NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
609328 | 5j17 | 30047 | cing | 1-original | 2 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " " and resid 192 and name HA) (segid " " and resid 185 and name HD21) 2.550 0.813 0.813 weight 1.000 ! spec=c13n...li-2, no=24, id=790, vol=4.987500e+00 or (segid " " and resid 192 and name HA) (segid " " and resid 185 and name HD11) assign (segid " " and resid 230 and name HA) (segid " " and resid 230 and name HG11) 2.231 0.622 0.622 weight 1.000 ! spec=c13n...li-2, no=47, id=804, vol=1.112890e+01 or (segid " " and resid 230 and name HA) (segid " " and resid 230 and name HG21) assign (segid " " and resid 152 and name HA) (segid " " and resid 152 and name HB2) 2.025 0.513 0.513 weight 1.000 ! spec=c13n...li-2, no=49, id=806, vol=1.989480e+01 or (segid " " and resid 207 and name HA) (segid " " and resid 207 and name HB2) assign (segid " " and resid 207 and name HA) (segid " " and resid 208 and name HB) 3.182 1.266 1.266 weight 1.000 ! spec=c13n...li-2, no=53, id=810, vol=1.321700e+00 or (segid " " and resid 207 and name HA) (segid " " and resid 199 and name HG1) assign (segid " " and resid 152 and name HA) (segid " " and resid 152 and name HG2) 2.349 0.690 0.690 weight 1.000 ! spec=c13n...li-2, no=61, id=817, vol=8.163300e+00 or (segid " " and resid 226 and name HA) (segid " " and resid 226 and name HB) assign (segid " " and resid 180 and name HB2) (segid " " and resid 214 and name HG21) 3.060 1.170 1.170 weight 1.000 ! spec=c13n...li-2, no=68, id=823, vol=1.671400e+00 or (segid " " and resid 180 and name HB2) (segid " " and resid 175 and name HG11) assign (segid " " and resid 207 and name HA) (segid " " and resid 208 and name HB) 3.110 1.209 1.209 weight 1.000 ! spec=c13n...li-2, no=110, id=849, vol=1.515500e+00 or (segid " " and resid 226 and name HA) (segid " " and resid 227 and name HB1) assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG21) 2.089 0.546 3.911 weight 1.000 ! spec=c13n...li-2, no=129, id=862, vol=1.649370e+01 or (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG11) assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HD2) 2.585 0.835 3.415 weight 1.000 ! spec=c13n...li-2, no=138, id=869, vol=4.602400e+00 or (segid " " and resid 182 and name HA) (segid " " and resid 181 and name HB1) assign (segid " " and resid 168 and name HA) (segid " " and resid 167 and name HA) 3.110 1.209 1.209 weight 1.000 ! spec=c13n...li-2, no=158, id=883, vol=1.515400e+00 or (segid " " and resid 224 and name HA) (segid " " and resid 161 and name HA) assign (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HB) 2.912 1.060 1.060 weight 1.000 ! spec=c13n...li-2, no=169, id=894, vol=2.248400e+00 or (segid " " and resid 168 and name HA) (segid " " and resid 156 and name HB) assign (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HG11) 2.045 0.523 3.955 weight 1.000 ! spec=c13n...li-2, no=173, id=898, vol=1.876030e+01 or (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HG21) assign (segid " " and resid 183 and name HA) (segid " " and resid 183 and name HD2) 2.683 0.900 0.900 weight 1.000 ! spec=c13n...li-2, no=191, id=910, vol=3.673900e+00 or (segid " " and resid 183 and name HA) (segid " " and resid 183 and name HD1) assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB2) 2.308 0.666 0.666 weight 1.000 ! spec=c13n...li-2, no=195, id=914, vol=9.083600e+00 or (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HB1) assign (segid " " and resid 193 and name HA) (segid " " and resid 193 and name HB2) 2.337 0.682 0.682 weight 1.000 ! spec=c13n...li-2, no=208, id=924, vol=8.430200e+00 or (segid " " and resid 193 and name HA) (segid " " and resid 193 and name HB1) assign (segid " " and resid 156 and name HA) (segid " " and resid 168 and name HG21) 2.592 0.840 3.408 weight 1.000 ! spec=c13n...li-2, no=214, id=929, vol=4.526100e+00 or (segid " " and resid 156 and name HA) (segid " " and resid 169 and name HG11) assign (segid " " and resid 195 and name HA) (segid " " and resid 227 and name HG) 2.646 0.875 3.354 weight 1.000 ! spec=c13n...li-2, no=229, id=942, vol=3.998200e+00 or (segid " " and resid 195 and name HA) (segid " " and resid 227 and name HB1) assign (segid " " and resid 195 and name HA) (segid " " and resid 226 and name HG21) 2.703 0.913 3.297 weight 1.000 ! spec=c13n...li-2, no=230, id=943, vol=3.516300e+00 or (segid " " and resid 195 and name HA) (segid " " and resid 226 and name HG11) assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HD21) 2.061 0.531 3.939 weight 1.000 ! spec=c13n...li-2, no=238, id=950, vol=1.788320e+01 or (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HD11) assign (segid " " and resid 187 and name HA) (segid " " and resid 183 and name HA) 2.862 1.024 3.138 weight 1.000 ! spec=c13n...li-2, no=241, id=953, vol=2.498000e+00 or (segid " " and resid 187 and name HA) (segid " " and resid 184 and name HA) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG1) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-2, no=248, id=959, vol=1.277050e+01 or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG2) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HB2) 1.995 0.498 0.498 weight 1.000 ! spec=c13n...li-2, no=249, id=960, vol=2.174590e+01 or (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HB1) assign (segid " " and resid 208 and name HA) (segid " " and resid 208 and name HG12) 2.523 0.796 0.796 weight 1.000 ! spec=c13n...li-2, no=256, id=965, vol=5.319800e+00 or (segid " " and resid 208 and name HA) (segid " " and resid 208 and name HG11) assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HB2) 2.254 0.635 0.635 weight 1.000 ! spec=c13n...li-2, no=259, id=967, vol=1.045820e+01 or (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HB1) assign (segid " " and resid 169 and name HA) (segid " " and resid 170 and name HG2) 2.842 1.009 1.009 weight 1.000 ! spec=c13n...li-2, no=269, id=976, vol=2.605500e+00 or (segid " " and resid 169 and name HA) (segid " " and resid 170 and name HG1) assign (segid " " and resid 179 and name HA) (segid " " and resid 182 and name HD1) 2.497 0.779 0.779 weight 1.000 ! spec=c13n...li-2, no=278, id=984, vol=5.661300e+00 or (segid " " and resid 179 and name HA) (segid " " and resid 182 and name HD2) assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB2) 2.454 0.753 0.753 weight 1.000 ! spec=c13n...li-2, no=304, id=1006, vol=6.277900e+00 or (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB1) assign (segid " " and resid 158 and name HA) (segid " " and resid 168 and name HG11) 2.251 0.633 0.633 weight 1.000 ! spec=c13n...li-2, no=306, id=1008, vol=1.054090e+01 or (segid " " and resid 158 and name HA) (segid " " and resid 168 and name HG21) assign (segid " " and resid 198 and