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 |
|
|
651404 |
6wap   |
30741 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
# Restraints file 2: D_1000247592_mr_P3.xplor-nih.V2 assign ( resid 161 and name CB ) ( resid 162 and name CG or resid 198 and name CB ) 4.6 2.6 2.6 assign ( resid 120 and name C ) ( resid 123 and name CG or resid 124 and name CG1 ) 4.6 2.6 2.6 assign ( resid 51 and name CB or resid 131 and name CE ) ( resid 47 and name CB ) 4.6 2.6 2.6 assign ( resid 154 and name CA ) ( resid 164 and name CB or resid 193 and name CB ) 4.6 2.6 2.6 assign ( resid 189 and name CA or resid 192 and name CA ) ( resid 193 and name CA ) 4.6 2.6 2.6 assign ( resid 193 and name CA ) ( resid 189 and name CA or resid 192 and name CA ) 4.6 2.6 2.6 assign ( resid 195 and name CA ) ( resid 155 and name CB or resid 198 and name CB ) 4.6 2.6 2.6 assign ( resid 195 and name CA ) ( resid 155 and name CG or resid 196 and name CB or resid 199 and name CB ) 4.6 2.6 2.6 assign ( resid 69 and name CA ) ( resid 73 and name CD1 or resid 141 and name CD1 ) 4.6 2.6 2.6 assign ( resid 210 and name CA or resid 214 and name CA ) ( resid 209 and name CB ) 4.6 2.6 2.6 assign ( resid 99 and name CA ) ( resid 100 and name CB or resid 104 and name CG1 ) 4.6 2.6 2.6 assign ( resid 99 and name CA or resid 125 and name CA ) ( resid 126 and name CG1 ) 4.6 2.6 2.6 assign ( resid 164 and name CB or resid 193 and name CB ) ( resid 154 and name CG or resid 155 and name CB ) 4.6 2.6 2.6 assign ( resid 115 and name CA ) ( resid 112 and name CA or resid 118 and name CA ) 4.6 2.6 2.6 assign ( resid 68 and name CA or resid 138 and name CA ) ( resid 141 and name CD1 ) 4.6 2.6 2.6 assign ( resid 34 and name CA or resid 135 and name CA ) ( resid 37 and name CG2 ) 4.6 2.6 2.6 assign ( resid 200 and name CA ) ( resid 201 and name CG2 or resid 204 and name CB ) 4.6 2.6 2.6 assign ( resid 164 and name CB ) ( resid 155 and name CG or resid 159 and name CB ) 4.6 2.6 2.6 assign ( resid 164 and name CB ) ( resid 155 and name CG or resid 159 and name CB ) 4.6 2.6 2.6 assign ( resid 155 and name CG or resid 199 and name CB ) ( resid 194 and name CB ) 4.6 2.6 2.6 assign ( resid 155 and name CG or resid 199 and name CB ) ( resid 194 and name CB ) 4.6 2.6 2.6 assign ( resid 80 and name CE2 or resid 133 and name CE2 ) ( resid 129 and name CG2 ) 4.6 2.6 2.6 assign ( resid 80 and name CE2 or resid 117 and name CE2 ) ( resid 99 and name CG ) 4.6 2.6 2.6 assign ( resid 117 and name CD1 ) ( resid 96 and name CG or resid 99 and name CB ) 4.6 2.6 2.6 assign ( resid 23 and name CD1 ) ( resid 26 and name CG2 or resid 27 and name CG1 ) 4.6 2.6 2.6 assign ( resid 23 and name CE2 ) ( resid 26 and name CG2 or resid 27 and name CG1 or resid 36 and name CG1 ) 4.6 2.6 2.6 assign ( resid 23 and name CE3 ) ( resid 26 and name CG2 or resid 27 and name CG1 or resid 36 and name CG1 ) 4.6 2.6 2.6 assign ( resid 40 and name CD* ) ( resid 39 and name CA or resid 52 and name CA ) 4.6 2.6 2.6 assign ( resid 40 and name CD* ) ( resid 23 and name CB or resid 37 and name CG1 ) 4.6 2.6 2.6 assign ( resid 164 and name CD* ) ( resid 154 and name CG or resid 155 and name CB ) 4.6 2.6 2.6 assign ( resid 164 and name CD* ) ( resid 155 and name CG or resid 159 and name CB ) 4.6 2.6 2.6 assign ( resid 164 and name CD* ) ( resid 161 and name CB or resid 168 and name CB ) 4.6 2.6 2.6 assign ( resid 49 and name CA or resid 109 and name CB ) ( resid 104 and name CA ) 4.6 2.6 2.6 assign ( resid 72 and name CA ) ( resid 70 and name CA or resid 71 and name CA ) 4.6 2.6 2.6 assign ( resid 70 and name CA or resid 71 and name CA ) ( resid 72 and name CA ) 4.6 2.6 2.6 assign ( resid 213 and name CA or resid 215 and name CA ) ( resid 216 and name CB ) 4.6 2.6 2.6 assign ( resid 213 and name CA or resid 215 and name CA ) ( resid 216 and name CA ) 4.6 2.6 2.6 assign ( resid 196 and name CA or resid 200 and name CA ) ( resid 199 and name CA ) 4.6 2.6 2.6 assign ( resid 201 and name CA ) ( resid 197 and name CA or resid 202 and name CA ) 4.6 2.6 2.6 assign ( resid 54 and name CB ) ( resid 50 and name CA or resid 55 and name CA ) 4.6 2.6 2.6 assign ( resid 50 and name CA or resid 55 and name CA ) ( resid 54 and name CB ) 4.6 2.6 2.6 assign ( resid 216 and name CB ) ( resid 212 and name CA or resid 214 and name CA ) 4.6 2.6 2.6 assign ( resid 212 and name CA or resid 214 and name CA ) ( resid 216 and name CB ) 4.6 2.6 2.6 assign ( resid 186 and name CB or resid 188 and name CB ) ( resid 190 and name CA ) 4.6 2.6 2.6 assign ( resid 45 and name CA or resid 52 and name CA ) ( resid 44 and name CB ) 4.6 2.6 2.6 assign ( resid 210 and name CA or resid 212 and name CA or resid 214 and name CA ) ( resid 211 and name CA ) 4.6 2.6 2.6 assign ( resid 66 and name CA ) ( resid 67 and name CA or resid 68 and name CA ) 4.6 2.6 2.6 assign ( resid 153 and name CA ) ( resid 152 and name CA or resid 154 and name CA ) 4.6 2.6 2.6 assign ( resid 152 and name CA or resid 154 and name CA ) ( resid 153 and name CA ) 4.6 2.6 2.6 assign ( resid 51 and name CB ) ( resid 49 and name CA or resid 54 and name CA ) 4.6 2.6 2.6 assign ( resid 197 and name CB ) ( resid 196 and name CA or resid 200 and name CA ) 4.6 2.6 2.6 assign ( resid 141 and name CA ) ( resid 32 and name CB or resid 145 and name CB ) 4.6 2.6 2.6 assign ( resid 74 and name CB or resid 76 and name CG ) ( resid 72 and name CA ) 4.6 2.6 2.6 assign ( resid 164 and name CB or resid 193 and name CB ) ( resid 154 and name CA ) 4.6 2.6 2.6 assign ( resid 129 and name CA ) ( resid 128 and name CG or resid 130 and name CB ) 4.6 2.6 2.6 assign ( resid 197 and name CA ) ( resid 196 and name CB or resid 199 and name CB ) 4.6 2.6 2.6 assign ( resid 196 and name CB or resid 199 and name CB ) ( resid 197 and name CA ) 4.6 2.6 2.6 assign ( resid 15 and name CG1 ) ( resid 19 and name CB or resid 54 and name CB ) 4.6 2.6 2.6 assign ( resid 73 and name CG1 or resid 75 and name CB ) ( resid 72 and name CA ) 4.6 2.6 2.6 assign ( resid 96 and name CA or resid 97 and name CA ) ( resid 91 and name CG1 ) 4.6 2.6 2.6 assign ( resid 91 and name CG1 ) ( resid 96 and name CA or resid 97 and name CA ) 4.6 2.6 2.6 assign ( resid 100 and name CB or resid 104 and name CG1 ) ( resid 99 and name CA ) 4.6 2.6 2.6 assign ( resid 45 and name CA or resid 52 and name CA ) ( resid 47 and name CB ) 4.6 2.6 2.6 assign ( resid 91 and name CG2 ) ( resid 95 and name CA or resid 96 and name CA ) 4.6 2.6 2.6 assign ( resid 202 and name CA ) ( resid 201 and name CG2 or resid 204 and name CB ) 4.6 2.6 2.6 assign ( resid 152 and name CA or resid 154 and name CA ) ( resid 153 and name CG2 ) 4.6 2.6 2.6 assign ( resid 153 and name CG2 ) ( resid 152 and name CA or resid 154 and name CA ) 4.6 2.6 2.6 assign ( resid 200 and name CB ) ( resid 201 and name CG2 or resid 204 and name CB ) 4.6 2.6 2.6 assign ( resid 35 and name CA or resid 138 and name CA ) ( resid 37 and name CD1 ) 4.6 2.6 2.6 assign ( resid 123 and name CA or resid 125 and name CA ) ( resid 124 and name CG2 ) 4.6 2.6 2.6 assign ( resid 49 and name CA or resid 109 and name CB ) ( resid 126 and name CG1 ) 4.6 2.6 2.6 assign ( resid 21 and name CA or resid 43 and name CA ) ( resid 19 and name CB ) 4.6 2.6 2.6 assign ( resid 11 and name CG2 ) ( resid 4 and name CA or resid 10 and name CA ) 4.6 2.6 2.6 assign ( resid 51 and name CB or resid 131 and name CE ) ( resid 52 and name CD2 ) 4.6 2.6 2.6 assign ( resid 197 and name CB ) ( resid 196 and name CB or resid 199 and name CB ) 4.6 2.6 2.6 assign ( resid 155 and name CG or resid 160 and name CB ) ( resid 161 and name CB ) 4.6 2.6 2.6 assign ( resid 154 and name CG or resid 155 and name CB ) ( resid 164 and name CB or resid 193 and name CB ) 4.6 2.6 2.6 assign ( resid 36 and name CG2 or resid 138 and name CD1 ) ( resid 40 and name CB ) 4.6 2.6 2.6 assign ( resid 40 and name CB ) ( resid 36 and name CG2 or resid 138 and name CD1 ) 4.6 2.6 2.6 assign ( resid 73 and name CG2 or resid 129 and name CG2 ) ( resid 130 and name CB ) 4.6 2.6 2.6 assign ( resid 141 and name CG2 ) ( resid 32 and name CB or resid 145 and name CB ) 4.6 2.6 2.6 assign ( resid 112 and name CB or resid 114 and name CB ) ( resid 113 and name CG ) 4.6 2.6 2.6 assign ( resid 113 and name CG ) ( resid 112 and name CB or resid 114 and name CB ) 4.6 2.6 2.6 assign ( resid 130 and name CB ) ( resid 73 and name CD1 or resid 134 and name CD1 ) 4.6 2.6 2.6 assign ( resid 164 and name CB or resid 193 and name CB ) ( resid 153 and name CG2 ) 4.6 2.6 2.6 assign ( resid 153 and name CG2 ) ( resid 164 and name CB or resid 193 and name CB ) 4.6 2.6 2.6 assign ( resid 117 and name CB or resid 124 and name CG1 or resid 125 and name CG ) ( resid 126 and name CG1 ) 4.6 2.6 2.6 assign ( resid 202 and name CD2 ) ( resid 194 and name CB or resid 201 and name CG2 or resid 217 and name CB ) 4.6 2.6 2.6 assign ( resid 126 and name CG2 ) ( resid 104 and name CG2 or resid 124 and name CG2 ) 4.6 2.6 2.6 assign ( resid 48 and name CG2 ) ( resid 2 and name CG2 or resid 115 and name CG2 ) 4.6 2.6 2.6 assign ( resid 49 and name CB or resid 99 and name CB or resid 104 and name CG1 ) ( resid 126 and name CG2 ) 4.6 2.6 2.6 assign ( resid 26 and name CG2 or resid 36 and name CG2 or resid 43 and name CD1 ) ( resid 39 and name CB ) 4.6 2.6 2.6 assign ( resid 47 and name CB ) ( resid 15 and name CG1 or resid 45 and name CB ) 4.6 2.6 2.6 assign ( resid 15 and name CG1 or resid 45 and name CB ) ( resid 47 and name CB ) 4.6 2.6 2.6 assign ( resid 126 and name CG2 ) ( resid 49 and name CB or resid 99 and name CB or resid 104 and name CG1 ) 4.6 2.6 2.6 assign ( resid 39 and name CB ) ( resid 36 and name CG2 or resid 43 and name CD2 ) 4.6 2.6 2.6 assign ( resid 187 and name CB ) ( resid 186 and name CG2 or resid 188 and name CG2 ) 4.6 2.6 2.6 assign ( resid 52 and name CA or resid 56 and name CA ) ( resid 134 and name CD1 ) 4.6 2.6 2.6 assign ( resid 80 and name CE2 or resid 133 and name CE2 ) ( resid 104 and name CG1 ) 4.6 2.6 2.6 assign ( resid 164 and name CD* or resid 169 and name CD* ) ( resid 166 and name CA ) 4.6 2.6 2.6 assign ( resid 15 and name CG2 ) ( resid 1 and name CG or resid 20 and name CD2 ) 4.6 2.6 2.6 assign ( resid 47 and name CB ) ( resid 51 and name CA or resid 52 and name CA ) 4.6 2.6 2.6 assign ( resid 72 and name CB ) ( resid 69 and name CA or resid 75 and name CA or resid 136 and name CA ) 4.6 2.6 2.6 assign ( resid 99 and name CA or resid 125 and name CA ) ( resid 126 and name CG2 ) 4.6 2.6 2.6 assign ( resid 4 and name CA ) ( resid 3 and name CG2 or resid 11 and name CG2 ) 4.6 2.6 2.6 assign ( resid 129 and name CA or resid 134 and name CA ) ( resid 131 and name CG ) 4.6 2.6 2.6 assign ( resid 133 and name CD1 ) ( resid 73 and name CG2 or resid 129 and name CG2 ) 4.6 2.6 2.6 assign ( resid 117 and name CD1 ) ( resid 96 and name CG or resid 99 and name CB ) 4.6 2.6 2.6 assign ( resid 117 and name CD1 ) ( resid 96 and name CA or resid 98 and name CA ) 4.6 2.6 2.6 assign ( resid 117 and name CD1 ) ( resid 113 and name CA or resid 124 and name CA ) 4.6 2.6 2.6 assign ( resid 133 and name CD1 ) ( resid 129 and name CA or resid 134 and name CA ) 4.6 2.6 2.6 assign ( resid 80 and name CD1 ) ( resid 99 and name CB or resid 104 and name CG1 ) 4.6 2.6 2.6 assign ( resid 23 and name CD1 ) ( resid 27 and name CG1 or resid 43 and name CD1 ) 4.6 2.6 2.6 assign ( resid 133 and name CE3 ) ( resid 73 and name CG2 or resid 129 and name CG2 ) 4.6 2.6 2.6 assign ( resid 133 and name CE3 ) ( resid 73 and name CG2 or resid 129 and name CG2 ) 4.6 2.6 2.6 assign ( resid 133 and name CE2 ) ( resid 73 and name CG2 or resid 129 and name CG2 ) 4.6 2.6 2.6 assign ( resid 133 and name CE2 ) ( resid 73 and name CA or resid 104 and name CA ) 4.6 2.6 2.6 assign ( resid 40 and name CD* ) ( resid 55 and name CA or resid 131 and name CA ) 4.6 2.6 2.6 assign ( resid 161 and name CD* ) ( resid 155 and name CG or resid 215 and name CB ) 4.6 2.6 2.6 assign ( resid 32 and name CD* ) ( resid 36 