak 1553 assign ( resid 139 and name HB1 ) ( resid 140 and name HD2 ) 4.41 4.41 0.00 peak 1553 assign ( resid 39 and name HB2 ) ( resid 40 and name HD2 ) 4.41 4.41 0.00 peak 1554 assign ( resid 139 and name HB2 ) ( resid 140 and name HD2 ) 4.41 4.41 0.00 peak 1554 assign ( resid 93 and name HB+ ) ( resid 93 and name HD+ ) 3.71 3.71 0.00 peak 1575 assign ( resid 193 and name HB+ ) ( resid 193 and name HD+ ) 3.71 3.71 0.00 peak 1575 assign ( resid 43 and name HB+ ) ( resid 46 and name HD+ ) 5.46 5.46 0.00 peak 1577 assign ( resid 143 and name HB+ ) ( resid 146 and name HD+ ) 5.46 5.46 0.00 peak 1577 assign ( resid 43 and name HB+ ) ( resid 47 and name HD+ ) 5.50 5.50 0.00 peak 1577 assign ( resid 143 and name HB+ ) ( resid 147 and name HD+ ) 5.50 5.50 0.00 peak 1577 assign ( resid 43 and name HG+ ) ( resid 47 and name HD+ ) 4.74 4.74 0.00 peak 1580 assign ( resid 143 and name HG+ ) ( resid 147 and name HD+ ) 4.74 4.74 0.00 peak 1580 assign ( resid 36 and name HB+ ) ( resid 36 and name HE+ ) 3.57 3.57 0.00 peak 1598 assign ( resid 136 and name HB+ ) ( resid 136 and name HE+ ) 3.57 3.57 0.00 peak 1598 assign ( resid 50 and name HB ) ( resid 51 and name HB2 ) 5.50 5.50 0.00 peak 1612 assign ( resid 150 and name HB ) ( resid 151 and name HB2 ) 5.50 5.50 0.00 peak 1612 assign ( resid 89 and name HB+ ) ( resid 90 and name HB2 ) 5.50 5.50 0.00 peak 1612 assign ( resid 189 and name HB+ ) ( resid 190 and name HB2 ) 5.50 5.50 0.00 peak 1612 assign ( resid 51 and name HB1 ) ( resid 54 and name HB1 ) 5.27 5.27 0.00 peak 1614 assign ( resid 151 and name HB1 ) ( resid 154 and name HB1 ) 5.27 5.27 0.00 peak 1614 assign ( resid 51 and name HB2 ) ( resid 52 and name HG+ ) 4.37 4.37 0.00 peak 1615 assign ( resid 151 and name HB2 ) ( resid 152 and name HG+ ) 4.37 4.37 0.00 peak 1615 assign ( resid 76 and name HB2 ) ( resid 79 and name HB2 ) 4.59 4.59 0.00 peak 1627 assign ( resid 176 and name HB2 ) ( resid 179 and name HB2 ) 4.59 4.59 0.00 peak 1627 assign ( resid 39 and name HB1 ) ( resid 42 and name HG1 ) 4.24 4.24 0.00 peak 1650 assign ( resid 139 and name HB1 ) ( resid 142 and name HG1 ) 4.24 4.24 0.00 peak 1650 assign ( resid 42 and name HG1 ) ( resid 42 and name HE+ ) 4.00 4.00 0.00 peak 1650 assign ( resid 142 and name HG1 ) ( resid 142 and name HE+ ) 4.00 4.00 0.00 peak 1650 assign ( resid 82 and name HG1 ) ( resid 86 and name HE+ ) 3.96 3.96 0.00 peak 1676 assign ( resid 182 and name HG1 ) ( resid 186 and name HE+ ) 3.96 3.96 0.00 peak 1676 assign ( resid 82 and name HB2 ) ( resid 86 and name HE+ ) 4.51 4.51 0.00 peak 1680 assign ( resid 182 and name HB2 ) ( resid 186 and name HE+ ) 4.51 4.51 0.00 peak 1680 assign ( resid 43 and name HB+ ) ( resid 43 and name HG+ ) 2.65 2.65 0.00 peak 1721 assign ( resid 143 and name HB+ ) ( resid 143 and name HG+ ) 2.65 2.65 0.00 peak 1721 assign ( resid 95 and name HB+ ) ( resid 95 and name HG1 ) 2.90 2.90 0.00 peak 1731 assign ( resid 195 and name HB+ ) ( resid 195 and name HG1 ) 2.90 2.90 0.00 peak 1731 assign ( resid 95 and name HB+ ) ( resid 95 and name HG2 ) 2.90 2.90 0.00 peak 1732 assign ( resid 195 and name HB+ ) ( resid 195 and name HG2 ) 2.90 2.90 0.00 peak 1732 assign ( resid 93 and name HB+ ) ( resid 93 and name HG+ ) 2.40 2.40 0.00 peak 1740 assign ( resid 193 and name HB+ ) ( resid 193 and name HG+ ) 2.40 2.40 0.00 peak 1740 assign ( resid 85 and name HB ) ( resid 86 and name HG1 ) 4.26 4.26 0.00 peak 1747 assign ( resid 185 and name HB ) ( resid 186 and name HG1 ) 4.26 4.26 0.00 peak 1747 assign ( resid 48 and name HB+ ) ( resid 52 and name HG+ ) 3.81 3.81 0.00 peak 1750 assign ( resid 148 and name HB+ ) ( resid 152 and name HG+ ) 3.81 3.81 0.00 peak 1750 assign ( resid 39 and name HG1 ) ( resid 42 and name HB2 ) 4.43 4.43 0.00 peak 1751 assign ( resid 139 and name HG1 ) ( resid 142 and name HB2 ) 4.43 4.43 0.00 peak 1751 assign ( resid 82 and name HG1 ) ( resid 86 and name HG2 ) 4.16 4.16 0.00 peak 1756 assign ( resid 182 and name HG1 ) ( resid 186 and name HG2 ) 4.16 4.16 0.00 peak 1756 assign ( resid 85 and name HB ) ( resid 86 and name HG2 ) 4.03 4.03 0.00 peak 1760 assign ( resid 185 and name HB ) ( resid 186 and name HG2 ) 4.03 4.03 0.00 peak 1760 assign ( resid 41 and name HB ) ( resid 42 and name HG2 ) 5.22 5.22 0.00 peak 1774 assign ( resid 141 and name HB ) ( resid 142 and name HG2 ) 5.22 5.22 0.00 peak 1774 assign ( resid 44 and name HB+ ) ( resid 44 and name HE+ ) 3.40 3.40 0.00 peak 1776 assign ( resid 144 and name HB+ ) ( resid 144 and name HE+ ) 3.40 3.40 0.00 peak 1776 assign ( resid 77 and name HB+ ) ( resid 77 and name HE+ ) 3.72 3.72 0.00 peak 1776 assign ( resid 177 and name HB+ ) ( resid 177 and name HE+ ) 3.72 3.72 0.00 peak 1776 assign ( resid 39 and name HB1 ) ( resid 42 and name HG2 ) 4.30 4.30 0.00 peak 1778 assign ( resid 139 and name HB1 ) ( resid 142 and name HG2 ) 4.30 4.30 0.00 peak 1778 assign ( resid 39 and name HB2 ) ( resid 42 and name HG1 ) 4.24 4.24 0.00 peak 1784 assign ( resid 139 and name HB2 ) ( resid 142 and name HG1 ) 4.24 4.24 0.00 peak 1784 assign ( resid 39 and name HB2 ) ( resid 42 and name HG2 ) 4.30 4.30 0.00 peak 1785 assign ( resid 139 and name HB2 ) ( resid 142 and name HG2 ) 4.30 4.30 0.00 peak 1785 assign ( resid 36 and name HD+ ) ( resid 36 and name HE+ ) 2.70 2.70 0.00 peak 1789 assign ( resid 136 and name HD+ ) ( resid 136 and name HE+ ) 2.70 2.70 0.00 peak 1789 assign ( resid 39 and name HD+ ) ( resid 42 and name HG2 ) 4.22 4.22 0.00 peak 1791 assign ( resid 139 and name HD+ ) ( resid 142 and name HG2 ) 4.22 4.22 0.00 peak 1791 assign ( resid 39 and name HD+ ) ( resid 42 and name HG1 ) 4.42 4.42 0.00 peak 1792 assign ( resid 139 and name HD+ ) ( resid 142 and name HG1 ) 4.42 4.42 0.00 peak 1792 assign ( resid 82 and name HG2 ) ( resid 86 and name HD+ ) 4.72 4.72 0.00 peak 1792 assign ( resid 182 and name HG2 ) ( resid 186 and name HD+ ) 4.72 4.72 0.00 peak 1792 assign ( resid 67 and name HB+ ) ( resid 68 and name HB1 ) 4.67 4.67 0.00 peak 1794 assign ( resid 167 and name HB+ ) ( resid 168 and name HB1 ) 4.67 4.67 0.00 peak 1794 assign ( resid 67 and name HB+ ) ( resid 68 and name HB2 ) 4.43 4.43 0.00 peak 1795 assign ( resid 167 and name HB+ ) ( resid 168 and name HB2 ) 4.43 4.43 0.00 peak 1795 assign ( resid 86 and name HG1 ) ( resid 86 and name HE+ ) 2.97 2.97 0.00 peak 1799 assign ( resid 186 and name HG1 ) ( resid 186 and name HE+ ) 2.97 2.97 0.00 peak 1799 assign ( resid 39 and name HG1 ) ( resid 42 and name HG2 ) 4.45 4.45 0.00 peak 1802 assign ( resid 139 and name HG1 ) ( resid 142 and name HG2 ) 4.45 4.45 0.00 peak 1802 assign ( resid 41 and name HG12 ) ( resid 42 and name HG2 ) 5.12 5.12 0.00 peak 1802 assign ( resid 141 and name HG12 ) ( resid 142 and name HG2 ) 5.12 5.12 0.00 peak 1802 assign ( resid 36 and name HG+ ) ( resid 36 and name HE+ ) 3.24 3.24 0.00 peak 1805 assign ( resid 136 and name HG+ ) ( resid 136 and name HE+ ) 3.24 3.24 0.00 peak 1805 assign ( resid 68 and name HB2 ) ( resid 71 and name HG+ ) 4.29 4.29 0.00 peak 1807 assign ( resid 168 and name HB2 ) ( resid 171 and name HG+ ) 4.29 4.29 0.00 peak 1807 assign ( resid 66 and name HG+ ) ( resid 66 and name HE+ ) 3.23 3.23 0.00 peak 1812 assign ( resid 166 and name HG+ ) ( resid 166 and name HE+ ) 3.23 3.23 0.00 peak 1812 assign ( resid 86 and name HG2 ) ( resid 86 and name HE+ ) 3.23 3.23 0.00 peak 1812 assign ( resid 186 and name HG2 ) ( resid 186 and name HE+ ) 3.23 3.23 0.00 peak 1812 assign ( resid 39 and name HG2 ) ( resid 42 and name HG1 ) 4.52 4.52 0.00 peak 1817 assign ( resid 139 and name HG2 ) ( resid 142 and name HG1 ) 4.52 4.52 0.00 peak 1817 assign ( resid 67 and name HG+ ) ( resid 67 and name HE+ ) 3.28 3.28 0.00 peak 1824 assign ( resid 167 and name HG+ ) ( resid 167 and name HE+ ) 3.28 3.28 0.00 peak 1824 assign ( resid 77 and name HG1 ) ( resid 77 and name HE+ ) 3.17 3.17 0.00 peak 1825 assign ( resid 177 and name HG1 ) ( resid 177 and name HE+ ) 3.17 3.17 0.00 peak 1825 assign ( resid 76 and name HB2 ) ( resid 79 and name HB1 ) 4.59 4.59 0.00 peak 1834 assign ( resid 176 and name HB2 ) ( resid 179 and name HB1 ) 4.59 4.59 0.00 peak 1834 assign ( resid 64 and name HB+ ) ( resid 192 and name HB1 ) 5.50 5.50 0.00 peak 1845 assign ( resid 92 and name HB1 ) ( resid 164 and name HB+ ) 5.50 5.50 0.00 peak 1845 assign ( resid 84 and name HG2+ ) ( resid 185 and name HB ) 5.50 5.50 0.00 peak 1852 assign ( resid 85 and name HB ) ( resid 184 and name HG2+ ) 5.50 5.50 0.00 peak 1852 assign ( resid 64 and name HB+ ) ( resid 192 and name HG1 ) 4.50 4.50 0.00 peak 1855 assign ( resid 92 and name HG1 ) ( resid 164 and name HB+ ) 4.50 4.50 0.00 peak 1855 assign ( resid 82 and name HG1 ) ( resid 85 and name