name HA) (segid " " and resid 208 and name HB) 3.142 1.234 1.234 weight 1.000 ! spec=c13n...li-2, no=310, id=1012, vol=1.425400e+00 or (segid " " and resid 198 and name HA) (segid " " and resid 199 and name HG1) assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HD2) 2.958 1.093 1.093 weight 1.000 ! spec=c13n...li-2, no=313, id=1014, vol=2.049300e+00 or (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HD1) assign (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HG2) 2.374 0.705 0.705 weight 1.000 ! spec=c13n...li-2, no=318, id=1018, vol=7.661700e+00 or (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HG1) assign (segid " " and resid 220 and name HA) (segid " " and resid 220 and name HB1) 2.088 0.545 3.912 weight 1.000 ! spec=c13n...li-2, no=329, id=1029, vol=1.656490e+01 or (segid " " and resid 220 and name HA) (segid " " and resid 220 and name HG2) or (segid " " and resid 220 and name HA) (segid " " and resid 220 and name HG1) assign (segid " " and resid 227 and name HA) (segid " " and resid 227 and name HB1) 2.222 0.617 0.617 weight 1.000 ! spec=c13n...li-2, no=332, id=1032, vol=1.138810e+01 or (segid " " and resid 227 and name HA) (segid " " and resid 227 and name HG) assign (segid " " and resid 223 and name HA) (segid " " and resid 160 and name HB2) 2.616 0.855 0.855 weight 1.000 ! spec=c13n...li-2, no=337, id=1037, vol=4.283200e+00 or (segid " " and resid 166 and name HA) (segid " " and resid 160 and name HB2) assign (segid " " and resid 165 and name HA) (segid " " and resid 166 and name HG1) 2.999 1.125 3.001 weight 1.000 ! spec=c13n...li-2, no=344, id=1043, vol=1.883500e+00 or (segid " " and resid 165 and name HA) (segid " " and resid 166 and name HG2) assign (segid " " and resid 184 and name HA) (segid " " and resid 187 and name HG2) 2.679 0.897 3.321 weight 1.000 ! spec=c13n...li-2, no=360, id=1057, vol=3.713400e+00 or (segid " " and resid 184 and name HA) (segid " " and resid 187 and name HG1) assign (segid " " and resid 199 and name HA) (segid " " and resid 208 and name HG12) 3.085 1.190 2.915 weight 1.000 ! spec=c13n...li-2, no=404, id=1094, vol=1.590800e+00 or (segid " " and resid 199 and name HA) (segid " " and resid 200 and name HG12) assign (segid " " and resid 199 and name HA) (segid " " and resid 208 and name HD11) 2.469 0.762 0.762 weight 1.000 ! spec=c13n...li-2, no=405, id=1095, vol=6.058600e+00 or (segid " " and resid 199 and name HA) (segid " " and resid 222 and name HD21) assign (segid " " and resid 163 and name HA) (segid " " and resid 163 and name HB2) 1.995 0.498 0.498 weight 1.000 ! spec=c13n...li-2, no=407, id=1097, vol=2.174680e+01 or (segid " " and resid 163 and name HA) (segid " " and resid 163 and name HB1) assign (segid " " and resid 217 and name HA) (segid " " and resid 220 and name HB1) 2.502 0.782 0.782 weight 1.000 ! spec=c13n...li-2, no=420, id=1107, vol=5.598100e+00 or (segid " " and resid 217 and name HA) (segid " " and resid 220 and name HG1) assign (segid " " and resid 222 and name HA) (segid " " and resid 222 and name HB2) 2.517 0.792 0.792 weight 1.000 ! spec=c13n...li-2, no=427, id=1113, vol=5.397900e+00 or (segid " " and resid 222 and name HA) (segid " " and resid 222 and name HG) assign (segid " " and resid 206 and name HA) (segid " " and resid 206 and name HB2) 2.387 0.712 0.712 weight 1.000 ! spec=c13n...li-2, no=437, id=1121, vol=7.412900e+00 or (segid " " and resid 206 and name HA) (segid " " and resid 206 and name HB1) assign (segid " " and resid 169 and name HA) (segid " " and resid 170 and name HD2) 2.046 0.523 0.523 weight 1.000 ! spec=c13n...li-2, no=452, id=1133, vol=1.868740e+01 or (segid " " and resid 206 and name HA) (segid " " and resid 207 and name HD1) assign (segid " " and resid 152 and name HA) (segid " " and resid 152 and name HD2) 2.863 1.025 1.025 weight 1.000 ! spec=c13n...li-2, no=453, id=1134, vol=2.489600e+00 or (segid " " and resid 207 and name HD1) (segid " " and resid 207 and name HA) assign (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HB2) 2.580 0.832 0.832 weight 1.000 ! spec=c13n...li-2, no=455, id=1135, vol=4.649800e+00 or (segid " " and resid 170 and name HD1) (segid " " and resid 170 and name HB2) assign (segid " " and resid 170 and name HD2) (segid " " and resid 169 and name HB) 2.251 0.633 3.749 weight 1.000 ! spec=c13n...li-2, no=456, id=1136, vol=1.054160e+01 or (segid " " and resid 170 and name HD1) (segid " " and resid 169 and name HB) assign (segid " " and resid 170 and name HD1) (segid " " and resid 170 and name HG1) 1.974 0.487 0.487 weight 1.000 ! spec=c13n...li-2, no=458, id=1138, vol=2.321660e+01 or (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HG1) or (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HG2) or (segid " " and resid 152 and name HD2) (segid " " and resid 152 and name HG1) assign (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HB1) 2.548 0.812 0.812 weight 1.000 ! spec=c13n...li-2, no=460, id=1140, vol=5.013200e+00 or (segid " " and resid 170 and name HD1) (segid " " and resid 170 and name HB1) assign (segid " " and resid 170 and name HD2) (segid " " and resid 156 and name HG21) 2.589 0.838 0.838 weight 1.000 ! spec=c13n...li-2, no=462, id=1142, vol=4.552400e+00 or (segid " " and resid 192 and name HD2) (segid " " and resid 185 and name HD11) assign (segid " " and resid 152 and name HD1) (segid " " and resid 152 and name HG1) 2.144 0.575 0.575 weight 1.000 ! spec=c13n...li-2, no=469, id=1146, vol=1.411540e+01 or (segid " " and resid 152 and name HD1) (segid " " and resid 152 and name HG2) assign (segid " " and resid 191 and name HA) (segid " " and resid 192 and name HD1) 2.113 0.558 0.558 weight 1.000 ! spec=c13n...li-2, no=476, id=1153, vol=1.540620e+01 or (segid " " and resid 154 and name HA) (segid " " and resid 155 and name HD1) assign (segid " " and resid 155 and name HD1) (segid " " and resid 155 and name HG1) 2.424 0.734 0.734 weight 1.000 ! spec=c13n...li-2, no=478, id=1155, vol=6.761200e+00 or (segid " " and resid 155 and name HD1) (segid " " and resid 155 and name HG2) assign (segid " " and resid 192 and name HD1) (segid " " and resid 185 and name HD11) 3.045 1.159 2.955 weight 1.000 ! spec=c13n...li-2, no=485, id=1162, vol=1.719500e+00 or (segid " " and resid 192 and name HD1) (segid " " and resid 185 and name HD21) assign (segid " " and resid 209 and name HA1) (segid " " and resid 212 and name HG21) 2.885 1.040 3.115 weight 1.000 ! spec=c13n...li-2, no=526, id=1192, vol=2.381100e+00 or (segid " " and resid 209 and name HA1) (segid " " and resid 197 and name HB) assign (segid " " and resid 190 and name HB1) (segid " " and resid 190 and name HD11) 2.370 0.702 0.702 weight 1.000 ! spec=c13n...li-2, no=551, id=1211, vol=7.732900e+00 or (segid " " and resid 190 and