NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
551077 | 2lwe | 18623 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | ambi |
assign (segid " " and resid 145 and name HB) (segid " " and resid 146 and name HG2) 5.795 3.977 0.977 weight 1.000 ! spec=c13n...li-6, no=3, id=1097, vol=1.655400e+00 assign (segid " " and resid 168 and name HA) (segid " " and resid 186 and name HZ2) 2.478 0.767 0.767 weight 1.000 ! spec=c13n...li-6, no=10, id=1102, vol=3.413600e+00 assign (segid " " and resid 112 and name HA) (segid " " and resid 116 and name HG21) 2.755 0.949 0.949 weight 1.000 ! spec=c13n...li-6, no=16, id=1106, vol=1.807400e+00 or (segid " " and resid 112 and name HA) (segid " " and resid 116 and name HG22) or (segid " " and resid 112 and name HA) (segid " " and resid 116 and name HG23) assign (segid " " and resid 168 and name HA) (segid " " and resid 168 and name HB2) 2.465 0.760 0.760 weight 1.000 ! spec=c13n...li-6, no=18, id=1108, vol=3.519600e+00 assign (segid " " and resid 121 and name HB) (segid " " and resid 140 and name HD11) 2.689 0.904 0.904 weight 1.000 ! spec=c13n...li-6, no=19, id=1109, vol=2.087700e+00 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HB) 2.603 0.847 0.847 weight 1.000 ! spec=c13n...li-6, no=23, id=1111, vol=2.541900e+00 assign (segid " " and resid 156 and name HA) (segid " " and resid 107 and name HD11) 2.410 0.726 0.726 weight 1.000 ! spec=c13n...li-6, no=24, id=1112, vol=4.033000e+00 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG11) 2.357 0.694 0.694 weight 1.000 ! spec=c13n...li-6, no=25, id=1113, vol=4.607900e+00 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HB2) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-6, no=29, id=1117, vol=7.363200e+00 assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HB1) 2.302 0.663 0.663 weight 1.000 ! spec=c13n...li-6, no=31, id=1119, vol=5.304000e+00 assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HD2) 2.650 0.878 0.878 weight 1.000 ! spec=c13n...li-6, no=34, id=1122, vol=2.280900e+00 assign (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HG2) 2.645 0.874 0.874 weight 1.000 ! spec=c13n...li-6, no=35, id=1123, vol=2.307800e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 151 and name HA1) 2.403 0.722 0.722 weight 1.000 ! spec=c13n...li-6, no=38, id=1125, vol=4.099700e+00 assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HB) 2.500 0.782 0.782 weight 1.000 ! spec=c13n...li-6, no=65, id=1144, vol=3.232100e+00 assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HB2) 2.203 0.607 0.607 weight 1.000 ! spec=c13n...li-6, no=66, id=1145, vol=6.911800e+00 assign (segid " " and resid 142 and name HA) (segid " " and resid 146 and name HB2) 3.303 1.663 0.663 weight 1.000 ! spec=c13n...li-6, no=67, id=1146, vol=5.288400e+00 assign (segid " " and resid 142 and name HA) (segid " " and resid 145 and name HG21) 2.659 0.884 0.884 weight 1.000 ! spec=c13n...li-6, no=69, id=1148, vol=2.233200e+00 assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HG12) 2.263 0.640 0.640 weight 1.000 ! spec=c13n...li-6, no=70, id=1149, vol=5.876600e+00 assign (segid " " and resid 120 and name HA) (segid " " and resid 155 and name HD11) 2.507 0.786 0.786 weight 1.000 ! spec=c13n...li-6, no=71, id=1150, vol=3.180200e+00 assign (segid " " and resid 120 and name HA) (segid " " and resid 118 and name HG21) 2.597 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=75, id=1154, vol=2.572800e+00 assign (segid " " and resid 143 and name HA) (segid " " and resid 148 and name HA) 2.481 0.770 0.770 weight 1.000 ! spec=c13n...li-6, no=81, id=1155, vol=3.383600e+00 assign (segid " " and resid 143 and name HA) (segid " " and resid 143 and name HB2) 2.443 0.746 0.746 weight 1.000 ! spec=c13n...li-6, no=83, id=1156, vol=3.718000e+00 assign (segid " " and resid 143 and name HA) (segid " " and resid 143 and name HB1) 2.279 0.649 0.649 weight 1.000 ! spec=c13n...li-6, no=84, id=1157, vol=5.641600e+00 assign (segid " " and resid 143 and name HA) (segid " " and resid 142 and name HG21) 2.678 0.897 0.897 weight 1.000 ! spec=c13n...li-6, no=85, id=1158, vol=2.139300e+00 assign (segid " " and resid 121 and name HA) (segid " " and resid 121 and name HB) 1.998 0.499 0.499 weight 1.000 ! spec=c13n...li-6, no=88, id=1161, vol=1.241490e+01 assign (segid " " and resid 136 and name HA) (segid " " and resid 136 and name HB1) 2.367 0.701 0.701 weight 1.000 ! spec=c13n...li-6, no=108, id=1175, vol=4.486200e+00 assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HB) 2.158 0.582 0.582 weight 1.000 ! spec=c13n...li-6, no=109, id=1176, vol=7.811600e+00 assign (segid " " and resid 136 and name HA) (segid " " and resid 139 and name HB) 2.399 0.719 0.719 weight 1.000 ! spec=c13n...li-6, no=110, id=1177, vol=4.144400e+00 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HB2) 2.584 0.835 0.835 weight 1.000 ! spec=c13n...li-6, no=112, id=1179, vol=2.653700e+00 assign (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HG12) 4.391 2.714 0.714 weight 1.000 ! spec=c13n...li-6, no=115, id=1182, vol=4.231600e+00 assign (segid " " and resid 121 and name HA) (segid " " and resid 124 and name HG21) 2.149 0.577 0.577 weight 1.000 ! spec=c13n...li-6, no=116, id=1183, vol=8.020300e+00 assign (segid " " and resid 124 and name HA) (segid " " and resid 127 and name HD21) 1.969 0.484 0.484 weight 1.000 ! spec=c13n...li-6, no=117, id=1184, vol=1.357180e+01 assign (segid " " and resid 145 and name HB) (segid " " and resid 145 and name HA) 1.926 0.464 0.464 weight 1.000 ! spec=c13n...li-6, no=126, id=1188, vol=1.545900e+01 assign (segid " " and resid 144 and name HB1) (segid " " and resid 144 and name HA) 1.915 0.458 0.458 weight 1.000 ! spec=c13n...li-6, no=130, id=1192, vol=1.600960e+01 assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HB2) 2.406 0.724 0.724 weight 1.000 ! spec=c13n...li-6, no=133, id=1193, vol=4.069500e+00 assign (segid " " and resid 183 and name HB2) (segid " " and resid 176 and name HB2) 3.783 1.968 1.968 weight 1.000 ! spec=c13n...li-6, no=134, id=1194, vol=1.699900e+00 assign (segid " " and resid 183 and name HB2) (segid " " and resid 175 and name HB1) 2.514 0.790 0.790 weight 1.000 ! spec=c13n...li-6, no=135, id=1195, vol=3.128000e+00 assign (segid " " and resid 144 and name HB1) (segid " " and resid 145 and name HG21) 2.596 0.842 0.842 weight 1.000 ! spec=c13n...li-6, no=136, id=1196, vol=2.581500e+00 assign (segid " " and resid 116 and name HA) (segid " " and resid 116 and name HG21) 2.009 0.505 0.505 weight 1.000 ! spec=c13n...li-6, no=137, id=1197, vol=1.200150e+01 assign (segid " " and resid 162 and name HB2) (segid " " and resid 162 and name HA) 2.276 0.647 0.647 weight 1.000 ! spec=c13n...li-6, no=141, id=1201, vol=5.686300e+00 assign (segid " " and resid 162 and name HB2) (segid " " and resid 162 and name HB1) 1.934 0.468 0.468 weight 1.000 ! spec=c13n...li-6, no=146, id=1204, vol=1.507280e+01 assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB2) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-6, no=157, id=1210, vol=5.437400e+00 assign (segid " " and resid 158 and name HA) (segid " " and resid 158 and name HB1) 2.291 0.656 0.656 weight 1.000 ! spec=c13n...li-6, no=158, id=1211, vol=5.469900e+00 assign (segid " " and resid 158 and name HA) (segid " " and resid 161 and name HG2) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-6, no=160, id=1213, vol=3.575200e+00 assign (segid " " and resid 167 and name HA) (segid " " and resid 167 and name HB2) 2.355 0.693 0.693 weight 1.000 ! spec=c13n...li-6, no=164, id=1216, vol=4.629200e+00 assign (segid " " and resid 167 and name HA) (segid " " and resid 167 and name HB1) 2.375 0.705 0.705 weight 1.000 ! spec=c13n...li-6, no=165, id=1217, vol=4.406100e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HD1) 2.423 0.734 0.734 weight 1.000 ! spec=c13n...li-6, no=169, id=1220, vol=3.906600e+00 assign (segid " " and resid 128 and name HB2) (segid " " and resid 136 and name HA) 4.746 2.942 0.942 weight 1.000 ! spec=c13n...li-6, no=174, id=1222, vol=1.843700e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HB2) 2.525 0.797 0.797 weight 1.000 ! spec=c13n...li-6, no=178, id=1226, vol=3.048600e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HB2) 2.519 0.793 0.793 weight 1.000 ! spec=c13n...li-6, no=181, id=1229, vol=3.088200e+00 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HB) 2.196 0.603 0.603 weight 1.000 ! spec=c13n...li-6, no=182, id=1230, vol=7.047800e+00 assign (segid " " and resid 97 and name HA) (segid " " and resid 100 and name HB1) 2.601 0.846 0.846 weight 1.000 ! spec=c13n...li-6, no=183, id=1231, vol=2.548800e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 181 and name HD2) 2.838 1.007 1.007 weight 1.000 ! spec=c13n...li-6, no=184, id=1232, vol=1.511800e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 185 and name HG) 2.489 0.774 0.774 weight 1.000 ! spec=c13n...li-6, no=186, id=1234, vol=3.325700e+00 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG11) 2.417 0.730 0.730 weight 1.000 ! spec=c13n...li-6, no=187, id=1235, vol=3.965600e+00 assign (segid " " and resid 97 and name HA) (segid " " and resid 97 and name HG21) 2.040 0.520 0.520 weight 1.000 ! spec=c13n...li-6, no=189, id=1237, vol=1.097340e+01 assign (segid " " and resid 183 and name HA) (segid " " and resid 172 and name HA) 2.355 0.693 0.693 weight 1.000 ! spec=c13n...li-6, no=195, id=1241, vol=4.626800e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 126 and name HB1) 2.770 0.959 0.959 weight 1.000 ! spec=c13n...li-6, no=202, id=1242, vol=1.748000e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HB) 2.227 0.620 0.620 weight 1.000 ! spec=c13n...li-6, no=203, id=1243, vol=6.469400e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 174 and name HB1) 2.800 0.980 0.980 weight 1.000 ! spec=c13n...li-6, no=204, id=1244, vol=1.640000e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HG21) 2.552 0.814 0.814 weight 1.000 ! spec=c13n...li-6, no=206, id=1246, vol=2.861900e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HD12) 2.499 0.781 0.781 weight 1.000 ! spec=c13n...li-6, no=208, id=1248, vol=3.243600e+00 or (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HD11) or (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HD13) assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HB) 2.105 0.554 0.554 weight 1.000 ! spec=c13n...li-6, no=211, id=1250, vol=9.070000e+00 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HG12) 2.557 0.817 0.817 weight 1.000 ! spec=c13n...li-6, no=212, id=1251, vol=2.829400e+00 assign (segid " " and resid 132 and name HA) (segid " " and resid 132 and name HG21) 2.007 0.503 0.503 weight 1.000 ! spec=c13n...li-6, no=213, id=1252, vol=1.209810e+01 assign (segid " " and resid 104 and name HA) (segid " " and resid 167 and name HZ2) 2.673 0.893 0.893 weight 1.000 ! spec=c13n...li-6, no=216, id=1255, vol=2.165200e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HD1) 2.404 0.722 0.722 weight 1.000 ! spec=c13n...li-6, no=217, id=1256, vol=4.092900e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 117 and name HD2) 4.769 2.958 0.958 weight 1.000 ! spec=c13n...li-6, no=222, id=1260, vol=1.752400e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HB2) 2.590 0.838 0.838 weight 1.000 ! spec=c13n...li-6, no=223, id=1261, vol=2.617500e+00 assign (segid " " and resid 182 and name HA) (segid " " and resid 182 and name HB1) 2.533 0.802 0.802 weight 1.000 ! spec=c13n...li-6, no=224, id=1262, vol=2.993500e+00 assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HB2) 2.533 0.802 0.802 weight 1.000 ! spec=c13n...li-6, no=225, id=1263, vol=2.988100e+00 assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HG2) 2.592 0.840 0.840 weight 1.000 ! spec=c13n...li-6, no=226, id=1264, vol=2.606400e+00 assign (segid " " and resid 104 and name HA) (segid " " and resid 160 and name HD11) 4.294 1.658 0.658 weight 1.000 ! spec=c13n...li-6, no=228, id=1266, vol=5.423900e+00 assign (segid " " and resid 183 and name HA) (segid " " and resid 175 and name HD11) 5.432 0.740 0.740 weight 1.000 ! spec=c13n...li-6, no=229, id=1267, vol=3.814900e+00 assign (segid " " and resid 183 and name HA) (segid " " and resid 186 and name HB2) 2.662 0.886 0.886 weight 1.000 ! spec=c13n...li-6, no=236, id=1271, vol=2.218200e+00 assign (segid " " and resid 114 and name HA) (segid " " and resid 182 and name HE1) 2.738 0.937 0.937 weight 1.000 ! spec=c13n...li-6, no=238, id=1273, vol=1.873700e+00 assign (segid " " and resid 114 and name HA) (segid " " and resid 114 and name HD1) 2.626 0.862 0.862 weight 1.000 ! spec=c13n...li-6, no=239, id=1274, vol=2.407700e+00 assign (segid " " and resid 114 and name HA) (segid " " and resid 114 and name HB1) 2.515 0.791 0.791 weight 1.000 ! spec=c13n...li-6, no=241, id=1275, vol=3.121600e+00 assign (segid " " and resid 188 and name HA) (segid " " and resid 103 and name HD1) 2.834 1.004 1.004 weight 1.000 ! spec=c13n...li-6, no=243, id=1277, vol=1.523300e+00 assign (segid " " and resid 188 and name HA) (segid " " and resid 103 and name HE1) 2.260 0.638 0.638 weight 1.000 ! spec=c13n...li-6, no=244, id=1278, vol=5.931100e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 115 and name HA) 2.799 0.979 0.979 weight 1.000 ! spec=c13n...li-6, no=249, id=1280, vol=1.643100e+00 assign (segid " " and resid 162 and name HA) (segid " " and resid 162 and name HB1) 2.583 0.834 0.834 weight 1.000 ! spec=c13n...li-6, no=251, id=1282, vol=2.657000e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HG2) 2.605 0.849 0.849 weight 1.000 ! spec=c13n...li-6, no=254, id=1285, vol=2.525200e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HG1) 2.420 0.732 0.732 weight 1.000 ! spec=c13n...li-6, no=255, id=1286, vol=3.934700e+00 assign (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HG2) 2.285 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=256, id=1287, vol=5.555500e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HB2) 2.243 0.629 0.629 weight 1.000 ! spec=c13n...li-6, no=258, id=1289, vol=6.197800e+00 assign (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HB2) 2.177 0.592 0.592 weight 1.000 ! spec=c13n...li-6, no=259, id=1290, vol=7.427000e+00 assign (segid " " and resid 109 and name HA) (segid " " and resid 109 and name HB2) 1.974 0.487 0.487 weight 1.000 ! spec=c13n...li-6, no=261, id=1292, vol=1.334510e+01 assign (segid " " and resid 101 and name HA) (segid " " and resid 101 and name HB1) 2.229 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=262, id=1293, vol=6.439800e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 149 and name HB1) 2.255 0.635 0.635 weight 1.000 ! spec=c13n...li-6, no=263, id=1294, vol=6.013700e+00 assign (segid " " and resid 135 and name HA) (segid " " and resid 138 and name HB1) 1.859 0.432 0.432 weight 1.000 ! spec=c13n...li-6, no=264, id=1295, vol=1.912200e+01 assign (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HB) 2.340 0.684 0.684 weight 1.000 ! spec=c13n...li-6, no=269, id=1300, vol=4.814100e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB2) 2.220 0.616 0.616 weight 1.000 ! spec=c13n...li-6, no=270, id=1301, vol=6.598000e+00 or (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB1) or (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB3) assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HG1) 2.375 0.705 0.705 weight 1.000 ! spec=c13n...li-6, no=271, id=1302, vol=4.402400e+00 assign (segid " " and resid 177 and name HA) (segid " " and resid 177 and name HG2) 2.646 0.875 0.875 weight 1.000 ! spec=c13n...li-6, no=272, id=1303, vol=2.302100e+00 assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG12) 2.775 0.963 0.963 weight 1.000 ! spec=c13n...li-6, no=273, id=1304, vol=1.728100e+00 assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG11) 2.545 0.810 1.810 weight 1.000 ! spec=c13n...li-6, no=274, id=1305, vol=2.904300e+00 assign (segid " " and resid 162 and name HB2) (segid " " and resid 167 and name HB2) 2.587 0.837 0.837 weight 1.000 ! spec=c13n...li-6, no=285, id=1314, vol=2.633600e+00 assign (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HG2) 2.443 0.746 0.746 weight 1.000 ! spec=c13n...li-6, no=286, id=1315, vol=3.718600e+00 assign (segid " " and resid 108 and name HA) (segid " " and resid 111 and name HG2) 2.327 0.677 0.677 weight 1.000 ! spec=c13n...li-6, no=287, id=1316, vol=4.977400e+00 assign (segid " " and resid 137 and name HA) (segid " " and resid 137 and name HG2) 2.486 0.772 0.772 weight 1.000 ! spec=c13n...li-6, no=289, id=1318, vol=3.350200e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HB2) 2.195 0.602 0.602 weight 1.000 ! spec=c13n...li-6, no=291, id=1320, vol=7.065700e+00 assign (segid " " and resid 137 and name HA) (segid " " and resid 137 and name HG1) 2.300 0.661 0.661 weight 1.000 ! spec=c13n...li-6, no=292, id=1321, vol=5.342900e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HB2) 2.455 0.753 0.753 weight 1.000 ! spec=c13n...li-6, no=296, id=1325, vol=3.611300e+00 assign (segid " " and resid 153 and name HA) (segid " " and resid 152 and name HB1) 2.722 0.926 0.926 weight 1.000 ! spec=c13n...li-6, no=298, id=1327, vol=1.940600e+00 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HB1) 2.150 0.578 0.578 weight 1.000 ! spec=c13n...li-6, no=299, id=1328, vol=7.990200e+00 assign (segid " " and resid 108 and name HA) (segid " " and resid 108 and name HG2) 2.457 0.755 0.755 weight 1.000 ! spec=c13n...li-6, no=300, id=1329, vol=3.588700e+00 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HB) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-6, no=301, id=1330, vol=3.572700e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HD21) 4.396 2.717 1.717 weight 1.000 ! spec=c13n...li-6, no=303, id=1332, vol=4.178100e+00 assign (segid " " and resid 153 and name HA) (segid " " and resid 156 and name HG21) 4.572 0.827 1.827 weight 1.000 ! spec=c13n...li-6, no=305, id=1334, vol=2.727100e+00 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HG12) 2.764 0.955 0.955 weight 1.000 ! spec=c13n...li-6, no=306, id=1335, vol=1.772300e+00 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HG11) 2.732 0.933 0.933 weight 1.000 ! spec=c13n...li-6, no=308, id=1337, vol=1.900400e+00 assign (segid " " and resid 130 and name HA) (segid " " and resid 130 and name HB2) 2.355 0.693 0.693 weight 1.000 ! spec=c13n...li-6, no=319, id=1339, vol=4.633100e+00 assign (segid " " and resid 130 and name HA) (segid " " and resid 130 and name HB1) 2.252 0.634 0.634 weight 1.000 ! spec=c13n...li-6, no=320, id=1340, vol=6.058200e+00 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HB2) 2.541 0.807 0.807 weight 1.000 ! spec=c13n...li-6, no=321, id=1341, vol=2.937200e+00 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HG1) 2.662 0.886 0.886 weight 1.000 ! spec=c13n...li-6, no=323, id=1343, vol=2.218900e+00 assign (segid " " and resid 130 and name HA) (segid " " and resid 164 and name HG2) 2.811 0.988 0.988 weight 1.000 ! spec=c13n...li-6, no=324, id=1344, vol=1.600100e+00 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD21) 3.169 1.588 0.588 weight 1.000 ! spec=c13n...li-6, no=325, id=1345, vol=7.593200e+00 assign (segid " " and resid 107 and name HA) (segid " " and resid 186 and name HZ2) 2.558 0.818 0.818 weight 1.000 ! spec=c13n...li-6, no=326, id=1346, vol=2.816700e+00 assign (segid " " and resid 172 and name HA) (segid " " and resid 186 and name HD1) 2.460 0.756 0.756 weight 1.000 ! spec=c13n...li-6, no=327, id=1347, vol=3.565300e+00 assign (segid " " and resid 176 and name HA) (segid " " and resid 179 and name HA) 2.249 0.632 0.632 weight 1.000 ! spec=c13n...li-6, no=339, id=1354, vol=6.110200e+00 assign (segid " " and resid 141 and name HA) (segid " " and resid 141 and name HG1) 2.350 0.690 0.690 weight 1.000 ! spec=c13n...li-6, no=341, id=1356, vol=4.690400e+00 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HB2) 2.023 0.511 0.511 weight 1.000 ! spec=c13n...li-6, no=344, id=1359, vol=1.153780e+01 assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HG1) 2.419 0.731 0.731 weight 1.000 ! spec=c13n...li-6, no=345, id=1360, vol=3.941800e+00 assign (segid " " and resid 135 and name HA) (segid " " and resid 135 and name HG2) 1.984 0.492 0.492 weight 1.000 ! spec=c13n...li-6, no=346, id=1361, vol=1.296050e+01 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HB1) 2.467 0.761 0.761 weight 1.000 ! spec=c13n...li-6, no=350, id=1365, vol=3.504300e+00 assign (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HB2) 4.110 2.557 0.557 weight 1.000 ! spec=c13n...li-6, no=354, id=1369, vol=8.951800e+00 assign (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HB1) 2.514 0.790 0.790 weight 1.000 ! spec=c13n...li-6, no=355, id=1370, vol=3.132400e+00 assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HG2) 2.248 0.632 0.632 weight 1.000 ! spec=c13n...li-6, no=357, id=1372, vol=6.116500e+00 assign (segid " " and resid 171 and name HA) (segid " " and resid 171 and name HB1) 2.261 0.639 0.639 weight 1.000 ! spec=c13n...li-6, no=358, id=1373, vol=5.920100e+00 assign (segid " " and resid 169 and name HA) (segid " " and resid 169 and name HG1) 2.384 0.710 0.710 weight 1.000 ! spec=c13n...li-6, no=359, id=1374, vol=4.305900e+00 assign (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD12) 5.516 3.791 0.791 weight 1.000 ! spec=c13n...li-6, no=362, id=1377, vol=3.113900e+00 or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD11) or (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD13) assign (segid " " and resid 172 and name HA) (segid " " and resid 175 and name HD11) 5.247 3.631 1.631 weight 1.000 ! spec=c13n...li-6, no=364, id=1379, vol=6.134700e+00 assign (segid " " and resid 115 and name HA) (segid " " and resid 114 and name HD1) 2.600 0.845 0.845 weight 1.000 ! spec=c13n...li-6, no=368, id=1383, vol=2.554600e+00 assign (segid " " and resid 140 and name HA) (segid " " and resid 143 and name HB2) 2.564 0.822 0.822 weight 1.000 ! spec=c13n...li-6, no=373, id=1387, vol=2.781000e+00 assign (segid " " and resid 155 and name HA) (segid " " and resid 158 and name HB2) 2.541 0.807 0.807 weight 1.000 ! spec=c13n...li-6, no=374, id=1388, vol=2.934100e+00 assign (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB2) 2.555 0.816 0.816 weight 1.000 ! spec=c13n...li-6, no=375, id=1389, vol=2.839800e+00 assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB2) 2.233 0.623 0.623 weight 1.000 ! spec=c13n...li-6, no=379, id=1393, vol=6.375100e+00 assign (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HB1) 2.267 0.643 0.643 weight 1.000 ! spec=c13n...li-6, no=380, id=1394, vol=5.813200e+00 assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HB1) 2.249 0.632 0.632 weight 1.000 ! spec=c13n...li-6, no=383, id=1397, vol=6.108000e+00 assign (segid " " and resid 155 and name HA) (segid " " and resid 155 and name HB1) 2.435 0.741 0.741 weight 1.000 ! spec=c13n...li-6, no=385, id=1399, vol=3.792500e+00 assign (segid " " and resid 155 and name HA) (segid " " and resid 139 and name HG12) 1.800 0.405 0.405 weight 1.000 ! spec=c13n...li-6, no=387, id=1401, vol=2.324850e+01 assign (segid " " and resid 118 and name HA) (segid " " and resid 118 and name HD11) 2.270 0.644 0.644 weight 1.000 ! spec=c13n...li-6, no=388, id=1402, vol=5.779800e+00 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HD1) 2.397 0.718 0.718 weight 1.000 ! spec=c13n...li-6, no=389, id=1403, vol=4.165400e+00 assign (segid " " and resid 133 and name HA) (segid " " and resid 136 and name HB2) 2.508 0.786 0.786 weight 1.000 ! spec=c13n...li-6, no=407, id=1414, vol=3.174800e+00 assign (segid " " and resid 133 and name HA) (segid " " and resid 133 and name HB1) 2.129 0.567 0.567 weight 1.000 ! spec=c13n...li-6, no=409, id=1416, vol=8.482700e+00 assign (segid " " and resid 133 and name HA) (segid " " and resid 136 and name HB1) 2.548 0.812 0.812 weight 1.000 ! spec=c13n...li-6, no=410, id=1417, vol=2.884400e+00 assign (segid " " and resid 133 and name HA) (segid " " and resid 137 and name HG2) 2.205 0.608 0.608 weight 1.000 ! spec=c13n...li-6, no=411, id=1418, vol=6.876700e+00 assign (segid " " and resid 173 and name HA) (segid " " and resid 176 and name HG1) 2.782 0.967 0.967 weight 1.000 ! spec=c13n...li-6, no=412, id=1419, vol=1.704600e+00 assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB2) 2.454 0.753 0.753 weight 1.000 ! spec=c13n...li-6, no=413, id=1420, vol=3.614000e+00 assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HB1) 2.245 0.630 0.630 weight 1.000 ! spec=c13n...li-6, no=417, id=1424, vol=6.170600e+00 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HB2) 2.363 0.698 0.698 weight 1.000 ! spec=c13n...li-6, no=421, id=1428, vol=4.532500e+00 assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HD2) 2.164 0.585 0.585 weight 1.000 ! spec=c13n...li-6, no=425, id=1432, vol=7.690100e+00 assign (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HD2) 2.143 0.574 0.574 weight 1.000 ! spec=c13n...li-6, no=427, id=1434, vol=8.149400e+00 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HD2) 2.359 0.696 0.696 weight 1.000 ! spec=c13n...li-6, no=429, id=1436, vol=4.581100e+00 assign (segid " " and resid 105 and name HA) (segid " " and resid 108 and name HG2) 2.788 0.972 0.972 weight 1.000 ! spec=c13n...li-6, no=431, id=1438, vol=1.680900e+00 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG2) 2.379 0.707 0.707 weight 1.000 ! spec=c13n...li-6, no=433, id=1440, vol=4.357800e+00 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HD21) 2.196 0.603 0.603 weight 1.000 ! spec=c13n...li-6, no=436, id=1443, vol=7.049600e+00 assign (segid " " and resid 173 and name HA) (segid " " and resid 173 and name HD21) 2.745 1.381 0.381 weight 1.000 ! spec=c13n...li-6, no=438, id=1444, vol=2.797590e+01 assign (segid " " and resid 106 and name HA) (segid " " and resid 105 and name HD11) 4.646 2.875 0.875 weight 1.000 ! spec=c13n...li-6, no=439, id=1445, vol=2.300900e+00 assign (segid " " and resid 100 and name HA) (segid " " and resid 100 and name HD11) 2.068 0.534 0.534 weight 1.000 ! spec=c13n...li-6, no=440, id=1446, vol=1.010720e+01 assign (segid " " and resid 175 and name HA) (segid " " and resid 180 and name HB1) 2.839 1.007 1.007 weight 1.000 ! spec=c13n...li-6, no=444, id=1449, vol=1.509100e+00 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HG) 2.859 1.022 1.022 weight 1.000 ! spec=c13n...li-6, no=445, id=1450, vol=1.445000e+00 assign (segid " " and resid 160 and name HA) (segid " " and resid 104 and name HG2) 2.762 0.953 0.953 weight 1.000 ! spec=c13n...li-6, no=446, id=1451, vol=1.781100e+00 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HB1) 2.452 0.752 0.752 weight 1.000 ! spec=c13n...li-6, no=448, id=1453, vol=3.630800e+00 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HB1) 2.597 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=449, id=1454, vol=2.576500e+00 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HD11) 2.101 0.552 1.552 weight 1.000 ! spec=c13n...li-6, no=450, id=1455, vol=9.184800e+00 assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD12) 2.743 0.941 0.941 weight 1.000 ! spec=c13n...li-6, no=451, id=1456, vol=1.852600e+00 or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD11) or (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD13) assign (segid " " and resid 175 and name HA) (segid " " and resid 175 and name HD21) 2.162 0.584 0.584 weight 1.000 ! spec=c13n...li-6, no=453, id=1458, vol=7.737400e+00 assign (segid " " and resid 162 and name HB2) (segid " " and resid 159 and name HA) 2.583 0.834 0.834 weight 1.000 ! spec=c13n...li-6, no=455, id=1460, vol=2.660600e+00 assign (segid " " and resid 159 and name HA) (segid " " and resid 162 and name HB1) 2.763 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=456, id=1461, vol=1.777000e+00 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HG) 2.574 0.828 0.828 weight 1.000 ! spec=c13n...li-6, no=458, id=1462, vol=2.717900e+00 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HB2) 2.597 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=459, id=1463, vol=2.576100e+00 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HD21) 4.054 2.527 0.527 weight 1.000 ! spec=c13n...li-6, no=462, id=1466, vol=1.052500e+01 assign (segid " " and resid 159 and name HA) (segid " " and resid 159 and name HB1) 2.572 0.827 0.827 weight 1.000 ! spec=c13n...li-6, no=463, id=1467, vol=2.731300e+00 assign (segid " " and resid 119 and name HA) (segid " " and resid 120 and name HD2) 2.271 0.645 0.645 weight 1.000 ! spec=c13n...li-6, no=476, id=1473, vol=5.761700e+00 assign (segid " " and resid 93 and name HA) (segid " " and resid 93 and name HB2) 2.279 0.649 0.649 weight 1.000 ! spec=c13n...li-6, no=479, id=1476, vol=5.635100e+00 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HG2) 2.399 0.720 0.720 weight 1.000 ! spec=c13n...li-6, no=482, id=1478, vol=4.140900e+00 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HB2) 2.180 0.594 0.594 weight 1.000 ! spec=c13n...li-6, no=484, id=1480, vol=7.369500e+00 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HB1) 2.251 0.633 0.633 weight 1.000 ! spec=c13n...li-6, no=485, id=1481, vol=6.079300e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HB1) 2.169 0.588 0.588 weight 1.000 ! spec=c13n...li-6, no=488, id=1484, vol=7.589800e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HD2) 2.317 0.671 0.671 weight 1.000 ! spec=c13n...li-6, no=490, id=1486, vol=5.107800e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HD1) 2.327 0.677 0.677 weight 1.000 ! spec=c13n...li-6, no=491, id=1487, vol=4.972400e+00 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG12) 2.716 0.922 0.922 weight 1.000 ! spec=c13n...li-6, no=492, id=1488, vol=1.966800e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HG2) 2.232 0.623 0.623 weight 1.000 ! spec=c13n...li-6, no=493, id=1489, vol=6.380600e+00 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG11) 2.679 0.897 0.897 weight 1.000 ! spec=c13n...li-6, no=494, id=1490, vol=2.136100e+00 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HD11) 2.343 0.686 0.686 weight 1.000 ! spec=c13n...li-6, no=497, id=1493, vol=4.771700e+00 assign (segid " " and resid 154 and name HA) (segid " " and resid 157 and name HG2) 2.770 0.959 0.959 weight 1.000 ! spec=c13n...li-6, no=508, id=1502, vol=1.748500e+00 assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HG2) 2.176 0.592 0.592 weight 1.000 ! spec=c13n...li-6, no=509, id=1503, vol=7.442000e+00 assign (segid " " and resid 95 and name HA) (segid " " and resid 98 and name HB2) 2.511 0.788 0.788 weight 1.000 ! spec=c13n...li-6, no=510, id=1504, vol=3.153100e+00 assign (segid " " and resid 189 and name HA) (segid " " and resid 189 and name HB2) 2.147 0.576 0.576 weight 1.000 ! spec=c13n...li-6, no=511, id=1505, vol=8.071200e+00 assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HB2) 2.042 0.521 0.521 weight 1.000 ! spec=c13n...li-6, no=512, id=1506, vol=1.089540e+01 assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HD1) 2.391 0.714 0.714 weight 1.000 ! spec=c13n...li-6, no=514, id=1508, vol=4.230600e+00 assign (segid " " and resid 95 and name HA) (segid " " and resid 95 and name HG2) 2.278 0.649 0.649 weight 1.000 ! spec=c13n...li-6, no=516, id=1510, vol=5.655400e+00 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HG1) 2.681 0.898 0.898 weight 1.000 ! spec=c13n...li-6, no=517, id=1511, vol=2.127700e+00 assign (segid " " and resid 154 and name HA) (segid " " and resid 139 and name HG12) 4.780 2.966 0.966 weight 1.000 ! spec=c13n...li-6, no=518, id=1512, vol=1.711200e+00 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HB1) 2.313 0.669 0.669 weight 1.000 ! spec=c13n...li-6, no=522, id=1515, vol=5.159300e+00 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HB2) 2.183 0.596 0.596 weight 1.000 ! spec=c13n...li-6, no=523, id=1516, vol=7.289300e+00 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HG2) 2.234 0.624 0.624 weight 1.000 ! spec=c13n...li-6, no=524, id=1517, vol=6.350000e+00 assign (segid " " and resid 126 and name HA) (segid " " and resid 126 and name HB2) 2.229 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=527, id=1519, vol=6.444300e+00 assign (segid " " and resid 126 and name HA) (segid " " and resid 126 and name HB1) 2.381 0.709 0.709 weight 1.000 ! spec=c13n...li-6, no=528, id=1520, vol=4.332000e+00 assign (segid " " and resid 94 and name HA) (segid " " and resid 94 and name HG2) 2.554 0.816 0.816 weight 1.000 ! spec=c13n...li-6, no=535, id=1525, vol=2.844100e+00 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HD2) 2.210 0.611 0.611 weight 1.000 ! spec=c13n...li-6, no=540, id=1530, vol=6.772400e+00 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HG1) 2.512 0.789 0.789 weight 1.000 ! spec=c13n...li-6, no=542, id=1532, vol=3.144100e+00 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HG2) 2.439 0.744 0.744 weight 1.000 ! spec=c13n...li-6, no=543, id=1533, vol=3.750900e+00 assign (segid " " and resid 174 and name HA) (segid " " and resid 126 and name HB2) 2.815 0.990 0.990 weight 1.000 ! spec=c13n...li-6, no=545, id=1534, vol=1.588000e+00 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HG1) 2.367 0.700 0.700 weight 1.000 ! spec=c13n...li-6, no=546, id=1535, vol=4.489700e+00 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HB2) 2.341 0.685 0.685 weight 1.000 ! spec=c13n...li-6, no=547, id=1536, vol=4.796400e+00 assign (segid " " and resid 174 and name HA) (segid " " and resid 177 and name HB2) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-6, no=548, id=1537, vol=5.362500e+00 assign (segid " " and resid 150 and name HA) (segid " " and resid 142 and name HG22) 2.721 0.926 0.926 weight 1.000 ! spec=c13n...li-6, no=551, id=1540, vol=1.945200e+00 or (segid " " and resid 150 and name HA) (segid " " and resid 142 and name HG21) or (segid " " and resid 150 and name HA) (segid " " and resid 142 and name HG23) assign (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HB1) 2.639 0.871 0.871 weight 1.000 ! spec=c13n...li-6, no=557, id=1545, vol=2.336600e+00 assign (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HD11) 2.439 0.744 0.744 weight 1.000 ! spec=c13n...li-6, no=558, id=1546, vol=3.747900e+00 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HG) 2.483 0.771 0.771 weight 1.000 ! spec=c13n...li-6, no=563, id=1548, vol=3.369100e+00 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HB2) 2.332 0.680 0.680 weight 1.000 ! spec=c13n...li-6, no=564, id=1549, vol=4.913400e+00 assign (segid " " and resid 110 and name HA) (segid " " and resid 110 and name HD11) 2.501 0.782 0.782 weight 1.000 ! spec=c13n...li-6, no=565, id=1550, vol=3.230100e+00 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HA) 2.290 0.655 0.655 weight 1.000 ! spec=c13n...li-6, no=567, id=1552, vol=5.480500e+00 assign (segid " " and resid 186 and name HA) (segid " " and resid 186 and name HB2) 2.493 0.777 0.777 weight 1.000 ! spec=c13n...li-6, no=570, id=1554, vol=3.289800e+00 assign (segid " " and resid 180 and name HA) (segid " " and resid 180 and name HB2) 2.316 0.670 0.670 weight 1.000 ! spec=c13n...li-6, no=572, id=1556, vol=5.120000e+00 assign (segid " " and resid 180 and name HA) (segid " " and resid 180 and name HB1) 2.410 0.726 0.726 weight 1.000 ! spec=c13n...li-6, no=573, id=1557, vol=4.034100e+00 assign (segid " " and resid 186 and name HA) (segid " " and resid 110 and name HD11) 2.785 0.969 0.969 weight 1.000 ! spec=c13n...li-6, no=575, id=1559, vol=1.693600e+00 assign (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HG2) 2.826 0.998 0.998 weight 1.000 ! spec=c13n...li-6, no=580, id=1563, vol=1.551800e+00 assign (segid " " and resid 150 and name HA) (segid " " and resid 153 and name HB2) 2.220 0.616 0.616 weight 1.000 ! spec=c13n...li-6, no=581, id=1564, vol=6.594800e+00 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HB2) 2.194 0.602 0.602 weight 1.000 ! spec=c13n...li-6, no=582, id=1565, vol=7.080400e+00 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HB1) 2.334 0.681 0.681 weight 1.000 ! spec=c13n...li-6, no=584, id=1567, vol=4.889500e+00 assign (segid " " and resid 185 and name HA) (segid " " and resid 185 and name HD21) 2.954 0.477 0.477 weight 1.000 ! spec=c13n...li-6, no=585, id=1568, vol=1.420860e+01 assign (segid " " and resid 163 and name HA) (segid " " and resid 163 and name HB1) 2.140 0.573 0.573 weight 1.000 ! spec=c13n...li-6, no=590, id=1570, vol=8.213200e+00 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HG) 2.179 0.594 0.594 weight 1.000 ! spec=c13n...li-6, no=592, id=1572, vol=7.375300e+00 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HD11) 2.946 0.523 1.523 weight 1.000 ! spec=c13n...li-6, no=595, id=1575, vol=1.078310e+01 assign (segid " " and resid 166 and name HA) (segid " " and resid 166 and name HB2) 2.040 0.520 0.520 weight 1.000 ! spec=c13n...li-6, no=598, id=1576, vol=1.096340e+01 assign (segid " " and resid 166 and name HA) (segid " " and resid 166 and name HB1) 2.019 0.510 0.510 weight 1.000 ! spec=c13n...li-6, no=599, id=1577, vol=1.166290e+01 assign (segid " " and resid 120 and name HD2) (segid " " and resid 120 and name HD1) 2.229 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=602, id=1579, vol=6.444500e+00 assign (segid " " and resid 120 and name HD1) (segid " " and resid 148 and name HB1) 2.640 0.871 0.871 weight 1.000 ! spec=c13n...li-6, no=605, id=1581, vol=2.333600e+00 assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD12) 2.750 0.945 0.945 weight 1.000 ! spec=c13n...li-6, no=607, id=1583, vol=1.826300e+00 or (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD11) or (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD13) assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HA) 2.395 0.717 0.717 weight 1.000 ! spec=c13n...li-6, no=613, id=1584, vol=4.184500e+00 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HG1) 2.531 0.801 0.801 weight 1.000 ! spec=c13n...li-6, no=615, id=1586, vol=3.007600e+00 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HA) 2.562 0.820 0.820 weight 1.000 ! spec=c13n...li-6, no=616, id=1587, vol=2.795200e+00 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HB2) 2.065 0.533 0.533 weight 1.000 ! spec=c13n...li-6, no=618, id=1588, vol=1.017370e+01 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HG1) 2.162 0.584 0.584 weight 1.000 ! spec=c13n...li-6, no=621, id=1591, vol=7.737500e+00 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HG2) 2.174 0.591 0.591 weight 1.000 ! spec=c13n...li-6, no=623, id=1593, vol=7.473800e+00 assign (segid " " and resid 168 and name HD2) (segid " " and resid 168 and name HD1) 2.252 0.634 0.634 weight 1.000 ! spec=c13n...li-6, no=628, id=1597, vol=6.052300e+00 assign (segid " " and resid 168 and name HD1) (segid " " and resid 168 and name HB1) 2.472 0.764 1.764 weight 1.000 ! spec=c13n...li-6, no=630, id=1598, vol=3.459900e+00 assign (segid " " and resid 168 and name HD1) (segid " " and resid 168 and name HG2) 2.811 0.988 0.988 weight 1.000 ! spec=c13n...li-6, no=632, id=1600, vol=1.600500e+00 assign (segid " " and resid 143 and name HA) (segid " " and resid 151 and name HA2) 2.672 0.892 0.892 weight 1.000 ! spec=c13n...li-6, no=635, id=1602, vol=2.171800e+00 assign (segid " " and resid 151 and name HA2) (segid " " and resid 151 and name HA1) 2.029 0.515 0.515 weight 1.000 ! spec=c13n...li-6, no=636, id=1603, vol=1.132810e+01 assign (segid " " and resid 151 and name HA2) (segid " " and resid 120 and name HB1) 2.779 0.965 0.965 weight 1.000 ! spec=c13n...li-6, no=637, id=1604, vol=1.716100e+00 assign (segid " " and resid 151 and name HA2) (segid " " and resid 139 and name HG21) 2.715 0.921 0.921 weight 1.000 ! spec=c13n...li-6, no=638, id=1605, vol=1.973400e+00 assign (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HG21) 2.290 0.656 0.656 weight 1.000 ! spec=c13n...li-6, no=643, id=1609, vol=5.473700e+00 assign (segid " " and resid 151 and name HA1) (segid " " and resid 139 and name HG21) 2.745 0.942 0.942 weight 1.000 ! spec=c13n...li-6, no=644, id=1610, vol=1.847300e+00 assign (segid " " and resid 147 and name HA2) (segid " " and resid 147 and name HA1) 1.947 0.474 0.474 weight 1.000 ! spec=c13n...li-6, no=646, id=1611, vol=1.448050e+01 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HA) 2.505 0.785 0.785 weight 1.000 ! spec=c13n...li-6, no=649, id=1613, vol=3.193900e+00 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HD1) 2.058 0.529 0.529 weight 1.000 ! spec=c13n...li-6, no=651, id=1614, vol=1.039780e+01 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HB1) 2.586 0.836 0.836 weight 1.000 ! spec=c13n...li-6, no=654, id=1616, vol=2.640800e+00 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HB1) 2.626 0.862 0.862 weight 1.000 ! spec=c13n...li-6, no=655, id=1617, vol=2.411300e+00 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HB2) 2.632 0.866 0.866 weight 1.000 ! spec=c13n...li-6, no=656, id=1618, vol=2.377800e+00 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HB2) 2.269 0.644 0.644 weight 1.000 ! spec=c13n...li-6, no=657, id=1619, vol=5.783900e+00 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HG1) 2.562 0.820 0.820 weight 1.000 ! spec=c13n...li-6, no=658, id=1620, vol=2.795400e+00 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HG2) 2.494 0.777 0.777 weight 1.000 ! spec=c13n...li-6, no=659, id=1621, vol=3.283400e+00 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HG1) 2.584 0.835 0.835 weight 1.000 ! spec=c13n...li-6, no=660, id=1622, vol=2.650800e+00 assign (segid " " and resid 109 and name HD2) (segid " " and resid 109 and name HG2) 2.100 0.551 0.551 weight 1.000 ! spec=c13n...li-6, no=661, id=1623, vol=9.220700e+00 assign (segid " " and resid 179 and name HA) (segid " " and resid 179 and name HD2) 2.316 0.670 1.970 weight 1.000 ! spec=c13n...li-6, no=670, id=1627, vol=5.124300e+00 assign (segid " " and resid 179 and name HD2) (segid " " and resid 179 and name HB1) 2.361 0.697 0.697 weight 1.000 ! spec=c13n...li-6, no=673, id=1629, vol=4.562900e+00 assign (segid " " and resid 179 and name HD2) (segid " " and resid 179 and name HG2) 1.926 0.464 0.464 weight 1.000 ! spec=c13n...li-6, no=675, id=1631, vol=1.548280e+01 assign (segid " " and resid 117 and name HD2) (segid " " and resid 182 and name HB2) 5.501 3.782 0.782 weight 1.000 ! spec=c13n...li-6, no=680, id=1635, vol=3.226200e+00 assign (segid " " and resid 117 and name HD2) (segid " " and resid 117 and name HB2) 2.320 0.673 0.673 weight 1.000 ! spec=c13n...li-6, no=681, id=1636, vol=5.066200e+00 assign (segid " " and resid 117 and name HD2) (segid " " and resid 181 and name HD2) 2.044 0.522 1.522 weight 1.000 ! spec=c13n...li-6, no=684, id=1639, vol=1.084760e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HG) 2.531 0.801 0.801 weight 1.000 ! spec=c13n...li-6, no=686, id=1641, vol=3.005700e+00 assign (segid " " and resid 110 and name HB1) (segid " " and resid 110 and name HD11) 2.542 0.808 0.808 weight 1.000 ! spec=c13n...li-6, no=688, id=1642, vol=2.930100e+00 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HD21) 2.628 0.863 0.863 weight 1.000 ! spec=c13n...li-6, no=689, id=1643, vol=2.398800e+00 assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD21) 2.471 0.763 0.763 weight 1.000 ! spec=c13n...li-6, no=693, id=1646, vol=3.473500e+00 assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HD21) 2.527 0.798 0.798 weight 1.000 ! spec=c13n...li-6, no=694, id=1647, vol=3.034300e+00 assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HD11) 2.358 0.695 0.695 weight 1.000 ! spec=c13n...li-6, no=695, id=1648, vol=4.597800e+00 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HE2) 1.740 0.379 0.379 weight 1.000 ! spec=c13n...li-6, no=706, id=1658, vol=2.844150e+01 assign (segid " " and resid 177 and name HE2) (segid " " and resid 176 and name HG2) 2.872 1.031 1.031 weight 1.000 ! spec=c13n...li-6, no=710, id=1660, vol=1.406600e+00 assign (segid " " and resid 177 and name HE1) (segid " " and resid 176 and name HG2) 2.019 0.510 0.510 weight 1.000 ! spec=c13n...li-6, no=711, id=1661, vol=1.166170e+01 assign (segid " " and resid 177 and name HE1) (segid " " and resid 176 and name HG1) 2.045 0.523 0.523 weight 1.000 ! spec=c13n...li-6, no=712, id=1662, vol=1.080120e+01 assign (segid " " and resid 169 and name HE2) (segid " " and resid 168 and name HD1) 4.330 2.679 0.679 weight 1.000 ! spec=c13n...li-6, no=716, id=1666, vol=4.934600e+00 assign (segid " " and resid 177 and name HE2) (segid " " and resid 177 and name HB2) 2.593 0.840 0.840 weight 1.000 ! spec=c13n...li-6, no=717, id=1667, vol=2.599500e+00 assign (segid " " and resid 177 and name HE1) (segid " " and resid 177 and name HB2) 4.054 2.528 0.528 weight 1.000 ! spec=c13n...li-6, no=719, id=1669, vol=1.050700e+01 assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HD2) 2.061 0.531 0.531 weight 1.000 ! spec=c13n...li-6, no=720, id=1670, vol=1.031580e+01 assign (segid " " and resid 177 and name HE2) (segid " " and resid 177 and name HG1) 2.764 0.955 0.955 weight 1.000 ! spec=c13n...li-6, no=722, id=1672, vol=1.772200e+00 assign (segid " " and resid 169 and name HE2) (segid " " and resid 169 and name HG2) 2.841 1.424 1.424 weight 1.000 ! spec=c13n...li-6, no=725, id=1673, vol=2.030260e+01 assign (segid " " and resid 95 and name HE2) (segid " " and resid 95 and name HG2) 1.930 0.466 0.466 weight 1.000 ! spec=c13n...li-6, no=726, id=1674, vol=1.529530e+01 assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HG1) 2.622 0.859 0.859 weight 1.000 ! spec=c13n...li-6, no=728, id=1676, vol=2.433100e+00 assign (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HB2) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-6, no=730, id=1678, vol=1.788200e+00 assign (segid " " and resid 175 and name HB2) (segid " " and resid 183 and name HA) 2.693 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=731, id=1679, vol=2.072100e+00 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD21) 2.822 0.995 0.995 weight 1.000 ! spec=c13n...li-6, no=740, id=1686, vol=1.564100e+00 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HD21) 2.522 0.795 0.795 weight 1.000 ! spec=c13n...li-6, no=741, id=1687, vol=3.067000e+00 assign (segid " " and resid 100 and name HB1) (segid " " and resid 100 and name HA) 2.721 0.925 0.925 weight 1.000 ! spec=c13n...li-6, no=742, id=1688, vol=1.947600e+00 assign (segid " " and resid 100 and name HB2) (segid " " and resid 100 and name HD11) 2.494 0.777 0.777 weight 1.000 ! spec=c13n...li-6, no=747, id=1690, vol=3.285000e+00 assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HA) 2.515 0.791 0.791 weight 1.000 ! spec=c13n...li-6, no=749, id=1692, vol=3.123300e+00 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HB1) 2.561 0.820 0.820 weight 1.000 ! spec=c13n...li-6, no=751, id=1694, vol=2.799500e+00 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HB1) 2.231 0.622 0.622 weight 1.000 ! spec=c13n...li-6, no=752, id=1695, vol=6.413100e+00 assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD11) 2.462 0.758 0.758 weight 1.000 ! spec=c13n...li-6, no=758, id=1697, vol=3.548700e+00 assign (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HD11) 2.427 0.736 0.736 weight 1.000 ! spec=c13n...li-6, no=759, id=1698, vol=3.867800e+00 assign (segid " " and resid 175 and name HB1) (segid " " and resid 175 and name HD11) 2.719 0.924 0.924 weight 1.000 ! spec=c13n...li-6, no=760, id=1699, vol=1.953700e+00 assign (segid " " and resid 127 and name HB2) (segid " " and resid 127 and name HD21) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-6, no=762, id=1701, vol=4.736500e+00 assign (segid " " and resid 127 and name HB1) (segid " " and resid 127 and name HD21) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-6, no=763, id=1702, vol=5.370600e+00 assign (segid " " and resid 185 and name HB2) (segid " " and resid 185 and name HB1) 2.258 0.637 0.637 weight 1.000 ! spec=c13n...li-6, no=766, id=1705, vol=5.955000e+00 assign (segid " " and resid 163 and name HB2) (segid " " and resid 163 and name HA) 2.326 0.676 0.676 weight 1.000 ! spec=c13n...li-6, no=770, id=1708, vol=4.993900e+00 assign (segid " " and resid 169 and name HE2) (segid " " and resid 165 and name HA) 2.561 0.820 0.820 weight 1.000 ! spec=c13n...li-6, no=771, id=1709, vol=2.800600e+00 assign (segid " " and resid 127 and name HA) (segid " " and resid 126 and name HB1) 4.700 2.911 0.911 weight 1.000 ! spec=c13n...li-6, no=775, id=1713, vol=2.037800e+00 assign (segid " " and resid 122 and name HA) (segid " " and resid 122 and name HB2) 2.362 0.697 0.697 weight 1.000 ! spec=c13n...li-6, no=777, id=1715, vol=4.553900e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HA) 2.661 0.885 0.885 weight 1.000 ! spec=c13n...li-6, no=778, id=1716, vol=2.226400e+00 assign (segid " " and resid 163 and name HB2) (segid " " and resid 163 and name HB1) 1.883 0.443 0.443 weight 1.000 ! spec=c13n...li-6, no=780, id=1718, vol=1.771130e+01 assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HE1) 1.802 0.406 0.406 weight 1.000 ! spec=c13n...li-6, no=785, id=1721, vol=2.308600e+01 assign (segid " " and resid 122 and name HB2) (segid " " and resid 178 and name HB2) 2.780 0.966 0.966 weight 1.000 ! spec=c13n...li-6, no=790, id=1724, vol=1.711600e+00 assign (segid " " and resid 154 and name HE2) (segid " " and resid 138 and name HB2) 2.565 0.822 0.822 weight 1.000 ! spec=c13n...li-6, no=791, id=1725, vol=2.772800e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 157 and name HG1) 3.602 3.846 0.846 weight 1.000 ! spec=c13n...li-6, no=792, id=1726, vol=2.544800e+00 assign (segid " " and resid 126 and name HB1) (segid " " and resid 170 and name HB2) 2.607 0.850 0.850 weight 1.000 ! spec=c13n...li-6, no=793, id=1727, vol=2.515900e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HB2) 2.429 0.738 0.738 weight 1.000 ! spec=c13n...li-6, no=794, id=1728, vol=3.844900e+00 assign (segid " " and resid 154 and name HE2) (segid " " and resid 154 and name HD1) 2.716 0.922 0.922 weight 1.000 ! spec=c13n...li-6, no=796, id=1730, vol=1.970000e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HD1) 2.456 0.754 0.754 weight 1.000 ! spec=c13n...li-6, no=797, id=1731, vol=3.598900e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 154 and name HG1) 2.606 0.849 0.849 weight 1.000 ! spec=c13n...li-6, no=799, id=1733, vol=2.523500e+00 assign (segid " " and resid 154 and name HE1) (segid " " and resid 139 and name HD11) 2.553 0.815 0.815 weight 1.000 ! spec=c13n...li-6, no=800, id=1734, vol=2.851100e+00 assign (segid " " and resid 154 and name HE2) (segid " " and resid 139 and name HD12) 2.534 0.803 0.803 weight 1.000 ! spec=c13n...li-6, no=801, id=1735, vol=2.983300e+00 or (segid " " and resid 154 and name HE2) (segid " " and resid 139 and name HD11) or (segid " " and resid 154 and name HE2) (segid " " and resid 139 and name HD13) assign (segid " " and resid 122 and name HB2) (segid " " and resid 123 and name HG21) 2.552 0.814 0.814 weight 1.000 ! spec=c13n...li-6, no=802, id=1736, vol=2.860500e+00 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HA) 2.695 0.908 0.908 weight 1.000 ! spec=c13n...li-6, no=804, id=1737, vol=2.060000e+00 assign (segid " " and resid 152 and name HA) (segid " " and resid 155 and name HB2) 2.483 0.770 0.770 weight 1.000 ! spec=c13n...li-6, no=805, id=1738, vol=3.374400e+00 assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HB1) 2.398 0.719 0.719 weight 1.000 ! spec=c13n...li-6, no=812, id=1741, vol=4.157900e+00 assign (segid " " and resid 107 and name HB1) (segid " " and resid 107 and name HG) 2.712 0.920 0.920 weight 1.000 ! spec=c13n...li-6, no=813, id=1742, vol=1.983900e+00 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HG) 2.783 0.968 0.968 weight 1.000 ! spec=c13n...li-6, no=814, id=1743, vol=1.702000e+00 assign (segid " " and resid 107 and name HB1) (segid " " and resid 160 and name HD11) 2.780 0.966 0.966 weight 1.000 ! spec=c13n...li-6, no=816, id=1745, vol=1.711400e+00 assign (segid " " and resid 105 and name HA) (segid " " and resid 105 and name HB2) 2.361 0.697 0.697 weight 1.000 ! spec=c13n...li-6, no=821, id=1750, vol=4.557600e+00 assign (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HB2) 2.755 0.949 0.949 weight 1.000 ! spec=c13n...li-6, no=823, id=1752, vol=1.805900e+00 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HB1) 2.434 0.740 0.740 weight 1.000 ! spec=c13n...li-6, no=824, id=1753, vol=3.803000e+00 assign (segid " " and resid 173 and name HB2) (segid " " and resid 173 and name HB1) 1.862 0.433 0.433 weight 1.000 ! spec=c13n...li-6, no=831, id=1754, vol=1.895680e+01 assign (segid " " and resid 105 and name HB2) (segid " " and resid 108 and name HB2) 5.540 3.806 0.806 weight 1.000 ! spec=c13n...li-6, no=832, id=1755, vol=2.942200e+00 assign (segid " " and resid 123 and name HB) (segid " " and resid 174 and name HB1) 2.647 0.876 0.876 weight 1.000 ! spec=c13n...li-6, no=833, id=1756, vol=2.297400e+00 assign (segid " " and resid 160 and name HB2) (segid " " and resid 160 and name HB1) 2.170 0.588 0.588 weight 1.000 ! spec=c13n...li-6, no=834, id=1757, vol=7.574100e+00 assign (segid " " and resid 173 and name HB2) (segid " " and resid 173 and name HD11) 2.053 0.527 0.527 weight 1.000 ! spec=c13n...li-6, no=837, id=1760, vol=1.055270e+01 assign (segid " " and resid 160 and name HB2) (segid " " and resid 160 and name HD11) 2.674 0.894 0.894 weight 1.000 ! spec=c13n...li-6, no=838, id=1761, vol=2.159900e+00 assign (segid " " and resid 160 and name HB2) (segid " " and resid 160 and name HD21) 2.506 0.785 0.785 weight 1.000 ! spec=c13n...li-6, no=840, id=1763, vol=3.187600e+00 assign (segid " " and resid 123 and name HB) (segid " " and resid 123 and name HG21) 2.246 0.630 0.630 weight 1.000 ! spec=c13n...li-6, no=841, id=1764, vol=6.159800e+00 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HD11) 2.752 0.947 0.947 weight 1.000 ! spec=c13n...li-6, no=842, id=1765, vol=1.817000e+00 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HB1) 2.329 0.678 0.678 weight 1.000 ! spec=c13n...li-6, no=849, id=1772, vol=4.948100e+00 assign (segid " " and resid 105 and name HB1) (segid " " and resid 105 and name HB2) 1.792 0.401 0.401 weight 1.000 ! spec=c13n...li-6, no=850, id=1773, vol=2.388620e+01 assign (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HB1) 2.021 0.511 0.511 weight 1.000 ! spec=c13n...li-6, no=852, id=1775, vol=1.158880e+01 assign (segid " " and resid 140 and name HG) (segid " " and resid 140 and name HB1) 2.330 0.679 0.679 weight 1.000 ! spec=c13n...li-6, no=853, id=1776, vol=4.931600e+00 assign (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HG) 2.799 0.980 0.980 weight 1.000 ! spec=c13n...li-6, no=857, id=1777, vol=1.641600e+00 assign (segid " " and resid 160 and name HB1) (segid " " and resid 160 and name HD11) 2.606 0.849 0.849 weight 1.000 ! spec=c13n...li-6, no=858, id=1778, vol=2.522100e+00 assign (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HD11) 2.726 0.929 0.929 weight 1.000 ! spec=c13n...li-6, no=861, id=1781, vol=1.923000e+00 assign (segid " " and resid 155 and name HB1) (segid " " and resid 155 and name HG) 2.518 0.792 0.792 weight 1.000 ! spec=c13n...li-6, no=864, id=1784, vol=3.101700e+00 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HD1) 2.519 0.793 0.793 weight 1.000 ! spec=c13n...li-6, no=867, id=1787, vol=3.094400e+00 assign (segid " " and resid 114 and name HB2) (segid " " and resid 115 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-6, no=868, id=1788, vol=2.092800e+00 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HA) 2.415 0.729 0.729 weight 1.000 ! spec=c13n...li-6, no=871, id=1790, vol=3.977000e+00 assign (segid " " and resid 114 and name HB1) (segid " " and resid 114 and name HD1) 2.609 0.851 0.851 weight 1.000 ! spec=c13n...li-6, no=880, id=1793, vol=2.506900e+00 assign (segid " " and resid 114 and name HB2) (segid " " and resid 114 and name HB1) 2.325 0.676 0.676 weight 1.000 ! spec=c13n...li-6, no=882, id=1795, vol=4.995800e+00 assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HG21) 2.154 0.580 0.580 weight 1.000 ! spec=c13n...li-6, no=887, id=1798, vol=7.907200e+00 assign (segid " " and resid 182 and name HB2) (segid " " and resid 182 and name HD1) 2.434 0.741 0.741 weight 1.000 ! spec=c13n...li-6, no=890, id=1800, vol=3.799500e+00 assign (segid " " and resid 182 and name HB1) (segid " " and resid 182 and name HB2) 2.336 0.682 0.682 weight 1.000 ! spec=c13n...li-6, no=894, id=1801, vol=4.856800e+00 assign (segid " " and resid 182 and name HB1) (segid " " and resid 182 and name HD1) 2.690 0.905 0.905 weight 1.000 ! spec=c13n...li-6, no=895, id=1802, vol=2.083600e+00 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HD21) 2.557 0.817 0.817 weight 1.000 ! spec=c13n...li-6, no=902, id=1807, vol=2.825200e+00 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HB1) 2.545 0.810 0.810 weight 1.000 ! spec=c13n...li-6, no=903, id=1808, vol=2.904900e+00 assign (segid " " and resid 103 and name HB2) (segid " " and resid 103 and name HD1) 2.603 0.847 0.847 weight 1.000 ! spec=c13n...li-6, no=904, id=1809, vol=2.538700e+00 assign (segid " " and resid 133 and name HA) (segid " " and resid 133 and name HB2) 2.267 0.642 0.642 weight 1.000 ! spec=c13n...li-6, no=908, id=1813, vol=5.819600e+00 assign (segid " " and resid 103 and name HB2) (segid " " and resid 103 and name HB1) 2.416 0.729 0.729 weight 1.000 ! spec=c13n...li-6, no=917, id=1817, vol=3.975100e+00 assign (segid " " and resid 133 and name HB2) (segid " " and resid 132 and name HB) 5.785 3.969 0.969 weight 1.000 ! spec=c13n...li-6, no=920, id=1819, vol=1.694600e+00 assign (segid " " and resid 103 and name HB1) (segid " " and resid 103 and name HD1) 2.593 0.841 0.841 weight 1.000 ! spec=c13n...li-6, no=921, id=1820, vol=2.596100e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HB1) 2.672 0.893 0.893 weight 1.000 ! spec=c13n...li-6, no=922, id=1821, vol=2.168700e+00 assign (segid " " and resid 133 and name HB1) (segid " " and resid 134 and name HG2) 2.842 1.010 1.010 weight 1.000 ! spec=c13n...li-6, no=928, id=1824, vol=1.499100e+00 assign (segid " " and resid 153 and name HG1) (segid " " and resid 153 and name HG2) 1.824 0.416 0.416 weight 1.000 ! spec=c13n...li-6, no=934, id=1828, vol=2.142890e+01 assign (segid " " and resid 135 and name HG2) (segid " " and resid 135 and name HB1) 2.258 0.637 0.637 weight 1.000 ! spec=c13n...li-6, no=935, id=1829, vol=5.963000e+00 assign (segid " " and resid 153 and name HG2) (segid " " and resid 115 and name HB2) 2.477 0.767 0.767 weight 1.000 ! spec=c13n...li-6, no=936, id=1830, vol=3.418300e+00 assign (segid " " and resid 151 and name HA1) (segid " " and resid 142 and name HB) 2.720 0.925 0.925 weight 1.000 ! spec=c13n...li-6, no=939, id=1833, vol=1.951400e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 142 and name HB) 2.663 0.886 0.886 weight 1.000 ! spec=c13n...li-6, no=940, id=1834, vol=2.216100e+00 assign (segid " " and resid 97 and name HB) (segid " " and resid 101 and name HG2) 2.789 0.972 0.972 weight 1.000 ! spec=c13n...li-6, no=941, id=1835, vol=1.678500e+00 assign (segid " " and resid 97 and name HB) (segid " " and resid 97 and name HG12) 2.305 0.664 0.664 weight 1.000 ! spec=c13n...li-6, no=945, id=1837, vol=5.268500e+00 assign (segid " " and resid 124 and name HB) (segid " " and resid 124 and name HG12) 2.433 0.740 0.740 weight 1.000 ! spec=c13n...li-6, no=947, id=1839, vol=3.806600e+00 assign (segid " " and resid 142 and name HB) (segid " " and resid 142 and name HG12) 2.458 0.755 0.755 weight 1.000 ! spec=c13n...li-6, no=948, id=1840, vol=3.584000e+00 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HA) 2.642 0.872 0.872 weight 1.000 ! spec=c13n...li-6, no=951, id=1843, vol=2.324100e+00 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG12) 2.471 0.763 0.763 weight 1.000 ! spec=c13n...li-6, no=954, id=1845, vol=3.473600e+00 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HG11) 2.551 0.814 0.814 weight 1.000 ! spec=c13n...li-6, no=955, id=1846, vol=2.865300e+00 assign (segid " " and resid 113 and name HG2) (segid " " and resid 113 and name HA) 2.551 0.814 0.814 weight 1.000 ! spec=c13n...li-6, no=957, id=1848, vol=2.864400e+00 assign (segid " " and resid 176 and name HA) (segid " " and resid 176 and name HG2) 2.710 0.918 0.918 weight 1.000 ! spec=c13n...li-6, no=958, id=1849, vol=1.996000e+00 assign (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HG1) 1.933 0.467 0.467 weight 1.000 ! spec=c13n...li-6, no=961, id=1850, vol=1.512770e+01 assign (segid " " and resid 113 and name HG2) (segid " " and resid 113 and name HG1) 1.945 0.473 0.473 weight 1.000 ! spec=c13n...li-6, no=962, id=1851, vol=1.458970e+01 assign (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HB2) 2.165 0.586 0.586 weight 1.000 ! spec=c13n...li-6, no=963, id=1852, vol=7.679800e+00 assign (segid " " and resid 176 and name HG2) (segid " " and resid 176 and name HB1) 2.322 0.674 0.674 weight 1.000 ! spec=c13n...li-6, no=964, id=1853, vol=5.036500e+00 assign (segid " " and resid 176 and name HG2) (segid " " and resid 177 and name HB2) 2.709 0.918 0.918 weight 1.000 ! spec=c13n...li-6, no=965, id=1854, vol=1.997100e+00 assign (segid " " and resid 113 and name HG2) (segid " " and resid 185 and name HD11) 2.527 0.798 1.798 weight 1.000 ! spec=c13n...li-6, no=966, id=1855, vol=3.036300e+00 assign (segid " " and resid 129 and name HA) (segid " " and resid 129 and name HB2) 2.580 0.832 0.832 weight 1.000 ! spec=c13n...li-6, no=968, id=1857, vol=2.676500e+00 assign (segid " " and resid 98 and name HG2) (segid " " and resid 102 and name HG1) 4.047 2.524 0.524 weight 1.000 ! spec=c13n...li-6, no=984, id=1869, vol=1.074670e+01 assign (segid " " and resid 176 and name HG1) (segid " " and resid 177 and name HD2) 3.497 1.779 0.779 weight 1.000 ! spec=c13n...li-6, no=986, id=1871, vol=3.261400e+00 assign (segid " " and resid 157 and name HG1) (segid " " and resid 158 and name HB1) 2.796 0.978 0.978 weight 1.000 ! spec=c13n...li-6, no=988, id=1872, vol=1.651800e+00 assign (segid " " and resid 102 and name HG2) (segid " " and resid 105 and name HD11) 5.269 3.643 0.643 weight 1.000 ! spec=c13n...li-6, no=992, id=1874, vol=5.792100e+00 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HG12) 2.826 0.998 0.998 weight 1.000 ! spec=c13n...li-6, no=995, id=1876, vol=1.550300e+00 assign (segid " " and resid 170 and name HG2) (segid " " and resid 167 and name HA) 2.773 0.962 0.962 weight 1.000 ! spec=c13n...li-6, no=999, id=1879, vol=1.735600e+00 assign (segid " " and resid 138 and name HA) (segid " " and resid 138 and name HG2) 2.435 0.741 0.741 weight 1.000 ! spec=c13n...li-6, no=1001, id=1881, vol=3.786600e+00 assign (segid " " and resid 170 and name HG2) (segid " " and resid 170 and name HA) 3.294 0.658 0.658 weight 1.000 ! spec=c13n...li-6, no=1002, id=1882, vol=5.415000e+00 assign (segid " " and resid 170 and name HG1) (segid " " and resid 168 and name HA) 3.238 1.311 1.311 weight 1.000 ! spec=c13n...li-6, no=1003, id=1883, vol=6.851000e-01 assign (segid " " and resid 184 and name HA) (segid " " and resid 184 and name HG2) 2.170 0.588 0.588 weight 1.000 ! spec=c13n...li-6, no=1007, id=1887, vol=7.572100e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG2) 2.614 0.854 0.854 weight 1.000 ! spec=c13n...li-6, no=1008, id=1888, vol=2.476100e+00 assign (segid " " and resid 170 and name HG2) (segid " " and resid 130 and name HB2) 4.449 0.750 0.750 weight 1.000 ! spec=c13n...li-6, no=1009, id=1889, vol=3.660700e+00 assign (segid " " and resid 157 and name HG2) (segid " " and resid 157 and name HG1) 1.673 0.350 0.350 weight 1.000 ! spec=c13n...li-6, no=1014, id=1893, vol=3.601620e+01 assign (segid " " and resid 113 and name HG1) (segid " " and resid 185 and name HD11) 5.539 0.806 0.806 weight 1.000 ! spec=c13n...li-6, no=1018, id=1896, vol=2.951200e+00 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HG2) 2.582 0.834 0.834 weight 1.000 ! spec=c13n...li-6, no=1020, id=1898, vol=2.663600e+00 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HG1) 2.547 0.811 0.811 weight 1.000 ! spec=c13n...li-6, no=1021, id=1899, vol=2.890400e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 157 and name HG1) 2.672 0.892 0.892 weight 1.000 ! spec=c13n...li-6, no=1022, id=1900, vol=2.170800e+00 assign (segid " " and resid 102 and name HG2) (segid " " and resid 98 and name HG2) 2.420 0.732 0.732 weight 1.000 ! spec=c13n...li-6, no=1024, id=1902, vol=3.936900e+00 assign (segid " " and resid 157 and name HG1) (segid " " and resid 157 and name HB2) 2.451 0.751 0.751 weight 1.000 ! spec=c13n...li-6, no=1025, id=1903, vol=3.645000e+00 assign (segid " " and resid 102 and name HG1) (segid " " and resid 101 and name HB2) 4.490 2.775 0.775 weight 1.000 ! spec=c13n...li-6, no=1026, id=1904, vol=3.312700e+00 assign (segid " " and resid 102 and name HG1) (segid " " and resid 102 and name HG2) 1.786 0.399 0.399 weight 1.000 ! spec=c13n...li-6, no=1030, id=1906, vol=2.435150e+01 assign (segid " " and resid 102 and name HG2) (segid " " and resid 102 and name HB1) 2.275 0.647 0.647 weight 1.000 ! spec=c13n...li-6, no=1032, id=1907, vol=5.691100e+00 assign (segid " " and resid 178 and name HG2) (segid " " and resid 178 and name HB2) 2.364 0.698 0.698 weight 1.000 ! spec=c13n...li-6, no=1036, id=1910, vol=4.530800e+00 assign (segid " " and resid 178 and name HG1) (segid " " and resid 178 and name HB1) 2.677 0.896 0.896 weight 1.000 ! spec=c13n...li-6, no=1039, id=1913, vol=2.147400e+00 assign (segid " " and resid 178 and name HG2) (segid " " and resid 178 and name HB1) 2.645 0.875 0.875 weight 1.000 ! spec=c13n...li-6, no=1040, id=1914, vol=2.305600e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 146 and name HB2) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-6, no=1046, id=1920, vol=4.742600e+00 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HB1) 2.025 0.512 0.512 weight 1.000 ! spec=c13n...li-6, no=1050, id=1922, vol=1.146840e+01 assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HD1) 2.521 0.794 0.794 weight 1.000 ! spec=c13n...li-6, no=1054, id=1924, vol=3.079100e+00 assign (segid " " and resid 146 and name HB2) (segid " " and resid 146 and name HG2) 2.540 0.806 0.806 weight 1.000 ! spec=c13n...li-6, no=1055, id=1925, vol=2.944300e+00 assign (segid " " and resid 146 and name HB1) (segid " " and resid 146 and name HG2) 2.655 0.881 0.881 weight 1.000 ! spec=c13n...li-6, no=1056, id=1926, vol=2.254500e+00 assign (segid " " and resid 146 and name HB2) (segid " " and resid 142 and name HG21) 2.691 0.905 0.905 weight 1.000 ! spec=c13n...li-6, no=1059, id=1929, vol=2.081500e+00 assign (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG21) 2.500 0.781 0.781 weight 1.000 ! spec=c13n...li-6, no=1060, id=1930, vol=3.236000e+00 assign (segid " " and resid 148 and name HA) (segid " " and resid 148 and name HG2) 2.746 0.942 0.942 weight 1.000 ! spec=c13n...li-6, no=1061, id=1931, vol=1.843100e+00 assign (segid " " and resid 148 and name HG2) (segid " " and resid 149 and name HG1) 4.749 2.944 0.944 weight 1.000 ! spec=c13n...li-6, no=1064, id=1932, vol=1.831200e+00 assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB2) 2.605 0.848 0.848 weight 1.000 ! spec=c13n...li-6, no=1065, id=1933, vol=2.528600e+00 assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HB2) 2.467 0.761 0.761 weight 1.000 ! spec=c13n...li-6, no=1066, id=1934, vol=3.505800e+00 assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HE2) 2.353 0.692 0.692 weight 1.000 ! spec=c13n...li-6, no=1067, id=1935, vol=4.650100e+00 or (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HE1) or (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HE3) assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HE1) 2.534 0.803 0.803 weight 1.000 ! spec=c13n...li-6, no=1068, id=1936, vol=2.983900e+00 assign (segid " " and resid 148 and name HG2) (segid " " and resid 148 and name HB1) 2.389 0.713 0.713 weight 1.000 ! spec=c13n...li-6, no=1069, id=1937, vol=4.250100e+00 assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HB1) 2.577 0.830 0.830 weight 1.000 ! spec=c13n...li-6, no=1070, id=1938, vol=2.697500e+00 assign (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HG21) 5.670 3.891 0.891 weight 1.000 ! spec=c13n...li-6, no=1072, id=1940, vol=2.180300e+00 assign (segid " " and resid 148 and name HG2) (segid " " and resid 119 and name HD11) 2.842 1.010 1.010 weight 1.000 ! spec=c13n...li-6, no=1073, id=1941, vol=1.498000e+00 assign (segid " " and resid 134 and name HG2) (segid " " and resid 134 and name HA) 2.124 0.564 0.564 weight 1.000 ! spec=c13n...li-6, no=1074, id=1942, vol=8.603600e+00 assign (segid " " and resid 134 and name HG2) (segid " " and resid 133 and name HB2) 4.677 2.896 0.896 weight 1.000 ! spec=c13n...li-6, no=1076, id=1944, vol=2.145400e+00 assign (segid " " and resid 141 and name HG2) (segid " " and resid 141 and name HB2) 1.881 0.442 0.442 weight 1.000 ! spec=c13n...li-6, no=1086, id=1949, vol=1.780990e+01 assign (segid " " and resid 134 and name HG2) (segid " " and resid 134 and name HB2) 1.922 0.462 0.462 weight 1.000 ! spec=c13n...li-6, no=1087, id=1950, vol=1.568790e+01 assign (segid " " and resid 141 and name HG2) (segid " " and resid 145 and name HG21) 2.660 0.885 0.885 weight 1.000 ! spec=c13n...li-6, no=1089, id=1952, vol=2.229400e+00 assign (segid " " and resid 141 and name HG1) (segid " " and resid 145 and name HG21) 2.587 0.837 0.837 weight 1.000 ! spec=c13n...li-6, no=1090, id=1953, vol=2.632600e+00 assign (segid " " and resid 141 and name HG1) (segid " " and resid 142 and name HD11) 2.831 1.002 1.002 weight 1.000 ! spec=c13n...li-6, no=1091, id=1954, vol=1.533800e+00 assign (segid " " and resid 190 and name HB2) (segid " " and resid 190 and name HG2) 2.647 0.876 0.876 weight 1.000 ! spec=c13n...li-6, no=1094, id=1956, vol=2.294000e+00 assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HB) 2.738 0.937 0.937 weight 1.000 ! spec=c13n...li-6, no=1096, id=1958, vol=1.874700e+00 assign (segid " " and resid 190 and name HD2) (segid " " and resid 189 and name HB2) 3.284 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1097, id=1959, vol=5.559200e+00 assign (segid " " and resid 94 and name HG1) (segid " " and resid 94 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-6, no=1103, id=1964, vol=2.093500e+00 assign (segid " " and resid 172 and name HA) (segid " " and resid 172 and