HG1+ ) 5.23 5.23 0.00 peak 1858 assign ( resid 182 and name HG1 ) ( resid 185 and name HG1+ ) 5.23 5.23 0.00 peak 1858 assign ( resid 85 and name HG1+ ) ( resid 156 and name HB+ ) 5.40 5.40 0.00 peak 1858 assign ( resid 56 and name HB+ ) ( resid 185 and name HG1+ ) 5.40 5.40 0.00 peak 1858 assign ( resid 82 and name HB2 ) ( resid 85 and name HG1+ ) 5.50 5.50 0.00 peak 1859 assign ( resid 182 and name HB2 ) ( resid 185 and name HG1+ ) 5.50 5.50 0.00 peak 1859 assign ( resid 41 and name HG11 ) ( resid 44 and name HE+ ) 4.16 4.16 0.00 peak 1862 assign ( resid 141 and name HG11 ) ( resid 144 and name HE+ ) 4.16 4.16 0.00 peak 1862 assign ( resid 59 and name HG2+ ) ( resid 63 and name HB1 ) 5.26 5.26 0.00 peak 1863 assign ( resid 159 and name HG2+ ) ( resid 163 and name HB1 ) 5.26 5.26 0.00 peak 1863 assign ( resid 63 and name HB1 ) ( resid 64 and name HB+ ) 5.50 5.50 0.00 peak 1863 assign ( resid 163 and name HB1 ) ( resid 164 and name HB+ ) 5.50 5.50 0.00 peak 1863 assign ( resid 58 and name HE+ ) ( resid 59 and name HG2+ ) 4.88 4.88 0.00 peak 1864 assign ( resid 158 and name HE+ ) ( resid 159 and name HG2+ ) 4.88 4.88 0.00 peak 1864 assign ( resid 85 and name HG1+ ) ( resid 156 and name HG2 ) 4.49 4.49 0.00 peak 1867 assign ( resid 56 and name HG2 ) ( resid 185 and name HG1+ ) 4.49 4.49 0.00 peak 1867 assign ( resid 41 and name HG2+ ) ( resid 42 and name HG2 ) 4.42 4.42 0.00 peak 1892 assign ( resid 141 and name HG2+ ) ( resid 142 and name HG2 ) 4.42 4.42 0.00 peak 1892 assign ( resid 41 and name HG2+ ) ( resid 42 and name HB2 ) 4.01 4.01 0.00 peak 1894 assign ( resid 141 and name HG2+ ) ( resid 142 and name HB2 ) 4.01 4.01 0.00 peak 1894 assign ( resid 50 and name HG2+ ) ( resid 177 and name HG1 ) 3.31 3.31 0.00 peak 1947 assign ( resid 77 and name HG1 ) ( resid 150 and name HG2+ ) 3.31 3.31 0.00 peak 1947 assign ( resid 54 and name HD1+ ) ( resid 77 and name HG1 ) 3.63 3.63 0.00 peak 1957 assign ( resid 154 and name HD1+ ) ( resid 177 and name HG1 ) 3.63 3.63 0.00 peak 1957 assign ( resid 75 and name HB2 ) ( resid 80 and name HG1+ ) 3.91 3.91 0.00 peak 1997 assign ( resid 175 and name HB2 ) ( resid 180 and name HG1+ ) 3.91 3.91 0.00 peak 1997 assign ( resid 41 and name HG2+ ) ( resid 41 and name HD1+ ) 2.40 2.40 0.00 peak 1999 assign ( resid 141 and name HG2+ ) ( resid 141 and name HD1+ ) 2.40 2.40 0.00 peak 1999 assign ( resid 41 and name HG2+ ) ( resid 41 and name HG11 ) 3.29 3.29 0.00 peak 2001 assign ( resid 141 and name HG2+ ) ( resid 141 and name HG11 ) 3.29 3.29 0.00 peak 2001 assign ( resid 65 and name HB+ ) ( resid 67 and name HG+ ) 3.10 3.10 0.00 peak 2008 assign ( resid 165 and name HB+ ) ( resid 167 and name HG+ ) 3.10 3.10 0.00 peak 2008 assign ( resid 85 and name HG1+ ) ( resid 157 and name HB+ ) 3.83 3.83 0.00 peak 2011 assign ( resid 57 and name HB+ ) ( resid 185 and name HG1+ ) 3.83 3.83 0.00 peak 2011 assign ( resid 39 and name HG2 ) ( resid 39 and name HD+ ) 2.88 2.88 0.00 peak 2013 assign ( resid 139 and name HG2 ) ( resid 139 and name HD+ ) 2.88 2.88 0.00 peak 2013 assign ( resid 64 and name HB+ ) ( resid 65 and name HG ) 4.00 4.00 0.00 peak 2015 assign ( resid 164 and name HB+ ) ( resid 165 and name HG ) 4.00 4.00 0.00 peak 2015 assign ( resid 36 and name HG+ ) ( resid 36 and name HD+ ) 2.40 2.40 0.00 peak 2037 assign ( resid 136 and name HG+ ) ( resid 136 and name HD+ ) 2.40 2.40 0.00 peak 2037 assign ( resid 85 and name HG1+ ) ( resid 86 and name HG2 ) 3.90 3.90 0.00 peak 2040 assign ( resid 185 and name HG1+ ) ( resid 186 and name HG2 ) 3.90 3.90 0.00 peak 2040 assign ( resid 78 and name HB+ ) ( resid 150 and name HD1+ ) 3.43 3.43 0.00 peak 2052 assign ( resid 50 and name HD1+ ) ( resid 178 and name HB+ ) 3.43 3.43 0.00 peak 2052 assign ( resid 57 and name HD1+ ) ( resid 84 and name HG2+ ) 2.94 2.94 0.00 peak 2065 assign ( resid 157 and name HD1+ ) ( resid 184 and name HG2+ ) 2.94 2.94 0.00 peak 2065 assign ( resid 57 and name HD2+ ) ( resid 84 and name HG2+ ) 2.94 2.94 0.00 peak 2066 assign ( resid 157 and name HD2+ ) ( resid 184 and name HG2+ ) 2.94 2.94 0.00 peak 2066 assign ( resid 61 and name HD1+ ) ( resid 84 and name HG2+ ) 3.26 3.26 0.00 peak 2067 assign ( resid 161 and name HD1+ ) ( resid 184 and name HG2+ ) 3.26 3.26 0.00 peak 2067 assign ( resid 92 and name HB1 ) ( resid 191 and name HD1+ ) 4.93 4.93 0.00 peak 2074 assign ( resid 91 and name HD1+ ) ( resid 192 and name HB1 ) 4.93 4.93 0.00 peak 2074 assign ( resid 92 and name HB1 ) ( resid 191 and name HD2+ ) 4.82 4.82 0.00 peak 2078 assign ( resid 91 and name HD2+ ) ( resid 192 and name HB1 ) 4.82 4.82 0.00 peak 2078 assign ( resid 92 and name HB2 ) ( resid 191 and name HD2+ ) 4.90 4.90 0.00 peak 2083 assign ( resid 91 and name HD2+ ) ( resid 192 and name HB2 ) 4.90 4.90 0.00 peak 2083 assign ( resid 92 and name HB2 ) ( resid 191 and name HD1+ ) 4.54 4.54 0.00 peak 2085 assign ( resid 91 and name HD1+ ) ( resid 192 and name HB2 ) 4.54 4.54 0.00 peak 2085 assign ( resid 80 and name HB ) ( resid 80 and name HD1+ ) 3.28 3.28 0.00 peak 2090 assign ( resid 180 and name HB ) ( resid 180 and name HD1+ ) 3.28 3.28 0.00 peak 2090 assign ( resid 54 and name HB1 ) ( resid 54 and name HD1+ ) 3.06 3.06 0.00 peak 2091 assign ( resid 154 and name HB1 ) ( resid 154 and name HD1+ ) 3.06 3.06 0.00 peak 2091 assign ( resid 77 and name HB+ ) ( resid 150 and name HD1+ ) 2.57 2.57 0.00 peak 2094 assign ( resid 50 and name HD1+ ) ( resid 177 and name HB+ ) 2.57 2.57 0.00 peak 2094 assign ( resid 50 and name HB ) ( resid 50 and name HD1+ ) 3.27 3.27 0.00 peak 2096 assign ( resid 150 and name HB ) ( resid 150 and name HD1+ ) 3.27 3.27 0.00 peak 2096 assign ( resid 61 and name HB ) ( resid 61 and name HD1+ ) 3.41 3.41 0.00 peak 2105 assign ( resid 161 and name HB ) ( resid 161 and name HD1+ ) 3.41 3.41 0.00 peak 2105 assign ( resid 91 and name HB1 ) ( resid 91 and name HD2+ ) 3.23 3.23 0.00 peak 2106 assign ( resid 191 and name HB1 ) ( resid 191 and name HD2+ ) 3.23 3.23 0.00 peak 2106 assign ( resid 91 and name HB1 ) ( resid 91 and name HD1+ ) 3.35 3.35 0.00 peak 2107 assign ( resid 191 and name HB1 ) ( resid 191 and name HD1+ ) 3.35 3.35 0.00 peak 2107 assign ( resid 65 and name HB+ ) ( resid 65 and name HD1+ ) 3.07 3.07 0.00 peak 2108 assign ( resid 165 and name HB+ ) ( resid 165 and name HD1+ ) 3.07 3.07 0.00 peak 2108 assign ( resid 65 and name HB+ ) ( resid 65 and name HD2+ ) 3.07 3.07 0.00 peak 2108 assign ( resid 165 and name HB+ ) ( resid 165 and name HD2+ ) 3.07 3.07 0.00 peak 2108 assign ( resid 46 and name HG2 ) ( resid 50 and name HD1+ ) 2.61 2.61 0.00 peak 2110 assign ( resid 146 and name HG2 ) ( resid 150 and name HD1+ ) 2.61 2.61 0.00 peak 2110 assign ( resid 54 and name HB2 ) ( resid 54 and name HD1+ ) 2.74 2.74 0.00 peak 2111 assign ( resid 154 and name HB2 ) ( resid 154 and name HD1+ ) 2.74 2.74 0.00 peak 2111 assign ( resid 77 and name HG2 ) ( resid 150 and name HG2+ ) 2.82 2.82 0.00 peak 2112 assign ( resid 50 and name HG2+ ) ( resid 177 and name HG2 ) 2.82 2.82 0.00 peak 2112 assign ( resid 76 and name HB2 ) ( resid 78 and name HB+ ) 3.83 3.83 0.00 peak 2129 assign ( resid 176 and name HB2 ) ( resid 178 and name HB+ ) 3.83 3.83 0.00 peak 2129 assign ( resid 85 and name HG1+ ) ( resid 86 and name HB+ ) 4.87 4.87 0.00 peak 2133 assign ( resid 185 and name HG1+ ) ( resid 186 and name HB+ ) 4.87 4.87 0.00 peak 2133 assign ( resid 36 and name HB+ ) ( resid 36 and name HG+ ) 2.79 2.79 0.00 peak 2140 assign ( resid 136 and name HB+ ) ( resid 136 and name HG+ ) 2.79 2.79 0.00 peak 2140 assign ( resid 61 and name HB ) ( resid 84 and name HG2+ ) 4.40 4.40 0.00 peak 2141 assign ( resid 161 and name HB ) ( resid 184 and name HG2+ ) 4.40 4.40 0.00 peak 2141 assign ( resid 82 and name HB2 ) ( resid 86 and name HG1 ) 4.65 4.65 0.00 peak 2146 assign ( resid 182 and name HB2 ) ( resid 186 and name HG1 ) 4.65 4.65 0.00 peak 2146 assign ( resid 82 and name HB2 ) ( resid 86 and name HG2 ) 5.26 5.26 0.00 peak 2147 assign ( resid 182 and name HB2 ) ( resid 186 and name HG2 ) 5.26 5.26 0.00 peak 2147 assign ( resid 82 and name HB2 ) ( resid 86 and name HD+ ) 4.97 4.97 0.00 peak 2148 assign ( resid 182 and name HB2 ) ( resid 186 and name HD+ ) 4.97 4.97 0.00 peak 2148 assign ( resid 85 and name HB ) ( resid 157 and name HB+ ) 4.74 4.74 0.00 peak 2153 assign ( resid 57 and name HB+ ) ( resid 185 and name HB ) 4.74 4.74 0.00 peak 2153 assign ( resid 91 and name HB1 ) ( resid 92 and name HG2 ) 5.17 5.17 0.00 peak 2162 assign ( resid 191 and name HB1 ) ( resid 192 and name HG2 ) 5.17 5.17 0.00 peak 2162 assign ( resid 92 and name HG2 ) ( resid 191 and name HB1 ) 5.46 5.46 0.00 peak 2162 assign ( resid 91 and name HB1 ) ( resid 