name HB1) (segid " " and resid 190 and name HD21) assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG21) 2.087 0.544 0.544 weight 1.000 ! spec=c13n...li-2, no=567, id=1226, vol=1.660280e+01 or (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HD11) assign (segid " " and resid 199 and name HD1) (segid " " and resid 199 and name HG2) 2.313 0.669 0.669 weight 1.000 ! spec=c13n...li-2, no=570, id=1228, vol=8.947700e+00 or (segid " " and resid 199 and name HD1) (segid " " and resid 199 and name HB1) assign (segid " " and resid 166 and name HD1) (segid " " and resid 160 and name HA) 3.130 1.225 1.225 weight 1.000 ! spec=c13n...li-2, no=576, id=1234, vol=1.458100e+00 or (segid " " and resid 166 and name HD2) (segid " " and resid 160 and name HA) assign (segid " " and resid 166 and name HD1) (segid " " and resid 166 and name HG1) 2.035 0.517 0.517 weight 1.000 ! spec=c13n...li-2, no=586, id=1241, vol=1.933180e+01 or (segid " " and resid 166 and name HD1) (segid " " and resid 166 and name HG2) assign (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HD2) 2.746 0.942 0.942 weight 1.000 ! spec=c13n...li-2, no=591, id=1242, vol=3.200300e+00 or (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HD1) assign (segid " " and resid 172 and name HD1) (segid " " and resid 172 and name HG1) 1.865 0.435 0.435 weight 1.000 ! spec=c13n...li-2, no=593, id=1243, vol=3.261530e+01 or (segid " " and resid 158 and name HD1) (segid " " and resid 158 and name HG2) or (segid " " and resid 172 and name HD2) (segid " " and resid 172 and name HG2) or (segid " " and resid 172 and name HD2) (segid " " and resid 172 and name HG1) assign (segid " " and resid 158 and name HD1) (segid " " and resid 156 and name HD11) 2.149 0.577 0.577 weight 1.000 ! spec=c13n...li-2, no=594, id=1244, vol=1.392170e+01 or (segid " " and resid 172 and name HD2) (segid " " and resid 175 and name HG21) or (segid " " and resid 172 and name HD1) (segid " " and resid 175 and name HG21) assign (segid " " and resid 188 and name HD2) (segid " " and resid 188 and name HG2) 1.987 0.493 0.493 weight 1.000 ! spec=c13n...li-2, no=595, id=1245, vol=2.231460e+01 or (segid " " and resid 188 and name HD2) (segid " " and resid 188 and name HG1) assign (segid " " and resid 158 and name HD2) (segid " " and resid 158 and name HG1) 2.129 0.567 0.567 weight 1.000 ! spec=c13n...li-2, no=596, id=1246, vol=1.473590e+01 or (segid " " and resid 158 and name HD1) (segid " " and resid 158 and name HG1) assign (segid " " and resid 158 and name HD2) (segid " " and resid 168 and name HG21) 2.430 0.738 0.738 weight 1.000 ! spec=c13n...li-2, no=597, id=1247, vol=6.660100e+00 or (segid " " and resid 158 and name HD1) (segid " " and resid 168 and name HG21) or (segid " " and resid 158 and name HD1) (segid " " and resid 168 and name HG11) assign (segid " " and resid 188 and name HD1) (segid " " and resid 161 and name HG) 2.452 0.752 0.752 weight 1.000 ! spec=c13n...li-2, no=598, id=1248, vol=6.305400e+00 or (segid " " and resid 188 and name HD1) (segid " " and resid 161 and name HB2) assign (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HD2) 2.528 0.799 3.472 weight 1.000 ! spec=c13n...li-2, no=603, id=1250, vol=5.254800e+00 or (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HD2) assign (segid " " and resid 188 and name HD1) (segid " " and resid 188 and name HG2) 2.306 0.665 0.665 weight 1.000 ! spec=c13n...li-2, no=624, id=1267, vol=9.125500e+00 or (segid " " and resid 188 and name HD1) (segid " " and resid 188 and name HG1) assign (segid " " and resid 227 and name HB2) (segid " " and resid 227 and name HD21) 2.174 0.591 0.591 weight 1.000 ! spec=c13n...li-2, no=634, id=1277, vol=1.300050e+01 or (segid " " and resid 227 and name HB2) (segid " " and resid 227 and name HD11) assign (segid " " and resid 217 and name HB1) (segid " " and resid 217 and name HG) 2.595 0.842 0.842 weight 1.000 ! spec=c13n...li-2, no=638, id=1281, vol=4.489800e+00 or (segid " " and resid 217 and name HB2) (segid " " and resid 217 and name HG) assign (segid " " and resid 164 and name HE1) (segid " " and resid 164 and name HB2) 2.397 0.718 0.718 weight 1.000 ! spec=c13n...li-2, no=643, id=1283, vol=7.235000e+00 or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HB2) assign (segid " " and resid 183 and name HE1) (segid " " and resid 183 and name HG1) 1.944 0.472 2.372 weight 1.000 ! spec=c13n...li-2, no=644, id=1284, vol=2.544250e+01 or (segid " " and resid 164 and name HE1) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HE1) (segid " " and resid 164 and name HG2) or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HG2) assign (segid " " and resid 182 and name HE1) (segid " " and resid 178 and name HB2) 2.802 0.981 0.981 weight 1.000 ! spec=c13n...li-2, no=647, id=1286, vol=2.833800e+00 or (segid " " and resid 182 and name HE2) (segid " " and resid 178 and name HB2) assign (segid " " and resid 182 and name HE1) (segid " " and resid 178 and name HB1) 2.590 0.839 0.839 weight 1.000 ! spec=c13n...li-2, no=650, id=1289, vol=4.539600e+00 or (segid " " and resid 182 and name HE2) (segid " " and resid 178 and name HB1) assign (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HG2) 2.322 0.674 0.674 weight 1.000 ! spec=c13n...li-2, no=651, id=1290, vol=8.748400e+00 or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HG2) assign (segid " " and resid 183 and name HE2) (segid " " and resid 186 and name HB1) 2.798 0.978 0.978 weight 1.000 ! spec=c13n...li-2, no=658, id=1296, vol=2.860700e+00 or (segid " " and resid 183 and name HE1) (segid " " and resid 186 and name HB1) assign (segid " " and resid 183 and name HE1) (segid " " and resid 183 and name HB2) 2.361 0.697 0.697 weight 1.000 ! spec=c13n...li-2, no=659, id=1297, vol=7.918000e+00 or (segid " " and resid 183 and name HE1) (segid " " and resid 183 and name HB1) or (segid " " and resid 183 and name HE2) (segid " " and resid 183 and name HB1) assign (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HB2) 2.379 0.708 0.708 weight 1.000 ! spec=c13n...li-2, no=664, id=1302, vol=7.564100e+00 or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HB2) assign (segid " " and resid 179 and name HA) (segid " " and resid 182 and name HE2) 2.503 0.783 0.783 weight 1.000 ! spec=c13n...li-2, no=665, id=1303, vol=5.580000e+00 or (segid " " and resid 179 and name HA) (segid " " and resid 182 and name HE1) assign (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HA) 2.885 1.040 3.115 weight 1.000 ! spec=c13n...li-2, no=666, id=1304, vol=2.378300e+00 or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HA) assign (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HB1) 2.217 0.614 0.614 weight 1.000 ! spec=c13n...li-2, no=669, id=1306, vol=1.154630e+01 