NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
23052 |
2jt2   |
cing | 1-original | 2 | XPLOR/CNS | distance | hydrogen bond | simple |
! hydrogen bond constraints assign ( resid 2 and name O ) ( resid 121 and name N ) 3.00 1.20 0.00 assign ( resid 2 and name O ) ( resid 121 and name HN ) 2.00 0.20 0.00 assign ( resid 4 and name N ) ( resid 119 and name O ) 3.00 1.20 0.00 assign ( resid 4 and name O ) ( resid 117 and name N ) 3.00 1.20 0.00 assign ( resid 4 and name O ) ( resid 117 and name HN ) 2.00 0.20 0.00 assign ( resid 4 and name HN ) ( resid 119 and name O ) 2.00 0.20 0.00 assign ( resid 5 and name O ) ( resid 85 and name N ) 3.00 1.20 0.00 assign ( resid 5 and name O ) ( resid 85 and name HN ) 2.00 0.20 0.00 assign ( resid 6 and name N ) ( resid 115 and name O ) 3.00 1.20 0.00 assign ( resid 6 and name O ) ( resid 115 and name N ) 3.00 1.20 0.00 assign ( resid 6 and name O ) ( resid 115 and name HN ) 2.00 0.20 0.00 assign ( resid 6 and name HN ) ( resid 115 and name O ) 2.00 0.20 0.00 assign ( resid 8 and name N ) ( resid 113 and name O ) 3.00 1.20 0.00 assign ( resid 8 and name HN ) ( resid 113 and name O ) 2.00 0.20 0.00 assign ( resid 11 and name N ) ( resid 28 and name O ) 3.00 1.20 0.00 assign ( resid 11 and name O ) ( resid 28 and name N ) 3.00 1.20 0.00 assign ( resid 11 and name O ) ( resid 28 and name HN ) 2.00 0.20 0.00 assign ( resid 11 and name HN ) ( resid 28 and name O ) 2.00 0.20 0.00 assign ( resid 13 and name N ) ( resid 26 and name O ) 3.00 1.20 0.00 assign ( resid 13 and name O ) ( resid 26 and name N ) 3.00 1.20 0.00 assign ( resid 13 and name O ) ( resid 26 and name HN ) 2.00 0.20 0.00 assign ( resid 13 and name HN ) ( resid 26 and name O ) 2.00 0.20 0.00 assign ( resid 15 and name N ) ( resid 24 and name O ) 3.00 1.20 0.00 assign ( resid 15 and name O ) ( resid 24 and name N ) 3.00 1.20 0.00 assign ( resid 15 and name O ) ( resid 24 and name HN ) 2.00 0.20 0.00 assign ( resid 15 and name HN ) ( resid 24 and name O ) 2.00 0.20 0.00 assign ( resid 16 and name O ) ( resid 98 and name N ) 3.00 1.20 0.00 assign ( resid 16 and name O ) ( resid 98 and name HN ) 2.00 0.20 0.00 assign ( resid 17 and name O ) ( resid 21 and name N ) 3.00 1.20 0.00 assign ( resid 17 and name O ) ( resid 21 and name HN ) 2.00 0.20 0.00 assign ( resid 18 and name O ) ( resid 197 and name N ) 3.00 1.20 0.00 assign ( resid 18 and name O ) ( resid 197 and name HN ) 2.00 0.20 0.00 assign ( resid 19 and name O ) ( resid 196 and name N ) 3.00 1.20 0.00 assign ( resid 19 and name O ) ( resid 196 and name HN ) 2.00 0.20 0.00 assign ( resid 19 and name HE2 ) ( resid 58 and name O ) 2.00 0.20 0.00 assign ( resid 19 and name ND1 ) ( resid 195 and name N ) 3.00 1.20 0.00 assign ( resid 19 and name ND1 ) ( resid 195 and name HN ) 2.00 0.20 0.00 assign ( resid 19 and name NE2 ) ( resid 58 and name O ) 3.00 1.20 0.00 assign ( resid 25 and name N ) ( resid 92 and name O ) 3.00 1.20 0.00 assign ( resid 25 and name O ) ( resid 92 and name N ) 3.00 1.20 0.00 assign ( resid 25 and name O ) ( resid 92 and name HN ) 2.00 0.20 0.00 assign ( resid 25 and name HN ) ( resid 92 and name O ) 2.00 0.20 0.00 assign ( resid 27 and name N ) ( resid 90 and name O ) 3.00 1.20 0.00 assign ( resid 27 and name O ) ( resid 90 and name N ) 3.00 1.20 0.00 assign ( resid 27 and name O ) ( resid 90 and name HN ) 2.00 0.20 0.00 assign ( resid 27 and name HN ) ( resid 90 and name O ) 2.00 0.20 0.00 assign ( resid 29 and name N ) ( resid 88 and name O ) 3.00 1.20 0.00 assign ( resid 29 and name O ) ( resid 88 and name N ) 3.00 1.20 0.00 assign ( resid 29 and name O ) ( resid 88 and name HN ) 2.00 0.20 0.00 assign ( resid 29 and name HN ) ( resid 88 and name O ) 2.00 0.20 0.00 assign ( resid 32 and name O ) ( resid 35 and name N ) 3.00 1.20 0.00 assign ( resid 32 and name O ) ( resid 35 and name HN ) 2.00 0.20 0.00 assign ( resid 36 and name O ) ( resid 87 and name N ) 3.00 1.20 0.00 assign ( resid 36 and name O ) ( resid 87 and name HN ) 2.00 0.20 0.00 assign ( resid 37 and name O ) ( resid 48 and name N ) 3.00 1.20 0.00 assign ( resid 37 and name O ) ( resid 48 and name HN ) 2.00 0.20 0.00 assign ( resid 38 and name N ) ( resid 87 and name O ) 3.00 1.20 0.00 assign ( resid 38 and name O ) ( resid 89 and name N ) 3.00 1.20 0.00 assign ( resid 38 and name O ) ( resid 89 and name HN ) 2.00 0.20 0.00 assign ( resid 38 and name HN ) ( resid 87 and name O ) 2.00 0.20 0.00 assign ( resid 39 and name N ) ( resid 46 and name O ) 3.00 1.20 0.00 assign ( resid 39 and name O ) ( resid 46 and name N ) 3.00 1.20 0.00 assign ( resid 39 and name O ) ( resid 46 and name HN ) 2.00 0.20 0.00 assign ( resid 39 and name HN ) ( resid 46 and name O ) 2.00 0.20 0.00 assign ( resid 40 and name N ) ( resid 89 and name O ) 3.00 1.20 0.00 assign ( resid 40 and name O ) ( resid 91 and name N ) 3.00 1.20 0.00 assign ( resid 40 and name O ) ( resid 91 and name HN ) 2.00 0.20 0.00 assign ( resid 40 and name HN ) ( resid 89 and name O ) 2.00 0.20 0.00 assign ( resid 41 and name N ) ( resid 44 and name O ) 3.00 1.20 0.00 assign ( resid 41 and name O ) ( resid 44 and name N ) 3.00 1.20 0.00 assign ( resid 41 and name O ) ( resid 44 and name HN ) 2.00 0.20 0.00 assign ( resid 41 and name HN ) ( resid 44 and name O ) 2.00 0.20 0.00 assign ( resid 50 and name HD1 ) ( resid 237 and name O ) 2.00 0.20 0.00 assign ( resid 50 and name ND1 ) ( resid 237 and name O ) 3.00 1.20 0.00 assign ( resid 52 and name O ) ( resid 63 and name N ) 3.00 1.20 0.00 assign ( resid 52 and name O ) ( resid 63 and name HN ) 2.00 0.20 0.00 assign ( resid 54 and name N ) ( resid 61 and name O ) 3.00 1.20 0.00 assign ( resid 54 and name HN ) ( resid 61 and name O ) 2.00 0.20 0.00 assign ( resid 55 and name O ) ( resid 61 and name N ) 3.00 1.20 0.00 assign ( resid 55 and name O ) ( resid 61 and name HN ) 2.00 0.20 0.00 assign ( resid 60 and name N ) ( resid 73 and name OE1 ) 3.00 1.20 0.00 assign ( resid 60 and name O ) ( resid 72 and name N ) 3.00 1.20 0.00 assign ( resid 60 and name O ) ( resid 72 and name HN ) 2.00 0.20 0.00 assign ( resid 60 and name HN ) ( resid 73 and name OE1 ) 2.00 0.20 0.00 assign ( resid 61 and name OD2 ) ( resid 70 and name NZ ) 3.00 1.20 0.00 assign ( resid 62 and name N ) ( resid 69 and name O ) 3.00 1.20 0.00 assign ( resid 62 and name O ) ( resid 69 and name N ) 3.00 1.20 0.00 assign ( resid 62 and name O ) ( resid 69 and name HN ) 2.00 0.20 0.00 assign ( resid 62 and name HN ) ( resid 69 and name O ) 2.00 0.20 0.00 assign ( resid 64 and name N ) ( resid 67 and name O ) 3.00 1.20 0.00 assign ( resid 64 and name O ) ( resid 67 and name N ) 3.00 1.20 0.00 assign ( resid 64 and name O ) ( resid 67 and name HN ) 2.00 0.20 0.00 assign ( resid 64 and name HN ) ( resid 67 and name O ) 2.00 0.20 0.00 assign ( resid 70 and name N ) ( resid 94 and name O ) 3.00 1.20 0.00 assign ( resid 70 and name O ) ( resid 96 and name N ) 3.00 1.20 0.00 assign ( resid 70 and name O ) ( resid 96 and name HN ) 2.00 0.20 0.00 assign ( resid 70 and name HN ) ( resid 94 and name O ) 2.00 0.20 0.00 assign ( resid 72 and name O ) ( resid 76 and name N ) 3.00 1.20 0.00 assign ( resid 72 and name O ) ( resid 76 and name HN ) 2.00 0.20 0.00 assign ( resid 73 and name N ) ( resid 73 and name OE1 ) 3.00 1.20 0.00 assign ( resid 73 and name O ) ( resid 77 and name N ) 3.00 1.20 0.00 assign ( resid 73 and name O ) ( resid 77 and name HN ) 2.00 0.20 0.00 assign ( resid 73 and name HN ) ( resid 73 and name OE1 ) 2.00 0.20 0.00 assign ( resid 74 and name O ) ( resid 78 and name N ) 3.00 1.20 0.00 assign ( resid 74 and name O ) ( resid 78 and name HN ) 2.00 0.20 0.00 assign ( resid 75 and name O ) ( resid 79 and name N ) 3.00 1.20 0.00 assign ( resid 75 and name O ) ( resid 79 and name HN ) 2.00 0.20 0.00 assign ( resid 76 and name O ) ( resid 80 and name N ) 3.00 1.20 0.00 assign ( resid 76 and name O ) ( resid 80 and name HN ) 2.00 0.20 0.00 assign ( resid 77 and name O ) ( resid 81 and name N ) 3.00 1.20 0.00 assign ( resid 77 and name O ) ( resid 81 and name HN ) 2.00 0.20 0.00 assign ( resid 78 and name O ) ( resid 82 and name N ) 3.00 1.20 0.00 assign ( resid 78 and name O ) ( resid 82 and name HN ) 2.00 0.20 0.00 assign ( resid 80 and name NE2) ( resid 242 and name N ) 3.00 1.20 0.00 assign ( resid 80 and name NE2) ( resid 242 and name HN ) 2.00 0.20 0.00 assign ( resid 80 and name HD1 ) ( resid 232 and name O ) 2.00 0.20 0.00 assign ( resid 80 and name ND1 ) ( resid 232 and name O ) 3.00 1.20 0.00 assign ( resid 