name HB2) 2.847 1.013 1.013 weight 1.000 ! spec=c13n...li-6, no=1104, id=1965, vol=1.483200e+00 assign (segid " " and resid 149 and name HG2) (segid " " and resid 149 and name HB2) 2.341 0.685 0.685 weight 1.000 ! spec=c13n...li-6, no=1116, id=1973, vol=4.802000e+00 assign (segid " " and resid 149 and name HG1) (segid " " and resid 149 and name HB2) 2.274 0.647 0.647 weight 1.000 ! spec=c13n...li-6, no=1117, id=1974, vol=5.707200e+00 assign (segid " " and resid 172 and name HB2) (segid " " and resid 172 and name HD2) 2.659 0.884 0.884 weight 1.000 ! spec=c13n...li-6, no=1119, id=1976, vol=2.235300e+00 assign (segid " " and resid 94 and name HB2) (segid " " and resid 94 and name HA) 2.620 0.858 0.858 weight 1.000 ! spec=c13n...li-6, no=1129, id=1984, vol=2.443700e+00 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HB2) 2.065 0.533 0.533 weight 1.000 ! spec=c13n...li-6, no=1131, id=1986, vol=1.017410e+01 assign (segid " " and resid 99 and name HA) (segid " " and resid 99 and name HB2) 2.054 0.527 0.527 weight 1.000 ! spec=c13n...li-6, no=1134, id=1989, vol=1.053190e+01 assign (segid " " and resid 181 and name HA) (segid " " and resid 181 and name HB2) 2.317 0.671 0.671 weight 1.000 ! spec=c13n...li-6, no=1135, id=1990, vol=5.106900e+00 assign (segid " " and resid 108 and name HB2) (segid " " and resid 105 and name HA) 4.049 2.525 0.525 weight 1.000 ! spec=c13n...li-6, no=1136, id=1991, vol=1.066090e+01 assign (segid " " and resid 169 and name HB1) (segid " " and resid 169 and name HA) 2.338 0.683 0.683 weight 1.000 ! spec=c13n...li-6, no=1137, id=1992, vol=4.839800e+00 assign (segid " " and resid 96 and name HB2) (segid " " and resid 96 and name HE2) 2.642 0.872 0.872 weight 1.000 ! spec=c13n...li-6, no=1146, id=2001, vol=2.323600e+00 assign (segid " " and resid 172 and name HB1) (segid " " and resid 172 and name HB2) 2.379 0.708 0.708 weight 1.000 ! spec=c13n...li-6, no=1150, id=2005, vol=4.355500e+00 assign (segid " " and resid 94 and name HG2) (segid " " and resid 94 and name HB2) 2.653 0.880 0.880 weight 1.000 ! spec=c13n...li-6, no=1151, id=2006, vol=2.263600e+00 assign (segid " " and resid 149 and name HB2) (segid " " and resid 149 and name HB1) 1.980 0.490 0.490 weight 1.000 ! spec=c13n...li-6, no=1154, id=2008, vol=1.309990e+01 assign (segid " " and resid 148 and name HB2) (segid " " and resid 148 and name HB1) 2.237 0.626 0.626 weight 1.000 ! spec=c13n...li-6, no=1155, id=2009, vol=6.298700e+00 assign (segid " " and resid 115 and name HB1) (segid " " and resid 115 and name HB2) 1.876 0.440 0.440 weight 1.000 ! spec=c13n...li-6, no=1161, id=2012, vol=1.810770e+01 assign (segid " " and resid 117 and name HG2) (segid " " and resid 117 and name HG1) 1.987 0.493 0.493 weight 1.000 ! spec=c13n...li-6, no=1163, id=2013, vol=1.285160e+01 assign (segid " " and resid 117 and name HB2) (segid " " and resid 117 and name HB1) 2.284 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1164, id=2014, vol=5.567200e+00 assign (segid " " and resid 169 and name HB1) (segid " " and resid 169 and name HG2) 1.935 0.468 0.468 weight 1.000 ! spec=c13n...li-6, no=1167, id=2017, vol=1.506370e+01 assign (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG22) 2.603 0.847 1.847 weight 1.000 ! spec=c13n...li-6, no=1173, id=2022, vol=2.541700e+00 or (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG23) assign (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD22) 2.599 0.844 0.844 weight 1.000 ! spec=c13n...li-6, no=1174, id=2023, vol=2.564700e+00 or (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD21) or (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD23) or (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD12) or (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD11) or (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD13) assign (segid " " and resid 120 and name HB2) (segid " " and resid 155 and name HD11) 5.409 0.726 0.726 weight 1.000 ! spec=c13n...li-6, no=1175, id=2024, vol=4.039700e+00 assign (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG22) 2.480 0.769 0.769 weight 1.000 ! spec=c13n...li-6, no=1176, id=2025, vol=3.397000e+00 or (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HB1) (segid " " and resid 119 and name HG23) assign (segid " " and resid 120 and name HB2) (segid " " and resid 139 and name HG22) 2.567 0.824 0.824 weight 1.000 ! spec=c13n...li-6, no=1178, id=2027, vol=2.757700e+00 or (segid " " and resid 120 and name HB2) (segid " " and resid 139 and name HG21) or (segid " " and resid 120 and name HB2) (segid " " and resid 139 and name HG23) assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HB1) 2.747 0.943 0.943 weight 1.000 ! spec=c13n...li-6, no=1180, id=2028, vol=1.837900e+00 assign (segid " " and resid 117 and name HB1) (segid " " and resid 117 and name HG2) 2.746 0.943 0.943 weight 1.000 ! spec=c13n...li-6, no=1182, id=2030, vol=1.840400e+00 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HB1) 2.611 0.852 0.852 weight 1.000 ! spec=c13n...li-6, no=1183, id=2031, vol=2.491700e+00 assign (segid " " and resid 164 and name HA) (segid " " and resid 164 and name HB2) 2.556 0.817 0.817 weight 1.000 ! spec=c13n...li-6, no=1184, id=2032, vol=2.830000e+00 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HG2) 2.198 0.604 0.604 weight 1.000 ! spec=c13n...li-6, no=1188, id=2035, vol=7.012100e+00 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HG1) 2.243 0.629 0.629 weight 1.000 ! spec=c13n...li-6, no=1190, id=2036, vol=6.199200e+00 assign (segid " " and resid 112 and name HB2) (segid " " and resid 112 and name HB1) 2.063 0.532 0.532 weight 1.000 ! spec=c13n...li-6, no=1191, id=2037, vol=1.025400e+01 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HD2) 2.608 0.850 0.850 weight 1.000 ! spec=c13n...li-6, no=1192, id=2038, vol=2.510000e+00 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG2) 2.568 0.825 0.825 weight 1.000 ! spec=c13n...li-6, no=1193, id=2039, vol=2.752300e+00 assign (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HG2) 2.552 0.814 0.814 weight 1.000 ! spec=c13n...li-6, no=1194, id=2040, vol=2.856400e+00 assign (segid " " and resid 164 and name HB2) (segid " " and resid 164 and name HG1) 2.583 0.834 0.834 weight 1.000 ! spec=c13n...li-6, no=1195, id=2041, vol=2.661200e+00 assign (segid " " and resid 161 and name HB1) (segid " " and resid 161 and name HA) 2.494 0.778 0.778 weight 1.000 ! spec=c13n...li-6, no=1196, id=2042, vol=3.281800e+00 assign (segid " " and resid 161 and name HA) (segid " " and resid 161 and name HB2) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-6, no=1197, id=2043, vol=3.574900e+00 assign (segid " " and resid 161 and name HB1) (segid " " and resid 161 and name HD2) 2.614 0.854 0.854 weight 1.000 ! spec=c13n...li-6, no=1201, id=2047, vol=2.477400e+00 assign (segid " " and resid 161 and name HB2) (segid " " and resid 161 and name HD2) 2.535 0.804 0.804 weight 1.000 ! spec=c13n...li-6, no=1202, id=2048, vol=2.973100e+00 assign (segid " " and resid 112 and name HB1) (segid " " and resid 112 and name HG2) 2.399 0.719 0.719 weight 1.000 ! spec=c13n...li-6, no=1206, id=2052, vol=4.143500e+00 assign (segid " " and resid 189 and name HB1) (segid " " and resid 190 and name HD2) 2.257 0.637 1.637 weight 1.000 ! spec=c13n...li-6, no=1209, id=2053, vol=5.974900e+00 assign (segid " " and resid 164 and name HD2) (segid " " and resid 164 and name HG1) 2.262 0.640 0.640 weight 1.000 ! spec=c13n...li-6, no=1210, id=2054, vol=5.889600e+00 assign (segid " " and resid 93 and name HB1) (segid " " and resid 93 and name HA) 2.407 0.724 0.724 weight 1.000 ! spec=c13n...li-6, no=1216, id=2059, vol=4.065800e+00 assign (segid " " and resid 186 and name HB1) (segid " " and resid 186 and name HA) 2.678 0.897 0.897 weight 1.000 ! spec=c13n...li-6, no=1222, id=2062, vol=2.139200e+00 assign (segid " " and resid 176 and name HA) (segid " " and resid 176 and name HB2) 2.594 0.841 0.841 weight 1.000 ! spec=c13n...li-6, no=1224, id=2064, vol=2.593600e+00 assign (segid " " and resid 153 and name HA) (segid " " and resid 153 and name HB2) 2.398 0.719 0.719 weight 1.000 ! spec=c13n...li-6, no=1225, id=2065, vol=4.151100e+00 assign (segid " " and resid 113 and name HB2) (segid " " and resid 113 and name HG1) 2.424 0.735 0.735 weight 1.000 ! spec=c13n...li-6, no=1230, id=2068, vol=3.891400e+00 assign (segid " " and resid 138 and name HB2) (segid " " and resid 154 and name HG1) 5.655 3.881 0.881 weight 1.000 ! spec=c13n...li-6, no=1236, id=2071, vol=2.254700e+00 assign (segid " " and resid 109 and name HB2) (segid " " and resid 106 and name HD22) 5.689 3.904 0.904 weight 1.000 ! spec=c13n...li-6, no=1237, id=2072, vol=2.089100e+00 or (segid " " and resid 109 and name HB2) (segid " " and resid 106 and name HD21) or (segid " " and resid 109 and name HB2) (segid " " and resid 106 and name HD23) assign (segid " " and resid 104 and name HA) (segid " " and resid 104 and name HB1) 2.455 0.754 0.754 weight 1.000 ! spec=c13n...li-6, no=1239, id=2074, vol=3.605000e+00 assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HA) 2.363 0.698 0.698 weight 1.000 ! spec=c13n...li-6, no=1240, id=2075, vol=4.536800e+00 assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HE2) 2.749 0.944 0.944 weight 1.000 ! spec=c13n...li-6, no=1243, id=2078, vol=1.832300e+00 assign (segid " " and resid 109 and name HG2) (segid " " and resid 109 and name HG1) 1.801 0.406 0.406 weight 1.000 ! spec=c13n...li-6, no=1247, id=2081, vol=2.312840e+01 assign (segid " " and resid 189 and name HB2) (segid " " and resid 189 and name HB1) 1.773 0.393 0.393 weight 1.000 ! spec=c13n...li-6, no=1248, id=2082, vol=2.542320e+01 assign (segid " " and resid 154 and name HB2) (segid " " and resid 154 and name HG1) 2.650 0.878 0.878 weight 1.000 ! spec=c13n...li-6, no=1252, id=2084, vol=2.280300e+00 assign (segid " " and resid 113 and name HB1) (segid " " and resid 185 and name HD11) 2.456 0.754 0.754 weight 1.000 ! spec=c13n...li-6, no=1255, id=2087, vol=3.598900e+00 assign (segid " " and resid 154 and name HB2) (segid " " and resid 139 and name HD11) 2.362 0.697 0.697 weight 1.000 ! spec=c13n...li-6, no=1256, id=2088, vol=4.552900e+00 assign (segid " " and resid 167 and name HB2) (segid " " and resid 167 and name HB1) 2.366 0.700 0.700 weight 1.000 ! spec=c13n...li-6, no=1265, id=2091, vol=4.498500e+00 assign (segid " " and resid 186 and name HB2) (segid " " and resid 186 and name HB1) 2.261 0.639 0.639 weight 1.000 ! spec=c13n...li-6, no=1268, id=2094, vol=5.906400e+00 assign (segid " " and resid 130 and name HB2) (segid " " and resid 167 and name HB1) 4.768 2.957 0.957 weight 1.000 ! spec=c13n...li-6, no=1271, id=2096, vol=1.757900e+00 assign (segid " " and resid 130 and name HB2) (segid " " and resid 130 and name HB1) 1.876 0.440 0.440 weight 1.000 ! spec=c13n...li-6, no=1278, id=2101, vol=1.814600e+01 assign (segid " " and resid 113 and name HB2) (segid " " and resid 110 and name HB1) 3.786 1.971 0.971 weight 1.000 ! spec=c13n...li-6, no=1281, id=2102, vol=1.687500e+00 assign (segid " " and resid 113 and name HA) (segid " " and resid 113 and name HB2) 2.693 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=1284, id=2105, vol=2.072100e+00 assign (segid " " and resid 178 and name HG1) (segid " " and resid 178 and name HB2) 2.442 0.746 0.746 weight 1.000 ! spec=c13n...li-6, no=1292, id=2111, vol=3.723200e+00 assign (segid " " and resid 138 and name HB2) (segid " " and resid 139 and name HD12) 2.596 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=1304, id=2119, vol=2.578400e+00 or (segid " " and resid 138 and name HB2) (segid " " and resid 139 and name HD11) or (segid " " and resid 138 and name HB2) (segid " " and resid 139 and name HD13) assign (segid " " and resid 113 and name HB1) (segid " " and resid 182 and name HE1) 2.719 0.924 0.924 weight 1.000 ! spec=c13n...li-6, no=1305, id=2120, vol=1.954200e+00 assign (segid " " and resid 167 and name HA) (segid " " and resid 170 and name HB1) 2.809 0.986 0.986 weight 1.000 ! spec=c13n...li-6, no=1307, id=2122, vol=1.608900e+00 assign (segid " " and resid 95 and name HD2) (segid " " and resid 93 and name HA) 2.760 0.952 0.952 weight 1.000 ! spec=c13n...li-6, no=1308, id=2123, vol=1.786300e+00 assign (segid " " and resid 178 and name HA) (segid " " and resid 178 and name HB1) 2.798 0.979 0.979 weight 1.000 ! spec=c13n...li-6, no=1310, id=2125, vol=1.646500e+00 assign (segid " " and resid 102 and name HA) (segid " " and resid 102 and name HB2) 2.432 0.739 0.739 weight 1.000 ! spec=c13n...li-6, no=1317, id=2132, vol=3.816700e+00 assign (segid " " and resid 95 and name HD2) (segid " " and resid 95 and name HE2) 2.228 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=1319, id=2134, vol=6.456300e+00 assign (segid " " and resid 113 and name HB2) (segid " " and resid 113 and name HB1) 1.991 0.496 0.496 weight 1.000 ! spec=c13n...li-6, no=1321, id=2136, vol=1.267930e+01 assign (segid " " and resid 178 and name HB2) (segid " " and resid 178 and name HB1) 2.078 0.540 0.540 weight 1.000 ! spec=c13n...li-6, no=1322, id=2137, vol=9.821200e+00 assign (segid " " and resid 129 and name HB2) (segid " " and resid 129 and name HB1) 1.871 0.438 0.438 weight 1.000 ! spec=c13n...li-6, no=1323, id=2138, vol=1.841730e+01 assign (segid " " and resid 170 and name HB1) (segid " " and resid 127 and name HB1) 2.480 0.769 0.769 weight 1.000 ! spec=c13n...li-6, no=1330, id=2141, vol=3.395600e+00 assign (segid " " and resid 135 and name HB1) (segid " " and resid 132 and name HD12) 2.590 0.839 0.839 weight 1.000 ! spec=c13n...li-6, no=1335, id=2146, vol=2.614400e+00 or (segid " " and resid 135 and name HB1) (segid " " and resid 132 and name HD11) or (segid " " and resid 135 and name HB1) (segid " " and resid 132 and name HD13) assign (segid " " and resid 95 and name HD1) (segid " " and resid 95 and name HE2) 2.040 0.520 0.520 weight 1.000 ! spec=c13n...li-6, no=1342, id=2153, vol=1.095340e+01 assign (segid " " and resid 102 and name HB2) (segid " " and resid 102 and name HB1) 1.661 0.345 0.345 weight 1.000 ! spec=c13n...li-6, no=1345, id=2156, vol=3.762180e+01 assign (segid " " and resid 102 and name HB1) (segid " " and resid 105 and name HD11) 5.546 3.810 0.810 weight 1.000 ! spec=c13n...li-6, no=1349, id=2158, vol=2.900900e+00 assign (segid " " and resid 142 and name HG12) (segid " " and resid 146 and name HB2) 4.127 2.565 0.565 weight 1.000 ! spec=c13n...li-6, no=1352, id=2161, vol=8.536400e+00 assign (segid " " and resid 142 and name HG12) (segid " " and resid 142 and name HD11) 2.225 0.619 0.619 weight 1.000 ! spec=c13n...li-6, no=1354, id=2162, vol=6.507200e+00 assign (segid " " and resid 117 and name HA) (segid " " and resid 117 and name HG2) 2.539 0.806 0.806 weight 1.000 ! spec=c13n...li-6, no=1360, id=2166, vol=2.945700e+00 assign (segid " " and resid 109 and name HG1) (segid " " and resid 109 and name HA) 2.620 0.858 0.858 weight 1.000 ! spec=c13n...li-6, no=1361, id=2167, vol=2.444500e+00 assign (segid " " and resid 154 and name HA) (segid " " and resid 154 and name HD2) 2.647 0.876 0.876 weight 1.000 ! spec=c13n...li-6, no=1362, id=2168, vol=2.294600e+00 assign (segid " " and resid 134 and name HA) (segid " " and resid 134 and name HB2) 2.304 0.663 0.663 weight 1.000 ! spec=c13n...li-6, no=1364, id=2170, vol=5.282500e+00 assign (segid " " and resid 120 and name HG2) (segid " " and resid 143 and name HB2) 2.336 0.682 0.682 weight 1.000 ! spec=c13n...li-6, no=1367, id=2173, vol=4.864400e+00 assign (segid " " and resid 134 and name HB2) (segid " " and resid 135 and name HG2) 4.609 0.851 1.851 weight 1.000 ! spec=c13n...li-6, no=1372, id=2178, vol=2.503700e+00 assign (segid " " and resid 109 and name HB2) (segid " " and resid 109 and name HG2) 2.217 0.615 0.615 weight 1.000 ! spec=c13n...li-6, no=1373, id=2179, vol=6.648700e+00 assign (segid " " and resid 117 and name HB2) (segid " " and resid 117 and name HG2) 2.317 0.671 0.671 weight 1.000 ! spec=c13n...li-6, no=1374, id=2180, vol=5.107300e+00 assign (segid " " and resid 120 and name HG2) (segid " " and resid 148 and name HB1) 3.132 1.568 0.568 weight 1.000 ! spec=c13n...li-6, no=1376, id=2181, vol=8.419900e+00 assign (segid " " and resid 109 and name HG1) (segid " " and resid 105 and name HG) 2.359 0.696 1.696 weight 1.000 ! spec=c13n...li-6, no=1381, id=2185, vol=4.579900e+00 assign (segid " " and resid 95 and name HD2) (segid " " and resid 95 and name HG2) 2.737 0.937 0.937 weight 1.000 ! spec=c13n...li-6, no=1382, id=2186, vol=1.878400e+00 assign (segid " " and resid 120 and name HG1) (segid " " and resid 152 and name HA) 2.611 0.852 0.852 weight 1.000 ! spec=c13n...li-6, no=1387, id=2191, vol=2.494100e+00 assign (segid " " and resid 120 and name HB1) (segid " " and resid 120 and name HG1) 2.295 0.658 0.658 weight 1.000 ! spec=c13n...li-6, no=1389, id=2193, vol=5.411900e+00 assign (segid " " and resid 123 and name HG12) (segid " " and resid 124 and name HB) 5.612 3.853 0.853 weight 1.000 ! spec=c13n...li-6, no=1390, id=2194, vol=2.488200e+00 assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HG11) 1.901 0.452 0.452 weight 1.000 ! spec=c13n...li-6, no=1396, id=2197, vol=1.671350e+01 assign (segid " " and resid 107 and name HG) (segid " " and resid 160 and name HD21) 2.426 0.736 0.736 weight 1.000 ! spec=c13n...li-6, no=1399, id=2200, vol=3.874700e+00 assign (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD12) 2.577 0.830 0.830 weight 1.000 ! spec=c13n...li-6, no=1401, id=2202, vol=2.698500e+00 or (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD11) or (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD13) assign (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HB) 2.661 0.885 0.885 weight 1.000 ! spec=c13n...li-6, no=1405, id=2206, vol=2.223600e+00 assign (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HD12) 2.241 0.628 0.628 weight 1.000 ! spec=c13n...li-6, no=1414, id=2211, vol=6.242900e+00 or (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HD11) or (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HD13) assign (segid " " and resid 175 and name HD11) (segid " " and resid 182 and name HB1) 5.673 3.893 0.893 weight 1.000 ! spec=c13n...li-6, no=1421, id=2218, vol=2.166400e+00 assign (segid " " and resid 175 and name HB2) (segid " " and resid 175 and name HD11) 2.562 0.821 0.821 weight 1.000 ! spec=c13n...li-6, no=1422, id=2219, vol=2.792000e+00 assign (segid " " and resid 175 and name HD11) (segid " " and resid 175 and name HG) 2.264 0.641 0.641 weight 1.000 ! spec=c13n...li-6, no=1423, id=2220, vol=5.860200e+00 assign (segid " " and resid 97 and name HG21) (segid " " and resid 97 and name HG12) 2.622 0.859 0.859 weight 1.000 ! spec=c13n...li-6, no=1424, id=2221, vol=2.433600e+00 assign (segid " " and resid 107 and name HD12) (segid " " and resid 107 and name HB2) 2.666 0.889 0.889 weight 1.000 ! spec=c13n...li-6, no=1431, id=2227, vol=2.199500e+00 or (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HD11) or (segid " " and resid 107 and name HD13) (segid " " and resid 107 and name HB2) assign (segid " " and resid 107 and name HD11) (segid " " and resid 107 and name HG) 2.453 0.752 0.752 weight 1.000 ! spec=c13n...li-6, no=1432, id=2228, vol=3.629000e+00 assign (segid " " and resid 159 and name HB2) (segid " " and resid 107 and name HD11) 2.689 0.904 0.904 weight 1.000 ! spec=c13n...li-6, no=1433, id=2229, vol=2.090400e+00 assign (segid " " and resid 107 and name HD11) (segid " " and resid 160 and name HD21) 5.497 3.779 0.779 weight 1.000 ! spec=c13n...li-6, no=1434, id=2230, vol=3.257800e+00 assign (segid " " and resid 107 and name HD11) (segid " " and resid 107 and name HD21) 2.999 0.499 0.499 weight 1.000 ! spec=c13n...li-6, no=1437, id=2232, vol=1.238650e+01 assign (segid " " and resid 143 and name HB2) (segid " " and resid 143 and name HB1) 2.077 0.539 0.539 weight 1.000 ! spec=c13n...li-6, no=1441, id=2235, vol=9.848900e+00 assign (segid " " and resid 158 and name HB1) (segid " " and resid 158 and name HB2) 2.122 0.563 0.563 weight 1.000 ! spec=c13n...li-6, no=1449, id=2241, vol=8.655900e+00 assign (segid " " and resid 158 and name HB2) (segid " " and resid 139 and name HG12) 4.633 2.866 0.866 weight 1.000 ! spec=c13n...li-6, no=1450, id=2242, vol=2.373200e+00 assign (segid " " and resid 158 and name HB2) (segid " " and resid 131 and name HD21) 2.658 0.883 0.883 weight 1.000 ! spec=c13n...li-6, no=1451, id=2243, vol=2.240000e+00 assign (segid " " and resid 111 and name HB2) (segid " " and resid 108 and name HA) 4.567 2.823 0.823 weight 1.000 ! spec=c13n...li-6, no=1454, id=2246, vol=2.764000e+00 assign (segid " " and resid 111 and name HB1) (segid " " and resid 112 and name HD1) 2.682 0.899 0.899 weight 1.000 ! spec=c13n...li-6, no=1455, id=2247, vol=2.124100e+00 assign (segid " " and resid 120 and name HG2) (segid " " and resid 120 and name HD2) 2.833 1.004 1.004 weight 1.000 ! spec=c13n...li-6, no=1465, id=2255, vol=1.526500e+00 assign (segid " " and resid 161 and name HG2) (segid " " and resid 161 and name HD2) 2.421 0.732 0.732 weight 1.000 ! spec=c13n...li-6, no=1469, id=2259, vol=3.925700e+00 assign (segid " " and resid 179 and name HB1) (segid " " and resid 179 and name HB2) 2.151 0.578 0.578 weight 1.000 ! spec=c13n...li-6, no=1470, id=2260, vol=7.970000e+00 assign (segid " " and resid 179 and name HB1) (segid " " and resid 179 and name HG2) 2.509 0.787 0.787 weight 1.000 ! spec=c13n...li-6, no=1478, id=2263, vol=3.166200e+00 assign (segid " " and resid 109 and name HG2) (segid " " and resid 106 and name HD21) 4.345 0.687 0.687 weight 1.000 ! spec=c13n...li-6, no=1481, id=2266, vol=4.755000e+00 assign (segid " " and resid 100 and name HG) (segid " " and resid 100 and name HD21) 2.254 0.635 0.635 weight 1.000 ! spec=c13n...li-6, no=1482, id=2267, vol=6.024600e+00 assign (segid " " and resid 100 and name HG) (segid " " and resid 100 and name HD12) 1.914 0.458 0.458 weight 1.000 ! spec=c13n...li-6, no=1483, id=2268, vol=1.606280e+01 or (segid " " and resid 100 and name HG) (segid " " and resid 100 and name HD11) or (segid " " and resid 100 and name HG) (segid " " and resid 100 and name HD13) assign (segid " " and resid 109 and name HG2) (segid " " and resid 105 and name HD11) 3.046 0.523 1.523 weight 1.000 ! spec=c13n...li-6, no=1484, id=2269, vol=1.077630e+01 assign (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD22) 2.687 0.903 0.903 weight 1.000 ! spec=c13n...li-6, no=1486, id=2271, vol=2.098300e+00 or (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD21) or (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD23) or (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD12) or (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD11) or (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD13) assign (segid " " and resid 178 and name HA) (segid " " and resid 179 and name HG2) 4.778 2.965 0.965 weight 1.000 ! spec=c13n...li-6, no=1487, id=2272, vol=1.717600e+00 assign (segid " " and resid 97 and name HG12) (segid " " and resid 97 and name HA) 2.751 0.946 0.946 weight 1.000 ! spec=c13n...li-6, no=1490, id=2275, vol=1.824000e+00 assign (segid " " and resid 117 and name HG1) (segid " " and resid 117 and name HB2) 2.284 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1496, id=2281, vol=5.568900e+00 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HB) 2.479 0.768 0.768 weight 1.000 ! spec=c13n...li-6, no=1497, id=2282, vol=3.405100e+00 assign (segid " " and resid 179 and name HB2) (segid " " and resid 179 and name HG2) 2.168 0.587 0.587 weight 1.000 ! spec=c13n...li-6, no=1499, id=2283, vol=7.616600e+00 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG11) 2.021 0.511 0.511 weight 1.000 ! spec=c13n...li-6, no=1503, id=2284, vol=1.157780e+01 assign (segid " " and resid 110 and name HB2) (segid " " and resid 110 and name HD11) 2.381 0.709 0.709 weight 1.000 ! spec=c13n...li-6, no=1513, id=2293, vol=4.338100e+00 assign (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD11) 2.283 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1514, id=2294, vol=5.573900e+00 assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HG) 2.596 0.842 0.842 weight 1.000 ! spec=c13n...li-6, no=1515, id=2295, vol=2.580500e+00 assign (segid " " and resid 119 and name HG11) (segid " " and resid 119 and name HB) 2.619 0.858 0.858 weight 1.000 ! spec=c13n...li-6, no=1516, id=2296, vol=2.446000e+00 assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HG12) 2.303 0.663 0.663 weight 1.000 ! spec=c13n...li-6, no=1517, id=2297, vol=5.294300e+00 assign (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG22) 2.325 0.675 0.675 weight 1.000 ! spec=c13n...li-6, no=1526, id=2301, vol=5.006100e+00 or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG21) or (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HG23) assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD21) 2.164 0.586 0.586 weight 1.000 ! spec=c13n...li-6, no=1531, id=2304, vol=7.681700e+00 assign (segid " " and resid 155 and name HD11) (segid " " and resid 114 and name HE1) 2.551 0.813 0.813 weight 1.000 ! spec=c13n...li-6, no=1538, id=2310, vol=2.869100e+00 assign (segid " " and resid 155 and name HD11) (segid " " and resid 114 and name HZ) 2.563 0.821 0.821 weight 1.000 ! spec=c13n...li-6, no=1539, id=2311, vol=2.784400e+00 assign (segid " " and resid 160 and name HD12) (segid " " and resid 160 and name HA) 2.725 0.928 0.928 weight 1.000 ! spec=c13n...li-6, no=1541, id=2313, vol=1.929000e+00 or (segid " " and resid 160 and name HA) (segid " " and resid 160 and name HD11) or (segid " " and resid 160 and name HD13) (segid " " and resid 160 and name HA) assign (segid " " and resid 155 and name HB2) (segid " " and resid 155 and name HD11) 2.464 0.759 0.759 weight 1.000 ! spec=c13n...li-6, no=1543, id=2315, vol=3.527500e+00 assign (segid " " and resid 160 and name HD11) (segid " " and resid 160 and name HG) 2.109 0.556 0.556 weight 1.000 ! spec=c13n...li-6, no=1544, id=2316, vol=8.985300e+00 assign (segid " " and resid 127 and name HG) (segid " " and resid 127 and name HD11) 2.118 0.561 0.561 weight 1.000 ! spec=c13n...li-6, no=1545, id=2317, vol=8.748000e+00 assign (segid " " and resid 131 and name HD11) (segid " " and resid 131 and name HG) 2.444 0.747 0.747 weight 1.000 ! spec=c13n...li-6, no=1546, id=2318, vol=3.705800e+00 assign (segid " " and resid 131 and name HD11) (segid " " and resid 127 and name HG) 4.543 2.808 0.808 weight 1.000 ! spec=c13n...li-6, no=1547, id=2319, vol=2.921100e+00 assign (segid " " and resid 155 and name HD11) (segid " " and resid 155 and name HG) 2.462 0.758 0.758 weight 1.000 ! spec=c13n...li-6, no=1548, id=2320, vol=3.543200e+00 assign (segid " " and resid 160 and name HD12) (segid " " and resid 160 and name HD22) 2.085 0.543 0.543 weight 1.000 ! spec=c13n...li-6, no=1549, id=2321, vol=9.626700e+00 or (segid " " and resid 160 and name HD12) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HD12) (segid " " and resid 160 and name HD23) or (segid " " and resid 160 and name HD11) (segid " " and resid 160 and name HD22) or (segid " " and resid 160 and name HD11) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HD11) (segid " " and resid 160 and name HD23) or (segid " " and resid 160 and name HD13) (segid " " and resid 160 and name HD22) or (segid " " and resid 160 and name HD13) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HD13) (segid " " and resid 160 and name HD23) assign (segid " " and resid 131 and name HD11) (segid " " and resid 127 and name HD11) 1.984 0.492 0.492 weight 1.000 ! spec=c13n...li-6, no=1553, id=2322, vol=1.296960e+01 assign (segid " " and resid 127 and name HD21) (segid " " and resid 159 and name HD21) 2.336 0.682 0.682 weight 1.000 ! spec=c13n...li-6, no=1555, id=2323, vol=4.863100e+00 assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG21) 2.621 0.859 0.859 weight 1.000 ! spec=c13n...li-6, no=1557, id=2325, vol=2.437300e+00 assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD12) 2.692 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=1558, id=2326, vol=2.074400e+00 or (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD11) or (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD13) assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HG11) 2.314 0.669 0.669 weight 1.000 ! spec=c13n...li-6, no=1559, id=2327, vol=5.142400e+00 assign (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HG21) 2.704 0.914 0.914 weight 1.000 ! spec=c13n...li-6, no=1562, id=2329, vol=2.019700e+00 assign (segid " " and resid 136 and name HA) (segid " " and resid 136 and name HB2) 2.637 0.869 0.869 weight 1.000 ! spec=c13n...li-6, no=1565, id=2331, vol=2.349800e+00 assign (segid " " and resid 136 and name HB2) (segid " " and resid 136 and name HB1) 1.953 0.477 0.477 weight 1.000 ! spec=c13n...li-6, no=1569, id=2334, vol=1.423670e+01 assign (segid " " and resid 181 and name HG2) (segid " " and resid 181 and name HA) 2.763 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=1577, id=2337, vol=1.777300e+00 assign (segid " " and resid 155 and name HG) (segid " " and resid 155 and name HA) 2.597 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=1578, id=2338, vol=2.575800e+00 assign (segid " " and resid 115 and name HA) (segid " " and resid 115 and name HG2) 2.710 0.918 0.918 weight 1.000 ! spec=c13n...li-6, no=1579, id=2339, vol=1.996100e+00 assign (segid " " and resid 108 and name HB2) (segid " " and resid 108 and name HG1) 2.386 0.712 0.712 weight 1.000 ! spec=c13n...li-6, no=1580, id=2340, vol=4.281700e+00 assign (segid " " and resid 185 and name HG) (segid " " and resid 184 and name HB2) 4.330 2.679 0.679 weight 1.000 ! spec=c13n...li-6, no=1581, id=2341, vol=4.934200e+00 assign (segid " " and resid 115 and name HB2) (segid " " and resid 115 and name HG2) 2.357 0.694 0.694 weight 1.000 ! spec=c13n...li-6, no=1582, id=2342, vol=4.609000e+00 assign (segid " " and resid 108 and name HG2) (segid " " and resid 108 and name HG1) 1.979 0.489 0.489 weight 1.000 ! spec=c13n...li-6, no=1584, id=2343, vol=1.316030e+01 assign (segid " " and resid 146 and name HG1) (segid " " and resid 142 and name HG12) 2.517 0.792 0.792 weight 1.000 ! spec=c13n...li-6, no=1586, id=2345, vol=3.103300e+00 assign (segid " " and resid 155 and name HG) (segid " " and resid 124 and name HD11) 2.665 0.888 0.888 weight 1.000 ! spec=c13n...li-6, no=1589, id=2348, vol=2.205800e+00 assign (segid " " and resid 185 and name HD11) (segid " " and resid 182 and name HE1) 2.612 0.853 0.853 weight 1.000 ! spec=c13n...li-6, no=1590, id=2349, vol=2.484700e+00 assign (segid " " and resid 185 and name HD11) (segid " " and resid 182 and name HD1) 2.643 0.873 0.873 weight 1.000 ! spec=c13n...li-6, no=1591, id=2350, vol=2.319100e+00 assign (segid " " and resid 185 and name HD11) (segid " " and resid 113 and name HB2) 2.501 0.782 0.782 weight 1.000 ! spec=c13n...li-6, no=1594, id=2353, vol=3.228700e+00 assign (segid " " and resid 105 and name HD11) (segid " " and resid 105 and name HG) 2.229 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=1597, id=2355, vol=6.435500e+00 assign (segid " " and resid 107 and name HG) (segid " " and resid 160 and name HD11) 2.662 0.885 0.885 weight 1.000 ! spec=c13n...li-6, no=1598, id=2356, vol=2.222300e+00 assign (segid " " and resid 185 and name HD11) (segid " " and resid 185 and name HG) 2.083 0.542 0.542 weight 1.000 ! spec=c13n...li-6, no=1599, id=2357, vol=9.668500e+00 assign (segid " " and resid 155 and name HD11) (segid " " and resid 155 and name HB1) 2.592 0.840 0.840 weight 1.000 ! spec=c13n...li-6, no=1600, id=2358, vol=2.605600e+00 assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HD1) 4.741 2.939 0.939 weight 1.000 ! spec=c13n...li-6, no=1607, id=2363, vol=1.861200e+00 assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HA) 3.751 1.946 0.946 weight 1.000 ! spec=c13n...li-6, no=1608, id=2364, vol=1.823100e+00 assign (segid " " and resid 106 and name HB2) (segid " " and resid 106 and name HD11) 2.378 0.707 0.707 weight 1.000 ! spec=c13n...li-6, no=1610, id=2366, vol=4.369300e+00 assign (segid " " and resid 159 and name HD21) (segid " " and resid 159 and name HG) 2.600 0.845 0.845 weight 1.000 ! spec=c13n...li-6, no=1613, id=2369, vol=2.558100e+00 assign (segid " " and resid 106 and name HD12) (segid " " and resid 110 and name HD12) 2.686 0.902 0.902 weight 1.000 ! spec=c13n...li-6, no=1615, id=2371, vol=2.104000e+00 or (segid " " and resid 106 and name HD12) (segid " " and resid 110 and name HD11) or (segid " " and resid 106 and name HD12) (segid " " and resid 110 and name HD13) or (segid " " and resid 106 and name HD11) (segid " " and resid 110 and name HD12) or (segid " " and resid 106 and name HD11) (segid " " and resid 110 and name HD11) or (segid " " and resid 106 and name HD11) (segid " " and resid 110 and name HD13) or (segid " " and resid 106 and name HD13) (segid " " and resid 110 and name HD12) or (segid " " and resid 106 and name HD13) (segid " " and resid 110 and name HD11) or (segid " " and resid 106 and name HD13) (segid " " and resid 110 and name HD13) assign (segid " " and resid 146 and name HG1) (segid " " and resid 146 and name HA) 2.606 0.849 0.849 weight 1.000 ! spec=c13n...li-6, no=1624, id=2378, vol=2.524700e+00 assign (segid " " and resid 96 and name HA) (segid " " and resid 96 and name HG1) 2.693 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=1629, id=2383, vol=2.072400e+00 assign (segid " " and resid 146 and name HG1) (segid " " and resid 146 and name HE2) 2.292 0.657 0.657 weight 1.000 ! spec=c13n...li-6, no=1639, id=2393, vol=5.451600e+00 assign (segid " " and resid 164 and name HG1) (segid " " and resid 130 and name HB2) 2.754 0.948 0.948 weight 1.000 ! spec=c13n...li-6, no=1641, id=2395, vol=1.809300e+00 assign (segid " " and resid 164 and name HG1) (segid " " and resid 130 and name HB1) 2.719 0.924 0.924 weight 1.000 ! spec=c13n...li-6, no=1642, id=2396, vol=1.956000e+00 assign (segid " " and resid 164 and name HG1) (segid " " and resid 164 and name HB1) 2.510 0.787 0.787 weight 1.000 ! spec=c13n...li-6, no=1644, id=2398, vol=3.161200e+00 assign (segid " " and resid 177 and name HB2) (segid " " and resid 177 and name HG2) 2.267 0.643 0.643 weight 1.000 ! spec=c13n...li-6, no=1645, id=2399, vol=5.815500e+00 assign (segid " " and resid 169 and name HG1) (segid " " and resid 169 and name HG2) 1.936 0.469 0.469 weight 1.000 ! spec=c13n...li-6, no=1655, id=2407, vol=1.498690e+01 assign (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HG21) 2.356 0.694 0.694 weight 1.000 ! spec=c13n...li-6, no=1660, id=2408, vol=4.622700e+00 or (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HG22) or (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HG23) assign (segid " " and resid 154 and name HG2) (segid " " and resid 154 and name HG1) 2.284 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1661, id=2409, vol=5.567800e+00 assign (segid " " and resid 159 and name HG) (segid " " and resid 159 and name HD11) 2.357 0.694 0.694 weight 1.000 ! spec=c13n...li-6, no=1664, id=2412, vol=4.607000e+00 assign (segid " " and resid 102 and name HA) (segid " " and resid 105 and name HD11) 4.436 2.742 0.742 weight 1.000 ! spec=c13n...li-6, no=1679, id=2423, vol=3.782200e+00 