or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HB1) assign (segid " " and resid 183 and name HE2) (segid " " and resid 183 and name HD1) 1.701 0.361 1.361 weight 1.000 ! spec=c13n...li-2, no=670, id=1307, vol=5.672060e+01 or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD2) or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD1) or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HD1) or (segid " " and resid 164 and name HE1) (segid " " and resid 164 and name HD1) or (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HD1) assign (segid " " and resid 206 and name HE2) (segid " " and resid 206 and name HG2) 1.969 0.485 0.485 weight 1.000 ! spec=c13n...li-2, no=671, id=1308, vol=2.355080e+01 or (segid " " and resid 164 and name HE1) (segid " " and resid 164 and name HG2) or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HE2) (segid " " and resid 164 and name HG2) or (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HG2) or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HG2) assign (segid " " and resid 217 and name HB2) (segid " " and resid 217 and name HD21) 2.276 0.648 0.648 weight 1.000 ! spec=c13n...li-2, no=682, id=1316, vol=9.860000e+00 or (segid " " and resid 217 and name HB1) (segid " " and resid 217 and name HD11) assign (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HA) 3.191 1.273 1.273 weight 1.000 ! spec=c13n...li-2, no=700, id=1331, vol=1.298900e+00 or (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HA) assign (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HB2) 2.635 0.868 0.868 weight 1.000 ! spec=c13n...li-2, no=702, id=1332, vol=4.094800e+00 or (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HB2) assign (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HG2) 2.158 0.582 0.582 weight 1.000 ! spec=c13n...li-2, no=704, id=1334, vol=1.356800e+01 or (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HD2) or (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HD2) assign (segid " " and resid 193 and name HG2) (segid " " and resid 193 and name HB1) 2.295 0.659 0.659 weight 1.000 ! spec=c13n...li-2, no=779, id=1393, vol=9.377000e+00 or (segid " " and resid 193 and name HG2) (segid " " and resid 193 and name HB2) assign (segid " " and resid 193 and name HG1) (segid " " and resid 193 and name HB1) 2.335 0.682 0.682 weight 1.000 ! spec=c13n...li-2, no=783, id=1396, vol=8.460900e+00 or (segid " " and resid 193 and name HG1) (segid " " and resid 193 and name HB2) assign (segid " " and resid 221 and name HG1) (segid " " and resid 158 and name HD2) 3.161 1.249 1.249 weight 1.000 ! spec=c13n...li-2, no=806, id=1416, vol=1.376300e+00 or (segid " " and resid 221 and name HG1) (segid " " and resid 158 and name HD1) assign (segid " " and resid 220 and name HA) (segid " " and resid 220 and name HG1) 2.431 0.739 0.739 weight 1.000 ! spec=c13n...li-2, no=812, id=1421, vol=6.649600e+00 or (segid " " and resid 220 and name HA) (segid " " and resid 220 and name HG2) assign (segid " " and resid 202 and name HB2) (segid " " and resid 204 and name HG2) 2.969 1.102 1.102 weight 1.000 ! spec=c13n...li-2, no=819, id=1427, vol=2.002400e+00 or (segid " " and resid 206 and name HE2) (segid " " and resid 204 and name HG2) assign (segid " " and resid 168 and name HB) (segid " " and resid 168 and name HG11) 1.847 0.427 0.427 weight 1.000 ! spec=c13n...li-2, no=837, id=1440, vol=3.449760e+01 or (segid " " and resid 168 and name HB) (segid " " and resid 168 and name HG21) assign (segid " " and resid 168 and name HB) (segid " " and resid 156 and name HG21) 2.347 0.688 0.688 weight 1.000 ! spec=c13n...li-2, no=838, id=1441, vol=8.216600e+00 or (segid " " and resid 168 and name HB) (segid " " and resid 156 and name HD11) assign (segid " " and resid 157 and name HB) (segid " " and resid 159 and name HG21) 2.237 0.625 3.763 weight 1.000 ! spec=c13n...li-2, no=842, id=1445, vol=1.094760e+01 or (segid " " and resid 157 and name HB) (segid " " and resid 222 and name HD11) assign (segid " " and resid 163 and name HB1) (segid " " and resid 165 and name HG1) 2.991 1.118 1.118 weight 1.000 ! spec=c13n...li-2, no=846, id=1447, vol=1.915900e+00 or (segid " " and resid 163 and name HB2) (segid " " and resid 165 and name HG1) assign (segid " " and resid 163 and name HB1) (segid " " and resid 165 and name HG2) 2.860 1.022 1.022 weight 1.000 ! spec=c13n...li-2, no=862, id=1462, vol=2.507000e+00 or (segid " " and resid 163 and name HB2) (segid " " and resid 165 and name HG2) assign (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD22) 3.090 1.194 2.910 weight 1.000 ! spec=c13n...li-2, no=865, id=1465, vol=1.575600e+00 or (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD21) or (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD23) or (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD12) or (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD11) or (segid " " and resid 165 and name HG1) (segid " " and resid 190 and name HD13) assign (segid " " and resid 165 and name HG2) (segid " " and resid 162 and name HB2) 2.366 0.700 3.634 weight 1.000 ! spec=c13n...li-2, no=872, id=1472, vol=7.826100e+00 or (segid " " and resid 165 and name HG1) (segid " " and resid 162 and name HB2) assign (segid " " and resid 153 and name HG1) (segid " " and resid 153 and name HB2) 2.049 0.525 0.525 weight 1.000 ! spec=c13n...li-2, no=875, id=1474, vol=1.855180e+01 or (segid " " and resid 153 and name HG2) (segid " " and resid 153 and name HB2) assign (segid " " and resid 153 and name HG2) (segid " " and resid 153 and name HB1) 2.053 0.527 0.527 weight 1.000 ! spec=c13n...li-2, no=877, id=1476, vol=1.830880e+01 or (segid " " and resid 153 and name HG1) (segid " " and resid 153 and name HB1) assign (segid " " and resid 199 and name HB2) (segid " " and resid 206 and name HB1) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-2, no=892, id=1489, vol=3.103500e+00 or (segid " " and resid 199 and name HB2) (segid " " and resid 217 and name HB2) assign (segid " " and resid 230 and name HB) (segid " " and resid 230 and name HG21) 2.172 0.590 0.590 weight 1.000 ! spec=c13n...li-2, no=919, id=1512, vol=1.306010e+01 or (segid " " and resid 230 and name HB) (segid " " and resid 230 and name HG11) assign (segid " " and resid 183 and name HA) (segid " " and resid 186 and name HB1) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-2, no=965, id=1552, vol=3.102800e+00 or (segid " " and resid 184 and name HA) (segid " " and resid 187 and name HB1) assign (segid " " and resid 187 and name HB2) (segid " " and resid 188 and name HG1) 2.909 1.058 1.058 weight 1.000 ! spec=c13n...li-2, no=968, id=1554, vol=2.263200e+00 or (segid " " and resid 187 and name HB1) (segid " " and resid 188 and name HG1) or (segid " " and resid 186 and name