NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
576479 | 2mou | 19952 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
assign ( resid 50 and name HA ) ( resid 35 and name HG2# ) 3.3 1.6 1.3 volume=0.858 peak=4211 ppm1=5.179 ppm2=0.849 assign ( resid 200 and name HG2 ) ( resid 55 and name HD2 or resid 200 and name HA ) 4.1 2.4 1.6 volume=0.219 peak=104 ppm1=1.130 ppm2=3.356 assign ( resid 105 and name HN ) ( resid 101 and name HN or resid 103 and name HN ) 3.9 2.2 1.6 volume=0.312 peak=37 ppm1=7.943 ppm2=8.436 assign ( resid 194 and name HA ) ( resid 195 and name HN or resid 197 and name HN ) 3.8 2.1 1.5 volume=0.364 peak=105 ppm1=4.334 ppm2=7.999 assign ( resid 187 and name HA ) ( resid 186 and name HB1 or resid 188 and name HE# ) 4.7 3.0 1.3 volume=0.094 peak=170 ppm1=4.270 ppm2=1.869 assign ( resid 80 and name HB ) ( resid 80 and name HG2# or resid 80 and name HG1# ) 3.3 1.6 1.3 volume=0.774 peak=154 ppm1=1.396 ppm2=0.709 assign ( resid 212 and name HN ) ( resid 211 and name HN or resid 213 and name HN ) 4.2 2.5 1.7 volume=0.185 peak=31 ppm1=8.244 ppm2=8.313 assign ( resid 210 and name HN or resid 211 and name HN ) ( resid 211 and name HN or resid 212 and name HN or resid 213 and name HN ) 3.6 1.9 1.4 volume=0.488 peak=153 ppm1=8.307 ppm2=8.267 assign ( resid 105 and name HB1 ) ( resid 105 and name HN or resid 106 and name HN ) 4.2 2.5 1.7 volume=0.185 peak=28 ppm1=3.871 ppm2=7.945 assign ( resid 208 and name HN ) ( resid 205 and name HA or resid 207 and name HA ) 3.0 1.2 1.2 volume=1.568 peak=77 ppm1=8.013 ppm2=4.149 assign ( resid 190 and name HA ) ( resid 191 and name HN or resid 193 and name HN ) 3.6 1.8 1.4 volume=0.523 peak=29 ppm1=3.981 ppm2=7.619 assign ( resid 196 and name HD1# ) ( resid 33 and name HG2# or resid 54 and name HD1# ) 3.0 1.2 1.2 volume=1.615 peak=195 ppm1=0.728 ppm2=0.491 assign ( resid 166 and name HN ) ( resid 156 and name HA or resid 167 and name HA ) 3.2 1.5 1.3 volume=0.991 peak=215 ppm1=9.000 ppm2=5.271 assign ( resid 196 and name HD1# ) ( resid 52 and name HN or resid 199 and name HN ) 4.0 2.3 1.6 volume=0.274 peak=23 ppm1=0.727 ppm2=8.593 assign ( resid 183 and name HG11 ) ( resid 180 and name HB2 or resid 180 and name HB1 or resid 183 and name HA ) 3.5 1.8 1.4 volume=0.559 peak=208 ppm1=1.268 ppm2=3.916 assign ( resid 66 and name HD1 or resid 66 and name HD2 ) ( resid 115 and name HG2# or resid 117 and name HG11 or resid 117 and name HG12 or resid 127 and name HG2# ) 2.6 0.8 1.0 volume=3.752 peak=40 ppm1=6.988 ppm2=0.690 assign ( resid 194 and name HA ) ( resid 193 and name HG1# or resid 197 and name HD1# ) 3.1 1.4 1.3 volume=1.138 peak=151 ppm1=4.321 ppm2=0.770 assign ( resid 192 and name HN ) ( resid 35 and name HG2# or resid 171 and name HG1# ) 3.0 1.2 1.2 volume=1.606 peak=136 ppm1=8.209 ppm2=0.873 assign ( resid 3 and name HD1 or resid 3 and name HD2 ) ( resid 114 and name HG or resid 132 and name HG2# ) 3.2 1.5 1.3 volume=0.998 peak=185 ppm1=7.379 ppm2=0.942 assign ( resid 204 and name HN ) ( resid 203 and name HA or resid 204 and name HE2 ) 3.1 1.4 1.3 volume=1.105 peak=94 ppm1=6.747 ppm2=2.837 assign ( resid 169 and name HN ) ( resid 50 and name HG2# or resid 167 and name HD1# or resid 168 and name HG1# ) 2.9 1.2 1.2 volume=1.799 peak=6 ppm1=9.258 ppm2=0.750 assign ( resid 66 and name HD1 or resid 66 and name HD2 ) ( resid 65 and name HD2# or resid 71 and name HG2 or resid 71 and name HG1 or resid 115 and name HG1# or resid 117 and name HG2# or resid 127 and name HD1# ) 2.7 1.0 1.1 volume=2.589 peak=189 ppm1=6.987 ppm2=0.327 assign ( resid 184 and name HD1# ) ( resid 179 and name HG or resid 183 and name HG12 ) 2.5 0.8 1.0 volume=4.547 peak=25 ppm1=0.889 ppm2=1.537 assign ( resid 134 and name HB2 ) ( resid 135 and name HG2 or resid 136 and name HB1 ) 4.3 2.6 1.7 volume=0.174 peak=57 ppm1=2.954 ppm2=1.788 assign ( resid 206 and name HN ) ( resid 205 and name HA or resid 207 and name HA ) 3.4 1.7 1.4 volume=0.643 peak=7 