NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
27424 | 2rmk | 11010 | cing | 1-original | 3 | XPLOR/CNS | distance | NOE | ambi |
ASSI { 2726} ( segid " " and resid 67 and name HD1%) (( segid " " and resid 1141 and name HB )) 3.400 1.400 1.400 peak 2726 spectrum 1 weight 0.10000E+01 volume 0.52081E-03 ppm1 0.796 ppm2 2.381 CV 1 OR { 2726} ( segid " " and resid 67 and name HD1%) (( segid " " and resid 1148 and name HG1 )) ASSI {12444} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1162 and name HA )) 2.900 1.000 1.000 peak 12444 spectrum 1 weight 0.10000E+01 volume 0.14065E-02 ppm1 0.890 ppm2 3.918 CV 1 OR {12444} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1163 and name HA )) OR {12444} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1165 and name HA )) ASSI {12461} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 1165 and name HA )) 3.200 3.200 2.800 peak 12461 spectrum 1 weight 0.10000E+01 volume 0.82191E-03 ppm1 0.786 ppm2 3.932 CV 1 OR {12461} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 1170 and name HA )) OR {12461} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 1167 and name HA )) ASSI {12466} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 1145 and name HA )) 3.100 1.200 1.200 peak 12466 spectrum 1 weight 0.10000E+01 volume 0.96703E-03 ppm1 0.781 ppm2 4.174 CV 1 OR {12466} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 1165 and name HB )) ASSI {12470} (( segid " " and resid 66 and name HD1 )) ( segid " " and resid 1141 and name HG1%) 3.200 3.200 2.800 peak 12470 spectrum 1 weight 0.10000E+01 volume 0.71795E-03 ppm1 3.117 ppm2 0.896 CV 1 OR {12470} (( segid " " and resid 66 and name HD2 )) ( segid " " and resid 1141 and name HG1%) OR {12470} (( segid " " and resid 66 and name HD2 )) ( segid " " and resid 1170 and name HD1%) ASSI {12478} ( segid " " and resid 67 and name HD1%) (( segid " " and resid 1170 and name HA )) 3.200 3.200 2.800 peak 12478 spectrum 1 weight 0.10000E+01 volume 0.80426E-03 ppm1 0.809 ppm2 3.935 CV 1 OR {12478} ( segid " " and resid 67 and name HD1%) (( segid " " and resid 1173 and name HB2 )) ASSI {12483} ( segid " " and resid 36 and name HG1%) ( segid " " and resid 1137 and name HG2%) 3.300 3.300 2.700 peak 12483 spectrum 1 weight 0.10000E+01 volume 0.65321E-03 ppm1 0.626 ppm2 0.848 CV 1 OR {12483} ( segid " " and resid 36 and name HG1%) ( segid " " and resid 1139 and name HD1%) ASSI {10500} ( segid " " and resid 1162 and name HD2%) ( segid " " and resid 70 and name HD2%) 3.200 1.300 1.300 peak 10500 spectrum 1 weight 0.10000E+01 volume 0.74149E-03 ppm1 0.614 ppm2 0.851 CV 1 OR {10500} ( segid " " and resid 1162 and name HD2%) (( segid " " and resid 5 and name HG2 )) ASSI {10793} ( segid " " and resid 1169 and name HE% ) ( segid " " and resid 64 and name HD% ) 3.200 3.200 2.800 peak 10793 spectrum 1 weight 0.10000E+01 volume 0.71403E-03 ppm1 1.999 ppm2 7.077 CV 1 OR {10793} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 72 and name HN )) ASSI { 3430} (( segid " " and resid 1147 and name HN )) (( segid " " and resid 1147 and name HD21)) 2.500 0.800 0.800 peak 3430 spectrum 1 weight 0.10000E+01 volume 0.20406E-02 ppm1 8.293 ppm2 6.873 CV 1 OR { 3430} (( segid " " and resid 1195 and name HN )) (( segid " " and resid 1195 and name HD21)) ASSI { 3435} (( segid " " and resid 89 and name HN )) (( segid " " and resid 86 and name HG )) 2.400 0.700 0.700 peak 3435 spectrum 1 weight 0.10000E+01 volume 0.25537E-02 ppm1 7.991 ppm2 6.117 CV 1 OR { 3435} (( segid " " and resid 89 and name HN )) (( segid " " and resid 89 and name HG )) ASSI { 8862} (( segid " " and resid 54 and name HN )) (( segid " " and resid 56 and name HE1 )) 2.700 2.700 3.300 peak 8862 spectrum 1 weight 0.10000E+01 volume 0.14187E-02 ppm1 9.463 ppm2 10.463 CV 1 OR { 8862} (( segid " " and resid 54 and name HN )) (( segid " " and resid 5 and name HN )) ASSI { 8872} (( segid " " and resid 25 and name HN )) (( segid " " and resid 22 and name HG )) 2.900 2.900 3.100 peak 8872 spectrum 1 weight 0.10000E+01 volume 0.94785E-03 ppm1 8.074 ppm2 5.077 CV 1 OR { 8872} (( segid " " and resid 161 and name HN )) (( segid " " and resid 22 and name HG )) ASSI { 8895} (( segid " " and resid 163 and name HN )) (( segid " " and resid 159 and name HN )) 2.800 2.800 3.200 peak 8895 spectrum 1 weight 0.10000E+01 volume 0.11803E-02 ppm1 7.836 ppm2 9.306 CV 1 OR { 8895} (( segid " " and resid 119 and name HN )) (( segid " " and resid 159 and name HN )) ASSI { 2542} (( segid " " and resid 162 and name HN )) (( segid " " and resid 163 and name HE )) 3.100 3.100 2.900 peak 2542 spectrum 1 weight 0.10000E+01 volume 0.10502E-02 ppm1 7.333 ppm2 6.724 CV 1 OR { 2542} (( segid " " and resid 162 and name HN )) (( segid " " and resid 193 and name H22 )) ASSI { 2596} (( segid " " and resid 161 and name HN )) (( segid " " and resid 162 and name HN )) 2.500 0.800 0.800 peak 2596 spectrum 1 weight 0.10000E+01 volume 0.41079E-02 ppm1 8.055 ppm2 7.346 CV 1 OR { 2596} (( segid " " and resid 161 and name HN )) (( segid " " and resid 160 and name HN )) ASSI { 2888} (( segid " " and resid 146 and name HN )) (( segid " " and resid 145 and name HN )) 2.800 1.000 1.000 peak 2888 spectrum 1 weight 0.10000E+01 volume 0.18654E-02 ppm1 8.123 ppm2 7.735 CV 1 OR { 2888} (( segid " " and resid 146 and name HN )) (( segid " " and resid 147 and name HN )) ASSI { 2898} (( segid " " and resid 144 and name HN )) (( segid " " and resid 146 and name HN )) 2.900 1.000 1.000 peak 2898 spectrum 1 weight 0.10000E+01 volume 0.17673E-02 ppm1 7.508 ppm2 8.082 CV 1 OR { 2898} (( segid " " and resid 144 and name HN )) (( segid " " and resid 142 and name HN )) ASSI { 2956} (( segid " " and resid 141 and name HN )) (( segid " " and resid 143 and name HN )) 2.600 0.800 0.800 peak 2956 spectrum 1 weight 0.10000E+01 volume 0.31384E-02 ppm1 7.167 ppm2 7.813 CV 1 OR { 2956} (( segid " " and resid 141 and name HN )) (( segid " " and resid 138 and name HN )) ASSI { 3025} (( segid " " and resid 125 and name HN )) (( segid " " and resid 126 and name HN )) 2.400 0.700 0.700 peak 3025 spectrum 1 weight 0.10000E+01 volume 0.45620E-02 ppm1 7.988 ppm2 8.443 CV 1 OR { 3025} (( segid " " and resid 125 and name HN )) (( segid " " and resid 124 and name HN )) ASSI { 3097} (( segid " " and resid 117 and name HN )) (( segid " " and resid 160 and name HN )) 3.600 1.600 1.600 peak 3097 spectrum 1 weight 0.10000E+01 volume 0.43831E-03 ppm1 8.272 ppm2 7.353 CV 1 OR { 3097} (( segid " " and resid 117 and name HN )) (( segid " " and resid 162 and name HN )) ASSI { 3211} (( segid " " and resid 83 and name HN )) (( segid " " and resid 90 and name HN )) 3.300 1.400 1.400 peak 3211 spectrum 1 weight 0.10000E+01 volume 0.68728E-03 ppm1 8.296 ppm2 7.427 CV 1 OR { 3211} (( segid " " and resid 83 and name HN )) (( segid " " and resid 85 and name HN )) ASSI { 3249} (( segid " " and resid 55 and name HN )) (( segid " " and resid 56 and name HN )) 3.300 1.400 1.400 peak 3249 spectrum 1 weight 0.10000E+01 volume 0.73111E-03 ppm1 8.761 ppm2 9.309 CV 1 OR { 3249} (( segid " " and resid 55 and name HN )) (( segid " " and resid 6 and name HN )) ASSI { 3269} (( segid " " and resid 52 and name HN )) (( segid " " and resid 51 and name HN )) 3.000 1.100 1.100 peak 3269 spectrum 1 weight 0.10000E+01 volume 0.14306E-02 ppm1 8.569 ppm2 9.109 CV 1 OR { 3269} (( segid " " and resid 52 and name HN )) (( segid " " and resid 53 and name HN )) ASSI { 3307} (( segid " " and resid 17 and name HN )) (( segid " " and resid 18 and name HN )) 2.800 0.900 0.900 peak 3307 spectrum 1 weight 0.10000E+01 volume 0.21916E-02 ppm1 9.126 ppm2 9.418 CV 1 OR { 3307} (( segid " " and resid 17 and name HN )) (( segid " " and resid 16 and name HN )) ASSI { 4998} (( segid " " and resid 4 and name HN )) (( segid " " and resid 3 and name HN )) 2.900 1.000 1.000 peak 4998 spectrum 1 weight 0.10000E+01 volume 0.17621E-02 ppm1 8.386 ppm2 8.577 CV 1 OR { 4998} (( segid " " and resid 4 and name HN )) (( segid " " and resid 52 and name HN )) ASSI {11177} (( segid " " and resid 121 and name HN )) (( segid " " and resid 120 and name HN )) 2.100 0.500 0.500 peak 11177 spectrum 1 weight 0.10000E+01 volume 0.11918E-01 ppm1 7.297 ppm2 7.147 CV 1 OR {11177} (( segid " " and resid 121 and name HN )) (( segid " " and resid 122 and name HN )) ASSI {11181} (( segid " " and resid 96 and name HN )) (( segid " " and resid 97 and name HN )) 2.300 0.700 0.700 peak 11181 spectrum 1 weight 0.10000E+01 volume 0.56770E-02 ppm1 7.973 ppm2 7.814 CV 1 OR {11181} (( segid " " and resid 96 and name HN )) (( segid " " and resid 95 and name HN )) ASSI {11191} (( segid " " and resid 147 and name HN )) (( segid " " and resid 150 and name HN )) 3.200 1.300 1.300 peak 11191 spectrum 1 weight 0.10000E+01 volume 0.94329E-03 ppm1 7.766 ppm2 7.304 CV 1 OR {11191} (( segid " " and resid 23 and name HN )) (( segid " " and resid 20 and name HN )) ASSI {12677} (( segid " " and resid 22 and name HN )) (( segid " " and resid 25 and name HG1 )) 3.400 1.400 1.400 peak 12677 spectrum 1 weight 0.10000E+01 volume 0.63293E-03 ppm1 8.860 ppm2 4.202 CV 1 OR {12677} (( segid " " and resid 22 and name HN )) (( segid " " and resid 24 and name HG1 )) ASSI { 6756} (( segid " " and resid 1176 and name HN )) ( segid " " and resid 1179 and name HD1%) 3.000 3.000 3.000 peak 6756 spectrum 1 weight 0.10000E+01 volume 0.12142E-02 