HB1) (segid " " and resid 185 and name HB2) assign (segid " " and resid 226 and name HB) (segid " " and resid 226 and name HG21) 1.854 0.430 0.430 weight 1.000 ! spec=c13n...li-2, no=971, id=1557, vol=3.376840e+01 or (segid " " and resid 226 and name HB) (segid " " and resid 226 and name HG11) assign (segid " " and resid 205 and name HB2) (segid " " and resid 205 and name HD2) 2.429 0.737 0.737 weight 1.000 ! spec=c13n...li-2, no=976, id=1561, vol=6.679900e+00 or (segid " " and resid 205 and name HB2) (segid " " and resid 205 and name HG2) assign (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HG1) 2.493 0.777 0.777 weight 1.000 ! spec=c13n...li-2, no=1020, id=1599, vol=5.715900e+00 or (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HG2) assign (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HD2) 2.341 0.685 0.685 weight 1.000 ! spec=c13n...li-2, no=1021, id=1600, vol=8.336700e+00 or (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HD1) assign (segid " " and resid 162 and name HB1) (segid " " and resid 190 and name HD11) 2.743 0.941 0.941 weight 1.000 ! spec=c13n...li-2, no=1024, id=1602, vol=3.216800e+00 or (segid " " and resid 162 and name HB1) (segid " " and resid 190 and name HD21) assign (segid " " and resid 162 and name HB1) (segid " " and resid 162 and name HA) 2.218 0.615 0.615 weight 1.000 ! spec=c13n...li-2, no=1041, id=1616, vol=1.152640e+01 or (segid " " and resid 170 and name HA) (segid " " and resid 170 and name HB1) assign (segid " " and resid 201 and name HG2) (segid " " and resid 201 and name HB1) 2.365 0.699 0.699 weight 1.000 ! spec=c13n...li-2, no=1042, id=1617, vol=7.848100e+00 or (segid " " and resid 201 and name HG1) (segid " " and resid 201 and name HB1) assign (segid " " and resid 187 and name HB1) (segid " " and resid 187 and name HG1) 1.989 0.495 0.495 weight 1.000 ! spec=c13n...li-2, no=1047, id=1620, vol=2.212810e+01 or (segid " " and resid 187 and name HB2) (segid " " and resid 187 and name HG2) or (segid " " and resid 187 and name HB1) (segid " " and resid 187 and name HG2) assign (segid " " and resid 201 and name HG1) (segid " " and resid 201 and name HB2) 2.220 0.616 0.616 weight 1.000 ! spec=c13n...li-2, no=1057, id=1629, vol=1.147330e+01 or (segid " " and resid 204 and name HG2) (segid " " and resid 204 and name HB1) assign (segid " " and resid 172 and name HB1) (segid " " and resid 214 and name HD11) 2.663 0.886 0.886 weight 1.000 ! spec=c13n...li-2, no=1068, id=1640, vol=3.847900e+00 or (segid " " and resid 172 and name HB1) (segid " " and resid 175 and name HG21) assign (segid " " and resid 177 and name HB) (segid " " and resid 177 and name HG21) 2.027 0.514 0.514 weight 1.000 ! spec=c13n...li-2, no=1073, id=1645, vol=1.977070e+01 or (segid " " and resid 177 and name HB) (segid " " and resid 177 and name HG11) assign (segid " " and resid 183 and name HA) (segid " " and resid 183 and name HB1) 2.083 0.542 0.542 weight 1.000 ! spec=c13n...li-2, no=1074, id=1646, vol=1.679640e+01 or (segid " " and resid 183 and name HA) (segid " " and resid 183 and name HB2) assign (segid " " and resid 183 and name HB2) (segid " " and resid 183 and name HG1) 2.112 0.558 0.558 weight 1.000 ! spec=c13n...li-2, no=1076, id=1648, vol=1.545520e+01 or (segid " " and resid 182 and name HB1) (segid " " and resid 182 and name HG2) or (segid " " and resid 183 and name HB1) (segid " " and resid 183 and name HG1) assign (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HD1) 2.881 1.037 1.037 weight 1.000 ! spec=c13n...li-2, no=1081, id=1652, vol=2.399400e+00 or (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HD2) assign (segid " " and resid 158 and name HB1) (segid " " and resid 158 and name HD2) 2.548 0.812 0.812 weight 1.000 ! spec=c13n...li-2, no=1088, id=1658, vol=5.008900e+00 or (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HD2) assign (segid " " and resid 188 and name HB2) (segid " " and resid 188 and name HG1) 2.415 0.729 0.729 weight 1.000 ! spec=c13n...li-2, no=1150, id=1711, vol=6.910200e+00 or (segid " " and resid 188 and name HB2) (segid " " and resid 188 and name HG2) assign (segid " " and resid 188 and name HB1) (segid " " and resid 188 and name HG2) 2.504 0.784 0.784 weight 1.000 ! spec=c13n...li-2, no=1165, id=1724, vol=5.563400e+00 or (segid " " and resid 188 and name HB1) (segid " " and resid 188 and name HG1) assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HD2) 2.933 1.075 1.075 weight 1.000 ! spec=c13n...li-2, no=1173, id=1731, vol=2.154500e+00 or (segid " " and resid 182 and name HD1) (segid " " and resid 182 and name HA) assign (segid " " and resid 214 and name HG11) (segid " " and resid 180 and name HB2) 3.220 1.296 1.296 weight 1.000 ! spec=c13n...li-2, no=1176, id=1734, vol=1.230900e+00 or (segid " " and resid 214 and name HG12) (segid " " and resid 180 and name HB2) assign (segid " " and resid 214 and name HA) (segid " " and resid 214 and name HG11) 2.524 0.796 0.796 weight 1.000 ! spec=c13n...li-2, no=1178, id=1736, vol=5.306100e+00 or (segid " " and resid 214 and name HG12) (segid " " and resid 214 and name HA) assign (segid " " and resid 214 and name HG12) (segid " " and resid 177 and name HA) 3.080 1.186 1.186 weight 1.000 ! spec=c13n...li-2, no=1179, id=1737, vol=1.606200e+00 or (segid " " and resid 214 and name HG11) (segid " " and resid 177 and name HA) assign (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HG2) 2.304 0.664 0.664 weight 1.000 ! spec=c13n...li-2, no=1187, id=1743, vol=9.163200e+00 or (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HG1) assign (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HG2) 1.951 0.476 0.476 weight 1.000 ! spec=c13n...li-2, no=1188, id=1744, vol=2.486440e+01 or (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HG2) assign (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HD2) 2.442 0.746 0.746 weight 1.000 ! spec=c13n...li-2, no=1189, id=1745, vol=6.460700e+00 or (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HD2) assign (segid " " and resid 205 and name HD1) (segid " " and resid 205 and name HE2) 2.416 0.730 0.730 weight 1.000 ! spec=c13n...li-2, no=1195, id=1750, vol=6.894700e+00 or (segid " " and resid 205 and name HD1) (segid " " and resid 205 and name HE1) assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG2) 2.292 0.657 0.657 weight 1.000 ! spec=c13n...li-2, no=1200, id=1755, vol=9.464000e+00 or (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG1) assign (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HE1) 1.844 0.425 0.425 weight 1.000 ! spec=c13n...li-2, no=1204, id=1759, vol=3.493140e+01 or (segid " " and resid 183 and name HE2) (segid " " and resid 183 and name HD1) or (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HE1) assign (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HB1) 1.988 0.494 0.494 weight 1.000 ! spec=c13n...li-2, no=1205, id=1760, vol=2.222170e+01 or (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HB1) or (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HB2) assign (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HG1) 1.878 0.441 0.441 weight 1.000 ! spec=c13n...li-2, no=1207, id=1761, vol=3.130720e+01 or (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HG1) assign (segid " " and resid 154 and name HD2) (segid " " and resid 154 and name HG1) 1.942 0.471 0.471 weight 1.000 ! spec=c13n...li-2, no=1222, id=1772, vol=2.556820e+01 or (segid " " and resid 164 and name HD1) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HD2) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HD2) (segid " " and resid 164 and name HG2) assign (segid " " and resid 170 and name HG2) (segid " " and resid 170 and name HA) 2.683 0.900 0.900 weight 1.000 ! spec=c13n...li-2, no=1275, id=1823, vol=3.676100e+00 or (segid " " and resid 170 and name HG1) (segid " " and resid 170 and name HA) or (segid " " and resid 155 and name HG1) (segid " " and resid 155 and name HA) assign (segid " " and resid 158 and name HD1) (segid " " and resid 158 and name HG2) 2.295 0.658 0.658 weight 1.000 ! spec=c13n...li-2, no=1277, id=1824, vol=9.383800e+00 or (segid " " and resid 158 and name HD2) (segid " " and resid 158 and name HG2) assign (segid " " and resid 152 and name HA) (segid " " and resid 152 and name HG2) 2.530 0.800 0.800 weight 1.000 ! spec=c13n...li-2, no=1294, id=1838, vol=5.231000e+00 or (segid " " and resid 207 and name HG1) (segid " " and resid 207 and name HA) or (segid " " and resid 152 and name HG1) (segid " " and resid 152 and name HA) assign (segid " " and resid 152 and name HD2) (segid " " and resid 152 and name HG1) 1.943 0.472 0.472 weight 1.000 ! spec=c13n...li-2, no=1295, id=1839, vol=2.551730e+01 or (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HG2) or (segid " " and resid 170 and name HD2) (segid " " and resid 170 and name HG1) or (segid " " and resid 170 and name HD1) (segid " " and resid 170 and name HG1) or (segid " " and resid 207 and name HG1) (segid " " and resid 207 and name HD1) assign (segid " " and resid 192 and name HB1) (segid " " and resid 192 and name HG1) 2.330 0.679 0.679 weight 1.000 ! spec=c13n...li-2, no=1299, id=1843, vol=8.564200e+00 or (segid " " and resid 200 and name HG12) (segid " " and resid 200 and name HD11) assign (segid " " and resid 152 and name HB2) (segid " " and resid 152 and name HG2) 2.017 0.509 0.509 weight 1.000 ! spec=c13n...li-2, no=1301, id=1844, vol=2.035640e+01 or (segid " " and resid 152 and name HB2) (segid " " and resid 152 and name HG1) assign (segid " " and resid 170 and name HG1) (segid " " and resid 170 and name HB1) 2.163 0.585 0.585 weight 1.000 ! spec=c13n...li-2, no=1302, id=1845, vol=1.339450e+01 or (segid " " and resid 170 and name HG2) (segid " " and resid 170 and name HB1) assign (segid " " and resid 199 and name HG1) (segid " " and resid 208 and name HD11) 2.214 0.613 0.613 weight 1.000 ! spec=c13n...li-2, no=1311, id=1854, vol=1.165350e+01 or (segid " " and resid 161 and name HG) (segid " " and resid 161 and name HD11) assign (segid " " and resid 227 and name HG) (segid " " and resid 227 and name HD11) 2.121 0.562 0.562 weight 1.000 ! spec=c13n...li-2, no=1323, id=1866, vol=1.506780e+01 or (segid " " and resid 227 and name HG) (segid " " and resid 227 and name HD21) assign (segid " " and resid 217 and name HD11) (segid " " and resid 214 and name HG12) 2.723 0.927 3.277 weight 1.000 ! spec=c13n...li-2, no=1325, id=1868, vol=3.365600e+00 or (segid " " and resid 217 and name HD11) (segid " " and resid 214 and name HG11) assign (segid " " and resid 217 and name HG) (segid " " and resid 217 and name HD11) 2.050 0.525 0.525 weight 1.000 ! spec=c13n...li-2, no=1331, id=1872, vol=1.848680e+01 or (segid " " and resid 217 and name HG) (segid " " and resid 217 and name HD21) assign (segid " " and resid 199 and name HG1) (segid " " and resid 208 and name HD11) 2.147 0.576 0.576 weight 1.000 ! spec=c13n...li-2, no=1332, id=1873, vol=1.401980e+01 or (segid " " and resid 222 and name HG) (segid " " and resid 222 and name HD21) assign (segid " " and resid 200 and name HG11) (segid " " and resid 223 and name HB1) 2.915 1.062 3.085 weight 1.000 ! spec=c13n...li-2, no=1338, id=1879, vol=2.233600e+00 or (segid " " and resid 217 and name HD11) (segid " " and resid 220 and name HB1) assign (segid " " and resid 217 and name HG) (segid " " and resid 217 and name HD11) 2.084 0.543 0.543 weight 1.000 ! spec=c13n...li-2, no=1359, id=1897, vol=1.676070e+01 or (segid " " and resid 217 and name HG) (segid " " and resid 217 and name HD21) or (segid " " and resid 190 and name HG) (segid " " and resid 190 and name HD21) or (segid " " and resid 190 and name HG) (segid " " and resid 190 and name HD11) assign (segid " " and resid 166 and name HG1) (segid " " and resid 158 and name HA) 3.033 1.150 1.150 weight 1.000 ! spec=c13n...li-2, no=1360, id=1898, vol=1.760900e+00 or (segid " " and resid 166 and name HG2) (segid " " and resid 158 and name HA) assign (segid " " and resid 166 and name HG2) (segid " " and resid 160 and name HA) 2.638 0.870 0.870 weight 1.000 ! spec=c13n...li-2, no=1369, id=1907, vol=4.072500e+00 or (segid " " and resid 166 and name HG2) (segid " " and resid 167 and name HA) or (segid " " and resid 166 and name HG1) (segid " " and resid 167 and name HA) assign (segid " " and resid 166 and name HG2) (segid " " and resid 166 and name HD2) 2.078 0.540 0.540 weight 1.000 ! spec=c13n...li-2, no=1370, id=1908, vol=1.701490e+01 or (segid " " and resid 166 and name HD1) (segid " " and resid 166 and name HG1) or (segid " " and resid 166 and name HD1) (segid " " and resid 166 and name HG2) assign (segid " " and resid 166 and name HG2) (segid " " and resid 166 and name HB1) 2.075 0.538 0.538 weight 1.000 ! spec=c13n...li-2, no=1371, id=1909, vol=1.720420e+01 or (segid " " and resid 166 and name HG1) (segid " " and resid 166 and name HB1) assign (segid " " and resid 208 and name HB) (segid " " and resid 208 and name HG12) 2.297 0.660 0.660 weight 1.000 ! spec=c13n...li-2, no=1376, id=1913, vol=9.326800e+00 or (segid " " and resid 208 and name HB) (segid " " and resid 208 and name HG11) assign (segid " " and resid 208 and name HG11) (segid " " and resid 208 and name HD11) 1.989 0.495 0.495 weight 1.000 ! spec=c13n...li-2, no=1378, id=1914, vol=2.212070e+01 or (segid " " and resid 208 and name HG12) (segid " " and resid 208 and name HD11) assign (segid " " and resid 227 and name HB1) (segid " " and resid 227 and name HD11) 1.951 0.476 0.476 weight 1.000 ! spec=c13n...li-2, no=1417, id=1950, vol=2.486680e+01 