assign (segid " " and resid 140 and name HD11) (segid " " and resid 140 and name HA) 2.236 0.625 0.625 weight 1.000 ! spec=c13n...li-6, no=1680, id=2424, vol=6.319300e+00 assign (segid " " and resid 160 and name HD21) (segid " " and resid 107 and name HB1) 2.338 0.683 0.683 weight 1.000 ! spec=c13n...li-6, no=1684, id=2427, vol=4.839500e+00 assign (segid " " and resid 140 and name HB2) (segid " " and resid 140 and name HD11) 2.171 0.589 0.589 weight 1.000 ! spec=c13n...li-6, no=1686, id=2429, vol=7.546400e+00 assign (segid " " and resid 140 and name HG) (segid " " and resid 140 and name HD11) 2.075 0.538 0.538 weight 1.000 ! spec=c13n...li-6, no=1687, id=2430, vol=9.884100e+00 assign (segid " " and resid 159 and name HD11) (segid " " and resid 127 and name HB1) 3.419 1.731 0.731 weight 1.000 ! spec=c13n...li-6, no=1688, id=2431, vol=3.941700e+00 assign (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD22) 2.258 0.637 0.637 weight 1.000 ! spec=c13n...li-6, no=1689, id=2432, vol=5.956900e+00 or (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD21) or (segid " " and resid 108 and name HG1) (segid " " and resid 160 and name HD23) assign (segid " " and resid 159 and name HD12) (segid " " and resid 171 and name HG) 2.262 0.640 0.640 weight 1.000 ! spec=c13n...li-6, no=1690, id=2433, vol=5.890700e+00 or (segid " " and resid 159 and name HD11) (segid " " and resid 171 and name HG) or (segid " " and resid 159 and name HD13) (segid " " and resid 171 and name HG) assign (segid " " and resid 171 and name HD11) (segid " " and resid 186 and name HZ2) 2.767 0.957 0.957 weight 1.000 ! spec=c13n...li-6, no=1699, id=2438, vol=1.760200e+00 assign (segid " " and resid 171 and name HD11) (segid " " and resid 171 and name HA) 2.793 0.975 0.975 weight 1.000 ! spec=c13n...li-6, no=1702, id=2441, vol=1.663800e+00 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD11) 2.331 0.679 0.679 weight 1.000 ! spec=c13n...li-6, no=1703, id=2442, vol=4.925200e+00 assign (segid " " and resid 171 and name HG) (segid " " and resid 171 and name HD11) 2.283 0.652 0.652 weight 1.000 ! spec=c13n...li-6, no=1704, id=2443, vol=5.576300e+00 assign (segid " " and resid 171 and name HD11) (segid " " and resid 168 and name HB1) 4.568 0.824 0.824 weight 1.000 ! spec=c13n...li-6, no=1705, id=2444, vol=2.754100e+00 assign (segid " " and resid 171 and name HD11) (segid " " and resid 171 and name HD21) 2.040 0.520 0.520 weight 1.000 ! spec=c13n...li-6, no=1706, id=2445, vol=1.095380e+01 assign (segid " " and resid 121 and name HG21) (segid " " and resid 121 and name HB) 1.984 0.492 0.492 weight 1.000 ! spec=c13n...li-6, no=1710, id=2447, vol=1.293710e+01 assign (segid " " and resid 106 and name HA) (segid " " and resid 106 and name HD21) 5.093 3.548 0.548 weight 1.000 ! spec=c13n...li-6, no=1711, id=2448, vol=9.396000e+00 assign (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HA) 2.688 0.903 0.903 weight 1.000 ! spec=c13n...li-6, no=1713, id=2449, vol=2.094400e+00 or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HA) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HA) assign (segid " " and resid 106 and name HD22) (segid " " and resid 109 and name HG2) 4.081 0.541 0.541 weight 1.000 ! spec=c13n...li-6, no=1718, id=2454, vol=9.738100e+00 or (segid " " and resid 106 and name HD21) (segid " " and resid 109 and name HG2) or (segid " " and resid 106 and name HD23) (segid " " and resid 109 and name HG2) assign (segid " " and resid 106 and name HB1) (segid " " and resid 106 and name HD21) 2.249 0.632 0.632 weight 1.000 ! spec=c13n...li-6, no=1719, id=2455, vol=6.112100e+00 assign (segid " " and resid 121 and name HG21) (segid " " and resid 119 and name HG22) 2.186 0.597 0.597 weight 1.000 ! spec=c13n...li-6, no=1723, id=2456, vol=7.234800e+00 or (segid " " and resid 121 and name HG21) (segid " " and resid 119 and name HG21) or (segid " " and resid 121 and name HG21) (segid " " and resid 119 and name HG23) or (segid " " and resid 121 and name HG22) (segid " " and resid 119 and name HG22) or (segid " " and resid 121 and name HG22) (segid " " and resid 119 and name HG21) or (segid " " and resid 121 and name HG22) (segid " " and resid 119 and name HG23) or (segid " " and resid 121 and name HG23) (segid " " and resid 119 and name HG22) or (segid " " and resid 121 and name HG23) (segid " " and resid 119 and name HG21) or (segid " " and resid 121 and name HG23) (segid " " and resid 119 and name HG23) assign (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD22) 1.966 0.483 0.483 weight 1.000 ! spec=c13n...li-6, no=1724, id=2457, vol=1.369860e+01 or (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD21) or (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD23) or (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD12) or (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD11) or (segid " " and resid 121 and name HG21) (segid " " and resid 140 and name HD13) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD22) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD21) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD23) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD12) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD11) or (segid " " and resid 121 and name HG22) (segid " " and resid 140 and name HD13) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD22) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD21) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD23) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD12) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD11) or (segid " " and resid 121 and name HG23) (segid " " and resid 140 and name HD13) assign (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD22) 2.782 0.397 1.397 weight 1.000 ! spec=c13n...li-6, no=1725, id=2458, vol=2.464070e+01 or (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD21) or (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD23) or (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD12) or (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD11) or (segid " " and resid 110 and name HD22) (segid " " and resid 185 and name HD13) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD22) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD21) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD23) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD12) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD11) or (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HD13) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD22) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD21) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD23) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD12) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD11) or (segid " " and resid 110 and name HD23) (segid " " and resid 185 and name HD13) assign (segid " " and resid 100 and name HD11) (segid " " and resid 103 and name HD1) 4.797 2.978 0.978 weight 1.000 ! spec=c13n...li-6, no=1727, id=2460, vol=1.649100e+00 assign (segid " " and resid 155 and name HD21) (segid " " and resid 114 and name HE1) 2.568 0.824 1.524 weight 1.000 ! spec=c13n...li-6, no=1728, id=2461, vol=2.756300e+00 assign (segid " " and resid 155 and name HD21) (segid " " and resid 114 and name HZ) 2.541 0.807 0.807 weight 1.000 ! spec=c13n...li-6, no=1729, id=2462, vol=2.935000e+00 assign (segid " " and resid 140 and name HD21) (segid " " and resid 140 and name HA) 2.039 0.520 0.520 weight 1.000 ! spec=c13n...li-6, no=1734, id=2467, vol=1.099760e+01 assign (segid " " and resid 173 and name HD11) (segid " " and resid 177 and name HE1) 2.793 0.975 1.975 weight 1.000 ! spec=c13n...li-6, no=1735, id=2468, vol=1.664600e+00 assign (segid " " and resid 105 and name HD21) (segid " " and resid 105 and name HB2) 1.945 0.473 0.473 weight 1.000 ! spec=c13n...li-6, no=1742, id=2475, vol=1.459070e+01 assign (segid " " and resid 105 and name HD21) (segid " " and resid 105 and name HG) 1.968 0.484 0.484 weight 1.000 ! spec=c13n...li-6, no=1745, id=2478, vol=1.358920e+01 assign (segid " " and resid 131 and name HG) (segid " " and resid 131 and name HD21) 2.164 0.585 0.585 weight 1.000 ! spec=c13n...li-6, no=1746, id=2479, vol=7.693500e+00 assign (segid " " and resid 155 and name HD21) (segid " " and resid 155 and name HG) 2.159 0.583 0.583 weight 1.000 ! spec=c13n...li-6, no=1748, id=2481, vol=7.788900e+00 assign (segid " " and resid 156 and name HG21) (segid " " and resid 114 and name HE1) 5.588 3.837 0.837 weight 1.000 ! spec=c13n...li-6, no=1761, id=2488, vol=2.627700e+00 assign (segid " " and resid 156 and name HG21) (segid " " and resid 114 and name HD1) 5.549 3.812 0.812 weight 1.000 ! spec=c13n...li-6, no=1762, id=2489, vol=2.878700e+00 assign (segid " " and resid 156 and name HA) (segid " " and resid 156 and name HG21) 2.374 0.705 0.705 weight 1.000 ! spec=c13n...li-6, no=1765, id=2492, vol=4.411400e+00 assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG21) 2.189 0.599 0.599 weight 1.000 ! spec=c13n...li-6, no=1767, id=2494, vol=7.177900e+00 assign (segid " " and resid 145 and name HA) (segid " " and resid 145 and name HG21) 1.962 0.481 0.481 weight 1.000 ! spec=c13n...li-6, no=1775, id=2500, vol=1.386150e+01 assign (segid " " and resid 144 and name HB2) (segid " " and resid 145 and name HG21) 2.415 0.729 0.729 weight 1.000 ! spec=c13n...li-6, no=1777, id=2502, vol=3.984000e+00 assign (segid " " and resid 110 and name HD21) (segid " " and resid 113 and name HB2) 2.707 0.916 1.916 weight 1.000 ! spec=c13n...li-6, no=1779, id=2504, vol=2.006900e+00 assign (segid " " and resid 110 and name HD21) (segid " " and resid 113 and name HG1) 3.696 0.908 0.908 weight 1.000 ! spec=c13n...li-6, no=1780, id=2505, vol=2.058400e+00 assign (segid " " and resid 110 and name HG) (segid " " and resid 110 and name HD21) 2.059 0.530 0.530 weight 1.000 ! spec=c13n...li-6, no=1781, id=2506, vol=1.037400e+01 assign (segid " " and resid 110 and name HD21) (segid " " and resid 110 and name HB1) 2.271 0.645 0.645 weight 1.000 ! spec=c13n...li-6, no=1782, id=2507, vol=5.755500e+00 assign (segid " " and resid 115 and name HG2) (segid " " and resid 116 and name HG21) 2.152 0.579 0.579 weight 1.000 ! spec=c13n...li-6, no=1786, id=2511, vol=7.958500e+00 assign (segid " " and resid 110 and name HD21) (segid " " and resid 185 and name HB2) 2.569 0.825 0.825 weight 1.000 ! spec=c13n...li-6, no=1787, id=2512, vol=2.748800e+00 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HD21) 2.211 0.611 0.611 weight 1.000 ! spec=c13n...li-6, no=1802, id=2524, vol=6.757300e+00 assign (segid " " and resid 171 and name HB1) (segid " " and resid 171 and name HD21) 2.245 0.630 0.630 weight 1.000 ! spec=c13n...li-6, no=1806, id=2528, vol=6.163500e+00 assign (segid " " and resid 185 and name HD21) (segid " " and resid 185 and name HG) 2.014 0.507 0.507 weight 1.000 ! spec=c13n...li-6, no=1807, id=2529, vol=1.183630e+01 assign (segid " " and resid 185 and name HB1) (segid " " and resid 185 and name HD21) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-6, no=1809, id=2531, vol=5.369700e+00 assign (segid " " and resid 107 and name HB1) (segid " " and resid 107 and name HD21) 2.525 0.797 0.797 weight 1.000 ! spec=c13n...li-6, no=1820, id=2539, vol=3.049500e+00 assign (segid " " and resid 107 and name HB2) (segid " " and resid 107 and name HD21) 2.596 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=1821, id=2540, vol=2.578400e+00 assign (segid " " and resid 107 and name HD21) (segid " " and resid 107 and name HG) 2.344 0.687 0.687 weight 1.000 ! spec=c13n...li-6, no=1822, id=2541, vol=4.763900e+00 assign (segid " " and resid 160 and name HD11) (segid " " and resid 107 and name HD21) 4.136 2.570 0.570 weight 1.000 ! spec=c13n...li-6, no=1823, id=2542, vol=8.309200e+00 assign (segid " " and resid 171 and name HD12) (segid " " and resid 107 and name HD22) 2.692 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=1826, id=2544, vol=2.076900e+00 or (segid " " and resid 171 and name HD12) (segid " " and resid 107 and name HD21) or (segid " " and resid 171 and name HD12) (segid " " and resid 107 and name HD23) or (segid " " and resid 171 and name HD11) (segid " " and resid 107 and name HD22) or (segid " " and resid 171 and name HD11) (segid " " and resid 107 and name HD21) or (segid " " and resid 171 and name HD11) (segid " " and resid 107 and name HD23) or (segid " " and resid 171 and name HD13) (segid " " and resid 107 and name HD22) or (segid " " and resid 171 and name HD13) (segid " " and resid 107 and name HD21) or (segid " " and resid 171 and name HD13) (segid " " and resid 107 and name HD23) assign (segid " " and resid 188 and name HG11) (segid " " and resid 103 and name HE1) 3.702 1.913 0.913 weight 1.000 ! spec=c13n...li-6, no=1830, id=2546, vol=2.029200e+00 assign (segid " " and resid 188 and name HA) (segid " " and resid 188 and name HG11) 2.326 0.677 0.677 weight 1.000 ! spec=c13n...li-6, no=1831, id=2547, vol=4.981700e+00 assign (segid " " and resid 169 and name HA) (segid " " and resid 188 and name HG11) 2.535 0.803 1.803 weight 1.000 ! spec=c13n...li-6, no=1832, id=2548, vol=2.979500e+00 assign (segid " " and resid 156 and name HG11) (segid " " and resid 111 and name HG2) 4.490 0.775 0.775 weight 1.000 ! spec=c13n...li-6, no=1836, id=2552, vol=3.311200e+00 assign (segid " " and resid 156 and name HB) (segid " " and resid 156 and name HG11) 2.122 0.563 0.563 weight 1.000 ! spec=c13n...li-6, no=1837, id=2553, vol=8.662300e+00 assign (segid " " and resid 156 and name HG21) (segid " " and resid 156 and name HB) 3.531 1.801 0.801 weight 1.000 ! spec=c13n...li-6, no=1838, id=2554, vol=3.004300e+00 assign (segid " " and resid 156 and name HG11) (segid " " and resid 107 and name HG) 4.655 0.881 1.881 weight 1.000 ! spec=c13n...li-6, no=1844, id=2559, vol=2.253300e+00 assign (segid " " and resid 188 and name HG11) (segid " " and resid 168 and name HB1) 3.792 0.401 0.401 weight 1.000 ! spec=c13n...li-6, no=1848, id=2563, vol=2.386550e+01 assign (segid " " and resid 107 and name HD11) (segid " " and resid 156 and name HG11) 2.698 0.910 1.910 weight 1.000 ! spec=c13n...li-6, no=1852, id=2567, vol=2.047200e+00 assign (segid " " and resid 174 and name HA) (segid " " and resid 174 and name HB1) 1.909 0.456 0.456 weight 1.000 ! spec=c13n...li-6, no=1860, id=2573, vol=1.631150e+01 assign (segid " " and resid 126 and name HB1) (segid " " and resid 174 and name HB1) 2.427 0.736 0.736 weight 1.000 ! spec=c13n...li-6, no=1862, id=2575, vol=3.869600e+00 assign (segid " " and resid 174 and name HB2) (segid " " and resid 123 and name HB) 2.293 0.657 0.657 weight 1.000 ! spec=c13n...li-6, no=1864, id=2577, vol=5.438700e+00 or (segid " " and resid 123 and name HB) (segid " " and resid 174 and name HB1) or (segid " " and resid 174 and name HB3) (segid " " and resid 123 and name HB) assign (segid " " and resid 148 and name HE1) (segid " " and resid 148 and name HA) 2.770 0.959 0.959 weight 1.000 ! spec=c13n...li-6, no=1869, id=2581, vol=1.748200e+00 assign (segid " " and resid 148 and name HE2) (segid " " and resid 143 and name HA) 2.762 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=1870, id=2582, vol=1.777700e+00 or (segid " " and resid 148 and name HE1) (segid " " and resid 143 and name HA) or (segid " " and resid 148 and name HE3) (segid " " and resid 143 and name HA) assign (segid " " and resid 148 and name HE1) (segid " " and resid 143 and name HB2) 2.778 0.964 0.964 weight 1.000 ! spec=c13n...li-6, no=1871, id=2583, vol=1.719800e+00 assign (segid " " and resid 121 and name HG21) (segid " " and resid 148 and name HE1) 2.012 0.506 0.506 weight 1.000 ! spec=c13n...li-6, no=1874, id=2585, vol=1.191320e+01 assign (segid " " and resid 148 and name HE2) (segid " " and resid 119 and name HG22) 2.044 0.522 0.522 weight 1.000 ! spec=c13n...li-6, no=1875, id=2586, vol=1.082670e+01 or (segid " " and resid 148 and name HE2) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HE2) (segid " " and resid 119 and name HG23) or (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HG22) or (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HE1) (segid " " and resid 119 and name HG23) or (segid " " and resid 148 and name HE3) (segid " " and resid 119 and name HG22) or (segid " " and resid 148 and name HE3) (segid " " and resid 119 and name HG21) or (segid " " and resid 148 and name HE3) (segid " " and resid 119 and name HG23) assign (segid " " and resid 152 and name HB1) (segid " " and resid 114 and name HE1) 2.773 0.961 0.961 weight 1.000 ! spec=c13n...li-6, no=1877, id=2588, vol=1.736400e+00 assign (segid " " and resid 152 and name HB1) (segid " " and resid 114 and name HD1) 2.459 0.756 0.756 weight 1.000 ! spec=c13n...li-6, no=1878, id=2589, vol=3.572700e+00 assign (segid " " and resid 149 and name HA) (segid " " and resid 152 and name HB1) 2.223 0.618 0.618 weight 1.000 ! spec=c13n...li-6, no=1879, id=2590, vol=6.547200e+00 assign (segid " " and resid 120 and name HD2) (segid " " and resid 152 and name HB2) 2.627 0.863 0.863 weight 1.000 ! spec=c13n...li-6, no=1880, id=2591, vol=2.403600e+00 or (segid " " and resid 120 and name HD2) (segid " " and resid 152 and name HB1) or (segid " " and resid 120 and name HD2) (segid " " and resid 152 and name HB3) assign (segid " " and resid 115 and name HA) (segid " " and resid 152 and name HB1) 1.878 0.441 0.441 weight 1.000 ! spec=c13n...li-6, no=1881, id=2592, vol=1.802690e+01 assign (segid " " and resid 152 and name HB1) (segid " " and resid 118 and name HB) 2.559 0.819 0.819 weight 1.000 ! spec=c13n...li-6, no=1887, id=2597, vol=2.812700e+00 assign (segid " " and resid 150 and name HB2) (segid " " and resid 146 and name HA) 2.707 0.916 0.916 weight 1.000 ! spec=c13n...li-6, no=1890, id=2600, vol=2.007000e+00 or (segid " " and resid 146 and name HA) (segid " " and resid 150 and name HB1) or (segid " " and resid 150 and name HB3) (segid " " and resid 146 and name HA) assign (segid " " and resid 146 and name HB2) (segid " " and resid 150 and name HB1) 2.100 0.551 0.551 weight 1.000 ! spec=c13n...li-6, no=1896, id=2606, vol=9.208300e+00 assign (segid " " and resid 146 and name HB1) (segid " " and resid 150 and name HB1) 2.113 0.558 0.558 weight 1.000 ! spec=c13n...li-6, no=1897, id=2607, vol=8.883700e+00 assign (segid " " and resid 150 and name HB1) (segid " " and resid 142 and name HG21) 1.966 0.483 0.483 weight 1.000 ! spec=c13n...li-6, no=1904, id=2612, vol=1.366770e+01 assign (segid " " and resid 151 and name HA2) (segid " " and resid 142 and name HG21) 2.481 0.769 0.769 weight 1.000 ! spec=c13n...li-6, no=1905, id=2613, vol=3.387500e+00 assign (segid " " and resid 119 and name HA) (segid " " and resid 119 and name HG21) 2.228 0.621 0.621 weight 1.000 ! spec=c13n...li-6, no=1906, id=2614, vol=6.454500e+00 assign (segid " " and resid 123 and name HG21) (segid " " and resid 118 and name HA) 2.561 0.820 0.820 weight 1.000 ! spec=c13n...li-6, no=1911, id=2619, vol=2.798300e+00 assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HG21) 2.204 0.607 0.607 weight 1.000 ! spec=c13n...li-6, no=1913, id=2621, vol=6.897800e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HG21) 2.518 0.793 0.793 weight 1.000 ! spec=c13n...li-6, no=1915, id=2623, vol=3.097300e+00 assign (segid " " and resid 97 and name HB) (segid " " and resid 97 and name HG21) 1.927 0.464 0.464 weight 1.000 ! spec=c13n...li-6, no=1916, id=2624, vol=1.541980e+01 assign (segid " " and resid 142 and name HB) (segid " " and resid 142 and name HG21) 2.053 0.527 0.527 weight 1.000 ! spec=c13n...li-6, no=1919, id=2627, vol=1.054830e+01 assign (segid " " and resid 142 and name HG22) (segid " " and resid 146 and name HB1) 2.148 0.577 0.577 weight 1.000 ! spec=c13n...li-6, no=1920, id=2628, vol=8.044700e+00 or (segid " " and resid 146 and name HB1) (segid " " and resid 142 and name HG21) or (segid " " and resid 142 and name HG23) (segid " " and resid 146 and name HB1) assign (segid " " and resid 139 and name HB) (segid " " and resid 139 and name HG21) 2.016 0.508 0.508 weight 1.000 ! spec=c13n...li-6, no=1922, id=2630, vol=1.176550e+01 assign (segid " " and resid 142 and name HG22) (segid " " and resid 146 and name HG1) 2.583 0.834 0.834 weight 1.000 ! spec=c13n...li-6, no=1924, id=2632, vol=2.662600e+00 or (segid " " and resid 142 and name HG21) (segid " " and resid 146 and name HG1) or (segid " " and resid 142 and name HG23) (segid " " and resid 146 and name HG1) assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HG21) 2.278 0.649 0.649 weight 1.000 ! spec=c13n...li-6, no=1925, id=2633, vol=5.645600e+00 assign (segid " " and resid 118 and name HG21) (segid " " and resid 114 and name HE1) 2.762 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=1934, id=2640, vol=1.778400e+00 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HG21) 2.216 0.614 0.614 weight 1.000 ! spec=c13n...li-6, no=1939, id=2645, vol=6.670500e+00 assign (segid " " and resid 118 and name HG21) (segid " " and resid 123 and name HD11) 2.326 0.677 0.677 weight 1.000 ! spec=c13n...li-6, no=1941, id=2647, vol=4.982100e+00 assign (segid " " and resid 118 and name HG22) (segid " " and resid 118 and name HG11) 2.636 0.868 0.868 weight 1.000 ! spec=c13n...li-6, no=1946, id=2650, vol=2.357100e+00 or (segid " " and resid 118 and name HG11) (segid " " and resid 118 and name HG21) or (segid " " and resid 118 and name HG23) (segid " " and resid 118 and name HG11) assign (segid " " and resid 149 and name HE2) (segid " " and resid 115 and name HE2) 2.462 0.758 0.758 weight 1.000 ! spec=c13n...li-6, no=1948, id=2652, vol=3.547300e+00 or (segid " " and resid 149 and name HE1) (segid " " and resid 115 and name HE2) or (segid " " and resid 149 and name HE3) (segid " " and resid 115 and name HE2) assign (segid " " and resid 149 and name HE1) (segid " " and resid 149 and name HG2) 2.084 0.543 0.543 weight 1.000 ! spec=c13n...li-6, no=1949, id=2653, vol=9.643700e+00 assign (segid " " and resid 149 and name HE1) (segid " " and resid 149 and name HB1) 3.765 2.390 0.390 weight 1.000 ! spec=c13n...li-6, no=1952, id=2654, vol=2.610360e+01 assign (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE2) 2.076 0.538 0.538 weight 1.000 ! spec=c13n...li-6, no=1953, id=2655, vol=9.881000e+00 or (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG21) (segid " " and resid 149 and name HE3) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE2) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG22) (segid " " and resid 149 and name HE3) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE2) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE1) or (segid " " and resid 116 and name HG23) (segid " " and resid 149 and name HE3) assign (segid " " and resid 187 and name HA) (segid " " and resid 187 and name HG21) 2.198 0.604 0.604 weight 1.000 ! spec=c13n...li-6, no=1956, id=2658, vol=7.006500e+00 assign (segid " " and resid 123 and name HG21) (segid " " and resid 123 and name HG11) 2.625 0.862 0.862 weight 1.000 ! spec=c13n...li-6, no=1960, id=2662, vol=2.412700e+00 assign (segid " " and resid 187 and name HG21) (segid " " and resid 187 and name HG11) 2.098 0.550 0.550 weight 1.000 ! spec=c13n...li-6, no=1962, id=2664, vol=9.257200e+00 assign (segid " " and resid 123 and name HG22) (segid " " and resid 175 and name HD12) 2.216 0.614 0.614 weight 1.000 ! spec=c13n...li-6, no=1964, id=2666, vol=6.675200e+00 or (segid " " and resid 123 and name HG22) (segid " " and resid 175 and name HD11) or (segid " " and resid 123 and name HG22) (segid " " and resid 175 and name HD13) or (segid " " and resid 123 and name HG21) (segid " " and resid 175 and name HD12) or (segid " " and resid 175 and name HD11) (segid " " and resid 123 and name HG21) or (segid " " and resid 123 and name HG21) (segid " " and resid 175 and name HD13) or (segid " " and resid 123 and name HG23) (segid " " and resid 175 and name HD12) or (segid " " and resid 123 and name HG23) (segid " " and resid 175 and name HD11) or (segid " " and resid 123 and name HG23) (segid " " and resid 175 and name HD13) assign (segid " " and resid 123 and name HG22) (segid " " and resid 118 and name HG12) 2.559 0.819 0.819 weight 1.000 ! spec=c13n...li-6, no=1967, id=2668, vol=2.813400e+00 or (segid " " and resid 123 and name HG21) (segid " " and resid 118 and name HG12) or (segid " " and resid 123 and name HG23) (segid " " and resid 118 and name HG12) assign (segid " " and resid 124 and name HA) (segid " " and resid 124 and name HD11) 2.217 0.614 0.614 weight 1.000 ! spec=c13n...li-6, no=1971, id=2671, vol=6.654900e+00 assign (segid " " and resid 124 and name HB) (segid " " and resid 124 and name HD11) 2.062 0.532 0.532 weight 1.000 ! spec=c13n...li-6, no=1973, id=2673, vol=1.027230e+01 assign (segid " " and resid 124 and name HD11) (segid " " and resid 124 and name HG11) 2.413 0.728 0.728 weight 1.000 ! spec=c13n...li-6, no=1975, id=2675, vol=4.003400e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HD11) 2.663 0.886 0.886 weight 1.000 ! spec=c13n...li-6, no=1981, id=2678, vol=2.217400e+00 assign (segid " " and resid 139 and name HD11) (segid " " and resid 158 and name HB2) 2.784 0.969 0.969 weight 1.000 ! spec=c13n...li-6, no=1982, id=2679, vol=1.695700e+00 assign (segid " " and resid 154 and name HE2) (segid " " and resid 139 and name HD11) 2.835 1.005 1.005 weight 1.000 ! spec=c13n...li-6, no=1983, id=2680, vol=1.521600e+00 assign (segid " " and resid 138 and name HB2) (segid " " and resid 139 and name HD11) 2.298 0.660 0.660 weight 1.000 ! spec=c13n...li-6, no=1985, id=2682, vol=5.358500e+00 assign (segid " " and resid 132 and name HD12) (segid " " and resid 135 and name HG2) 2.711 0.919 0.919 weight 1.000 ! spec=c13n...li-6, no=1986, id=2683, vol=1.989000e+00 or (segid " " and resid 132 and name HD11) (segid " " and resid 135 and name HG2) or (segid " " and resid 132 and name HD13) (segid " " and resid 135 and name HG2) assign (segid " " and resid 132 and name HB) (segid " " and resid 132 and name HD11) 2.157 0.582 0.582 weight 1.000 ! spec=c13n...li-6, no=1987, id=2684, vol=7.840300e+00 assign (segid " " and resid 139 and name HB) (segid " " and resid 139 and name HG12) 2.026 0.513 0.513 weight 1.000 ! spec=c13n...li-6, no=1988, id=2685, vol=1.142930e+01 assign (segid " " and resid 139 and name HD12) (segid " " and resid 154 and name HG1) 2.330 0.678 0.678 weight 1.000 ! spec=c13n...li-6, no=1990, id=2687, vol=4.942600e+00 or (segid " " and resid 139 and name HD11) (segid " " and resid 154 and name HG1) or (segid " " and resid 139 and name HD13) (segid " " and resid 154 and name HG1) assign (segid " " and resid 132 and name HG12) (segid " " and resid 132 and name HD11) 1.959 0.480 0.480 weight 1.000 ! spec=c13n...li-6, no=1991, id=2688, vol=1.397690e+01 assign (segid " " and resid 139 and name HG12) (segid " " and resid 139 and name HG11) 2.101 0.552 0.552 weight 1.000 ! spec=c13n...li-6, no=1992, id=2689, vol=9.183300e+00 assign (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD12) 2.571 0.826 0.826 weight 1.000 ! spec=c13n...li-6, no=1996, id=2691, vol=2.736400e+00 or (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD13) assign (segid " " and resid 123 and name HG11) (segid " " and resid 123 and name HD11) 2.320 0.673 0.673 weight 1.000 ! spec=c13n...li-6, no=1999, id=2693, vol=5.070400e+00 assign (segid " " and resid 123 and name HD11) (segid " " and resid 123 and name HG21) 1.818 0.413 0.413 weight 1.000 ! spec=c13n...li-6, no=2002, id=2696, vol=2.188860e+01 assign (segid " " and resid 123 and name HD12) (segid " " and resid 118 and name HG12) 2.712 0.919 0.919 weight 1.000 ! spec=c13n...li-6, no=2004, id=2697, vol=1.985600e+00 or (segid " " and resid 123 and name HD11) (segid " " and resid 118 and name HG12) or (segid " " and resid 123 and name HD13) (segid " " and resid 118 and name HG12) assign (segid " " and resid 123 and name HD11) (segid " " and resid 118 and name HD11) 2.705 0.914 0.914 weight 1.000 ! spec=c13n...li-6, no=2006, id=2699, vol=2.018100e+00 assign (segid " " and resid 97 and name HG11) (segid " " and resid 97 and name HD11) 2.178 0.593 0.593 weight 1.000 ! spec=c13n...li-6, no=2010, id=2703, vol=7.398200e+00 assign (segid " " and resid 118 and name HB) (segid " " and resid 118 and name HD11) 2.774 0.962 0.962 weight 1.000 ! spec=c13n...li-6, no=2012, id=2704, vol=1.734600e+00 assign (segid " " and resid 120 and name HD1) (segid " " and resid 119 and name HD11) 2.763 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=2014, id=2706, vol=1.775700e+00 assign (segid " " and resid 119 and name HD11) (segid " " and resid 148 and name HG1) 2.694 0.907 0.907 weight 1.000 ! spec=c13n...li-6, no=2016, id=2708, vol=2.067300e+00 assign (segid " " and resid 187 and name HB) (segid " " and resid 187 and name HD11) 2.803 0.982 0.982 weight 1.000 ! spec=c13n...li-6, no=2018, id=2710, vol=1.628200e+00 assign (segid " " and resid 119 and name HG12) (segid " " and resid 119 and name HD11) 2.205 0.608 0.608 weight 1.000 ! spec=c13n...li-6, no=2019, id=2711, vol=6.863800e+00 assign (segid " " and resid 187 and name HG12) (segid " " and resid 187 and name HD11) 2.271 0.645 0.645 weight 1.000 ! spec=c13n...li-6, no=2020, id=2712, vol=5.754500e+00 assign (segid " " and resid 119 and name HG11) (segid " " and resid 119 and name HD11) 2.215 0.613 0.613 weight 1.000 ! spec=c13n...li-6, no=2021, id=2713, vol=6.692800e+00 assign (segid " " and resid 187 and name HG11) (segid " " and resid 187 and name HD11) 2.119 0.561 0.561 weight 1.000 ! spec=c13n...li-6, no=2022, id=2714, vol=8.735500e+00 assign (segid " " and resid 187 and name HD11) (segid " " and resid 187 and name HG21) 1.712 0.367 0.367 weight 1.000 ! spec=c13n...li-6, no=2024, id=2716, vol=3.133890e+01 assign (segid " " and resid 119 and name HD11) (segid " " and resid 119 and name HG21) 1.851 0.428 0.428 weight 1.000 ! spec=c13n...li-6, no=2025, id=2717, vol=1.964720e+01 assign (segid " " and resid 118 and name HD11) (segid " " and resid 123 and name HG21) 1.995 0.497 0.497 weight 1.000 ! spec=c13n...li-6, no=2032, id=2722, vol=1.253680e+01 assign (segid " " and resid 118 and name HD12) (segid " " and resid 123 and name HD12) 2.762 0.954 0.954 weight 1.000 ! spec=c13n...li-6, no=2033, id=2723, vol=1.778800e+00 or (segid " " and resid 118 and name HD12) (segid " " and resid 123 and name HD11) or (segid " " and resid 118 and name HD12) (segid " " and resid 123 and name HD13) or (segid " " and resid 118 and name HD11) (segid " " and resid 123 and name HD12) or (segid " " and resid 123 and name HD11) (segid " " and resid 118 and name HD11) or (segid " " and resid 118 and name HD11) (segid " " and resid 123 and name HD13) or (segid " " and resid 118 and name HD13) (segid " " and resid 123 and name HD12) or (segid " " and resid 118 and name HD13) (segid " " and resid 123 and name HD11) or (segid " " and resid 118 and name HD13) (segid " " and resid 123 and name HD13) assign (segid " " and resid 118 and name HG12) (segid " " and resid 118 and name HD11) 2.535 0.803 0.803 weight 1.000 ! spec=c13n...li-6, no=2034, id=2724, vol=2.975100e+00 assign (segid " " and resid 119 and name HD11) (segid " " and resid 120 and name HD2) 2.800 0.980 0.980 weight 1.000 ! spec=c13n...li-6, no=2038, id=2726, vol=1.640100e+00 assign (segid " " and resid 156 and name HA) (segid " " and resid 160 and name HD21) 4.969 2.102 1.102 weight 1.000 ! spec=c13n...li-6, no=2040, id=2728, vol=1.153600e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 154 and name HG1) 2.906 1.056 1.056 weight 1.000 ! spec=c13n...li-6, no=2041, id=2729, vol=1.310600e+00 assign (segid " " and resid 120 and name HA) (segid " " and resid 124 and name HG21) 2.992 1.119 1.119 weight 1.000 ! spec=c13n...li-6, no=2043, id=2731, vol=1.101600e+00 assign (segid " " and resid 116 and name HA) (segid " " and resid 115 and name HG2) 2.827 0.999 0.999 weight 1.000 ! spec=c13n...li-6, no=2049, id=2737, vol=1.547800e+00 assign (segid " " and resid 158 and name HA) (segid " " and resid 131 and name HD21) 3.952 2.089 1.089 weight 1.000 ! spec=c13n...li-6, no=2053, id=2740, vol=1.193100e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 103 and name HE1) 2.872 1.031 1.031 weight 1.000 ! spec=c13n...li-6, no=2054, id=2741, vol=1.406500e+00 assign (segid " " and resid 103 and name HA) (segid " " and resid 186 and name HZ2) 3.122 1.219 1.219 weight 1.000 ! spec=c13n...li-6, no=2055, id=2742, vol=8.527000e-01 assign (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD22) 3.011 1.133 1.133 weight 1.000 ! spec=c13n...li-6, no=2058, id=2744, vol=1.060400e+00 or (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD21) or (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD23) or (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD12) or (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD11) or (segid " " and resid 128 and name HA) (segid " " and resid 131 and name HD13) assign (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HD12) 2.811 0.988 0.988 weight 1.000 ! spec=c13n...li-6, no=2059, id=2745, vol=1.601600e+00 or (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HA) or (segid " " and resid 103 and name HA) (segid " " and resid 106 and name HD13) assign (segid " " and resid 182 and name HA) (segid " " and resid 185 and name HD11) 2.509 0.787 0.787 weight 1.000 ! spec=c13n...li-6, no=2061, id=2747, vol=3.164400e+00 assign (segid " " and resid 114 and name HA) (segid " " and resid 182 and name HD1) 2.952 1.089 1.089 weight 1.000 ! spec=c13n...li-6, no=2063, id=2749, vol=1.194800e+00 assign (segid " " and resid 114 and name HA) (segid " " and resid 118 and name HG12) 2.926 1.070 1.070 weight 1.000 ! spec=c13n...li-6, no=2065, id=2750, vol=1.257700e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 156 and name HG11) 4.911 2.059 1.059 weight 1.000 ! spec=c13n...li-6, no=2068, id=2753, vol=1.298100e+00 assign (segid " " and resid 157 and name HA) (segid " " and resid 160 and name HB1) 3.031 1.149 1.149 weight 1.000 ! spec=c13n...li-6, no=2069, id=2754, vol=1.018100e+00 assign (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD22) 2.225 0.619 0.619 weight 1.000 ! spec=c13n...li-6, no=2070, id=2755, vol=6.511500e+00 or (segid " " and resid 140 and name HD21) (segid " " and resid 140 and name HA) or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD23) or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD12) or (segid " " and resid 140 and name HD11) (segid " " and resid 140 and name HA) or (segid " " and resid 140 and name HA) (segid " " and resid 140 and name HD13) assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HG) 2.910 1.059 1.059 weight 1.000 ! spec=c13n...li-6, no=2072, id=2757, vol=1.299900e+00 assign (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD12) 2.862 1.024 1.024 weight 1.000 ! spec=c13n...li-6, no=2073, id=2758, vol=1.438500e+00 or (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD11) or (segid " " and resid 107 and name HA) (segid " " and resid 107 and name HD13) assign (segid " " and resid 107 and name HA) (segid " " and resid 171 and name HD21) 4.910 2.058 1.058 weight 1.000 ! spec=c13n...li-6, no=2075, id=2760, vol=1.301400e+00 assign (segid " " and resid 170 and name HA) (segid " " and resid 173 and name HB2) 2.210 0.611 0.611 weight 1.000 ! spec=c13n...li-6, no=2076, id=2761, vol=6.771600e+00 assign (segid " " and resid 155 and name HA) (segid " " and resid 158 and name HB1) 2.928 1.071 1.071 weight 1.000 ! spec=c13n...li-6, no=2078, id=2763, vol=1.254500e+00 assign (segid " " and resid 100 and name HA) (segid " " and resid 103 and name HE1) 3.028 1.146 1.146 weight 1.000 ! spec=c13n...li-6, no=2079, id=2764, vol=1.024000e+00 assign (segid " " and resid 175 and name HA) (segid " " and resid 180 and name HB2) 2.907 1.056 1.056 weight 1.000 ! spec=c13n...li-6, no=2082, id=2767, vol=1.309100e+00 assign (segid " " and resid 159 and name HA) (segid " " and resid 127 and name HD11) 2.864 1.025 1.025 weight 1.000 ! spec=c13n...li-6, no=2083, id=2768, vol=1.432500e+00 assign (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG22) 2.942 1.082 1.082 weight 1.000 ! spec=c13n...li-6, no=2084, id=2769, vol=1.218900e+00 or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG21) or (segid " " and resid 146 and name HA) (segid " " and resid 142 and name HG23) assign (segid " " and resid 152 and name HA) (segid " " and resid 114 and name HE1) 2.880 1.037 1.037 weight 1.000 ! spec=c13n...li-6, no=2089, id=2774, vol=1.385100e+00 assign (segid " " and resid 152 and name HA) (segid " " and resid 120 and name HB2) 2.948 1.086 1.086 weight 1.000 ! spec=c13n...li-6, no=2090, id=2775, vol=1.204400e+00 assign (segid " " and resid 118 and name HG21) (segid " " and resid 152 and name HA) 3.031 1.149 1.149 weight 1.000 ! spec=c13n...li-6, no=2091, id=2776, vol=1.018000e+00 assign (segid " " and resid 110 and name HA) (segid " " and resid 112 and name HD1) 2.838 1.006 1.006 weight 1.000 ! spec=c13n...li-6, no=2092, id=2777, vol=1.513400e+00 assign (segid " " and resid 127 and name HA) (segid " " and resid 127 and name HB2) 2.447 0.748 0.748 weight 1.000 ! spec=c13n...li-6, no=2094, id=2779, vol=3.681300e+00 assign (segid " " and resid 131 and name HA) (segid " " and resid 131 and name HB1) 2.598 0.843 0.843 weight 1.000 ! spec=c13n...li-6, no=2095, id=2780, vol=2.571900e+00 assign (segid " " and resid 120 and name HD2) (segid " " and resid 152 and name HA) 2.888 1.043 1.043 weight 1.000 ! spec=c13n...li-6, no=2102, id=2787, vol=1.361700e+00 assign (segid " " and resid 120 and name HD1) (segid " " and resid 120 and name HG2) 2.956 1.092 1.092 weight 1.000 ! spec=c13n...li-6, no=2104, id=2789, vol=1.183800e+00 assign (segid " " and resid 112 and name HD2) (segid " " and resid 110 and name HA) 2.890 1.044 1.044 weight 1.000 ! spec=c13n...li-6, no=2105, id=2790, vol=1.356700e+00 assign (segid " " and resid 109 and name HD1) (segid " " and resid 109 and name HA) 2.899 1.051 1.051 weight 1.000 ! spec=c13n...li-6, no=2106, id=2791, vol=1.329800e+00 assign (segid " " and resid 109 and name HD1) (segid " " and resid 105 and name HD11) 4.934 3.076 1.076 weight 1.000 ! spec=c13n...li-6, no=2108, id=2793, vol=1.238000e+00 assign (segid " " and resid 131 and name HB2) (segid " " and resid 131 and name HA) 2.710 0.918 0.918 weight 1.000 ! spec=c13n...li-6, no=2110, id=2794, vol=1.996300e+00 assign (segid " " and resid 131 and name HG) (segid " " and resid 132 and name HA) 2.947 1.086 1.086 weight 1.000 ! spec=c13n...li-6, no=2112, id=2796, vol=1.206000e+00 assign (segid " " and resid 117 and name HD2) (segid " " and resid 182 and name HD1) 2.819 0.993 0.993 weight 1.000 ! spec=c13n...li-6, no=2113, id=2797, vol=1.573600e+00 assign (segid " " and resid 117 and name HD2) (segid " " and resid 181 and name HB2) 2.166 0.586 0.586 weight 1.000 ! spec=c13n...li-6, no=2114, id=2798, vol=7.653700e+00 assign (segid " " and resid 110 and name HB2) (segid " " and resid 182 and name HE1) 2.933 1.075 1.075 weight 1.000 ! spec=c13n...li-6, no=2115, id=2799, vol=1.242000e+00 assign (segid " " and resid 127 and name HB1) (segid " " and resid 124 and name HA) 2.902 1.052 1.052 weight 1.000 ! spec=c13n...li-6, no=2116, id=2800, vol=1.323400e+00 assign (segid " " and resid 174 and name HB1) (segid " " and resid 126 and name HB2) 2.505 0.785 0.785 weight 1.000 ! spec=c13n...li-6, no=2120, id=2804, vol=3.194100e+00 assign (segid " " and resid 171 and name HB2) (segid " " and resid 171 and name HG) 2.872 1.031 1.031 weight 1.000 ! spec=c13n...li-6, no=2122, id=2806, vol=1.406800e+00 assign (segid " " and resid 114 and name HB2) (segid " " and resid 156 and name HG21) 4.893 3.046 1.046 weight 1.000 ! spec=c13n...li-6, no=2125, id=2809, vol=1.347600e+00 assign (segid " " and resid 156 and name HG21) (segid " " and resid 114 and name HB1) 5.945 1.084 1.084 weight 1.000 ! spec=c13n...li-6, no=2127, id=2811, vol=1.209800e+00 assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HB) 2.930 1.073 1.073 weight 1.000 ! spec=c13n...li-6, no=2131, id=2815, vol=1.248400e+00 assign (segid " " and resid 159 and name HB2) (segid " " and resid 159 and name HG) 2.973 1.105 1.105 weight 1.000 ! spec=c13n...li-6, no=2132, id=2816, vol=1.143500e+00 assign (segid " " and resid 103 and name HB1) (segid " " and resid 100 and name HD21) 2.933 1.075 1.075 weight 1.000 ! spec=c13n...li-6, no=2133, id=2817, vol=1.240400e+00 assign (segid " " and resid 153 and name HG1) (segid " " and resid 115 and name HE2) 2.732 0.933 0.933 weight 1.000 ! spec=c13n...li-6, no=2135, id=2819, vol=1.900500e+00 assign (segid " " and resid 178 and name HG2) (segid " " and resid 178 and name HA) 2.910 1.058 1.058 weight 1.000 ! spec=c13n...li-6, no=2140, id=2822, vol=1.301200e+00 assign (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD12) 2.892 1.046 1.046 weight 1.000 ! spec=c13n...li-6, no=2142, id=2823, vol=1.349200e+00 or (segid " " and resid 119 and name HD11) (segid " " and resid 148 and name HG1) or (segid " " and resid 148 and name HG1) (segid " " and resid 119 and name HD13) assign (segid " " and resid 148 and name HG1) (segid " " and resid 148 and name HA) 3.067 1.176 1.176 weight 1.000 ! spec=c13n...li-6, no=2143, id=2824, vol=9.487000e-01 assign (segid " " and resid 132 and name HD12) (segid " " and resid 134 and name HG2) 2.879 1.036 1.036 weight 1.000 ! spec=c13n...li-6, no=2146, id=2827, vol=1.387900e+00 or (segid " " and resid 132 and name HD11) (segid " " and resid 134 and name HG2) or (segid " " and resid 132 and name HD13) (segid " " and resid 134 and name HG2) assign (segid " " and resid 172 and name HB2) (segid " " and resid 173 and name HD11) 5.871 1.030 1.030 weight 1.000 ! spec=c13n...li-6, no=2148, id=2829, vol=1.410100e+00 assign (segid " " and resid 117 and name HB1) (segid " " and resid 117 and name HD2) 2.903 1.053 1.053 weight 1.000 ! spec=c13n...li-6, no=2150, id=2831, vol=1.320200e+00 assign (segid " " and resid 164 and name HB1) (segid " " and resid 164 and name HD2) 2.826 0.998 0.998 weight 1.000 ! spec=c13n...li-6, no=2152, id=2833, vol=1.550500e+00 assign (segid " " and resid 186 and name HB2) (segid " " and resid 186 and name HD1) 3.039 1.155 1.155 weight 1.000 ! spec=c13n...li-6, no=2153, id=2834, vol=1.002300e+00 assign (segid " " and resid 186 and name HB1) (segid " " and resid 186 and name HD1) 2.853 1.018 1.018 weight 1.000 ! spec=c13n...li-6, no=2154, id=2835, vol=1.463400e+00 assign (segid " " and resid 168 and name HB2) (segid " " and resid 168 and name HG2) 2.940 1.081 1.081 weight 1.000 ! spec=c13n...li-6, no=2158, id=2839, vol=1.222900e+00 assign (segid " " and resid 168 and name HB2) (segid " " and resid 186 and name HZ2) 2.792 0.975 0.975 weight 1.000 ! spec=c13n...li-6, no=2159, id=2840, vol=1.666700e+00 assign (segid " " and resid 168 and name HB1) (segid " " and resid 186 and name HZ2) 2.921 1.066 1.066 weight 1.000 ! spec=c13n...li-6, no=2160, id=2841, vol=1.273000e+00 assign (segid " " and resid 168 and name HB1) (segid " " and resid 168 and name HA) 3.020 1.140 1.140 weight 1.000 ! spec=c13n...li-6, no=2161, id=2842, vol=1.040800e+00 assign (segid " " and resid 167 and name HB2) (segid " " and resid 167 and name HD1) 2.920 1.066 1.066 weight 1.000 ! spec=c13n...li-6, no=2162, id=2843, vol=1.274300e+00 assign (segid " " and resid 167 and name HB2) (segid " " and resid 170 and name HG1) 4.951 2.088 1.088 weight 1.000 ! spec=c13n...li-6, no=2164, id=2845, vol=1.196500e+00 assign (segid " " and resid 167 and name HB1) (segid " " and resid 167 and name HD1) 2.934 1.076 1.076 weight 1.000 ! spec=c13n...li-6, no=2165, id=2846, vol=1.238600e+00 assign (segid " " and resid 118 and name HD11) (segid " " and resid 182 and name HB2) 2.993 1.119 1.119 weight 1.000 ! spec=c13n...li-6, no=2170, id=2851, vol=1.099900e+00 assign (segid " " and resid 118 and name HD11) (segid " " and resid 182 and name HB1) 3.006 1.129 1.129 weight 1.000 ! spec=c13n...li-6, no=2171, id=2852, vol=1.071400e+00 assign (segid " " and resid 123 and name HA) (segid " " and resid 123 and name HD11) 2.862 1.024 1.024 weight 1.000 ! spec=c13n...li-6, no=2172, id=2853, vol=1.436700e+00 assign (segid " " and resid 123 and name HG22) (segid " " and resid 123 and name HB) 2.518 0.792 0.792 weight 1.000 ! spec=c13n...li-6, no=2178, id=2859, vol=3.100500e+00 or (segid " " and resid 123 and name HB) (segid " " and resid 123 and name HG21) or (segid " " and resid 123 and name HG23) (segid " " and resid 123 and name HB) assign (segid " " and resid 150 and name HB1) (segid " " and resid 146 and name HE2) 4.827 2.999 0.999 weight 1.000 ! spec=c13n...li-6, no=2181, id=2862, vol=1.547300e+00 assign (segid " " and resid 150 and name HB2) (segid " " and resid 150 and name HN) 2.954 1.091 1.091 weight 1.000 ! spec=c13n...li-6, no=2182, id=2863, vol=1.188300e+00 or (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HB1) or (segid " " and resid 150 and name HB3) (segid " " and resid 150 and name HN) assign (segid " " and resid 156 and name HG11) (segid " " and resid 108 and name HA) 5.871 1.030 1.030 weight 1.000 ! spec=c13n...li-6, no=2184, id=2865, vol=1.411800e+00 assign (segid " " and resid 107 and name HD21) (segid " " and resid 186 and name HZ2) 4.918 3.064 1.064 weight 1.000 ! spec=c13n...li-6, no=2189, id=2869, vol=1.279100e+00 assign (segid " " and resid 107 and name HD21) (segid " " and resid 167 and name HH2) 2.841 1.009 1.009 weight 1.000 ! spec=c13n...li-6, no=2190, id=2870, vol=1.502200e+00 assign (segid " " and resid 110 and name HD21) (segid " " and resid 182 and name HE1) 2.892 1.045 1.045 weight 1.000 ! spec=c13n...li-6, no=2192, id=2872, vol=1.350100e+00 assign (segid " " and resid 121 and name HG21) (segid " " and resid 143 and name HB1) 2.959 1.094 1.094 weight 1.000 ! spec=c13n...li-6, no=2195, id=2875, vol=1.177000e+00 assign (segid " " and resid 121 and name HG21) (segid " " and resid 143 and name HB2) 2.886 1.041 1.041 weight 1.000 ! spec=c13n...li-6, no=2196, id=2876, vol=1.366500e+00 or (segid " " and resid 121 and name HG22) (segid " " and resid 143 and name HB2) or (segid " " and resid 121 and name HG23) (segid " " and resid 143 and name HB2) assign (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD22) 2.082 0.542 0.542 weight 1.000 ! spec=c13n...li-6, no=2197, id=2877, vol=9.702200e+00 or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD21) or (segid " " and resid 160 and name HG) (segid " " and resid 160 and name HD23) assign (segid " " and resid 169 and name HB2) (segid " " and resid 173 and name HD11) 5.125 0.564 0.564 weight 1.000 ! spec=c13n...li-6, no=2198, id=2878, vol=8.585400e+00 assign (segid " " and resid 159 and name HD21) (segid " " and resid 159 and name HB1) 2.896 1.049 1.049 weight 1.000 ! spec=c13n...li-6, no=2200, id=2880, vol=1.338200e+00 assign (segid " " and resid 106 and name HD12) (segid " " and resid 186 and name HA) 2.998 1.123 1.123 weight 1.000 ! spec=c13n...li-6, no=2202, id=2882, vol=1.088600e+00 or (segid " " and resid 106 and name HD11) (segid " " and resid 186 and name HA) or (segid " " and resid 106 and name HD13) (segid " " and resid 186 and name HA) assign (segid " " and resid 106 and name HD11) (segid " " and resid 103 and name HE1) 5.056 1.019 1.019 weight 1.000 ! spec=c13n...li-6, no=2203, id=2883, vol=1.456600e+00 assign (segid " " and resid 107 and name HD11) (segid " " and resid 159 and name HB1) 2.914 1.061 1.061 weight 1.000 ! spec=c13n...li-6, no=2213, id=2891, vol=1.291000e+00 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HA) 3.109 1.208 1.208 weight 1.000 ! spec=n15n...hn-6, no=8, id=2, vol=3.808000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 120 and name HD2) 3.206 1.284 1.284 weight 1.000 ! spec=n15n...hn-6, no=10, id=3, vol=3.168000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HA) 2.329 0.678 0.678 weight 1.000 ! spec=n15n...hn-6, no=11, id=4, vol=2.154200e+00 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HB) 2.674 0.894 0.894 weight 1.000 ! spec=n15n...hn-6, no=13, id=6, vol=9.410000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HG12) 3.029 1.147 1.147 weight 1.000 ! spec=n15n...hn-6, no=14, id=7, vol=4.453000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HG11) 2.895 1.048 1.048 weight 1.000 ! spec=n15n...hn-6, no=15, id=8, vol=5.834000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HD11) 2.977 1.108 1.108 weight 1.000 ! spec=n15n...hn-6, no=16, id=9, vol=4.939000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 119 and name HG21) 3.173 1.258 1.258 weight 1.000 ! spec=n15n...hn-6, no=17, id=10, vol=3.371000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HG21) 2.792 0.975 0.975 weight 1.000 ! spec=n15n...hn-6, no=18, id=11, vol=7.253000e-01 assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HD11) 3.418 1.460 1.460 weight 1.000 ! spec=n15n...hn-6, no=19, id=12, vol=2.155000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 119 and name HA) 3.451 1.489 1.489 weight 1.000 ! spec=n15n...hn-6, no=29, id=16, vol=2.035000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 121 and name HA) 2.972 1.104 1.104 weight 1.000 ! spec=n15n...hn-6, no=30, id=17, vol=4.984000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 120 and name HD2) 3.329 1.385 1.385 weight 1.000 ! spec=n15n...hn-6, no=31, id=18, vol=2.525000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 119 and name HB) 3.165 1.252 1.252 weight 1.000 ! spec=n15n...hn-6, no=33, id=20, vol=3.422000e-01 assign (segid " " and resid 121 and name HN) (segid " " and resid 121 and name HG21) 2.338 0.683 0.683 weight 1.000 ! spec=n15n...hn-6, no=35, id=22, vol=2.104800e+00 assign (segid " " and resid 121 and name HN) (segid " " and resid 119 and name HG21) 2.536 0.804 0.804 weight 1.000 ! spec=n15n...hn-6, no=36, id=23, vol=1.292500e+00 assign (segid " " and resid 121 and name HN) (segid " " and resid 140 and name HD21) 3.022 1.142 2.978 weight 1.000 ! spec=n15n...hn-6, no=37, id=24, vol=4.510000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 164 and name HN) 2.555 0.816 0.816 weight 1.000 ! spec=n15n...hn-6, no=39, id=25, vol=1.235900e+00 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HA) 2.911 1.059 1.059 weight 1.000 ! spec=n15n...hn-6, no=43, id=28, vol=5.650000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HA) 2.340 0.685 0.685 weight 1.000 ! spec=n15n...hn-6, no=45, id=30, vol=2.092800e+00 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HB2) 3.349 1.402 1.402 weight 1.000 ! spec=n15n...hn-6, no=46, id=31, vol=2.436000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HB2) 2.906 1.055 1.055 weight 1.000 ! spec=n15n...hn-6, no=47, id=32, vol=5.712000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 163 and name HB1) 2.790 0.973 0.973 weight 1.000 ! spec=n15n...hn-6, no=48, id=33, vol=7.293000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HA) 1.954 0.477 0.477 weight 1.000 ! spec=n15n...hn-6, no=51, id=34, vol=6.169000e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HA) 2.515 0.791 3.485 weight 1.000 ! spec=n15n...hn-6, no=52, id=35, vol=1.358100e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 189 and name HG2) 3.079 1.185 1.185 weight 1.000 ! spec=n15n...hn-6, no=53, id=36, vol=4.038000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HB2) 2.687 0.903 0.903 weight 1.000 ! spec=n15n...hn-6, no=54, id=37, vol=9.124000e-01 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HD2) 2.384 0.711 0.711 weight 1.000 ! spec=n15n...hn-6, no=56, id=39, vol=1.870500e+00 assign (segid " " and resid 190 and name HN) (segid " " and resid 190 and name HG2) 3.581 0.833 0.833 weight 1.000 ! spec=n15n...hn-6, no=57, id=40, vol=1.162100e+00 assign (segid " " and resid 186 and name HE1) (segid " " and resid 186 and name HZ2) 3.025 1.144 1.144 weight 1.000 ! spec=n15n...hn-6, no=63, id=44, vol=4.487000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 186 and name HD1) 2.642 0.872 0.872 weight 1.000 ! spec=n15n...hn-6, no=64, id=45, vol=1.010800e+00 assign (segid " " and resid 186 and name HE1) (segid " " and resid 188 and name HA) 4.355 2.407 1.407 weight 1.000 ! spec=n15n...hn-6, no=65, id=46, vol=2.410000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HB2) 2.982 1.112 1.112 weight 1.000 ! spec=n15n...hn-6, no=67, id=48, vol=4.885000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HB1) 3.378 1.426 1.426 weight 1.000 ! spec=n15n...hn-6, no=69, id=50, vol=2.313000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 168 and name HB2) 3.240 1.312 1.312 weight 1.000 ! spec=n15n...hn-6, no=70, id=51, vol=2.972000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 171 and name HD11) 3.351 1.404 1.404 weight 1.000 ! spec=n15n...hn-6, no=72, id=53, vol=2.426000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 148 and name HA) 3.263 1.331 1.331 weight 1.000 ! spec=n15n...hn-6, no=75, id=55, vol=2.848000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HA2) 2.687 0.902 0.902 weight 1.000 ! spec=n15n...hn-6, no=76, id=56, vol=9.143000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 152 and name HA) 2.757 0.950 0.950 weight 1.000 ! spec=n15n...hn-6, no=77, id=57, vol=7.821000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HA1) 3.161 1.249 1.249 weight 1.000 ! spec=n15n...hn-6, no=78, id=58, vol=3.446000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 152 and name HB1) 2.378 0.707 0.707 weight 1.000 ! spec=n15n...hn-6, no=80, id=60, vol=1.901500e+00 assign (segid " " and resid 152 and name HN) (segid " " and resid 150 and name HB1) 3.454 1.491 1.491 weight 1.000 ! spec=n15n...hn-6, no=82, id=62, vol=2.024000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 155 and name HD11) 5.299 1.360 1.360 weight 1.000 ! spec=n15n...hn-6, no=83, id=63, vol=2.667000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 188 and name HN) 3.180 1.264 1.264 weight 1.000 ! spec=n15n...hn-6, no=84, id=64, vol=3.323000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 186 and name HH2) 5.575 3.829 3.425 weight 1.000 ! spec=n15n...hn-6, no=85, id=65, vol=1.179600e+00 assign (segid " " and resid 187 and name HN) (segid " " and resid 186 and name HN) 3.390 1.437 1.437 weight 1.000 ! spec=n15n...hn-6, no=87, id=67, vol=2.263000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 186 and name HA) 2.282 0.651 0.651 weight 1.000 ! spec=n15n...hn-6, no=89, id=68, vol=2.435100e+00 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HA) 2.868 1.029 1.029 weight 1.000 ! spec=n15n...hn-6, no=91, id=70, vol=6.170000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 186 and name HB2) 3.364 1.415 1.415 weight 1.000 ! spec=n15n...hn-6, no=92, id=71, vol=2.371000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HB) 2.482 0.770 0.770 weight 1.000 ! spec=n15n...hn-6, no=95, id=74, vol=1.468700e+00 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HG12) 2.928 1.072 1.072 weight 1.000 ! spec=n15n...hn-6, no=96, id=75, vol=5.455000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HG11) 2.742 0.940 0.940 weight 1.000 ! spec=n15n...hn-6, no=97, id=76, vol=8.084000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 187 and name HD11) 2.728 0.930 3.272 weight 1.000 ! spec=n15n...hn-6, no=98, id=77, vol=8.335000e-01 assign (segid " " and resid 187 and name HN) (segid " " and resid 106 and name HD21) 2.871 1.030 1.030 weight 1.000 ! spec=n15n...hn-6, no=100, id=78, vol=6.138000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HA) 2.890 1.044 1.044 weight 1.000 ! spec=n15n...hn-6, no=105, id=82, vol=5.903000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HA) 2.533 0.802 3.467 weight 1.000 ! spec=n15n...hn-6, no=106, id=83, vol=1.301900e+00 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HG2) 3.007 1.130 2.993 weight 1.000 ! spec=n15n...hn-6, no=107, id=84, vol=4.653000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 98 and name HB2) 2.716 0.922 0.922 weight 1.000 ! spec=n15n...hn-6, no=108, id=85, vol=8.566000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HB) 3.144 1.235 1.235 weight 1.000 ! spec=n15n...hn-6, no=109, id=86, vol=3.562000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 103 and name HE1) 3.462 1.498 1.498 weight 1.000 ! spec=n15n...hn-6, no=120, id=90, vol=1.996000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HG2) 2.933 1.075 1.075 weight 1.000 ! spec=n15n...hn-6, no=125, id=95, vol=5.401000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HB2) 2.734 0.935 0.935 weight 1.000 ! spec=n15n...hn-6, no=126, id=96, vol=8.224000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 189 and name HB1) 2.566 0.823 0.823 weight 1.000 ! spec=n15n...hn-6, no=127, id=97, vol=1.204800e+00 assign (segid " " and resid 189 and name HN) (segid " " and resid 188 and name HB) 2.893 1.046 3.107 weight 1.000 ! spec=n15n...hn-6, no=128, id=98, vol=5.859000e-01 assign (segid " " and resid 189 and name HN) (segid " " and resid 188 and name HG21) 2.715 0.921 0.921 weight 1.000 ! spec=n15n...hn-6, no=130, id=100, vol=8.581000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 132 and name HA) 3.318 1.376 1.376 weight 1.000 ! spec=n15n...hn-6, no=131, id=101, vol=2.575000e-01 assign (segid " " and resid 133 and name HN) (segid " " and resid 131 and name HA) 2.667 0.889 3.333 weight 1.000 ! spec=n15n...hn-6, no=132, id=102, vol=9.544000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 164 and name HN) 2.967 1.100 3.033 weight 1.000 ! spec=n15n...hn-6, no=135, id=104, vol=5.038000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 166 and name HA) 3.225 1.300 2.775 weight 1.000 ! spec=n15n...hn-6, no=136, id=105, vol=3.055000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 164 and name HA) 2.223 0.618 0.618 weight 1.000 ! spec=n15n...hn-6, no=137, id=106, vol=2.847300e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HA) 2.634 0.867 0.867 weight 1.000 ! spec=n15n...hn-6, no=138, id=107, vol=1.029200e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HG2) 2.805 0.984 0.984 weight 1.000 ! spec=n15n...hn-6, no=139, id=108, vol=7.055000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 165 and name HB2) 2.334 0.681 0.681 weight 1.000 ! spec=n15n...hn-6, no=140, id=109, vol=2.124700e+00 assign (segid " " and resid 165 and name HN) (segid " " and resid 164 and name HD2) 3.273 1.339 1.339 weight 1.000 ! spec=n15n...hn-6, no=142, id=110, vol=2.794000e-01 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HB) 2.632 0.866 0.866 weight 1.000 ! spec=n15n...hn-6, no=149, id=113, vol=1.033000e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 187 and name HG11) 5.437 1.476 1.476 weight 1.000 ! spec=n15n...hn-6, no=150, id=114, vol=2.086000e-01 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HG21) 3.500 0.781 0.781 weight 1.000 ! spec=n15n...hn-6, no=152, id=116, vol=1.407800e+00 assign (segid " " and resid 142 and name HN) (segid " " and resid 139 and name HN) 3.059 1.170 2.941 weight 1.000 ! spec=n15n...hn-6, no=154, id=117, vol=4.192000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HA) 3.087 1.191 1.191 weight 1.000 ! spec=n15n...hn-6, no=156, id=119, vol=3.969000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HA) 2.828 0.999 0.999 weight 1.000 ! spec=n15n...hn-6, no=157, id=120, vol=6.724000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 139 and name HA) 3.333 1.388 1.388 weight 1.000 ! spec=n15n...hn-6, no=158, id=121, vol=2.509000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HB2) 2.597 0.843 0.843 weight 1.000 ! spec=n15n...hn-6, no=159, id=122, vol=1.120400e+00 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HG2) 3.465 1.501 1.501 weight 1.000 ! spec=n15n...hn-6, no=160, id=123, vol=1.986000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HB) 2.472 0.764 0.764 weight 1.000 ! spec=n15n...hn-6, no=161, id=124, vol=1.505600e+00 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HG12) 2.766 0.956 3.234 weight 1.000 ! spec=n15n...hn-6, no=162, id=125, vol=7.674000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 142 and name HD11) 2.552 0.814 0.814 weight 1.000 ! spec=n15n...hn-6, no=163, id=126, vol=1.243800e+00 assign (segid " " and resid 95 and name HN) (segid " " and resid 94 and name HA) 2.502 0.783 0.783 weight 1.000 ! spec=n15n...hn-6, no=166, id=128, vol=1.401100e+00 assign (segid " " and resid 96 and name HN) (segid " " and resid 95 and name HA) 2.336 0.682 0.682 weight 1.000 ! spec=n15n...hn-6, no=167, id=129, vol=2.115900e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 172 and name HN) 2.634 0.867 3.366 weight 1.000 ! spec=n15n...hn-6, no=176, id=135, vol=1.029200e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 174 and name HA) 2.295 0.658 0.658 weight 1.000 ! spec=n15n...hn-6, no=177, id=136, vol=2.352600e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 123 and name HB) 4.064 2.174 1.936 weight 1.000 ! spec=n15n...hn-6, no=179, id=138, vol=4.153000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 173 and name HB2) 2.700 0.911 0.911 weight 1.000 ! spec=n15n...hn-6, no=180, id=139, vol=8.872000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 123 and name HB) 4.246 1.317 1.317 weight 1.000 ! spec=n15n...hn-6, no=181, id=140, vol=2.941000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 174 and name HB1) 2.103 0.553 0.553 weight 1.000 ! spec=n15n...hn-6, no=182, id=141, vol=3.971100e+00 assign (segid " " and resid 174 and name HN) (segid " " and resid 175 and name HD11) 2.928 1.072 1.072 weight 1.000 ! spec=n15n...hn-6, no=184, id=143, vol=5.457000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 166 and name HN) 2.510 0.788 0.788 weight 1.000 ! spec=n15n...hn-6, no=185, id=144, vol=1.373400e+00 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HD1) 2.833 1.003 1.003 weight 1.000 ! spec=n15n...hn-6, no=187, id=145, vol=6.648000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 166 and name HA) 2.907 1.057 1.057 weight 1.000 ! spec=n15n...hn-6, no=189, id=147, vol=5.692000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HA) 2.648 0.876 0.876 weight 1.000 ! spec=n15n...hn-6, no=191, id=149, vol=9.975000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HB2) 2.788 0.972 0.972 weight 1.000 ! spec=n15n...hn-6, no=192, id=150, vol=7.312000e-01 assign (segid " " and resid 167 and name HN) (segid " " and resid 167 and name HB1) 2.633 0.867 0.867 weight 1.000 ! spec=n15n...hn-6, no=193, id=151, vol=1.031700e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 189 and name HA) 2.634 0.868 3.366 weight 1.000 ! spec=n15n...hn-6, no=200, id=158, vol=1.028100e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 188 and name HA) 2.712 0.919 0.919 weight 1.000 ! spec=n15n...hn-6, no=201, id=159, vol=8.638000e-01 assign (segid " " and resid 188 and name HN) (segid " " and resid 187 and name HA) 2.092 0.547 0.547 weight 1.000 ! spec=n15n...hn-6, no=202, id=160, vol=4.106200e+00 assign (segid " " and resid 188 and name HN) (segid " " and resid 172 and name HB1) 3.186 1.269 1.269 weight 1.000 ! spec=n15n...hn-6, no=203, id=161, vol=3.284000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 110 and name HN) 2.501 0.782 0.782 weight 1.000 ! spec=n15n...hn-6, no=207, id=164, vol=1.404200e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 113 and name HN) 3.060 1.171 2.940 weight 1.000 ! spec=n15n...hn-6, no=209, id=166, vol=4.186000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 110 and name HA) 3.009 1.132 1.132 weight 1.000 ! spec=n15n...hn-6, no=213, id=168, vol=4.634000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 112 and name HD1) 2.517 0.792 0.792 weight 1.000 ! spec=n15n...hn-6, no=215, id=170, vol=1.353200e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 112 and name HD2) 2.520 0.794 0.794 weight 1.000 ! spec=n15n...hn-6, no=216, id=171, vol=1.342100e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 111 and name HB2) 2.924 1.069 1.069 weight 1.000 ! spec=n15n...hn-6, no=217, id=172, vol=5.495000e-01 assign (segid " " and resid 111 and name HN) (segid " " and resid 111 and name HG2) 2.264 0.641 3.736 weight 1.000 ! spec=n15n...hn-6, no=218, id=173, vol=2.551000e+00 assign (segid " " and resid 111 and name HN) (segid " " and resid 112 and name HG1) 3.371 1.421 1.421 weight 1.000 ! spec=n15n...hn-6, no=219, id=174, vol=2.342000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 181 and name HA) 3.106 1.206 1.206 weight 1.000 ! spec=n15n...hn-6, no=223, id=177, vol=3.825000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HB1) 2.952 1.090 1.090 weight 1.000 ! spec=n15n...hn-6, no=224, id=178, vol=5.189000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HB2) 3.015 1.136 1.136 weight 1.000 ! spec=n15n...hn-6, no=225, id=179, vol=4.578000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 115 and name HN) 2.864 1.025 1.025 weight 1.000 ! spec=n15n...hn-6, no=227, id=180, vol=6.227000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 182 and name HE1) 3.237 1.310 1.310 weight 1.000 ! spec=n15n...hn-6, no=229, id=182, vol=2.988000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HD1) 3.334 1.389 1.389 weight 1.000 ! spec=n15n...hn-6, no=230, id=183, vol=2.504000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HA) 3.214 1.291 1.291 weight 1.000 ! spec=n15n...hn-6, no=231, id=184, vol=3.121000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 112 and name HD1) 3.160 1.248 1.248 weight 1.000 ! spec=n15n...hn-6, no=232, id=185, vol=3.450000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HA) 2.930 1.073 1.073 weight 1.000 ! spec=n15n...hn-6, no=233, id=186, vol=5.432000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 114 and name HB2) 2.702 0.912 0.912 weight 1.000 ! spec=n15n...hn-6, no=234, id=187, vol=8.841000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HB1) 3.179 1.263 1.263 weight 1.000 ! spec=n15n...hn-6, no=236, id=189, vol=3.333000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 167 and name HN) 3.348 1.401 1.401 weight 1.000 ! spec=n15n...hn-6, no=240, id=191, vol=2.442000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 167 and name HD1) 3.226 1.301 1.301 weight 1.000 ! spec=n15n...hn-6, no=241, id=192, vol=3.050000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 163 and name HA) 2.813 0.989 0.989 weight 1.000 ! spec=n15n...hn-6, no=243, id=193, vol=6.944000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HA) 2.758 0.951 0.951 weight 1.000 ! spec=n15n...hn-6, no=244, id=194, vol=7.805000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 162 and name HB1) 3.476 1.510 1.510 weight 1.000 ! spec=n15n...hn-6, no=245, id=195, vol=1.950000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HB2) 2.590 0.839 0.839 weight 1.000 ! spec=n15n...hn-6, no=246, id=196, vol=1.138200e+00 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HD2) 3.027 1.146 1.146 weight 1.000 ! spec=n15n...hn-6, no=248, id=198, vol=4.465000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HG2) 2.829 1.000 1.000 weight 1.000 ! spec=n15n...hn-6, no=249, id=199, vol=6.710000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 174 and name HN) 3.049 1.162 2.951 weight 1.000 ! spec=n15n...hn-6, no=250, id=200, vol=4.279000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HN) 2.703 0.913 0.913 weight 1.000 ! spec=n15n...hn-6, no=251, id=201, vol=8.810000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 179 and name HN) 2.621 0.859 0.859 weight 1.000 ! spec=n15n...hn-6, no=253, id=202, vol=1.060300e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 178 and name HA) 3.460 1.497 2.540 weight 1.000 ! spec=n15n...hn-6, no=256, id=205, vol=2.002000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HA) 2.506 0.785 0.785 weight 1.000 ! spec=n15n...hn-6, no=257, id=206, vol=1.386600e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HG2) 3.408 1.452 1.452 weight 1.000 ! spec=n15n...hn-6, no=258, id=207, vol=2.194000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 176 and name HG1) 2.808 0.986 0.986 weight 1.000 ! spec=n15n...hn-6, no=259, id=208, vol=7.008000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 178 and name HB1) 3.328 1.385 1.385 weight 1.000 ! spec=n15n...hn-6, no=261, id=210, vol=2.528000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HB2) 2.245 0.630 0.630 weight 1.000 ! spec=n15n...hn-6, no=262, id=211, vol=2.681300e+00 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HG1) 2.826 0.998 0.998 weight 1.000 ! spec=n15n...hn-6, no=264, id=213, vol=6.747000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 177 and name HD2) 3.298 1.360 1.360 weight 1.000 ! spec=n15n...hn-6, no=265, id=214, vol=2.669000e-01 assign (segid " " and resid 98 and name HN) (segid " " and resid 97 and name HN) 2.933 1.075 1.075 weight 1.000 ! spec=n15n...hn-6, no=267, id=216, vol=5.404000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HN) 2.915 1.062 1.062 weight 1.000 ! spec=n15n...hn-6, no=268, id=217, vol=5.603000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HA) 2.094 0.548 3.906 weight 1.000 ! spec=n15n...hn-6, no=271, id=218, vol=4.078100e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HA) 2.579 0.832 0.832 weight 1.000 ! spec=n15n...hn-6, no=272, id=219, vol=1.167600e+00 assign (segid " " and resid 167 and name HN) (segid " " and resid 165 and name HA) 3.324 1.381 1.381 weight 1.000 ! spec=n15n...hn-6, no=273, id=220, vol=2.547000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 98 and name HB2) 3.368 1.418 1.418 weight 1.000 ! spec=n15n...hn-6, no=274, id=221, vol=2.354000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HB) 2.296 0.659 0.659 weight 1.000 ! spec=n15n...hn-6, no=275, id=222, vol=2.344300e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HB2) 2.381 0.709 3.619 weight 1.000 ! spec=n15n...hn-6, no=276, id=223, vol=1.885100e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HG12) 2.589 0.838 0.838 weight 1.000 ! spec=n15n...hn-6, no=278, id=225, vol=1.140100e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 96 and name HG1) 3.194 1.275 1.275 weight 1.000 ! spec=n15n...hn-6, no=280, id=227, vol=3.240000e-01 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HG11) 2.642 0.872 0.872 weight 1.000 ! spec=n15n...hn-6, no=281, id=228, vol=1.011000e+00 assign (segid " " and resid 97 and name HN) (segid " " and resid 97 and name HD11) 2.606 0.849 0.849 weight 1.000 ! spec=n15n...hn-6, no=282, id=229, vol=1.096800e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 152 and name