ppm1 7.827 ppm2 0.788 CV 1 OR { 6756} (( segid " " and resid 1176 and name HN )) ( segid " " and resid 1177 and name HG2%) ASSI { 6757} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1175 and name HB )) 2.500 0.800 0.800 peak 6757 spectrum 1 weight 0.10000E+01 volume 0.37364E-02 ppm1 7.827 ppm2 4.331 CV 1 OR { 6757} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1173 and name HA )) ASSI { 6758} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1176 and name HA )) 2.500 0.800 0.800 peak 6758 spectrum 1 weight 0.10000E+01 volume 0.31551E-02 ppm1 7.825 ppm2 3.906 CV 1 OR { 6758} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1175 and name HA )) ASSI { 6759} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1178 and name HB2 )) 3.100 1.200 1.200 peak 6759 spectrum 1 weight 0.10000E+01 volume 0.88161E-03 ppm1 7.833 ppm2 2.828 CV 1 OR { 6759} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1176 and name HE2 )) OR { 6759} (( segid " " and resid 1176 and name HN )) (( segid " " and resid 1176 and name HE1 )) ASSI { 6762} (( segid " " and resid 1177 and name HN )) (( segid " " and resid 1176 and name HG1 )) 3.300 3.300 2.700 peak 6762 spectrum 1 weight 0.10000E+01 volume 0.69431E-03 ppm1 8.844 ppm2 1.315 CV 1 OR { 6762} (( segid " " and resid 1177 and name HN )) (( segid " " and resid 1174 and name HG1 )) ASSI { 6783} (( segid " " and resid 1175 and name HN )) (( segid " " and resid 1178 and name HB2 )) 3.200 1.300 1.300 peak 6783 spectrum 1 weight 0.10000E+01 volume 0.73306E-03 ppm1 7.980 ppm2 2.845 CV 1 OR { 6783} (( segid " " and resid 1175 and name HN )) (( segid " " and resid 1174 and name HE1 )) ASSI { 6796} (( segid " " and resid 1171 and name HN )) ( segid " " and resid 1170 and name HD1%) 2.500 0.800 0.800 peak 6796 spectrum 1 weight 0.10000E+01 volume 0.32972E-02 ppm1 7.853 ppm2 0.864 CV 1 OR { 6796} (( segid " " and resid 1134 and name HN )) ( segid " " and resid 1180 and name HG2%) ASSI { 6797} (( segid " " and resid 1126 and name HN )) (( segid " " and resid 1125 and name HB1 )) 3.100 1.200 1.200 peak 6797 spectrum 1 weight 0.10000E+01 volume 0.98491E-03 ppm1 8.242 ppm2 1.548 CV 1 OR { 6797} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1176 and name HD1 )) ASSI { 6798} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1174 and name HB1 )) 3.100 1.200 1.200 peak 6798 spectrum 1 weight 0.10000E+01 volume 0.10463E-02 ppm1 8.236 ppm2 1.907 CV 1 OR { 6798} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1176 and name HB2 )) OR { 6798} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1142 and name HB1 )) ASSI { 6800} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1173 and name HB2 )) 2.300 0.700 0.700 peak 6800 spectrum 1 weight 0.10000E+01 volume 0.51378E-02 ppm1 8.231 ppm2 3.908 CV 1 OR { 6800} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1170 and name HA )) ASSI { 6810} (( segid " " and resid 1153 and name HN )) (( segid " " and resid 1153 and name HB2 )) 2.500 0.800 0.800 peak 6810 spectrum 1 weight 0.10000E+01 volume 0.38591E-02 ppm1 7.838 ppm2 3.931 CV 1 OR { 6810} (( segid " " and resid 1153 and name HN )) (( segid " " and resid 1150 and name HA )) ASSI { 6816} (( segid " " and resid 1167 and name HN )) ( segid " " and resid 1163 and name HD2%) 2.700 0.900 0.900 peak 6816 spectrum 1 weight 0.10000E+01 volume 0.23510E-02 ppm1 8.647 ppm2 0.846 CV 1 OR { 6816} (( segid " " and resid 1167 and name HN )) ( segid " " and resid 1164 and name HD1%) OR { 6816} (( segid " " and resid 1167 and name HN )) (( segid " " and resid 1149 and name HG11)) OR { 6816} (( segid " " and resid 1167 and name HN )) ( segid " " and resid 1164 and name HD2%) ASSI { 6825} (( segid " " and resid 1181 and name HN )) ( segid " " and resid 1180 and name HG2%) 2.500 0.800 0.800 peak 6825 spectrum 1 weight 0.10000E+01 volume 0.33650E-02 ppm1 8.948 ppm2 0.868 CV 1 OR { 6825} (( segid " " and resid 1181 and name HN )) (( segid " " and resid 1180 and name HG11)) OR { 6825} (( segid " " and resid 1181 and name HN )) ( segid " " and resid 1135 and name HD2%) ASSI { 6832} (( segid " " and resid 1181 and name HN )) (( segid " " and resid 1180 and name HA )) 3.400 1.400 1.400 peak 6832 spectrum 1 weight 0.10000E+01 volume 0.55222E-03 ppm1 8.950 ppm2 3.673 CV 1 OR { 6832} (( segid " " and resid 1181 and name HN )) (( segid " " and resid 1179 and name HA )) ASSI { 6837} (( segid " " and resid 1146 and name HN )) (( segid " " and resid 1149 and name HG11)) 3.000 1.100 1.100 peak 6837 spectrum 1 weight 0.10000E+01 volume 0.11884E-02 ppm1 8.511 ppm2 0.835 CV 1 OR { 6837} (( segid " " and resid 1146 and name HN )) ( segid " " and resid 67 and name HD1%) ASSI { 6843} (( segid " " and resid 1146 and name HN )) (( segid " " and resid 1145 and name HA )) 2.800 0.900 0.900 peak 6843 spectrum 1 weight 0.10000E+01 volume 0.19376E-02 ppm1 8.505 ppm2 4.152 CV 1 OR { 6843} (( segid " " and resid 1146 and name HN )) (( segid " " and resid 1143 and name HA )) ASSI { 6845} (( segid " " and resid 1186 and name HN )) ( segid " " and resid 1184 and name HD1%) 3.200 1.300 1.300 peak 6845 spectrum 1 weight 0.10000E+01 volume 0.78796E-03 ppm1 7.684 ppm2 0.893 CV 1 OR { 6845} (( segid " " and resid 1186 and name HN )) ( segid " " and resid 1184 and name HD2%) OR { 6845} (( segid " " and resid 1186 and name HN )) ( segid " " and resid 1128 and name HG2%) ASSI { 6847} (( segid " " and resid 1186 and name HN )) (( segid " " and resid 1186 and name HB2 )) 2.100 0.600 0.600 peak 6847 spectrum 1 weight 0.10000E+01 volume 0.90680E-02 ppm1 7.686 ppm2 1.849 CV 1 OR { 6847} (( segid " " and resid 1186 and name HN )) (( segid " " and resid 1185 and name HB1 )) ASSI { 6852} (( segid " " and resid 1132 and name HN )) ( segid " " and resid 1184 and name HD2%) 2.500 0.800 0.800 peak 6852 spectrum 1 weight 0.10000E+01 volume 0.38913E-02 ppm1 8.672 ppm2 0.878 CV 1 OR { 6852} (( segid " " and resid 1132 and name HN )) ( segid " " and resid 1184 and name HD1%) OR { 6852} (( segid " " and resid 1132 and name HN )) ( segid " " and resid 1131 and name HD2%) ASSI { 6859} (( segid " " and resid 1132 and name HN )) (( segid " " and resid 1129 and name HA )) 2.700 0.900 0.900 peak 6859 spectrum 1 weight 0.10000E+01 volume 0.23510E-02 ppm1 8.668 ppm2 4.145 CV 1 OR { 6859} (( segid " " and resid 1132 and name HN )) (( segid " " and resid 1131 and name HA )) ASSI { 6861} (( segid " " and resid 1132 and name HN )) (( segid " " and resid 1131 and name HN )) 2.400 0.700 0.700 peak 6861 spectrum 1 weight 0.10000E+01 volume 0.41755E-02 ppm1 8.669 ppm2 7.851 CV 1 OR { 6861} (( segid " " and resid 1132 and name HN )) (( segid " " and resid 1133 and name HN )) ASSI { 6864} (( segid " " and resid 1139 and name HN )) (( segid " " and resid 1139 and name HB2 )) 2.500 0.800 0.800 peak 6864 spectrum 1 weight 0.10000E+01 volume 0.33747E-02 ppm1 8.733 ppm2 1.882 CV 1 OR { 6864} (( segid " " and resid 1139 and name HN )) (( segid " " and resid 1138 and name HB1 )) ASSI { 6874} (( segid " " and resid 1135 and name HN )) (( segid " " and resid 1131 and name HA )) 3.000 1.100 1.100 peak 6874 spectrum 1 weight 0.10000E+01 volume 0.11012E-02 ppm1 8.662 ppm2 4.119 CV 1 OR { 6874} (( segid " " and resid 1135 and name HN )) (( segid " " and resid 1133 and name HA )) ASSI { 6881} (( segid " " and resid 1184 and name HN )) (( segid " " and resid 1184 and name HA )) 2.500 0.800 0.800 peak 6881 spectrum 1 weight 0.10000E+01 volume 0.37428E-02 ppm1 9.014 ppm2 3.941 CV 1 OR { 6881} (( segid " " and resid 1184 and name HN )) (( segid " " and resid 1183 and name HA )) ASSI { 6892} (( segid " " and resid 1190 and name HN )) (( segid " " and resid 1190 and name HA )) 2.200 0.600 0.600 peak 6892 spectrum 1 weight 0.10000E+01 volume 0.67623E-02 ppm1 7.903 ppm2 4.166 CV 1 OR { 6892} (( segid " " and resid 1190 and name HN )) (( segid " " and resid 1189 and name HA )) ASSI { 6895} (( segid " " and resid 1140 and name HN )) ( segid " " and resid 1139 and name HD2%) 2.800 0.900 0.900 peak 6895 spectrum 1 weight 0.10000E+01 volume 0.19279E-02 ppm1 7.375 ppm2 0.840 CV 1 OR { 6895} (( segid " " and resid 1140 and name HN )) ( segid " " and resid 1137 and name HG2%) OR { 6895} (( segid " " and resid 1140 and name HN )) ( segid " " and resid 1139 and name HD1%) ASSI { 6921} (( segid " " and resid 1143 and name HN )) (( segid " " and resid 1144 and name HA2 )) 3.000 3.000 3.000 peak 6921 spectrum 1 weight 0.10000E+01 volume 0.10819E-02 ppm1 7.853 ppm2 3.896 CV 1 OR { 6921} (( segid " " and resid 1143 and name HN )) (( segid " " and resid 1144 and name HA1 )) OR { 6921} (( segid " " and resid 1143 and name HN )) (( segid " " and resid 1173 and name HB2 )) ASSI { 6931} (( segid " " and resid 1188 and name HN )) (( segid " " and resid 1188 and name HA )) 2.400 0.700 0.700 peak 6931 spectrum 1 weight 0.10000E+01 volume 0.41432E-02 ppm1 8.001 ppm2 4.111 CV 1 OR { 6931} (( segid " " and resid 1188 and name HN )) (( segid " " and resid 1187 and name HA )) ASSI { 6936} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1192 and name HG2 )) 3.200 1.300 1.300 peak 6936 spectrum 1 weight 0.10000E+01 volume 0.82026E-03 ppm1 8.114 ppm2 2.357 CV 1 OR { 6936} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1192 and name HG1 )) OR { 6936} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1189 and name HG1 )) ASSI { 6937} (( segid " " and resid 1192 and