and name CG1 or resid 138 and name CD2 ) 4.6 2.6 2.6 assign ( resid 138 and name CB ) ( resid 36 and name CA or resid 135 and name CA ) 4.6 2.6 2.6 assign ( resid 47 and name CA ) ( resid 52 and name CB or resid 131 and name CE ) 4.6 2.6 2.6 assign ( resid 33 and name CA or resid 144 and name CA ) ( resid 142 and name CB ) 4.6 2.6 2.6 assign ( resid 104 and name CD1 ) ( resid 99 and name CD or resid 101 and name CA ) 4.6 2.6 2.6 assign ( resid 137 and name CA ) ( resid 69 and name CB or resid 136 and name CB ) 4.6 2.6 2.6 assign ( resid 137 and name CA ) ( resid 69 and name CG or resid 136 and name CG ) 4.6 2.6 2.6 assign ( resid 17 and name CA ) ( resid 16 and name CA or resid 21 and name CA ) 4.6 2.6 2.6 assign ( resid 130 and name CA ) ( resid 129 and name CB or resid 134 and name CB ) 4.6 2.6 2.6 assign ( resid 80 and name CG or resid 133 and name CG ) ( resid 104 and name CB ) 4.6 2.6 2.6 assign ( resid 80 and name CA ) ( resid 77 and name CA or resid 78 and name CA ) 4.6 2.6 2.6 assign ( resid 136 and name C ) ( resid 134 and name CB or resid 135 and name CB ) 4.6 2.6 2.6 assign ( resid 136 and name C ) ( resid 138 and name CB or resid 140 and name CE ) 4.6 2.6 2.6 assign ( resid 125 and name CD ) ( resid 124 and name CB or resid 129 and name CB ) 4.6 2.6 2.6 assign ( resid 125 and name CD ) ( resid 118 and name CA or resid 124 and name CA ) 4.6 2.6 2.6 assign ( resid 37 and name CA ) ( resid 40 and name CA or resid 41 and name CA ) 4.6 2.6 2.6 assign ( resid 54 and name CA ) ( resid 50 and name CA or resid 55 and name CA ) 4.6 2.6 2.6 assign ( resid 191 and name CA ) ( resid 190 and name CB or resid 202 and name CB ) 4.6 2.6 2.6 assign ( resid 190 and name CB or resid 202 and name CB ) ( resid 191 and name CA ) 4.6 2.6 2.6 assign ( resid 16 and name CA or resid 21 and name CA ) ( resid 17 and name CA ) 4.6 2.6 2.6 assign ( resid 165 and name CA or resid 171 and name CA ) ( resid 169 and name CA ) 4.6 2.6 2.6 assign ( resid 169 and name CA ) ( resid 165 and name CA or resid 171 and name CA ) 4.6 2.6 2.6 assign ( resid 23 and name CD2 ) ( resid 26 and name CB or resid 27 and name CB ) 4.6 2.6 2.6 assign ( resid 23 and name CG ) ( resid 24 and name CB or resid 26 and name CB or resid 27 and name CB ) 4.6 2.6 2.6 assign ( resid 133 and name CG ) ( resid 73 and name CB or resid 129 and name CB or resid 134 and name CB ) 4.6 2.6 2.6 assign ( resid 133 and name CG ) ( resid 129 and name CA or resid 134 and name CA ) 4.6 2.6 2.6 assign ( resid 49 and name CA ) ( resid 50 and name CA or resid 114 and name CA ) 4.6 2.6 2.6 assign ( resid 49 and name CA or resid 54 and name CA ) ( resid 51 and name CA ) 4.6 2.6 2.6 assign ( resid 196 and name CA or resid 200 and name CA ) ( resid 199 and name CA ) 4.6 2.6 2.6 assign ( resid 102 and name CA or resid 108 and name CA ) ( resid 103 and name CA ) 4.6 2.6 2.6 assign ( resid 63 and name CA ) ( resid 64 and name CA or resid 65 and name CA ) 4.6 2.6 2.6 assign ( resid 64 and name CA or resid 65 and name CA ) ( resid 63 and name CA ) 4.6 2.6 2.6 assign ( resid 153 and name CA ) ( resid 152 and name CA or resid 154 and name CA ) 4.6 2.6 2.6 assign ( resid 209 and name CA ) ( resid 210 and name CA or resid 214 and name CA ) 4.6 2.6 2.6 assign ( resid 107 and name CA ) ( resid 102 and name CA or resid 108 and name CA ) 4.6 2.6 2.6 assign ( resid 54 and name CA ) ( resid 50 and name CA or resid 55 and name CA ) 4.6 2.6 2.6 assign ( resid 216 and name CA ) ( resid 212 and name CA or resid 214 and name CA or resid 218 and name CA ) 4.6 2.6 2.6 assign ( resid 115 and name CA ) ( resid 112 and name CA or resid 118 and name CA ) 4.6 2.6 2.6 assign ( resid 36 and name CA ) ( resid 32 and name CA or resid 39 and name CA ) 4.6 2.6 2.6 assign ( resid 123 and name CA ) ( resid 118 and name CA or resid 124 and name CA ) 4.6 2.6 2.6 assign ( resid 160 and name CA ) ( resid 162 and name CA or resid 164 and name CA ) 4.6 2.6 2.6 assign ( resid 104 and name CA or resid 126 and name CA ) ( resid 130 and name CA ) 4.6 2.6 2.6 assign ( resid 213 and name CA or resid 215 and name CA ) ( resid 216 and name CA ) 4.6 2.6 2.6 assign ( resid 70 and name CA or resid 71 and name CA ) ( resid 72 and name CA ) 4.6 2.6 2.6 assign ( resid 199 and name CA ) ( resid 196 and name CA or resid 200 and name CA ) 4.6 2.6 2.6 assign ( resid 175 and name CA or resid 178 and name CA ) ( resid 177 and name CA ) 4.6 2.6 2.6 assign ( resid 129 and name CB or resid 134 and name CB ) ( resid 130 and name CA ) 4.6 2.6 2.6 assign ( resid 138 and name CB or resid 140 and name CE ) ( resid 139 and name CA ) 4.6 2.6 2.6 assign ( resid 20 and name CB ) ( resid 16 and name CA or resid 21 and name CA ) 4.6 2.6 2.6 assign ( resid 135 and name CB or resid 141 and name CB ) ( resid 137 and name CA ) 4.6 2.6 2.6 assign ( resid 20 and name CG or resid 56 and name CG ) ( resid 54 and name CA ) 4.6 2.6 2.6 assign ( resid 214 and name CA or resid 218 and name CA ) ( resid 202 and name CG ) 4.6 2.6 2.6 assign ( resid 23 and name CA or resid 29 and name CA or resid 39 and name CA ) ( resid 26 and name CB ) 4.6 2.6 2.6 assign ( resid 23 and name CA or resid 29 and name CA or resid 32 and name CA ) ( resid 27 and name CB ) 4.6 2.6 2.6 assign ( resid 191 and name CB ) ( resid 190 and name CB or resid 202 and name CB ) 4.6 2.6 2.6 assign ( resid 134 and name CB ) ( resid 52 and name CB or resid 69 and name CB ) 4.6 2.6 2.6 assign ( resid 32 and name CA or resid 35 and name CA or resid 39 and name CA ) ( resid 36 and name CB ) 4.6 2.6 2.6 assign ( resid 67 and name CA or resid 68 and name CA ) ( resid 69 and name CG ) 4.6 2.6 2.6 assign ( resid 23 and name CA or resid 39 and name CA ) ( resid 43 and name CG ) 4.6 2.6 2.6 assign ( resid 118 and name CG ) ( resid 2 and name CB or resid 115 and name CB or resid 124 and name CB ) 4.6 2.6 2.6 assign ( resid 37 and name CB ) ( resid 37 and name CD1 or resid 135 and name CD1 ) 4.6 2.6 2.6 assign ( resid 213 and name CA or resid 215 and name CA ) ( resid 211 and name CG ) 4.6 2.6 2.6 assign ( resid 77 and name CA or resid 78 and name CA ) ( resid 80 and name CA ) 4.6 2.6 2.6 assign ( resid 24 and name CB or resid 26 and name CB ) ( resid 23 and name CA ) 4.6 2.6 2.6 assign ( resid 28 and name CD ) ( resid 24 and name CB or resid 27 and name CB ) 4.6 2.6 2.6 assign ( resid 3 and name CA or resid 11 and name CA ) ( resid 13 and name CA ) 4.6 2.6 2.6 assign ( resid 23 and name CG ) ( resid 20 and name CG or resid 43 and name CG ) 4.6 2.6 2.6 # Restraints file 3: D_1000247592_mr_P1.xplor-nih.V2 assign ( resid 1 and name CA ) ( resid 12 and name CG ) 4.6 2.6 2.6 ! P1CA-H12CG assign ( resid 1 and name CB ) ( resid 47 and name CB ) 4.6 2.6 2.6 ! P1CB-A47CB assign ( resid 1 and name CG ) ( resid 48 and name CB ) 4.6 2.6 2.6 ! P1CG-T48CB assign ( resid 1 and name CG ) ( resid 51 and name CB ) 4.6 2.6 2.6 ! P1CG-D51CB assign ( resid 2 and name CB ) ( resid 11 and name CA ) 4.6 2.6 2.6 ! I2CB-V11CA assign ( resid 2 and name CA ) ( resid 12 and name CA ) 4.6 2.6 2.6 ! I2CA-H12CA assign ( resid 2 and name CA ) ( resid 12 and name CG ) 4.6 2.6 2.6 ! I2CA-H12CG assign ( resid 2 and name CB ) ( resid 12 and name CA ) 4.6 2.6 2.6 ! I2CB-H12CA assign ( resid 3 and name CB ) ( resid 12 and name CA ) 4.6 2.6 2.6 ! V3CB-H12CA assign ( resid 4 and name CA ) ( resid 11 and name CG2 ) 4.6 2.6 2.6 ! Q4CA-V11CG2 assign ( resid 5 and name CB ) ( resid 10 and name CA ) 4.6 2.6 2.6 ! N5CB-M10CA assign ( resid 12 and name CG ) ( resid 111 and name CG ) 4.6 2.6 2.6 ! H12CG-L111CG assign ( resid 15 and name CD1 ) ( resid 20 and name CA ) 4.6 2.6 2.6 ! I15CD1-L20CA assign ( resid 15 and name CA ) ( resid 51 and name CA ) 4.6 2.6 2.6 ! I15CA-D51CA assign ( resid 15 and name CD1 ) ( resid 51 and name CA ) 4.6 2.6 2.6 ! I15CD1-D51CA assign ( resid 15 and name CD1 ) ( resid 51 and name CB ) 4.6 2.6 2.6 ! I15CD1-D51CB assign ( resid 19 and name CA ) ( resid 43 and name CA ) 4.6 2.6 2.6 ! T19CA-L43CA assign ( resid 19 and name CA ) ( resid 43 and name CB ) 4.6 2.6 2.6 ! T19CA-L43CB assign ( resid 19 and name CA ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! T19CA-L43CG assign ( resid 19 and name CG2 ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! T19CG2-L43CG assign ( resid 19 and name CB ) ( resid 55 and name CE ) 4.6 2.6 2.6 ! T19CB-M55CE assign ( resid 20 and name CD2 ) ( resid 54 and name CB ) 4.6 2.6 2.6 ! L20CD2-T54CB assign ( resid 20 and name CA ) ( resid 55 and name CE ) 4.6 2.6 2.6 ! L20CA-M55CE assign ( resid 20 and name CG ) ( resid 55 and name CA ) 4.6 2.6 2.6 ! L20CG-M55CA assign ( resid 20 and name CD1 ) ( resid 58 and name CB ) 4.6 2.6 2.6 ! L20CD1-T58CB assign ( resid 22 and name CA ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! A22CA-L43CG assign ( resid 23 and name CZ2 ) ( resid 36 and name CA ) 4.6 2.6 2.6 ! W23CZ2-V36CA assign ( resid 23 and name CE3 ) ( resid 39 and name CA ) 4.6 2.6 2.6 ! W23CE3-M39CA assign ( resid 23 and name CA ) ( resid 40 and name CA ) 4.6 2.6 2.6 ! W23CA-F40CA assign ( resid 23 and name CB ) ( resid 40 and name CD1 ) 4.6 2.6 2.6 ! W23CB-F40CD1 assign ( resid 23 and name CD2 ) ( resid 40 and name CA ) 4.6 2.6 2.6 ! W23CD2-F40CA assign ( resid 23 and name CE2 ) ( resid 40 and name CB ) 4.6 2.6 2.6 ! W23CE2-F40CB assign ( resid 23 and name CD2 ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! W23CD2-L43CG assign ( resid 23 and name CG ) ( resid 43 and name CB ) 4.6 2.6 2.6 ! W23CG-L43CB assign ( resid 23 and name CB ) ( resid 55 and name CE ) 4.6 2.6 2.6 ! W23CB-M55CE assign ( resid 23 and name CD2 ) ( resid 55 and name CA ) 4.6 2.6 2.6 ! W23CD2-M55CA assign ( resid 23 and name CE2 ) ( resid 55 and name CB ) 4.6 2.6 2.6 ! W23CE2-M55CB assign ( resid 23 and name CE2 ) ( resid 55 and name CE ) 4.6 2.6 2.6 ! W23CE2-M55CE assign ( resid 23 and name CE3 ) ( resid 55 and name CE ) 4.6 2.6 2.6 ! W23CE3-M55CE assign ( resid 23 and name CD1 ) ( resid 58 and name CB ) 4.6 2.6 2.6 ! W23CD1-T58CB assign ( resid 23 and name CD1 ) ( resid 59 and name CG1 ) 4.6 2.6 2.6 ! W23CD1-V59CG1 assign ( resid 23 and name CD2 ) ( resid 59 and name CA ) 4.6 2.6 2.6 ! W23CD2-V59CA assign ( resid 23 and name CE2 ) ( resid 138 and name CD2 ) 4.6 2.6 2.6 ! W23CE2-L138CD2 assign ( resid 23 and name CZ2 ) ( resid 138 and name CG ) 4.6 2.6 2.6 ! W23CZ2-L138CG assign ( resid 24 and name CG1 ) ( resid 58 and name CA ) 4.6 2.6 2.6 ! V24CG1-T58CA assign ( resid 26 and name CG2 ) ( resid 39 and name CB ) 4.6 2.6 2.6 ! V26CG2-M39CB assign ( resid 27 and name CB ) ( resid 59 and name CA ) 4.6 2.6 2.6 ! V27CB-V59CA assign ( resid 27 and name CG1 ) ( resid 59 and name CG2 ) 4.6 2.6 2.6 ! V27CG1-V59CG2 assign ( resid 32 and name CD1 ) ( resid 65 and name CB ) 4.6 2.6 2.6 ! F32CD1-A65CB assign ( resid 32 and name CB ) ( resid 141 and name CA ) 4.6 2.6 2.6 ! F32CB-I141CA assign ( resid 32 and name CD1 ) ( resid 141 and name CD1 ) 4.6 2.6 2.6 ! F32CD1-I141CD1 assign ( resid 32 and name CB ) ( resid 142 and name CG1 ) 4.6 2.6 2.6 ! F32CB-V142CG1 assign ( resid 34 and name CD ) ( resid 142 and name CB ) 4.6 2.6 2.6 ! P34CD-V142CB assign ( resid 34 and name CD ) ( resid 174 and name CA ) 4.6 2.6 2.6 ! P34CD-A174CA assign ( resid 36 and name CB ) ( resid 138 and name CB ) 4.6 2.6 2.6 ! V36CB-L138CB assign ( resid 36 and name CG1 ) ( resid 142 and name CG1 ) 4.6 2.6 2.6 ! V36CG1-V142CG1 assign ( resid 37 and name CD1 ) ( resid 138 and name CA ) 4.6 2.6 2.6 ! 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32.93000-28.81400 : Q63CG-Q63CB assign ( resid 71 and name CA ) ( resid 71 and name CB ) 4.5 3.0 2.0 ! 59.97100-29.71600 : E71CA-E71CB assign ( resid 112 and name CB ) ( resid 112 and name CG ) 4.5 3.0 2.0 ! 28.06700-34.87000 : Q112CB-Q112CG assign ( resid 35 and name CA ) ( resid 35 and name CB ) 4.5 3.0 2.0 ! 58.55200-29.91200 : E35CA-E35CB assign ( resid 135 and name CG2 ) ( resid 135 and name CG1 ) 4.5 3.0 2.0 ! 17.56300-31.41600 : I135CG2-I135CG1 assign ( resid 29 and name CA ) ( resid 29 and name CB ) 4.5 3.0 2.0 ! 