HN) 3.337 1.392 1.392 weight 1.000 ! spec=n15n...hn-6, no=283, id=230, vol=2.488000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 151 and name HN) 2.239 0.627 0.627 weight 1.000 ! spec=n15n...hn-6, no=285, id=232, vol=2.726000e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 147 and name HA2) 3.069 1.177 2.931 weight 1.000 ! spec=n15n...hn-6, no=287, id=233, vol=4.114000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HA) 2.682 0.899 0.899 weight 1.000 ! spec=n15n...hn-6, no=288, id=234, vol=9.239000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HA) 2.339 0.684 0.684 weight 1.000 ! spec=n15n...hn-6, no=289, id=235, vol=2.099100e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HB2) 2.538 0.805 0.805 weight 1.000 ! spec=n15n...hn-6, no=290, id=236, vol=1.286200e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 149 and name HB1) 2.647 0.876 3.353 weight 1.000 ! spec=n15n...hn-6, no=291, id=237, vol=9.995000e-01 assign (segid " " and resid 150 and name HN) (segid " " and resid 150 and name HB1) 2.023 0.512 0.512 weight 1.000 ! spec=n15n...hn-6, no=292, id=238, vol=5.016200e+00 assign (segid " " and resid 150 and name HN) (segid " " and resid 142 and name HG21) 3.079 1.185 1.185 weight 1.000 ! spec=n15n...hn-6, no=293, id=239, vol=4.032000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HA) 2.737 0.936 0.936 weight 1.000 ! spec=n15n...hn-6, no=298, id=243, vol=8.179000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HA) 2.892 1.045 1.045 weight 1.000 ! spec=n15n...hn-6, no=299, id=244, vol=5.876000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HB2) 2.542 0.808 0.808 weight 1.000 ! spec=n15n...hn-6, no=301, id=246, vol=1.273400e+00 assign (segid " " and resid 186 and name HN) (segid " " and resid 186 and name HB1) 2.693 0.906 0.906 weight 1.000 ! spec=n15n...hn-6, no=302, id=247, vol=9.020000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HG) 2.977 1.108 1.108 weight 1.000 ! spec=n15n...hn-6, no=303, id=248, vol=4.934000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HD21) 3.383 1.430 1.430 weight 1.000 ! spec=n15n...hn-6, no=304, id=249, vol=2.295000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 144 and name HN) 2.998 1.124 1.124 weight 1.000 ! spec=n15n...hn-6, no=310, id=254, vol=4.731000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 147 and name HA2) 3.120 1.217 2.880 weight 1.000 ! spec=n15n...hn-6, no=312, id=256, vol=3.724000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HA) 2.736 0.936 0.936 weight 1.000 ! spec=n15n...hn-6, no=313, id=257, vol=8.196000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HA) 2.958 1.094 1.094 weight 1.000 ! spec=n15n...hn-6, no=314, id=258, vol=5.129000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HB) 2.807 0.985 0.985 weight 1.000 ! spec=n15n...hn-6, no=315, id=259, vol=7.030000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 142 and name HA) 3.099 1.200 1.200 weight 1.000 ! spec=n15n...hn-6, no=317, id=261, vol=3.883000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HB2) 2.687 0.903 0.903 weight 1.000 ! spec=n15n...hn-6, no=318, id=262, vol=9.129000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HB1) 2.528 0.799 3.472 weight 1.000 ! spec=n15n...hn-6, no=319, id=263, vol=1.315500e+00 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HD2) 3.125 1.220 2.875 weight 1.000 ! spec=n15n...hn-6, no=320, id=264, vol=3.693000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HD1) 2.812 0.989 0.989 weight 1.000 ! spec=n15n...hn-6, no=321, id=265, vol=6.950000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 146 and name HG2) 2.876 1.034 1.034 weight 1.000 ! spec=n15n...hn-6, no=322, id=266, vol=6.070000e-01 assign (segid " " and resid 146 and name HN) (segid " " and resid 142 and name HG21) 2.977 1.108 1.108 weight 1.000 ! spec=n15n...hn-6, no=324, id=268, vol=4.934000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 106 and name HN) 3.208 1.286 1.286 weight 1.000 ! spec=n15n...hn-6, no=328, id=271, vol=3.156000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 167 and name HZ2) 3.480 1.514 1.514 weight 1.000 ! spec=n15n...hn-6, no=330, id=273, vol=1.935000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 103 and name HA) 2.771 0.960 0.960 weight 1.000 ! spec=n15n...hn-6, no=331, id=274, vol=7.589000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HA) 3.082 1.188 1.188 weight 1.000 ! spec=n15n...hn-6, no=332, id=275, vol=4.008000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HD2) 3.471 1.506 1.506 weight 1.000 ! spec=n15n...hn-6, no=333, id=276, vol=1.965000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 103 and name HB2) 3.512 1.542 1.542 weight 1.000 ! spec=n15n...hn-6, no=334, id=277, vol=1.831000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HB2) 2.841 1.009 1.009 weight 1.000 ! spec=n15n...hn-6, no=336, id=279, vol=6.540000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HB1) 2.926 1.070 1.070 weight 1.000 ! spec=n15n...hn-6, no=338, id=281, vol=5.476000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 104 and name HG2) 2.791 0.974 3.209 weight 1.000 ! spec=n15n...hn-6, no=339, id=282, vol=7.265000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 168 and name HB2) 3.306 1.366 2.694 weight 1.000 ! spec=n15n...hn-6, no=340, id=283, vol=2.635000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 100 and name HN) 2.683 0.900 0.900 weight 1.000 ! spec=n15n...hn-6, no=344, id=285, vol=9.224000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HN) 2.548 0.812 0.812 weight 1.000 ! spec=n15n...hn-6, no=346, id=287, vol=1.255300e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HA) 3.141 1.234 1.234 weight 1.000 ! spec=n15n...hn-6, no=347, id=288, vol=3.577000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 98 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=n15n...hn-6, no=348, id=289, vol=1.134200e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HA) 2.441 0.745 0.745 weight 1.000 ! spec=n15n...hn-6, no=349, id=290, vol=1.623900e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HB2) 2.516 0.791 0.791 weight 1.000 ! spec=n15n...hn-6, no=350, id=291, vol=1.356500e+00 assign (segid " " and resid 155 and name HN) (segid " " and resid 154 and name HB2) 2.809 0.986 0.986 weight 1.000 ! spec=n15n...hn-6, no=353, id=294, vol=6.996000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 101 and name HB2) 2.984 1.113 1.113 weight 1.000 ! spec=n15n...hn-6, no=354, id=295, vol=4.865000e-01 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HB2) 2.455 0.753 0.753 weight 1.000 ! spec=n15n...hn-6, no=355, id=296, vol=1.569900e+00 assign (segid " " and resid 99 and name HN) (segid " " and resid 99 and name HG2) 3.062 1.172 1.172 weight 1.000 ! spec=n15n...hn-6, no=359, id=300, vol=4.172000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 155 and name HB1) 2.533 0.802 0.802 weight 1.000 ! spec=n15n...hn-6, no=360, id=301, vol=1.302500e+00 assign (segid " " and resid 99 and name HN) (segid " " and resid 97 and name HG21) 3.346 1.399 1.399 weight 1.000 ! spec=n15n...hn-6, no=364, id=305, vol=2.451000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 141 and name HN) 2.558 0.818 0.818 weight 1.000 ! spec=n15n...hn-6, no=365, id=306, vol=1.225800e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 139 and name HN) 2.949 1.087 1.087 weight 1.000 ! spec=n15n...hn-6, no=366, id=307, vol=5.226000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HA) 2.370 0.702 0.702 weight 1.000 ! spec=n15n...hn-6, no=368, id=308, vol=1.937200e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HA) 2.765 0.955 0.955 weight 1.000 ! spec=n15n...hn-6, no=369, id=309, vol=7.699000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HG1) 2.756 0.949 3.244 weight 1.000 ! spec=n15n...hn-6, no=370, id=310, vol=7.851000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HB2) 2.061 0.531 0.531 weight 1.000 ! spec=n15n...hn-6, no=371, id=311, vol=4.484800e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HB2) 2.569 0.825 0.825 weight 1.000 ! spec=n15n...hn-6, no=372, id=312, vol=1.196800e+00 assign (segid " " and resid 141 and name HN) (segid " " and resid 140 and name HB1) 2.792 0.974 0.974 weight 1.000 ! spec=n15n...hn-6, no=374, id=314, vol=7.261000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 107 and name HN) 2.676 0.895 0.895 weight 1.000 ! spec=n15n...hn-6, no=377, id=317, vol=9.359000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 160 and name HN) 2.580 0.832 0.832 weight 1.000 ! spec=n15n...hn-6, no=378, id=318, vol=1.166200e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 139 and name HN) 2.525 0.797 0.797 weight 1.000 ! spec=n15n...hn-6, no=380, id=320, vol=1.327400e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 137 and name HN) 2.462 0.757 0.757 weight 1.000 ! spec=n15n...hn-6, no=384, id=322, vol=1.544700e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HA) 2.506 0.785 0.785 weight 1.000 ! spec=n15n...hn-6, no=387, id=323, vol=1.386300e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HA) 2.915 1.062 1.062 weight 1.000 ! spec=n15n...hn-6, no=388, id=324, vol=5.599000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HA) 2.407 0.724 0.724 weight 1.000 ! spec=n15n...hn-6, no=389, id=325, vol=1.769500e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 137 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=n15n...hn-6, no=391, id=327, vol=6.213000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HA) 2.840 1.008 1.008 weight 1.000 ! spec=n15n...hn-6, no=392, id=328, vol=6.551000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 158 and name HB1) 3.117 1.215 1.215 weight 1.000 ! spec=n15n...hn-6, no=394, id=330, vol=3.746000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HB2) 2.457 0.755 0.755 weight 1.000 ! spec=n15n...hn-6, no=395, id=331, vol=1.561600e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HG2) 2.575 0.829 3.425 weight 1.000 ! spec=n15n...hn-6, no=396, id=332, vol=1.179200e+00 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HB2) 2.203 0.607 3.797 weight 1.000 ! spec=n15n...hn-6, no=398, id=334, vol=3.008100e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HB1) 2.416 0.730 0.730 weight 1.000 ! spec=n15n...hn-6, no=399, id=335, vol=1.728100e+00 assign (segid " " and resid 159 and name HN) (segid " " and resid 160 and name HB2) 5.119 3.216 1.216 weight 1.000 ! spec=n15n...hn-6, no=400, id=336, vol=3.735000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 138 and name HB1) 2.106 0.555 0.555 weight 1.000 ! spec=n15n...hn-6, no=401, id=337, vol=3.935000e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HG) 2.350 0.690 3.650 weight 1.000 ! spec=n15n...hn-6, no=403, id=339, vol=2.040300e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HD11) 2.936 1.077 3.064 weight 1.000 ! spec=n15n...hn-6, no=404, id=340, vol=5.369000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HB2) 2.671 0.892 0.892 weight 1.000 ! spec=n15n...hn-6, no=406, id=342, vol=9.469000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 106 and name HD21) 3.039 1.154 2.961 weight 1.000 ! spec=n15n...hn-6, no=409, id=345, vol=4.363000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 131 and name HD21) 3.327 1.383 1.383 weight 1.000 ! spec=n15n...hn-6, no=410, id=346, vol=2.536000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 107 and name HD12) 3.367 1.417 1.417 weight 1.000 ! spec=n15n...hn-6, no=411, id=347, vol=2.361000e-01 or (segid " " and resid 159 and name HN) (segid " " and resid 107 and name HD11) or (segid " " and resid 159 and name HN) (segid " " and resid 107 and name HD13) assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HD21) 4.674 2.894 0.894 weight 1.000 ! spec=n15n...hn-6, no=412, id=348, vol=9.404000e-01 assign (segid " " and resid 159 and name HN) (segid " " and resid 159 and name HB1) 2.959 1.095 1.095 weight 1.000 ! spec=n15n...hn-6, no=413, id=349, vol=5.117000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 129 and name HN) 3.258 1.327 1.327 weight 1.000 ! spec=n15n...hn-6, no=414, id=350, vol=2.872000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 132 and name HN) 3.293 1.356 1.356 weight 1.000 ! spec=n15n...hn-6, no=415, id=351, vol=2.695000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HN) 2.152 0.579 0.579 weight 1.000 ! spec=n15n...hn-6, no=416, id=352, vol=3.457300e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 128 and name HN) 3.206 1.285 1.285 weight 1.000 ! spec=n15n...hn-6, no=418, id=354, vol=3.163000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HA) 2.572 0.827 0.827 weight 1.000 ! spec=n15n...hn-6, no=420, id=355, vol=1.188300e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HA) 2.782 0.967 0.967 weight 1.000 ! spec=n15n...hn-6, no=421, id=356, vol=7.413000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 129 and name HA) 3.171 1.257 1.257 weight 1.000 ! spec=n15n...hn-6, no=422, id=357, vol=3.379000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 128 and name HA) 2.884 1.040 1.040 weight 1.000 ! spec=n15n...hn-6, no=423, id=358, vol=5.975000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HB2) 3.019 1.139 1.139 weight 1.000 ! spec=n15n...hn-6, no=424, id=359, vol=4.542000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 130 and name HB1) 2.937 1.078 1.078 weight 1.000 ! spec=n15n...hn-6, no=425, id=360, vol=5.356000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HB2) 2.347 0.688 0.688 weight 1.000 ! spec=n15n...hn-6, no=426, id=361, vol=2.058800e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 131 and name HB1) 2.484 0.771 0.771 weight 1.000 ! spec=n15n...hn-6, no=427, id=362, vol=1.463100e+00 assign (segid " " and resid 131 and name HN) (segid " " and resid 127 and name HD11) 3.052 1.164 1.164 weight 1.000 ! spec=n15n...hn-6, no=428, id=363, vol=4.253000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 184 and name HN) 2.927 1.071 1.071 weight 1.000 ! spec=n15n...hn-6, no=430, id=365, vol=5.462000e-01 assign (segid " " and resid 186 and name HN) (segid " " and resid 185 and name HB1) 3.122 1.218 1.218 weight 1.000 ! spec=n15n...hn-6, no=432, id=367, vol=3.714000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 167 and name HA) 3.205 1.284 1.284 weight 1.000 ! spec=n15n...hn-6, no=436, id=370, vol=3.173000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HA) 2.717 0.923 0.923 weight 1.000 ! spec=n15n...hn-6, no=437, id=371, vol=8.544000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HA) 2.968 1.101 1.101 weight 1.000 ! spec=n15n...hn-6, no=438, id=372, vol=5.025000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HG1) 1.501 0.182 0.782 weight 1.000 ! spec=n15n...hn-6, no=439, id=373, vol=1.405000e+00 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HG2) 3.648 0.876 0.876 weight 1.000 ! spec=n15n...hn-6, no=440, id=374, vol=9.977000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HB2) 3.498 1.780 1.502 weight 1.000 ! spec=n15n...hn-6, no=441, id=375, vol=1.415600e+00 assign (segid " " and resid 170 and name HN) (segid " " and resid 170 and name HB1) 2.610 0.851 0.851 weight 1.000 ! spec=n15n...hn-6, no=442, id=376, vol=1.087900e+00 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HG1) 3.350 1.402 1.402 weight 1.000 ! spec=n15n...hn-6, no=443, id=377, vol=2.434000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 173 and name HD11) 3.326 1.383 1.383 weight 1.000 ! spec=n15n...hn-6, no=445, id=379, vol=2.540000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 142 and name HN) 3.357 1.408 1.408 weight 1.000 ! spec=n15n...hn-6, no=446, id=380, vol=2.403000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=n15n...hn-6, no=452, id=385, vol=1.697600e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HA) 3.322 1.379 1.379 weight 1.000 ! spec=n15n...hn-6, no=453, id=386, vol=2.558000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 141 and name HB2) 3.318 1.376 1.376 weight 1.000 ! spec=n15n...hn-6, no=454, id=387, vol=2.577000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 138 and name HB1) 3.177 1.262 2.823 weight 1.000 ! spec=n15n...hn-6, no=455, id=388, vol=3.344000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HB) 2.180 0.594 0.594 weight 1.000 ! spec=n15n...hn-6, no=456, id=389, vol=3.201600e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HB2) 2.322 0.674 0.674 weight 1.000 ! spec=n15n...hn-6, no=457, id=390, vol=2.191400e+00 assign (segid " " and resid 140 and name HN) (segid " " and resid 140 and name HB1) 2.656 0.882 0.882 weight 1.000 ! spec=n15n...hn-6, no=458, id=391, vol=9.786000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HG21) 2.744 0.941 0.941 weight 1.000 ! spec=n15n...hn-6, no=460, id=393, vol=8.045000e-01 assign (segid " " and resid 138 and name HN) (segid " " and resid 140 and name HN) 3.006 1.130 1.130 weight 1.000 ! spec=n15n...hn-6, no=461, id=394, vol=4.656000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 152 and name HN) 3.477 1.512 1.512 weight 1.000 ! spec=n15n...hn-6, no=462, id=395, vol=1.944000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 156 and name HN) 3.037 1.153 1.153 weight 1.000 ! spec=n15n...hn-6, no=464, id=397, vol=4.379000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 122 and name HN) 2.872 1.031 1.031 weight 1.000 ! spec=n15n...hn-6, no=466, id=398, vol=6.129000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HN) 2.355 0.693 0.693 weight 1.000 ! spec=n15n...hn-6, no=467, id=399, vol=2.015700e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 114 and name HE1) 3.454 1.491 2.546 weight 1.000 ! spec=n15n...hn-6, no=468, id=400, vol=2.024000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HA) 3.120 1.217 1.217 weight 1.000 ! spec=n15n...hn-6, no=469, id=401, vol=3.726000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 151 and name HA2) 3.295 1.357 1.357 weight 1.000 ! spec=n15n...hn-6, no=470, id=402, vol=2.688000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 154 and name HA) 2.440 0.744 0.744 weight 1.000 ! spec=n15n...hn-6, no=471, id=403, vol=1.628000e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 124 and name HA) 2.437 0.742 0.742 weight 1.000 ! spec=n15n...hn-6, no=472, id=404, vol=1.642000e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 152 and name HA) 3.014 1.135 1.135 weight 1.000 ! spec=n15n...hn-6, no=473, id=405, vol=4.588000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 151 and name HA1) 3.072 1.180 1.180 weight 1.000 ! spec=n15n...hn-6, no=474, id=406, vol=4.086000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HG2) 3.297 1.358 1.358 weight 1.000 ! spec=n15n...hn-6, no=476, id=408, vol=2.678000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 124 and name HB) 2.264 0.641 0.641 weight 1.000 ! spec=n15n...hn-6, no=478, id=410, vol=2.553900e+00 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HB2) 2.207 0.609 0.609 weight 1.000 ! spec=n15n...hn-6, no=479, id=411, vol=2.972800e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 127 and name HB2) 2.951 1.089 1.089 weight 1.000 ! spec=n15n...hn-6, no=481, id=413, vol=5.204000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 155 and name HB1) 2.562 0.821 3.438 weight 1.000 ! spec=n15n...hn-6, no=482, id=414, vol=1.214300e+00 assign (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HD12) 3.382 1.430 1.430 weight 1.000 ! spec=n15n...hn-6, no=485, id=417, vol=2.297000e-01 or (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HD11) or (segid " " and resid 124 and name HN) (segid " " and resid 123 and name HD13) assign (segid " " and resid 119 and name HN) (segid " " and resid 118 and name HN) 3.117 1.214 2.883 weight 1.000 ! spec=n15n...hn-6, no=486, id=418, vol=3.749000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 115 and name HN) 3.016 1.137 2.984 weight 1.000 ! spec=n15n...hn-6, no=487, id=419, vol=4.563000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 116 and name HN) 3.444 1.483 1.483 weight 1.000 ! spec=n15n...hn-6, no=492, id=422, vol=2.060000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 123 and name HN) 2.443 0.746 0.746 weight 1.000 ! spec=n15n...hn-6, no=493, id=423, vol=1.618800e+00 assign (segid " " and resid 121 and name HN) (segid " " and resid 122 and name HN) 2.561 0.820 0.820 weight 1.000 ! spec=n15n...hn-6, no=494, id=424, vol=1.217700e+00 assign (segid " " and resid 122 and name HN) (segid " " and resid 123 and name HA) 2.952 1.089 3.048 weight 1.000 ! spec=n15n...hn-6, no=495, id=425, vol=5.199000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HA) 2.793 0.975 0.975 weight 1.000 ! spec=n15n...hn-6, no=497, id=427, vol=7.234000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 122 and name HA) 2.708 0.917 0.917 weight 1.000 ! spec=n15n...hn-6, no=498, id=428, vol=8.712000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 121 and name HA) 3.048 1.161 1.161 weight 1.000 ! spec=n15n...hn-6, no=501, id=431, vol=4.289000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HA) 2.804 0.983 0.983 weight 1.000 ! spec=n15n...hn-6, no=502, id=432, vol=7.066000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 121 and name HB) 2.826 0.998 3.174 weight 1.000 ! spec=n15n...hn-6, no=503, id=433, vol=6.754000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 114 and name HA) 3.506 1.536 1.536 weight 1.000 ! spec=n15n...hn-6, no=504, id=434, vol=1.851000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 122 and name HB2) 2.271 0.645 0.645 weight 1.000 ! spec=n15n...hn-6, no=506, id=436, vol=2.506300e+00 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HB2) 3.084 1.189 1.189 weight 1.000 ! spec=n15n...hn-6, no=507, id=437, vol=3.996000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HG2) 2.987 1.115 1.115 weight 1.000 ! spec=n15n...hn-6, no=508, id=438, vol=4.837000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 124 and name HB) 3.227 1.301 1.301 weight 1.000 ! spec=n15n...hn-6, no=509, id=439, vol=3.046000e-01 assign (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HB) 3.224 1.299 1.299 weight 1.000 ! spec=n15n...hn-6, no=510, id=440, vol=3.063000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 117 and name HB1) 2.876 1.034 1.034 weight 1.000 ! spec=n15n...hn-6, no=511, id=441, vol=6.068000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HB) 2.306 0.664 0.664 weight 1.000 ! spec=n15n...hn-6, no=512, id=442, vol=2.288800e+00 assign (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HG22) 3.261 1.329 1.329 weight 1.000 ! spec=n15n...hn-6, no=514, id=444, vol=2.859000e-01 or (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HG21) or (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HG23) assign (segid " " and resid 122 and name HN) (segid " " and resid 119 and name HG21) 2.491 0.776 0.776 weight 1.000 ! spec=n15n...hn-6, no=516, id=446, vol=1.439200e+00 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG21) 2.723 0.927 3.277 weight 1.000 ! spec=n15n...hn-6, no=517, id=447, vol=8.431000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG12) 2.734 0.934 3.266 weight 1.000 ! spec=n15n...hn-6, no=518, id=448, vol=8.227000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HD11) 2.859 1.022 3.141 weight 1.000 ! spec=n15n...hn-6, no=519, id=449, vol=6.298000e-01 assign (segid " " and resid 118 and name HN) (segid " " and resid 118 and name HG11) 3.014 1.135 1.135 weight 1.000 ! spec=n15n...hn-6, no=520, id=450, vol=4.589000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 171 and name HN) 2.753 0.947 0.947 weight 1.000 ! spec=n15n...hn-6, no=522, id=451, vol=7.904000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 169 and name HN) 3.277 1.343 1.343 weight 1.000 ! spec=n15n...hn-6, no=525, id=454, vol=2.774000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HA) 2.674 0.894 0.894 weight 1.000 ! spec=n15n...hn-6, no=526, id=455, vol=9.410000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 168 and name HA) 3.240 1.312 1.312 weight 1.000 ! spec=n15n...hn-6, no=527, id=456, vol=2.973000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HB2) 2.565 0.822 0.822 weight 1.000 ! spec=n15n...hn-6, no=528, id=457, vol=1.207900e+00 assign (segid " " and resid 171 and name HN) (segid " " and resid 170 and name HB1) 2.874 1.032 1.032 weight 1.000 ! spec=n15n...hn-6, no=529, id=458, vol=6.104000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HB1) 2.690 0.905 0.905 weight 1.000 ! spec=n15n...hn-6, no=530, id=459, vol=9.064000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HG) 3.371 1.421 1.421 weight 1.000 ! spec=n15n...hn-6, no=531, id=460, vol=2.342000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HD21) 2.977 1.108 3.023 weight 1.000 ! spec=n15n...hn-6, no=532, id=461, vol=4.936000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 171 and name HD11) 3.281 1.346 1.346 weight 1.000 ! spec=n15n...hn-6, no=533, id=462, vol=2.754000e-01 assign (segid " " and resid 140 and name HN) (segid " " and resid 139 and name HN) 2.530 0.800 0.800 weight 1.000 ! spec=n15n...hn-6, no=534, id=463, vol=1.310500e+00 assign (segid " " and resid 139 and name HN) (segid " " and resid 136 and name HN) 3.449 1.487 1.487 weight 1.000 ! spec=n15n...hn-6, no=535, id=464, vol=2.043000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 135 and name HA) 3.105 1.205 1.205 weight 1.000 ! spec=n15n...hn-6, no=537, id=466, vol=3.833000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 137 and name HA) 3.070 1.178 2.930 weight 1.000 ! spec=n15n...hn-6, no=538, id=467, vol=4.108000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HA) 2.808 0.985 0.985 weight 1.000 ! spec=n15n...hn-6, no=539, id=468, vol=7.017000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 138 and name HB1) 2.729 0.931 0.931 weight 1.000 ! spec=n15n...hn-6, no=541, id=470, vol=8.328000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HB) 2.248 0.632 0.632 weight 1.000 ! spec=n15n...hn-6, no=542, id=471, vol=2.665600e+00 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HG12) 2.414 0.728 3.586 weight 1.000 ! spec=n15n...hn-6, no=543, id=472, vol=1.736900e+00 assign (segid " " and resid 139 and name HN) (segid " " and resid 139 and name HD11) 2.528 0.799 0.799 weight 1.000 ! spec=n15n...hn-6, no=544, id=473, vol=1.316300e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 106 and name HN) 3.263 1.331 1.331 weight 1.000 ! spec=n15n...hn-6, no=546, id=474, vol=2.848000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 186 and name HH2) 2.728 0.930 3.272 weight 1.000 ! spec=n15n...hn-6, no=547, id=475, vol=8.334000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HA) 2.512 0.789 0.789 weight 1.000 ! spec=n15n...hn-6, no=549, id=477, vol=1.366800e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HD2) 3.446 1.485 1.485 weight 1.000 ! spec=n15n...hn-6, no=551, id=479, vol=2.051000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HB1) 3.234 1.307 1.307 weight 1.000 ! spec=n15n...hn-6, no=552, id=480, vol=3.005000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HB2) 2.212 0.611 3.788 weight 1.000 ! spec=n15n...hn-6, no=553, id=481, vol=2.936400e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 109 and name HG1) 2.438 0.743 0.743 weight 1.000 ! spec=n15n...hn-6, no=554, id=482, vol=1.637100e+00 assign (segid " " and resid 109 and name HN) (segid " " and resid 108 and name HD2) 3.279 1.344 2.721 weight 1.000 ! spec=n15n...hn-6, no=556, id=484, vol=2.766000e-01 assign (segid " " and resid 109 and name HN) (segid " " and resid 110 and name HD11) 3.349 1.402 1.402 weight 1.000 ! spec=n15n...hn-6, no=557, id=485, vol=2.437000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 125 and name HN) 2.446 0.748 0.748 weight 1.000 ! spec=n15n...hn-6, no=558, id=486, vol=1.605600e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 174 and name HN) 3.064 1.173 2.936 weight 1.000 ! spec=n15n...hn-6, no=559, id=487, vol=4.158000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HA) 2.423 0.734 0.734 weight 1.000 ! spec=n15n...hn-6, no=564, id=491, vol=1.700100e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 122 and name HA) 3.432 1.472 2.568 weight 1.000 ! spec=n15n...hn-6, no=565, id=492, vol=2.104000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 125 and name HA) 2.899 1.050 1.050 weight 1.000 ! spec=n15n...hn-6, no=567, id=494, vol=5.793000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 125 and name HB2) 2.541 0.807 0.807 weight 1.000 ! spec=n15n...hn-6, no=568, id=495, vol=1.275700e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 124 and name HA) 3.264 1.331 1.331 weight 1.000 ! spec=n15n...hn-6, no=569, id=496, vol=2.845000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HB2) 2.605 0.848 0.848 weight 1.000 ! spec=n15n...hn-6, no=570, id=497, vol=1.099200e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 126 and name HB1) 2.329 0.678 0.678 weight 1.000 ! spec=n15n...hn-6, no=571, id=498, vol=2.154000e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 127 and name HG) 3.074 1.181 2.926 weight 1.000 ! spec=n15n...hn-6, no=572, id=499, vol=4.077000e-01 assign (segid " " and resid 126 and name HN) (segid " " and resid 127 and name HB2) 3.211 1.289 1.289 weight 1.000 ! spec=n15n...hn-6, no=573, id=500, vol=3.138000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 109 and name HN) 3.042 1.157 1.157 weight 1.000 ! spec=n15n...hn-6, no=577, id=503, vol=4.338000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 186 and name HH2) 3.192 1.273 1.273 weight 1.000 ! spec=n15n...hn-6, no=579, id=505, vol=3.252000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 186 and name HZ2) 3.168 1.255 1.255 weight 1.000 ! spec=n15n...hn-6, no=580, id=506, vol=3.398000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HA) 3.080 1.186 1.186 weight 1.000 ! spec=n15n...hn-6, no=581, id=507, vol=4.028000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HA) 2.879 1.036 1.036 weight 1.000 ! spec=n15n...hn-6, no=582, id=508, vol=6.031000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HB1) 2.747 0.944 0.944 weight 1.000 ! spec=n15n...hn-6, no=583, id=509, vol=7.991000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HB1) 3.162 1.250 1.250 weight 1.000 ! spec=n15n...hn-6, no=585, id=511, vol=3.438000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HG) 3.002 1.126 2.998 weight 1.000 ! spec=n15n...hn-6, no=587, id=513, vol=4.697000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 108 and name HG2) 3.397 1.442 1.442 weight 1.000 ! spec=n15n...hn-6, no=588, id=514, vol=2.237000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 106 and name HD21) 3.212 1.289 1.289 weight 1.000 ! spec=n15n...hn-6, no=589, id=515, vol=3.133000e-01 assign (segid " " and resid 107 and name HN) (segid " " and resid 107 and name HD21) 3.192 1.274 1.274 weight 1.000 ! spec=n15n...hn-6, no=591, id=517, vol=3.250000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 145 and name HN) 3.226 1.301 1.301 weight 1.000 ! spec=n15n...hn-6, no=593, id=518, vol=3.051000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HA) 2.698 0.910 0.910 weight 1.000 ! spec=n15n...hn-6, no=595, id=520, vol=8.914000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 141 and name HA) 3.311 1.370 1.370 weight 1.000 ! spec=n15n...hn-6, no=596, id=521, vol=2.610000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 140 and name HA) 3.043 1.157 1.157 weight 1.000 ! spec=n15n...hn-6, no=597, id=522, vol=4.329000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 142 and name HA) 3.367 1.417 1.417 weight 1.000 ! spec=n15n...hn-6, no=598, id=523, vol=2.359000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HB2) 2.644 0.874 0.874 weight 1.000 ! spec=n15n...hn-6, no=599, id=524, vol=1.007100e+00 assign (segid " " and resid 143 and name HN) (segid " " and resid 143 and name HB1) 2.762 0.954 0.954 weight 1.000 ! spec=n15n...hn-6, no=601, id=526, vol=7.744000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 142 and name HB) 2.670 0.891 0.891 weight 1.000 ! spec=n15n...hn-6, no=602, id=527, vol=9.478000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HN) 2.736 0.936 0.936 weight 1.000 ! spec=n15n...hn-6, no=606, id=531, vol=8.186000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 150 and name HN) 2.416 0.730 0.730 weight 1.000 ! spec=n15n...hn-6, no=609, id=532, vol=1.728200e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HG2) 3.227 1.301 1.301 weight 1.000 ! spec=n15n...hn-6, no=613, id=536, vol=3.046000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HG2) 2.755 0.949 0.949 weight 1.000 ! spec=n15n...hn-6, no=614, id=537, vol=7.858000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HB2) 2.940 1.080 3.060 weight 1.000 ! spec=n15n...hn-6, no=615, id=538, vol=5.328000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 149 and name HB2) 2.412 0.727 0.727 weight 1.000 ! spec=n15n...hn-6, no=616, id=539, vol=1.743700e+00 assign (segid " " and resid 149 and name HN) (segid " " and resid 148 and name HB1) 2.707 0.916 0.916 weight 1.000 ! spec=n15n...hn-6, no=617, id=540, vol=8.745000e-01 assign (segid " " and resid 149 and name HN) (segid " " and resid 150 and name HB1) 3.162 1.250 2.838 weight 1.000 ! spec=n15n...hn-6, no=619, id=542, vol=3.437000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 98 and name HA) 3.319 1.377 1.377 weight 1.000 ! spec=n15n...hn-6, no=623, id=544, vol=2.570000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HA) 2.507 0.786 0.786 weight 1.000 ! spec=n15n...hn-6, no=624, id=545, vol=1.384100e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HA) 3.223 1.299 1.299 weight 1.000 ! spec=n15n...hn-6, no=625, id=546, vol=3.066000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HB2) 2.434 0.741 0.741 weight 1.000 ! spec=n15n...hn-6, no=626, id=547, vol=1.652800e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HG2) 2.563 0.821 0.821 weight 1.000 ! spec=n15n...hn-6, no=627, id=548, vol=1.211500e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HB1) 2.818 0.992 0.992 weight 1.000 ! spec=n15n...hn-6, no=628, id=549, vol=6.871000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 101 and name HB1) 2.414 0.728 3.586 weight 1.000 ! spec=n15n...hn-6, no=629, id=550, vol=1.738400e+00 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HB2) 2.714 0.921 0.921 weight 1.000 ! spec=n15n...hn-6, no=630, id=551, vol=8.603000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 101 and name HB1) 3.354 1.406 2.646 weight 1.000 ! spec=n15n...hn-6, no=631, id=552, vol=2.414000e-01 assign (segid " " and resid 155 and name HN) (segid " " and resid 156 and name HN) 2.522 0.795 0.795 weight 1.000 ! spec=n15n...hn-6, no=632, id=553, vol=1.335500e+00 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HA) 2.955 1.091 1.091 weight 1.000 ! spec=n15n...hn-6, no=636, id=557, vol=5.163000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HA) 2.709 0.917 0.917 weight 1.000 ! spec=n15n...hn-6, no=637, id=558, vol=8.704000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HB2) 2.795 0.976 0.976 weight 1.000 ! spec=n15n...hn-6, no=638, id=559, vol=7.210000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HB) 2.324 0.675 3.676 weight 1.000 ! spec=n15n...hn-6, no=640, id=561, vol=2.183400e+00 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HB1) 2.965 1.099 1.099 weight 1.000 ! spec=n15n...hn-6, no=642, id=563, vol=5.059000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 155 and name HD11) 2.744 0.941 3.256 weight 1.000 ! spec=n15n...hn-6, no=643, id=564, vol=8.057000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HG21) 2.305 0.664 0.664 weight 1.000 ! spec=n15n...hn-6, no=644, id=565, vol=2.289400e+00 assign (segid " " and resid 156 and name HN) (segid " " and resid 156 and name HG11) 2.779 0.966 3.221 weight 1.000 ! spec=n15n...hn-6, no=645, id=566, vol=7.459000e-01 assign (segid " " and resid 186 and name HE1) (segid " " and resid 172 and name HN) 3.009 1.132 1.132 weight 1.000 ! spec=n15n...hn-6, no=647, id=567, vol=4.628000e-01 assign (segid " " and resid 171 and name HN) (segid " " and resid 172 and name HN) 2.700 0.911 0.911 weight 1.000 ! spec=n15n...hn-6, no=648, id=568, vol=8.870000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 173 and name HN) 2.614 0.854 0.854 weight 1.000 ! spec=n15n...hn-6, no=649, id=569, vol=1.076200e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 186 and name HD1) 3.027 1.145 1.145 weight 1.000 ! spec=n15n...hn-6, no=652, id=571, vol=4.469000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HA) 2.618 0.857 0.857 weight 1.000 ! spec=n15n...hn-6, no=653, id=572, vol=1.068000e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 171 and name HA) 2.720 0.925 0.925 weight 1.000 ! spec=n15n...hn-6, no=654, id=573, vol=8.493000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HB2) 2.595 0.842 0.842 weight 1.000 ! spec=n15n...hn-6, no=655, id=574, vol=1.124700e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 171 and name HB2) 2.656 0.882 0.882 weight 1.000 ! spec=n15n...hn-6, no=656, id=575, vol=9.792000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HB1) 2.539 0.806 0.806 weight 1.000 ! spec=n15n...hn-6, no=657, id=576, vol=1.284500e+00 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HD2) 2.957 1.093 3.043 weight 1.000 ! spec=n15n...hn-6, no=659, id=578, vol=5.139000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 172 and name HG2) 2.721 0.925 3.279 weight 1.000 ! spec=n15n...hn-6, no=660, id=579, vol=8.478000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 168 and name HB2) 5.133 1.227 1.227 weight 1.000 ! spec=n15n...hn-6, no=661, id=580, vol=3.632000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 171 and name HD21) 3.146 1.237 2.854 weight 1.000 ! spec=n15n...hn-6, no=662, id=581, vol=3.544000e-01 assign (segid " " and resid 172 and name HN) (segid " " and resid 188 and name HG21) 3.082 1.188 1.188 weight 1.000 ! spec=n15n...hn-6, no=663, id=582, vol=4.009000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 103 and name HN) 2.494 0.777 3.506 weight 1.000 ! spec=n15n...hn-6, no=664, id=583, vol=1.428900e+00 assign (segid " " and resid 127 and name HN) (segid " " and resid 125 and name HN) 2.777 0.964 3.223 weight 1.000 ! spec=n15n...hn-6, no=666, id=585, vol=7.498000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 101 and name HN) 2.808 0.986 3.192 weight 1.000 ! spec=n15n...hn-6, no=669, id=588, vol=7.009000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HN) 2.341 0.685 0.685 weight 1.000 ! spec=n15n...hn-6, no=670, id=589, vol=2.090800e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 158 and name HN) 2.526 0.798 0.798 weight 1.000 ! spec=n15n...hn-6, no=671, id=590, vol=1.322800e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HN) 2.478 0.768 0.768 weight 1.000 ! spec=n15n...hn-6, no=672, id=591, vol=1.482800e+00 assign (segid " " and resid 126 and name HN) (segid " " and resid 127 and name HN) 2.392 0.715 0.715 weight 1.000 ! spec=n15n...hn-6, no=673, id=592, vol=1.833600e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HD1) 2.668 0.890 0.890 weight 1.000 ! spec=n15n...hn-6, no=676, id=593, vol=9.527000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HE1) 3.249 1.320 1.320 weight 1.000 ! spec=n15n...hn-6, no=677, id=594, vol=2.921000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 100 and name HA) 2.583 0.834 0.834 weight 1.000 ! spec=n15n...hn-6, no=679, id=596, vol=1.157100e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HA) 2.869 1.029 1.029 weight 1.000 ! spec=n15n...hn-6, no=680, id=597, vol=6.169000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 154 and name HA) 2.845 1.012 1.012 weight 1.000 ! spec=n15n...hn-6, no=681, id=598, vol=6.481000e-01 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HA) 3.001 1.125 1.125 weight 1.000 ! spec=n15n...hn-6, no=682, id=599, vol=4.709000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 124 and name HA) 2.952 1.089 1.089 weight 1.000 ! spec=n15n...hn-6, no=683, id=600, vol=5.199000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 155 and name HA) 3.212 1.290 1.290 weight 1.000 ! spec=n15n...hn-6, no=684, id=601, vol=3.129000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HA) 2.564 0.822 0.822 weight 1.000 ! spec=n15n...hn-6, no=685, id=602, vol=1.209000e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 103 and name HB2) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-6, no=686, id=603, vol=1.150500e+00 assign (segid " " and resid 127 and name HN) (segid " " and resid 126 and name HB1) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-6, no=687, id=604, vol=1.148600e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HG2) 2.683 0.900 0.900 weight 1.000 ! spec=n15n...hn-6, no=688, id=605, vol=9.213000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HB2) 2.286 0.653 0.653 weight 1.000 ! spec=n15n...hn-6, no=689, id=606, vol=2.407300e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HB2) 2.504 0.784 0.784 weight 1.000 ! spec=n15n...hn-6, no=690, id=607, vol=1.395100e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 101 and name HB1) 2.997 1.123 3.003 weight 1.000 ! spec=n15n...hn-6, no=691, id=608, vol=4.742000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 157 and name HG1) 2.395 0.717 0.717 weight 1.000 ! spec=n15n...hn-6, no=692, id=609, vol=1.819800e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 102 and name HB1) 2.204 0.607 3.796 weight 1.000 ! spec=n15n...hn-6, no=693, id=610, vol=2.995300e+00 assign (segid " " and resid 103 and name HN) (segid " " and resid 100 and name HD21) 3.135 1.229 1.229 weight 1.000 ! spec=n15n...hn-6, no=694, id=611, vol=3.618000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 127 and name HD11) 2.535 0.803 3.465 weight 1.000 ! spec=n15n...hn-6, no=695, id=612, vol=1.295300e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 160 and name HD21) 5.205 3.284 1.284 weight 1.000 ! spec=n15n...hn-6, no=697, id=614, vol=3.172000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HG11) 2.866 1.027 1.027 weight 1.000 ! spec=n15n...hn-6, no=698, id=615, vol=6.197000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 134 and name HA) 2.951 1.088 1.088 weight 1.000 ! spec=n15n...hn-6, no=702, id=618, vol=5.210000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 133 and name HB1) 3.006 1.129 1.129 weight 1.000 ! spec=n15n...hn-6, no=703, id=619, vol=4.661000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 134 and name HG2) 3.167 1.253 1.253 weight 1.000 ! spec=n15n...hn-6, no=704, id=620, vol=3.409000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 132 and name HD11) 3.491 1.523 1.523 weight 1.000 ! spec=n15n...hn-6, no=706, id=622, vol=1.900000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 132 and name HG12) 3.355 1.407 1.407 weight 1.000 ! spec=n15n...hn-6, no=707, id=623, vol=2.409000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 127 and name HA) 3.321 1.378 1.378 weight 1.000 ! spec=n15n...hn-6, no=713, id=628, vol=2.563000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HG2) 2.838 1.007 1.007 weight 1.000 ! spec=n15n...hn-6, no=714, id=629, vol=6.581000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 174 and name HN) 3.324 1.381 1.381 weight 1.000 ! spec=n15n...hn-6, no=720, id=632, vol=2.547000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 179 and name HN) 2.884 1.040 1.040 weight 1.000 ! spec=n15n...hn-6, no=722, id=634, vol=5.976000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 126 and name HA) 2.827 0.999 0.999 weight 1.000 ! spec=n15n...hn-6, no=723, id=635, vol=6.727000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HA) 2.675 0.894 0.894 weight 1.000 ! spec=n15n...hn-6, no=724, id=636, vol=9.386000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 125 and name HA) 3.472 1.507 1.507 weight 1.000 ! spec=n15n...hn-6, no=725, id=637, vol=1.961000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HA) 2.679 0.897 0.897 weight 1.000 ! spec=n15n...hn-6, no=727, id=639, vol=9.308000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HG2) 2.922 1.067 1.067 weight 1.000 ! spec=n15n...hn-6, no=728, id=640, vol=5.524000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HG1) 2.461 0.757 0.757 weight 1.000 ! spec=n15n...hn-6, no=729, id=641, vol=1.546900e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HB2) 2.545 0.810 0.810 weight 1.000 ! spec=n15n...hn-6, no=730, id=642, vol=1.264000e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 176 and name HB1) 3.248 1.318 1.318 weight 1.000 ! spec=n15n...hn-6, no=732, id=644, vol=2.930000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 129 and name HB1) 2.530 0.800 0.800 weight 1.000 ! spec=n15n...hn-6, no=733, id=645, vol=1.312000e+00 assign (segid " " and resid 176 and name HN) (segid " " and resid 172 and name HG2) 3.281 1.346 1.346 weight 1.000 ! spec=n15n...hn-6, no=735, id=647, vol=2.755000e-01 assign (segid " " and resid 176 and name HN) (segid " " and resid 175 and name HD11) 3.219 1.295 1.295 weight 1.000 ! spec=n15n...hn-6, no=737, id=649, vol=3.092000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 153 and name HN) 2.725 0.928 0.928 weight 1.000 ! spec=n15n...hn-6, no=738, id=650, vol=8.389000e-01 assign (segid " " and resid 154 and name HN) (segid " " and resid 153 and name HN) 2.634 0.867 0.867 weight 1.000 ! spec=n15n...hn-6, no=740, id=651, vol=1.029900e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 149 and name HA) 3.123 1.219 1.219 weight 1.000 ! spec=n15n...hn-6, no=741, id=652, vol=3.702000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 150 and name HA) 2.794 0.976 0.976 weight 1.000 ! spec=n15n...hn-6, no=742, id=653, vol=7.225000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HA) 2.592 0.840 0.840 weight 1.000 ! spec=n15n...hn-6, no=743, id=654, vol=1.132200e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HG2) 2.632 0.866 0.866 weight 1.000 ! spec=n15n...hn-6, no=744, id=655, vol=1.033700e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 153 and name HB2) 2.219 0.616 0.616 weight 1.000 ! spec=n15n...hn-6, no=745, id=656, vol=2.875800e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 152 and name HB1) 2.550 0.813 0.813 weight 1.000 ! spec=n15n...hn-6, no=747, id=658, vol=1.250600e+00 assign (segid " " and resid 153 and name HN) (segid " " and resid 155 and name HB1) 4.269 2.336 1.336 weight 1.000 ! spec=n15n...hn-6, no=748, id=659, vol=2.818000e-01 assign (segid " " and resid 104 and name HN) (segid " " and resid 105 and name HN) 2.727 0.929 0.929 weight 1.000 ! spec=n15n...hn-6, no=750, id=660, vol=8.363000e-01 assign (segid " " and resid 101 and name HN) (segid " " and resid 100 and name HN) 2.467 0.761 0.761 weight 1.000 ! spec=n15n...hn-6, no=753, id=662, vol=1.524900e+00 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HN) 2.479 0.768 0.768 weight 1.000 ! spec=n15n...hn-6, no=755, id=663, vol=1.480800e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HA) 2.780 0.966 0.966 weight 1.000 ! spec=n15n...hn-6, no=756, id=664, vol=7.445000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HA) 2.526 0.798 0.798 weight 1.000 ! spec=n15n...hn-6, no=759, id=667, vol=1.323400e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HA) 2.937 1.078 1.078 weight 1.000 ! spec=n15n...hn-6, no=760, id=668, vol=5.355000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 102 and name HA) 2.865 1.026 1.026 weight 1.000 ! spec=n15n...hn-6, no=761, id=669, vol=6.214000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HB1) 2.796 0.977 3.204 weight 1.000 ! spec=n15n...hn-6, no=762, id=670, vol=7.201000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HB2) 2.902 1.053 1.053 weight 1.000 ! spec=n15n...hn-6, no=763, id=671, vol=5.750000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HG1) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-6, no=764, id=672, vol=1.148500e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 101 and name HB2) 5.202 3.281 1.281 weight 1.000 ! spec=n15n...hn-6, no=765, id=673, vol=3.192000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HB1) 2.334 0.681 0.681 weight 1.000 ! spec=n15n...hn-6, no=767, id=675, vol=2.125300e+00 assign (segid " " and resid 105 and name HN) (segid " " and resid 104 and name HB1) 2.874 1.033 1.033 weight 1.000 ! spec=n15n...hn-6, no=768, id=676, vol=6.095000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HB2) 2.127 0.566 0.566 weight 1.000 ! spec=n15n...hn-6, no=769, id=677, vol=3.708600e+00 assign (segid " " and resid 100 and name HN) (segid " " and resid 99 and name HG2) 3.411 1.454 1.454 weight 1.000 ! spec=n15n...hn-6, no=771, id=679, vol=2.183000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HD21) 3.058 1.169 2.942 weight 1.000 ! spec=n15n...hn-6, no=774, id=682, vol=4.203000e-01 assign (segid " " and resid 100 and name HN) (segid " " and resid 100 and name HD11) 2.725 0.928 0.928 weight 1.000 ! spec=n15n...hn-6, no=775, id=683, vol=8.400000e-01 assign (segid " " and resid 105 and name HN) (segid " " and resid 105 and name HD21) 3.558 0.818 0.818 weight 1.000 ! spec=n15n...hn-6, no=776, id=684, vol=1.227900e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 132 and name HD11) 3.216 1.293 2.784 weight 1.000 ! spec=n15n...hn-6, no=777, id=685, vol=3.107000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 104 and name HN) 3.464 1.500 1.500 weight 1.000 ! spec=n15n...hn-6, no=778, id=686, vol=1.989000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 180 and name HN) 2.535 0.803 0.803 weight 1.000 ! spec=n15n...hn-6, no=779, id=687, vol=1.295300e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 100 and name HN) 2.870 1.029 1.029 weight 1.000 ! spec=n15n...hn-6, no=780, id=688, vol=6.156000e-01 assign (segid " " and resid 156 and name HN) (segid " " and resid 158 and name HN) 2.653 0.880 3.347 weight 1.000 ! spec=n15n...hn-6, no=781, id=689, vol=9.860000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 178 and name HA) 2.887 1.042 1.042 weight 1.000 ! spec=n15n...hn-6, no=787, id=692, vol=5.935000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 176 and name HA) 2.741 0.939 0.939 weight 1.000 ! spec=n15n...hn-6, no=789, id=694, vol=8.099000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 100 and name HA) 3.397 1.443 1.443 weight 1.000 ! spec=n15n...hn-6, no=790, id=695, vol=2.235000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HA) 2.222 0.617 0.617 weight 1.000 ! spec=n15n...hn-6, no=792, id=697, vol=2.854300e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HA) 2.510 0.787 0.787 weight 1.000 ! spec=n15n...hn-6, no=793, id=698, vol=1.376100e+00 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HD2) 3.346 1.399 1.399 weight 1.000 ! spec=n15n...hn-6, no=794, id=699, vol=2.450000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HG2) 3.077 1.183 2.923 weight 1.000 ! spec=n15n...hn-6, no=795, id=700, vol=4.051000e-01 assign (segid " " and resid 102 and name HN) (segid " " and resid 101 and name HB2) 2.809 0.986 0.986 weight 1.000 ! spec=n15n...hn-6, no=796, id=701, vol=7.002000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HB2) 2.681 0.899 0.899 weight 1.000 ! spec=n15n...hn-6, no=797, id=702, vol=9.255000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HG2) 2.533 0.802 0.802 weight 1.000 ! spec=n15n...hn-6, no=800, id=705, vol=1.302400e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 102 and name HB1) 2.569 0.825 3.431 weight 1.000 ! spec=n15n...hn-6, no=802, id=707, vol=1.194600e+00 assign (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD22) 3.232 1.306 1.306 weight 1.000 ! spec=n15n...hn-6, no=803, id=708, vol=3.017000e-01 or (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD21) or (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD23) or (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD12) or (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD11) or (segid " " and resid 102 and name HN) (segid " " and resid 105 and name HD13) assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HA) 2.632 0.866 0.866 weight 1.000 ! spec=n15n...hn-6, no=806, id=710, vol=1.034200e+00 assign (segid " " and resid 117 and name HN) (segid " " and resid 116 and name HA) 2.572 0.827 0.827 weight 1.000 ! spec=n15n...hn-6, no=807, id=711, vol=1.187100e+00 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HA) 3.285 1.349 1.349 weight 1.000 ! spec=n15n...hn-6, no=810, id=714, vol=2.735000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HB2) 2.776 0.963 0.963 weight 1.000 ! spec=n15n...hn-6, no=811, id=715, vol=7.515000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 117 and name HG2) 2.829 1.000 1.000 weight 1.000 ! spec=n15n...hn-6, no=812, id=716, vol=6.710000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 116 and name HG21) 3.181 1.265 2.819 weight 1.000 ! spec=n15n...hn-6, no=814, id=718, vol=3.320000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 118 and name HB) 3.313 1.372 1.372 weight 1.000 ! spec=n15n...hn-6, no=815, id=719, vol=2.598000e-01 assign (segid " " and resid 157 and name HN) (segid " " and resid 156 and name HG21) 2.982 1.111 1.111 weight 1.000 ! spec=n15n...hn-6, no=816, id=720, vol=4.891000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 135 and name HN) 3.263 1.331 1.331 weight 1.000 ! spec=n15n...hn-6, no=818, id=722, vol=2.847000e-01 assign (segid " " and resid 170 and name HN) (segid " " and resid 169 and name HN) 2.460 0.757 0.757 weight 1.000 ! spec=n15n...hn-6, no=819, id=723, vol=1.550000e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 166 and name HA) 3.268 1.335 1.335 weight 1.000 ! spec=n15n...hn-6, no=823, id=725, vol=2.822000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HA) 2.824 0.997 0.997 weight 1.000 ! spec=n15n...hn-6, no=824, id=726, vol=6.783000e-01 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HE2) 2.967 1.100 1.100 weight 1.000 ! spec=n15n...hn-6, no=826, id=728, vol=5.038000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HB2) 2.522 0.795 3.478 weight 1.000 ! spec=n15n...hn-6, no=827, id=729, vol=1.337200e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 170 and name HG1) 3.034 1.151 1.151 weight 1.000 ! spec=n15n...hn-6, no=828, id=730, vol=4.403000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 135 and name HB1) 2.503 0.783 0.783 weight 1.000 ! spec=n15n...hn-6, no=829, id=731, vol=1.398400e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HG2) 3.428 1.468 1.468 weight 1.000 ! spec=n15n...hn-6, no=831, id=733, vol=2.120000e-01 assign (segid " " and resid 169 and name HN) (segid " " and resid 169 and name HG1) 2.857 1.020 1.020 weight 1.000 ! spec=n15n...hn-6, no=832, id=734, vol=6.318000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 132 and name HG12) 2.558 0.818 3.442 weight 1.000 ! spec=n15n...hn-6, no=833, id=735, vol=1.227200e+00 assign (segid " " and resid 169 and name HN) (segid " " and resid 188 and name HG11) 3.253 1.323 1.323 weight 1.000 ! spec=n15n...hn-6, no=837, id=739, vol=2.902000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 173 and name HN) 2.497 0.779 0.779 weight 1.000 ! spec=n15n...hn-6, no=839, id=740, vol=1.418500e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 178 and name HN) 3.424 1.466 1.466 weight 1.000 ! spec=n15n...hn-6, no=841, id=742, vol=2.132000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HA) 2.622 0.859 0.859 weight 1.000 ! spec=n15n...hn-6, no=844, id=745, vol=1.058000e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 179 and name HA) 2.476 0.767 0.767 weight 1.000 ! spec=n15n...hn-6, no=845, id=746, vol=1.490600e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HA) 3.510 1.540 1.540 weight 1.000 ! spec=n15n...hn-6, no=846, id=747, vol=1.837000e-01 assign (segid " " and resid 180 and name HN) (segid " " and resid 180 and name HB2) 2.494 0.777 0.777 weight 1.000 ! spec=n15n...hn-6, no=847, id=748, vol=1.429300e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 180 and name HB1) 2.501 0.782 0.782 weight 1.000 ! spec=n15n...hn-6, no=848, id=749, vol=1.405700e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 178 and name HG2) 3.076 1.182 2.924 weight 1.000 ! spec=n15n...hn-6, no=850, id=751, vol=4.061000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 172 and name HB1) 2.859 1.022 1.022 weight 1.000 ! spec=n15n...hn-6, no=851, id=752, vol=6.289000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HB2) 2.474 0.765 0.765 weight 1.000 ! spec=n15n...hn-6, no=852, id=753, vol=1.499100e+00 assign (segid " " and resid 173 and name HN) (segid " " and resid 173 and name HB1) 2.505 0.784 0.784 weight 1.000 ! spec=n15n...hn-6, no=854, id=755, vol=1.391300e+00 assign (segid " " and resid 180 and name HN) (segid " " and resid 175 and name HD22) 3.147 1.238 1.238 weight 1.000 ! spec=n15n...hn-6, no=855, id=756, vol=3.541000e-01 or (segid " " and resid 180 and name HN) (segid " " and resid 175 and name HD21) or (segid " " and resid 180 and name HN) (segid " " and resid 175 and name HD23) assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HN) 2.526 0.797 0.797 weight 1.000 ! spec=n15n...hn-6, no=860, id=759, vol=1.324600e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 186 and name HH2) 2.834 1.004 1.004 weight 1.000 ! spec=n15n...hn-6, no=861, id=760, vol=6.629000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 135 and name HN) 3.390 1.437 1.437 weight 1.000 ! spec=n15n...hn-6, no=864, id=763, vol=2.263000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 161 and name HN) 2.593 0.841 0.841 weight 1.000 ! spec=n15n...hn-6, no=865, id=764, vol=1.130200e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HA) 2.796 0.977 0.977 weight 1.000 ! spec=n15n...hn-6, no=866, id=765, vol=7.194000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 134 and name HA) 2.897 1.049 1.049 weight 1.000 ! spec=n15n...hn-6, no=867, id=766, vol=5.811000e-01 assign (segid " " and resid 110 and name HN) (segid " " and resid 107 and name HA) 3.154 1.243 1.243 weight 1.000 ! spec=n15n...hn-6, no=868, id=767, vol=3.493000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HA) 2.492 0.776 0.776 weight 1.000 ! spec=n15n...hn-6, no=870, id=769, vol=1.435000e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HA) 2.654 0.880 0.880 weight 1.000 ! spec=n15n...hn-6, no=873, id=772, vol=9.841000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 136 and name HB2) 2.685 0.901 0.901 weight 1.000 ! spec=n15n...hn-6, no=874, id=773, vol=9.169000e-01 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HG2) 2.576 0.829 0.829 weight 1.000 ! spec=n15n...hn-6, no=875, id=774, vol=1.177300e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HB2) 2.524 0.797 0.797 weight 1.000 ! spec=n15n...hn-6, no=876, id=775, vol=1.328100e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 109 and name HB2) 2.332 0.680 0.680 weight 1.000 ! spec=n15n...hn-6, no=877, id=776, vol=2.135700e+00 assign (segid " " and resid 137 and name HN) (segid " " and resid 137 and name HB2) 2.205 0.608 0.608 weight 1.000 ! spec=n15n...hn-6, no=878, id=777, vol=2.987000e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 109 and name HG2) 3.114 1.212 2.886 weight 1.000 ! spec=n15n...hn-6, no=879, id=778, vol=3.768000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HB2) 2.249 0.632 0.632 weight 1.000 ! spec=n15n...hn-6, no=880, id=779, vol=2.657400e+00 assign (segid " " and resid 110 and name HN) (segid " " and resid 110 and name HD11) 2.762 0.954 0.954 weight 1.000 ! spec=n15n...hn-6, no=882, id=781, vol=7.736000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HB2) 2.881 1.037 1.037 weight 1.000 ! spec=n15n...hn-6, no=883, id=782, vol=6.014000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HB1) 2.576 0.829 0.829 weight 1.000 ! spec=n15n...hn-6, no=884, id=783, vol=1.177400e+00 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HD11) 2.875 1.033 1.033 weight 1.000 ! spec=n15n...hn-6, no=886, id=785, vol=6.088000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 160 and name HD21) 2.683 0.900 0.900 weight 1.000 ! spec=n15n...hn-6, no=887, id=786, vol=9.218000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 107 and name HD12) 3.267 1.334 1.334 weight 1.000 ! spec=n15n...hn-6, no=889, id=788, vol=2.829000e-01 or (segid " " and resid 160 and name HN) (segid " " and resid 107 and name HD11) or (segid " " and resid 160 and name HN) (segid " " and resid 107 and name HD13) assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HD21) 3.103 1.204 2.897 weight 1.000 ! spec=n15n...hn-6, no=890, id=789, vol=3.851000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 159 and name HB1) 3.187 1.269 1.269 weight 1.000 ! spec=n15n...hn-6, no=891, id=790, vol=3.283000e-01 assign (segid " " and resid 114 and name HN) (segid " " and resid 113 and name HN) 2.546 0.810 0.810 weight 1.000 ! spec=n15n...hn-6, no=892, id=791, vol=1.261900e+00 assign (segid " " and resid 113 and name HN) (segid " " and resid 115 and name HN) 3.333 1.389 1.389 weight 1.000 ! spec=n15n...hn-6, no=893, id=792, vol=2.506000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 182 and name HE1) 3.392 1.439 1.439 weight 1.000 ! spec=n15n...hn-6, no=895, id=793, vol=2.255000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 110 and name HA) 3.383 1.430 1.430 weight 1.000 ! spec=n15n...hn-6, no=896, id=794, vol=2.295000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 113 and name HA) 2.535 0.803 0.803 weight 1.000 ! spec=n15n...hn-6, no=897, id=795, vol=1.295600e+00 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HD2) 3.285 1.349 1.349 weight 1.000 ! spec=n15n...hn-6, no=898, id=796, vol=2.733000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HD1) 2.684 0.901 0.901 weight 1.000 ! spec=n15n...hn-6, no=899, id=797, vol=9.191000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 114 and name HB2) 3.383 1.431 1.431 weight 1.000 ! spec=n15n...hn-6, no=900, id=798, vol=2.293000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 113 and name HB2) 2.376 0.706 0.706 weight 1.000 ! spec=n15n...hn-6, no=901, id=799, vol=1.909200e+00 assign (segid " " and resid 113 and name HN) (segid " " and resid 113 and name HG1) 2.746 0.942 0.942 weight 1.000 ! spec=n15n...hn-6, no=902, id=800, vol=8.025000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HG2) 3.136 1.229 1.229 weight 1.000 ! spec=n15n...hn-6, no=903, id=801, vol=3.617000e-01 assign (segid " " and resid 113 and name HN) (segid " " and resid 112 and name HB1) 3.448 1.486 1.486 weight 1.000 ! spec=n15n...hn-6, no=906, id=804, vol=2.044000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 138 and name HN) 2.837 1.006 3.163 weight 1.000 ! spec=n15n...hn-6, no=908, id=806, vol=6.593000e-01 assign (segid " " and resid 135 and name HN) (segid " " and resid 136 and name HN) 2.517 0.792 0.792 weight 1.000 ! spec=n15n...hn-6, no=910, id=807, vol=1.351600e+00 assign (segid " " and resid 136 and name HN) (segid " " and resid 133 and name HA) 3.175 1.260 1.260 weight 1.000 ! spec=n15n...hn-6, no=911, id=808, vol=3.353000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HA) 3.105 1.205 1.205 weight 1.000 ! spec=n15n...hn-6, no=912, id=809, vol=3.838000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HA) 2.772 0.961 0.961 weight 1.000 ! spec=n15n...hn-6, no=913, id=810, vol=7.576000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HB2) 2.594 0.841 0.841 weight 1.000 ! spec=n15n...hn-6, no=914, id=811, vol=1.127500e+00 assign (segid " " and resid 136 and name HN) (segid " " and resid 136 and name HB1) 2.806 0.984 0.984 weight 1.000 ! spec=n15n...hn-6, no=915, id=812, vol=7.049000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HB2) 2.856 1.019 1.019 weight 1.000 ! spec=n15n...hn-6, no=916, id=813, vol=6.338000e-01 assign (segid " " and resid 136 and name HN) (segid " " and resid 135 and name HB1) 2.798 0.978 0.978 weight 1.000 ! spec=n15n...hn-6, no=917, id=814, vol=7.168000e-01 assign (segid " " and resid 148 and name HN) (segid " " and resid 147 and name HA2) 2.484 0.772 0.772 weight 1.000 ! spec=n15n...hn-6, no=923, id=819, vol=1.461900e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HA) 2.739 0.938 0.938 weight 1.000 ! spec=n15n...hn-6, no=924, id=820, vol=8.133000e-01 assign (segid " " and resid 148 and name HN) (segid " " and resid 147 and name HA1) 2.594 0.841 0.841 weight 1.000 ! spec=n15n...hn-6, no=925, id=821, vol=1.129500e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HG2) 2.561 0.820 0.820 weight 1.000 ! spec=n15n...hn-6, no=926, id=822, vol=1.219700e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HB2) 2.748 0.944 0.944 weight 1.000 ! spec=n15n...hn-6, no=928, id=824, vol=7.988000e-01 assign (segid " " and resid 148 and name HN) (segid " " and resid 148 and name HB1) 2.806 0.984 0.984 weight 1.000 ! spec=n15n...hn-6, no=929, id=825, vol=7.046000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 177 and name HN) 3.081 1.187 1.187 weight 1.000 ! spec=n15n...hn-6, no=931, id=826, vol=4.015000e-01 assign (segid " " and resid 174 and name HN) (segid " " and resid 175 and name HN) 2.524 0.796 0.796 weight 1.000 ! spec=n15n...hn-6, no=933, id=827, vol=1.329300e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 135 and name HN) 3.506 1.536 1.536 weight 1.000 ! spec=n15n...hn-6, no=934, id=828, vol=1.852000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 131 and name HA) 2.342 0.685 0.685 weight 1.000 ! spec=n15n...hn-6, no=935, id=829, vol=2.085600e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HA) 2.835 1.004 1.004 weight 1.000 ! spec=n15n...hn-6, no=936, id=830, vol=6.627000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 174 and name HA) 2.824 0.997 0.997 weight 1.000 ! spec=n15n...hn-6, no=937, id=831, vol=6.782000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HA) 2.781 0.967 0.967 weight 1.000 ! spec=n15n...hn-6, no=938, id=832, vol=7.428000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HB2) 2.637 0.869 0.869 weight 1.000 ! spec=n15n...hn-6, no=939, id=833, vol=1.022500e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HG) 2.479 0.768 3.521 weight 1.000 ! spec=n15n...hn-6, no=940, id=834, vol=1.480200e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HB) 2.672 0.893 0.893 weight 1.000 ! spec=n15n...hn-6, no=941, id=835, vol=9.440000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 131 and name HG) 2.669 0.890 0.890 weight 1.000 ! spec=n15n...hn-6, no=943, id=837, vol=9.510000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 174 and name HB1) 2.547 0.811 3.453 weight 1.000 ! spec=n15n...hn-6, no=946, id=840, vol=1.259500e+00 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HB1) 2.859 1.022 1.022 weight 1.000 ! spec=n15n...hn-6, no=947, id=841, vol=6.289000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HG12) 2.421 0.733 0.733 weight 1.000 ! spec=n15n...hn-6, no=948, id=842, vol=1.706000e+00 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HG21) 2.677 0.895 0.895 weight 1.000 ! spec=n15n...hn-6, no=949, id=843, vol=9.349000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 132 and name HD11) 2.973 1.105 1.105 weight 1.000 ! spec=n15n...hn-6, no=950, id=844, vol=4.975000e-01 assign (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD22) 3.238 1.310 1.310 weight 1.000 ! spec=n15n...hn-6, no=951, id=845, vol=2.984000e-01 or (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD21) or (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD23) or (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD12) or (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD11) or (segid " " and resid 132 and name HN) (segid " " and resid 127 and name HD13) assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HD11) 2.866 1.027 1.027 weight 1.000 ! spec=n15n...hn-6, no=953, id=847, vol=6.198000e-01 assign (segid " " and resid 175 and name HN) (segid " " and resid 175 and name HD21) 2.734 0.935 0.935 weight 1.000 ! spec=n15n...hn-6, no=954, id=848, vol=8.222000e-01 assign (segid " " and resid 124 and name HN) (segid " " and resid 125 and name HN) 3.125 1.220 1.220 weight 1.000 ! spec=n15n...hn-6, no=957, id=850, vol=3.694000e-01 assign (segid " " and resid 125 and name HN) (segid " " and resid 125 and name HA) 2.596 0.843 0.843 weight 1.000 ! spec=n15n...hn-6, no=958, id=851, vol=1.122400e+00 assign (segid " " and resid 125 and name HN) (segid " " and resid 125 and name HB2) 2.271 0.645 0.645 weight 1.000 ! spec=n15n...hn-6, no=959, id=852, vol=2.506900e+00 assign (segid " " and resid 125 and name HN) (segid " " and resid 124 and name HG21) 2.655 0.881 0.881 weight 1.000 ! spec=n15n...hn-6, no=960, id=853, vol=9.803000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 128 and name HN) 2.545 0.810 0.810 weight 1.000 ! spec=n15n...hn-6, no=961, id=854, vol=1.265500e+00 assign (segid " " and resid 128 and name HN) (segid " " and resid 125 and name HN) 3.052 1.164 1.164 weight 1.000 ! spec=n15n...hn-6, no=962, id=855, vol=4.252000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 130 and name HN) 2.852 1.017 3.148 weight 1.000 ! spec=n15n...hn-6, no=963, id=856, vol=6.388000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 125 and name HA) 2.927 1.071 1.071 weight 1.000 ! spec=n15n...hn-6, no=965, id=857, vol=5.469000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 128 and name HA) 1.994 0.497 4.006 weight 1.000 ! spec=n15n...hn-6, no=966, id=858, vol=5.462500e+00 assign (segid " " and resid 128 and name HN) (segid " " and resid 128 and name HB2) 2.946 1.085 1.085 weight 1.000 ! spec=n15n...hn-6, no=967, id=859, vol=5.253000e-01 assign (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD22) 3.472 1.507 1.507 weight 1.000 ! spec=n15n...hn-6, no=970, id=862, vol=1.961000e-01 or (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD21) or (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD23) or (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD12) or (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD11) or (segid " " and resid 128 and name HN) (segid " " and resid 131 and name HD13) assign (segid " " and resid 107 and name HN) (segid " " and resid 108 and name HN) 2.761 0.953 0.953 weight 1.000 ! spec=n15n...hn-6, no=971, id=863, vol=7.765000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 106 and name HN) 3.111 1.210 1.210 weight 1.000 ! spec=n15n...hn-6, no=973, id=864, vol=3.794000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 