name HN )) (( segid " " and resid 1192 and name HB1 )) 2.300 0.700 0.700 peak 6937 spectrum 1 weight 0.10000E+01 volume 0.57805E-02 ppm1 8.007 ppm2 2.007 CV 1 OR { 6937} (( segid " " and resid 1128 and name HN )) (( segid " " and resid 1128 and name HB )) ASSI { 6939} (( segid " " and resid 1147 and name HN )) ( segid " " and resid 1145 and name HB% ) 3.400 1.400 1.400 peak 6939 spectrum 1 weight 0.10000E+01 volume 0.57160E-03 ppm1 8.261 ppm2 1.469 CV 1 OR { 6939} (( segid " " and resid 1147 and name HN )) (( segid " " and resid 1170 and name HG )) ASSI { 6946} (( segid " " and resid 1147 and name HN )) (( segid " " and resid 1146 and name HA )) 2.700 0.900 0.900 peak 6946 spectrum 1 weight 0.10000E+01 volume 0.24026E-02 ppm1 8.257 ppm2 3.872 CV 1 OR { 6946} (( segid " " and resid 1147 and name HN )) (( segid " " and resid 1144 and name HA1 )) ASSI { 6953} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1190 and name HA )) 2.400 0.700 0.700 peak 6953 spectrum 1 weight 0.10000E+01 volume 0.45857E-02 ppm1 8.113 ppm2 4.164 CV 1 OR { 6953} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1189 and name HA )) ASSI { 6955} (( segid " " and resid 1189 and name HN )) ( segid " " and resid 1187 and name HB% ) 2.900 1.000 1.000 peak 6955 spectrum 1 weight 0.10000E+01 volume 0.15145E-02 ppm1 7.635 ppm2 1.391 CV 1 OR { 6955} (( segid " " and resid 1189 and name HN )) ( segid " " and resid 1190 and name HB% ) ASSI { 6962} (( segid " " and resid 1152 and name HN )) (( segid " " and resid 1153 and name HN )) 2.600 0.900 0.900 peak 6962 spectrum 1 weight 0.10000E+01 volume 0.26254E-02 ppm1 8.119 ppm2 7.874 CV 1 OR { 6962} (( segid " " and resid 1152 and name HN )) (( segid " " and resid 1151 and name HN )) ASSI { 6967} (( segid " " and resid 1161 and name HN )) (( segid " " and resid 1161 and name HA )) 2.800 1.000 1.000 peak 6967 spectrum 1 weight 0.10000E+01 volume 0.18536E-02 ppm1 8.123 ppm2 3.967 CV 1 OR { 6967} (( segid " " and resid 1161 and name HN )) (( segid " " and resid 1160 and name HA )) ASSI { 6979} (( segid " " and resid 1185 and name HN )) ( segid " " and resid 1184 and name HD1%) 2.700 0.900 0.900 peak 6979 spectrum 1 weight 0.10000E+01 volume 0.22703E-02 ppm1 7.915 ppm2 0.867 CV 1 OR { 6979} (( segid " " and resid 1185 and name HN )) ( segid " " and resid 1184 and name HD2%) OR { 6979} (( segid " " and resid 1185 and name HN )) ( segid " " and resid 1188 and name HD2%) ASSI { 6985} (( segid " " and resid 1185 and name HN )) (( segid " " and resid 1185 and name HA )) 2.300 0.600 0.600 peak 6985 spectrum 1 weight 0.10000E+01 volume 0.60324E-02 ppm1 7.915 ppm2 3.944 CV 1 OR { 6985} (( segid " " and resid 1185 and name HN )) (( segid " " and resid 1184 and name HA )) ASSI { 6993} (( segid " " and resid 1181 and name HN )) (( segid " " and resid 1183 and name HG2 )) 3.400 1.400 1.400 peak 6993 spectrum 1 weight 0.10000E+01 volume 0.55545E-03 ppm1 8.954 ppm2 2.607 CV 1 OR { 6993} (( segid " " and resid 1181 and name HN )) (( segid " " and resid 1178 and name HB1 )) ASSI { 6995} (( segid " " and resid 1130 and name HN )) ( segid " " and resid 1131 and name HD2%) 3.200 1.200 1.200 peak 6995 spectrum 1 weight 0.10000E+01 volume 0.86224E-03 ppm1 8.248 ppm2 0.905 CV 1 OR { 6995} (( segid " " and resid 1130 and name HN )) ( segid " " and resid 1128 and name HG2%) OR { 6995} (( segid " " and resid 1130 and name HN )) ( segid " " and resid 1184 and name HD1%) ASSI { 6996} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1184 and name HD2%) 2.900 2.900 3.100 peak 6996 spectrum 1 weight 0.10000E+01 volume 0.14338E-02 ppm1 7.825 ppm2 0.860 CV 1 OR { 6996} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1135 and name HD1%) OR { 6996} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1131 and name HD2%) OR { 6996} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1180 and name HG2%) OR { 6996} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1184 and name HD1%) ASSI { 6997} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1133 and name HG2 )) 2.800 1.000 1.000 peak 6997 spectrum 1 weight 0.10000E+01 volume 0.18730E-02 ppm1 7.830 ppm2 1.525 CV 1 OR { 6997} (( segid " " and resid 1133 and name HN )) ( segid " " and resid 1136 and name HB% ) ASSI { 6999} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1133 and name HB1 )) 2.100 0.600 0.600 peak 6999 spectrum 1 weight 0.10000E+01 volume 0.92198E-02 ppm1 7.831 ppm2 1.948 CV 1 OR { 6999} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1132 and name HB1 )) OR { 6999} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1133 and name HB2 )) ASSI { 7001} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1132 and name HG2 )) 3.100 1.200 1.200 peak 7001 spectrum 1 weight 0.10000E+01 volume 0.86869E-03 ppm1 7.828 ppm2 2.492 CV 1 OR { 7001} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1134 and name HG2 )) ASSI { 7002} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1132 and name HA )) 2.700 0.900 0.900 peak 7002 spectrum 1 weight 0.10000E+01 volume 0.22186E-02 ppm1 7.831 ppm2 3.859 CV 1 OR { 7002} (( segid " " and resid 1133 and name HN )) (( segid " " and resid 1130 and name HA1 )) ASSI { 7007} (( segid " " and resid 1169 and name HN )) (( segid " " and resid 1168 and name HB2 )) 2.400 2.400 3.600 peak 7007 spectrum 1 weight 0.10000E+01 volume 0.44306E-02 ppm1 8.246 ppm2 2.217 CV 1 OR { 7007} (( segid " " and resid 1169 and name HN )) (( segid " " and resid 1169 and name HB2 )) ASSI { 7011} (( segid " " and resid 1169 and name HN )) (( segid " " and resid 1168 and name HA )) 2.800 1.000 1.000 peak 7011 spectrum 1 weight 0.10000E+01 volume 0.15953E-02 ppm1 8.248 ppm2 3.966 CV 1 OR { 7011} (( segid " " and resid 1169 and name HN )) (( segid " " and resid 1165 and name HA )) ASSI { 7019} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1171 and name HA )) 2.500 0.800 0.800 peak 7019 spectrum 1 weight 0.10000E+01 volume 0.34974E-02 ppm1 8.478 ppm2 3.942 CV 1 OR { 7019} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1170 and name HA )) OR { 7019} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1168 and name HA )) ASSI { 7024} (( segid " " and resid 1172 and name HN )) ( segid " " and resid 1145 and name HB% ) 3.400 1.400 1.400 peak 7024 spectrum 1 weight 0.10000E+01 volume 0.59743E-03 ppm1 8.477 ppm2 1.546 CV 1 OR { 7024} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1176 and name HD2 )) OR { 7024} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1176 and name HD1 )) OR { 7024} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1174 and name HD2 )) OR { 7024} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1174 and name HD1 )) ASSI { 7025} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1174 and name HB1 )) 3.300 3.300 2.700 peak 7025 spectrum 1 weight 0.10000E+01 volume 0.65233E-03 ppm1 8.469 ppm2 1.890 CV 1 OR { 7025} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1174 and name HB2 )) OR { 7025} (( segid " " and resid 1172 and name HN )) (( segid " " and resid 1176 and name HB2 )) ASSI { 7026} (( segid " " and resid 1182 and name HN )) ( segid " " and resid 1179 and name HG2%) 2.800 2.800 3.200 peak 7026 spectrum 1 weight 0.10000E+01 volume 0.17794E-02 ppm1 7.801 ppm2 0.854 CV 1 OR { 7026} (( segid " " and resid 1182 and name HN )) ( segid " " and resid 1177 and name HG2%) OR { 7026} (( segid " " and resid 1182 and name HN )) (( segid " " and resid 1180 and name HG11)) OR { 7026} (( segid " " and resid 1182 and name HN )) ( segid " " and resid 1135 and name HD2%) OR { 7026} (( segid " " and resid 1182 and name HN )) ( segid " " and resid 1135 and name HD1%) ASSI { 7032} (( segid " " and resid 1162 and name HN )) (( segid " " and resid 1162 and name HA )) 2.600 0.800 0.800 peak 7032 spectrum 1 weight 0.10000E+01 volume 0.29806E-02 ppm1 7.677 ppm2 3.924 CV 1 OR { 7032} (( segid " " and resid 1162 and name HN )) (( segid " " and resid 1161 and name HA )) ASSI { 7033} (( segid " " and resid 1182 and name HN )) (( segid " " and resid 1181 and name HD2 )) 3.300 1.300 1.300 peak 7033 spectrum 1 weight 0.10000E+01 volume 0.67170E-03 ppm1 7.804 ppm2 3.161 CV 1 OR { 7033} (( segid " " and resid 1182 and name HN )) (( segid " " and resid 1185 and name HD1 )) ASSI { 7037} (( segid " " and resid 1182 and name HN )) (( segid " " and resid 1183 and name HA )) 2.900 2.900 3.100 peak 7037 spectrum 1 weight 0.10000E+01 volume 0.12949E-02 ppm1 7.806 ppm2 3.923 CV 1 OR { 7037} (( segid " " and resid 1182 and name HN )) (( segid " " and resid 1184 and name HA )) ASSI { 7050} (( segid " " and resid 1174 and name HN )) (( segid " " and resid 1173 and name HA )) 2.800 1.000 1.000 peak 7050 spectrum 1 weight 0.10000E+01 volume 0.18020E-02 ppm1 8.390 ppm2 4.339 CV 1 OR { 7050} (( segid " " and resid 1174 and name HN )) (( segid " " and resid 1172 and name HA )) ASSI { 7052} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1171 and name HN )) 3.400 1.400 1.400 peak 7052 spectrum 1 weight 0.10000E+01 volume 0.58451E-03 ppm1 8.239 ppm2 7.847 CV 1 OR { 7052} (( segid " " and resid 1173 and name HN )) (( segid " " and resid 1176 and name HN )) ASSI { 7059} (( segid " " and resid 1170 and name HN )) (( segid " " and resid 1169 and name HA )) 3.000 1.100 1.100 peak 7059 spectrum 1 weight 0.10000E+01 volume 0.11367E-02 ppm1 8.416 ppm2 4.152 CV 1 OR { 7059} (( segid " " and resid 1170 and name