58.30000-30.96800 : E29CA-E29CB assign ( resid 25 and name CG ) ( resid 25 and name CE ) 4.5 3.0 2.0 ! 25.12700-41.95000 : K25CG-K25CE assign ( resid 107 and name CG2 ) ( resid 107 and name CB ) 4.5 3.0 2.0 ! 22.82900-68.86800 : T107CG2-T107CB assign ( resid 164 and name CE* ) ( resid 164 and name CG ) 4.5 3.0 2.0 ! 115.60513-126.75883 : Y164CE*-Y164CG assign ( resid 117 and name CE3 ) ( resid 117 and name CB ) 4.5 3.0 2.0 ! 121.71900-27.46303 : W117CE3-W117CB assign ( resid 17 and name CA ) ( resid 17 and name CG ) 4.5 3.0 2.0 ! 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127.58528-121.63199 : W23CD1-W23CE3 assign ( resid 131 and name CB ) ( resid 131 and name CG ) 4.5 3.0 2.0 ! 32.24900-25.66000 : K131CB-K131CG assign ( resid 57 and name CA ) ( resid 57 and name CB ) 4.5 3.0 2.0 ! 54.80054-37.77894 : N57CA-N57CB assign ( resid 121 and name CB ) ( resid 121 and name CA ) 4.5 3.0 2.0 ! 39.60831-49.25563 : N121CB-N121CA assign ( resid 55 and name CA ) ( resid 55 and name CB ) 4.5 3.0 2.0 ! 60.46000-32.97200 : M55CA-M55CB assign ( resid 98 and name CA ) ( resid 98 and name CG ) 4.5 3.0 2.0 ! 54.31933-36.66130 : E98CA-E98CG assign ( resid 82 and name CB ) ( resid 82 and name CZ ) 4.5 3.0 2.0 ! 30.81800-159.42600 : R82CB-R82CZ assign ( resid 131 and name CG ) ( resid 131 and name CE ) 4.5 3.0 2.0 ! 25.64746-40.97337 : K131CG-K131CE assign ( resid 97 and name CG ) ( resid 97 and name CB ) 4.5 3.0 2.0 ! 26.95900-29.99000 : R97CG-R97CB assign ( resid 15 and name CD1 ) ( resid 15 and name CG1 ) 4.5 3.0 2.0 ! 15.02400-28.49000 : I15CD1-I15CG1 assign ( resid 162 and name CB ) ( resid 162 and name CA ) 4.5 3.0 2.0 ! 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67.87000-34.78400 : I37CA-I37CB assign ( resid 192 and name CB ) ( resid 192 and name CA ) 4.5 3.0 2.0 ! 28.38900-58.47800 : Q192CB-Q192CA assign ( resid 141 and name CG2 ) ( resid 141 and name CD1 ) 4.5 3.0 2.0 ! 17.96900-14.98800 : I141CG2-I141CD1 assign ( resid 155 and name CB ) ( resid 155 and name CA ) 4.5 3.0 2.0 ! 27.28700-55.97700 : Q155CB-Q155CA assign ( resid 19 and name CG2 ) ( resid 19 and name CB ) 4.5 3.0 2.0 ! 23.34800-68.16400 : T19CG2-T19CB assign ( resid 134 and name CA ) ( resid 134 and name CD1 ) 4.5 3.0 2.0 ! 65.13700-14.84200 : I134CA-I134CD1 assign ( resid 129 and name CB ) ( resid 129 and name CA ) 4.5 3.0 2.0 ! 38.19800-65.47000 : I129CB-I129CA assign ( resid 53 and name CA ) ( resid 53 and name CB ) 4.5 3.0 2.0 ! 56.98900-38.42900 : N53CA-N53CB assign ( resid 134 and name CG1 ) ( resid 134 and name CA ) 4.5 3.0 2.0 ! 29.84900-65.13700 : I134CG1-I134CA assign ( resid 23 and name CE3 ) ( resid 23 and name CB ) 4.5 3.0 2.0 ! 121.63305-30.21270 : W23CE3-W23CB assign ( resid 74 and name CA ) ( resid 74 and name CB ) 4.5 3.0 2.0 ! 55.90266-37.62371 : N74CA-N74CB assign ( resid 75 and name CD ) ( resid 75 and name CA ) 4.5 3.0 2.0 ! 183.73600-59.33800 : E75CD-E75CA assign ( resid 85 and name CG ) ( resid 85 and name CB ) 4.5 3.0 2.0 ! 27.50400-32.11300 : P85CG-P85CB assign ( resid 133 and name CE2 ) ( resid 133 and name CD1 ) 4.5 3.0 2.0 ! 138.76673-124.90369 : W133CE2-W133CD1 assign ( resid 164 and name CA ) ( resid 164 and name CG ) 4.5 3.0 2.0 ! 59.47876-126.85884 : Y164CA-Y164CG assign ( resid 179 and name CB ) ( resid 179 and name CA ) 4.5 3.0 2.0 ! 28.61100-58.54100 : Q179CB-Q179CA assign ( resid 66 and name CB ) ( resid 66 and name CA ) 4.5 3.0 2.0 ! 29.47200-56.43500 : M66CB-M66CA assign ( resid 134 and name CG2 ) ( resid 134 and name CA ) 4.5 3.0 2.0 ! 17.80700-65.13700 : I134CG2-I134CA assign ( resid 25 and name CG ) ( resid 25 and name CA ) 4.5 3.0 2.0 ! 25.12700-60.16000 : K25CG-K25CA assign ( resid 75 and name CB ) ( resid 75 and name CA ) 4.5 3.0 2.0 ! 29.37100-59.26800 : E75CB-E75CA assign ( resid 1 and name CB ) ( resid 1 and name CA ) 4.5 3.0 2.0 ! 33.18100-62.44000 : P1CB-P1CA assign ( resid 80 and name CD2 ) ( resid 80 and name CA ) 4.5 3.0 2.0 ! 129.23528-61.78404 : W80CD2-W80CA assign ( resid 166 and name CB ) ( resid 166 and name CA ) 4.5 3.0 2.0 ! 40.44000-58.25000 : D166CB-D166CA assign ( resid 196 and name CD ) ( resid 196 and name CA ) 4.5 3.0 2.0 ! 50.02900-66.73100 : P196CD-P196CA assign ( resid 115 and name CG1 ) ( resid 115 and name CD1 ) 4.5 3.0 2.0 ! 29.21900-14.23700 : I115CG1-I115CD1 assign ( resid 140 and name CB ) ( resid 140 and name CD ) 4.5 3.0 2.0 ! 32.09300-29.80400 : K140CB-K140CD assign ( resid 201 and name CG2 ) ( resid 201 and name CD1 ) 4.5 3.0 2.0 ! 18.70800-14.40600 : I201CG2-I201CD1 assign ( resid 82 and name CG ) ( resid 82 and name CA ) 4.5 3.0 2.0 ! 28.25200-59.24100 : R82CG-R82CA assign ( resid 79 and name CG ) ( resid 79 and name CA ) 4.5 3.0 2.0 ! 34.87800-58.55900 : E79CG-E79CA assign ( resid 90 and name CA ) ( resid 90 and name CD ) 4.5 3.0 2.0 ! 63.03500-49.92000 : P90CA-P90CD assign ( resid 186 and name CA ) ( resid 186 and name CG2 ) 4.5 3.0 2.0 ! 66.75200-21.76200 : T186CA-T186CG2 assign ( resid 91 and name CA ) ( resid 91 and name CD1 ) 4.5 3.0 2.0 ! 60.12900-15.32000 : I91CA-I91CD1 assign ( resid 129 and name CA ) ( resid 129 and name CG1 ) 4.5 3.0 2.0 ! 65.27200-28.48900 : I129CA-I129CG1 assign ( resid 80 and name CD2 ) ( resid 80 and name CG ) 4.5 3.0 2.0 ! 129.22000-110.24400 : W80CD2-W80CG assign ( resid 23 and name CG ) ( resid 23 and name CD* ) 4.5 3.0 2.0 ! 111.72100-130.16100 : W23CG-W23CD* assign ( resid 29 and name CA ) ( resid 29 and name CG ) 4.5 3.0 2.0 ! 58.30000-36.91200 : E29CA-E29CG assign ( resid 133 and name CE2 ) ( resid 133 and name CE3 ) 4.5 3.0 2.0 ! 138.76082-119.38982 : W133CE2-W133CE3 assign ( resid 135 and name CG2 ) ( resid 135 and name CD1 ) 4.5 3.0 2.0 ! 17.56300-13.68000 : I135CG2-I135CD1 assign ( resid 207 and name CA ) ( resid 207 and name CG ) 4.5 3.0 2.0 ! 63.97200-27.55000 : P207CA-P207CG assign ( resid 119 and name CA ) ( resid 119 and name CG2 ) 4.5 3.0 2.0 ! 60.98000-21.38300 : T119CA-T119CG2 assign ( resid 188 and name CA ) ( resid 188 and name CB ) 4.5 3.0 2.0 ! 64.71883-69.30015 : T188CA-T188CB assign ( resid 140 and name CD ) ( resid 140 and name CA ) 4.5 3.0 2.0 ! 29.80400-60.14000 : K140CD-K140CA assign ( resid 43 and name C ) ( resid 43 and name CB ) 4.6 2.6 2.6 ! 175.97300-42.00900 : L43C-L43CB assign ( resid 210 and name CG2 ) ( resid 210 and name CB ) 4.5 3.0 2.0 ! 22.27800-70.50200 : T210CG2-T210CB assign ( resid 82 and name CG ) ( resid 82 and name CB ) 4.5 3.0 2.0 ! 28.25200-30.81800 : R82CG-R82CB assign ( resid 55 and name CA ) ( resid 55 and name CE ) 4.5 3.0 2.0 ! 60.42864-15.86875 : M55CA-M55CE assign ( resid 38 and name CB ) ( resid 38 and name CG ) 4.5 3.0 2.0 ! 30.61200-28.24200 : P38CB-P38CG assign ( resid 75 and name CG ) ( resid 75 and name CB ) 4.5 3.0 2.0 ! 35.94300-29.37100 : E75CG-E75CB assign ( resid 153 and name CD1 ) ( resid 153 and name CA ) 4.5 3.0 2.0 ! 9.80000-58.98300 : I153CD1-I153CA assign ( resid 111 and name CD2 ) ( resid 111 and name CA ) 4.5 3.0 2.0 ! 25.19200-57.98000 : L111CD2-L111CA assign ( resid 114 and name CB ) ( resid 114 and name CG ) 4.5 3.0 2.0 ! 28.27800-32.92200 : Q114CB-Q114CG assign ( resid 216 and name CB ) ( resid 216 and name CG2 ) 4.5 3.0 2.0 ! 68.80600-21.75900 : T216CB-T216CG2 assign ( resid 23 and name CD1 ) ( resid 23 and name CB ) 4.5 3.0 2.0 ! 127.42235-30.15972 : W23CD1-W23CB assign ( resid 159 and name CB ) ( resid 159 and name CA ) 4.5 3.0 2.0 ! 32.36000-53.61100 : E159CB-E159CA assign ( resid 30 and name CA ) ( resid 30 and name CE ) 4.5 3.0 2.0 ! 55.79200-42.02300 : K30CA-K30CE assign ( resid 7 and name CB ) ( resid 7 and name CA ) 4.5 3.0 2.0 ! 28.04200-59.97100 : Q7CB-Q7CA assign ( resid 158 and name CG ) ( resid 158 and name CE ) 4.5 3.0 2.0 ! 25.07000-42.09700 : K158CG-K158CE assign ( resid 171 and name CB ) ( resid 171 and name CG2 ) 4.5 3.0 2.0 ! 68.84600-21.52100 : T171CB-T171CG2 assign ( resid 117 and name CD1 ) ( resid 117 and name CE2 ) 4.5 3.0 2.0 ! 125.39849-139.10783 : W117CD1-W117CE2 assign ( resid 188 and name CG2 ) ( resid 188 and name CB ) 4.5 3.0 2.0 ! 21.81900-69.49800 : T188CG2-T188CB assign ( resid 144 and name CG ) ( resid 144 and name CB ) 4.5 3.0 2.0 ! 30.24900-32.80100 : M144CG-M144CB assign ( resid 13 and name CA ) ( resid 13 and name CG ) 4.5 3.0 2.0 ! 54.06800-33.21000 : Q13CA-Q13CG assign ( resid 121 and name CB ) ( resid 121 and name CG ) 4.5 3.0 2.0 ! 40.03000-177.62800 : N121CB-N121CG assign ( resid 73 and name CG2 ) ( resid 73 and name CD1 ) 4.5 3.0 2.0 ! 18.33900-14.77700 : I73CG2-I73CD1 assign ( resid 28 and name CB ) ( resid 28 and name CA ) 4.5 3.0 2.0 ! 29.50600-59.08300 : E28CB-E28CA assign ( resid 141 and name CG1 ) ( resid 141 and name CD1 ) 4.5 3.0 2.0 ! 29.89000-14.98800 : I141CG1-I141CD1 assign ( resid 199 and name CA ) ( resid 199 and name CB ) 4.5 3.0 2.0 ! 60.91100-32.34000 : K199CA-K199CB assign ( resid 147 and name CB ) ( resid 147 and name CG ) 4.5 3.0 2.0 ! 32.64600-28.67000 : P147CB-P147CG assign ( resid 108 and name CA ) ( resid 108 and name CG2 ) 4.5 3.0 2.0 ! 60.95200-20.44100 : T108CA-T108CG2 assign ( resid 73 and name CD1 ) ( resid 73 and name CG1 ) 4.5 3.0 2.0 ! 14.77700-29.72800 : I73CD1-I73CG1 assign ( resid 210 and name CA ) ( resid 210 and name CB ) 4.5 3.0 2.0 ! 60.22900-70.50200 : T210CA-T210CB assign ( resid 195 and name CA ) ( resid 195 and name CB ) 4.5 3.0 2.0 ! 51.54565-35.57873 : N195CA-N195CB assign ( resid 38 and name CD ) ( resid 38 and name CA ) 4.5 3.0 2.0 ! 49.06900-64.94400 : P38CD-P38CA assign ( resid 216 and name CG2 ) ( resid 216 and name CA ) 4.5 3.0 2.0 ! 21.75900-66.44000 : T216CG2-T216CA assign ( resid 201 and name CG1 ) ( resid 201 and name CD1 ) 4.5 3.0 2.0 ! 29.55100-14.40600 : I201CG1-I201CD1 assign ( resid 140 and name CA ) ( resid 140 and name CB ) 4.5 3.0 2.0 ! 60.14000-32.09300 : K140CA-K140CB assign ( resid 200 and name CA ) ( resid 200 and name CG2 ) 4.5 3.0 2.0 ! 66.52900-21.76700 : T200CA-T200CG2 assign ( resid 153 and name CA ) ( resid 153 and name CG2 ) 4.5 3.0 2.0 ! 58.98300-17.04900 : I153CA-I153CG2 assign ( resid 200 and name CG2 ) ( resid 200 and name CB ) 4.5 3.0 2.0 ! 21.76700-68.80800 : T200CG2-T200CB assign ( resid 96 and name CA ) ( resid 96 and name CG ) 4.5 3.0 2.0 ! 54.79700-30.50800 : M96CA-M96CG assign ( resid 23 and name CA ) ( resid 23 and name CD2 ) 4.5 3.0 2.0 ! 58.46170-130.39234 : W23CA-W23CD2 assign ( resid 18 and name CB ) ( resid 18 and name CG ) 4.5 3.0 2.0 ! 30.24100-27.72700 : R18CB-R18CG assign ( resid 197 and name CA ) ( resid 197 and name CB ) 4.5 3.0 2.0 ! 57.27900-40.36100 : D197CA-D197CB assign ( resid 125 and name CG ) ( resid 125 and name CA ) 4.5 3.0 2.0 ! 27.41300-63.02100 : P125CG-P125CA assign ( resid 161 and name CG ) ( resid 161 and name CA ) 4.5 3.0 2.0 ! 138.74909-62.73849 : F161CG-F161CA assign ( resid 215 and name CA ) ( resid 215 and name CB ) 4.5 3.0 2.0 ! 59.05200-32.42300 : M215CA-M215CB assign ( resid 107 and name CA ) ( resid 107 and name CB ) 4.5 3.0 2.0 ! 64.11400-68.86800 : T107CA-T107CB assign ( resid 37 and name CA ) ( resid 37 and name CG2 ) 4.5 3.0 2.0 ! 67.78000-18.73900 : I37CA-I37CG2 assign ( resid 104 and name CD1 ) ( resid 104 and name CG2 ) 4.5 3.0 2.0 ! 11.07300-17.09000 : I104CD1-I104CG2 assign ( resid 2 and name CG2 ) ( resid 2 and name CA ) 4.5 3.0 2.0 ! 17.41800-61.96000 : I2CG2-I2CA assign ( resid 213 and name CA ) ( resid 213 and name CG ) 4.5 3.0 2.0 ! 59.04000-37.13800 : E213CA-E213CG assign ( resid 54 and name CB ) ( resid 54 and name CA ) 4.5 3.0 2.0 ! 68.41800-67.52100 : T54CB-T54CA assign ( resid 129 and name CA ) ( resid 129 and name CD1 ) 4.5 3.0 2.0 ! 65.27200-15.08800 : I129CA-I129CD1 assign ( resid 63 and name CA ) ( resid 63 and name CG ) 4.5 3.0 2.0 ! 60.09300-32.93000 : Q63CA-Q63CG assign ( resid 115 and name CG2 ) ( resid 115 and name CG1 ) 4.5 3.0 2.0 ! 17.27000-29.21900 : I115CG2-I115CG1 assign ( resid 35 and name CB ) ( resid 35 and name CG ) 4.5 3.0 2.0 ! 29.91200-36.56800 : E35CB-E35CG assign ( resid 28 and name CB ) ( resid 28 and name CG ) 4.5 3.0 2.0 ! 