80 and name NE2 ) ( resid 242 and name N ) 3.00 1.20 0.00 assign ( resid 80 and name NE2 ) ( resid 242 and name HN ) 2.00 0.20 0.00 assign ( resid 84 and name O ) ( resid 236 and name HH ) 2.00 0.20 0.00 assign ( resid 84 and name O ) ( resid 236 and name OH ) 3.00 1.20 0.00 assign ( resid 95 and name OE1 ) ( resid 20 and name N ) 3.00 1.20 0.00 assign ( resid 95 and name OE2 ) ( resid 19 and name N ) 3.00 1.20 0.00 assign ( resid 103 and name N ) ( resid 175 and name O ) 3.00 1.20 0.00 assign ( resid 103 and name O ) ( resid 107 and name N ) 3.00 1.20 0.00 assign ( resid 103 and name O ) ( resid 107 and name HN ) 2.00 0.20 0.00 assign ( resid 103 and name HN ) ( resid 175 and name O ) 2.00 0.20 0.00 assign ( resid 104 and name O ) ( resid 108 and name N ) 3.00 1.20 0.00 assign ( resid 104 and name O ) ( resid 108 and name HN ) 2.00 0.20 0.00 assign ( resid 105 and name O ) ( resid 109 and name N ) 3.00 1.20 0.00 assign ( resid 105 and name O ) ( resid 109 and name HN ) 2.00 0.20 0.00 assign ( resid 106 and name O ) ( resid 110 and name N ) 3.00 1.20 0.00 assign ( resid 106 and name O ) ( resid 110 and name HN ) 2.00 0.20 0.00 assign ( resid 107 and name O ) ( resid 111 and name N ) 3.00 1.20 0.00 assign ( resid 107 and name O ) ( resid 111 and name HN ) 2.00 0.20 0.00 assign ( resid 108 and name O ) ( resid 112 and name N ) 3.00 1.20 0.00 assign ( resid 108 and name O ) ( resid 112 and name HN ) 2.00 0.20 0.00 assign ( resid 124 and name N ) ( resid 241 and name O ) 3.00 1.20 0.00 assign ( resid 124 and name O ) ( resid 243 and name N ) 3.00 1.20 0.00 assign ( resid 124 and name O ) ( resid 243 and name HN ) 2.00 0.20 0.00 assign ( resid 124 and name HN ) ( resid 241 and name O ) 2.00 0.20 0.00 assign ( resid 126 and name N ) ( resid 243 and name O ) 3.00 1.20 0.00 assign ( resid 126 and name HN ) ( resid 243 and name O ) 2.00 0.20 0.00 assign ( resid 130 and name N ) ( resid 141 and name O ) 3.00 1.20 0.00 assign ( resid 130 and name O ) ( resid 141 and name N ) 3.00 1.20 0.00 assign ( resid 130 and name O ) ( resid 141 and name HN ) 2.00 0.20 0.00 assign ( resid 130 and name HN ) ( resid 141 and name O ) 2.00 0.20 0.00 assign ( resid 132 and name N ) ( resid 139 and name O ) 3.00 1.20 0.00 assign ( resid 132 and name O ) ( resid 139 and name N ) 3.00 1.20 0.00 assign ( resid 132 and name O ) ( resid 139 and name HN ) 2.00 0.20 0.00 assign ( resid 132 and name HN ) ( resid 139 and name O ) 2.00 0.20 0.00 assign ( resid 134 and name N ) ( resid 137 and name O ) 3.00 1.20 0.00 assign ( resid 134 and name O ) ( resid 137 and name N ) 3.00 1.20 0.00 assign ( resid 134 and name O ) ( resid 137 and name HN ) 2.00 0.20 0.00 assign ( resid 134 and name HN ) ( resid 137 and name O ) 2.00 0.20 0.00 assign ( resid 138 and name N ) ( resid 249 and name O ) 3.00 1.20 0.00 assign ( resid 138 and name O ) ( resid 249 and name N ) 3.00 1.20 0.00 assign ( resid 138 and name O ) ( resid 249 and name HN ) 2.00 0.20 0.00 assign ( resid 138 and name HN ) ( resid 249 and name O ) 2.00 0.20 0.00 assign ( resid 140 and name N ) ( resid 247 and name O ) 3.00 1.20 0.00 assign ( resid 140 and name O ) ( resid 247 and name N ) 3.00 1.20 0.00 assign ( resid 140 and name O ) ( resid 247 and name HN ) 2.00 0.20 0.00 assign ( resid 140 and name HN ) ( resid 247 and name O ) 2.00 0.20 0.00 assign ( resid 142 and name N ) ( resid 245 and name O ) 3.00 1.20 0.00 assign ( resid 142 and name O ) ( resid 245 and name N ) 3.00 1.20 0.00 assign ( resid 142 and name O ) ( resid 245 and name HN ) 2.00 0.20 0.00 assign ( resid 142 and name HN ) ( resid 245 and name O ) 2.00 0.20 0.00 assign ( resid 146 and name O ) ( resid 244 and name N ) 3.00 1.20 0.00 assign ( resid 146 and name O ) ( resid 244 and name HN ) 2.00 0.20 0.00 assign ( resid 148 and name N ) ( resid 244 and name O ) 3.00 1.20 0.00 assign ( resid 148 and name O ) ( resid 246 and name N ) 3.00 1.20 0.00 assign ( resid 148 and name O ) ( resid 246 and name HN ) 2.00 0.20 0.00 assign ( resid 148 and name HN ) ( resid 244 and name O ) 2.00 0.20 0.00 assign ( resid 149 and name N ) ( resid 166 and name O ) 3.00 1.20 0.00 assign ( resid 149 and name O ) ( resid 166 and name N ) 3.00 1.20 0.00 assign ( resid 149 and name O ) ( resid 166 and name HN ) 2.00 0.20 0.00 assign ( resid 149 and name HN ) ( resid 166 and name O ) 2.00 0.20 0.00 assign ( resid 150 and name N ) ( resid 246 and name O ) 3.00 1.20 0.00 assign ( resid 150 and name O ) ( resid 248 and name N ) 3.00 1.20 0.00 assign ( resid 150 and name O ) ( resid 248 and name HN ) 2.00 0.20 0.00 assign ( resid 150 and name HN ) ( resid 246 and name O ) 2.00 0.20 0.00 assign ( resid 151 and name N ) ( resid 164 and name O ) 3.00 1.20 0.00 assign ( resid 151 and name O ) ( resid 164 and name N ) 3.00 1.20 0.00 assign ( resid 151 and name O ) ( resid 164 and name HN ) 2.00 0.20 0.00 assign ( resid 151 and name HN ) ( resid 164 and name O ) 2.00 0.20 0.00 assign ( resid 152 and name N ) ( resid 248 and name O ) 3.00 1.20 0.00 assign ( resid 152 and name O ) ( resid 250 and name N ) 3.00 1.20 0.00 assign ( resid 152 and name O ) ( resid 250 and name HN ) 2.00 0.20 0.00 assign ( resid 152 and name HN ) ( resid 248 and name O ) 2.00 0.20 0.00 assign ( resid 153 and name N ) ( resid 162 and name O ) 3.00 1.20 0.00 assign ( resid 153 and name O ) ( resid 162 and name N ) 3.00 1.20 0.00 assign ( resid 153 and name O ) ( resid 162 and name HN ) 2.00 0.20 0.00 assign ( resid 153 and name HN ) ( resid 162 and name O ) 2.00 0.20 0.00 assign ( resid 155 and name N ) ( resid 160 and name O ) 3.00 1.20 0.00 assign ( resid 155 and name HN ) ( resid 160 and name O ) 2.00 0.20 0.00 