HN )) (( segid " " and resid 1166 and name HA )) ASSI { 7073} (( segid " " and resid 1167 and name HN )) (( segid " " and resid 1165 and name HN )) 3.200 1.300 1.300 peak 7073 spectrum 1 weight 0.10000E+01 volume 0.77504E-03 ppm1 8.650 ppm2 7.836 CV 1 OR { 7073} (( segid " " and resid 1167 and name HN )) (( segid " " and resid 1164 and name HN )) ASSI { 7080} (( segid " " and resid 1183 and name HN )) ( segid " " and resid 1179 and name HG2%) 2.400 2.400 3.600 peak 7080 spectrum 1 weight 0.10000E+01 volume 0.41497E-02 ppm1 8.301 ppm2 0.871 CV 1 OR { 7080} (( segid " " and resid 1183 and name HN )) ( segid " " and resid 1180 and name HG2%) OR { 7080} (( segid " " and resid 1183 and name HN )) ( segid " " and resid 1131 and name HD2%) ASSI { 7081} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1184 and name HB2 )) 2.800 1.000 1.000 peak 7081 spectrum 1 weight 0.10000E+01 volume 0.17632E-02 ppm1 8.297 ppm2 1.739 CV 1 OR { 7081} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1186 and name HG2 )) OR { 7081} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1184 and name HB1 )) OR { 7081} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1185 and name HG2 )) OR { 7081} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1181 and name HG2 )) ASSI { 7084} (( segid " " and resid 1138 and name HN )) (( segid " " and resid 1135 and name HB1 )) 3.100 3.100 2.900 peak 7084 spectrum 1 weight 0.10000E+01 volume 0.89776E-03 ppm1 8.194 ppm2 1.545 CV 1 OR { 7084} (( segid " " and resid 1138 and name HN )) (( segid " " and resid 1133 and name HG2 )) OR { 7084} (( segid " " and resid 1138 and name HN )) (( segid " " and resid 1176 and name HG2 )) ASSI { 7089} (( segid " " and resid 1138 and name HN )) (( segid " " and resid 1135 and name HA )) 2.800 1.000 1.000 peak 7089 spectrum 1 weight 0.10000E+01 volume 0.16179E-02 ppm1 8.196 ppm2 3.912 CV 1 OR { 7089} (( segid " " and resid 1138 and name HN )) (( segid " " and resid 1134 and name HA )) ASSI { 7094} (( segid " " and resid 1187 and name HN )) ( segid " " and resid 1188 and name HD2%) 2.800 1.000 1.000 peak 7094 spectrum 1 weight 0.10000E+01 volume 0.16276E-02 ppm1 8.055 ppm2 0.873 CV 1 OR { 7094} (( segid " " and resid 1187 and name HN )) ( segid " " and resid 1184 and name HD1%) ASSI { 7103} (( segid " " and resid 1187 and name HN )) (( segid " " and resid 1184 and name HA )) 2.600 0.800 0.800 peak 7103 spectrum 1 weight 0.10000E+01 volume 0.29419E-02 ppm1 8.058 ppm2 3.934 CV 1 OR { 7103} (( segid " " and resid 1187 and name HN )) (( segid " " and resid 1185 and name HA )) ASSI { 7106} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1180 and name HA )) 2.900 1.100 1.100 peak 7106 spectrum 1 weight 0.10000E+01 volume 0.13628E-02 ppm1 8.294 ppm2 3.681 CV 1 OR { 7106} (( segid " " and resid 1183 and name HN )) (( segid " " and resid 1179 and name HA )) ASSI { 7114} (( segid " " and resid 1125 and name HN )) (( segid " " and resid 1125 and name HA )) 2.200 0.600 0.600 peak 7114 spectrum 1 weight 0.10000E+01 volume 0.70690E-02 ppm1 8.056 ppm2 4.224 CV 1 OR { 7114} (( segid " " and resid 1193 and name HN )) (( segid " " and resid 1193 and name HA )) ASSI { 7123} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1162 and name HB1 )) 2.600 0.800 0.800 peak 7123 spectrum 1 weight 0.10000E+01 volume 0.27126E-02 ppm1 7.718 ppm2 0.832 CV 1 OR { 7123} (( segid " " and resid 1163 and name HN )) ( segid " " and resid 1163 and name HD1%) ASSI { 7126} (( segid " " and resid 1163 and name HN )) ( segid " " and resid 1166 and name HB% ) 3.100 1.200 1.200 peak 7126 spectrum 1 weight 0.10000E+01 volume 0.10302E-02 ppm1 7.713 ppm2 1.618 CV 1 OR { 7126} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1160 and name HG1 )) OR { 7126} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1160 and name HG2 )) OR { 7126} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1161 and name HD1 )) ASSI { 7128} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1152 and name HB1 )) 3.300 1.400 1.400 peak 7128 spectrum 1 weight 0.10000E+01 volume 0.65878E-03 ppm1 7.736 ppm2 2.591 CV 1 OR { 7128} (( segid " " and resid 1163 and name HN )) (( segid " " and resid 1159 and name HB1 )) ASSI { 7151} (( segid " " and resid 1164 and name HN )) (( segid " " and resid 1161 and name HA )) 2.300 2.300 3.700 peak 7151 spectrum 1 weight 0.10000E+01 volume 0.50862E-02 ppm1 7.807 ppm2 3.939 CV 1 OR { 7151} (( segid " " and resid 1164 and name HN )) (( segid " " and resid 1160 and name HA )) ASSI { 7159} (( segid " " and resid 1180 and name HN )) (( segid " " and resid 1176 and name HA )) 3.200 1.300 1.300 peak 7159 spectrum 1 weight 0.10000E+01 volume 0.80411E-03 ppm1 8.560 ppm2 3.895 CV 1 OR { 7159} (( segid " " and resid 1180 and name HN )) (( segid " " and resid 1181 and name HA )) ASSI { 7164} (( segid " " and resid 1178 and name HN )) (( segid " " and resid 1178 and name HA )) 2.600 0.800 0.800 peak 7164 spectrum 1 weight 0.10000E+01 volume 0.29290E-02 ppm1 7.709 ppm2 4.373 CV 1 OR { 7164} (( segid " " and resid 1150 and name HN )) (( segid " " and resid 1147 and name HA )) ASSI { 7167} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1189 and name HB2 )) 3.300 1.400 1.400 peak 7167 spectrum 1 weight 0.10000E+01 volume 0.62972E-03 ppm1 8.108 ppm2 2.050 CV 1 OR { 7167} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1189 and name HB1 )) OR { 7167} (( segid " " and resid 1191 and name HN )) (( segid " " and resid 1192 and name HB2 )) ASSI { 7178} (( segid " " and resid 1142 and name HN )) (( segid " " and resid 1138 and name HA )) 3.100 1.200 1.200 peak 7178 spectrum 1 weight 0.10000E+01 volume 0.91067E-03 ppm1 8.480 ppm2 4.114 CV 1 OR { 7178} (( segid " " and resid 1142 and name HN )) (( segid " " and resid 1140 and name HA )) ASSI { 7181} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1162 and name HB1 )) 2.800 2.800 3.200 peak 7181 spectrum 1 weight 0.10000E+01 volume 0.15856E-02 ppm1 8.176 ppm2 0.842 CV 1 OR { 7181} (( segid " " and resid 1166 and name HN )) ( segid " " and resid 1164 and name HD1%) OR { 7181} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1149 and name HG11)) OR { 7181} (( segid " " and resid 1166 and name HN )) ( segid " " and resid 1164 and name HD2%) ASSI { 7184} (( segid " " and resid 1166 and name HN )) ( segid " " and resid 1169 and name HE% ) 3.100 1.200 1.200 peak 7184 spectrum 1 weight 0.10000E+01 volume 0.87515E-03 ppm1 8.170 ppm2 1.987 CV 1 OR { 7184} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1169 and name HB1 )) OR { 7184} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1148 and name HB1 )) OR { 7184} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1148 and name HB2 )) ASSI { 7186} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1167 and name HB2 )) 3.100 1.200 1.200 peak 7186 spectrum 1 weight 0.10000E+01 volume 0.91067E-03 ppm1 8.172 ppm2 2.319 CV 1 OR { 7186} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1168 and name HG1 )) ASSI { 7187} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1165 and name HA )) 2.600 0.800 0.800 peak 7187 spectrum 1 weight 0.10000E+01 volume 0.30195E-02 ppm1 8.175 ppm2 3.927 CV 1 OR { 7187} (( segid " " and resid 1166 and name HN )) (( segid " " and resid 1162 and name HA )) ASSI { 7201} (( segid " " and resid 1130 and name HN )) (( segid " " and resid 1127 and name HA )) 3.100 1.200 1.200 peak 7201 spectrum 1 weight 0.10000E+01 volume 0.89452E-03 ppm1 8.222 ppm2 4.151 CV 1 OR { 7201} (( segid " " and resid 1130 and name HN )) (( segid " " and resid 1129 and name HA )) ASSI { 7212} (( segid " " and resid 1141 and name HN )) (( segid " " and resid 1140 and name HB1 )) 3.200 1.200 1.200 peak 7212 spectrum 1 weight 0.10000E+01 volume 0.84931E-03 ppm1 7.990 ppm2 1.937 CV 1 OR { 7212} (( segid " " and resid 1141 and name HN )) (( segid " " and resid 1142 and name HB1 )) ASSI { 7215} (( segid " " and resid 1141 and name HN )) (( segid " " and resid 1138 and name HA )) 3.100 1.200 1.200 peak 7215 spectrum 1 weight 0.10000E+01 volume 0.92036E-03 ppm1 7.991 ppm2 4.109 CV 1 OR { 7215} (( segid " " and resid 1141 and name HN )) (( segid " " and resid 1140 and name HA )) ASSI { 7217} (( segid " " and resid 1137 and name HN )) ( segid " " and resid 1137 and name HG2%) 2.400 2.400 3.600 peak 7217 spectrum 1 weight 0.10000E+01 volume 0.41465E-02 ppm1 7.661 ppm2 0.815 CV 1 OR { 7217} (( segid " " and resid 1137 and name HN )) ( segid " " and resid 1139 and name HD2%) ASSI { 7218} (( segid " " and resid 1164 and name HN )) ( segid " " and resid 1164 and name HD2%) 2.400 2.400 3.600 peak 7218 spectrum 1 weight 0.10000E+01 volume 0.39494E-02 ppm1 7.808 ppm2 0.846 CV 1 OR { 7218} (( segid " " and resid 1164 and name HN )) ( segid " " and resid 1164 and name HD1%) OR { 7218} (( segid " " and resid 1164 and name HN )) ( segid " " and resid 1163 and name HD2%) ASSI { 7219} (( segid " " and resid 1134 and name HN )) (( segid " " and resid 1134 and name HG1 )) 2.500 0.800 0.800 peak 7219 spectrum 1 weight 0.10000E+01 volume 0.34199E-02 ppm1 7.849 ppm2 2.432 CV 1 OR { 7219} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1171 and name HG1 )) OR { 7219} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1171 and name HG2 )) ASSI { 7220} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1170 and name HG )) 2.500 2.500 3.500 peak 7220 spectrum 1 weight 0.10000E+01 