ppm1=7.464 ppm2=4.142 assign ( resid 137 and name HN ) ( resid 134 and name HD1 or resid 134 and name HD2 or resid 136 and name HN ) 2.9 1.2 1.2 volume=1.722 peak=186 ppm1=8.051 ppm2=6.878 assign ( resid 116 and name HN ) ( resid 117 and name HA or resid 127 and name HA ) 3.8 2.1 1.5 volume=0.352 peak=115 ppm1=8.835 ppm2=5.020 assign ( resid 60 and name HG2 ) ( resid 60 and name HE1 or resid 203 and name HA ) 2.7 1.0 1.1 volume=2.506 peak=61 ppm1=1.324 ppm2=2.840 assign ( resid 180 and name HN ) ( resid 183 and name HD1# or resid 184 and name HD1# ) 2.7 1.0 1.1 volume=2.483 peak=166 ppm1=8.353 ppm2=0.882 assign ( resid 128 and name HN ) ( resid 126 and name HG11 or resid 127 and name HG11 ) 2.9 1.1 1.1 volume=1.971 peak=73 ppm1=9.932 ppm2=1.015 assign ( resid 157 and name HD1 ) ( resid 124 and name HA or resid 156 and name HA ) 3.8 2.1 1.5 volume=0.346 peak=132 ppm1=3.626 ppm2=5.271 assign ( resid 147 and name HN ) ( resid 146 and name HN or resid 176 and name HN ) 3.5 1.8 1.4 volume=0.579 peak=129 ppm1=8.785 ppm2=8.444 assign ( resid 153 and name HB2 ) ( resid 127 and name HN or resid 153 and name HN ) 3.9 2.1 1.5 volume=0.321 peak=169 ppm1=2.854 ppm2=9.345 assign ( resid 158 and name HN ) ( resid 58 and name HG2 or resid 58 and name HG1 or resid 157 and name HG2 ) 2.6 0.9 1.0 volume=3.674 peak=74 ppm1=8.221 ppm2=1.795 assign ( resid 33 and name HD1# ) ( resid 193 and name HG2# or resid 197 and name HD2# ) 3.5 1.8 1.4 volume=0.568 peak=54 ppm1=0.359 ppm2=0.746 assign ( resid 113 and name HN ) ( resid 95 and name HN or resid 115 and name HN ) 4.5 2.7 1.5 volume=0.138 peak=198 ppm1=8.235 ppm2=9.084 assign ( resid 3 and name HN ) ( resid 1 and name HN# or resid 2 and name HN ) 3.0 1.2 1.2 volume=1.602 peak=202 ppm1=7.914 ppm2=8.181 assign ( resid 98 and name HG2# ) ( resid 98 and name HB or resid 98 and name HA ) 4.3 2.6 1.7 volume=0.163 peak=81 ppm1=1.318 ppm2=4.632 assign ( resid 18 and name HB2 ) ( resid 14 and name HG2# or resid 168 and name HG1# ) 3.8 2.1 1.5 volume=0.338 peak=122 ppm1=2.447 ppm2=0.765 assign ( resid 114 and name HD1# ) ( resid 87 and name HG12 or resid 114 and name HB1 ) 2.8 1.1 1.1 volume=2.252 peak=109 ppm1=0.538 ppm2=1.034 assign ( resid 12 and name HN ) ( resid 9 and name HB2 or resid 9 and name HB1 or resid 12 and name HB2 ) 2.9 1.2 1.2 volume=1.773 peak=172 ppm1=7.546 ppm2=2.285 assign ( resid 203 and name HG2# ) ( resid 55 and name HD2 or resid 200 and name HA ) 3.3 1.6 1.3 volume=0.807 peak=21 ppm1=0.338 ppm2=3.379 assign ( resid 92 and name HN ) ( resid 87 and name HG12 or resid 91 and name HG2# ) 2.8 1.1 1.1 volume=2.116 peak=137 ppm1=9.456 ppm2=1.011 assign ( resid 192 and name HB2 ) ( resid 35 and name HB or resid 193 and name HB ) 4.3 2.6 1.7 volume=0.176 peak=119 ppm1=1.331 ppm2=2.010 assign ( resid 18 and name HB2 ) ( resid 154 and name HG2# or resid 154 and name HG1# ) 3.8 2.1 1.5 volume=0.338 peak=12 ppm1=2.446 ppm2=0.837 assign ( resid 16 and name HN ) ( resid 13 and name HA or resid 15 and name HA or resid 16 and name HA2 or resid 16 and name HA1 ) 3.1 1.4 1.2 volume=1.252 peak=123 ppm1=7.496 ppm2=3.681 assign ( resid 81 and name HB1 or resid 81 and name HB2 ) ( resid 72 and name HD1# or resid 72 and name HG2# ) 3.9 2.2 1.6 volume=0.286 peak=69 ppm1=2.326 ppm2=0.576 assign ( resid 203 and name HN ) ( resid 54 and name HG2# or resid 199 and name HB# ) 3.1 1.3 1.2 volume=1.327 peak=92 ppm1=7.683 ppm2=0.622 assign ( resid 17 and name HN ) ( resid 16 and name HN or resid 19 and name HN ) 2.8 1.0 1.1 volume=2.393 peak=162 ppm1=7.602 ppm2=7.496 assign ( resid 173 and name HN ) ( resid 47 and name HD2# or resid 47 and name HD1# ) 3.2 1.5 1.3 volume=0.918 peak=108 ppm1=8.519 ppm2=0.096 assign ( resid 154 and name HG1# ) ( resid 126 and name HA or resid 153 and name HA ) 3.9 2.2 1.6 volume=0.287 peak=114 ppm1=0.910 ppm2=5.338 assign ( resid 35 and name HN ) ( resid 34 and name HA or resid 35 and name HA ) 3.0 1.2 1.2 volume=1.624 peak=19 ppm1=9.429 