192 and name HG2 ) 5.46 5.46 0.00 peak 2162 assign ( resid 92 and name HG2 ) ( resid 191 and name HD2+ ) 4.71 4.71 0.00 peak 2164 assign ( resid 91 and name HD2+ ) ( resid 192 and name HG2 ) 4.71 4.71 0.00 peak 2164 assign ( resid 92 and name HG2 ) ( resid 191 and name HG ) 4.90 4.90 0.00 peak 2165 assign ( resid 91 and name HG ) ( resid 192 and name HG2 ) 4.90 4.90 0.00 peak 2165 assign ( resid 56 and name HG1 ) ( resid 185 and name HG1+ ) 4.62 4.62 0.00 peak 2166 assign ( resid 85 and name HG1+ ) ( resid 156 and name HG1 ) 4.62 4.62 0.00 peak 2166 assign ( resid 56 and name HG1 ) ( resid 185 and name HG2+ ) 3.87 3.87 0.00 peak 2167 assign ( resid 85 and name HG2+ ) ( resid 156 and name HG1 ) 3.87 3.87 0.00 peak 2167 assign ( resid 76 and name HB1 ) ( resid 78 and name HB+ ) 4.53 4.53 0.00 peak 2170 assign ( resid 176 and name HB1 ) ( resid 178 and name HB+ ) 4.53 4.53 0.00 peak 2170 assign ( resid 74 and name HG+ ) ( resid 76 and name HG1 ) 5.09 5.09 0.00 peak 2171 assign ( resid 174 and name HG+ ) ( resid 176 and name HG1 ) 5.09 5.09 0.00 peak 2171 assign ( resid 74 and name HG+ ) ( resid 76 and name HG2 ) 5.09 5.09 0.00 peak 2172 assign ( resid 174 and name HG+ ) ( resid 176 and name HG2 ) 5.09 5.09 0.00 peak 2172 assign ( resid 92 and name HG1 ) ( resid 191 and name HD2+ ) 4.33 4.33 0.00 peak 2179 assign ( resid 91 and name HD2+ ) ( resid 192 and name HG1 ) 4.33 4.33 0.00 peak 2179 assign ( resid 82 and name HG1 ) ( resid 86 and name HD+ ) 3.62 3.62 0.00 peak 2180 assign ( resid 182 and name HG1 ) ( resid 186 and name HD+ ) 3.62 3.62 0.00 peak 2180 assign ( resid 54 and name HD1+ ) ( resid 77 and name HE+ ) 3.90 3.90 0.00 peak 2186 assign ( resid 154 and name HD1+ ) ( resid 177 and name HE+ ) 3.90 3.90 0.00 peak 2186 assign ( resid 61 and name HG2+ ) ( resid 67 and name HE+ ) 3.90 3.90 0.00 peak 2187 assign ( resid 161 and name HG2+ ) ( resid 167 and name HE+ ) 3.90 3.90 0.00 peak 2187 assign ( resid 90 and name HB2 ) ( resid 91 and name HG ) 4.18 4.18 0.00 peak 2192 assign ( resid 190 and name HB2 ) ( resid 191 and name HG ) 4.18 4.18 0.00 peak 2192 assign ( resid 90 and name HB2 ) ( resid 91 and name HD2+ ) 4.74 4.74 0.00 peak 2194 assign ( resid 190 and name HB2 ) ( resid 191 and name HD2+ ) 4.74 4.74 0.00 peak 2194 assign ( resid 90 and name HB2 ) ( resid 91 and name HD1+ ) 4.61 4.61 0.00 peak 2195 assign ( resid 190 and name HB2 ) ( resid 191 and name HD1+ ) 4.61 4.61 0.00 peak 2195 assign ( resid 68 and name HB1 ) ( resid 71 and name HG+ ) 4.37 4.37 0.00 peak 2199 assign ( resid 168 and name HB1 ) ( resid 171 and name HG+ ) 4.37 4.37 0.00 peak 2199 assign ( resid 63 and name HB1 ) ( resid 66 and name HG+ ) 4.54 4.54 0.00 peak 2200 assign ( resid 163 and name HB1 ) ( resid 166 and name HG+ ) 4.54 4.54 0.00 peak 2200 assign ( resid 68 and name HB1 ) ( resid 71 and name HB+ ) 4.54 4.54 0.00 peak 2201 assign ( resid 168 and name HB1 ) ( resid 171 and name HB+ ) 4.54 4.54 0.00 peak 2201 assign ( resid 67 and name HG+ ) ( resid 83 and name HG1 ) 5.29 5.29 0.00 peak 2204 assign ( resid 167 and name HG+ ) ( resid 183 and name HG1 ) 5.29 5.29 0.00 peak 2204 assign ( resid 39 and name HG2 ) ( resid 42 and name HG2 ) 4.82 4.82 0.00 peak 2208 assign ( resid 139 and name HG2 ) ( resid 142 and name HG2 ) 4.82 4.82 0.00 peak 2208 assign ( resid 56 and name HG2 ) ( resid 185 and name HG2+ ) 3.92 3.92 0.00 peak 2214 assign ( resid 85 and name HG2+ ) ( resid 156 and name HG2 ) 3.92 3.92 0.00 peak 2214 assign ( resid 56 and name HG2 ) ( resid 57 and name HB+ ) 4.51 4.51 0.00 peak 2216 assign ( resid 156 and name HG2 ) ( resid 157 and name HB+ ) 4.51 4.51 0.00 peak 2216 assign ( resid 63 and name HB2 ) ( resid 66 and name HG+ ) 5.26 5.26 0.00 peak 2217 assign ( resid 163 and name HB2 ) ( resid 166 and name HG+ ) 5.26 5.26 0.00 peak 2217 assign ( resid 59 and name HG2+ ) ( resid 63 and name HB2 ) 4.37 4.37 0.00 peak 2218 assign ( resid 159 and name HG2+ ) ( resid 163 and name HB2 ) 4.37 4.37 0.00 peak 2218 assign ( resid 63 and name HB2 ) ( resid 64 and name HB+ ) 4.98 4.98 0.00 peak 2218 assign ( resid 163 and name HB2 ) ( resid 164 and name HB+ ) 4.98 4.98 0.00 peak 2218 assign ( resid 39 and name HG1 ) ( resid 42 and name HG1 ) 4.38 4.38 0.00 peak 2221 assign ( resid 139 and name HG1 ) ( resid 142 and name HG1 ) 4.38 4.38 0.00 peak 2221 assign ( resid 82 and name HG2 ) ( resid 86 and name HG2 ) 5.28 5.28 0.00 peak 2222 assign ( resid 182 and name HG2 ) ( resid 186 and name HG2 ) 5.28 5.28 0.00 peak 2222 assign ( resid 67 and name HG+ ) ( resid 83 and name HG2 ) 5.29 5.29 0.00 peak 2223 assign ( resid 167 and name HG+ ) ( resid 183 and name HG2 ) 5.29 5.29 0.00 peak 2223 assign ( resid 41 and name HG2+ ) ( resid 42 and name HG1 ) 4.07 4.07 0.00 peak 2225 assign ( resid 141 and name HG2+ ) ( resid 142 and name HG1 ) 4.07 4.07 0.00 peak 2225 assign ( resid 85 and name HA ) ( resid 184 and name HG2+ ) 4.70 4.70 0.00 peak 2230 assign ( resid 84 and name HG2+ ) ( resid 185 and name HA ) 4.70 4.70 0.00 peak 2230 assign ( resid 85 and name HA ) ( resid 85 and name HG1+ ) 4.04 4.04 0.00 peak 2231 assign ( resid 185 and name HA ) ( resid 185 and name HG1+ ) 4.04 4.04 0.00 peak 2231 assign ( resid 85 and name HA ) ( resid 85 and name HG2+ ) 3.53 3.53 0.00 peak 2232 assign ( resid 185 and name HA ) ( resid 185 and name HG2+ ) 3.53 3.53 0.00 peak 2232 assign ( resid 85 and name HA ) ( resid 161 and name HD1+ ) 4.69 4.69 0.00 peak 2233 assign ( resid 61 and name HD1+ ) ( resid 185 and name HA ) 4.69 4.69 0.00 peak 2233 assign ( resid 46 and name HD+ ) ( resid 50 and name HD1+ ) 3.61 3.61 0.00 peak 2239 assign ( resid 146 and name HD+ ) ( resid 150 and name HD1+ ) 3.61 3.61 0.00 peak 2239 assign ( resid 46 and name HD+ ) ( resid 178 and name HB+ ) 4.43 4.43 0.00 peak 2242 assign ( resid 78 and name HB+ ) ( resid 146 and name HD+ ) 4.43 4.43 0.00 peak 2242 assign ( resid 61 and name HD1+ ) ( resid 87 and name HB1 ) 3.97 3.97 0.00 peak 2247 assign ( resid 161 and name HD1+ ) ( resid 187 and name HB1 ) 3.97 3.97 0.00 peak 2247 assign ( resid 93 and name HD+ ) ( resid 94 and name HB+ ) 4.19 4.19 0.00 peak 2249 assign ( resid 193 and name HD+ ) ( resid 194 and name HB+ ) 4.19 4.19 0.00 peak 2249 assign ( resid 41 and name HG2+ ) ( resid 45 and name HD+ ) 3.74 3.74 0.00 peak 2250 assign ( resid 141 and name HG2+ ) ( resid 145 and name HD+ ) 3.74 3.74 0.00 peak 2250 assign ( resid 62 and name HD1+ ) ( resid 71 and name HD+ ) 4.67 4.67 0.00 peak 2258 assign ( resid 162 and name HD1+ ) ( resid 171 and name HD+ ) 4.67 4.67 0.00 peak 2258 assign ( resid 61 and name HD1+ ) ( resid 87 and name HB2 ) 3.97 3.97 0.00 peak 2259 assign ( resid 161 and name HD1+ ) ( resid 187 and name HB2 ) 3.97 3.97 0.00 peak 2259 assign ( resid 90 and name HB1 ) ( resid 91 and name HG ) 4.36 4.36 0.00 peak 2260 assign ( resid 190 and name HB1 ) ( resid 191 and name HG ) 4.36 4.36 0.00 peak 2260 assign ( resid 77 and name HG2 ) ( resid 77 and name HE+ ) 3.93 3.93 0.00 peak 2265 assign ( resid 177 and name HG2 ) ( resid 177 and name HE+ ) 3.93 3.93 0.00 peak 2265 assign ( resid 62 and name HD2+ ) ( resid 71 and name HD+ ) 4.67 4.67 0.00 peak 2268 assign ( resid 162 and name HD2+ ) ( resid 171 and name HD+ ) 4.67 4.67 0.00 peak 2268 assign ( resid 74 and name HA ) ( resid 74 and name HD+ ) 3.28 3.28 0.00 peak 2271 assign ( resid 174 and name HA ) ( resid 174 and name HD+ ) 3.28 3.28 0.00 peak 2271 assign ( resid 41 and name HG12 ) ( resid 42 and name HA ) 3.64 3.64 0.00 peak 2272 assign ( resid 141 and name HG12 ) ( resid 142 and name HA ) 3.64 3.64 0.00 peak 2272 assign ( resid 41 and name HG11 ) ( resid 42 and name HA ) 5.35 5.35 0.00 peak 2274 assign ( resid 141 and name HG11 ) ( resid 142 and name HA ) 5.35 5.35 0.00 peak 2274 assign ( resid 36 and name HA ) ( resid 36 and name HD+ ) 3.83 3.83 0.00 peak 2278 assign ( resid 136 and name HA ) ( resid 136 and name HD+ ) 3.83 3.83 0.00 peak 2278 assign ( resid 64 and name HB+ ) ( resid 65 and name HA ) 3.96 3.96 0.00 peak 2283 assign ( resid 164 and name HB+ ) ( resid 165 and name HA ) 3.96 3.96 0.00 peak 2283 assign ( resid 45 and name HA ) ( resid 45 and name HG2 ) 3.16 3.16 0.00 peak 2284 assign ( resid 145 and name HA ) ( resid 145 and name HG2 ) 3.16 3.16 0.00 peak 2284 assign ( resid 59 and name HB ) ( resid 185 and name HG1+ ) 5.50 5.50 0.00 peak 2293 assign ( resid 85 and name HG1+ ) ( resid 159 and name HB ) 5.50 5.50 0.00 peak 2293 assign ( resid 56 and name HA ) ( resid 185 and name HG1+ ) 5.50 5.50 0.00 peak 2298 assign ( resid 85 and name HG1+ ) ( resid 156 and name HA ) 5.50 5.50 0.00 peak 2298 assign ( resid 66 and name HA ) ( resid 66 and name HG+ ) 3.55 3.55 0.00 