volume 0.32649E-02 ppm1 7.845 ppm2 1.521 CV 1 OR { 7220} (( segid " " and resid 1171 and name HN )) ( segid " " and resid 1145 and name HB% ) OR { 7220} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1174 and name HD2 )) ASSI { 7221} (( segid " " and resid 1134 and name HN )) (( segid " " and resid 1134 and name HB1 )) 2.100 0.600 0.600 peak 7221 spectrum 1 weight 0.10000E+01 volume 0.92198E-02 ppm1 7.848 ppm2 2.139 CV 1 OR { 7221} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1171 and name HB1 )) OR { 7221} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1171 and name HB2 )) ASSI { 7223} (( segid " " and resid 1134 and name HN )) (( segid " " and resid 1134 and name HA )) 2.200 0.600 0.600 peak 7223 spectrum 1 weight 0.10000E+01 volume 0.78343E-02 ppm1 7.849 ppm2 3.939 CV 1 OR { 7223} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1171 and name HA )) OR { 7223} (( segid " " and resid 1171 and name HN )) (( segid " " and resid 1168 and name HA )) ASSI { 7228} (( segid " " and resid 1164 and name HN )) (( segid " " and resid 1164 and name HB2 )) 2.200 0.600 0.600 peak 7228 spectrum 1 weight 0.10000E+01 volume 0.67946E-02 ppm1 7.806 ppm2 1.772 CV 1 OR { 7228} (( segid " " and resid 1164 and name HN )) (( segid " " and resid 1163 and name HB2 )) ASSI { 7231} (( segid " " and resid 1137 and name HN )) (( segid " " and resid 1135 and name HG )) 2.600 2.600 3.400 peak 7231 spectrum 1 weight 0.10000E+01 volume 0.26965E-02 ppm1 7.662 ppm2 1.727 CV 1 OR { 7231} (( segid " " and resid 1137 and name HN )) (( segid " " and resid 1139 and name HG )) ASSI { 7237} (( segid " " and resid 1134 and name HN )) (( segid " " and resid 1131 and name HA )) 2.500 0.800 0.800 peak 7237 spectrum 1 weight 0.10000E+01 volume 0.34780E-02 ppm1 7.856 ppm2 4.100 CV 1 OR { 7237} (( segid " " and resid 1134 and name HN )) (( segid " " and resid 1133 and name HA )) ASSI { 7255} (( segid " " and resid 1136 and name HN )) (( segid " " and resid 1137 and name HB )) 2.500 2.500 3.500 peak 7255 spectrum 1 weight 0.10000E+01 volume 0.34490E-02 ppm1 7.659 ppm2 1.959 CV 1 OR { 7255} (( segid " " and resid 1136 and name HN )) (( segid " " and resid 1133 and name HB1 )) OR { 7255} (( segid " " and resid 1136 and name HN )) (( segid " " and resid 1133 and name HB2 )) ASSI { 9949} (( segid " " and resid 1150 and name HN )) (( segid " " and resid 1150 and name HA )) 2.300 0.700 0.700 peak 9949 spectrum 1 weight 0.10000E+01 volume 0.53446E-02 ppm1 7.669 ppm2 3.936 CV 1 OR { 9949} (( segid " " and resid 1178 and name HN )) (( segid " " and resid 1175 and name HA )) ASSI { 9958} (( segid " " and resid 1150 and name HN )) ( segid " " and resid 1149 and name HG2%) 2.300 0.700 0.700 peak 9958 spectrum 1 weight 0.10000E+01 volume 0.59323E-02 ppm1 7.665 ppm2 0.844 CV 1 OR { 9958} (( segid " " and resid 1178 and name HN )) ( segid " " and resid 1177 and name HG2%) OR { 9958} (( segid " " and resid 1136 and name HN )) ( segid " " and resid 1135 and name HD2%) OR { 9958} (( segid " " and resid 1136 and name HN )) ( segid " " and resid 1135 and name HD1%) OR { 9958} (( segid " " and resid 1150 and name HN )) (( segid " " and resid 1149 and name HG11)) ASSI {11002} (( segid " " and resid 1183 and name HE21)) (( segid " " and resid 1183 and name HG2 )) 2.700 0.900 0.900 peak 11002 spectrum 1 weight 0.10000E+01 volume 0.20991E-02 ppm1 6.601 ppm2 2.591 CV 1 OR {11002} (( segid " " and resid 1167 and name HE21)) (( segid " " and resid 1167 and name HG2 )) ASSI {11003} (( segid " " and resid 1167 and name HE21)) (( segid " " and resid 1167 and name HG1 )) 2.500 0.800 0.800 peak 11003 spectrum 1 weight 0.10000E+01 volume 0.36104E-02 ppm1 6.602 ppm2 2.325 CV 1 OR {11003} (( segid " " and resid 1183 and name HE21)) (( segid " " and resid 1183 and name HB2 )) OR {11003} (( segid " " and resid 1183 and name HE21)) (( segid " " and resid 1183 and name HG1 )) ASSI {11004} (( segid " " and resid 1183 and name HE21)) (( segid " " and resid 1179 and name HB )) 3.000 1.100 1.100 peak 11004 spectrum 1 weight 0.10000E+01 volume 0.11044E-02 ppm1 6.602 ppm2 1.991 CV 1 OR {11004} (( segid " " and resid 1183 and name HE21)) (( segid " " and resid 1183 and name HB1 )) OR {11004} (( segid " " and resid 1167 and name HE21)) (( segid " " and resid 1167 and name HB1 )) ASSI {11006} (( segid " " and resid 1167 and name HE21)) ( segid " " and resid 1149 and name HG2%) 2.300 0.700 0.700 peak 11006 spectrum 1 weight 0.10000E+01 volume 0.58064E-02 ppm1 6.602 ppm2 0.846 CV 1 OR {11006} (( segid " " and resid 1183 and name HE21)) ( segid " " and resid 1179 and name HG2%) ASSI {11011} (( segid " " and resid 1154 and name HD22)) (( segid " " and resid 1153 and name HB2 )) 3.300 1.300 1.300 peak 11011 spectrum 1 weight 0.10000E+01 volume 0.70076E-03 ppm1 7.626 ppm2 3.938 CV 1 OR {11011} (( segid " " and resid 1154 and name HD22)) (( segid " " and resid 1150 and name HA )) ASSI {11012} (( segid " " and resid 1154 and name HD21)) (( segid " " and resid 1153 and name HB2 )) 3.300 1.400 1.400 peak 11012 spectrum 1 weight 0.10000E+01 volume 0.66848E-03 ppm1 7.033 ppm2 3.916 CV 1 OR {11012} (( segid " " and resid 1154 and name HD21)) (( segid " " and resid 1150 and name HA )) ASSI {11039} (( segid " " and resid 1168 and name HE22)) ( segid " " and resid 1164 and name HD1%) 3.300 1.400 1.400 peak 11039 spectrum 1 weight 0.10000E+01 volume 0.66525E-03 ppm1 7.417 ppm2 0.850 CV 1 OR {11039} (( segid " " and resid 1168 and name HE22)) ( segid " " and resid 192 and name HD2%) ASSI {11041} (( segid " " and resid 1168 and name HE21)) ( segid " " and resid 1164 and name HD1%) 3.100 1.200 1.200 peak 11041 spectrum 1 weight 0.10000E+01 volume 0.98817E-03 ppm1 6.774 ppm2 0.834 CV 1 OR {11041} (( segid " " and resid 1168 and name HE21)) ( segid " " and resid 192 and name HD2%) ASSI {11055} (( segid " " and resid 1134 and name HE21)) (( segid " " and resid 1134 and name HE22)) 1.600 0.300 0.600 peak 11055 spectrum 1 weight 0.10000E+01 volume 0.50335E-01 ppm1 6.728 ppm2 7.487 CV 1 OR {11055} (( segid " " and resid 1189 and name HE21)) (( segid " " and resid 1189 and name HE22)) ASSI {11056} (( segid " " and resid 1134 and name HE22)) (( segid " " and resid 1137 and name HB )) 3.100 1.200 1.200 peak 11056 spectrum 1 weight 0.10000E+01 volume 0.89129E-03 ppm1 7.496 ppm2 1.950 CV 1 OR {11056} (( segid " " and resid 1134 and name HE22)) (( segid " " and resid 1133 and name HB1 )) ASSI {11065} (( segid " " and resid 1134 and name HE21)) (( segid " " and resid 1137 and name HB )) 3.100 1.200 1.200 peak 11065 spectrum 1 weight 0.10000E+01 volume 0.10011E-02 ppm1 6.721 ppm2 1.948 CV 1 OR {11065} (( segid " " and resid 1134 and name HE21)) (( segid " " and resid 1133 and name HB1 )) ASSI {11067} (( segid " " and resid 1134 and name HE21)) ( segid " " and resid 1137 and name HG2%) 2.700 0.900 0.900 peak 11067 spectrum 1 weight 0.10000E+01 volume 0.23638E-02 ppm1 6.724 ppm2 0.845 CV 1 OR {11067} (( segid " " and resid 1189 and name HE21)) ( segid " " and resid 1193 and name HD2%) ASSI { 3401} (( segid " " and resid 27 and name HN )) (( segid " " and resid 27 and name HA )) 2.200 0.600 0.600 peak 3401 spectrum 1 weight 0.10000E+01 volume 0.69656E-02 ppm1 7.597 ppm2 4.438 CV 1 OR { 3401} (( segid " " and resid 27 and name HN )) (( segid " " and resid 26 and name HA )) ASSI { 3402} (( segid " " and resid 131 and name HN )) (( segid " " and resid 131 and name HA )) 2.100 0.600 0.600 peak 3402 spectrum 1 weight 0.10000E+01 volume 0.94422E-02 ppm1 7.738 ppm2 4.030 CV 1 OR { 3402} (( segid " " and resid 131 and name HN )) (( segid " " and resid 128 and name HA )) ASSI { 4006} (( segid " " and resid 122 and name HN )) (( segid " " and resid 122 and name HA )) 2.500 0.800 0.800 peak 4006 spectrum 1 weight 0.10000E+01 volume 0.33553E-02 ppm1 7.152 ppm2 4.548 CV 1 OR { 4006} (( segid " " and resid 122 and name HN )) (( segid " " and resid 125 and name HB )) ASSI { 4012} (( segid " " and resid 122 and name HN )) ( segid " " and resid 119 and name HD1%) 2.700 2.700 3.300 peak 4012 spectrum 1 weight 0.10000E+01 volume 0.24414E-02 ppm1 7.148 ppm2 0.656 CV 1 OR { 4012} (( segid " " and resid 122 and name HN )) ( segid " " and resid 129 and name HD1%) ASSI { 4045} (( segid " " and resid 145 and name HN )) ( segid " " and resid 145 and name HE% ) 2.600 2.600 3.400 peak 4045 spectrum 1 weight 0.10000E+01 volume 0.28289E-02 ppm1 7.687 ppm2 0.782 CV 1 OR { 4045} (( segid " " and resid 145 and name HN )) ( segid " " and resid 112 and name HD1%) ASSI { 4072} (( segid " " and resid 152 and name HN )) ( segid " " and resid 110 and name HG2%) 2.900 2.900 3.100 peak 4072 spectrum 1 weight 0.10000E+01 volume 0.15114E-02 ppm1 9.044 ppm2 0.756 CV 1 OR { 4072} (( segid " " and resid 152 and name HN )) ( segid " " and resid 112 and name HD1%) OR { 4072} (( segid " " and resid 152 and name HN )) ( segid " " and resid 77 and name HG2%) ASSI { 4073} (( segid " " and resid 153 and name HN )) ( segid " " and resid 112 and name HD1%) 2.800 2.800 3.200 peak 4073 spectrum 1 weight 0.10000E+01 volume 0.18923E-02 ppm1 7.052 ppm2 0.757 CV 1 OR { 4073} (( segid " " and resid 153 and name HN )) ( segid " " and resid 77 and name HG2%) ASSI { 4085} (( segid " " and resid 168 and name HN )) ( segid " " and resid 167 and name HG2%) 2.800 1.000 1.000 peak 4085 spectrum 1 weight 0.10000E+01 volume 0.17923E-02 