ppm2=4.920 assign ( resid 203 and name HN ) ( resid 200 and name HA or resid 202 and name HA2 ) 3.3 1.5 1.3 volume=0.894 peak=100 ppm1=7.684 ppm2=3.357 assign ( resid 199 and name HN ) ( resid 196 and name HD1# or resid 196 and name HG2# ) 2.7 1.0 1.1 volume=2.587 peak=140 ppm1=8.633 ppm2=0.754 assign ( resid 144 and name HN ) ( resid 145 and name HN or resid 146 and name HN ) 3.9 2.2 1.6 volume=0.298 peak=180 ppm1=7.536 ppm2=8.409 assign ( resid 106 and name HA ) ( resid 106 and name HD1# or resid 179 and name HD2# ) 3.2 1.5 1.3 volume=0.938 peak=199 ppm1=4.143 ppm2=0.766 assign ( resid 156 and name HN ) ( resid 156 and name HA or resid 167 and name HA ) 2.7 1.0 1.1 volume=2.933 peak=80 ppm1=8.552 ppm2=5.182 assign ( resid 200 and name HA ) ( resid 199 and name HA or resid 200 and name HE1 ) 4.4 2.7 1.6 volume=0.146 peak=171 ppm1=3.361 ppm2=2.804 assign ( resid 184 and name HD1# ) ( resid 180 and name HB2 or resid 183 and name HA ) 3.1 1.4 1.2 volume=1.264 peak=52 ppm1=0.889 ppm2=3.908 assign ( resid 184 and name HD1# ) ( resid 184 and name HG2# or resid 184 and name HG12 ) 2.4 0.6 0.9 volume=6.327 peak=76 ppm1=0.895 ppm2=1.093 assign ( resid 195 and name HB1 ) ( resid 196 and name HD1# or resid 199 and name HB# ) 4.4 2.7 1.6 volume=0.153 peak=182 ppm1=3.221 ppm2=0.702 assign ( resid 116 and name HA ) ( resid 91 and name HG2# or resid 117 and name HB ) 4.2 2.5 1.7 volume=0.186 peak=4 ppm1=6.164 ppm2=1.032 assign ( resid 84 and name HG1# ) ( resid 85 and name HN or resid 134 and name HE1 or resid 134 and name HE2 ) 3.4 1.7 1.4 volume=0.644 peak=158 ppm1=0.533 ppm2=7.152 assign ( resid 176 and name HN ) ( resid 146 and name HA2 or resid 176 and name HA ) 2.9 1.1 1.1 volume=1.992 peak=183 ppm1=8.402 ppm2=4.003 assign ( resid 196 and name HD1# ) ( resid 50 and name HG2# or resid 167 and name HD1# ) 2.1 0.3 0.8 volume=14.150 peak=193 ppm1=0.729 ppm2=0.788 assign ( resid 103 and name HA ) ( resid 103 and name HG1# or resid 103 and name HG2# ) 3.9 2.2 1.6 volume=0.295 peak=201 ppm1=3.628 ppm2=0.879 assign ( resid 184 and name HN ) ( resid 183 and name HD1# or resid 184 and name HD1# ) 2.7 1.0 1.1 volume=2.845 peak=197 ppm1=7.501 ppm2=0.878 assign ( resid 13 and name HN ) ( resid 14 and name HN or resid 15 and name HN ) 2.6 0.9 1.0 volume=3.664 peak=63 ppm1=7.721 ppm2=7.785 assign ( resid 194 and name HN ) ( resid 191 and name HA or resid 194 and name HA ) 2.8 1.1 1.1 volume=2.121 peak=16 ppm1=7.774 ppm2=4.276 assign ( resid 201 and name HN ) ( resid 198 and name HN or resid 199 and name HN ) 3.4 1.7 1.4 volume=0.678 peak=143 ppm1=7.405 ppm2=8.675 assign ( resid 129 and name HN ) ( resid 128 and name HB1 or resid 152 and name HA1 ) 3.5 1.8 1.4 volume=0.607 peak=184 ppm1=8.719 ppm2=3.719 assign ( resid 15 and name HD1# ) ( resid 12 and name HG1 or resid 12 and name HG2 or resid 18 and name HB2 ) 3.5 1.8 1.4 volume=0.607 peak=210 ppm1=0.439 ppm2=2.457 assign ( resid 196 and name HN ) ( resid 195 and name HN or resid 197 and name HN ) 3.2 1.5 1.3 volume=0.929 peak=41 ppm1=7.439 ppm2=7.970 assign ( resid 3 and name HE1 or resid 3 and name HE2 ) ( resid 6 and name HD1# or resid 114 and name HD2# ) 2.5 0.8 1.0 volume=4.577 peak=160 ppm1=7.211 ppm2=0.789 assign ( resid 200 and name HN ) ( resid 196 and name HD1# or resid 197 and name HD2# ) 2.8 1.1 1.1 volume=2.320 peak=96 ppm1=8.085 ppm2=0.749 assign ( resid 197 and name HG ) ( resid 197 and name HD2# or resid 197 and name HD1# ) 3.6 1.9 1.4 volume=0.476 peak=58 ppm1=1.277 ppm2=0.756 assign ( resid 105 and name HN ) ( resid 103 and name HG1# or resid 103 and name HG2# ) 3.4 1.7 1.4 volume=0.726 peak=34 ppm1=7.943 ppm2=0.879 assign ( resid 167 and name HN ) ( resid 167 and name HD2# or resid 167 and name HD1# or resid 168 and name HG1# ) 3.0 1.3 1.2 volume=1.388 peak=26 ppm1=8.643 ppm2=0.754 assign ( resid 117 and name HN ) ( resid 91 and name HG2# or resid 117 and name HB ) 3.1 1.3 1.2 volume=1.322 peak=53 ppm1=8.232 ppm2=1.011 assign ( resid 