assign ( resid 157 and name O ) ( resid 160 and name N ) 3.00 1.20 0.00 assign ( resid 157 and name O ) ( resid 160 and name HN ) 2.00 0.20 0.00 assign ( resid 157 and name ND2 ) ( resid 207 and name O ) 3.00 1.20 0.00 assign ( resid 157 and name OD1 ) ( resid 159 and name N ) 3.50 1.70 0.00 assign ( resid 157 and name OD1 ) ( resid 159 and name HN ) 2.50 0.70 0.00 assign ( resid 158 and name N ) ( resid 208 and name O ) 3.00 1.20 0.00 assign ( resid 158 and name HN ) ( resid 208 and name O ) 2.00 0.20 0.00 assign ( resid 167 and name O ) ( resid 170 and name N ) 3.00 1.20 0.00 assign ( resid 167 and name O ) ( resid 170 and name HN ) 2.00 0.20 0.00 assign ( resid 178 and name HE ) ( resid 222 and name OE2 ) 2.00 0.20 0.00 assign ( resid 178 and name NE ) ( resid 222 and name OE2 ) 3.00 1.20 0.00 assign ( resid 178 and name NH1 ) ( resid 216 and name O ) 3.00 1.20 0.00 assign ( resid 178 and name NH1 ) ( resid 222 and name OE1 ) 3.00 1.20 0.00 assign ( resid 178 and name HH11 ) ( resid 222 and name OE1 ) 2.00 0.20 0.00 assign ( resid 178 and name HH12 ) ( resid 216 and name O ) 2.00 0.20 0.00 assign ( resid 179 and name N ) ( resid 101 and name O ) 3.00 1.20 0.00 assign ( resid 179 and name O ) ( resid 204 and name N ) 3.00 1.20 0.00 assign ( resid 179 and name O ) ( resid 204 and name HN ) 2.00 0.20 0.00 assign ( resid 179 and name HN ) ( resid 101 and name O ) 2.00 0.20 0.00 assign ( resid 181 and name N ) ( resid 204 and name O ) 3.00 1.20 0.00 assign ( resid 181 and name O ) ( resid 206 and name N ) 3.00 1.20 0.00 assign ( resid 181 and name O ) ( resid 206 and name HN ) 2.00 0.20 0.00 assign ( resid 181 and name HN ) ( resid 204 and name O ) 2.00 0.20 0.00 assign ( resid 183 and name N ) ( resid 206 and name O ) 3.00 1.20 0.00 assign ( resid 183 and name HN ) ( resid 206 and name O ) 2.00 0.20 0.00 assign ( resid 183 and name OD1 ) ( resid 212 and name HH ) 2.00 0.20 0.00 assign ( resid 183 and name OD1 ) ( resid 212 and name OH ) 3.00 1.20 0.00 assign ( resid 185 and name O ) ( resid 189 and name N ) 3.00 1.20 0.00 assign ( resid 185 and name O ) ( resid 189 and name HN ) 2.00 0.20 0.00 assign ( resid 186 and name O ) ( resid 190 and name N ) 3.00 1.20 0.00 assign ( resid 186 and name O ) ( resid 190 and name HN ) 2.00 0.20 0.00 assign ( resid 187 and name O ) ( resid 191 and name N ) 3.00 1.20 0.00 assign ( resid 187 and name O ) ( resid 191 and name HN ) 2.00 0.20 0.00 assign ( resid 188 and name O ) ( resid 192 and name N ) 3.00 1.20 0.00 assign ( resid 188 and name O ) ( resid 192 and name HN ) 2.00 0.20 0.00 assign ( resid 189 and name O ) ( resid 194 and name N ) 3.00 1.20 0.00 assign ( resid 189 and name O ) ( resid 194 and name HN ) 2.00 0.20 0.00 assign ( resid 190 and name O ) ( resid 193 and name N ) 3.50 1.70 0.00 assign ( resid 190 and name O ) ( resid 193 