peak 2302 assign ( resid 166 and name HA ) ( resid 166 and name HG+ ) 3.55 3.55 0.00 peak 2302 assign ( resid 91 and name HA ) ( resid 94 and name HB+ ) 3.86 3.86 0.00 peak 2302 assign ( resid 191 and name HA ) ( resid 194 and name HB+ ) 3.86 3.86 0.00 peak 2302 assign ( resid 62 and name HD1+ ) ( resid 66 and name HA ) 4.94 4.94 0.00 peak 2304 assign ( resid 162 and name HD1+ ) ( resid 166 and name HA ) 4.94 4.94 0.00 peak 2304 assign ( resid 91 and name HA ) ( resid 91 and name HD2+ ) 3.04 3.04 0.00 peak 2305 assign ( resid 191 and name HA ) ( resid 191 and name HD2+ ) 3.04 3.04 0.00 peak 2305 assign ( resid 41 and name HA ) ( resid 41 and name HG12 ) 3.82 3.82 0.00 peak 2307 assign ( resid 141 and name HA ) ( resid 141 and name HG12 ) 3.82 3.82 0.00 peak 2307 assign ( resid 41 and name HA ) ( resid 41 and name HG11 ) 3.48 3.48 0.00 peak 2308 assign ( resid 141 and name HA ) ( resid 141 and name HG11 ) 3.48 3.48 0.00 peak 2308 assign ( resid 54 and name HA ) ( resid 57 and name HB+ ) 3.62 3.62 0.00 peak 2309 assign ( resid 154 and name HA ) ( resid 157 and name HB+ ) 3.62 3.62 0.00 peak 2309 assign ( resid 47 and name HA ) ( resid 50 and name HD1+ ) 2.92 2.92 0.00 peak 2311 assign ( resid 147 and name HA ) ( resid 150 and name HD1+ ) 2.92 2.92 0.00 peak 2311 assign ( resid 61 and name HA ) ( resid 64 and name HB+ ) 3.96 3.96 0.00 peak 2312 assign ( resid 161 and name HA ) ( resid 164 and name HB+ ) 3.96 3.96 0.00 peak 2312 assign ( resid 61 and name HA ) ( resid 61 and name HG2+ ) 3.12 3.12 0.00 peak 2315 assign ( resid 161 and name HA ) ( resid 161 and name HG2+ ) 3.12 3.12 0.00 peak 2315 assign ( resid 82 and name HA ) ( resid 85 and name HG2+ ) 3.26 3.26 0.00 peak 2315 assign ( resid 182 and name HA ) ( resid 185 and name HG2+ ) 3.26 3.26 0.00 peak 2315 assign ( resid 61 and name HA ) ( resid 61 and name HD1+ ) 3.39 3.39 0.00 peak 2316 assign ( resid 161 and name HA ) ( resid 161 and name HD1+ ) 3.39 3.39 0.00 peak 2316 assign ( resid 62 and name HA ) ( resid 62 and name HD1+ ) 3.33 3.33 0.00 peak 2318 assign ( resid 162 and name HA ) ( resid 162 and name HD1+ ) 3.33 3.33 0.00 peak 2318 assign ( resid 46 and name HA ) ( resid 46 and name HG2 ) 3.53 3.53 0.00 peak 2320 assign ( resid 146 and name HA ) ( resid 146 and name HG2 ) 3.53 3.53 0.00 peak 2320 assign ( resid 77 and name HG2 ) ( resid 78 and name HA ) 3.91 3.91 0.00 peak 2321 assign ( resid 177 and name HG2 ) ( resid 178 and name HA ) 3.91 3.91 0.00 peak 2321 assign ( resid 62 and name HA ) ( resid 62 and name HD2+ ) 3.33 3.33 0.00 peak 2323 assign ( resid 162 and name HA ) ( resid 162 and name HD2+ ) 3.33 3.33 0.00 peak 2323 assign ( resid 61 and name HD1+ ) ( resid 84 and name HA ) 3.42 3.42 0.00 peak 2325 assign ( resid 161 and name HD1+ ) ( resid 184 and name HA ) 3.42 3.42 0.00 peak 2325 assign ( resid 84 and name HA ) ( resid 84 and name HG2+ ) 3.69 3.69 0.00 peak 2327 assign ( resid 184 and name HA ) ( resid 184 and name HG2+ ) 3.69 3.69 0.00 peak 2327 assign ( resid 85 and name HG1+ ) ( resid 86 and name HA ) 4.22 4.22 0.00 peak 2328 assign ( resid 185 and name HG1+ ) ( resid 186 and name HA ) 4.22 4.22 0.00 peak 2328 assign ( resid 86 and name HA ) ( resid 86 and name HG1 ) 3.71 3.71 0.00 peak 2330 assign ( resid 186 and name HA ) ( resid 186 and name HG1 ) 3.71 3.71 0.00 peak 2330 assign ( resid 86 and name HA ) ( resid 86 and name HG2 ) 3.70 3.70 0.00 peak 2331 assign ( resid 186 and name HA ) ( resid 186 and name HG2 ) 3.70 3.70 0.00 peak 2331 assign ( resid 77 and name HA ) ( resid 80 and name HD1+ ) 3.24 3.24 0.00 peak 2332 assign ( resid 177 and name HA ) ( resid 180 and name HD1+ ) 3.24 3.24 0.00 peak 2332 assign ( resid 77 and name HA ) ( resid 77 and name HG2 ) 3.80 3.80 0.00 peak 2333 assign ( resid 177 and name HA ) ( resid 177 and name HG2 ) 3.80 3.80 0.00 peak 2333 assign ( resid 59 and name HA ) ( resid 59 and name HG2+ ) 3.35 3.35 0.00 peak 2334 assign ( resid 159 and name HA ) ( resid 159 and name HG2+ ) 3.35 3.35 0.00 peak 2334 assign ( resid 39 and name HG2 ) ( resid 40 and name HD2 ) 4.48 4.48 0.00 peak 2343 assign ( resid 139 and name HG2 ) ( resid 140 and name HD2 ) 4.48 4.48 0.00 peak 2343 assign ( resid 39 and name HG1 ) ( resid 40 and name HD2 ) 4.67 4.67 0.00 peak 2344 assign ( resid 139 and name HG1 ) ( resid 140 and name HD2 ) 4.67 4.67 0.00 peak 2344 assign ( resid 39 and name HD+ ) ( resid 40 and name HD2 ) 3.97 3.97 0.00 peak 2345 assign ( resid 139 and name HD+ ) ( resid 140 and name HD2 ) 3.97 3.97 0.00 peak 2345 assign ( resid 50 and name HA ) ( resid 177 and name HG1 ) 5.23 5.23 0.00 peak 2349 assign ( resid 77 and name HG1 ) ( resid 150 and name HA ) 5.23 5.23 0.00 peak 2349 assign ( resid 50 and name HA ) ( resid 178 and name HB+ ) 4.31 4.31 0.00 peak 2350 assign ( resid 78 and name HB+ ) ( resid 150 and name HA ) 4.31 4.31 0.00 peak 2350 assign ( resid 50 and name HA ) ( resid 50 and name HG2+ ) 3.30 3.30 0.00 peak 2352 assign ( resid 150 and name HA ) ( resid 150 and name HG2+ ) 3.30 3.30 0.00 peak 2352 assign ( resid 80 and name HA ) ( resid 80 and name HG2+ ) 3.41 3.41 0.00 peak 2360 assign ( resid 180 and name HA ) ( resid 180 and name HG2+ ) 3.41 3.41 0.00 peak 2360 assign ( resid 68 and name HA ) ( resid 71 and name HG+ ) 4.51 4.51 0.00 peak 2371 assign ( resid 168 and name HA ) ( resid 171 and name HG+ ) 4.51 4.51 0.00 peak 2371 assign ( resid 67 and name HB+ ) ( resid 68 and name HA ) 4.70 4.70 0.00 peak 2373 assign ( resid 167 and name HB+ ) ( resid 168 and name HA ) 4.70 4.70 0.00 peak 2373 assign ( resid 65 and name HD1+ ) ( resid 87 and name HA ) 4.64 4.64 0.00 peak 2378 assign ( resid 165 and name HD1+ ) ( resid 187 and name HA ) 4.64 4.64 0.00 peak 2378 assign ( resid 65 and name HD2+ ) ( resid 87 and name HA ) 4.64 4.64 0.00 peak 2378 assign ( resid 165 and name HD2+ ) ( resid 187 and name HA ) 4.64 4.64 0.00 peak 2378 assign ( resid 61 and name HD1+ ) ( resid 87 and name HA ) 5.27 5.27 0.00 peak 2379 assign ( resid 161 and name HD1+ ) ( resid 187 and name HA ) 5.27 5.27 0.00 peak 2379 assign ( resid 39 and name HA ) ( resid 39 and name HG2 ) 3.73 3.73 0.00 peak 2380 assign ( resid 139 and name HA ) ( resid 139 and name HG2 ) 3.73 3.73 0.00 peak 2380 assign ( resid 39 and name HA ) ( resid 39 and name HD+ ) 3.56 3.56 0.00 peak 2381 assign ( resid 139 and name HA ) ( resid 139 and name HD+ ) 3.56 3.56 0.00 peak 2381 assign ( resid 39 and name HA ) ( resid 39 and name HG1 ) 3.98 3.98 0.00 peak 2382 assign ( resid 139 and name HA ) ( resid 139 and name HG1 ) 3.98 3.98 0.00 peak 2382 assign ( resid 84 and name HB ) ( resid 85 and name HG2+ ) 3.54 3.54 0.00 peak 2385 assign ( resid 184 and name HB ) ( resid 185 and name HG2+ ) 3.54 3.54 0.00 peak 2385 assign ( resid 84 and name HB ) ( resid 184 and name HG2+ ) 4.38 4.38 0.00 peak 2387 assign ( resid 84 and name HG2+ ) ( resid 184 and name HB ) 4.38 4.38 0.00 peak 2387 assign ( resid 84 and name HB ) ( resid 85 and name HG1+ ) 5.42 5.42 0.00 peak 2388 assign ( resid 184 and name HB ) ( resid 185 and name HG1+ ) 5.42 5.42 0.00 peak 2388 assign ( resid 75 and name HA ) ( resid 75 and name HG ) 3.65 3.65 0.00 peak 2389 assign ( resid 175 and name HA ) ( resid 175 and name HG ) 3.65 3.65 0.00 peak 2389 assign ( resid 51 and name HA ) ( resid 54 and name HB2 ) 3.87 3.87 0.00 peak 2390 assign ( resid 151 and name HA ) ( resid 154 and name HB2 ) 3.87 3.87 0.00 peak 2390 assign ( resid 50 and name HG2+ ) ( resid 51 and name HA ) 3.64 3.64 0.00 peak 2391 assign ( resid 150 and name HG2+ ) ( resid 151 and name HA ) 3.64 3.64 0.00 peak 2391 assign ( resid 79 and name HN ) ( resid 80 and name HD1+ ) 4.30 4.30 0.00 peak 2400 assign ( resid 179 and name HN ) ( resid 180 and name HD1+ ) 4.30 4.30 0.00 peak 2400 assign ( resid 50 and name HG2+ ) ( resid 51 and name HD22 ) 4.70 4.70 0.00 peak 2401 assign ( resid 150 and name HG2+ ) ( resid 151 and name HD22 ) 4.70 4.70 0.00 peak 2401 assign ( resid 91 and name HB1 ) ( resid 95 and name HE22 ) 4.56 4.56 0.00 peak 2404 assign ( resid 191 and name HB1 ) ( resid 195 and name HE22 ) 4.56 4.56 0.00 peak 2404 assign ( resid 36 and name HD+ ) ( resid 37 and name HN ) 4.09 4.09 0.00 peak 2414 assign ( resid 136 and name HD+ ) ( resid 137 and name HN ) 4.09 4.09 0.00 peak 2414 assign ( resid 41 and name HD1+ ) ( resid 42 and name HN ) 4.46 4.46 0.00 peak 2424 assign ( resid 141 and name HD1+ ) ( resid 142 and name HN ) 4.46 4.46 0.00 peak 2424 assign ( resid 53 and name HN ) ( resid 178 and name HB+ ) 4.94 4.94 0.00 peak 2429 assign ( resid 78 and name HB+ ) ( resid 153 and name HN ) 4.94 4.94 0.00 peak 2429 assign ( resid 47 and name HN ) ( resid 50 and name HD1+ ) 3.64 3.64 0.00 peak 