11 and name HN ) ( resid 6 and name HD1# or resid 7 and name HB# ) 2.6 0.9 1.1 volume=3.260 peak=209 ppm1=8.180 ppm2=0.752 assign ( resid 203 and name HN ) ( resid 201 and name HN or resid 206 and name HN ) 3.7 2.0 1.5 volume=0.438 peak=177 ppm1=7.683 ppm2=7.459 assign ( resid 183 and name HG2# ) ( resid 183 and name HN or resid 184 and name HN ) 3.2 1.5 1.3 volume=1.029 peak=62 ppm1=0.932 ppm2=7.472 assign ( resid 186 and name HN ) ( resid 182 and name HA or resid 186 and name HA ) 2.6 0.9 1.0 volume=3.383 peak=75 ppm1=7.370 ppm2=4.138 assign ( resid 153 and name HB1 ) ( resid 126 and name HG2# or resid 127 and name HG2# or resid 167 and name HD2# ) 3.2 1.5 1.3 volume=0.948 peak=88 ppm1=2.853 ppm2=0.764 assign ( resid 189 and name HA ) ( resid 189 and name HG1 or resid 192 and name HG ) 4.4 2.7 1.6 volume=0.142 peak=1 ppm1=4.646 ppm2=1.776 assign ( resid 167 and name HD2# ) ( resid 61 and name HB1 or resid 65 and name HB1 ) 3.0 1.3 1.2 volume=1.334 peak=174 ppm1=0.763 ppm2=1.640 assign ( resid 85 and name HB2 ) ( resid 85 and name HN or resid 134 and name HE1 or resid 134 and name HE2 ) 4.0 2.3 1.6 volume=0.263 peak=56 ppm1=3.049 ppm2=7.151 assign ( resid 34 and name HA ) ( resid 28 and name HG2 or resid 34 and name HG2# ) 4.2 2.5 1.7 volume=0.189 peak=134 ppm1=4.964 ppm2=1.095 assign ( resid 187 and name HG2# ) ( resid 106 and name HD1# or resid 179 and name HD2# ) 2.4 0.6 0.9 volume=6.164 peak=110 ppm1=1.063 ppm2=0.773 assign ( resid 176 and name HN ) ( resid 147 and name HN or resid 175 and name HN ) 3.3 1.6 1.3 volume=0.843 peak=207 ppm1=8.404 ppm2=8.823 assign ( resid 200 and name HB1 ) ( resid 55 and name HD2 or resid 200 and name HA ) 4.1 2.4 1.7 volume=0.211 peak=90 ppm1=1.670 ppm2=3.366 assign ( resid 72 and name HG2# ) ( resid 73 and name HN or resid 75 and name HN ) 3.2 1.5 1.3 volume=1.036 peak=135 ppm1=0.601 ppm2=7.476 assign ( resid 72 and name HG12 ) ( resid 72 and name HD1# or resid 72 and name HG2# ) 3.0 1.3 1.2 volume=1.366 peak=32 ppm1=1.038 ppm2=0.589 assign ( resid 94 and name HN ) ( resid 95 and name HN or resid 115 and name HN ) 3.7 2.0 1.5 volume=0.402 peak=112 ppm1=9.603 ppm2=9.093 assign ( resid 154 and name HN ) ( resid 126 and name HG2# or resid 167 and name HD1# ) 3.5 1.8 1.4 volume=0.570 peak=89 ppm1=10.007 ppm2=0.756 assign ( resid 196 and name HG2# ) ( resid 33 and name HG2# or resid 54 and name HD1# ) 3.0 1.2 1.2 volume=1.605 peak=159 ppm1=0.812 ppm2=0.505 assign ( resid 16 and name HN ) ( resid 14 and name HN or resid 15 and name HN ) 3.0 1.3 1.2 volume=1.400 peak=124 ppm1=7.497 ppm2=7.777 assign ( resid 3 and name HE1 or resid 3 and name HE2 ) ( resid 114 and name HD1# or resid 132 and name HG1# ) 2.8 1.1 1.1 volume=2.349 peak=139 ppm1=7.214 ppm2=0.532 assign ( resid 114 and name HD1# ) ( resid 114 and name HG or resid 132 and name HG2# ) 2.8 1.1 1.1 volume=2.180 peak=106 ppm1=0.538 ppm2=0.956 assign ( resid 80 and name HG2# or resid 80 and name HG1# ) ( resid 80 and name HA ) 3.4 1.7 1.4 volume=0.667 peak=17 ppm1=0.708 ppm2=3.983 assign ( resid 124 and name HN ) ( resid 122 and name HA2 or resid 157 and name HD2 ) 3.1 1.4 1.2 volume=1.198 peak=14 ppm1=6.472 ppm2=3.619 assign ( resid 197 and name HN ) ( resid 196 and name HD1# or resid 199 and name HB# ) 3.2 1.4 1.3 volume=1.093 peak=179 ppm1=7.990 ppm2=0.667 assign ( resid 167 and name HG ) ( resid 167 and name HD2# or resid 167 and name HD1# ) 2.8 1.1 1.1 volume=2.364 peak=156 ppm1=0.922 ppm2=0.764 assign ( resid 205 and name HN ) ( resid 202 and name HA1 or resid 206 and name HB2 ) 3.2 1.4 1.3 volume=1.097 peak=214 ppm1=7.179 ppm2=2.964 assign ( resid 190 and name HN ) ( resid 186 and name HA or resid 188 and name HA ) 3.5 1.8 1.4 volume=0.544 peak=117 ppm1=7.520 ppm2=4.201 assign ( resid 179 and name HN ) ( resid 178 and name HD1 or resid 179 and name HG ) 2.6 0.9 1.1 volume=3.252 peak=165 ppm1=7.303 ppm2=1.535 assign ( resid 152 and name HN ) ( resid 129 and name HN or resid 151 and