or (segid " " and resid 227 and name HG) (segid " " and resid 227 and name HD11) assign (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HG1) 2.190 0.600 0.600 weight 1.000 ! spec=c13n...li-2, no=1424, id=1956, vol=1.241830e+01 or (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HG2) or (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG2) assign (segid " " and resid 183 and name HB2) (segid " " and resid 183 and name HG2) 2.105 0.554 0.554 weight 1.000 ! spec=c13n...li-2, no=1431, id=1962, vol=1.577300e+01 or (segid " " and resid 183 and name HB1) (segid " " and resid 183 and name HG2) assign (segid " " and resid 183 and name HB2) (segid " " and resid 183 and name HG1) 2.137 0.571 0.571 weight 1.000 ! spec=c13n...li-2, no=1434, id=1965, vol=1.441510e+01 or (segid " " and resid 183 and name HB1) (segid " " and resid 183 and name HG1) assign (segid " " and resid 164 and name HD1) (segid " " and resid 164 and name HG1) 1.912 0.457 0.457 weight 1.000 ! spec=c13n...li-2, no=1435, id=1966, vol=2.811640e+01 or (segid " " and resid 164 and name HD2) (segid " " and resid 164 and name HG1) or (segid " " and resid 164 and name HD2) (segid " " and resid 164 and name HG2) or (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HG1) or (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HG1) assign (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HG2) 2.579 0.831 0.831 weight 1.000 ! spec=c13n...li-2, no=1441, id=1971, vol=4.662600e+00 or (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HG2) assign (segid " " and resid 205 and name HE1) (segid " " and resid 205 and name HG1) 2.245 0.630 0.630 weight 1.000 ! spec=c13n...li-2, no=1453, id=1983, vol=1.071460e+01 or (segid " " and resid 205 and name HE2) (segid " " and resid 205 and name HG1) assign (segid " " and resid 222 and name HD11) (segid " " and resid 217 and name HB2) 2.269 0.644 0.644 weight 1.000 ! spec=c13n...li-2, no=1454, id=1984, vol=1.004530e+01 or (segid " " and resid 222 and name HD11) (segid " " and resid 217 and name HB1) assign (segid " " and resid 222 and name HD11) (segid " " and resid 222 and name HG) 1.845 0.425 0.425 weight 1.000 ! spec=c13n...li-2, no=1455, id=1985, vol=3.481890e+01 or (segid " " and resid 161 and name HB2) (segid " " and resid 161 and name HD11) assign (segid " " and resid 181 and name HG) (segid " " and resid 181 and name HD21) 2.096 0.549 0.549 weight 1.000 ! spec=c13n...li-2, no=1467, id=1997, vol=1.617980e+01 or (segid " " and resid 181 and name HG) (segid " " and resid 181 and name HD11) assign (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HD1) 1.919 0.461 0.461 weight 1.000 ! spec=c13n...li-2, no=1479, id=2003, vol=2.743370e+01 or (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HB1) or (segid " " and resid 183 and name HD1) (segid " " and resid 183 and name HG2) assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HG2) 2.222 0.617 0.617 weight 1.000 ! spec=c13n...li-2, no=1488, id=2009, vol=1.138640e+01 or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HG2) or (segid " " and resid 206 and name HE2) (segid " " and resid 206 and name HG2) assign (segid " " and resid 182 and name HB1) (segid " " and resid 182 and name HG2) 2.184 0.596 0.596 weight 1.000 ! spec=c13n...li-2, no=1490, id=2011, vol=1.262900e+01 or (segid " " and resid 206 and name HB1) (segid " " and resid 206 and name HG2) assign (segid " " and resid 206 and name HB2) (segid " " and resid 206 and name HG2) 2.243 0.629 0.629 weight 1.000 ! spec=c13n...li-2, no=1496, id=2016, vol=1.075890e+01 or (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HB2) assign (segid " " and resid 217 and name HD21) (segid " " and resid 220 and name HB1) 2.409 0.725 3.591 weight 1.000 ! spec=c13n...li-2, no=1535, id=2052, vol=7.019200e+00 or (segid " " and resid 217 and name HD21) (segid " " and resid 220 and name HG1) assign (segid " " and resid 190 and name HD21) (segid " " and resid 162 and name HG2) 2.809 0.986 3.191 weight 1.000 ! spec=c13n...li-2, no=1542, id=2056, vol=2.794300e+00 or (segid " " and resid 217 and name HD21) (segid " " and resid 199 and name HB2) assign (segid " " and resid 217 and name HG) (segid " " and resid 217 and name HD21) 2.035 0.518 0.518 weight 1.000 ! spec=c13n...li-2, no=1543, id=2057, vol=1.931360e+01 or (segid " " and resid 190 and name HG) (segid " " and resid 190 and name HD21) assign (segid " " and resid 176 and name HG21) (segid " " and resid 176 and name HB) 1.854 0.429 0.429 weight 1.000 ! spec=c13n...li-2, no=1569, id=2081, vol=3.382120e+01 or (segid " " and resid 211 and name HA) (segid " " and resid 176 and name HG21) assign (segid " " and resid 158 and name HD2) (segid " " and resid 168 and name HG11) 2.727 0.929 0.929 weight 1.000 ! spec=c13n...li-2, no=1588, id=2099, vol=3.336400e+00 or (segid " " and resid 158 and name HD1) (segid " " and resid 168 and name HG11) assign (segid " " and resid 157 and name HB) (segid " " and resid 157 and name HG21) 2.021 0.510 0.510 weight 1.000 ! spec=c13n...li-2, no=1593, id=2104, vol=2.015250e+01 or (segid " " and resid 157 and name HB) (segid " " and resid 157 and name HG11) assign (segid " " and resid 157 and name HG21) (segid " " and resid 214 and name HG11) 2.260 0.638 0.638 weight 1.000 ! spec=c13n...li-2, no=1594, id=2105, vol=1.029360e+01 or (segid " " and resid 157 and name HG21) (segid " " and resid 214 and name HG12) assign (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HG11) 1.981 0.491 4.019 weight 1.000 ! spec=c13n...li-2, no=1608, id=2117, vol=2.266960e+01 or (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HG11) assign (segid " " and resid 172 and name HD2) (segid " " and resid 175 and name HG21) 2.579 0.831 0.831 weight 1.000 ! spec=c13n...li-2, no=1610, id=2119, vol=4.661900e+00 or (segid " " and resid 172 and name HD1) (segid " " and resid 175 and name HG21) assign (segid " " and resid 175 and name HB) (segid " " and resid 175 and name HG21) 1.991 0.496 4.009 weight 1.000 ! spec=c13n...li-2, no=1618, id=2126, vol=2.201990e+01 or (segid " " and resid 224 and name HG21) (segid " " and resid 224 and name HB) assign (segid " " and resid 175 and name HG11) (segid " " and resid 172 and name HD1) 2.909 1.058 1.058 weight 1.000 ! spec=c13n...li-2, no=1628, id=2136, vol=2.263300e+00 or (segid " " and resid 175 and name HG11) (segid " " and resid 172 and name HD2) assign (segid " " and resid 226 and name HA) (segid " " and resid 226 and name HG21) 1.932 0.467 0.467 weight 1.000 ! spec=c13n...li-2, no=1631, id=2138, vol=2.636500e+01 or (segid " " and resid 226 and name HA) (segid " " and resid 226 and name HG11) assign (segid " " and resid 224 and name HG11) (segid " " and resid 161 and name HA) 2.718 0.924 0.924 weight 1.000 ! spec=c13n...li-2, no=1656, id=2163, vol=3.401100e+00 or (segid " " and resid 224 and name HG11) (segid " " and resid 196 and name HA) assign (segid " " and resid 224 and name HG11) (segid " " and resid 162 and name HD1) 3.007 1.130 1.130 weight 1.000 ! spec=c13n...li-2, no=1657, id=2164, vol=1.854900e+00 or (segid " " and resid 224 and name HG11) (segid " " and resid 192 and name HA) assign (segid " " and resid 159 and name HG11) (segid " " and resid 224 and name HA) 2.675 0.894 3.325 weight 1.000 ! spec=c13n...li-2, no=1669, id=2176, vol=3.745600e+00 or (segid " " and resid 159 and name HG11) (segid " " and resid 197 and name HA) assign (segid " " and resid 197 and name HG11) (segid " " and resid 208 and name HD11) 2.031 0.516 3.969 weight 1.000 ! spec=c13n...li-2, no=1685, id=2187, vol=1.954740e+01 or (segid " " and resid 197 and name HG11) (segid " " and resid 208 and name HG21) or (segid " " and resid 222 and name HD21) (segid " " and resid 197 and name HG11) assign (segid " " and resid 156 and name HB) (segid " " and resid 168 and name HG21) 2.552 0.814 3.448 weight 1.000 ! spec=c13n...li-2, no=1690, id=2192, vol=4.968200e+00 or (segid " " and resid 158 and name HB2) (segid " " and resid 168 and name HG21) assign (segid " " and resid 214 and name HB) (segid " " and resid 214 and name HG21) 1.936 0.468 4.064 weight 1.000 ! spec=c13n...li-2, no=1717, id=2213, vol=2.607720e+01 or (segid " " and resid 214 and name HG11) (segid " " and resid 214 and name HG21) assign (segid " " and resid 169 and name HG21) (segid " " and resid 170 and name HD1) 2.552 0.814 3.448 weight 1.000 ! spec=c13n...li-2, no=1732, id=2227, vol=4.965800e+00 or (segid " " and resid 169 and name HG21) (segid " " and resid 170 and name HD2) assign (segid " " and resid 169 and name HG21) (segid " " and resid 214 and name HG12) 2.605 0.848 3.395 weight 1.000 ! spec=c13n...li-2, no=1736, id=2231, vol=4.391900e+00 or (segid " " and resid 169 and name HG21) (segid " " and resid 214 and name HG11) assign (segid " " and resid 184 and name HB1) (segid " " and resid 185 and name HD11) 2.192 0.600 3.808 weight 1.000 ! spec=c13n...li-2, no=1775, id=2267, vol=1.238150e+01 or (segid " " and resid 184 and name HB1) (segid " " and resid 181 and name HD21) assign (segid " " and resid 214 and name HA) (segid " " and resid 214 and name HD11) 2.217 0.614 3.783 weight 1.000 ! spec=c13n...li-2, no=1803, id=2291, vol=1.156250e+01 or (segid " " and resid 214 and name HD11) (segid " " and resid 170 and name HD1) assign (segid " " and resid 214 and name HD11) (segid " " and resid 172 and name HB2) 2.386 0.712 3.614 weight 1.000 ! spec=c13n...li-2, no=1806, id=2294, vol=7.434000e+00 or (segid " " and resid 214 and name HD11) (segid " " and resid 157 and name HB) assign (segid " " and resid 214 and name HG11) (segid " " and resid 214 and name HD11) 1.973 0.486 0.486 weight 1.000 ! spec=c13n...li-2, no=1807, id=2295, vol=2.327190e+01 or (segid " " and resid 214 and name HG12) (segid " " and resid 214 and name HD11) assign (segid " " and resid 158 and name HD2) (segid " " and resid 156 and name HD11) 2.737 0.936 0.936 weight 1.000 ! spec=c13n...li-2, no=1823, id=2308, vol=3.264700e+00 or (segid " " and resid 158 and name HD1) (segid " " and resid 156 and name HD11) assign (segid " " and resid 208 and name HD11) (segid " " and resid 199 and name HB1) 2.400 0.720 0.720 weight 1.000 ! spec=c13n...li-2, no=1828, id=2313, vol=7.170500e+00 or (segid " " and resid 199 and name HG2) (segid " " and resid 208 and name HD11) assign (segid " " and resid 205 and name HE2) (segid " " and resid 200 and name HD11) 2.536 0.804 3.464 weight 1.000 ! spec=c13n...li-2, no=1846, id=2328, vol=5.157100e+00 or (segid " " and resid 205 and name HE1) (segid " " and resid 200 and name HD11) assign (segid " " and resid 170 and name HA) (segid " " and resid 170 and name HD2) 2.912 1.060 1.060 weight 1.000 ! spec=c13n...li-2, no=1861, id=2342, vol=2.248300e+00 or (segid " " and resid 170 and name HA) (segid " " and resid 170 and name HD1) assign (segid " " and resid 170 and name HG2) (segid " " and resid 170 and name HA) 2.848 1.014 1.014 weight 1.000 ! spec=c13n...li-2, no=1862, id=2343, vol=2.568200e+00 or (segid " " and resid 170 and name HG1) (segid " " and resid 170 and name HA) assign (segid " " and resid 156 and name HD11) (segid " " and resid 168 and name HA) 2.643 0.873 3.357 weight 1.000 ! spec=c13n...li-2, no=1868, id=2347, vol=4.027600e+00 or (segid " " and resid 168 and name HA) (segid " " and resid 159 and name HG11) or (segid " " and resid 168 and name HA) (segid " " and resid 156 and name HG21) assign (segid " " and resid 181 and name HD11) (segid " " and resid 181 and name HA) 2.557 0.817 0.817 weight 1.000 ! spec=c13n...li-2, no=1882, id=2359, vol=4.910500e+00 or (segid " " and resid 181 and name HA) (segid " " and resid 169 and name HG11) assign (segid " " and resid 158 and name HD2) (segid " " and resid 168 and name HG21) 2.566 0.823 3.434 weight 1.000 ! spec=c13n...li-2, no=1896, id=2373, vol=4.802000e+00 or (segid " " and resid 158 and name HD1) (segid " " and resid 168 and name HG21) assign (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD2) 2.264 0.641 0.641 weight 1.000 ! spec=c13n...li-2, no=1900, id=2377, vol=1.017300e+01 or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HD2) or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HD1) or (segid " " and resid 206 and name HE2) (segid " " and resid 206 and name HD2) assign (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD2) 2.062 0.531 0.531 weight 1.000 ! spec=c13n...li-2, no=1922, id=2397, vol=1.784980e+01 or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HD2) or (segid " " and resid 182 and name HE1) (segid " " and resid 182 and name HD1) or (segid " " and resid 182 and name HE2) (segid " " and resid 182 and name HD1) assign (segid " " and resid 182 and name HD1) (segid " " and resid 182 and name HG2) 2.107 0.555 0.555 weight 1.000 ! spec=c13n...li-2, no=1923, id=2398, vol=1.567390e+01 or (segid " " and resid 182 and name HD2) (segid " " and resid 182 and name HG2) assign (segid " " and resid 183 and name HD2) (segid " " and resid 183 and name HB1) 2.274 0.647 0.647 weight 1.000 ! spec=c13n...li-2, no=1924, id=2399, vol=9.912600e+00 or (segid " " and resid 182 and name HD1) (segid " " and resid 182 and name HB1) assign (segid " " and resid 168 and name HG21) (segid " " and resid 158 and name HG1) 2.475 0.766 0.766 weight 1.000 ! spec=c13n...li-2, no=1930, id=2404, vol=5.968500e+00 or (segid " " and resid 168 and name HG11) (segid " " and resid 158 and name HG1) assign (segid " " and resid 172 and name HD1) (segid " " and resid 172 and name HG2) 2.398 0.719 0.719 weight 1.000 ! 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