and name HN ) 2.50 0.70 0.00 assign ( resid 195 and name O ) ( resid 198 and name N ) 3.00 1.20 0.00 assign ( resid 195 and name O ) ( resid 198 and name HN ) 2.00 0.20 0.00 assign ( resid 197 and name O ) ( resid 202 and name ND2 ) 3.00 1.20 0.00 assign ( resid 197 and name O ) ( resid 202 and name HD22 ) 2.00 0.20 0.00 assign ( resid 199 and name N ) ( resid 202 and name OD1 ) 3.00 1.20 0.00 assign ( resid 199 and name HN ) ( resid 202 and name OD1 ) 2.00 0.20 0.00 assign ( resid 200 and name O ) ( resid 215 and name OE2 ) 3.50 1.70 0.00 assign ( resid 202 and name OD1 ) ( resid 203 and name OG1 ) 3.00 1.20 0.00 assign ( resid 203 and name O ) ( resid 213 and name ND2 ) 3.00 1.20 0.00 assign ( resid 203 and name O ) ( resid 213 and name HD22 ) 2.00 0.20 0.00 assign ( resid 205 and name N ) ( resid 213 and name OD1 ) 3.00 1.20 0.00 assign ( resid 205 and name O ) ( resid 212 and name N ) 3.00 1.20 0.00 assign ( resid 205 and name O ) ( resid 212 and name HN ) 2.00 0.20 0.00 assign ( resid 205 and name HN ) ( resid 213 and name OD1 ) 2.00 0.20 0.00 assign ( resid 207 and name N ) ( resid 210 and name O ) 3.00 1.20 0.00 assign ( resid 207 and name HN ) ( resid 210 and name O ) 2.00 0.20 0.00 assign ( resid 213 and name O ) ( resid 216 and name N ) 3.00 1.20 0.00 assign ( resid 213 and name O ) ( resid 216 and name HN ) 2.00 0.20 0.00 assign ( resid 213 and name ND2 ) ( resid 215 and name OE1 ) 3.50 1.70 0.00 assign ( resid 213 and name ND2 ) ( resid 215 and name OE2 ) 3.50 1.70 0.00 assign ( resid 215 and name N ) ( resid 215 and name OE1 ) 3.50 1.70 0.00 assign ( resid 221 and name O ) ( resid 225 and name N ) 3.00 1.20 0.00 assign ( resid 221 and name O ) ( resid 225 and name HN ) 2.00 0.20 0.00 assign ( resid 222 and name O ) ( resid 226 and name N ) 3.00 1.20 0.00 assign ( resid 222 and name O ) ( resid 226 and name HN ) 2.00 0.20 0.00 assign ( resid 222 and name OE1 ) ( resid 218 and name N ) 3.00 1.20 0.00 assign ( resid 222 and name OE1 ) ( resid 218 and name HN ) 2.00 0.20 0.00 assign ( resid 222 and name OE2 ) ( resid 178 and name N ) 3.00 1.20 0.00 assign ( resid 222 and name OE2 ) ( resid 178 and name HN ) 2.00 0.20 0.00 assign ( resid 223 and name O ) ( resid 227 and name N ) 3.00 1.20 0.00 assign ( resid 223 and name O ) ( resid 227 and name HN ) 2.00 0.20 0.00 assign ( resid 224 and name O ) ( resid 228 and name N ) 3.00 1.20 0.00 assign ( resid 224 and name O ) ( resid 228 and name HN ) 2.00 0.20 0.00 assign ( resid 225 and name O ) ( resid 229 and name N ) 3.00 1.20 0.00 assign ( resid 225 and name O ) ( resid 229 and name HN ) 2.00 0.20 0.00 assign ( resid 226 and name O ) ( resid 230 and name N ) 3.00 1.20 0.00 assign ( resid 226 and name O ) ( resid 230 and name HN ) 2.00 0.20 0.00 assign ( resid 226 and name HD1 ) ( resid 177 and name O ) 2.00 0.20 0.00 