name HN ) 4.0 2.3 1.6 volume=0.259 peak=38 ppm1=8.344 ppm2=8.688 assign ( resid 158 and name HN ) ( resid 159 and name HN or resid 166 and name HN ) 3.4 1.7 1.4 volume=0.713 peak=212 ppm1=8.218 ppm2=8.965 assign ( resid 65 and name HD1# ) ( resid 65 and name HB1 or resid 65 and name HB2 or resid 65 and name HG ) 3.2 1.5 1.3 volume=1.025 peak=20 ppm1=0.175 ppm2=1.636 assign ( resid 112 and name HN ) ( resid 131 and name HB2 or resid 145 and name HD2 ) 4.0 2.2 1.6 volume=0.276 peak=147 ppm1=8.134 ppm2=3.483 assign ( resid 169 and name HA ) ( resid 167 and name HD1# or resid 168 and name HG1# ) 3.6 1.9 1.4 volume=0.489 peak=27 ppm1=5.232 ppm2=0.772 assign ( resid 159 and name HN ) ( resid 159 and name HG1 or resid 160 and name HG1 ) 3.1 1.4 1.2 volume=1.246 peak=78 ppm1=9.025 ppm2=2.251 assign ( resid 136 and name HB1 ) ( resid 134 and name HD1 or resid 134 and name HD2 or resid 136 and name HN ) 3.7 2.0 1.5 volume=0.437 peak=3 ppm1=1.745 ppm2=6.888 assign ( resid 56 and name HN ) ( resid 55 and name HB1 or resid 56 and name HB1 ) 2.8 1.1 1.1 volume=2.037 peak=181 ppm1=8.639 ppm2=1.794 assign ( resid 211 and name HN or resid 213 and name HN ) ( resid 212 and name HN or resid 213 and name HN ) 4.0 2.3 1.6 volume=0.273 peak=150 ppm1=8.282 ppm2=8.243 assign ( resid 18 and name HB1 ) ( resid 154 and name HG2# or resid 154 and name HG1# ) 3.9 2.1 1.5 volume=0.326 peak=133 ppm1=2.970 ppm2=0.894 assign ( resid 188 and name HN ) ( resid 186 and name HA or resid 187 and name HB ) 3.0 1.3 1.2 volume=1.547 peak=203 ppm1=8.442 ppm2=4.186 assign ( resid 154 and name HG2# ) ( resid 126 and name HG2# or resid 167 and name HD1# or resid 168 and name HG1# ) 1.7 0.0 0.7 volume=67.417 peak=82 ppm1=0.838 ppm2=0.752 assign ( resid 186 and name HN ) ( resid 183 and name HA or resid 185 and name HA ) 3.0 1.3 1.2 volume=1.483 peak=142 ppm1=7.370 ppm2=3.885 assign ( resid 155 and name HB2 ) ( resid 61 and name HD1# or resid 126 and name HG2# or resid 167 and name HD2# ) 4.0 2.3 1.6 volume=0.266 peak=43 ppm1=2.572 ppm2=0.768 assign ( resid 184 and name HB ) ( resid 184 and name HG2# or resid 184 and name HG12 ) 3.1 1.4 1.2 volume=1.217 peak=22 ppm1=2.044 ppm2=1.095 assign ( resid 132 and name HB ) ( resid 132 and name HA or resid 133 and name HA ) 4.8 3.1 1.2 volume=0.089 peak=64 ppm1=2.284 ppm2=4.671 assign ( resid 196 and name HG2# ) ( resid 196 and name HD1# or resid 197 and name HD2# ) 1.9 0.2 0.8 volume=19.681 peak=131 ppm1=0.812 ppm2=0.727 assign ( resid 126 and name HN ) ( resid 117 and name HA or resid 127 and name HA ) 3.7 2.0 1.5 volume=0.431 peak=204 ppm1=9.105 ppm2=5.048 assign ( resid 30 and name HN ) ( resid 28 and name HG1 or resid 29 and name HG2# ) 2.8 1.1 1.1 volume=2.267 peak=55 ppm1=8.721 ppm2=1.048 assign ( resid 183 and name HN ) ( resid 182 and name HB2 or resid 183 and name HA ) 2.6 0.9 1.0 volume=3.530 peak=116 ppm1=7.419 ppm2=3.876 assign ( resid 174 and name HN ) ( resid 147 and name HN or resid 175 and name HN ) 3.8 2.0 1.5 volume=0.375 peak=196 ppm1=9.153 ppm2=8.813 assign ( resid 214 and name HN ) ( resid 211 and name HN or resid 213 and name HN ) 3.5 1.7 1.4 volume=0.620 peak=33 ppm1=7.957 ppm2=8.272 assign ( resid 84 and name HN ) ( resid 85 and name HN or resid 134 and name HE1 or resid 134 and name HE2 ) 3.2 1.5 1.3 volume=0.969 peak=24 ppm1=8.503 ppm2=7.131 assign ( resid 155 and name HB1 ) ( resid 61 and name HD1# or resid 126 and name HG2# or resid 167 and name HD2# ) 3.9 2.2 1.6 volume=0.307 peak=121 ppm1=3.008 ppm2=0.743 assign ( resid 133 and name HN ) ( resid 132 and name HA or resid 133 and name HA ) 2.5 0.8 1.0 volume=4.183 peak=42 ppm1=8.123 ppm2=4.657 assign ( resid 21 and name HG2# ) ( resid 21 and name HA or resid 21 and name HB ) 3.4 1.7 1.4 volume=0.682 peak=35 ppm1=1.146 ppm2=4.679 assign ( resid 3 and name HD1 or resid 3 and name HD2 ) ( resid 6 and name HD1# or resid 114 and name HD2# ) 3.1 1.3 1.2 volume=1.286 peak=86 ppm1=7.379 ppm2=0.793 assign ( resid 