186 and name HH2) 2.657 0.882 3.343 weight 1.000 ! spec=n15n...hn-6, no=974, id=865, vol=9.777000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HA) 3.254 1.324 1.324 weight 1.000 ! spec=n15n...hn-6, no=975, id=866, vol=2.893000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 105 and name HA) 2.773 0.962 0.962 weight 1.000 ! spec=n15n...hn-6, no=976, id=867, vol=7.552000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HA) 2.563 0.821 0.821 weight 1.000 ! spec=n15n...hn-6, no=977, id=868, vol=1.211300e+00 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HB1) 2.764 0.955 0.955 weight 1.000 ! spec=n15n...hn-6, no=978, id=869, vol=7.711000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 107 and name HB2) 2.874 1.033 1.033 weight 1.000 ! spec=n15n...hn-6, no=979, id=870, vol=6.099000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HB2) 2.185 0.597 0.597 weight 1.000 ! spec=n15n...hn-6, no=980, id=871, vol=3.162800e+00 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HD2) 2.647 0.876 3.353 weight 1.000 ! spec=n15n...hn-6, no=981, id=872, vol=9.986000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 108 and name HG2) 3.023 1.142 1.142 weight 1.000 ! spec=n15n...hn-6, no=982, id=873, vol=4.504000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 160 and name HD11) 2.938 1.079 3.062 weight 1.000 ! spec=n15n...hn-6, no=984, id=875, vol=5.348000e-01 assign (segid " " and resid 108 and name HN) (segid " " and resid 160 and name HD21) 3.154 1.244 1.244 weight 1.000 ! spec=n15n...hn-6, no=985, id=876, vol=3.491000e-01 assign (segid " " and resid 160 and name HN) (segid " " and resid 158 and name HN) 2.953 1.090 1.090 weight 1.000 ! spec=n15n...hn-6, no=986, id=877, vol=5.183000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HA) 2.474 0.765 0.765 weight 1.000 ! spec=n15n...hn-6, no=990, id=879, vol=1.497500e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HA) 3.117 1.215 1.215 weight 1.000 ! spec=n15n...hn-6, no=991, id=880, vol=3.747000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 161 and name HD2) 5.356 3.408 1.408 weight 1.000 ! spec=n15n...hn-6, no=992, id=881, vol=2.404000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HB2) 2.535 0.804 0.804 weight 1.000 ! spec=n15n...hn-6, no=993, id=882, vol=1.293700e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 158 and name HB1) 2.586 0.836 0.836 weight 1.000 ! spec=n15n...hn-6, no=994, id=883, vol=1.149000e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HG2) 3.104 1.204 1.204 weight 1.000 ! spec=n15n...hn-6, no=995, id=884, vol=3.844000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HB2) 2.565 0.822 3.435 weight 1.000 ! spec=n15n...hn-6, no=996, id=885, vol=1.207600e+00 assign (segid " " and resid 158 and name HN) (segid " " and resid 157 and name HG1) 2.943 1.082 1.082 weight 1.000 ! spec=n15n...hn-6, no=997, id=886, vol=5.295000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 160 and name HB1) 3.284 1.348 2.716 weight 1.000 ! spec=n15n...hn-6, no=999, id=888, vol=2.741000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 139 and name HG12) 4.887 3.042 1.113 weight 1.000 ! spec=n15n...hn-6, no=1000, id=889, vol=5.934000e-01 assign (segid " " and resid 158 and name HN) (segid " " and resid 156 and name HG11) 3.268 1.335 1.335 weight 1.000 ! spec=n15n...hn-6, no=1001, id=890, vol=2.823000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HN) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-6, no=1003, id=892, vol=8.975000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HA) 2.713 0.920 0.920 weight 1.000 ! spec=n15n...hn-6, no=1006, id=894, vol=8.627000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HA) 2.954 1.091 1.091 weight 1.000 ! spec=n15n...hn-6, no=1007, id=895, vol=5.176000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HG2) 3.291 1.354 1.354 weight 1.000 ! spec=n15n...hn-6, no=1008, id=896, vol=2.704000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 184 and name HB2) 2.982 1.112 1.112 weight 1.000 ! spec=n15n...hn-6, no=1009, id=897, vol=4.886000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HG) 2.465 0.759 0.759 weight 1.000 ! spec=n15n...hn-6, no=1010, id=898, vol=1.532600e+00 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HB1) 2.697 0.909 0.909 weight 1.000 ! spec=n15n...hn-6, no=1011, id=899, vol=8.927000e-01 assign (segid " " and resid 185 and name HN) (segid " " and resid 185 and name HD21) 2.727 0.930 0.930 weight 1.000 ! spec=n15n...hn-6, no=1012, id=900, vol=8.357000e-01 assign (segid " " and resid 129 and name HN) (segid " " and resid 130 and name HN) 2.407 0.724 0.724 weight 1.000 ! spec=n15n...hn-6, no=1013, id=901, vol=1.767500e+00 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HA) 2.596 0.842 0.842 weight 1.000 ! spec=n15n...hn-6, no=1019, id=906, vol=1.124000e+00 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HA) 2.893 1.046 1.046 weight 1.000 ! spec=n15n...hn-6, no=1020, id=907, vol=5.858000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 128 and name HA) 2.984 1.113 1.113 weight 1.000 ! spec=n15n...hn-6, no=1021, id=908, vol=4.873000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HB2) 2.639 0.871 3.361 weight 1.000 ! spec=n15n...hn-6, no=1022, id=909, vol=1.016700e+00 assign (segid " " and resid 130 and name HN) (segid " " and resid 130 and name HB1) 2.697 0.909 0.909 weight 1.000 ! spec=n15n...hn-6, no=1023, id=910, vol=8.939000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HB2) 2.932 1.075 1.075 weight 1.000 ! spec=n15n...hn-6, no=1024, id=911, vol=5.409000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 129 and name HB1) 3.045 1.159 1.159 weight 1.000 ! spec=n15n...hn-6, no=1025, id=912, vol=4.314000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HG) 3.172 1.258 1.258 weight 1.000 ! spec=n15n...hn-6, no=1026, id=913, vol=3.373000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 131 and name HB2) 3.353 1.405 1.405 weight 1.000 ! spec=n15n...hn-6, no=1028, id=915, vol=2.421000e-01 assign (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD22) 3.389 1.436 1.436 weight 1.000 ! spec=n15n...hn-6, no=1029, id=916, vol=2.268000e-01 or (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD21) or (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD23) or (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD12) or (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD11) or (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD13) assign (segid " " and resid 130 and name HN) (segid " " and resid 127 and name HD11) 3.493 1.525 1.525 weight 1.000 ! spec=n15n...hn-6, no=1030, id=917, vol=1.893000e-01 assign (segid " " and resid 184 and name HN) (segid " " and resid 183 and name HN) 2.809 0.987 0.987 weight 1.000 ! spec=n15n...hn-6, no=1031, id=918, vol=6.992000e-01 assign (segid " " and resid 184 and name HN) (segid " " and resid 181 and name HA) 2.995 1.121 1.121 weight 1.000 ! spec=n15n...hn-6, no=1035, id=921, vol=4.760000e-01 assign (segid " " and resid 184 and name HN) (segid " " and resid 184 and name HG2) 2.596 0.843 0.843 weight 1.000 ! spec=n15n...hn-6, no=1037, id=923, vol=1.122500e+00 assign (segid " " and resid 184 and name HN) (segid " " and resid 184 and name HB2) 2.475 0.766 0.766 weight 1.000 ! spec=n15n...hn-6, no=1038, id=924, vol=1.495100e+00 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HN) 3.364 1.415 1.415 weight 1.000 ! spec=n15n...hn-6, no=1039, id=925, vol=2.372000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 160 and name HN) 3.519 1.548 1.548 weight 1.000 ! spec=n15n...hn-6, no=1040, id=926, vol=1.811000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 163 and name HA) 2.769 0.958 3.231 weight 1.000 ! spec=n15n...hn-6, no=1043, id=928, vol=7.633000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 161 and name HA) 2.863 1.024 1.024 weight 1.000 ! spec=n15n...hn-6, no=1044, id=929, vol=6.246000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HA) 2.680 0.898 0.898 weight 1.000 ! spec=n15n...hn-6, no=1045, id=930, vol=9.277000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HB2) 2.520 0.794 0.794 weight 1.000 ! spec=n15n...hn-6, no=1046, id=931, vol=1.342800e+00 assign (segid " " and resid 162 and name HN) (segid " " and resid 162 and name HB1) 2.539 0.806 0.806 weight 1.000 ! spec=n15n...hn-6, no=1047, id=932, vol=1.284300e+00 assign (segid " " and resid 162 and name HN) (segid " " and resid 159 and name HA) 3.013 1.135 1.135 weight 1.000 ! spec=n15n...hn-6, no=1048, id=933, vol=4.592000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 161 and name HB2) 3.059 1.170 1.170 weight 1.000 ! spec=n15n...hn-6, no=1049, id=934, vol=4.197000e-01 assign (segid " " and resid 162 and name HN) (segid " " and resid 161 and name HB1) 3.120 1.217 1.217 weight 1.000 ! spec=n15n...hn-6, no=1050, id=935, vol=3.726000e-01 assign (segid " " and resid 177 and name HN) (segid " " and resid 178 and name HN) 2.666 0.888 0.888 weight 1.000 ! spec=n15n...hn-6, no=1061, id=936, vol=9.578000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 178 and name HN) 2.413 0.728 0.728 weight 1.000 ! spec=n15n...hn-6, no=1062, id=937, vol=1.740000e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HA) 2.788 0.972 0.972 weight 1.000 ! spec=n15n...hn-6, no=1064, id=938, vol=7.315000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 177 and name HA) 2.880 1.037 1.037 weight 1.000 ! spec=n15n...hn-6, no=1065, id=939, vol=6.019000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 175 and name HA) 3.259 1.327 1.327 weight 1.000 ! spec=n15n...hn-6, no=1066, id=940, vol=2.870000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HG1) 2.832 1.003 1.003 weight 1.000 ! spec=n15n...hn-6, no=1067, id=941, vol=6.661000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HG2) 2.741 0.939 3.259 weight 1.000 ! spec=n15n...hn-6, no=1069, id=943, vol=8.100000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 177 and name HB2) 2.533 0.802 0.802 weight 1.000 ! spec=n15n...hn-6, no=1070, id=944, vol=1.302100e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 178 and name HB1) 2.597 0.843 0.843 weight 1.000 ! spec=n15n...hn-6, no=1071, id=945, vol=1.121100e+00 assign (segid " " and resid 178 and name HN) (segid " " and resid 177 and name HG1) 3.201 1.281 2.799 weight 1.000 ! spec=n15n...hn-6, no=1072, id=946, vol=3.197000e-01 assign (segid " " and resid 178 and name HN) (segid " " and resid 177 and name HG2) 3.315 1.374 1.374 weight 1.000 ! spec=n15n...hn-6, no=1073, id=947, vol=2.588000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 161 and name HA) 2.511 0.788 0.788 weight 1.000 ! spec=n15n...hn-6, no=1078, id=949, vol=1.371000e+00 assign (segid " " and resid 161 and name HN) (segid " " and resid 158 and name HA) 2.908 1.057 1.057 weight 1.000 ! spec=n15n...hn-6, no=1079, id=950, vol=5.688000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HD21) 5.372 1.422 1.422 weight 1.000 ! spec=n15n...hn-6, no=1081, id=951, vol=2.337000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HD1) 3.249 1.319 1.319 weight 1.000 ! spec=n15n...hn-6, no=1092, id=954, vol=2.923000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 112 and name HA) 3.224 1.299 1.299 weight 1.000 ! spec=n15n...hn-6, no=1093, id=955, vol=3.060000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HA) 2.821 0.995 0.995 weight 1.000 ! spec=n15n...hn-6, no=1095, id=957, vol=6.817000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HA) 3.123 1.219 1.219 weight 1.000 ! spec=n15n...hn-6, no=1096, id=958, vol=3.706000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HB2) 2.805 0.984 0.984 weight 1.000 ! spec=n15n...hn-6, no=1097, id=959, vol=7.050000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 114 and name HB1) 2.965 1.099 1.099 weight 1.000 ! spec=n15n...hn-6, no=1098, id=960, vol=5.054000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HB2) 2.764 0.955 0.955 weight 1.000 ! spec=n15n...hn-6, no=1099, id=961, vol=7.714000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HB1) 2.773 0.961 0.961 weight 1.000 ! spec=n15n...hn-6, no=1100, id=962, vol=7.564000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HG2) 2.671 0.892 0.892 weight 1.000 ! spec=n15n...hn-6, no=1101, id=963, vol=9.467000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 115 and name HD2) 3.247 1.318 1.318 weight 1.000 ! spec=n15n...hn-6, no=1102, id=964, vol=2.931000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HA) 3.130 1.224 1.224 weight 1.000 ! spec=n15n...hn-6, no=1116, id=968, vol=3.658000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 159 and name HA) 3.045 1.159 1.159 weight 1.000 ! spec=n15n...hn-6, no=1117, id=969, vol=4.313000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 161 and name HB2) 2.399 0.719 0.719 weight 1.000 ! spec=n15n...hn-6, no=1118, id=970, vol=1.805400e+00 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HB1) 3.029 1.147 1.147 weight 1.000 ! spec=n15n...hn-6, no=1119, id=971, vol=4.451000e-01 assign (segid " " and resid 161 and name HN) (segid " " and resid 160 and name HD11) 3.374 1.423 2.626 weight 1.000 ! spec=n15n...hn-6, no=1120, id=972, vol=2.331000e-01 assign (segid " " and resid 165 and name HN) (segid " " and resid 166 and name HN) 2.685 0.901 0.901 weight 1.000 ! spec=n15n...hn-6, no=1133, id=973, vol=9.172000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HA) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-6, no=1136, id=975, vol=8.973000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 164 and name HA) 3.145 1.236 1.236 weight 1.000 ! spec=n15n...hn-6, no=1137, id=976, vol=3.555000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 165 and name HA) 2.883 1.039 1.039 weight 1.000 ! spec=n15n...hn-6, no=1138, id=977, vol=5.982000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HB2) 2.678 0.896 0.896 weight 1.000 ! spec=n15n...hn-6, no=1139, id=978, vol=9.320000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 166 and name HB1) 2.718 0.923 0.923 weight 1.000 ! spec=n15n...hn-6, no=1140, id=979, vol=8.527000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 165 and name HG2) 3.133 1.227 1.227 weight 1.000 ! spec=n15n...hn-6, no=1141, id=980, vol=3.636000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 164 and name HB1) 2.981 1.111 1.111 weight 1.000 ! spec=n15n...hn-6, no=1142, id=981, vol=4.899000e-01 assign (segid " " and resid 166 and name HN) (segid " " and resid 165 and name HB2) 2.733 0.934 0.934 weight 1.000 ! spec=n15n...hn-6, no=1143, id=982, vol=8.243000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 144 and name HN) 2.500 0.781 0.781 weight 1.000 ! spec=n15n...hn-6, no=1160, id=984, vol=1.408600e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 145 and name HN) 2.312 0.668 0.668 weight 1.000 ! spec=n15n...hn-6, no=1161, id=985, vol=2.247700e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 144 and name HA) 2.430 0.738 0.738 weight 1.000 ! spec=n15n...hn-6, no=1163, id=986, vol=1.667700e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HA) 2.634 0.867 0.867 weight 1.000 ! spec=n15n...hn-6, no=1164, id=987, vol=1.029400e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 144 and name HB2) 2.145 0.575 0.575 weight 1.000 ! spec=n15n...hn-6, no=1165, id=988, vol=3.529100e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HB2) 2.597 0.843 0.843 weight 1.000 ! spec=n15n...hn-6, no=1166, id=989, vol=1.120900e+00 assign (segid " " and resid 144 and name HN) (segid " " and resid 143 and name HB1) 2.751 0.946 3.249 weight 1.000 ! spec=n15n...hn-6, no=1168, id=991, vol=7.925000e-01 assign (segid " " and resid 144 and name HN) (segid " " and resid 142 and name HB) 3.424 1.466 1.466 weight 1.000 ! spec=n15n...hn-6, no=1169, id=992, vol=2.132000e-01 assign (segid " " and resid 144 and name HN) (segid " " and resid 145 and name HG21) 3.065 1.175 1.175 weight 1.000 ! spec=n15n...hn-6, no=1170, id=993, vol=4.142000e-01 assign (segid " " and resid 182 and name HN) (segid " " and resid 183 and name HN) 2.796 0.977 0.977 weight 1.000 ! spec=n15n...hn-6, no=1181, id=995, vol=7.196000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 181 and name HA) 2.910 1.059 1.059 weight 1.000 ! spec=n15n...hn-6, no=1185, id=998, vol=5.659000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 182 and name HB2) 3.251 1.321 1.321 weight 1.000 ! spec=n15n...hn-6, no=1188, id=1001, vol=2.909000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HB1) 3.452 1.490 1.490 weight 1.000 ! spec=n15n...hn-6, no=1189, id=1002, vol=2.030000e-01 assign (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD22) 3.362 1.413 1.413 weight 1.000 ! spec=n15n...hn-6, no=1190, id=1003, vol=2.381000e-01 or (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD21) or (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD23) assign (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD12) 3.486 1.519 1.519 weight 1.000 ! spec=n15n...hn-6, no=1191, id=1004, vol=1.916000e-01 or (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD11) or (segid " " and resid 183 and name HN) (segid " " and resid 175 and name HD13) assign (segid " " and resid 146 and name HN) (segid " " and resid 145 and name HN) 2.373 0.704 0.704 weight 1.000 ! spec=n15n...hn-6, no=1192, id=1005, vol=1.925700e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 147 and name HA2) 2.482 0.770 3.518 weight 1.000 ! spec=n15n...hn-6, no=1197, id=1008, vol=1.469000e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HA) 2.529 0.799 0.799 weight 1.000 ! spec=n15n...hn-6, no=1198, id=1009, vol=1.315200e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 144 and name HA) 2.832 1.002 1.002 weight 1.000 ! spec=n15n...hn-6, no=1199, id=1010, vol=6.665000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HB) 2.627 0.863 0.863 weight 1.000 ! spec=n15n...hn-6, no=1200, id=1011, vol=1.046100e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 144 and name HB2) 2.552 0.814 0.814 weight 1.000 ! spec=n15n...hn-6, no=1201, id=1012, vol=1.245200e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 142 and name HA) 2.940 1.080 1.080 weight 1.000 ! spec=n15n...hn-6, no=1202, id=1013, vol=5.326000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 145 and name HG21) 2.321 0.674 0.674 weight 1.000 ! spec=n15n...hn-6, no=1205, id=1016, vol=2.196800e+00 assign (segid " " and resid 145 and name HN) (segid " " and resid 142 and name HD11) 3.445 1.483 1.483 weight 1.000 ! spec=n15n...hn-6, no=1206, id=1017, vol=2.058000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HA) 3.122 1.218 1.218 weight 1.000 ! spec=n15n...hn-6, no=1213, id=1020, vol=3.714000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 122 and name HA) 3.356 1.408 1.408 weight 1.000 ! spec=n15n...hn-6, no=1214, id=1021, vol=2.407000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 120 and name HA) 2.985 1.114 1.114 weight 1.000 ! spec=n15n...hn-6, no=1215, id=1022, vol=4.862000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 122 and name HB2) 2.801 0.981 0.981 weight 1.000 ! spec=n15n...hn-6, no=1216, id=1023, vol=7.113000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HB) 2.793 0.975 0.975 weight 1.000 ! spec=n15n...hn-6, no=1217, id=1024, vol=7.244000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HG12) 2.915 1.062 1.062 weight 1.000 ! spec=n15n...hn-6, no=1218, id=1025, vol=5.604000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HG21) 2.843 1.010 1.010 weight 1.000 ! spec=n15n...hn-6, no=1219, id=1026, vol=6.510000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HD11) 2.695 0.908 0.908 weight 1.000 ! spec=n15n...hn-6, no=1220, id=1027, vol=8.977000e-01 assign (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HD12) 3.220 1.296 1.296 weight 1.000 ! spec=n15n...hn-6, no=1221, id=1028, vol=3.083000e-01 or (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HD11) or (segid " " and resid 123 and name HN) (segid " " and resid 123 and name HD13) assign (segid " " and resid 146 and name HN) (segid " " and resid 147 and name HN) 2.189 0.599 0.599 weight 1.000 ! spec=n15n...hn-6, no=1234, id=1029, vol=3.122400e+00 assign (segid " " and resid 148 and name HN) (segid " " and resid 147 and name HN) 2.933 1.076 1.076 weight 1.000 ! spec=n15n...hn-6, no=1235, id=1030, vol=5.395000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 151 and name HN) 3.495 1.527 1.527 weight 1.000 ! spec=n15n...hn-6, no=1236, id=1031, vol=1.885000e-01 assign (segid " " and resid 145 and name HN) (segid " " and resid 147 and name HN) 4.785 0.969 0.969 weight 1.000 ! spec=n15n...hn-6, no=1237, id=1032, vol=7.370000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 144 and name HN) 2.792 0.975 0.975 weight 1.000 ! spec=n15n...hn-6, no=1238, id=1033, vol=7.251000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 147 and name HA2) 2.394 0.717 0.717 weight 1.000 ! spec=n15n...hn-6, no=1240, id=1034, vol=1.824500e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HA) 2.782 0.968 0.968 weight 1.000 ! spec=n15n...hn-6, no=1241, id=1035, vol=7.411000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 143 and name HA) 2.574 0.828 0.828 weight 1.000 ! spec=n15n...hn-6, no=1243, id=1037, vol=1.181000e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 147 and name HA1) 2.346 0.688 0.688 weight 1.000 ! spec=n15n...hn-6, no=1244, id=1038, vol=2.060300e+00 assign (segid " " and resid 147 and name HN) (segid " " and resid 142 and name HA) 3.423 1.465 1.465 weight 1.000 ! spec=n15n...hn-6, no=1245, id=1039, vol=2.136000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HB2) 2.874 1.033 1.033 weight 1.000 ! spec=n15n...hn-6, no=1246, id=1040, vol=6.099000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HB1) 2.699 0.911 0.911 weight 1.000 ! spec=n15n...hn-6, no=1247, id=1041, vol=8.886000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 146 and name HG2) 3.309 1.369 1.369 weight 1.000 ! spec=n15n...hn-6, no=1248, id=1042, vol=2.619000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 150 and name HB1) 2.846 1.012 1.012 weight 1.000 ! spec=n15n...hn-6, no=1250, id=1044, vol=6.475000e-01 assign (segid " " and resid 147 and name HN) (segid " " and resid 142 and name HG21) 2.971 1.104 1.104 weight 1.000 ! spec=n15n...hn-6, no=1251, id=1045, vol=4.993000e-01 assign (segid " " and resid 152 and name HN) (segid " " and resid 151 and name HN) 2.609 0.851 0.851 weight 1.000 ! spec=n15n...hn-6, no=1252, id=1046, vol=1.089900e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 151 and name HA2) 2.368 0.701 0.701 weight 1.000 ! spec=n15n...hn-6, no=1256, id=1049, vol=1.948200e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 150 and name HA) 2.703 0.913 0.913 weight 1.000 ! spec=n15n...hn-6, no=1257, id=1050, vol=8.817000e-01 assign (segid " " and resid 151 and name HN) (segid " " and resid 151 and name HA1) 2.516 0.791 0.791 weight 1.000 ! spec=n15n...hn-6, no=1258, id=1051, vol=1.355700e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 152 and name HB1) 3.156 1.245 2.844 weight 1.000 ! spec=n15n...hn-6, no=1261, id=1054, vol=3.477000e-01 assign (segid " " and resid 151 and name HN) (segid " " and resid 150 and name HB1) 2.438 0.743 0.743 weight 1.000 ! spec=n15n...hn-6, no=1262, id=1055, vol=1.635000e+00 assign (segid " " and resid 151 and name HN) (segid " " and resid 142 and name HG21) 2.634 0.867 0.867 weight 1.000 ! spec=n15n...hn-6, no=1263, id=1056, vol=1.030000e+00 assign (segid " " and resid 167 and name HE1) (segid " " and resid 167 and name HD1) 2.888 1.043 1.043 weight 1.000 ! spec=n15n...hn-6, no=1265, id=1057, vol=5.923000e-01 assign (segid " " and resid 167 and name HE1) (segid " " and resid 167 and name HZ2) 3.204 1.284 1.284 weight 1.000 ! spec=n15n...hn-6, no=1266, id=1058, vol=3.175000e-01 assign (segid " " and resid 167 and name HE1) (segid " " and resid 163 and name HA) 2.983 1.112 1.112 weight 1.000 ! spec=n15n...hn-6, no=1267, id=1059, vol=4.883000e-01 assign (segid " " and resid 167 and name HE1) (segid " " and resid 160 and name HA) 5.450 3.487 0.550 weight 1.000 ! spec=n15n...hn-6, no=1268, id=1060, vol=2.040000e-01 assign (segid " " and resid 115 and name HN) (segid " " and resid 116 and name HN) 2.808 0.986 0.986 weight 1.000 ! spec=n15n...hn-6, no=1271, id=1063, vol=7.008000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 113 and name HN) 3.036 1.152 2.964 weight 1.000 ! spec=n15n...hn-6, no=1272, id=1064, vol=4.388000e-01 assign (segid " " and resid 117 and name HN) (segid " " and resid 116 and name HN) 2.453 0.752 0.752 weight 1.000 ! spec=n15n...hn-6, no=1273, id=1065, vol=1.576900e+00 assign (segid " " and resid 116 and name HN) (segid " " and resid 117 and name HA) 3.233 1.307 2.767 weight 1.000 ! spec=n15n...hn-6, no=1275, id=1066, vol=3.010000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 116 and name HA) 2.361 0.697 0.697 weight 1.000 ! spec=n15n...hn-6, no=1276, id=1067, vol=1.982400e+00 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HA) 3.141 1.233 1.233 weight 1.000 ! spec=n15n...hn-6, no=1277, id=1068, vol=3.581000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HB2) 3.052 1.164 1.164 weight 1.000 ! spec=n15n...hn-6, no=1278, id=1069, vol=4.254000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 115 and name HG2) 2.928 1.071 1.071 weight 1.000 ! spec=n15n...hn-6, no=1280, id=1071, vol=5.460000e-01 assign (segid " " and resid 116 and name HN) (segid " " and resid 116 and name HG21) 2.609 0.851 0.851 weight 1.000 ! spec=n15n...hn-6, no=1281, id=1072, vol=1.089000e+00 assign (segid " " and resid 116 and name HN) (segid " " and resid 118 and name HB) 3.270 1.337 1.337 weight 1.000 ! spec=n15n...hn-6, no=1282, id=1073, vol=2.811000e-01 assign (segid " " and resid 163 and name HN) (segid " " and resid 162 and name HB1) 3.604 1.623 1.623 weight 1.000 ! spec=n15n...hn-6, no=1283, id=1074, vol=1.569000e-01 assign (segid " " and resid 142 and name HN) (segid " " and resid 140 and name HB2) 2.578 0.831 3.422 weight 1.000 ! spec=n15n...hn-6, no=1284, id=1075, vol=1.169900e+00 assign (segid " " and resid 182 and name HN) (segid " " and resid 182 and name HD1) 3.598 1.618 1.618 weight 1.000 ! spec=n15n...hn-6, no=1285, id=1076, vol=1.585000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 162 and name HA) 3.175 1.260 1.260 weight 1.000 ! spec=n15n...hn-6, no=1286, id=1077, vol=3.356000e-01 assign (segid " " and resid 164 and name HN) (segid " " and resid 164 and name HB1) 2.728 0.930 0.930 weight 1.000 ! spec=n15n...hn-6, no=1287, id=1078, vol=8.346000e-01 assign (segid " " and resid 141 and name HN) (segid " " and resid 141 and name HG2) 2.796 0.977 3.204 weight 1.000 ! spec=n15n...hn-6, no=1288, id=1079, vol=7.196000e-01 assign (segid " " and resid 106 and name HN) (segid " " and resid 105 and name HD11) 3.135 1.229 1.229 weight 1.000 ! spec=n15n...hn-6, no=1289, id=1080, vol=3.619000e-01 assign (segid " " and resid 131 and name HN) (segid " " and resid 127 and name HG) 2.829 1.000 1.000 weight 1.000 ! spec=n15n...hn-6, no=1291, id=1082, vol=6.707000e-01 assign (segid " " and resid 139 and name HN) (segid " " and resid 138 and name HB2) 2.899 1.051 1.051 weight 1.000 ! spec=n15n...hn-6, no=1293, id=1084, vol=5.791000e-01 assign (segid " " and resid 143 and name HN) (segid " " and resid 140 and name HB2) 3.144 1.235 2.856 weight 1.000 ! spec=n15n...hn-6, no=1294, id=1085, vol=3.562000e-01 assign (segid " " and resid 127 and name HN) (segid " " and resid 126 and name HA) 2.827 0.999 0.999 weight 1.000 ! spec=n15n...hn-6, no=1295, id=1086, vol=6.732000e-01 assign (segid " " and resid 134 and name HN) (segid " " and resid 133 and name HB2) 3.006 1.130 1.130 weight 1.000 ! spec=n15n...hn-6, no=1296, id=1087, vol=4.657000e-01 assign (segid " " and resid 153 and name HN) (segid " " and resid 152 and name HA) 3.003 1.127 1.127 weight 1.000 ! spec=n15n...hn-6, no=1297, id=1088, vol=4.689000e-01 assign (segid " " and resid 179 and name HN) (segid " " and resid 179 and name HB1) 2.772 0.961 3.228 weight 1.000 ! spec=n15n...hn-6, no=1298, id=1089, vol=7.570000e-01 assign (segid " " and resid 173 and name HN) (segid " " and resid 172 and name HB2) 2.780 0.966 0.966 weight 1.000 ! spec=n15n...hn-6, no=1301, id=1092, vol=7.443000e-01 assign (segid " " and resid 112 and name HD2) (segid " " and resid 112 and name HA) 2.698 0.910 0.910 weight 1.000 ! spec=c13n...li-6, no=14, id=1104, vol=2.050300e+00 or (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HD1) or (segid " " and resid 121 and name HB) (segid " " and resid 140 and name HA) assign (segid " " and resid 112 and name HA) (segid " " and resid 112 and name HG1) 2.346 0.688 0.688 weight 1.000 ! spec=c13n...li-6, no=32, id=1120, vol=4.737100e+00 or (segid " " and resid 112 and name HA) (segid " " and resid 115 and name HB2) assign (segid " " and resid 139 and name HA) (segid " " and resid 142 and name HB) 2.203 0.607 0.607 weight 1.000 ! spec=c13n...li-6, no=40, id=1126, vol=6.908000e+00 or (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HB) assign (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HG21) 2.107 0.555 0.555 weight 1.000 ! spec=c13n...li-6, no=42, id=1128, vol=9.038900e+00 or (segid " " and resid 139 and name HA) (segid " " and resid 139 and name HD11) assign (segid " " and resid 142 and name HA) (segid " " and resid 141 and name HA) 2.642 0.873 0.873 weight 1.000 ! spec=c13n...li-6, no=48, id=1134, vol=2.320300e+00 or (segid " " and resid 142 and name HA) (segid " " and resid 143 and name HA) or (segid " " and resid 142 and name HA) (segid " " and resid 145 and name HB) assign (segid " " and resid 142 and name HA) (segid " " and resid 141 and name HA) 2.647 0.876 0.876 weight 1.000 ! spec=c13n...li-6, no=50, id=1136, vol=2.297200e+00 or (segid " " and resid 142 and name HA) (segid " " and resid 144 and name HB2) assign (segid " " and resid 120 and name HA) (segid " " and resid 120 and name HG1) 2.693 0.906 0.906 weight 1.000 ! spec=c13n...li-6, no=68, id=1147, vol=2.072700e+00 or (segid " " and resid 120 and name HA) (segid " " and resid 152 and name HB2) or (segid " " and resid 120 and name HA) (segid " " and resid 152 and name HB1) or (segid " " and resid 120 and name HA) (segid " " and resid 152 and name HB3) assign (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HD11) 2.022 0.511 0.511 weight 1.000 ! spec=c13n...li-6, no=74, id=1153, vol=1.157220e+01 or (segid " " and resid 142 and name HA) (segid " " and resid 142 and name HG21) assign (segid " " and resid 162 and name HB2) (segid " " and resid 159 and name HA) 2.461 0.757 0.757 weight 1.000 ! spec=c13n...li-6, no=107, id=1174, vol=3.553400e+00 or (segid " " and resid 136 and name HA) (segid " " and resid 136 and name HB2) assign (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HD12) 2.796 0.978 0.978 weight 1.000 ! spec=c13n...li-6, no=119, id=1186, vol=1.651800e+00 or (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HD11) or (segid " " and resid 124 and name HA) (segid " " and resid 123 and name HD13) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD22) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD21) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD23) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD12) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD11) or (segid " " and resid 124 and name HA) (segid " " and resid 131 and name HD13) assign (segid " " and resid 158 and name HA) (segid " " and resid 161 and name HD2) 2.538 0.805 0.805 weight 1.000 ! 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spec=c13n...li-6, no=1799, id=2521, vol=3.246700e+00 or (segid " " and resid 186 and name HB1) (segid " " and resid 127 and name HD21) or (segid " " and resid 186 and name HB1) (segid " " and resid 127 and name HD23) or (segid " " and resid 186 and name HB1) (segid " " and resid 127 and name HD12) or (segid " " and resid 186 and name HB1) (segid " " and resid 127 and name HD11) or (segid " " and resid 186 and name HB1) (segid " " and resid 127 and name HD13) or (segid " " and resid 127 and name HD22) (segid " " and resid 158 and name HB1) or (segid " " and resid 127 and name HD21) (segid " " and resid 158 and name HB1) or (segid " " and resid 127 and name HD23) (segid " " and resid 158 and name HB1) or (segid " " and resid 127 and name HD12) (segid " " and resid 158 and name HB1) or (segid " " and resid 127 and name HD11) (segid " " and resid 158 and name HB1) or (segid " " and resid 127 and name HD13) (segid " " and resid 158 and name HB1) assign (segid " " and resid 127 and name HD22) (segid " " and resid 126 and name HB1) 2.611 0.852 0.852 weight 1.000 ! 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spec=c13n...li-6, no=1803, id=2525, vol=2.721100e+00 or (segid " " and resid 127 and name HD21) (segid " " and resid 170 and name HB1) or (segid " " and resid 127 and name HD23) (segid " " and resid 170 and name HB1) or (segid " " and resid 127 and name HD12) (segid " " and resid 170 and name HB1) or (segid " " and resid 127 and name HD11) (segid " " and resid 170 and name HB1) or (segid " " and resid 127 and name HD13) (segid " " and resid 170 and name HB1) assign (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD12) 2.703 0.913 0.913 weight 1.000 ! spec=c13n...li-6, no=1811, id=2533, vol=2.025700e+00 or (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD22) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD21) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD23) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD12) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD11) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD12) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD11) or (segid " " and resid 131 and name HD13) (segid " " and resid 132 and name HD13) or (segid " " and resid 131 and name HD22) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD22) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD22) (segid " " and resid 159 and name HD13) or (segid " " and resid 131 and name HD21) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD21) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD21) (segid " " and resid 159 and name HD13) or (segid " " and resid 131 and name HD23) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD23) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD23) (segid " " and resid 159 and name HD13) or (segid " " and resid 131 and name HD12) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD12) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD12) (segid " " and resid 159 and name HD13) or (segid " " and resid 131 and name HD11) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD11) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD11) (segid " " and resid 159 and name HD13) or (segid " " and resid 131 and name HD13) (segid " " and resid 159 and name HD12) or (segid " " and resid 131 and name HD13) (segid " " and resid 159 and name HD11) or (segid " " and resid 131 and name HD13) (segid " " and resid 159 and name HD13) assign (segid " " and resid 188 and name HG22) (segid " " and resid 169 and name HB2) 4.788 1.971 1.971 weight 1.000 ! 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