assign ( resid 226 and name ND1 ) ( resid 177 and name O ) 3.00 1.20 0.00 assign ( resid 227 and name O ) ( resid 231 and name N ) 3.00 1.20 0.00 assign ( resid 227 and name O ) ( resid 231 and name HN ) 2.00 0.20 0.00 assign ( resid 228 and name O ) ( resid 232 and name N ) 3.00 1.20 0.00 assign ( resid 228 and name O ) ( resid 232 and name HN ) 2.00 0.20 0.00 assign ( resid 229 and name O ) ( resid 233 and name N ) 3.00 1.20 0.00 assign ( resid 229 and name O ) ( resid 233 and name HN ) 2.00 0.20 0.00 assign ( resid 230 and name O ) ( resid 234 and name N ) 3.00 1.20 0.00 assign ( resid 230 and name O ) ( resid 234 and name HN ) 2.00 0.20 0.00 assign ( resid 231 and name O ) ( resid 235 and name N ) 3.00 1.20 0.00 assign ( resid 231 and name O ) ( resid 235 and name HN ) 2.00 0.20 0.00 assign ( resid 234 and name OD2 ) ( resid 253 and name HD1 ) 1.80 0.20 0.00 assign ( resid 234 and name OD2 ) ( resid 253 and name ND1 ) 2.80 1.00 0.00 assign ( resid 234 and name OD2 ) ( resid 256 and name ND2 ) 2.80 1.20 0.00 assign ( resid 251 and name O ) ( resid 151 and name HH ) 2.00 0.20 0.00 assign ( resid 251 and name O ) ( resid 151 and name OH ) 3.00 1.20 0.00 assign ( resid 252 and name O ) ( resid 256 and name N ) 3.00 1.20 0.00 assign ( resid 252 and name O ) ( resid 256 and name HN ) 2.00 0.20 0.00 assign ( resid 253 and name O ) ( resid 257 and name N ) 3.00 1.20 0.00 assign ( resid 253 and name O ) ( resid 257 and name HN ) 2.00 0.20 0.00 assign ( resid 254 and name O ) ( resid 258 and name N ) 3.00 1.20 0.00 assign ( resid 254 and name O ) ( resid 258 and name HN ) 2.00 0.20 0.00 assign ( resid 255 and name O ) ( resid 259 and name N ) 3.00 1.20 0.00 assign ( resid 255 and name O ) ( resid 259 and name HN ) 2.00 0.20 0.00 assign ( resid 256 and name O ) ( resid 260 and name N ) 3.00 1.20 0.00 assign ( resid 256 and name O ) ( resid 260 and name HN ) 2.00 0.20 0.00 assign ( resid 257 and name O ) ( resid 261 and name N ) 3.00 1.20 0.00 assign ( resid 257 and name O ) ( resid 261 and name HN ) 2.00 0.20 0.00 assign ( resid 258 and name O ) ( resid 262 and name N ) 3.00 1.20 0.00 assign ( resid 258 and name O ) ( resid 262 and name HN ) 2.00 0.20 0.00 assign ( resid 259 and name O ) ( resid 263 and name N ) 3.00 1.20 0.00 assign ( resid 259 and name O ) ( resid 263 and name HN ) 2.00 0.20 0.00 assign ( resid 260 and name O ) ( resid 264 and name N ) 3.00 1.20 0.00 assign ( resid 260 and name O ) ( resid 264 and name HN ) 2.00 0.20 0.00 assign ( resid 261 and name O ) ( resid 265 and name N ) 3.00 1.20 0.00 assign ( resid 261 and name O ) ( resid 265 and name HN ) 2.00 0.20 0.00 assign ( resid 262 and name O ) ( resid 266 and name N ) 3.00 1.20 0.00 assign ( resid 262 and name O ) ( resid 266 and name HN ) 2.00 0.20 0.00
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