197 and name HN ) ( resid 193 and name HG2# or resid 197 and name HD2# or resid 197 and name HD1# ) 2.5 0.8 1.0 volume=4.416 peak=130 ppm1=7.990 ppm2=0.749 assign ( resid 72 and name HG2# ) ( resid 72 and name HG11 or resid 73 and name HG2# ) 2.8 1.1 1.1 volume=2.031 peak=60 ppm1=0.603 ppm2=1.200 assign ( resid 193 and name HB ) ( resid 193 and name HG1# or resid 193 and name HG2# ) 3.0 1.2 1.2 volume=1.622 peak=187 ppm1=2.054 ppm2=0.749 assign ( resid 192 and name HG ) ( resid 35 and name HG2# or resid 171 and name HG1# ) 3.0 1.3 1.2 volume=1.374 peak=72 ppm1=1.754 ppm2=0.870 assign ( resid 155 and name HN ) ( resid 124 and name HG1 or resid 125 and name HB2 ) 3.6 1.9 1.5 volume=0.469 peak=97 ppm1=8.976 ppm2=2.428 assign ( resid 154 and name HN ) ( resid 154 and name HG2# or resid 154 and name HG1# ) 2.8 1.1 1.1 volume=2.147 peak=83 ppm1=10.007 ppm2=0.880 assign ( resid 192 and name HD1# ) ( resid 50 and name HG2# or resid 171 and name HG2# ) 2.9 1.2 1.2 volume=1.646 peak=45 ppm1=0.492 ppm2=0.759 assign ( resid 168 and name HG2# ) ( resid 167 and name HA or resid 169 and name HA ) 4.2 2.5 1.7 volume=0.185 peak=188 ppm1=0.202 ppm2=5.266 assign ( resid 191 and name HN ) ( resid 187 and name HA or resid 191 and name HA ) 2.8 1.1 1.1 volume=2.088 peak=111 ppm1=7.651 ppm2=4.273 assign ( resid 197 and name HD1# ) ( resid 76 and name HE1 or resid 194 and name HB1 ) 3.1 1.3 1.2 volume=1.293 peak=205 ppm1=0.757 ppm2=2.847 assign ( resid 183 and name HG2# ) ( resid 180 and name HB2 or resid 180 and name HB1 or resid 182 and name HB2 or resid 182 and name HB1 or resid 183 and name HA ) 3.1 1.3 1.2 volume=1.327 peak=146 ppm1=0.932 ppm2=3.903 assign ( resid 183 and name HB ) ( resid 183 and name HG2# or resid 183 and name HD1# ) 2.8 1.1 1.1 volume=2.317 peak=67 ppm1=1.976 ppm2=0.901 assign ( resid 169 and name HN ) ( resid 51 and name HG1 or resid 169 and name HG1 or resid 169 and name HG2 ) 3.3 1.6 1.3 volume=0.856 peak=9 ppm1=9.256 ppm2=1.923 assign ( resid 155 and name HN ) ( resid 124 and name HA or resid 156 and name HA ) 3.4 1.7 1.4 volume=0.707 peak=211 ppm1=8.977 ppm2=5.166 assign ( resid 154 and name HG2# ) ( resid 155 and name HA or resid 167 and name HA or resid 169 and name HA ) 3.9 2.2 1.6 volume=0.313 peak=176 ppm1=0.837 ppm2=5.252 assign ( resid 12 and name HN ) ( resid 13 and name HN or resid 14 and name HN ) 3.0 1.3 1.2 volume=1.423 peak=2 ppm1=7.547 ppm2=7.762 assign ( resid 176 and name HB2 ) ( resid 176 and name HN or resid 177 and name HN ) 4.3 2.6 1.7 volume=0.170 peak=128 ppm1=1.851 ppm2=8.451 assign ( resid 167 and name HB2 ) ( resid 61 and name HD1# or resid 167 and name HD2# ) 3.5 1.8 1.4 volume=0.614 peak=93 ppm1=1.678 ppm2=0.765 assign ( resid 65 and name HN ) ( resid 64 and name HA or resid 65 and name HA ) 3.0 1.2 1.2 volume=1.569 peak=15 ppm1=7.742 ppm2=3.879 assign ( resid 170 and name HA ) ( resid 48 and name HN or resid 169 and name HN ) 4.1 2.4 1.6 volume=0.225 peak=138 ppm1=5.822 ppm2=9.233 assign ( resid 156 and name HN ) ( resid 58 and name HB1 or resid 124 and name HB2 ) 3.1 1.4 1.3 volume=1.123 peak=101 ppm1=8.551 ppm2=2.057 assign ( resid 187 and name HN ) ( resid 184 and name HB or resid 185 and name HB2 ) 3.4 1.6 1.3 volume=0.755 peak=18 ppm1=7.600 ppm2=2.138 assign ( resid 184 and name HN ) ( resid 184 and name HG2# or resid 184 and name HG12 ) 2.7 1.0 1.1 volume=2.599 peak=164 ppm1=7.501 ppm2=1.094 assign ( resid 198 and name HB2 ) ( resid 198 and name HN or resid 199 and name HN ) 4.5 2.8 1.5 volume=0.132 peak=65 ppm1=3.090 ppm2=8.718 assign ( resid 203 and name HD1# ) ( resid 200 and name HA or resid 202 and name HA2 ) 3.9 2.2 1.6 volume=0.306 peak=194 ppm1=-0.010 ppm2=3.381 assign ( resid 207 and name HA ) ( resid 206 and name HB1 or resid 207 and name HD2 ) 3.7 2.0 1.5 volume=0.404 peak=103 ppm1=4.168 ppm2=3.043 assign ( resid 192 and name HN ) ( resid 191 and name HN or resid 193 and name HN ) 3.1 1.3 1.2 volume=1.290 peak=190 ppm1=8.209 