2432 assign ( resid 147 and name HN ) ( resid 150 and name HD1+ ) 3.64 3.64 0.00 peak 2432 assign ( resid 62 and name HD1+ ) ( resid 67 and name HN ) 4.60 4.60 0.00 peak 2433 assign ( resid 162 and name HD1+ ) ( resid 167 and name HN ) 4.60 4.60 0.00 peak 2433 assign ( resid 62 and name HD2+ ) ( resid 67 and name HN ) 4.60 4.60 0.00 peak 2435 assign ( resid 162 and name HD2+ ) ( resid 167 and name HN ) 4.60 4.60 0.00 peak 2435 assign ( resid 77 and name HG1 ) ( resid 81 and name HN ) 4.59 4.59 0.00 peak 2438 assign ( resid 177 and name HG1 ) ( resid 181 and name HN ) 4.59 4.59 0.00 peak 2438 assign ( resid 50 and name HN ) ( resid 178 and name HB+ ) 4.20 4.20 0.00 peak 2440 assign ( resid 78 and name HB+ ) ( resid 150 and name HN ) 4.20 4.20 0.00 peak 2440 assign ( resid 80 and name HG2+ ) ( resid 81 and name HN ) 4.08 4.08 0.00 peak 2443 assign ( resid 180 and name HG2+ ) ( resid 181 and name HN ) 4.08 4.08 0.00 peak 2443 assign ( resid 44 and name HN ) ( resid 44 and name HG2 ) 4.87 4.87 0.00 peak 2446 assign ( resid 144 and name HN ) ( resid 144 and name HG2 ) 4.87 4.87 0.00 peak 2446 assign ( resid 48 and name HB+ ) ( resid 49 and name HN ) 3.48 3.48 0.00 peak 2447 assign ( resid 148 and name HB+ ) ( resid 149 and name HN ) 3.48 3.48 0.00 peak 2447 assign ( resid 84 and name HG2+ ) ( resid 85 and name HN ) 4.55 4.55 0.00 peak 2448 assign ( resid 184 and name HG2+ ) ( resid 185 and name HN ) 4.55 4.55 0.00 peak 2448 assign ( resid 85 and name HN ) ( resid 184 and name HG2+ ) 4.85 4.85 0.00 peak 2448 assign ( resid 84 and name HG2+ ) ( resid 185 and name HN ) 4.85 4.85 0.00 peak 2448 assign ( resid 85 and name HN ) ( resid 85 and name HG2+ ) 3.36 3.36 0.00 peak 2450 assign ( resid 185 and name HN ) ( resid 185 and name HG2+ ) 3.36 3.36 0.00 peak 2450 assign ( resid 61 and name HD1+ ) ( resid 87 and name HN ) 4.71 4.71 0.00 peak 2451 assign ( resid 161 and name HD1+ ) ( resid 187 and name HN ) 4.71 4.71 0.00 peak 2451 assign ( resid 62 and name HD1+ ) ( resid 72 and name HN ) 4.93 4.93 0.00 peak 2452 assign ( resid 162 and name HD1+ ) ( resid 172 and name HN ) 4.93 4.93 0.00 peak 2452 assign ( resid 59 and name HG2+ ) ( resid 60 and name HN ) 3.57 3.57 0.00 peak 2455 assign ( resid 159 and name HG2+ ) ( resid 160 and name HN ) 3.57 3.57 0.00 peak 2455 assign ( resid 60 and name HN ) ( resid 185 and name HG1+ ) 4.72 4.72 0.00 peak 2457 assign ( resid 85 and name HG1+ ) ( resid 160 and name HN ) 4.72 4.72 0.00 peak 2457 assign ( resid 80 and name HN ) ( resid 80 and name HD1+ ) 3.30 3.30 0.00 peak 2462 assign ( resid 180 and name HN ) ( resid 180 and name HD1+ ) 3.30 3.30 0.00 peak 2462 assign ( resid 71 and name HN ) ( resid 71 and name HG+ ) 3.58 3.58 0.00 peak 2463 assign ( resid 171 and name HN ) ( resid 171 and name HG+ ) 3.58 3.58 0.00 peak 2463 assign ( resid 84 and name HN ) ( resid 84 and name HG2+ ) 3.88 3.88 0.00 peak 2465 assign ( resid 184 and name HN ) ( resid 184 and name HG2+ ) 3.88 3.88 0.00 peak 2465 assign ( resid 61 and name HG2+ ) ( resid 62 and name HN ) 3.32 3.32 0.00 peak 2468 assign ( resid 161 and name HG2+ ) ( resid 162 and name HN ) 3.32 3.32 0.00 peak 2468 assign ( resid 61 and name HD1+ ) ( resid 84 and name HN ) 4.31 4.31 0.00 peak 2470 assign ( resid 161 and name HD1+ ) ( resid 184 and name HN ) 4.31 4.31 0.00 peak 2470 assign ( resid 62 and name HD1+ ) ( resid 63 and name HN ) 4.80 4.80 0.00 peak 2479 assign ( resid 162 and name HD1+ ) ( resid 163 and name HN ) 4.80 4.80 0.00 peak 2479 assign ( resid 86 and name HN ) ( resid 86 and name HD+ ) 4.07 4.07 0.00 peak 2487 assign ( resid 186 and name HN ) ( resid 186 and name HD+ ) 4.07 4.07 0.00 peak 2487 assign ( resid 92 and name HN ) ( resid 191 and name HD2+ ) 5.50 5.50 0.00 peak 2497 assign ( resid 91 and name HD2+ ) ( resid 192 and name HN ) 5.50 5.50 0.00 peak 2497 assign ( resid 61 and name HG2+ ) ( resid 65 and name HN ) 4.70 4.70 0.00 peak 2503 assign ( resid 161 and name HG2+ ) ( resid 165 and name HN ) 4.70 4.70 0.00 peak 2503 assign ( resid 59 and name HN ) ( resid 59 and name HG2+ ) 3.78 3.78 0.00 peak 2510 assign ( resid 159 and name HN ) ( resid 159 and name HG2+ ) 3.78 3.78 0.00 peak 2510 assign ( resid 77 and name HN ) ( resid 77 and name HG2 ) 4.65 4.65 0.00 peak 2524 assign ( resid 177 and name HN ) ( resid 177 and name HG2 ) 4.65 4.65 0.00 peak 2524 assign ( resid 77 and name HN ) ( resid 146 and name HG2 ) 5.00 5.00 0.00 peak 2527 assign ( resid 46 and name HG2 ) ( resid 177 and name HN ) 5.00 5.00 0.00 peak 2527 assign ( resid 57 and name HN ) ( resid 185 and name HG1+ ) 4.53 4.53 0.00 peak 2530 assign ( resid 85 and name HG1+ ) ( resid 157 and name HN ) 4.53 4.53 0.00 peak 2530 assign ( resid 77 and name HN ) ( resid 80 and name HD1+ ) 3.78 3.78 0.00 peak 2532 assign ( resid 177 and name HN ) ( resid 180 and name HD1+ ) 3.78 3.78 0.00 peak 2532 assign ( resid 61 and name HN ) ( resid 61 and name HD1+ ) 4.02 4.02 0.00 peak 2533 assign ( resid 161 and name HN ) ( resid 161 and name HD1+ ) 4.02 4.02 0.00 peak 2533 assign ( resid 50 and name HG2+ ) ( resid 54 and name HN ) 4.18 4.18 0.00 peak 2536 assign ( resid 150 and name HG2+ ) ( resid 154 and name HN ) 4.18 4.18 0.00 peak 2536 assign ( resid 80 and name HG2+ ) ( resid 83 and name HN ) 4.80 4.80 0.00 peak 2537 assign ( resid 180 and name HG2+ ) ( resid 183 and name HN ) 4.80 4.80 0.00 peak 2537 assign ( resid 83 and name HN ) ( resid 86 and name HD+ ) 5.50 5.50 0.00 peak 2538 assign ( resid 183 and name HN ) ( resid 186 and name HD+ ) 5.50 5.50 0.00 peak 2538 assign ( resid 69 and name HN ) ( resid 71 and name HG+ ) 4.69 4.69 0.00 peak 2545 assign ( resid 169 and name HN ) ( resid 171 and name HG+ ) 4.69 4.69 0.00 peak 2545 assign ( resid 38 and name HN ) ( resid 39 and name HG2 ) 5.26 5.26 0.00 peak 2552 assign ( resid 138 and name HN ) ( resid 139 and name HG2 ) 5.26 5.26 0.00 peak 2552 assign ( resid 88 and name HN ) ( resid 184 and name HG2+ ) 5.50 5.50 0.00 peak 2553 assign ( resid 84 and name HG2+ ) ( resid 188 and name HN ) 5.50 5.50 0.00 peak 2553 assign ( resid 61 and name HD1+ ) ( resid 88 and name HN ) 5.01 5.01 0.00 peak 2555 assign ( resid 161 and name HD1+ ) ( resid 188 and name HN ) 5.01 5.01 0.00 peak 2555 assign ( resid 48 and name HB+ ) ( resid 51 and name HN ) 5.33 5.33 0.00 peak 2556 assign ( resid 148 and name HB+ ) ( resid 151 and name HN ) 5.33 5.33 0.00 peak 2556 assign ( resid 51 and name HN ) ( resid 54 and name HB2 ) 5.50 5.50 0.00 peak 2556 assign ( resid 151 and name HN ) ( resid 154 and name HB2 ) 5.50 5.50 0.00 peak 2556 assign ( resid 42 and name HG1 ) ( resid 45 and name HD+ ) 5.47 5.47 0.00 peak 2579 assign ( resid 142 and name HG1 ) ( resid 145 and name HD+ ) 5.47 5.47 0.00 peak 2579 assign ( resid 37 and name HN ) ( resid 37 and name HB+ ) 3.46 3.46 0.00 peak 471 assign ( resid 37 and name HB+ ) ( resid 38 and name HN ) 3.91 3.91 0.00 peak 476 assign ( resid 39 and name HN ) ( resid 39 and name HB+ ) 3.10 3.10 0.00 peak 194 assign ( resid 39 and name HB+ ) ( resid 39 and name HG2 ) 2.57 2.57 0.00 peak 2138 assign ( resid 39 and name HB+ ) ( resid 39 and name HE+ ) 4.00 4.00 0.00 peak 1598 assign ( resid 39 and name HB+ ) ( resid 40 and name HD2 ) 3.58 3.58 0.00 peak 1554 assign ( resid 39 and name HB+ ) ( resid 41 and name HN ) 3.72 3.72 0.00 peak 1347 assign ( resid 39 and name HB+ ) ( resid 42 and name HN ) 4.18 4.18 0.00 peak 1323 assign ( resid 39 and name HB+ ) ( resid 42 and name HB2 ) 3.57 3.57 0.00 peak 1743 assign ( resid 39 and name HB+ ) ( resid 42 and name HG1 ) 3.40 3.40 0.00 peak 1650 assign ( resid 39 and name HE+ ) ( resid 40 and name HG+ ) 5.25 5.25 0.00 peak 1710 assign ( resid 40 and name HB+ ) ( resid 41 and name HN ) 4.10 4.10 0.00 peak 330 assign ( resid 40 and name HG+ ) ( resid 41 and name HN ) 3.65 3.65 0.00 peak 177 assign ( resid 41 and name HA ) ( resid 44 and name HG+ ) 4.38 4.38 0.00 peak 2310 assign ( resid 44 and name HN ) ( resid 44 and name HG+ ) 4.18 4.18 0.00 peak 2446 assign ( resid 44 and name HA ) ( resid 44 and name HG+ ) 3.38 3.38 0.00 peak 2299 assign ( resid 44 and name HG+ ) ( resid 44 and name HE+ ) 3.46 3.46 0.00 peak 2265 assign ( resid 44 and name HG+ ) ( resid 45 and name HN ) 4.70 4.70 0.00 peak 2426 assign ( resid 46 and name HB+ ) ( resid 46 and name HG2 ) 2.55 2.55 0.00 peak 2159 assign ( resid 46 and name HB+ ) ( resid 46 and name HD+ ) 3.04 3.04 0.00 peak 814 assign ( resid 50 and name HA ) ( resid 181 and name HD++ ) 3.26 3.26 0.00 peak 2351 assign ( resid 50 and name HG2+ ) ( resid 181 and name HD++ ) 2.68 2.68 0.00 peak 1952 assign ( resid 51 and name HN ) ( resid 181 and name HD++ ) 4.90 4.90 0.00 peak 125 assign ( resid 51 and name HA ) ( resid 181 and name HD++ ) 4.25 4.25 0.00 peak 741 assign ( resid 51 and name HB2 ) ( resid 52 and name HB+ ) 4.89 4.89 0.00 peak 1712 assign ( resid 52 and name HN ) ( resid 181 and name HD++ ) 5.44 5.44 0.00 peak 158 assign ( resid 52 and name HB+ ) ( resid 53 and name HN ) 3.36 3.36 0.00 peak 352 assign ( resid 52 and name HB+ ) ( resid 56 and name HN ) 5.21 5.21 0.00 peak 338 assign ( resid 53 and name HN ) ( resid 181 and name HD++ ) 3.67 3.67 0.00 peak 2431 assign ( resid 54 and name HN ) ( resid 181 and name HD++ ) 3.41 3.41 0.00 peak 556 assign ( resid 54 and name HB2 ) ( resid 181 and name HD++ ) 3.06 3.06 0.00 peak 2114 assign ( resid 54 and name HG ) ( resid 81 and name HD++ ) 3.42 3.42 0.00 peak 1923 assign ( resid 54 and name HG ) ( resid 181 and name HD++ ) 2.63 2.63 0.00 peak 2099 assign ( resid 54 and name HD1+ ) ( resid 81 and name HD++ ) 3.17 3.17 0.00 peak 1964 assign ( resid 54 and name HD2+ ) ( resid 81 and name HD++ ) 2.99 2.99 0.00 peak 1963 assign ( resid 55 and name HN ) ( resid 181 and name HD++ ) 4.86 4.86 0.00 peak 2481 assign ( resid 56 and name HB+ ) ( resid 60 and name HD++ ) 4.20 4.20 0.00 peak 1912 assign ( resid 57 and name HD++ ) ( resid 58 and name HN ) 3.52 3.52 0.00 peak 128 assign ( resid 57 and name HD++ ) ( resid 59 and name HN ) 4.57 4.57 0.00 peak 133 assign ( resid 57 and name HD++ ) ( resid 61 and name HN ) 4.90 4.90 0.00 peak 114 assign ( resid 57 and name HD++ ) ( resid 84 and name HN ) 3.88 3.88 0.00 peak 385 assign ( resid 57 and name HD++ ) ( resid 84 and name HG2+ ) 2.45 2.45 0.00 peak 2065 assign ( resid 57 and name HD++ ) ( resid 185 and name HN ) 3.72 3.72 0.00 peak 146 assign ( resid 57 and name HD++ ) ( resid 185 and name HA ) 4.07 4.07 0.00 peak 772 assign ( resid 57 and name HD++ ) ( resid 185 and name HB ) 4.56 4.56 0.00 peak 1908 assign ( resid 57 and name HD++ ) ( resid 185 and name HG2+ ) 2.99 2.99 0.00 peak 1952 assign ( resid 58 and name HN ) ( resid 61 and name HG1+ ) 4.97 4.97 0.00 peak 257 assign ( resid 59 and name HN ) ( resid 60 and name HD++ ) 4.60 4.60 0.00 peak 2512 assign ( resid 59 and name HN ) ( resid 61 and name HG1+ ) 5.26 5.26 0.00 peak 256 assign ( resid 59 and name HB ) ( resid 60 and name HD++ ) 3.42 3.42 0.00 peak 2287 assign ( resid 59 and name HG2+ ) ( resid 60 and name HD++ ) 3.07 3.07 0.00 peak 1951 assign ( resid 60 and name HN ) ( resid 60 and name HD++ ) 3.42 3.42 0.00 peak 2459 assign ( resid 60 and name HN ) ( resid 61 and name HG1+ ) 4.39 4.39 0.00 peak 2460 assign ( resid 60 and name HA ) ( resid 60 and name HD++ ) 3.03 3.03 0.00 peak 2301 assign ( resid 60 and name HD++ ) ( resid 61 and name HN ) 5.10 5.10 0.00 peak 114 assign ( resid 60 and name HD++ ) ( resid 63 and name HB2 ) 4.20 4.20 0.00 peak 2219 assign ( resid 61 and name HN ) ( resid 61 and name HG1+ ) 3.43 3.43 0.00 peak 272 assign ( resid 61 and name HA ) ( resid 61 and name HG1+ ) 3.54 3.54 0.00 peak 2312 assign ( resid 61 and name HG2+ ) ( resid 62 and name HD++ ) 3.55 3.55 0.00 peak 1939 assign ( resid 61 and name HG2+ ) ( resid 83 and name HG+ ) 3.73 3.73 0.00 peak 2226 assign ( resid 61 and name HG1+ ) ( resid 62 and name HN ) 4.44 4.44 0.00 peak 261 assign ( resid 61 and name HG1+ ) ( resid 84 and name HG2+ ) 2.97 2.97 0.00 peak 2029 assign ( resid 61 and name HG1+ ) ( resid 87 and name HB+ ) 4.79 4.79 0.00 peak 2244 assign ( resid 62 and name HN ) ( resid 62 and name HB+ ) 3.23 3.23 0.00 peak 251 assign ( resid 62 and name HN ) ( resid 62 and name HD++ ) 3.71 3.71 0.00 peak 2471 assign ( resid 62 and name HA ) ( resid 62 and name HD++ ) 2.87 2.87 0.00 peak 2318 assign ( resid 62 and name HB+ ) ( resid 62 and name HD++ ) 2.50 2.50 0.00 peak 1918 assign ( resid 62 and name HB+ ) ( resid 63 and name HN ) 3.24 3.24 0.00 peak 191 assign ( resid 62 and name HD++ ) ( resid 65 and name HN ) 5.28 5.28 0.00 peak 2498 assign ( resid 62 and name HD++ ) ( resid 66 and name HN ) 3.66 3.66 0.00 peak 318 assign ( resid 62 and name HD++ ) ( resid 66 and name HA ) 3.41 3.41 0.00 peak 2304 assign ( resid 62 and name HD++ ) ( resid 67 and name HN ) 3.75 3.75 0.00 peak 2433 assign ( resid 62 and name HD++ ) ( resid 67 and name HB+ ) 3.53 3.53 0.00 peak 2109 assign ( resid 62 and name HD++ ) ( resid 67 and name HD+ ) 3.73 3.73 0.00 peak 2113 assign ( resid 62 and name HD++ ) ( resid 67 and name HE+ ) 4.46 4.46 0.00 peak 1882 assign ( resid 62 and name HD++ ) ( resid 68 and name HN ) 4.56 4.56 0.00 peak 353 assign ( resid 62 and name HD++ ) ( resid 71 and name HD+ ) 3.93 3.93 0.00 peak 2258 assign ( resid 62 and name HD++ ) ( resid 72 and name HN ) 3.98 3.98 0.00 peak 2452 assign ( resid 62 and name HD++ ) ( resid 72 and name HA ) 4.64 4.64 0.00 peak 2367 assign ( resid 62 and name HD++ ) ( resid 72 and name HB+ ) 3.33 3.33 0.00 peak 2186 assign ( resid 62 and name HD++ ) ( resid 75 and name HD++ ) 2.65 2.65 0.00 peak 1974 assign ( resid 64 and name HN ) ( resid 65 and name HD++ ) 3.74 3.74 0.00 peak 290 assign ( resid 64 and name HB+ ) ( resid 65 and name HD++ ) 3.01 3.01 0.00 peak 2058 assign ( resid 65 and name HN ) ( resid 65 and name HD++ ) 3.32 3.32 0.00 peak 312 assign ( resid 65 and name HA ) ( resid 65 and name HD++ ) 3.33 3.33 0.00 peak 2286 assign ( resid 65 and name HB+ ) ( resid 65 and name HD++ ) 2.59 2.59 0.00 peak 2108 assign ( resid 65 and name HD++ ) ( resid 66 and name HE+ ) 5.03 5.03 0.00 peak 2262 assign ( resid 65 and name HD++ ) ( resid 67 and name HG+ ) 4.10 4.10 0.00 peak 1957 assign ( resid 65 and name HD++ ) ( resid 83 and name HG+ ) 4.00 4.00 0.00 peak 2206 assign ( resid 65 and name HD++ ) ( resid 87 and name HA ) 3.95 3.95 0.00 peak 2378 assign ( resid 65 and name HD++ ) ( resid 87 and name HB+ ) 4.15 4.15 0.00 peak 2258 assign ( resid 65 and name HD++ ) ( resid 90 and name HD21 ) 3.91 3.91 0.00 peak 156 assign ( resid 65 and name HD++ ) ( resid 90 and name HD22 ) 4.39 4.39 0.00 peak 698 assign ( resid 65 and name HD++ ) ( resid 192 and name HE22 ) 5.44 5.44 0.00 peak 154 assign ( resid 68 and name HA ) ( resid 70 and name HB+ ) 5.34 5.34 0.00 peak 1118 assign ( resid 68 and name HA ) ( resid 72 and name HB+ ) 5.34 5.34 0.00 peak 1433 assign ( resid 68 and name HB2 ) ( resid 70 and name HB+ ) 4.59 4.59 0.00 peak 1526 assign ( resid 68 and name HB1 ) ( resid 70 and name HB+ ) 4.50 4.50 0.00 peak 1520 assign ( resid 69 and name HN ) ( resid 70 and name HB+ ) 4.93 4.93 0.00 peak 52 assign ( resid 69 and name HA ) ( resid 72 and name HB+ ) 3.94 3.94 0.00 peak 1485 assign ( resid 69 and name HB+ ) ( resid 72 and name HB+ ) 4.37 4.37 0.00 peak 992 assign ( resid 70 and name HN ) ( resid 70 and name HB+ ) 3.30 3.30 0.00 peak 467 assign ( resid 70 and name HB+ ) ( resid 71 and name HN ) 3.72 3.72 0.00 peak 464 assign ( resid 71 and name HA ) ( resid 75 and name HD++ ) 4.25 4.25 0.00 peak 764 assign ( resid 71 and name HD+ ) ( resid 72 and name HB+ ) 4.25 4.25 0.00 peak 1584 assign ( resid 71 and name HD+ ) ( resid 75 and name HD++ ) 3.63 3.63 0.00 peak 2254 assign ( resid 72 and name HN ) ( resid 75 and name HD++ ) 4.18 4.18 0.00 peak 386 assign ( resid 72 and name HA ) ( resid 75 and name HD++ ) 4.17 4.17 0.00 peak 2368 assign ( resid 74 and name HG+ ) ( resid 76 and name HG+ ) 4.37 4.37 0.00 peak 2172 assign ( resid 74 and name HE+ ) ( resid 76 and name HG+ ) 4.50 4.50 0.00 peak 1668 assign ( resid 75 and name HN ) ( resid 75 and name HD++ ) 3.62 3.62 0.00 peak 2468 assign ( resid 75 and name HN ) ( resid 76 and name HG+ ) 5.34 5.34 0.00 peak 404 assign ( resid 75 and name HA ) ( resid 75 and name HD++ ) 3.76 3.76 0.00 peak 2391 assign ( resid 75 and name HB2 ) ( resid 79 and name HB+ ) 5.34 5.34 0.00 peak 2203 assign ( resid 75 and name HD++ ) ( resid 76 and name HN ) 4.23 4.23 0.00 peak 2522 assign ( resid 75 and name HD++ ) ( resid 79 and name HN ) 4.44 4.44 0.00 peak 456 assign ( resid 75 and name HD++ ) ( resid 79 and name HA ) 4.05 4.05 0.00 peak 2270 assign ( resid 75 and name HD++ ) ( resid 79 and name HB+ ) 2.98 2.98 0.00 peak 2188 assign ( resid 75 and name HD++ ) ( resid 80 and name HN ) 3.29 3.29 0.00 peak 585 assign ( resid 75 and name HD++ ) ( resid 80 and name HA ) 3.62 3.62 0.00 peak 2359 assign ( resid 75 and name HD++ ) ( resid 83 and name HN ) 4.87 4.87 0.00 peak 2543 assign ( resid 75 and name HD++ ) ( resid 83 and name HG+ ) 4.81 4.81 0.00 peak 1911 assign ( resid 76 and name HN ) ( resid 76 and name HG+ ) 3.32 3.32 0.00 peak 411 assign ( resid 76 and name HB2 ) ( resid 79 and name HB+ ) 3.91 3.91 0.00 peak 1627 assign ( resid 76 and name HG+ ) ( resid 79 and name HB+ ) 5.07 5.07 0.00 peak 1604 assign ( resid 76 and name HG+ ) ( resid 80 and name HD1+ ) 5.34 5.34 0.00 peak 2168 assign ( resid 