29.50600-37.28000 : E28CB-E28CG assign ( resid 104 and name CG2 ) ( resid 104 and name CG1 ) 4.5 3.0 2.0 ! 17.09000-30.68700 : I104CG2-I104CG1 assign ( resid 68 and name CB ) ( resid 68 and name CA ) 4.5 3.0 2.0 ! 32.70900-58.29100 : M68CB-M68CA assign ( resid 90 and name CB ) ( resid 90 and name CG ) 4.5 3.0 2.0 ! 32.18900-27.17900 : P90CB-P90CG assign ( resid 128 and name CB ) ( resid 128 and name CA ) 4.5 3.0 2.0 ! 29.56700-58.45000 : E128CB-E128CA assign ( resid 34 and name CB ) ( resid 34 and name CG ) 4.5 3.0 2.0 ! 31.68100-28.15700 : P34CB-P34CG assign ( resid 98 and name CB ) ( resid 98 and name CG ) 4.5 3.0 2.0 ! 29.50000-36.78900 : E98CB-E98CG assign ( resid 212 and name CB ) ( resid 212 and name CG ) 4.5 3.0 2.0 ! 29.93300-36.73700 : E212CB-E212CG assign ( resid 30 and name CE ) ( resid 30 and name CB ) 4.5 3.0 2.0 ! 42.02300-33.15900 : K30CE-K30CB assign ( resid 124 and name CG1 ) ( resid 124 and name CG2 ) 4.5 3.0 2.0 ! 27.52400-17.22700 : I124CG1-I124CG2 assign ( resid 71 and name CB ) ( resid 71 and name CG ) 4.5 3.0 2.0 ! 29.71600-36.82000 : E71CB-E71CG assign ( resid 25 and name CD ) ( resid 25 and name CB ) 4.5 3.0 2.0 ! 29.47200-32.18600 : K25CD-K25CB assign ( resid 48 and name CA ) ( resid 48 and name CG2 ) 4.5 3.0 2.0 ! 59.86300-22.05100 : T48CA-T48CG2 assign ( resid 25 and name CG ) ( resid 25 and name CD ) 4.5 3.0 2.0 ! 25.12700-29.47200 : K25CG-K25CD assign ( resid 118 and name CB ) ( resid 118 and name CA ) 4.5 3.0 2.0 ! 35.21900-59.63100 : M118CB-M118CA assign ( resid 199 and name CD ) ( resid 199 and name CA ) 4.5 3.0 2.0 ! 29.86300-60.91100 : K199CD-K199CA assign ( resid 111 and name C ) ( resid 111 and name CG ) 4.6 2.6 2.6 ! 178.14600-26.66000 : L111C-L111CG assign ( resid 91 and name CA ) ( resid 91 and name CG2 ) 4.5 3.0 2.0 ! 60.12900-18.01300 : I91CA-I91CG2 assign ( resid 79 and name CD ) ( resid 79 and name CA ) 4.5 3.0 2.0 ! 184.14900-58.49100 : E79CD-E79CA assign ( resid 30 and name CD ) ( resid 30 and name CE ) 4.5 3.0 2.0 ! 27.06004-42.26176 : K30CD-K30CE assign ( resid 112 and name CA ) ( resid 112 and name CB ) 4.5 3.0 2.0 ! 59.71800-28.06700 : Q112CA-Q112CB assign ( resid 210 and name CG2 ) ( resid 210 and name CA ) 4.5 3.0 2.0 ! 22.27800-60.22900 : T210CG2-T210CA assign ( resid 132 and name CB ) ( resid 132 and name CG ) 4.5 3.0 2.0 ! 29.88800-28.40900 : R132CB-R132CG assign ( resid 23 and name CZ2 ) ( resid 23 and name CA ) 4.5 3.0 2.0 ! 113.28700-58.50400 : W23CZ2-W23CA assign ( resid 148 and name CB ) ( resid 148 and name CA ) 4.5 3.0 2.0 ! 70.70200-61.72100 : T148CB-T148CA assign ( resid 154 and name CA ) ( resid 154 and name CB ) 4.5 3.0 2.0 ! 54.33700-33.14700 : R154CA-R154CB assign ( resid 135 and name CG1 ) ( resid 135 and name CA ) 4.5 3.0 2.0 ! 31.41600-66.48800 : I135CG1-I135CA assign ( resid 85 and name CA ) ( resid 85 and name CG ) 4.5 3.0 2.0 ! 63.04000-27.50400 : P85CA-P85CG assign ( resid 4 and name CA ) ( resid 4 and name CB ) 4.5 3.0 2.0 ! 54.38900-29.89800 : Q4CA-Q4CB assign ( resid 202 and name CA ) ( resid 202 and name CD1 ) 4.5 3.0 2.0 ! 57.18700-23.21700 : L202CA-L202CD1 assign ( resid 201 and name CG2 ) ( resid 201 and name CA ) 4.5 3.0 2.0 ! 18.70800-64.71300 : I201CG2-I201CA assign ( resid 58 and name CG2 ) ( resid 58 and name CB ) 4.5 3.0 2.0 ! 23.52700-69.69800 : T58CG2-T58CB assign ( resid 10 and name CG ) ( resid 10 and name CB ) 4.5 3.0 2.0 ! 34.60800-31.43600 : M10CG-M10CB assign ( resid 96 and name CB ) ( resid 96 and name CG ) 4.5 3.0 2.0 ! 34.75800-30.50800 : M96CB-M96CG assign ( resid 7 and name CB ) ( resid 7 and name CG ) 4.5 3.0 2.0 ! 28.04200-33.60100 : Q7CB-Q7CG assign ( resid 37 and name CG2 ) ( resid 37 and name CD1 ) 4.5 3.0 2.0 ! 18.73900-13.71700 : I37CG2-I37CD1 assign ( resid 115 and name CG2 ) ( resid 115 and name CA ) 4.5 3.0 2.0 ! 17.27000-65.60900 : I115CG2-I115CA assign ( resid 202 and name CG ) ( resid 202 and name CB ) 4.5 3.0 2.0 ! 27.79800-41.57900 : L202CG-L202CB assign ( resid 70 and name CG ) ( resid 70 and name CE ) 4.5 3.0 2.0 ! 25.29044-41.74951 : K70CG-K70CE assign ( resid 125 and name CD ) ( resid 125 and name CA ) 4.5 3.0 2.0 ! 51.36000-63.19800 : P125CD-P125CA assign ( resid 70 and name CG ) ( resid 70 and name CB ) 4.5 3.0 2.0 ! 25.36200-31.89000 : K70CG-K70CB assign ( resid 150 and name CG1 ) ( resid 150 and name CA ) 4.5 3.0 2.0 ! 28.64300-60.61100 : I150CG1-I150CA assign ( resid 80 and name CZ2 ) ( resid 80 and name CA ) 4.5 3.0 2.0 ! 112.66278-61.72466 : W80CZ2-W80CA assign ( resid 17 and name CB ) ( resid 17 and name CA ) 4.5 3.0 2.0 ! 31.96800-65.56100 : P17CB-P17CA assign ( resid 154 and name CB ) ( resid 154 and name CG ) 4.5 3.0 2.0 ! 33.14700-27.24200 : R154CB-R154CG assign ( resid 110 and name CB ) ( resid 110 and name CA ) 4.5 3.0 2.0 ! 71.36000-59.38000 : T110CB-T110CA assign ( resid 129 and name CG1 ) ( resid 129 and name CG2 ) 4.5 3.0 2.0 ! 28.48900-18.25800 : I129CG1-I129CG2 assign ( resid 80 and name CD1 ) ( resid 80 and name CE3 ) 4.5 3.0 2.0 ! 126.56010-120.09978 : W80CD1-W80CE3 assign ( resid 67 and name CA ) ( resid 67 and name CG ) 4.5 3.0 2.0 ! 58.30200-32.66900 : Q67CA-Q67CG assign ( resid 13 and name CG ) ( resid 13 and name CB ) 4.5 3.0 2.0 ! 33.21000-32.29800 : Q13CG-Q13CB assign ( resid 38 and name CA ) ( resid 38 and name CB ) 4.5 3.0 2.0 ! 65.04600-30.61200 : P38CA-P38CB assign ( resid 56 and name CB ) ( resid 56 and name CG ) 4.5 3.0 2.0 ! 41.57100-26.86800 : L56CB-L56CG assign ( resid 1 and name CG ) ( resid 1 and name CA ) 4.5 3.0 2.0 ! 24.82600-62.44000 : P1CG-P1CA assign ( resid 93 and name CA ) ( resid 93 and name CG ) 4.5 3.0 2.0 ! 64.17100-27.39100 : P93CA-P93CG assign ( resid 196 and name CG ) ( resid 196 and name CB ) 4.5 3.0 2.0 ! 28.44300-32.53800 : P196CG-P196CB assign ( resid 124 and name CG1 ) ( resid 124 and name CD1 ) 4.5 3.0 2.0 ! 27.52400-14.61300 : I124CG1-I124CD1 assign ( resid 1 and name CA ) ( resid 1 and name CD ) 4.5 3.0 2.0 ! 62.41000-50.36800 : P1CA-P1CD assign ( resid 151 and name CD1 ) ( resid 151 and name CA ) 4.5 3.0 2.0 ! 23.56740-56.67471 : L151CD1-L151CA assign ( resid 135 and name CA ) ( resid 135 and name CG2 ) 4.5 3.0 2.0 ! 66.48800-17.56300 : I135CA-I135CG2 assign ( resid 130 and name CE* ) ( resid 130 and name CA ) 4.5 3.0 2.0 ! 116.37278-56.08041 : Y130CE*-Y130CA assign ( resid 155 and name CA ) ( resid 155 and name CG ) 4.5 3.0 2.0 ! 55.66981-32.59432 : Q155CA-Q155CG assign ( resid 80 and name CD1 ) ( resid 80 and name CD2 ) 4.5 3.0 2.0 ! 126.58045-129.20483 : W80CD1-W80CD2 assign ( resid 159 and name CA ) ( resid 159 and name CG ) 4.5 3.0 2.0 ! 53.55353-35.06451 : E159CA-E159CG assign ( resid 132 and name CB ) ( resid 132 and name CA ) 4.5 3.0 2.0 ! 29.88800-60.13000 : R132CB-R132CA assign ( resid 152 and name CB ) ( resid 152 and name CA ) 4.5 3.0 2.0 ! 42.03800-54.16900 : D152CB-D152CA assign ( resid 54 and name CG2 ) ( resid 54 and name CA ) 4.5 3.0 2.0 ! 23.66800-67.52100 : T54CG2-T54CA assign ( resid 43 and name C ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! 176.07700-27.11100 : L43C-L43CG assign ( resid 18 and name CZ ) ( resid 18 and name CA ) 4.5 3.0 2.0 ! 159.08900-59.58200 : R18CZ-R18CA assign ( resid 213 and name CG ) ( resid 213 and name CB ) 4.5 3.0 2.0 ! 37.13800-29.25000 : E213CG-E213CB assign ( resid 7 and name CG ) ( resid 7 and name CA ) 4.5 3.0 2.0 ! 33.60100-59.97100 : Q7CG-Q7CA assign ( resid 143 and name CD ) ( resid 143 and name CA ) 4.5 3.0 2.0 ! 42.04900-57.97400 : R143CD-R143CA assign ( resid 160 and name CB ) ( resid 160 and name CA ) 4.5 3.0 2.0 ! 32.70500-63.47600 : P160CB-P160CA assign ( resid 153 and name CG2 ) ( resid 153 and name CG1 ) 4.5 3.0 2.0 ! 17.04900-26.88300 : I153CG2-I153CG1 assign ( resid 119 and name CB ) ( resid 119 and name CA ) 4.5 3.0 2.0 ! 70.02900-60.90200 : T119CB-T119CA assign ( resid 133 and name CA ) ( resid 133 and name CD2 ) 4.5 3.0 2.0 ! 58.27637-130.05091 : W133CA-W133CD2 assign ( resid 72 and name CA ) ( resid 72 and name CG2 ) 4.5 3.0 2.0 ! 67.33000-21.55000 : T72CA-T72CG2 assign ( resid 153 and name CG1 ) ( resid 153 and name CA ) 4.5 3.0 2.0 ! 26.88300-58.98300 : I153CG1-I153CA assign ( resid 108 and name CB ) ( resid 108 and name CG2 ) 4.5 3.0 2.0 ! 69.31400-20.44100 : T108CB-T108CG2 assign ( resid 131 and name CE ) ( resid 131 and name CD ) 4.5 3.0 2.0 ! 41.57389-30.09645 : K131CE-K131CD assign ( resid 15 and name CG2 ) ( resid 15 and name CG1 ) 4.5 3.0 2.0 ! 16.99806-28.71995 : I15CG2-I15CG1 assign ( resid 50 and name CG ) ( resid 50 and name CB ) 4.5 3.0 2.0 ! 34.35300-29.30000 : Q50CG-Q50CB assign ( resid 111 and name CG ) ( resid 111 and name CB ) 4.5 3.0 2.0 ! 26.67300-40.94700 : L111CG-L111CB assign ( resid 97 and name CA ) ( resid 97 and name CG ) 4.5 3.0 2.0 ! 55.35900-26.95900 : R97CA-R97CG assign ( resid 118 and name CA ) ( resid 118 and name CE ) 4.5 3.0 2.0 ! 59.63100-15.10200 : M118CA-M118CE assign ( resid 50 and name CB ) ( resid 50 and name CA ) 4.5 3.0 2.0 ! 29.30000-60.39300 : Q50CB-Q50CA assign ( resid 17 and name CB ) ( resid 17 and name CG ) 4.5 3.0 2.0 ! 31.96800-28.01200 : P17CB-P17CG assign ( resid 80 and name CE2 ) ( resid 80 and name CB ) 4.5 3.0 2.0 ! 139.02348-27.97738 : W80CE2-W80CB assign ( resid 118 and name CG ) ( resid 118 and name CE ) 4.5 3.0 2.0 ! 32.61360-14.90933 : M118CG-M118CE assign ( resid 133 and name CG ) ( resid 133 and name CA ) 4.5 3.0 2.0 ! 110.61012-58.21917 : W133CG-W133CA assign ( resid 131 and name CD ) ( resid 131 and name CB ) 4.5 3.0 2.0 ! 29.79800-32.24900 : K131CD-K131CB assign ( resid 43 and name CA ) ( resid 43 and name CD2 ) 4.5 3.0 2.0 ! 55.94923-22.47223 : L43CA-L43CD2 assign ( resid 85 and name CD ) ( resid 85 and name CA ) 4.5 3.0 2.0 ! 50.04800-63.00900 : P85CD-P85CA assign ( resid 200 and name CA ) ( resid 200 and name CB ) 4.5 3.0 2.0 ! 66.52900-68.80800 : T200CA-T200CB assign ( resid 59 and name CB ) ( resid 59 and name CA ) 4.5 3.0 2.0 ! 32.95600-62.30500 : V59CB-V59CA assign ( resid 196 and name CG ) ( resid 196 and name CA ) 4.5 3.0 2.0 ! 28.44300-66.77700 : P196CG-P196CA assign ( resid 185 and name CB ) ( resid 185 and name CA ) 4.5 3.0 2.0 ! 31.30100-59.43200 : M185CB-M185CA assign ( resid 70 and name CD ) ( resid 70 and name CA ) 4.5 3.0 2.0 ! 29.07300-60.03000 : K70CD-K70CA assign ( resid 76 and name CB ) ( resid 76 and name CA ) 4.5 3.0 2.0 ! 29.18600-58.86700 : E76CB-E76CA assign ( resid 113 and name CB ) ( resid 113 and name CG ) 4.5 3.0 2.0 ! 29.04800-37.37100 : E113CB-E113CG assign ( resid 15 and name CA ) ( resid 15 and name CG1 ) 4.5 3.0 2.0 ! 62.11000-28.49000 : I15CA-I15CG1 assign ( resid 118 and name CA ) ( resid 118 and name CG ) 4.5 3.0 2.0 ! 59.63100-32.99700 : M118CA-M118CG assign ( resid 211 and name C ) ( resid 211 and name CB ) 4.6 2.6 2.6 ! 178.63100-40.50500 : L211C-L211CB assign ( resid 118 and name CB ) ( resid 118 and name CE ) 4.5 3.0 2.0 ! 34.98859-14.97142 : M118CB-M118CE assign ( resid 138 and name CB ) ( resid 138 and name CG ) 4.5 3.0 2.0 ! 42.26100-26.25100 : L138CB-L138CG assign ( resid 190 and name C ) ( resid 190 and name CB ) 4.6 2.6 2.6 ! 177.71900-41.39200 : L190C-L190CB assign ( resid 13 and name CB ) ( resid 13 and name CA ) 4.5 3.0 2.0 ! 32.29800-54.06800 : Q13CB-Q13CA assign ( resid 15 and name CG2 ) ( resid 15 and name CA ) 4.5 3.0 2.0 ! 16.85700-62.11000 : I15CG2-I15CA assign ( resid 201 and name CA ) ( resid 201 and name CG1 ) 4.5 3.0 2.0 ! 64.71300-29.55100 : I201CA-I201CG1 assign ( resid 124 and name CD1 ) ( resid 124 and name CB ) 4.5 3.0 2.0 ! 14.75700-38.74900 : I124CD1-I124CB assign ( resid 140 and name CD ) ( resid 140 and name CG ) 4.5 3.0 2.0 ! 29.80400-25.20400 : K140CD-K140CG assign ( resid 182 and name CD ) ( resid 182 and name CA ) 4.5 3.0 2.0 ! 29.90100-60.91000 : K182CD-K182CA assign ( resid 25 and name CB ) ( resid 25 and name CA ) 4.5 3.0 2.0 ! 32.18600-60.16000 : K25CB-K25CA assign ( resid 51 and name CA ) ( resid 51 and name CB ) 4.5 3.0 2.0 ! 57.75100-41.21200 : D51CA-D51CB assign ( resid 154 and name CA ) ( resid 154 and name CG ) 4.5 3.0 2.0 ! 