ppm2=7.650 assign ( resid 54 and name HD1# ) ( resid 55 and name HD2 or resid 200 and name HA ) 3.1 1.4 1.2 volume=1.268 peak=46 ppm1=0.491 ppm2=3.376 assign ( resid 82 and name HA ) ( resid 82 and name HN or resid 83 and name HN ) 4.1 2.4 1.6 volume=0.229 peak=141 ppm1=5.041 ppm2=8.559 assign ( resid 16 and name HN ) ( resid 13 and name HA or resid 15 and name HA ) 2.6 0.9 1.0 volume=3.693 peak=85 ppm1=7.496 ppm2=3.630 assign ( resid 184 and name HG11 ) ( resid 184 and name HG2# or resid 184 and name HG12 ) 2.7 1.0 1.1 volume=2.525 peak=99 ppm1=1.676 ppm2=1.092 assign ( resid 65 and name HD1# ) ( resid 64 and name HB2 or resid 64 and name HB1 or resid 66 and name HB2 ) 4.2 2.5 1.7 volume=0.203 peak=155 ppm1=0.176 ppm2=3.050 assign ( resid 65 and name HD2# ) ( resid 65 and name HB1 or resid 65 and name HB2 or resid 65 and name HG ) 3.1 1.3 1.2 volume=1.321 peak=107 ppm1=0.320 ppm2=1.634 assign ( resid 103 and name HB ) ( resid 103 and name HG1# or resid 103 and name HG2# ) 4.3 2.6 1.7 volume=0.160 peak=206 ppm1=2.588 ppm2=0.875 assign ( resid 147 and name HN ) ( resid 148 and name HN or resid 174 and name HN ) 3.7 2.0 1.5 volume=0.398 peak=68 ppm1=8.784 ppm2=9.154 assign ( resid 67 and name HN ) ( resid 66 and name HN or resid 68 and name HN ) 2.8 1.0 1.1 volume=2.451 peak=200 ppm1=7.603 ppm2=8.050 assign ( resid 198 and name HN ) ( resid 197 and name HD2# or resid 197 and name HD1# ) 2.7 1.0 1.1 volume=2.626 peak=48 ppm1=8.716 ppm2=0.751 assign ( resid 212 and name HA ) ( resid 211 and name HG1 or resid 212 and name HG1 ) 3.9 2.2 1.6 volume=0.309 peak=39 ppm1=4.141 ppm2=1.518 assign ( resid 93 and name HD1# ) ( resid 85 and name HN or resid 134 and name HE1 or resid 134 and name HE2 ) 3.0 1.3 1.2 volume=1.546 peak=49 ppm1=-0.271 ppm2=7.155 assign ( resid 102 and name HB# ) ( resid 105 and name HN or resid 106 and name HN ) 4.0 2.2 1.6 volume=0.281 peak=145 ppm1=1.280 ppm2=7.996 assign ( resid 197 and name HN ) ( resid 193 and name HA or resid 196 and name HA ) 3.5 1.8 1.4 volume=0.541 peak=8 ppm1=7.990 ppm2=3.483 assign ( resid 104 and name HN ) ( resid 103 and name HG1# or resid 103 and name HG2# ) 3.4 1.6 1.3 volume=0.739 peak=120 ppm1=8.051 ppm2=0.879 assign ( resid 212 and name HA ) ( resid 211 and name HN or resid 213 and name HN ) 4.1 2.3 1.6 volume=0.242 peak=157 ppm1=4.140 ppm2=8.288 assign ( resid 204 and name HN ) ( resid 200 and name HA or resid 202 and name HA2 ) 3.9 2.2 1.6 volume=0.293 peak=84 ppm1=6.745 ppm2=3.360 assign ( resid 54 and name HG2# ) ( resid 61 and name HD2# or resid 61 and name HD1# ) 2.6 0.9 1.0 volume=3.434 peak=5 ppm1=0.577 ppm2=0.742 assign ( resid 168 and name HG2# ) ( resid 154 and name HG2# or resid 154 and name HG1# ) 3.0 1.3 1.2 volume=1.516 peak=70 ppm1=0.198 ppm2=0.885 assign ( resid 144 and name HG2# ) ( resid 107 and name HN or resid 145 and name HN ) 3.7 2.0 1.5 volume=0.416 peak=118 ppm1=0.766 ppm2=8.333 assign ( resid 72 and name HD1# ) ( resid 72 and name HN or resid 73 and name HN ) 3.2 1.5 1.3 volume=0.963 peak=59 ppm1=0.590 ppm2=7.541 assign ( resid 183 and name HN ) ( resid 183 and name HD1# or resid 184 and name HD1# ) 2.5 0.8 1.0 volume=3.944 peak=167 ppm1=7.421 ppm2=0.878 assign ( resid 167 and name HG ) ( resid 61 and name HD1# or resid 196 and name HD1# ) 3.3 1.6 1.3 volume=0.855 peak=149 ppm1=0.922 ppm2=0.736 assign ( resid 192 and name HG ) ( resid 192 and name HD1# or resid 192 and name HD2# ) 3.7 2.0 1.5 volume=0.423 peak=71 ppm1=1.754 ppm2=0.490 assign ( resid 126 and name HD1# ) ( resid 118 and name HE1 or resid 120 and name HB2 ) 4.0 2.3 1.6 volume=0.272 peak=95 ppm1=0.348 ppm2=2.953 assign ( resid 198 and name HN ) ( resid 196 and name HN or resid 201 and name HN ) 3.5 1.8 1.4 volume=0.543 peak=144 ppm1=8.717 ppm2=7.404 assign ( resid 72 and name HA ) ( resid 72 and name HD1# or resid 72 and name HG2# ) 3.0 1.3 1.2 volume=1.547 peak=173 ppm1=3.631 ppm2=0.586 assign ( resid 212 and name HN ) ( resid 211 and name HG1 