ppm1 7.044 ppm2 1.208 CV 1 OR { 4085} (( segid " " and resid 168 and name HN )) (( segid " " and resid 155 and name HG )) ASSI { 4088} (( segid " " and resid 168 and name HN )) (( segid " " and resid 166 and name HB1 )) 3.100 3.100 2.900 peak 4088 spectrum 1 weight 0.10000E+01 volume 0.98491E-03 ppm1 7.045 ppm2 1.941 CV 1 OR { 4088} (( segid " " and resid 168 and name HN )) (( segid " " and resid 165 and name HB2 )) ASSI { 4114} (( segid " " and resid 46 and name HN )) ( segid " " and resid 51 and name HG2%) 2.400 0.700 0.700 peak 4114 spectrum 1 weight 0.10000E+01 volume 0.46890E-02 ppm1 8.675 ppm2 0.770 CV 1 OR { 4114} (( segid " " and resid 46 and name HN )) ( segid " " and resid 44 and name HG2%) OR { 4114} (( segid " " and resid 46 and name HN )) ( segid " " and resid 51 and name HG1%) ASSI { 4116} (( segid " " and resid 24 and name HN )) (( segid " " and resid 23 and name HA )) 2.900 1.000 1.000 peak 4116 spectrum 1 weight 0.10000E+01 volume 0.15339E-02 ppm1 7.655 ppm2 4.152 CV 1 OR { 4116} (( segid " " and resid 24 and name HN )) (( segid " " and resid 22 and name HA )) ASSI { 4130} (( segid " " and resid 44 and name HN )) (( segid " " and resid 44 and name HB )) 2.700 0.900 0.900 peak 4130 spectrum 1 weight 0.10000E+01 volume 0.20377E-02 ppm1 8.931 ppm2 1.870 CV 1 OR { 4130} (( segid " " and resid 44 and name HN )) ( segid " " and resid 1 and name HE% ) ASSI { 4151} (( segid " " and resid 117 and name HN )) ( segid " " and resid 117 and name HD1%) 2.600 2.600 3.400 peak 4151 spectrum 1 weight 0.10000E+01 volume 0.25189E-02 ppm1 8.274 ppm2 0.508 CV 1 OR { 4151} (( segid " " and resid 117 and name HN )) ( segid " " and resid 84 and name HD1%) ASSI { 4161} (( segid " " and resid 175 and name HN )) ( segid " " and resid 77 and name HG2%) 2.500 2.500 3.500 peak 4161 spectrum 1 weight 0.10000E+01 volume 0.34037E-02 ppm1 7.781 ppm2 0.777 CV 1 OR { 4161} (( segid " " and resid 175 and name HN )) ( segid " " and resid 173 and name HG2%) OR { 4161} (( segid " " and resid 175 and name HN )) (( segid " " and resid 173 and name HG11)) ASSI { 4165} (( segid " " and resid 175 and name HN )) (( segid " " and resid 172 and name HA )) 2.700 0.900 0.900 peak 4165 spectrum 1 weight 0.10000E+01 volume 0.20538E-02 ppm1 7.779 ppm2 3.706 CV 1 OR { 4165} (( segid " " and resid 175 and name HN )) (( segid " " and resid 174 and name HA )) ASSI { 4168} (( segid " " and resid 174 and name HN )) ( segid " " and resid 173 and name HG2%) 2.500 0.800 0.800 peak 4168 spectrum 1 weight 0.10000E+01 volume 0.38494E-02 ppm1 8.426 ppm2 0.755 CV 1 OR { 4168} (( segid " " and resid 174 and name HN )) (( segid " " and resid 173 and name HG11)) OR { 4168} (( segid " " and resid 174 and name HN )) ( segid " " and resid 46 and name HG1%) ASSI { 4180} (( segid " " and resid 173 and name HN )) (( segid " " and resid 171 and name HB1 )) 3.100 1.200 1.200 peak 4180 spectrum 1 weight 0.10000E+01 volume 0.10043E-02 ppm1 7.600 ppm2 1.670 CV 1 OR { 4180} (( segid " " and resid 173 and name HN )) (( segid " " and resid 174 and name HB2 )) OR { 4180} (( segid " " and resid 173 and name HN )) (( segid " " and resid 174 and name HB1 )) OR { 4180} (( segid " " and resid 173 and name HN )) (( segid " " and resid 177 and name HG )) ASSI { 4205} (( segid " " and resid 155 and name HN )) ( segid " " and resid 111 and name HG2%) 2.700 0.900 0.900 peak 4205 spectrum 1 weight 0.10000E+01 volume 0.20507E-02 ppm1 8.299 ppm2 0.510 CV 1 OR { 4205} (( segid " " and resid 155 and name HN )) ( segid " " and resid 113 and name HG2%) ASSI { 4256} (( segid " " and resid 112 and name HN )) ( segid " " and resid 151 and name HB% ) 2.800 1.000 1.000 peak 4256 spectrum 1 weight 0.10000E+01 volume 0.17148E-02 ppm1 8.293 ppm2 1.193 CV 1 OR { 4256} (( segid " " and resid 112 and name HN )) ( segid " " and resid 112 and name HD2%) ASSI { 4300} (( segid " " and resid 125 and name HN )) ( segid " " and resid 85 and name HG2%) 3.000 3.000 3.000 peak 4300 spectrum 1 weight 0.10000E+01 volume 0.12239E-02 ppm1 7.979 ppm2 0.623 CV 1 OR { 4300} (( segid " " and resid 125 and name HN )) ( segid " " and resid 129 and name HD1%) ASSI { 4378} (( segid " " and resid 125 and name HN )) (( segid " " and resid 123 and name HE1 )) 3.200 3.200 2.800 peak 4378 spectrum 1 weight 0.10000E+01 volume 0.83317E-03 ppm1 7.990 ppm2 2.929 CV 1 OR { 4378} (( segid " " and resid 125 and name HN )) (( segid " " and resid 123 and name HE2 )) OR { 4378} (( segid " " and resid 125 and name HN )) (( segid " " and resid 128 and name HE2 )) ASSI { 4388} (( segid " " and resid 125 and name HN )) (( segid " " and resid 123 and name HB2 )) 2.900 2.900 3.100 peak 4388 spectrum 1 weight 0.10000E+01 volume 0.13176E-02 ppm1 7.993 ppm2 1.843 CV 1 OR { 4388} (( segid " " and resid 125 and name HN )) (( segid " " and resid 128 and name HB1 )) OR { 4388} (( segid " " and resid 125 and name HN )) (( segid " " and resid 119 and name HB1 )) ASSI { 4422} (( segid " " and resid 26 and name HN )) (( segid " " and resid 22 and name HA )) 2.500 0.800 0.800 peak 4422 spectrum 1 weight 0.10000E+01 volume 0.34037E-02 ppm1 7.543 ppm2 4.184 CV 1 OR { 4422} (( segid " " and resid 26 and name HN )) (( segid " " and resid 25 and name HB )) ASSI { 4452} (( segid " " and resid 52 and name HN )) (( segid " " and resid 52 and name HA )) 2.700 0.900 0.900 peak 4452 spectrum 1 weight 0.10000E+01 volume 0.22993E-02 ppm1 8.578 ppm2 5.132 CV 1 OR { 4452} (( segid " " and resid 52 and name HN )) (( segid " " and resid 3 and name HA )) ASSI { 4454} (( segid " " and resid 53 and name HN )) ( segid " " and resid 44 and name HG1%) 2.500 0.800 0.800 peak 4454 spectrum 1 weight 0.10000E+01 volume 0.35522E-02 ppm1 9.136 ppm2 0.757 CV 1 OR { 4454} (( segid " " and resid 53 and name HN )) ( segid " " and resid 53 and name HD1%) OR { 4454} (( segid " " and resid 53 and name HN )) ( segid " " and resid 51 and name HG1%) ASSI { 4456} (( segid " " and resid 55 and name HN )) ( segid " " and resid 55 and name HD2%) 2.600 0.900 0.900 peak 4456 spectrum 1 weight 0.10000E+01 volume 0.25221E-02 ppm1 8.742 ppm2 0.778 CV 1 OR { 4456} (( segid " " and resid 55 and name HN )) ( segid " " and resid 20 and name HD1%) ASSI { 4476} (( segid " " and resid 127 and name HN )) (( segid " " and resid 127 and name HB1 )) 2.600 0.800 0.800 peak 4476 spectrum 1 weight 0.10000E+01 volume 0.29581E-02 ppm1 8.366 ppm2 1.595 CV 1 OR { 4476} (( segid " " and resid 127 and name HN )) (( segid " " and resid 130 and name HG2 )) OR { 4476} (( segid " " and resid 127 and name HN )) (( segid " " and resid 126 and name HG12)) ASSI { 4488} (( segid " " and resid 94 and name HN )) ( segid " " and resid 145 and name HE% ) 2.600 0.800 0.800 peak 4488 spectrum 1 weight 0.10000E+01 volume 0.28354E-02 ppm1 6.347 ppm2 0.772 CV 1 OR { 4488} (( segid " " and resid 94 and name HN )) ( segid " " and resid 93 and name HG1%) ASSI { 4495} (( segid " " and resid 98 and name HN )) ( segid " " and resid 80 and name HG2%) 2.700 2.700 3.300 peak 4495 spectrum 1 weight 0.10000E+01 volume 0.20571E-02 ppm1 9.031 ppm2 0.783 CV 1 OR { 4495} (( segid " " and resid 98 and name HN )) ( segid " " and resid 80 and name HD1%) OR { 4495} (( segid " " and resid 98 and name HN )) (( segid " " and resid 102 and name HG1 )) OR { 4495} (( segid " " and resid 98 and name HN )) ( segid " " and resid 93 and name HG1%) ASSI { 4498} (( segid " " and resid 100 and name HN )) (( segid " " and resid 97 and name HA )) 3.000 1.200 1.200 peak 4498 spectrum 1 weight 0.10000E+01 volume 0.10625E-02 ppm1 7.510 ppm2 4.367 CV 1 OR { 4498} (( segid " " and resid 100 and name HN )) (( segid " " and resid 98 and name HA )) ASSI { 4501} (( segid " " and resid 100 and name HN )) (( segid " " and resid 103 and name HB1 )) 2.800 2.800 3.200 peak 4501 spectrum 1 weight 0.10000E+01 volume 0.17180E-02 ppm1 7.513 ppm2 3.020 CV 1 OR { 4501} (( segid " " and resid 100 and name HN )) (( segid " " and resid 101 and name HA )) OR { 4501} (( segid " " and resid 100 and name HN )) (( segid " " and resid 97 and name HB2 )) ASSI { 4539} (( segid " " and resid 4 and name HN )) ( segid " " and resid 4 and name HD1%) 2.500 0.800 0.800 peak 4539 spectrum 1 weight 0.10000E+01 volume 0.34070E-02 ppm1 8.374 ppm2 0.748 CV 1 OR { 4539} (( segid " " and resid 4 and name HN )) ( segid " " and resid 51 and name HG1%) OR { 4539} (( segid " " and resid 4 and name HN )) ( segid " " and resid 173 and name HG2%) ASSI { 4545} (( segid " " and resid 8 and name HN )) ( segid " " and resid 7 and name HG1%) 2.800 1.000 1.000 peak 4545 spectrum 1 weight 0.10000E+01 volume 0.16405E-02 ppm1 8.166 ppm2 0.631 CV 1 OR { 4545} (( segid " " and resid 8 and name HN )) ( segid " " and resid 9 and name HG1%) ASSI { 4558} (( segid " " and resid 26 and name HN )) ( segid " " and resid 25 and name HG2%) 2.700 2.700 3.300 peak 4558 spectrum 1 weight 0.10000E+01 volume 0.22186E-02 ppm1 7.541 ppm2 1.110 CV 1 OR { 4558} (( segid " " and resid 26 and name HN )) ( segid " " and resid 27 and name HB% ) ASSI { 4568} (( segid " " and resid 6 and name HN )) ( segid " " and resid 53 and name HD1%) 2.800 1.000 1.000 peak 4568 spectrum 1 weight 0.10000E+01 volume 0.16857E-02 ppm1 9.304 ppm2 0.786 CV 1 OR { 4568} (( segid " " and resid 6 and name HN )) ( segid " " and resid 20 and name HD1%) OR { 4568} (( segid " " and resid 6 and name HN )) ( segid " " and resid 20 and name