54.33700-27.24200 : R154CA-R154CG assign ( resid 81 and name CA ) ( resid 81 and name CB ) 4.5 3.0 2.0 ! 57.27100-40.01100 : D81CA-D81CB assign ( resid 99 and name CG ) ( resid 99 and name CB ) 4.5 3.0 2.0 ! 26.39400-30.39400 : P99CG-P99CB assign ( resid 95 and name CG ) ( resid 95 and name CA ) 4.5 3.0 2.0 ! 33.84900-54.41700 : Q95CG-Q95CA assign ( resid 124 and name CG1 ) ( resid 124 and name CA ) 4.5 3.0 2.0 ! 27.52400-59.24900 : I124CG1-I124CA assign ( resid 23 and name CD1 ) ( resid 23 and name CA ) 4.5 3.0 2.0 ! 127.50200-58.43439 : W23CD1-W23CA assign ( resid 45 and name CG ) ( resid 45 and name CB ) 4.5 3.0 2.0 ! 34.87700-28.94100 : E45CG-E45CB assign ( resid 134 and name CG1 ) ( resid 134 and name CG2 ) 4.5 3.0 2.0 ! 29.84900-17.80700 : I134CG1-I134CG2 assign ( resid 30 and name CA ) ( resid 30 and name CB ) 4.5 3.0 2.0 ! 55.74743-32.88925 : K30CA-K30CB assign ( resid 23 and name CD2 ) ( resid 23 and name CZ2 ) 4.5 3.0 2.0 ! 130.08449-113.30574 : W23CD2-W23CZ2 assign ( resid 158 and name CA ) ( resid 158 and name CB ) 4.5 3.0 2.0 ! 54.11200-32.52800 : K158CA-K158CB assign ( resid 104 and name CG1 ) ( resid 104 and name CA ) 4.5 3.0 2.0 ! 30.68700-65.78000 : I104CG1-I104CA assign ( resid 91 and name CG1 ) ( resid 91 and name CA ) 4.5 3.0 2.0 ! 28.44300-60.12900 : I91CG1-I91CA assign ( resid 19 and name CB ) ( resid 19 and name CA ) 4.5 3.0 2.0 ! 68.16400-66.92600 : T19CB-T19CA assign ( resid 131 and name CG ) ( resid 131 and name CD ) 4.5 3.0 2.0 ! 25.66000-29.79800 : K131CG-K131CD assign ( resid 201 and name CB ) ( resid 201 and name CD1 ) 4.5 3.0 2.0 ! 38.07100-14.57500 : I201CB-I201CD1 assign ( resid 157 and name CA ) ( resid 157 and name CB ) 4.5 3.0 2.0 ! 65.64700-32.13000 : P157CA-P157CB assign ( resid 70 and name CG ) ( resid 70 and name CD ) 4.5 3.0 2.0 ! 25.36200-29.07300 : K70CG-K70CD assign ( resid 113 and name CG ) ( resid 113 and name CA ) 4.5 3.0 2.0 ! 37.37100-58.86200 : E113CG-E113CA assign ( resid 133 and name CD1 ) ( resid 133 and name CD2 ) 4.5 3.0 2.0 ! 124.95200-129.95800 : W133CD1-W133CD2 assign ( resid 140 and name CG ) ( resid 140 and name CE ) 4.5 3.0 2.0 ! 25.20400-42.05700 : K140CG-K140CE assign ( resid 84 and name C ) ( resid 84 and name CD2 ) 4.6 2.6 2.6 ! 170.79288-119.01294 : H84C-H84CD2 assign ( resid 139 and name CA ) ( resid 139 and name CB ) 4.5 3.0 2.0 ! 57.04100-38.78900 : N139CA-N139CB assign ( resid 135 and name CD1 ) ( resid 135 and name CG1 ) 4.5 3.0 2.0 ! 13.68000-31.41600 : I135CD1-I135CG1 assign ( resid 23 and name CD1 ) ( resid 23 and name CE2 ) 4.5 3.0 2.0 ! 127.63542-139.36132 : W23CD1-W23CE2 assign ( resid 103 and name CA ) ( resid 103 and name CB ) 4.5 3.0 2.0 ! 56.95800-41.59800 : D103CA-D103CB assign ( resid 129 and name CG2 ) ( resid 129 and name CA ) 4.5 3.0 2.0 ! 18.25800-65.27200 : I129CG2-I129CA assign ( resid 39 and name CB ) ( resid 39 and name CA ) 4.5 3.0 2.0 ! 32.74900-58.20100 : M39CB-M39CA assign ( resid 119 and name CG2 ) ( resid 119 and name CB ) 4.5 3.0 2.0 ! 21.59800-70.02900 : T119CG2-T119CB assign ( resid 141 and name CA ) ( resid 141 and name CG1 ) 4.5 3.0 2.0 ! 65.11700-29.89000 : I141CA-I141CG1 assign ( resid 108 and name CA ) ( resid 108 and name CB ) 4.5 3.0 2.0 ! 60.95200-69.31400 : T108CA-T108CB assign ( resid 213 and name CB ) ( resid 213 and name CA ) 4.5 3.0 2.0 ! 29.25000-59.04000 : E213CB-E213CA assign ( resid 159 and name CB ) ( resid 159 and name CG ) 4.5 3.0 2.0 ! 32.36000-35.02300 : E159CB-E159CG assign ( resid 69 and name C ) ( resid 69 and name CG ) 4.6 2.6 2.6 ! 179.45700-27.17100 : L69C-L69CG assign ( resid 76 and name CG ) ( resid 76 and name CB ) 4.5 3.0 2.0 ! 37.36300-29.18600 : E76CG-E76CB assign ( resid 37 and name CB ) ( resid 37 and name CD1 ) 4.5 3.0 2.0 ! 34.92900-13.67600 : I37CB-I37CD1 assign ( resid 151 and name CD2 ) ( resid 151 and name CA ) 4.5 3.0 2.0 ! 26.06658-56.76785 : L151CD2-L151CA assign ( resid 79 and name CA ) ( resid 79 and name CB ) 4.5 3.0 2.0 ! 58.55900-28.56000 : E79CA-E79CB assign ( resid 114 and name CG ) ( resid 114 and name CA ) 4.5 3.0 2.0 ! 32.92200-60.39300 : Q114CG-Q114CA assign ( resid 23 and name CD2 ) ( resid 23 and name CG ) 4.5 3.0 2.0 ! 130.36271-111.44469 : W23CD2-W23CG assign ( resid 9 and name CA ) ( resid 9 and name CG ) 4.5 3.0 2.0 ! 54.21100-33.88000 : Q9CA-Q9CG assign ( resid 157 and name CG ) ( resid 157 and name CA ) 4.5 3.0 2.0 ! 27.69000-65.64700 : P157CG-P157CA assign ( resid 132 and name CB ) ( resid 132 and name CZ ) 4.5 3.0 2.0 ! 29.88800-159.67800 : R132CB-R132CZ assign ( resid 9 and name CA ) ( resid 9 and name CB ) 4.5 3.0 2.0 ! 54.21100-29.76000 : Q9CA-Q9CB assign ( resid 141 and name CA ) ( resid 141 and name CD1 ) 4.5 3.0 2.0 ! 65.11700-14.98800 : I141CA-I141CD1 assign ( resid 141 and name CG1 ) ( resid 141 and name CG2 ) 4.5 3.0 2.0 ! 29.89000-17.96900 : I141CG1-I141CG2 assign ( resid 129 and name CD1 ) ( resid 129 and name CG1 ) 4.5 3.0 2.0 ! 15.08800-28.48900 : I129CD1-I129CG1 assign ( resid 80 and name CB ) ( resid 80 and name CD1 ) 4.5 3.0 2.0 ! 28.03200-126.61800 : W80CB-W80CD1 assign ( resid 133 and name CA ) ( resid 133 and name CD1 ) 4.5 3.0 2.0 ! 58.21387-124.64665 : W133CA-W133CD1 assign ( resid 196 and name CB ) ( resid 196 and name CA ) 4.5 3.0 2.0 ! 32.53800-66.77700 : P196CB-P196CA assign ( resid 38 and name CG ) ( resid 38 and name CA ) 4.5 3.0 2.0 ! 28.24200-65.04600 : P38CG-P38CA assign ( resid 143 and name CZ ) ( resid 143 and name CG ) 4.5 3.0 2.0 ! 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31.78000-56.26000 : M66CG-M66CA assign ( resid 163 and name CB ) ( resid 163 and name CA ) 4.5 3.0 2.0 ! 39.81900-57.40900 : D163CB-D163CA assign ( resid 168 and name CB ) ( resid 166 and name CB ) 4.6 2.6 2.6 ! volume=74104228.625 peak=5 ppm1=39.236 ppm2=40.379 assign ( resid 161 and name CB ) ( resid 162 and name CA ) 4.6 2.6 2.6 ! volume=50499569.750 peak=6 ppm1=39.373 ppm2=59.980 assign ( resid 121 and name CA ) ( resid 122 and name CG ) 4.6 2.6 2.6 ! volume=74960844.000 peak=9 ppm1=49.246 ppm2=24.747 assign ( resid 121 and name CA ) ( resid 122 and name CA ) 4.6 2.6 2.6 ! volume=96999894.500 peak=10 ppm1=49.313 ppm2=62.559 assign ( resid 121 and name CA ) ( resid 123 and name CG ) 4.6 2.6 2.6 ! volume=80674844.500 peak=11 ppm1=49.500 ppm2=27.692 assign ( resid 120 and name CE1 ) ( resid 121 and name CA ) 4.6 2.6 2.6 ! volume=35670806.750 peak=12 ppm1=136.540 ppm2=49.316 assign ( resid 120 and name CE1 ) ( resid 121 and name CB ) 4.6 2.6 2.6 ! volume=34013477.250 peak=13 ppm1=136.585 ppm2=39.535 assign ( resid 120 and name C ) ( resid 121 and name CB ) 4.6 2.6 2.6 ! volume=139983329.000 peak=14 ppm1=172.159 ppm2=39.668 assign ( resid 120 and name C ) ( resid 121 and name CA ) 4.6 2.6 2.6 ! volume=185112267.000 peak=15 ppm1=172.185 ppm2=49.380 assign ( resid 120 and name C ) ( resid 122 and name CG ) 4.6 2.6 2.6 ! volume=123267229.000 peak=16 ppm1=172.234 ppm2=24.860 assign ( resid 120 and name C ) ( resid 119 and name CA ) 4.6 2.6 2.6 ! volume=67118418.500 peak=18 ppm1=172.168 ppm2=61.039 assign ( resid 120 and name C ) ( resid 122 and name CA ) 4.6 2.6 2.6 ! volume=109010887.000 peak=19 ppm1=172.224 ppm2=62.500 assign ( resid 120 and name C ) ( resid 119 and name CB ) 4.6 2.6 2.6 ! volume=57302571.250 peak=20 ppm1=172.073 ppm2=70.296 assign ( resid 84 and name C ) ( resid 85 and name CG ) 4.6 2.6 2.6 ! volume=321397826.000 peak=21 ppm1=170.728 ppm2=27.502 assign ( resid 84 and name C ) ( resid 85 and name CB ) 4.6 2.6 2.6 ! volume=136760979.000 peak=22 ppm1=170.730 ppm2=32.115 assign ( resid 84 and name C ) ( resid 83 and name CA ) 4.6 2.6 2.6 ! 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volume=40008671.500 peak=140 ppm1=131.914 ppm2=25.476 assign ( resid 110 and name CB ) ( resid 109 and name CB ) 4.6 2.6 2.6 ! volume=36189165.500 peak=152 ppm1=71.527 ppm2=66.994 assign ( resid 110 and name CB ) ( resid 111 and name CA ) 4.6 2.6 2.6 ! volume=142450844.000 peak=154 ppm1=71.498 ppm2=58.022 assign ( resid 37 and name CA ) ( resid 38 and name CA ) 4.6 2.6 2.6 ! volume=44612399.250 peak=156 ppm1=67.997 ppm2=65.048 assign ( resid 201 and name CA ) ( resid 200 and name CA ) 4.6 2.6 2.6 ! volume=45986506.750 peak=159 ppm1=64.643 ppm2=66.506 assign ( resid 17 and name CA ) ( resid 16 and name CB ) 4.6 2.6 2.6 ! volume=34688959.500 peak=160 ppm1=65.266 ppm2=63.610 assign ( resid 107 and name CA ) ( resid 108 and name CA ) 4.6 2.6 2.6 ! volume=94423247.000 peak=162 ppm1=64.191 ppm2=60.967 assign ( resid 210 and name CB ) ( resid 211 and name CA ) 4.6 2.6 2.6 ! volume=123333420.000 peak=165 ppm1=70.489 ppm2=58.563 assign ( resid 20 and name CA ) ( resid 19 and name CB ) 4.6 2.6 2.6 ! volume=236512038.000 peak=167 ppm1=58.140 ppm2=68.196 assign ( resid 135 and name CA ) ( resid 136 and name CA ) 4.6 2.6 2.6 ! volume=172361319.000 peak=173 ppm1=66.522 ppm2=58.877 assign ( resid 108 and name CA ) ( resid 109 and name CB ) 4.6 2.6 2.6 ! volume=53955008.000 peak=176 ppm1=60.916 ppm2=67.059 assign ( resid 186 and name CA ) ( resid 182 and name CA ) 4.6 2.6 2.6 ! volume=54893726.500 peak=177 ppm1=66.689 ppm2=60.958 assign ( resid 19 and name CA ) ( resid 20 and name CA ) 4.6 2.6 2.6 ! volume=159291046.000 peak=178 ppm1=67.066 ppm2=58.146 assign ( resid 118 and name CA ) ( resid 115 and name CA ) 4.6 2.6 2.6 ! volume=81680335.000 peak=182 ppm1=59.524 ppm2=65.737 assign ( resid 179 and name CA ) ( resid 178 and name CB ) 4.6 2.6 2.6 ! volume=108820427.000 peak=183 ppm1=58.735 ppm2=65.311 assign ( resid 129 and name CA ) ( resid 128 and name CA ) 4.6 2.6 2.6 ! volume=105119369.000 peak=184 ppm1=65.426 ppm2=58.442 assign ( resid 144 and name CA ) ( resid 141 and name CA ) 4.6 2.6 2.6 ! volume=112993827.000 peak=186 ppm1=57.574 ppm2=64.737 assign ( resid 44 and name CB ) ( resid 45 and name CA ) 4.6 2.6 2.6 ! volume=81403048.500 peak=193 ppm1=63.574 ppm2=58.337 assign ( resid 19 and name CB ) ( resid 21 and name CA ) 4.6 2.6 2.6 ! volume=55526014.500 peak=195 ppm1=68.395 ppm2=56.402 assign ( resid 160 and name CA ) ( resid 163 and name CA ) 4.6 2.6 2.6 ! volume=45639123.000 peak=196 ppm1=63.529 ppm2=57.072 assign ( resid 103 and name CA ) ( resid 107 and name CA ) 4.6 2.6 2.6 ! volume=47780858.750 peak=199 ppm1=56.826 ppm2=64.497 assign ( resid 58 and name CA ) ( resid 57 and name CA ) 4.6 2.6 2.6 ! volume=52834826.000 peak=200 ppm1=63.754 ppm2=54.908 assign ( resid 97 and name CA ) ( resid 99 and name CA ) 4.6 2.6 2.6 ! volume=41467576.000 peak=203 ppm1=55.176 ppm2=63.012 assign ( resid 41 and name CB ) ( resid 43 and name CA ) 4.6 2.6 2.6 ! volume=34260338.500 peak=204 ppm1=62.607 ppm2=55.716 assign ( resid 179 and name CA ) ( resid 180 and name CA ) 4.6 2.6 2.6 ! volume=279329280.000 peak=205 ppm1=58.442 ppm2=60.139 assign ( resid 152 and name CA ) ( resid 151 and name CA ) 4.6 2.6 2.6 ! volume=63027966.500 peak=207 ppm1=54.190 ppm2=56.841 assign ( resid 110 and name CA ) ( resid 111 and name CA ) 4.6 2.6 2.6 ! volume=232919375.500 peak=208 ppm1=59.360 ppm2=57.796 assign ( resid 151 and name CA ) ( resid 150 and name CA ) 4.6 2.6 2.6 ! volume=102630985.000 peak=210 ppm1=56.659 ppm2=60.429 assign ( resid 63 and name CA ) ( resid 66 and name CA ) 4.6 2.6 2.6 ! volume=114480573.000 peak=211 ppm1=60.245 ppm2=56.562 assign ( resid 20 and name CA ) ( resid 21 and name CA ) 4.6 2.6 2.6 ! volume=185245212.000 peak=215 ppm1=58.031 ppm2=56.167 assign ( resid 67 and name CA ) ( resid 66 and name CA ) 4.6 2.6 2.6 ! volume=185245212.000 peak=218 ppm1=58.211 ppm2=56.367 assign ( resid 179 and name CA ) ( resid 183 and name CA ) 4.6 2.6 2.6 ! volume=121589966.000 peak=219 ppm1=58.495 ppm2=56.902 assign ( resid 155 and name CA ) ( resid 154 and name CA ) 4.6 2.6 2.6 ! volume=86367086.000 peak=222 ppm1=55.808 ppm2=54.232 assign ( resid 56 and name CA ) ( resid 57 and name CA ) 4.6 2.6 2.6 ! volume=125530131.000 peak=223 ppm1=58.422 ppm2=54.780 assign ( resid 83 and name CA ) ( resid 82 and