or resid 212 and name HG2 ) 3.8 2.1 1.5 volume=0.354 peak=192 ppm1=8.245 ppm2=1.514 assign ( resid 3 and name HZ ) ( resid 114 and name HD1# or resid 132 and name HG1# ) 3.1 1.3 1.2 volume=1.289 peak=87 ppm1=6.203 ppm2=0.565 assign ( resid 170 and name HN ) ( resid 169 and name HB1 or resid 170 and name HB2 ) 3.3 1.6 1.3 volume=0.861 peak=44 ppm1=9.145 ppm2=1.777 assign ( resid 200 and name HD2 ) ( resid 55 and name HD2 or resid 200 and name HA ) 3.4 1.7 1.4 volume=0.682 peak=148 ppm1=1.546 ppm2=3.369 assign ( resid 143 and name HN ) ( resid 141 and name HA or resid 144 and name HA ) 3.2 1.5 1.3 volume=0.999 peak=30 ppm1=6.899 ppm2=3.939 assign ( resid 188 and name HN ) ( resid 187 and name HN or resid 191 and name HN ) 3.2 1.5 1.3 volume=1.029 peak=98 ppm1=8.442 ppm2=7.653 assign ( resid 202 and name HN ) ( resid 200 and name HA or resid 202 and name HA2 ) 3.3 1.6 1.3 volume=0.844 peak=10 ppm1=8.576 ppm2=3.355 assign ( resid 186 and name HG1 ) ( resid 182 and name HB1 or resid 183 and name HA ) 3.5 1.8 1.4 volume=0.557 peak=161 ppm1=1.479 ppm2=3.826 assign ( resid 72 and name HG11 ) ( resid 72 and name HD1# or resid 72 and name HG2# ) 3.0 1.3 1.2 volume=1.431 peak=168 ppm1=1.171 ppm2=0.589 assign ( resid 200 and name HE2 ) ( resid 32 and name HD1 or resid 200 and name HD1 ) 4.3 2.6 1.7 volume=0.176 peak=127 ppm1=2.735 ppm2=1.547 assign ( resid 72 and name HG2# ) ( resid 81 and name HB2 or resid 150 and name HB2 ) 3.6 1.9 1.4 volume=0.493 peak=178 ppm1=0.603 ppm2=2.339 assign ( resid 180 and name HB2 ) ( resid 183 and name HD1# or resid 184 and name HD1# ) 2.7 1.0 1.1 volume=2.914 peak=11 ppm1=3.908 ppm2=0.895 assign ( resid 11 and name HA ) ( resid 14 and name HG2# or resid 14 and name HG1# ) 3.3 1.6 1.3 volume=0.774 peak=175 ppm1=3.956 ppm2=0.707 assign ( resid 173 and name HN ) ( resid 174 and name HB2 or resid 188 and name HE# ) 3.1 1.4 1.2 volume=1.163 peak=47 ppm1=8.520 ppm2=1.925 assign ( resid 196 and name HN ) ( resid 193 and name HA or resid 196 and name HA ) 3.2 1.5 1.3 volume=0.983 peak=91 ppm1=7.438 ppm2=3.460 assign ( resid 132 and name HN ) ( resid 112 and name HN or resid 133 and name HN ) 3.6 1.8 1.4 volume=0.533 peak=163 ppm1=7.895 ppm2=8.169 assign ( resid 193 and name HA ) ( resid 35 and name HG2# or resid 196 and name HG2# ) 2.8 1.1 1.1 volume=2.174 peak=51 ppm1=3.461 ppm2=0.831 assign ( resid 157 and name HD1 ) ( resid 58 and name HG1 or resid 157 and name HG2 ) 3.3 1.5 1.3 volume=0.887 peak=50 ppm1=3.628 ppm2=1.816 assign ( resid 196 and name HD1# ) ( resid 193 and name HA or resid 196 and name HA ) 3.2 1.5 1.3 volume=1.036 peak=102 ppm1=0.726 ppm2=3.450 assign ( resid 154 and name HB ) ( resid 154 and name HG2# or resid 154 and name HG1# ) 2.9 1.2 1.2 volume=1.747 peak=13 ppm1=2.183 ppm2=0.882 assign ( resid 166 and name HG1 ) ( resid 53 and name HD1# or resid 168 and name HG1# ) 3.1 1.4 1.2 volume=1.195 peak=213 ppm1=1.212 ppm2=0.773 assign ( resid 165 and name HN ) ( resid 164 and name HB1 or resid 165 and name HB1 ) 3.5 1.8 1.4 volume=0.602 peak=191 ppm1=8.465 ppm2=2.986 assign ( resid 126 and name HD1# ) ( resid 15 and name HB2 or resid 118 and name HD2 ) 3.5 1.8 1.4 volume=0.561 peak=152 ppm1=0.349 ppm2=1.380 assign ( resid 6 and name HB ) ( resid 6 and name HD1# or resid 114 and name HD2# ) 2.8 1.1 1.1 volume=2.041 peak=79 ppm1=1.721 ppm2=0.772 assign ( resid 115 and name HN ) ( resid 114 and name HN or resid 116 and name HN ) 3.9 2.2 1.6 volume=0.312 peak=36 ppm1=9.053 ppm2=8.817 assign ( resid 187 and name HN ) ( resid 183 and name HA or resid 185 and name HA ) 3.0 1.3 1.2 volume=1.367 peak=113 ppm1=7.601 ppm2=3.882 assign ( resid 154 and name HG2# ) ( resid 126 and name HA or resid 153 and name HA ) 3.9 2.2 1.6 volume=0.286 peak=126 ppm1=0.837 ppm2=5.384 assign ( resid 185 and name HN ) ( resid 183 and name HA or resid 185 and name HA ) 2.5 0.8 1.0 volume=4.534 peak=66 ppm1=8.185 ppm2=3.896
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