HD2%) OR { 4568} (( segid " " and resid 6 and name HN )) ( segid " " and resid 55 and name HD2%) OR { 4568} (( segid " " and resid 6 and name HN )) ( segid " " and resid 77 and name HG2%) ASSI { 4578} (( segid " " and resid 49 and name HN )) ( segid " " and resid 46 and name HG1%) 2.500 2.500 3.500 peak 4578 spectrum 1 weight 0.10000E+01 volume 0.31809E-02 ppm1 7.938 ppm2 0.748 CV 1 OR { 4578} (( segid " " and resid 49 and name HN )) ( segid " " and resid 51 and name HG1%) ASSI { 4585} (( segid " " and resid 49 and name HN )) ( segid " " and resid 45 and name HE% ) 2.100 0.500 0.500 peak 4585 spectrum 1 weight 0.10000E+01 volume 0.10735E-01 ppm1 7.939 ppm2 1.740 CV 1 OR { 4585} (( segid " " and resid 49 and name HN )) (( segid " " and resid 49 and name HB1 )) ASSI { 4597} (( segid " " and resid 86 and name HN )) ( segid " " and resid 134 and name HD2%) 3.000 3.000 3.000 peak 4597 spectrum 1 weight 0.10000E+01 volume 0.10560E-02 ppm1 7.696 ppm2 0.852 CV 1 OR { 4597} (( segid " " and resid 86 and name HN )) ( segid " " and resid 134 and name HD1%) OR { 4597} (( segid " " and resid 86 and name HN )) ( segid " " and resid 119 and name HD2%) ASSI { 4602} (( segid " " and resid 91 and name HN )) ( segid " " and resid 88 and name HB% ) 3.100 1.200 1.200 peak 4602 spectrum 1 weight 0.10000E+01 volume 0.92359E-03 ppm1 8.172 ppm2 1.369 CV 1 OR { 4602} (( segid " " and resid 91 and name HN )) ( segid " " and resid 95 and name HB% ) ASSI { 4606} (( segid " " and resid 92 and name HN )) ( segid " " and resid 95 and name HB% ) 2.800 1.000 1.000 peak 4606 spectrum 1 weight 0.10000E+01 volume 0.16890E-02 ppm1 7.861 ppm2 1.346 CV 1 OR { 4606} (( segid " " and resid 92 and name HN )) ( segid " " and resid 88 and name HB% ) ASSI { 4635} (( segid " " and resid 121 and name HN )) ( segid " " and resid 117 and name HD2%) 2.600 2.600 3.400 peak 4635 spectrum 1 weight 0.10000E+01 volume 0.30743E-02 ppm1 7.299 ppm2 0.690 CV 1 OR { 4635} (( segid " " and resid 121 and name HN )) ( segid " " and resid 119 and name HD1%) ASSI { 4644} (( segid " " and resid 128 and name HN )) (( segid " " and resid 127 and name HG1 )) 2.700 2.700 3.300 peak 4644 spectrum 1 weight 0.10000E+01 volume 0.20119E-02 ppm1 7.997 ppm2 2.312 CV 1 OR { 4644} (( segid " " and resid 128 and name HN )) (( segid " " and resid 131 and name HG1 )) ASSI { 4647} (( segid " " and resid 84 and name HN )) ( segid " " and resid 85 and name HG1%) 2.900 1.100 1.100 peak 4647 spectrum 1 weight 0.10000E+01 volume 0.13079E-02 ppm1 8.859 ppm2 0.547 CV 1 OR { 4647} (( segid " " and resid 84 and name HN )) ( segid " " and resid 84 and name HD1%) ASSI { 4659} (( segid " " and resid 131 and name HN )) (( segid " " and resid 132 and name HD1 )) 2.400 0.700 0.700 peak 4659 spectrum 1 weight 0.10000E+01 volume 0.45340E-02 ppm1 7.736 ppm2 1.608 CV 1 OR { 4659} (( segid " " and resid 131 and name HN )) (( segid " " and resid 130 and name HG2 )) ASSI { 4665} (( segid " " and resid 132 and name HN )) (( segid " " and resid 132 and name HB1 )) 2.300 0.700 0.700 peak 4665 spectrum 1 weight 0.10000E+01 volume 0.55222E-02 ppm1 7.233 ppm2 2.099 CV 1 OR { 4665} (( segid " " and resid 132 and name HN )) (( segid " " and resid 131 and name HB1 )) ASSI { 4666} (( segid " " and resid 132 and name HN )) (( segid " " and resid 130 and name HG2 )) 2.200 2.200 3.800 peak 4666 spectrum 1 weight 0.10000E+01 volume 0.65233E-02 ppm1 7.233 ppm2 1.603 CV 1 OR { 4666} (( segid " " and resid 132 and name HN )) (( segid " " and resid 133 and name HD1 )) OR { 4666} (( segid " " and resid 132 and name HN )) (( segid " " and resid 130 and name HD2 )) OR { 4666} (( segid " " and resid 132 and name HN )) (( segid " " and resid 134 and name HB2 )) ASSI { 4670} (( segid " " and resid 133 and name HN )) (( segid " " and resid 130 and name HA )) 2.700 0.900 0.900 peak 4670 spectrum 1 weight 0.10000E+01 volume 0.21346E-02 ppm1 8.059 ppm2 4.072 CV 1 OR { 4670} (( segid " " and resid 133 and name HN )) (( segid " " and resid 131 and name HA )) ASSI { 4673} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HD2 )) 2.500 0.800 0.800 peak 4673 spectrum 1 weight 0.10000E+01 volume 0.35910E-02 ppm1 8.053 ppm2 1.611 CV 1 OR { 4673} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HD1 )) OR { 4673} (( segid " " and resid 133 and name HN )) (( segid " " and resid 132 and name HD1 )) ASSI { 4675} (( segid " " and resid 133 and name HN )) (( segid " " and resid 132 and name HB1 )) 2.600 0.900 0.900 peak 4675 spectrum 1 weight 0.10000E+01 volume 0.26319E-02 ppm1 8.057 ppm2 2.085 CV 1 OR { 4675} (( segid " " and resid 133 and name HN )) (( segid " " and resid 133 and name HB2 )) OR { 4675} (( segid " " and resid 133 and name HN )) (( segid " " and resid 132 and name HB2 )) ASSI { 4680} (( segid " " and resid 134 and name HN )) (( segid " " and resid 134 and name HB2 )) 2.300 2.300 3.700 peak 4680 spectrum 1 weight 0.10000E+01 volume 0.57676E-02 ppm1 7.904 ppm2 1.610 CV 1 OR { 4680} (( segid " " and resid 134 and name HN )) (( segid " " and resid 130 and name HD2 )) OR { 4680} (( segid " " and resid 134 and name HN )) (( segid " " and resid 132 and name HD1 )) OR { 4680} (( segid " " and resid 134 and name HN )) (( segid " " and resid 133 and name HD2 )) ASSI { 4739} (( segid " " and resid 156 and name HN )) ( segid " " and resid 84 and name HD1%) 2.700 2.700 3.300 peak 4739 spectrum 1 weight 0.10000E+01 volume 0.23994E-02 ppm1 7.928 ppm2 0.502 CV 1 OR { 4739} (( segid " " and resid 156 and name HN )) ( segid " " and resid 113 and name HG2%) OR { 4739} (( segid " " and resid 156 and name HN )) ( segid " " and resid 111 and name HG2%) ASSI { 4749} (( segid " " and resid 158 and name HN )) (( segid " " and resid 117 and name HB2 )) 2.900 1.000 1.000 peak 4749 spectrum 1 weight 0.10000E+01 volume 0.14984E-02 ppm1 8.347 ppm2 1.074 CV 1 OR { 4749} (( segid " " and resid 158 and name HN )) (( segid " " and resid 117 and name HB1 )) OR { 4749} (( segid " " and resid 158 and name HN )) ( segid " " and resid 165 and name HD2%) ASSI { 4751} (( segid " " and resid 158 and name HN )) (( segid " " and resid 117 and name HA )) 2.900 2.900 3.100 peak 4751 spectrum 1 weight 0.10000E+01 volume 0.13757E-02 ppm1 8.336 ppm2 3.783 CV 1 OR { 4751} (( segid " " and resid 158 and name HN )) (( segid " " and resid 167 and name HB )) ASSI { 4752} (( segid " " and resid 158 and name HN )) (( segid " " and resid 163 and name HA )) 3.100 1.200 1.200 peak 4752 spectrum 1 weight 0.10000E+01 volume 0.94301E-03 ppm1 8.337 ppm2 4.142 CV 1 OR { 4752} (( segid " " and resid 158 and name HN )) (( segid " " and resid 159 and name HA )) ASSI { 4757} (( segid " " and resid 161 and name HN )) ( segid " " and resid 161 and name HG2%) 2.600 0.900 0.900 peak 4757 spectrum 1 weight 0.10000E+01 volume 0.26125E-02 ppm1 8.036 ppm2 1.053 CV 1 OR { 4757} (( segid " " and resid 161 and name HN )) (( segid " " and resid 160 and name HB2 )) ASSI { 4759} (( segid " " and resid 162 and name HN )) (( segid " " and resid 162 and name HA )) 2.800 1.000 1.000 peak 4759 spectrum 1 weight 0.10000E+01 volume 0.16437E-02 ppm1 7.337 ppm2 3.855 CV 1 OR { 4759} (( segid " " and resid 162 and name HN )) (( segid " " and resid 158 and name HB1 )) ASSI { 4762} (( segid " " and resid 163 and name HN )) (( segid " " and resid 117 and name HB1 )) 2.700 0.900 0.900 peak 4762 spectrum 1 weight 0.10000E+01 volume 0.23638E-02 ppm1 7.838 ppm2 1.057 CV 1 OR { 4762} (( segid " " and resid 163 and name HN )) ( segid " " and resid 161 and name HG2%) OR { 4762} (( segid " " and resid 163 and name HN )) (( segid " " and resid 117 and name HB2 )) ASSI { 4763} (( segid " " and resid 163 and name HN )) ( segid " " and resid 117 and name HD1%) 3.100 3.100 2.900 peak 4763 spectrum 1 weight 0.10000E+01 volume 0.10205E-02 ppm1 7.846 ppm2 0.474 CV 1 OR { 4763} (( segid " " and resid 163 and name HN )) ( segid " " and resid 160 and name HD2%) ASSI { 4774} (( segid " " and resid 172 and name HN )) (( segid " " and resid 173 and name HG11)) 2.500 2.500 3.500 peak 4774 spectrum 1 weight 0.10000E+01 volume 0.32649E-02 ppm1 7.936 ppm2 0.763 CV 1 OR { 4774} (( segid " " and resid 172 and name HN )) ( segid " " and resid 77 and name HG2%) OR { 4774} (( segid " " and resid 172 and name HN )) ( segid " " and resid 155 and name HD2%) ASSI { 4780} (( segid " " and resid 112 and name HN )) ( segid " " and resid 112 and name HD1%) 2.800 1.000 1.000 peak 4780 spectrum 1 weight 0.10000E+01 volume 0.16986E-02 ppm1 8.292 ppm2 0.784 CV 1 OR { 4780} (( segid " " and resid 112 and name HN )) ( segid " " and resid 80 and name HD1%) OR { 4780} (( segid " " and resid 112 and name HN )) ( segid " " and resid 155 and name HD2%) ASSI { 4789} (( segid " " and resid 17 and name HN )) ( segid " " and resid 8 and name HG1%) 2.900 2.900 3.100 peak 4789 spectrum 1 weight 0.10000E+01 volume 0.14370E-02 ppm1 9.111 ppm2 0.813 CV 1 OR { 4789} (( segid " " and resid 17 and name HN )) ( segid " " and resid 20 and name HD2%) ASSI { 4794} (( segid " " and resid 22 and name HN )) ( segid " " and resid 21 and name HD1%) 3.000 1.100 1.100 peak 4794 spectrum 1 weight 0.10000E+01 volume 0.11464E-02 ppm1 8.849 ppm2 0.459 CV 1 OR { 4794} (( segid " " and resid 79 and name HN )) ( segid " " and resid 113 and name HG2%) OR { 4794} (( segid " " and resid 79 and name HN )) ( segid " " and resid 111 and name HG2%) ASSI { 