name CA ) 4.6 2.6 2.6 ! volume=74339764.500 peak=225 ppm1=55.165 ppm2=59.213 assign ( resid 69 and name CA ) ( resid 66 and name CA ) 4.6 2.6 2.6 ! volume=101221444.000 peak=226 ppm1=59.138 ppm2=56.436 assign ( resid 21 and name CA ) ( resid 18 and name CA ) 4.6 2.6 2.6 ! volume=61591761.000 peak=227 ppm1=55.966 ppm2=59.454 assign ( resid 81 and name CA ) ( resid 83 and name CA ) 4.6 2.6 2.6 ! volume=56810588.500 peak=230 ppm1=57.668 ppm2=54.997 assign ( resid 155 and name CA ) ( resid 159 and name CA ) 4.6 2.6 2.6 ! volume=40669436.750 peak=231 ppm1=56.175 ppm2=53.340 assign ( resid 70 and name CE ) ( resid 69 and name CA ) 4.6 2.6 2.6 ! volume=76496355.000 peak=237 ppm1=41.979 ppm2=59.071 assign ( resid 153 and name CA ) ( resid 152 and name CB ) 4.6 2.6 2.6 ! volume=61222717.000 peak=238 ppm1=59.165 ppm2=41.994 assign ( resid 122 and name CA ) ( resid 121 and name CB ) 4.6 2.6 2.6 ! volume=65644578.000 peak=239 ppm1=62.515 ppm2=39.490 assign ( resid 17 and name CA ) ( resid 21 and name CB ) 4.6 2.6 2.6 ! volume=52702294.750 peak=246 ppm1=65.454 ppm2=38.329 assign ( resid 58 and name CA ) ( resid 57 and name CB ) 4.6 2.6 2.6 ! volume=46810228.500 peak=247 ppm1=63.738 ppm2=37.791 assign ( resid 54 and name CA ) ( resid 57 and name CB ) 4.6 2.6 2.6 ! volume=90079227.000 peak=250 ppm1=67.501 ppm2=37.580 assign ( resid 109 and name CB ) ( resid 113 and name CG ) 4.6 2.6 2.6 ! volume=55026532.500 peak=251 ppm1=67.053 ppm2=37.293 assign ( resid 183 and name CB ) ( resid 186 and name CA ) 4.6 2.6 2.6 ! volume=56127927.000 peak=252 ppm1=37.807 ppm2=66.790 assign ( resid 54 and name CB ) ( resid 57 and name CB ) 4.6 2.6 2.6 ! volume=44891984.250 peak=254 ppm1=68.312 ppm2=37.723 assign ( resid 21 and name CB ) ( resid 20 and name CA ) 4.6 2.6 2.6 ! volume=128517410.000 peak=256 ppm1=38.489 ppm2=58.231 assign ( resid 138 and name CA ) ( resid 139 and name CB ) 4.6 2.6 2.6 ! volume=85783563.000 peak=257 ppm1=58.176 ppm2=38.854 assign ( resid 140 and name CA ) ( resid 139 and name CB ) 4.6 2.6 2.6 ! volume=39598775.500 peak=258 ppm1=60.122 ppm2=39.009 assign ( resid 110 and name CB ) ( resid 113 and name CG ) 4.6 2.6 2.6 ! volume=68191857.500 peak=259 ppm1=71.502 ppm2=37.187 assign ( resid 110 and name CB ) ( resid 112 and name CB ) 4.6 2.6 2.6 ! volume=38097883.125 peak=261 ppm1=71.700 ppm2=27.918 assign ( resid 110 and name CB ) ( resid 113 and name CB ) 4.6 2.6 2.6 ! volume=46464321.500 peak=262 ppm1=71.606 ppm2=29.126 assign ( resid 160 and name CA ) ( resid 159 and name CG ) 4.6 2.6 2.6 ! volume=93956979.500 peak=263 ppm1=63.438 ppm2=35.036 assign ( resid 118 and name CB ) ( resid 119 and name CA ) 4.6 2.6 2.6 ! volume=63651046.000 peak=265 ppm1=35.075 ppm2=61.037 assign ( resid 119 and name CB ) ( resid 118 and name CB ) 4.6 2.6 2.6 ! volume=58240441.000 peak=267 ppm1=70.177 ppm2=35.096 assign ( resid 118 and name CB ) ( resid 115 and name CA ) 4.6 2.6 2.6 ! volume=44711405.250 peak=269 ppm1=35.165 ppm2=65.530 assign ( resid 159 and name CG ) ( resid 157 and name CA ) 4.6 2.6 2.6 ! volume=38793425.000 peak=271 ppm1=35.003 ppm2=65.611 assign ( resid 128 and name CG ) ( resid 129 and name CA ) 4.6 2.6 2.6 ! volume=38973000.875 peak=274 ppm1=36.145 ppm2=65.262 assign ( resid 195 and name CB ) ( resid 196 and name CA ) 4.6 2.6 2.6 ! volume=42723846.500 peak=276 ppm1=35.879 ppm2=66.961 assign ( resid 58 and name CB ) ( resid 57 and name CB ) 4.6 2.6 2.6 ! volume=43730312.250 peak=278 ppm1=69.682 ppm2=37.733 assign ( resid 48 and name CB ) ( resid 49 and name CB ) 4.6 2.6 2.6 ! volume=94378722.000 peak=279 ppm1=69.592 ppm2=30.430 assign ( resid 201 and name CG1 ) ( resid 200 and name CB ) 4.6 2.6 2.6 ! volume=46744035.000 peak=281 ppm1=29.632 ppm2=68.987 assign ( resid 216 and name CB ) ( resid 213 and name CB ) 4.6 2.6 2.6 ! volume=53299914.000 peak=282 ppm1=68.844 ppm2=29.390 assign ( resid 68 and name CB ) ( resid 72 and name CB ) 4.6 2.6 2.6 ! volume=37106737.000 peak=284 ppm1=32.878 ppm2=68.058 assign ( resid 54 and name CB ) ( resid 55 and name CB ) 4.6 2.6 2.6 ! volume=54216214.500 peak=285 ppm1=68.254 ppm2=32.808 assign ( resid 19 and name CA ) ( resid 21 and name CB ) 4.6 2.6 2.6 ! volume=31949709.000 peak=287 ppm1=66.968 ppm2=38.331 assign ( resid 75 and name CG ) ( resid 74 and name CA ) 4.6 2.6 2.6 ! volume=50316049.750 peak=288 ppm1=36.040 ppm2=55.973 assign ( resid 43 and name CA ) ( resid 45 and name CG ) 4.6 2.6 2.6 ! volume=79230512.500 peak=290 ppm1=55.913 ppm2=34.929 assign ( resid 159 and name CG ) ( resid 155 and name CA ) 4.6 2.6 2.6 ! volume=79555406.000 peak=291 ppm1=34.991 ppm2=55.849 assign ( resid 51 and name CA ) ( resid 50 and name CG ) 4.6 2.6 2.6 ! volume=86856364.500 peak=292 ppm1=57.611 ppm2=34.295 assign ( resid 52 and name CD1 ) ( resid 54 and name CB ) 4.6 2.6 2.6 ! volume=38884838.750 peak=298 ppm1=26.914 ppm2=68.152 assign ( resid 37 and name CA ) ( resid 38 and name CG ) 4.6 2.6 2.6 ! volume=57871967.500 peak=300 ppm1=68.153 ppm2=28.198 assign ( resid 19 and name CB ) ( resid 18 and name CG ) 4.6 2.6 2.6 ! volume=48066755.750 peak=301 ppm1=67.837 ppm2=27.817 assign ( resid 186 and name CA ) ( resid 187 and name CB ) 4.6 2.6 2.6 ! volume=65302556.000 peak=302 ppm1=66.575 ppm2=29.459 assign ( resid 50 and name CB ) ( resid 49 and name CA ) 4.6 2.6 2.6 ! volume=75263912.500 peak=303 ppm1=29.330 ppm2=67.253 assign ( resid 66 and name CA ) ( resid 67 and name CB ) 4.6 2.6 2.6 ! volume=49691417.000 peak=307 ppm1=56.546 ppm2=27.269 assign ( resid 20 and name CD2 ) ( resid 17 and name CA ) 4.6 2.6 2.6 ! volume=40778874.000 peak=309 ppm1=25.224 ppm2=65.673 assign ( resid 158 and name CG ) ( resid 157 and name CA ) 4.6 2.6 2.6 ! volume=37060359.500 peak=310 ppm1=25.212 ppm2=65.769 assign ( resid 15 and name CA ) ( resid 14 and name CB ) 4.6 2.6 2.6 ! volume=61912290.500 peak=315 ppm1=62.120 ppm2=18.882 assign ( resid 21 and name CA ) ( resid 22 and name CB ) 4.6 2.6 2.6 ! volume=126448003.000 peak=322 ppm1=56.231 ppm2=18.323 assign ( resid 204 and name CB ) ( resid 205 and name CA ) 4.6 2.6 2.6 ! volume=129180214.000 peak=325 ppm1=18.599 ppm2=57.508 assign ( resid 105 and name CB ) ( resid 107 and name CB ) 4.6 2.6 2.6 ! volume=50825225.500 peak=330 ppm1=18.766 ppm2=69.130 assign ( resid 19 and name CA ) ( resid 15 and name CD1 ) 4.6 2.6 2.6 ! volume=32251982.000 peak=331 ppm1=67.299 ppm2=14.881 assign ( resid 73 and name CD1 ) ( resid 72 and name CA ) 4.6 2.6 2.6 ! volume=33825329.500 peak=332 ppm1=14.708 ppm2=67.322 assign ( resid 31 and name CB ) ( resid 33 and name CB ) 4.6 2.6 2.6 ! volume=39689692.000 peak=336 ppm1=17.353 ppm2=63.408 assign ( resid 72 and name CA ) ( resid 73 and name CG2 ) 4.6 2.6 2.6 ! volume=33840872.250 peak=339 ppm1=67.388 ppm2=18.232 assign ( resid 22 and name CB ) ( resid 19 and name CA ) 4.6 2.6 2.6 ! volume=63691435.000 peak=340 ppm1=18.571 ppm2=66.807 assign ( resid 21 and name CA ) ( resid 17 and name CA ) 4.6 2.6 2.6 ! volume=37318359.500 peak=342 ppm1=56.248 ppm2=65.355 assign ( resid 196 and name CB ) ( resid 195 and name CA ) 4.6 2.6 2.6 ! volume=87159806.000 peak=345 ppm1=32.588 ppm2=51.729 assign ( resid 186 and name CG2 ) ( resid 183 and name CA ) 4.6 2.6 2.6 ! volume=60430245.500 peak=347 ppm1=21.532 ppm2=56.981 assign ( resid 209 and name CB ) ( resid 210 and name CA ) 4.6 2.6 2.6 ! volume=95695003.500 peak=348 ppm1=19.703 ppm2=60.165 assign ( resid 47 and name CB ) ( resid 48 and name CA ) 4.6 2.6 2.6 ! volume=42874751.000 peak=349 ppm1=20.295 ppm2=59.821 assign ( resid 209 and name CB ) ( resid 210 and name CB ) 4.6 2.6 2.6 ! volume=28808271.438 peak=352 ppm1=19.842 ppm2=70.365 assign ( resid 115 and name CG2 ) ( resid 119 and name CB ) 4.6 2.6 2.6 ! volume=35690662.500 peak=354 ppm1=16.907 ppm2=69.805 assign ( resid 103 and name CB ) ( resid 104 and name CG2 ) 4.6 2.6 2.6 ! volume=48574870.500 peak=355 ppm1=41.455 ppm2=17.034 assign ( resid 164 and name CB ) ( resid 163 and name CB ) 4.6 2.6 2.6 ! volume=64138502.750 peak=365 ppm1=38.233 ppm2=39.864 assign ( resid 161 and name CB ) ( resid 160 and name CB ) 4.6 2.6 2.6 ! volume=57896396.500 peak=367 ppm1=39.454 ppm2=32.951 assign ( resid 214 and name CB ) ( resid 213 and name CG ) 4.6 2.6 2.6 ! volume=54724659.500 peak=369 ppm1=33.712 ppm2=37.284 assign ( resid 81 and name CB ) ( resid 79 and name CB ) 4.6 2.6 2.6 ! volume=74431748.500 peak=372 ppm1=40.203 ppm2=28.705 assign ( resid 196 and name CG ) ( resid 197 and name CB ) 4.6 2.6 2.6 ! volume=50735734.500 peak=373 ppm1=28.671 ppm2=40.278 assign ( resid 37 and name CG2 ) ( resid 40 and name CB ) 4.6 2.6 2.6 ! volume=92928216.500 peak=380 ppm1=18.674 ppm2=37.935 assign ( resid 130 and name CB ) ( resid 129 and name CG2 ) 4.6 2.6 2.6 ! volume=127271605.000 peak=382 ppm1=36.647 ppm2=18.394 assign ( resid 30 and name CD ) ( resid 29 and name CG ) 4.6 2.6 2.6 ! volume=171914072.000 peak=385 ppm1=27.228 ppm2=36.547 assign ( resid 212 and name CG ) ( resid 215 and name CB ) 4.6 2.6 2.6 ! volume=67361618.000 peak=387 ppm1=36.569 ppm2=32.417 assign ( resid 183 and name CB ) ( resid 185 and name CB ) 4.6 2.6 2.6 ! volume=69785474.500 peak=388 ppm1=37.742 ppm2=31.288 assign ( resid 130 and name CB ) ( resid 131 and name CG ) 4.6 2.6 2.6 ! volume=50689708.250 peak=390 ppm1=36.712 ppm2=25.919 assign ( resid 144 and name CG ) ( resid 145 and name CB ) 4.6 2.6 2.6 ! volume=87399291.000 peak=391 ppm1=30.218 ppm2=38.068 assign ( resid 192 and name CB ) ( resid 193 and name CB ) 4.6 2.6 2.6 ! volume=53390335.500 peak=393 ppm1=28.492 ppm2=38.198 assign ( resid 76 and name CG ) ( resid 72 and name CG2 ) 4.6 2.6 2.6 ! volume=50108415.000 peak=397 ppm1=37.627 ppm2=21.129 assign ( resid 113 and name CG ) ( resid 110 and name CG2 ) 4.6 2.6 2.6 ! volume=66968249.500 peak=399 ppm1=37.534 ppm2=22.051 assign ( resid 195 and name CB ) ( resid 194 and name CB ) 4.6 2.6 2.6 ! volume=48290728.000 peak=405 ppm1=35.649 ppm2=18.828 assign ( resid 45 and name CG ) ( resid 42 and name CB ) 4.6 2.6 2.6 ! volume=41613417.250 peak=408 ppm1=34.987 ppm2=19.373 assign ( resid 38 and name CB ) ( resid 37 and name CG2 ) 4.6 2.6 2.6 ! volume=161664853.000 peak=415 ppm1=30.585 ppm2=19.125 assign ( resid 125 and name CG ) ( resid 129 and name CG2 ) 4.6 2.6 2.6 ! volume=132430025.000 peak=417 ppm1=27.265 ppm2=18.370 assign ( resid 105 and name CB ) ( resid 107 and name CG2 ) 4.6 2.6 2.6 ! volume=52094474.500 peak=421 ppm1=18.655 ppm2=22.972 assign ( resid 138 and name CD1 ) ( resid 135 and name CG2 ) 4.6 2.6 2.6 ! volume=46975546.000 peak=425 ppm1=22.566 ppm2=17.291 assign ( resid 27 and name CG1 ) ( resid 31 and name CB ) 4.6 2.6 2.6 ! volume=43059903.500 peak=426 ppm1=22.234 ppm2=17.268 assign ( resid 131 and name CG ) ( resid 134 and name CG2 ) 4.6 2.6 2.6 ! volume=56982666.500 peak=428 ppm1=25.595 ppm2=17.900 assign ( resid 65 and name CB ) ( resid 68 and name CB ) 4.6 2.6 2.6 ! volume=87959748.000 peak=429 ppm1=18.711 ppm2=32.578 assign ( resid 181 and name CG2 ) ( resid 184 and name CB ) 4.6 2.6 2.6 ! volume=66085744.500 peak=431 ppm1=23.987 ppm2=28.687 assign ( resid 181 and name CG2 ) ( resid 185 and name CB ) 4.6 2.6 2.6 ! volume=62436659.500 peak=432 ppm1=24.005 ppm2=30.957 assign ( resid 110 and name CG2 ) ( resid 113 and name CB ) 4.6 2.6 2.6 ! volume=73535412.000 peak=434 ppm1=22.342 ppm2=29.161 assign ( resid 213 and name CB ) ( resid 210 and name CG2 ) 4.6 2.6 2.6 ! volume=78734839.500 peak=435 ppm1=29.145 ppm2=22.344 assign ( resid 48 and name CG2 ) ( resid 49 and name CB ) 4.6 2.6 2.6 ! volume=88192782.000 peak=436 ppm1=22.246 ppm2=30.307 assign ( resid 23 and name CB ) ( resid 24 and name CG1 ) 4.6 2.6 2.6 ! volume=117398960.000 peak=437 ppm1=30.255 ppm2=22.230 assign ( resid 216 and name CG2 ) ( resid 215 and name CB ) 4.6 2.6 2.6 ! volume=83784599.500 peak=440 ppm1=21.571 ppm2=32.697 assign ( resid 3 and name CG2 ) ( resid 4 and name CB ) 4.6 2.6 2.6 ! volume=45161844.500 peak=444 ppm1=21.074 ppm2=30.045 assign ( resid 36 and name CG2 ) ( resid 34 and name CB ) 4.6 2.6 2.6 ! volume=38817688.750 peak=446 ppm1=22.779 ppm2=31.685 assign ( resid 138 and name CD1 ) ( resid 135 and name CG1 ) 4.6 2.6 2.6 ! volume=39785635.500 peak=447 ppm1=22.723 ppm2=31.718 assign ( resid 28 and name CB ) ( resid 24 and name CG1 ) 4.6 2.6 2.6 ! volume=72206439.000 peak=450 ppm1=29.330 ppm2=22.686 assign ( resid 49 and name CA ) ( resid 52 and name CD1 ) 4.6 2.6 2.6 ! volume=83222418.000 peak=453 ppm1=67.132 ppm2=27.049 assign ( resid 149 and name CB ) ( resid 151 and name CA ) 4.6 2.6 2.6 ! volume=45639123.000 peak=456 ppm1=63.559 ppm2=56.993 assign ( resid 129 and name CD1 ) ( resid 128 and name CA ) 4.6 2.6 2.6 ! volume=59678136.000 peak=457 ppm1=14.893 ppm2=58.630 assign ( resid 117 and name CE3 ) ( resid 118 and name CB ) 4.6 2.6 2.6 ! volume=25829787.500 peak=4 ppm1=121.798 ppm2=34.982 assign ( resid 117 and name CE3 ) ( resid 113 and name CB ) 4.6 2.6 2.6 ! volume=99213839.000 peak=7 ppm1=121.773 ppm2=29.009 assign ( resid 130 and name CD* ) ( resid 134 and name CG1 ) 4.6 2.6 2.6 ! volume=33013589.375 peak=8 ppm1=132.778 ppm2=29.898 assign ( resid 117 and name CE3 ) ( resid 113 and name CA ) 4.6 2.6 2.6 ! volume=32358129.750 peak=13 ppm1=121.699 ppm2=59.096 assign ( resid 117 and name CE3 ) ( resid 118 and name CA ) 4.6 2.6 2.6 ! volume=34599590.500 peak=14 ppm1=121.592 ppm2=59.819 assign ( resid 159 and name CG ) ( resid 158 and name CG ) 4.6 2.6 2.6 ! volume=48483599.250 peak=15 ppm1=35.216 ppm2=25.105 assign ( resid 36 and name CG1 ) ( resid 37 and name CD1 ) 4.6 2.6 2.6 ! volume=29732814.500 peak=16 ppm1=22.740 ppm2=13.691 assign ( resid 135 and name CD1 ) ( resid 131 and name CG ) 4.6 2.6 2.6 ! volume=27784083.750 peak=18 ppm1=13.592 ppm2=25.536 assign ( resid 115 and name CG2 ) ( resid 118 and name CB ) 4.6 2.6 2.6 ! volume=31698844.000 peak=20 ppm1=17.122 ppm2=35.170 assign ( resid 83 and name CD1 ) ( resid 79 and name CG ) 4.6 2.6 2.6 ! volume=31210661.000 peak=22 ppm1=25.243 ppm2=34.986 assign ( resid 42 and name CB ) ( resid 41 and name CB ) 4.6 2.6 2.6 ! volume=43517416.750 peak=25 ppm1=19.368 ppm2=62.448 assign ( resid 183 and name CB ) ( resid 186 and name CB ) 4.6 2.6 2.6 ! volume=25125241.500 peak=28 ppm1=37.642 ppm2=69.302 assign ( resid 121 and name CB ) ( resid 119 and name CA ) 4.6 2.6 2.6 ! volume=29488647.000 peak=32 ppm1=39.598 ppm2=60.882 assign ( resid 135 and name CA ) ( resid 134 and name CA ) 4.6 2.6 2.6 ! volume=34750005.750 peak=34 ppm1=66.558 ppm2=65.081 assign ( resid 95 and name CA ) ( resid 93 and name CA ) 4.6 2.6 2.6 ! volume=31066624.750 peak=35 ppm1=54.470 ppm2=64.246 assign ( resid 141 and name CA ) ( resid 140 and name CA ) 4.6 2.6 2.6 ! volume=73745726.000 peak=36 ppm1=65.302 ppm2=60.234 assign ( resid 41 and name CB ) ( resid 37 and name CA ) 4.6 2.6 2.6 ! volume=26650149.250 peak=38 ppm1=62.404 ppm2=68.009 assign ( resid 19 and name CB ) ( resid 16 and name CB ) 4.6 2.6 2.6 ! volume=21813252.625 peak=39 ppm1=68.143 ppm2=63.736 assign ( resid 19 and name CA ) ( resid 16 and name CB ) 4.6 2.6 2.6 ! volume=26859658.750 peak=40 ppm1=66.964 ppm2=63.627 assign ( resid 157 and name CA ) ( resid 158 and name CA ) 4.6 2.6 2.6 ! volume=32466799.750 peak=41 ppm1=65.665 ppm2=54.021 assign ( resid 54 and name CB ) ( resid 57 and name CA ) 4.6 2.6 2.6 ! volume=25609429.500 peak=43 ppm1=68.512 ppm2=54.845 assign ( resid 41 and name CB ) ( resid 40 and name CB ) 4.6 2.6 2.6 ! volume=24282103.750 peak=46 ppm1=62.639 ppm2=38.130 assign ( resid 210 and name CB ) ( resid 214 and name CB ) 4.6 2.6 2.6 ! volume=28735340.500 peak=47 ppm1=70.367 ppm2=33.553 assign ( resid 210 and name CB ) ( resid 213 and name CB ) 4.6 2.6 2.6 ! volume=27873885.750 peak=48 ppm1=70.360 ppm2=29.263 assign ( resid 102 and name CB ) ( resid 100 and name CB ) 4.6 2.6 2.6 ! volume=28551902.250 peak=49 ppm1=62.011 ppm2=30.754 assign ( resid 48 and name CB ) ( resid 52 and name CD1 ) 4.6 2.6 2.6 ! volume=28665962.500 peak=50 ppm1=69.621 ppm2=26.939 assign ( resid 16 and name CB ) ( resid 15 and name CD1 ) 4.6 2.6 2.6 ! volume=26633968.750 peak=51 ppm1=63.542 ppm2=14.913 assign ( resid 48 and name CB ) ( resid 47 and name CB ) 4.6 2.6 2.6 ! volume=57564019.500 peak=54 ppm1=69.700 ppm2=20.470 assign ( resid 135 and name CA ) ( resid 138 and name CD2 ) 4.6 2.6 2.6 ! volume=30497970.000 peak=56 ppm1=66.592 ppm2=25.097 assign ( resid 180 and name CA ) ( resid 181 and name CG2 ) 4.6 2.6 2.6 ! volume=31774329.500 peak=59 ppm1=60.191 ppm2=20.795 assign ( resid 13 and name CA ) ( resid 14 and name CB ) 4.6 2.6 2.6 ! 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volume=27145758.750 peak=87 ppm1=62.854 ppm2=18.269 assign ( resid 117 and name CD1 ) ( resid 114 and name CG ) 4.6 2.6 2.6 ! volume=54104374.000 peak=100 ppm1=125.535 ppm2=32.709 assign ( resid 117 and name CD1 ) ( resid 114 and name CA ) 4.6 2.6 2.6 ! volume=27040087.125 peak=102 ppm1=125.436 ppm2=60.349 assign ( resid 117 and name CD1 ) ( resid 113 and name CB ) 4.6 2.6 2.6 ! volume=29268670.875 peak=105 ppm1=125.760 ppm2=28.938 assign ( resid 133 and name CD1 ) ( resid 132 and name CG ) 4.6 2.6 2.6 ! volume=44742645.000 peak=108 ppm1=124.841 ppm2=28.257 assign ( resid 133 and name CD1 ) ( resid 129 and name CA ) 4.6 2.6 2.6 ! volume=36351633.000 peak=109 ppm1=125.122 ppm2=65.427 assign ( resid 80 and name CD1 ) ( resid 81 and name CA ) 4.6 2.6 2.6 ! volume=26669730.250 peak=113 ppm1=126.622 ppm2=57.554 assign ( resid 23 and name CD1 ) ( resid 24 and name CG2 ) 4.6 2.6 2.6 ! volume=37440874.000 peak=121 ppm1=127.268 ppm2=24.066 assign ( resid 23 and name CD1 ) ( resid 20 and name CA ) 4.6 2.6 2.6 ! volume=27404228.750 peak=126 ppm1=127.634 ppm2=58.120 assign ( resid 133 and name CE2 ) ( resid 129 and name CG2 ) 4.6 2.6 2.6 ! volume=76537479.000 peak=138 ppm1=138.776 ppm2=18.239 assign ( resid 133 and name CD1 ) ( resid 132 and name CA ) 4.6 2.6 2.6 ! volume=22945709.375 peak=142 ppm1=124.792 ppm2=59.981 assign ( resid 133 and name CE3 ) ( resid 132 and name CA ) 4.6 2.6 2.6 ! volume=21421240.375 peak=143 ppm1=119.432 ppm2=59.981 assign ( resid 133 and name CE2 ) ( resid 132 and name CA ) 4.6 2.6 2.6 ! volume=29201793.500 peak=144 ppm1=138.738 ppm2=59.981 assign ( resid 40 and name CD* ) ( resid 44 and name CB ) 4.6 2.6 2.6 ! volume=42338047.250 peak=5 ppm1=131.243 ppm2=63.905 assign ( resid 32 and name CD* ) ( resid 31 and name CB ) 4.6 2.6 2.6 ! volume=64166088.500 peak=13 ppm1=132.459 ppm2=17.120 assign ( resid 130 and name CD* ) ( resid 128 and name CA ) 4.6 2.6 2.6 ! volume=48287173.000 peak=16 ppm1=132.016 ppm2=58.641 assign ( resid 40 and name CD* ) ( resid 37 and name CG2 ) 4.6 2.6 2.6 ! volume=33255053.000 peak=17 ppm1=130.623 ppm2=19.193 assign ( resid 161 and name CD* ) ( resid 162 and name CB ) 4.6 2.6 2.6 ! volume=31902224.000 peak=18 ppm1=132.507 ppm2=30.209 assign ( resid 141 and name CD1 ) ( resid 138 and name CG ) 4.6 2.6 2.6 ! volume=24283541.750 peak=1 ppm1=14.802 ppm2=26.289 assign ( resid 138 and name CB ) ( resid 135 and name CA ) 4.6 2.6 2.6 ! volume=25409679.250 peak=3 ppm1=42.244 ppm2=66.509 assign ( resid 172 and name CB ) ( resid 171 and name CA ) 4.6 2.6 2.6 ! volume=24520544.500 peak=4 ppm1=42.195 ppm2=66.581 assign ( resid 194 and name CA ) ( resid 198 and name CA ) 4.6 2.6 2.6 ! volume=23789449.125 peak=7 ppm1=52.918 ppm2=62.713 assign ( resid 99 and name CA ) ( resid 101 and name CA ) 4.6 2.6 2.6 ! volume=23522864.500 peak=9 ppm1=62.623 ppm2=48.499 assign ( resid 102 and name CA ) ( resid 101 and name CA ) 4.6 2.6 2.6 ! volume=50448726.000 peak=11 ppm1=60.852 ppm2=48.426 assign ( resid 104 and name CB ) ( resid 101 and name CA ) 4.6 2.6 2.6 ! volume=18219724.938 peak=12 ppm1=36.808 ppm2=48.466 assign ( resid 40 and name CA ) ( resid 39 and name CA ) 4.6 2.6 2.6 ! volume=35277642.750 peak=14 ppm1=61.962 ppm2=58.396 assign ( resid 222 and name CA ) ( resid 221 and name CB ) 4.6 2.6 2.6 ! volume=36236259.500 peak=18 ppm1=44.564 ppm2=32.449 assign ( resid 38 and name CD ) ( resid 37 and name CB ) 4.6 2.6 2.6 ! volume=63881253.000 peak=20 ppm1=49.060 ppm2=34.737 assign ( resid 38 and name CD ) ( resid 36 and name CB ) 4.6 2.6 2.6 ! volume=16988079.500 peak=22 ppm1=49.116 ppm2=31.996 assign ( resid 105 and name CA ) ( resid 104 and name CB ) 4.6 2.6 2.6 ! volume=36556801.500 peak=24 ppm1=50.533 ppm2=36.821 assign ( resid 132 and name CD ) ( resid 129 and name CB ) 4.6 2.6 2.6 ! volume=14726826.500 peak=29 ppm1=44.180 ppm2=38.248 assign ( resid 89 and name CA ) ( resid 90 and name CD ) 4.6 2.6 2.6 ! volume=91049069.000 peak=30 ppm1=44.401 ppm2=49.730 assign ( resid 121 and name CA ) ( resid 120 and name CA ) 4.6 2.6 2.6 ! volume=26045094.500 peak=34 ppm1=49.190 ppm2=57.270 assign ( resid 172 and name CG ) ( resid 175 and name CA ) 4.6 2.6 2.6 ! volume=38414818.000 peak=35 ppm1=26.306 ppm2=57.285 assign ( resid 48 and name CA ) ( resid 47 and name CA ) 4.6 2.6 2.6 ! volume=29010110.750 peak=39 ppm1=59.667 ppm2=53.157 assign ( resid 46 and name CA ) ( resid 47 and name CA ) 4.6 2.6 2.6 ! volume=49116812.000 peak=40 ppm1=45.803 ppm2=53.068 assign ( resid 48 and name CG2 ) ( resid 47 and name CA ) 4.6 2.6 2.6 ! volume=16486640.750 peak=42 ppm1=21.962 ppm2=53.119 assign ( resid 189 and name CB ) ( resid 193 and name CA ) 4.6 2.6 2.6 ! volume=44791161.000 peak=43 ppm1=42.442 ppm2=52.829 assign ( resid 85 and name CD ) ( resid 84 and name CA ) 4.6 2.6 2.6 ! volume=87771840.000 peak=44 ppm1=50.080 ppm2=53.026 assign ( resid 84 and name CG ) ( resid 81 and name CA ) 4.6 2.6 2.6 ! volume=23394490.500 peak=45 ppm1=130.578 ppm2=57.297 assign ( resid 15 and name CA ) ( resid 16 and name CA ) 4.6 2.6 2.6 ! volume=31927084.750 peak=48 ppm1=62.012 ppm2=55.920 assign ( resid 31 and name CA ) ( resid 30 and name CA ) 4.6 2.6 2.6 ! volume=30356432.375 peak=50 ppm1=53.017 ppm2=55.806 assign ( resid 17 and name CD ) ( resid 16 and name CA ) 4.6 2.6 2.6 ! volume=115058025.000 peak=52 ppm1=50.644 ppm2=56.015 assign ( resid 133 and name CG ) ( resid 136 and name CG ) 4.6 2.6 2.6 ! volume=58606378.000 peak=58 ppm1=110.589 ppm2=27.062 assign ( resid 133 and name CG ) ( resid 130 and name CA ) 4.6 2.6 2.6 ! volume=26424412.250 peak=61 ppm1=110.659 ppm2=56.082 assign ( resid 133 and name CG ) ( resid 132 and name CA ) 4.6 2.6 2.6 ! volume=29108690.500 peak=62 ppm1=110.488 ppm2=60.077 assign ( resid 133 and name CG ) ( resid 131 and name CA ) 4.6 2.6 2.6 ! volume=33239059.000 peak=63 ppm1=110.728 ppm2=60.966 assign ( resid 184 and name CG ) ( resid 182 and name CA ) 4.6 2.6 2.6 ! volume=23522159.500 peak=64 ppm1=110.328 ppm2=60.965 assign ( resid 80 and name CG ) ( resid 79 and name CA ) 4.6 2.6 2.6 ! volume=68618689.500 peak=65 ppm1=110.347 ppm2=58.560 assign ( resid 40 and name CA ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! volume=26916182.250 peak=66 ppm1=61.740 ppm2=27.109 assign ( resid 40 and name CA ) ( resid 43 and name CB ) 4.6 2.6 2.6 ! volume=16263131.250 peak=67 ppm1=61.712 ppm2=42.080 assign ( resid 40 and name CA ) ( resid 36 and name CB ) 4.6 2.6 2.6 ! volume=16263131.250 peak=70 ppm1=61.665 ppm2=31.524 assign ( resid 40 and name CA ) ( resid 36 and name CA ) 4.6 2.6 2.6 ! volume=24368877.500 peak=71 ppm1=61.669 ppm2=66.702 assign ( resid 7 and name CA ) ( resid 8 and name CA ) 4.6 2.6 2.6 ! volume=19483001.250 peak=72 ppm1=59.799 ppm2=47.288 assign ( resid 126 and name CA ) ( resid 127 and name CA ) 4.6 2.6 2.6 ! volume=63874295.500 peak=73 ppm1=65.770 ppm2=47.213 assign ( resid 115 and name CA ) ( resid 116 and name CA ) 4.6 2.6 2.6 ! volume=46183568.500 peak=74 ppm1=65.691 ppm2=47.472 assign ( resid 59 and name CA ) ( resid 61 and name CA ) 4.6 2.6 2.6 ! volume=40172961.500 peak=75 ppm1=62.382 ppm2=47.213 assign ( resid 128 and name CA ) ( resid 127 and name CA ) 4.6 2.6 2.6 ! volume=17230565.500 peak=76 ppm1=58.668 ppm2=47.254 assign ( resid 131 and name CE ) ( resid 127 and name CA ) 4.6 2.6 2.6 ! volume=26077863.250 peak=79 ppm1=41.238 ppm2=47.114 assign ( resid 126 and name CB ) ( resid 