77 and name HG2 ) ( resid 81 and name HD++ ) 4.22 4.22 0.00 peak 1966 assign ( resid 77 and name HE+ ) ( resid 81 and name HD++ ) 3.91 3.91 0.00 peak 1881 assign ( resid 78 and name HN ) ( resid 81 and name HD++ ) 4.77 4.77 0.00 peak 108 assign ( resid 78 and name HB+ ) ( resid 79 and name HB+ ) 5.17 5.17 0.00 peak 2205 assign ( resid 79 and name HN ) ( resid 81 and name HD++ ) 5.44 5.44 0.00 peak 670 assign ( resid 79 and name HB+ ) ( resid 80 and name HN ) 3.68 3.68 0.00 peak 579 assign ( resid 79 and name HB+ ) ( resid 80 and name HG1+ ) 4.89 4.89 0.00 peak 1870 assign ( resid 79 and name HB+ ) ( resid 80 and name HD1+ ) 3.95 3.95 0.00 peak 2206 assign ( resid 80 and name HA ) ( resid 81 and name HD++ ) 5.26 5.26 0.00 peak 792 assign ( resid 80 and name HB ) ( resid 81 and name HD++ ) 3.61 3.61 0.00 peak 2089 assign ( resid 80 and name HG2+ ) ( resid 81 and name HD++ ) 3.45 3.45 0.00 peak 1964 assign ( resid 81 and name HN ) ( resid 81 and name HD++ ) 3.83 3.83 0.00 peak 2439 assign ( resid 81 and name HA ) ( resid 81 and name HD++ ) 3.40 3.40 0.00 peak 790 assign ( resid 81 and name HD++ ) ( resid 83 and name HN ) 5.44 5.44 0.00 peak 2539 assign ( resid 81 and name HD++ ) ( resid 150 and name HA ) 3.26 3.26 0.00 peak 2351 assign ( resid 81 and name HD++ ) ( resid 150 and name HG2+ ) 2.68 2.68 0.00 peak 1952 assign ( resid 81 and name HD++ ) ( resid 151 and name HN ) 4.90 4.90 0.00 peak 125 assign ( resid 81 and name HD++ ) ( resid 151 and name HA ) 4.25 4.25 0.00 peak 741 assign ( resid 81 and name HD++ ) ( resid 152 and name HN ) 5.44 5.44 0.00 peak 158 assign ( resid 81 and name HD++ ) ( resid 153 and name HN ) 3.67 3.67 0.00 peak 2431 assign ( resid 81 and name HD++ ) ( resid 154 and name HN ) 3.41 3.41 0.00 peak 556 assign ( resid 81 and name HD++ ) ( resid 154 and name HB2 ) 3.06 3.06 0.00 peak 2114 assign ( resid 81 and name HD++ ) ( resid 154 and name HG ) 2.63 2.63 0.00 peak 2099 assign ( resid 81 and name HD++ ) ( resid 155 and name HN ) 4.86 4.86 0.00 peak 2481 assign ( resid 83 and name HN ) ( resid 83 and name HG+ ) 4.29 4.29 0.00 peak 60 assign ( resid 83 and name HA ) ( resid 87 and name HB+ ) 5.10 5.10 0.00 peak 1067 assign ( resid 84 and name HN ) ( resid 87 and name HB+ ) 4.77 4.77 0.00 peak 356 assign ( resid 84 and name HA ) ( resid 87 and name HB+ ) 3.76 3.76 0.00 peak 1018 assign ( resid 84 and name HG2+ ) ( resid 87 and name HB+ ) 5.13 5.13 0.00 peak 2256 assign ( resid 85 and name HN ) ( resid 157 and name HD++ ) 3.72 3.72 0.00 peak 146 assign ( resid 85 and name HA ) ( resid 157 and name HD++ ) 4.07 4.07 0.00 peak 772 assign ( resid 85 and name HB ) ( resid 157 and name HD++ ) 4.56 4.56 0.00 peak 1908 assign ( resid 85 and name HG2+ ) ( resid 157 and name HD++ ) 2.99 2.99 0.00 peak 1952 assign ( resid 86 and name HN ) ( resid 87 and name HB+ ) 5.34 5.34 0.00 peak 367 assign ( resid 87 and name HN ) ( resid 87 and name HB+ ) 3.63 3.63 0.00 peak 359 assign ( resid 87 and name HB+ ) ( resid 90 and name HD22 ) 5.34 5.34 0.00 peak 1193 assign ( resid 88 and name HN ) ( resid 88 and name HD++ ) 4.27 4.27 0.00 peak 2554 assign ( resid 88 and name HD++ ) ( resid 89 and name HN ) 3.70 3.70 0.00 peak 2542 assign ( resid 88 and name HD++ ) ( resid 89 and name HD+ ) 3.43 3.43 0.00 peak 2257 assign ( resid 88 and name HD++ ) ( resid 91 and name HN ) 5.30 5.30 0.00 peak 130 assign ( resid 88 and name HD++ ) ( resid 92 and name HN ) 5.00 5.00 0.00 peak 2503 assign ( resid 88 and name HD++ ) ( resid 92 and name HB2 ) 3.53 3.53 0.00 peak 1896 assign ( resid 88 and name HD++ ) ( resid 92 and name HG2 ) 4.24 4.24 0.00 peak 1899 assign ( resid 88 and name HD++ ) ( resid 92 and name HG1 ) 3.50 3.50 0.00 peak 2178 assign ( resid 88 and name HD++ ) ( resid 92 and name HE21 ) 4.64 4.64 0.00 peak 2405 assign ( resid 88 and name HD++ ) ( resid 92 and name HE22 ) 5.01 5.01 0.00 peak 126 assign ( resid 92 and name HE22 ) ( resid 165 and name HD++ ) 5.44 5.44 0.00 peak 154 assign ( resid 94 and name HN ) ( resid 95 and name HG+ ) 4.39 4.39 0.00 peak 489 assign ( resid 94 and name HB+ ) ( resid 95 and name HG+ ) 4.00 4.00 0.00 peak 2122 assign ( resid 95 and name HN ) ( resid 95 and name HG+ ) 3.38 3.38 0.00 peak 494 assign ( resid 95 and name HA ) ( resid 95 and name HG+ ) 3.45 3.45 0.00 peak 926 assign ( resid 95 and name HB+ ) ( resid 95 and name HG+ ) 2.43 2.43 0.00 peak 1732 assign ( resid 95 and name HG+ ) ( resid 95 and name HE21 ) 3.08 3.08 0.00 peak 1390 assign ( resid 137 and name HN ) ( resid 137 and name HB+ ) 3.46 3.46 0.00 peak 471 assign ( resid 137 and name HB+ ) ( resid 138 and name HN ) 3.91 3.91 0.00 peak 476 assign ( resid 139 and name HN ) ( resid 139 and name HB+ ) 3.10 3.10 0.00 peak 194 assign ( resid 139 and name HB+ ) ( resid 139 and name HG2 ) 2.57 2.57 0.00 peak 2138 assign ( resid 139 and name HB+ ) ( resid 139 and name HE+ ) 4.00 4.00 0.00 peak 1598 assign ( resid 139 and name HB+ ) ( resid 140 and name HD2 ) 3.58 3.58 0.00 peak 1554 assign ( resid 139 and name HB+ ) ( resid 141 and name HN ) 3.72 3.72 0.00 peak 1347 assign ( resid 139 and name HB+ ) ( resid 142 and name HN ) 4.18 4.18 0.00 peak 1323 assign ( resid 139 and name HB+ ) ( resid 142 and name HB2 ) 3.57 3.57 0.00 peak 1743 assign ( resid 139 and name HB+ ) ( resid 142 and name HG1 ) 3.40 3.40 0.00 peak 1650 assign ( resid 139 and name HE+ ) ( resid 140 and name HG+ ) 5.25 5.25 0.00 peak 1710 assign ( resid 140 and name HB+ ) ( resid 141 and name HN ) 4.10 4.10 0.00 peak 330 assign ( resid 140 and name HG+ ) ( resid 141 and name HN ) 3.65 3.65 0.00 peak 177 assign ( resid 141 and name HA ) ( resid 144 and name HG+ ) 4.38 4.38 0.00 peak 2310 assign ( resid 144 and name HN ) ( resid 144 and name HG+ ) 4.18 4.18 0.00 peak 2446 assign ( resid 144 and name HA ) ( resid 144 and name HG+ ) 3.38 3.38 0.00 peak 2299 assign ( resid 144 and name HG+ ) ( resid 144 and name HE+ ) 3.46 3.46 0.00 peak 2265 assign ( resid 144 and name HG+ ) ( resid 145 and name HN ) 4.70 4.70 0.00 peak 2426 assign ( resid 146 and name HB+ ) ( resid 146 and name HG2 ) 2.55 2.55 0.00 peak 2159 assign ( resid 146 and name HB+ ) ( resid 146 and name HD+ ) 3.04 3.04 0.00 peak 814 assign ( resid 151 and name HB2 ) ( resid 152 and name HB+ ) 4.89 4.89 0.00 peak 1712 assign ( resid 152 and name HB+ ) ( resid 153 and name HN ) 3.36 3.36 0.00 peak 352 assign ( resid 152 and name HB+ ) ( resid 156 and name HN ) 5.21 5.21 0.00 peak 338 assign ( resid 154 and name HG ) ( resid 181 and name HD++ ) 3.42 3.42 0.00 peak 1923 assign ( resid 154 and name HD1+ ) ( resid 181 and name HD++ ) 3.17 3.17 0.00 peak 1964 assign ( resid 154 and name HD2+ ) ( resid 181 and name HD++ ) 2.99 2.99 0.00 peak 1963 assign ( resid 156 and name HB+ ) ( resid 160 and name HD++ ) 4.20 4.20 0.00 peak 1912 assign ( resid 157 and name HD++ ) ( resid 158 and name HN ) 3.52 3.52 0.00 peak 128 assign ( resid 157 and name HD++ ) ( resid 159 and name HN ) 4.57 4.57 0.00 peak 133 assign ( resid 157 and name HD++ ) ( resid 161 and name HN ) 4.90 4.90 0.00 peak 114 assign ( resid 157 and name HD++ ) ( resid 184 and name HN ) 3.88 3.88 0.00 peak 385 assign ( resid 157 and name HD++ ) ( resid 184 and name HG2+ ) 2.45 2.45 0.00 peak 2065 assign ( resid 158 and name HN ) ( resid 161 and name HG1+ ) 4.97 4.97 0.00 peak 257 assign ( resid 159 and name HN ) ( resid 160 and name HD++ ) 4.60 4.60 0.00 peak 2512 assign ( resid 159 and name HN ) ( resid 161 and name HG1+ ) 5.26 5.26 0.00 peak 256 assign ( resid 159 and name HB ) ( resid 160 and name HD++ ) 3.42 3.42 0.00 peak 2287 assign ( resid 159 and name HG2+ ) ( resid 160 and name HD++ ) 3.07 3.07 0.00 peak 1951 assign ( resid 160 and name HN ) ( resid 160 and name HD++ ) 3.42 3.42 0.00 peak 2459 assign ( resid 160 and name HN ) ( resid 161 and name HG1+ ) 4.39 4.39 0.00 peak 2460 assign ( resid 160 and name HA ) ( resid 160 and name HD++ ) 3.03 3.03 0.00 peak 2301 assign ( resid 160 and name HD++ ) ( resid 161 and name HN ) 5.10 5.10 0.00 peak 114 assign ( resid 160 and name HD++ ) ( resid 163 and name HB2 ) 4.20 4.20 0.00 peak 2219 assign ( resid 161 and name HN ) ( resid 161 and name HG1+ ) 3.43 3.43 0.00 peak 272 assign ( resid 161 and name HA ) ( resid 161 and name HG1+ ) 3.54 3.54 0.00 peak 2312 assign ( resid 161 and name HG2+ ) ( resid 162 and name HD++ ) 3.55 3.55 0.00 peak 1939 assign ( resid 161 and name HG2+ ) ( resid 183 and name HG+ ) 3.73 3.73 0.00 peak 2226 assign ( resid 161 and name HG1+ ) ( resid 162 and name HN ) 4.44 4.44 0.00 peak 261 assign ( resid 161 and name HG1+ ) ( resid 184 and name HG2+ ) 2.97 2.97 0.00 peak 2029 assign ( resid 161 and name HG1+ ) ( resid 187 and name HB+ ) 4.79 4.79 0.00 peak 