127 and name CA ) 4.6 2.6 2.6 ! volume=25364247.500 peak=80 ppm1=30.760 ppm2=47.290 assign ( resid 115 and name CB ) ( resid 116 and name CA ) 4.6 2.6 2.6 ! volume=28467722.250 peak=81 ppm1=38.535 ppm2=47.183 assign ( resid 129 and name CB ) ( resid 127 and name CA ) 4.6 2.6 2.6 ! volume=27301206.500 peak=82 ppm1=38.590 ppm2=47.062 assign ( resid 136 and name C ) ( resid 137 and name CA ) 4.6 2.6 2.6 ! volume=78765172.500 peak=85 ppm1=180.935 ppm2=47.583 assign ( resid 109 and name CA ) ( resid 106 and name CA ) 4.6 2.6 2.6 ! volume=16547518.750 peak=92 ppm1=54.038 ppm2=45.225 assign ( resid 37 and name CA ) ( resid 38 and name CD ) 4.6 2.6 2.6 ! volume=39546370.500 peak=97 ppm1=67.802 ppm2=49.142 assign ( resid 134 and name CA ) ( resid 135 and name CD1 ) 4.6 2.6 2.6 ! volume=39172104.250 peak=108 ppm1=65.462 ppm2=13.397 assign ( resid 115 and name CA ) ( resid 119 and name CG2 ) 4.6 2.6 2.6 ! volume=22298194.250 peak=110 ppm1=65.460 ppm2=21.432 assign ( resid 17 and name CA ) ( resid 20 and name CG ) 4.6 2.6 2.6 ! volume=31014284.750 peak=111 ppm1=65.434 ppm2=26.699 assign ( resid 115 and name CA ) ( resid 111 and name CG ) 4.6 2.6 2.6 ! volume=26345163.250 peak=112 ppm1=65.479 ppm2=26.823 assign ( resid 87 and name CG ) ( resid 91 and name CB ) 4.6 2.6 2.6 ! volume=16486361.938 peak=125 ppm1=132.958 ppm2=38.260 assign ( resid 84 and name CG ) ( resid 80 and name CA ) 4.6 2.6 2.6 ! volume=51546564.500 peak=126 ppm1=130.708 ppm2=62.040 assign ( resid 133 and name CD2 ) ( resid 129 and name CB ) 4.6 2.6 2.6 ! volume=22603650.500 peak=127 ppm1=129.991 ppm2=38.282 assign ( resid 23 and name CZ2 ) ( resid 27 and name CB ) 4.6 2.6 2.6 ! volume=23255990.000 peak=147 ppm1=113.233 ppm2=30.306 assign ( resid 23 and name CG ) ( resid 22 and name CA ) 4.6 2.6 2.6 ! volume=20499917.500 peak=149 ppm1=111.539 ppm2=54.963 assign ( resid 23 and name CG ) ( resid 19 and name CA ) 4.6 2.6 2.6 ! volume=24359006.250 peak=150 ppm1=111.506 ppm2=66.537 assign ( resid 23 and name CD1 ) ( resid 24 and name CA ) 4.6 2.6 2.6 ! volume=20250285.500 peak=152 ppm1=127.374 ppm2=66.376 assign ( resid 23 and name CD2 ) ( resid 24 and name CA ) 4.6 2.6 2.6 ! volume=17002659.750 peak=153 ppm1=129.946 ppm2=66.321 assign ( resid 80 and name CG ) ( resid 83 and name CB ) 4.6 2.6 2.6 ! volume=34063058.000 peak=158 ppm1=110.511 ppm2=42.271 assign ( resid 133 and name CG ) ( resid 136 and name CB ) 4.6 2.6 2.6 ! volume=21444208.750 peak=159 ppm1=110.660 ppm2=41.378 assign ( resid 184 and name CG ) ( resid 185 and name CA ) 4.6 2.6 2.6 ! volume=28266860.250 peak=161 ppm1=110.519 ppm2=59.265 assign ( resid 108 and name CA ) ( resid 109 and name CA ) 4.6 2.6 2.6 ! volume=33728961.000 peak=167 ppm1=60.881 ppm2=54.108 assign ( resid 48 and name CA ) ( resid 49 and name CD ) 4.6 2.6 2.6 ! volume=37706062.250 peak=169 ppm1=59.783 ppm2=49.747 assign ( resid 3 and name CB ) ( resid 1 and name CD ) 4.6 2.6 2.6 ! volume=31899898.000 peak=175 ppm1=35.458 ppm2=50.034 assign ( resid 40 and name CA ) ( resid 37 and name CA ) 4.6 2.6 2.6 ! volume=19926527.250 peak=178 ppm1=61.874 ppm2=67.878 assign ( resid 198 and name CA ) ( resid 200 and name CA ) 4.6 2.6 2.6 ! volume=24125325.250 peak=182 ppm1=62.240 ppm2=66.564 assign ( resid 86 and name CA ) ( resid 87 and name CA ) 4.6 2.6 2.6 ! volume=26502466.250 peak=184 ppm1=62.585 ppm2=56.203 assign ( resid 131 and name CA ) ( resid 130 and name CA ) 4.6 2.6 2.6 ! volume=27442655.250 peak=185 ppm1=60.503 ppm2=56.285 assign ( resid 113 and name CA ) ( resid 109 and name CA ) 4.6 2.6 2.6 ! volume=32973640.250 peak=191 ppm1=59.104 ppm2=53.889 assign ( resid 173 and name CA ) ( resid 174 and name CA ) 4.6 2.6 2.6 ! volume=28913338.750 peak=193 ppm1=58.995 ppm2=53.210 assign ( resid 32 and name CA ) ( resid 31 and name CA ) 4.6 2.6 2.6 ! volume=17555003.750 peak=194 ppm1=58.224 ppm2=53.048 assign ( resid 47 and name CA ) ( resid 51 and name CA ) 4.6 2.6 2.6 ! volume=22205457.375 peak=195 ppm1=53.120 ppm2=57.685 assign ( resid 23 and name CA ) ( resid 22 and name CA ) 4.6 2.6 2.6 ! volume=72045540.500 peak=198 ppm1=58.479 ppm2=54.920 assign ( resid 79 and name CA ) ( resid 77 and name CA ) 4.6 2.6 2.6 ! volume=68554986.500 peak=199 ppm1=58.468 ppm2=54.833 assign ( resid 77 and name CA ) ( resid 75 and name CA ) 4.6 2.6 2.6 ! volume=40924031.500 peak=201 ppm1=54.895 ppm2=59.263 assign ( resid 10 and name CA ) ( resid 11 and name CA ) 4.6 2.6 2.6 ! 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volume=43369444.250 peak=275 ppm1=47.481 ppm2=60.121 assign ( resid 37 and name CB ) ( resid 38 and name CA ) 4.6 2.6 2.6 ! volume=18515852.250 peak=278 ppm1=34.658 ppm2=65.031 assign ( resid 58 and name CA ) ( resid 60 and name CA ) 4.6 2.6 2.6 ! volume=22817810.500 peak=280 ppm1=63.366 ppm2=45.747 assign ( resid 34 and name CD ) ( resid 36 and name CB ) 4.6 2.6 2.6 ! volume=88980945.000 peak=284 ppm1=50.660 ppm2=31.728 assign ( resid 85 and name CD ) ( resid 86 and name CB ) 4.6 2.6 2.6 ! volume=150054286.000 peak=286 ppm1=50.386 ppm2=32.923 assign ( resid 129 and name CB ) ( resid 125 and name CD ) 4.6 2.6 2.6 ! volume=48077243.000 peak=288 ppm1=38.191 ppm2=51.249 assign ( resid 134 and name CB ) ( resid 133 and name CA ) 4.6 2.6 2.6 ! volume=56740376.000 peak=291 ppm1=38.188 ppm2=58.312 assign ( resid 143 and name CA ) ( resid 141 and name CB ) 4.6 2.6 2.6 ! volume=22746512.750 peak=292 ppm1=58.163 ppm2=37.968 assign ( resid 128 and name CA ) ( resid 129 and name CB ) 4.6 2.6 2.6 ! volume=20639854.000 peak=293 ppm1=58.620 ppm2=38.096 assign ( resid 110 and name CA ) ( resid 111 and name CB ) 4.6 2.6 2.6 ! volume=22368206.500 peak=295 ppm1=59.367 ppm2=40.705 assign ( resid 21 and name CA ) ( resid 20 and name CB ) 4.6 2.6 2.6 ! volume=25599476.750 peak=296 ppm1=56.514 ppm2=40.661 assign ( resid 139 and name CA ) ( resid 140 and name CE ) 4.6 2.6 2.6 ! volume=54487245.000 peak=297 ppm1=56.978 ppm2=41.985 assign ( resid 144 and name CA ) ( resid 143 and name CD ) 4.6 2.6 2.6 ! volume=41468172.500 peak=299 ppm1=57.935 ppm2=42.070 assign ( resid 23 and name CA ) ( resid 20 and name CB ) 4.6 2.6 2.6 ! volume=40314928.500 peak=300 ppm1=58.122 ppm2=40.642 assign ( resid 149 and name CA ) ( resid 151 and name CB ) 4.6 2.6 2.6 ! volume=29771578.500 peak=302 ppm1=56.671 ppm2=41.587 assign ( resid 82 and name CA ) ( resid 83 and name CB ) 4.6 2.6 2.6 ! volume=20986801.500 peak=303 ppm1=59.043 ppm2=42.351 assign ( resid 136 and name CB ) ( resid 137 and name CA ) 4.6 2.6 2.6 ! volume=49902790.500 peak=305 ppm1=41.765 ppm2=47.680 assign ( resid 153 and name CB ) ( resid 154 and name CD ) 4.6 2.6 2.6 ! volume=22068187.750 peak=307 ppm1=33.772 ppm2=43.207 assign ( resid 72 and name CA ) ( resid 69 and name CG ) 4.6 2.6 2.6 ! volume=21581592.250 peak=311 ppm1=67.161 ppm2=26.809 assign ( resid 171 and name CG2 ) ( resid 172 and name CG ) 4.6 2.6 2.6 ! volume=26710051.750 peak=317 ppm1=21.245 ppm2=26.515 assign ( resid 28 and name CA ) ( resid 25 and name CG ) 4.6 2.6 2.6 ! volume=34241091.000 peak=320 ppm1=59.099 ppm2=24.849 assign ( resid 136 and name CG ) ( resid 132 and name CA ) 4.6 2.6 2.6 ! volume=26327498.250 peak=324 ppm1=27.424 ppm2=59.960 assign ( resid 56 and name CG ) ( resid 57 and name CA ) 4.6 2.6 2.6 ! volume=40769375.500 peak=326 ppm1=27.011 ppm2=54.986 assign ( resid 69 and name CG ) ( resid 66 and name CA ) 4.6 2.6 2.6 ! volume=38982704.750 peak=327 ppm1=27.154 ppm2=56.056 assign ( resid 114 and name CA ) ( resid 118 and name CG ) 4.6 2.6 2.6 ! volume=79269776.000 peak=328 ppm1=60.285 ppm2=32.981 assign ( resid 59 and name CB ) ( resid 55 and name CA ) 4.6 2.6 2.6 ! volume=87451659.000 peak=329 ppm1=32.949 ppm2=60.290 assign ( resid 169 and name CA ) ( resid 165 and name CB ) 4.6 2.6 2.6 ! volume=72058083.000 peak=332 ppm1=63.514 ppm2=31.544 assign ( resid 181 and name CB ) ( resid 184 and name CA ) 4.6 2.6 2.6 ! volume=30926823.000 peak=335 ppm1=30.709 ppm2=61.892 assign ( resid 142 and name CB ) ( resid 138 and name CB ) 4.6 2.6 2.6 ! volume=24908801.000 peak=338 ppm1=32.167 ppm2=42.448 assign ( resid 202 and name CB ) ( resid 201 and name CB ) 4.6 2.6 2.6 ! volume=14926620.500 peak=339 ppm1=41.809 ppm2=38.202 assign ( resid 66 and name CG ) ( resid 67 and name CA ) 4.6 2.6 2.6 ! volume=53727365.000 peak=343 ppm1=31.805 ppm2=58.116 assign ( resid 63 and name CA ) ( resid 66 and name CG ) 4.6 2.6 2.6 ! volume=31808235.750 peak=345 ppm1=59.859 ppm2=31.879 assign ( resid 166 and name CA ) ( resid 165 and name CB ) 4.6 2.6 2.6 ! volume=22258736.500 peak=346 ppm1=58.393 ppm2=31.469 assign ( resid 145 and name CA ) ( resid 144 and name CG ) 4.6 2.6 2.6 ! volume=23095161.500 peak=347 ppm1=59.358 ppm2=29.871 assign ( resid 44 and name CA ) ( resid 43 and name CG ) 4.6 2.6 2.6 ! volume=24142479.500 peak=348 ppm1=57.045 ppm2=27.251 assign ( resid 49 and name CD ) ( resid 48 and name CG2 ) 4.6 2.6 2.6 ! volume=21312224.000 peak=351 ppm1=49.653 ppm2=21.977 assign ( resid 206 and name CA ) ( resid 205 and name CG ) 4.6 2.6 2.6 ! volume=17497064.250 peak=352 ppm1=44.221 ppm2=26.164 assign ( resid 201 and name CB ) ( resid 202 and name CG ) 4.6 2.6 2.6 ! volume=46378384.500 peak=353 ppm1=38.216 ppm2=27.695 assign ( resid 142 and name CB ) ( resid 141 and name CB ) 4.6 2.6 2.6 ! volume=36237014.250 peak=356 ppm1=32.110 ppm2=37.984 assign ( resid 126 and name CB ) ( resid 129 and name CB ) 4.6 2.6 2.6 ! volume=23416373.000 peak=357 ppm1=30.838 ppm2=38.314 assign ( resid 70 and name CG ) ( resid 66 and name CG ) 4.6 2.6 2.6 ! volume=25692553.750 peak=358 ppm1=25.451 ppm2=31.987 assign ( resid 43 and name CB ) ( resid 44 and name CA ) 4.6 2.6 2.6 ! volume=50198218.000 peak=360 ppm1=42.094 ppm2=57.282 assign ( resid 134 and name CB ) ( resid 135 and name CD1 ) 4.6 2.6 2.6 ! volume=109877379.000 peak=362 ppm1=38.313 ppm2=13.572 assign ( resid 125 and name CA ) ( resid 129 and name CB ) 4.6 2.6 2.6 ! volume=14098370.375 peak=370 ppm1=63.117 ppm2=38.128 assign ( resid 161 and name CA ) ( resid 163 and name CA ) 4.6 2.6 2.6 ! volume=18981085.375 peak=373 ppm1=62.906 ppm2=57.489 assign ( resid 188 and name CA ) ( resid 192 and name CA ) 4.6 2.6 2.6 ! volume=25226563.000 peak=374 ppm1=64.459 ppm2=58.321 assign ( resid 106 and name CA ) ( resid 104 and name CA ) 4.6 2.6 2.6 ! volume=21394347.500 peak=377 ppm1=45.317 ppm2=65.636 assign ( resid 105 and name CA ) ( resid 102 and name CA ) 4.6 2.6 2.6 ! volume=23040495.750 peak=379 ppm1=50.575 ppm2=61.069 assign ( resid 116 and name CA ) ( resid 117 and name CA ) 4.6 2.6 2.6 ! volume=21624850.500 peak=380 ppm1=47.097 ppm2=61.322 assign ( resid 158 and name CG ) ( resid 157 and name CD ) 4.6 2.6 2.6 ! volume=21634628.250 peak=383 ppm1=25.024 ppm2=50.353 assign ( resid 26 and name CB ) ( resid 30 and name CA ) 4.6 2.6 2.6 ! volume=24677268.000 peak=384 ppm1=30.951 ppm2=55.930 assign ( resid 23 and name CG ) ( resid 24 and name CA ) 4.6 2.6 2.6 ! volume=18798554.875 peak=387 ppm1=111.614 ppm2=65.858 assign ( resid 113 and name CD ) ( resid 109 and name CA ) 4.6 2.6 2.6 ! volume=53086871.000 peak=390 ppm1=184.089 ppm2=54.098 assign ( resid 79 and name CD ) ( resid 82 and name CD ) 4.6 2.6 2.6 ! volume=23160800.375 peak=391 ppm1=184.118 ppm2=43.361 assign ( resid 28 and name CD ) ( resid 25 and name CA ) 4.6 2.6 2.6 ! volume=49253952.000 peak=394 ppm1=183.580 ppm2=60.150 assign ( resid 43 and name C ) ( resid 42 and name CA ) 4.6 2.6 2.6 ! volume=32360970.000 peak=395 ppm1=175.953 ppm2=54.303 assign ( resid 23 and name CD2 ) ( resid 26 and name CB ) 4.6 2.6 2.6 ! volume=375422.625 peak=403 ppm1=130.122 ppm2=31.233 assign ( resid 80 and name CE3 ) ( resid 76 and name CA ) 4.6 2.6 2.6 ! 24-25 021219 assign ( resid 43 and name C ) ( resid 47 and name CA ) 4.6 2.6 2.6 ! 21-19 021219 assign ( resid 97 and name CD ) ( resid 100 and name CA ) 4.6 2.6 2.6 ! 21-19 021219 assign ( resid 153 and name CB ) ( resid 151 and name CG ) 4.6 2.6 2.6 ! 21-19 021219
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