2244 assign ( resid 162 and name HN ) ( resid 162 and name HB+ ) 3.23 3.23 0.00 peak 251 assign ( resid 162 and name HN ) ( resid 162 and name HD++ ) 3.71 3.71 0.00 peak 2471 assign ( resid 162 and name HA ) ( resid 162 and name HD++ ) 2.87 2.87 0.00 peak 2318 assign ( resid 162 and name HB+ ) ( resid 162 and name HD++ ) 2.50 2.50 0.00 peak 1918 assign ( resid 162 and name HB+ ) ( resid 163 and name HN ) 3.24 3.24 0.00 peak 191 assign ( resid 162 and name HD++ ) ( resid 165 and name HN ) 5.28 5.28 0.00 peak 2498 assign ( resid 162 and name HD++ ) ( resid 166 and name HN ) 3.66 3.66 0.00 peak 318 assign ( resid 162 and name HD++ ) ( resid 166 and name HA ) 3.41 3.41 0.00 peak 2304 assign ( resid 162 and name HD++ ) ( resid 167 and name HN ) 3.75 3.75 0.00 peak 2433 assign ( resid 162 and name HD++ ) ( resid 167 and name HB+ ) 3.53 3.53 0.00 peak 2109 assign ( resid 162 and name HD++ ) ( resid 167 and name HD+ ) 3.73 3.73 0.00 peak 2113 assign ( resid 162 and name HD++ ) ( resid 167 and name HE+ ) 4.46 4.46 0.00 peak 1882 assign ( resid 162 and name HD++ ) ( resid 168 and name HN ) 4.56 4.56 0.00 peak 353 assign ( resid 162 and name HD++ ) ( resid 171 and name HD+ ) 3.93 3.93 0.00 peak 2258 assign ( resid 162 and name HD++ ) ( resid 172 and name HN ) 3.98 3.98 0.00 peak 2452 assign ( resid 162 and name HD++ ) ( resid 172 and name HA ) 4.64 4.64 0.00 peak 2367 assign ( resid 162 and name HD++ ) ( resid 172 and name HB+ ) 3.33 3.33 0.00 peak 2186 assign ( resid 162 and name HD++ ) ( resid 175 and name HD++ ) 2.65 2.65 0.00 peak 1974 assign ( resid 164 and name HN ) ( resid 165 and name HD++ ) 3.74 3.74 0.00 peak 290 assign ( resid 164 and name HB+ ) ( resid 165 and name HD++ ) 3.01 3.01 0.00 peak 2058 assign ( resid 165 and name HN ) ( resid 165 and name HD++ ) 3.32 3.32 0.00 peak 312 assign ( resid 165 and name HA ) ( resid 165 and name HD++ ) 3.33 3.33 0.00 peak 2286 assign ( resid 165 and name HB+ ) ( resid 165 and name HD++ ) 2.59 2.59 0.00 peak 2108 assign ( resid 165 and name HD++ ) ( resid 166 and name HE+ ) 5.03 5.03 0.00 peak 2262 assign ( resid 165 and name HD++ ) ( resid 167 and name HG+ ) 4.10 4.10 0.00 peak 1957 assign ( resid 165 and name HD++ ) ( resid 183 and name HG+ ) 4.00 4.00 0.00 peak 2206 assign ( resid 165 and name HD++ ) ( resid 187 and name HA ) 3.95 3.95 0.00 peak 2378 assign ( resid 165 and name HD++ ) ( resid 187 and name HB+ ) 4.15 4.15 0.00 peak 2258 assign ( resid 165 and name HD++ ) ( resid 190 and name HD21 ) 3.91 3.91 0.00 peak 156 assign ( resid 165 and name HD++ ) ( resid 190 and name HD22 ) 4.39 4.39 0.00 peak 698 assign ( resid 168 and name HA ) ( resid 170 and name HB+ ) 5.34 5.34 0.00 peak 1118 assign ( resid 168 and name HA ) ( resid 172 and name HB+ ) 5.34 5.34 0.00 peak 1433 assign ( resid 168 and name HB2 ) ( resid 170 and name HB+ ) 4.59 4.59 0.00 peak 1526 assign ( resid 168 and name HB1 ) ( resid 170 and name HB+ ) 4.50 4.50 0.00 peak 1520 assign ( resid 169 and name HN ) ( resid 170 and name HB+ ) 4.93 4.93 0.00 peak 52 assign ( resid 169 and name HA ) ( resid 172 and name HB+ ) 3.94 3.94 0.00 peak 1485 assign ( resid 169 and name HB+ ) ( resid 172 and name HB+ ) 4.37 4.37 0.00 peak 992 assign ( resid 170 and name HN ) ( resid 170 and name HB+ ) 3.30 3.30 0.00 peak 467 assign ( resid 170 and name HB+ ) ( resid 171 and name HN ) 3.72 3.72 0.00 peak 464 assign ( resid 171 and name HA ) ( resid 175 and name HD++ ) 4.25 4.25 0.00 peak 764 assign ( resid 171 and name HD+ ) ( resid 172 and name HB+ ) 4.25 4.25 0.00 peak 1584 assign ( resid 171 and name HD+ ) ( resid 175 and name HD++ ) 3.63 3.63 0.00 peak 2254 assign ( resid 172 and name HN ) ( resid 175 and name HD++ ) 4.18 4.18 0.00 peak 386 assign ( resid 172 and name HA ) ( resid 175 and name HD++ ) 4.17 4.17 0.00 peak 2368 assign ( resid 174 and name HG+ ) ( resid 176 and name HG+ ) 4.37 4.37 0.00 peak 2172 assign ( resid 174 and name HE+ ) ( resid 176 and name HG+ ) 4.50 4.50 0.00 peak 1668 assign ( resid 175 and name HN ) ( resid 175 and name HD++ ) 3.62 3.62 0.00 peak 2468 assign ( resid 175 and name HN ) ( resid 176 and name HG+ ) 5.34 5.34 0.00 peak 404 assign ( resid 175 and name HA ) ( resid 175 and name HD++ ) 3.76 3.76 0.00 peak 2391 assign ( resid 175 and name HB2 ) ( resid 179 and name HB+ ) 5.34 5.34 0.00 peak 2203 assign ( resid 175 and name HD++ ) ( resid 176 and name HN ) 4.23 4.23 0.00 peak 2522 assign ( resid 175 and name HD++ ) ( resid 179 and name HN ) 4.44 4.44 0.00 peak 456 assign ( resid 175 and name HD++ ) ( resid 179 and name HA ) 4.05 4.05 0.00 peak 2270 assign ( resid 175 and name HD++ ) ( resid 179 and name HB+ ) 2.98 2.98 0.00 peak 2188 assign ( resid 175 and name HD++ ) ( resid 180 and name HN ) 3.29 3.29 0.00 peak 585 assign ( resid 175 and name HD++ ) ( resid 180 and name HA ) 3.62 3.62 0.00 peak 2359 assign ( resid 175 and name HD++ ) ( resid 183 and name HN ) 4.87 4.87 0.00 peak 2543 assign ( resid 175 and name HD++ ) ( resid 183 and name HG+ ) 4.81 4.81 0.00 peak 1911 assign ( resid 176 and name HN ) ( resid 176 and name HG+ ) 3.32 3.32 0.00 peak 411 assign ( resid 176 and name HB2 ) ( resid 179 and name HB+ ) 3.91 3.91 0.00 peak 1627 assign ( resid 176 and name HG+ ) ( resid 179 and name HB+ ) 5.07 5.07 0.00 peak 1604 assign ( resid 176 and name HG+ ) ( resid 180 and name HD1+ ) 5.34 5.34 0.00 peak 2168 assign ( resid 177 and name HG2 ) ( resid 181 and name HD++ ) 4.22 4.22 0.00 peak 1966 assign ( resid 177 and name HE+ ) ( resid 181 and name HD++ ) 3.91 3.91 0.00 peak 1881 assign ( resid 178 and name HN ) ( resid 181 and name HD++ ) 4.77 4.77 0.00 peak 108 assign ( resid 178 and name HB+ ) ( resid 179 and name HB+ ) 5.17 5.17 0.00 peak 2205 assign ( resid 179 and name HN ) ( resid 181 and name HD++ ) 5.44 5.44 0.00 peak 670 assign ( resid 179 and name HB+ ) ( resid 180 and name HN ) 3.68 3.68 0.00 peak 579 assign ( resid 179 and name HB+ ) ( resid 180 and name HG1+ ) 4.89 4.89 0.00 peak 1870 assign ( resid 179 and name HB+ ) ( resid 180 and name HD1+ ) 3.95 3.95 0.00 peak 2206 assign ( resid 180 and name HA ) ( resid 181 and name HD++ ) 5.26 5.26 0.00 peak 792 assign ( resid 180 and name HB ) ( resid 181 and name HD++ ) 3.61 3.61 0.00 peak 2089 assign ( resid 180 and name HG2+ ) ( resid 181 and name HD++ ) 3.45 3.45 0.00 peak 1964 assign ( resid 181 and name HN ) ( resid 181 and name HD++ ) 3.83 3.83 0.00 peak 2439 assign ( resid 181 and name HA ) ( resid 181 and name HD++ ) 3.40 3.40 0.00 peak 790 assign ( resid 181 and name HD++ ) ( resid 183 and name HN ) 5.44 5.44 0.00 peak 2539 assign ( resid 183 and name HN ) ( resid 183 and name HG+ ) 4.29 4.29 0.00 peak 60 assign ( resid 183 and name HA ) ( resid 187 and name HB+ ) 5.10 5.10 0.00 peak 1067 assign ( resid 184 and name HN ) ( resid 187 and name HB+ ) 4.77 4.77 0.00 peak 356 assign ( resid 184 and name HA ) ( resid 187 and name HB+ ) 3.76 3.76 0.00 peak 1018 assign ( resid 184 and name HG2+ ) ( resid 187 and name HB+ ) 5.13 5.13 0.00 peak 2256 assign ( resid 186 and name HN ) ( resid 187 and name HB+ ) 5.34 5.34 0.00 peak 367 assign ( resid 187 and name HN ) ( resid 187 and name HB+ ) 3.63 3.63 0.00 peak 359 assign ( resid 187 and name HB+ ) ( resid 190 and name HD22 ) 5.34 5.34 0.00 peak 1193 assign ( resid 188 and name HN ) ( resid 188 and name HD++ ) 4.27 4.27 0.00 peak 2554 assign ( resid 188 and name HD++ ) ( resid 189 and name HN ) 3.70 3.70 0.00 peak 2542 assign ( resid 188 and name HD++ ) ( resid 189 and name HD+ ) 3.43 3.43 0.00 peak 2257 assign ( resid 188 and name HD++ ) ( resid 191 and name HN ) 5.30 5.30 0.00 peak 130 assign ( resid 188 and name HD++ ) ( resid 192 and name HN ) 5.00 5.00 0.00 peak 2503 assign ( resid 188 and name HD++ ) ( resid 192 and name HB2 ) 3.53 3.53 0.00 peak 1896 assign ( resid 188 and name HD++ ) ( resid 192 and name HG2 ) 4.24 4.24 0.00 peak 1899 assign ( resid 188 and name HD++ ) ( resid 192 and name HG1 ) 3.50 3.50 0.00 peak 2178 assign ( resid 188 and name HD++ ) ( resid 192 and name HE21 ) 4.64 4.64 0.00 peak 2405 assign ( resid 188 and name HD++ ) ( resid 192 and name HE22 ) 5.01 5.01 0.00 peak 126 assign ( resid 194 and name HN ) ( resid 195 and name HG+ ) 4.39 4.39 0.00 peak 489 assign ( resid 194 and name HB+ ) ( resid 195 and name HG+ ) 4.00 4.00 0.00 peak 2122 assign ( resid 195 and name HN ) ( resid 195 and name HG+ ) 3.38 3.38 0.00 peak 494 assign ( resid 195 and name HA ) ( resid 195 and name HG+ ) 3.45 3.45 0.00 peak 926 assign ( resid 195 and name HB+ ) ( resid 195 and name HG+ ) 2.43 2.43 0.00 peak 1732 assign ( resid 195 and name HG+ ) ( resid 195 and name HE21 ) 3.08 3.08 0.00 peak 1390
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