4799} (( segid " " and resid 42 and name HN )) ( segid " " and resid 42 and name HB% ) 2.700 0.900 0.900 peak 4799 spectrum 1 weight 0.10000E+01 volume 0.23735E-02 ppm1 8.799 ppm2 1.141 CV 1 OR { 4799} (( segid " " and resid 42 and name HN )) (( segid " " and resid 53 and name HB1 )) ASSI { 4805} (( segid " " and resid 51 and name HN )) ( segid " " and resid 51 and name HG1%) 2.400 0.700 0.700 peak 4805 spectrum 1 weight 0.10000E+01 volume 0.40819E-02 ppm1 9.080 ppm2 0.767 CV 1 OR { 4805} (( segid " " and resid 51 and name HN )) ( segid " " and resid 51 and name HG2%) OR { 4805} (( segid " " and resid 51 and name HN )) ( segid " " and resid 44 and name HG1%) ASSI { 4815} (( segid " " and resid 63 and name HN )) (( segid " " and resid 61 and name HB2 )) 2.700 0.900 0.900 peak 4815 spectrum 1 weight 0.10000E+01 volume 0.23477E-02 ppm1 8.265 ppm2 1.985 CV 1 OR { 4815} (( segid " " and resid 63 and name HN )) (( segid " " and resid 62 and name HB1 )) ASSI { 4818} (( segid " " and resid 81 and name HN )) ( segid " " and resid 80 and name HG2%) 2.600 0.900 0.900 peak 4818 spectrum 1 weight 0.10000E+01 volume 0.24963E-02 ppm1 8.852 ppm2 0.780 CV 1 OR { 4818} (( segid " " and resid 81 and name HN )) ( segid " " and resid 93 and name HG1%) ASSI { 4828} (( segid " " and resid 110 and name HN )) (( segid " " and resid 152 and name HB )) 3.100 1.200 1.200 peak 4828 spectrum 1 weight 0.10000E+01 volume 0.10043E-02 ppm1 8.545 ppm2 2.046 CV 1 OR { 4828} (( segid " " and resid 110 and name HN )) (( segid " " and resid 77 and name HB )) ASSI { 4830} (( segid " " and resid 113 and name HN )) ( segid " " and resid 80 and name HG2%) 2.600 0.900 0.900 peak 4830 spectrum 1 weight 0.10000E+01 volume 0.26125E-02 ppm1 9.198 ppm2 0.764 CV 1 OR { 4830} (( segid " " and resid 113 and name HN )) ( segid " " and resid 80 and name HD1%) OR { 4830} (( segid " " and resid 113 and name HN )) ( segid " " and resid 112 and name HD1%) ASSI { 4839} (( segid " " and resid 171 and name HN )) ( segid " " and resid 167 and name HG2%) 2.700 0.900 0.900 peak 4839 spectrum 1 weight 0.10000E+01 volume 0.21508E-02 ppm1 8.251 ppm2 1.210 CV 1 OR { 4839} (( segid " " and resid 171 and name HN )) ( segid " " and resid 172 and name HB% ) ASSI { 4852} (( segid " " and resid 139 and name HN )) (( segid " " and resid 139 and name HB1 )) 2.900 1.100 1.100 peak 4852 spectrum 1 weight 0.10000E+01 volume 0.13402E-02 ppm1 9.054 ppm2 3.093 CV 1 OR { 4852} (( segid " " and resid 139 and name HN )) (( segid " " and resid 140 and name HD1 )) ASSI { 4853} (( segid " " and resid 139 and name HN )) (( segid " " and resid 138 and name HA )) 3.000 1.100 1.100 peak 4853 spectrum 1 weight 0.10000E+01 volume 0.12271E-02 ppm1 9.064 ppm2 4.269 CV 1 OR { 4853} (( segid " " and resid 139 and name HN )) (( segid " " and resid 139 and name HA )) ASSI { 4862} (( segid " " and resid 157 and name HN )) (( segid " " and resid 156 and name HA )) 2.600 0.900 0.900 peak 4862 spectrum 1 weight 0.10000E+01 volume 0.26578E-02 ppm1 9.013 ppm2 5.134 CV 1 OR { 4862} (( segid " " and resid 157 and name HN )) (( segid " " and resid 157 and name HA )) ASSI { 4868} (( segid " " and resid 158 and name HN )) (( segid " " and resid 157 and name HA )) 2.600 0.900 0.900 peak 4868 spectrum 1 weight 0.10000E+01 volume 0.26061E-02 ppm1 8.351 ppm2 5.155 CV 1 OR { 4868} (( segid " " and resid 158 and name HN )) (( segid " " and resid 158 and name HA )) ASSI { 5420} (( segid " " and resid 117 and name HN )) ( segid " " and resid 117 and name HD2%) 2.700 0.900 0.900 peak 5420 spectrum 1 weight 0.10000E+01 volume 0.19602E-02 ppm1 8.259 ppm2 0.747 CV 1 OR { 5420} (( segid " " and resid 171 and name HN )) ( segid " " and resid 155 and name HD2%) OR { 5420} (( segid " " and resid 171 and name HN )) (( segid " " and resid 173 and name HG11)) OR { 5420} (( segid " " and resid 171 and name HN )) ( segid " " and resid 46 and name HG1%) ASSI { 5632} (( segid " " and resid 3 and name HN )) (( segid " " and resid 2 and name HB1 )) 2.600 2.600 3.400 peak 5632 spectrum 1 weight 0.10000E+01 volume 0.28935E-02 ppm1 8.604 ppm2 1.906 CV 1 OR { 5632} (( segid " " and resid 3 and name HN )) (( segid " " and resid 1 and name HB1 )) ASSI { 8582} (( segid " " and resid 3 and name HN )) ( segid " " and resid 4 and name HD1%) 2.800 1.000 1.000 peak 8582 spectrum 1 weight 0.10000E+01 volume 0.16566E-02 ppm1 8.595 ppm2 0.737 CV 1 OR { 8582} (( segid " " and resid 3 and name HN )) ( segid " " and resid 51 and name HG1%) ASSI { 8717} (( segid " " and resid 192 and name HN )) ( segid " " and resid 192 and name HD2%) 2.700 0.900 0.900 peak 8717 spectrum 1 weight 0.10000E+01 volume 0.23801E-02 ppm1 7.623 ppm2 0.781 CV 1 OR { 8717} (( segid " " and resid 192 and name HN )) ( segid " " and resid 192 and name HD1%) OR { 8717} (( segid " " and resid 192 and name HN )) ( segid " " and resid 191 and name HD2%) ASSI { 8718} (( segid " " and resid 192 and name HN )) (( segid " " and resid 192 and name HB2 )) 1.900 0.500 0.500 peak 8718 spectrum 1 weight 0.10000E+01 volume 0.15501E-01 ppm1 7.620 ppm2 1.474 CV 1 OR { 8718} (( segid " " and resid 192 and name HN )) (( segid " " and resid 192 and name HB1 )) OR { 8718} (( segid " " and resid 192 and name HN )) (( segid " " and resid 191 and name HB1 )) ASSI { 8779} (( segid " " and resid 115 and name HN )) (( segid " " and resid 115 and name HG1 )) 3.000 1.100 1.100 peak 8779 spectrum 1 weight 0.10000E+01 volume 0.11109E-02 ppm1 9.212 ppm2 5.135 CV 1 OR { 8779} (( segid " " and resid 115 and name HN )) (( segid " " and resid 83 and name HA )) ASSI { 8805} (( segid " " and resid 118 and name HN )) (( segid " " and resid 117 and name HA )) 3.000 1.100 1.100 peak 8805 spectrum 1 weight 0.10000E+01 volume 0.12498E-02 ppm1 8.469 ppm2 3.806 CV 1 OR { 8805} (( segid " " and resid 118 and name HN )) (( segid " " and resid 158 and name HB1 )) ASSI { 9120} (( segid " " and resid 103 and name HN )) (( segid " " and resid 102 and name HA )) 3.100 1.200 1.200 peak 9120 spectrum 1 weight 0.10000E+01 volume 0.97523E-03 ppm1 7.674 ppm2 3.701 CV 1 OR { 9120} (( segid " " and resid 103 and name HN )) (( segid " " and resid 99 and name HA )) ASSI { 9126} (( segid " " and resid 2 and name HN )) (( segid " " and resid 52 and name HN )) 2.700 0.900 0.900 peak 9126 spectrum 1 weight 0.10000E+01 volume 0.22637E-02 ppm1 8.196 ppm2 8.570 CV 1 OR { 9126} (( segid " " and resid 2 and name HN )) (( segid " " and resid 3 and name HN )) ASSI { 9130} (( segid " " and resid 5 and name HN )) (( segid " " and resid 5 and name HG2 )) 2.900 1.100 1.100 peak 9130 spectrum 1 weight 0.10000E+01 volume 0.13369E-02 ppm1 10.484 ppm2 0.862 CV 1 OR { 9130} (( segid " " and resid 5 and name HN )) ( segid " " and resid 176 and name HG2%) OR { 9130} (( segid " " and resid 5 and name HN )) ( segid " " and resid 176 and name HG1%) ASSI { 9152} (( segid " " and resid 122 and name HN )) (( segid " " and resid 126 and name HG12)) 3.000 1.100 1.100 peak 9152 spectrum 1 weight 0.10000E+01 volume 0.11593E-02 ppm1 7.166 ppm2 1.600 CV 1 OR { 9152} (( segid " " and resid 122 and name HN )) (( segid " " and resid 120 and name HB1 )) ASSI { 9156} (( segid " " and resid 46 and name HN )) (( segid " " and resid 50 and name HA )) 2.900 1.100 1.100 peak 9156 spectrum 1 weight 0.10000E+01 volume 0.13886E-02 ppm1 8.684 ppm2 4.794 CV 1 OR { 9156} (( segid " " and resid 46 and name HN )) (( segid " " and resid 49 and name HA )) ASSI { 9159} (( segid " " and resid 86 and name HN )) (( segid " " and resid 137 and name HB )) 3.100 3.100 2.900 peak 9159 spectrum 1 weight 0.10000E+01 volume 0.91067E-03 ppm1 7.684 ppm2 1.949 CV 1 OR { 9159} (( segid " " and resid 86 and name HN )) (( segid " " and resid 120 and name HB2 )) ASSI { 9174} (( segid " " and resid 86 and name HN )) (( segid " " and resid 86 and name HB2 )) 2.800 1.000 1.000 peak 9174 spectrum 1 weight 0.10000E+01 volume 0.16146E-02 ppm1 7.696 ppm2 3.962 CV 1 OR { 9174} (( segid " " and resid 86 and name HN )) (( segid " " and resid 83 and name HB2 )) ASSI { 9180} (( segid " " and resid 104 and name HN )) (( segid " " and resid 104 and name HB1 )) 2.500 0.800 0.800 peak 9180 spectrum 1 weight 0.10000E+01 volume 0.32907E-02 ppm1 6.900 ppm2 2.964 CV 1 OR { 9180} (( segid " " and resid 104 and name HN )) (( segid " " and resid 103 and name HB2 )) ASSI { 9184} (( segid " " and resid 123 and name HN )) (( segid " " and resid 122 and name HB2 )) 2.900 1.100 1.100 peak 9184 spectrum 1 weight 0.10000E+01 volume 0.13015E-02 ppm1 8.784 ppm2 2.960 CV 1 OR { 9184} (( segid " " and resid 123 and name HN )) (( segid " " and resid 123 and name HE1 )) ASSI { 9190} (( segid " " and resid 94 and name HN )) (( segid " " and resid 93 and name HA )) 3.000 1.100 1.100 peak 9190 spectrum 1 weight 0.10000E+01 volume 0.11206E-02 ppm1 6.342 ppm2 3.681 CV 1 OR { 9190} (( segid " " and resid 94 and name HN )) (( segid " " and resid 91 and name HA )) ASSI { 9239} (( segid " " and resid 162 and name HN )) ( segid " " and resid 161 and name HG2%) 2.700 0.900 0.900 peak 9239 spectrum 1 weight 0.10000E+01 volume 0.19925E-02 ppm1 7.337 ppm2 1.042 CV 1 OR { 9239} (( segid " " and resid 162 and name HN )) (( segid " " and resid 160 and name HB2 )) ASSI { 9241} (( segid " " and resid 75 and name HN )) ( segid " " and resid 72 and name HD% ) 2.900 2.900 3.100 peak 9241 spectrum 1 weight 0.10000E+01 volume 0.14016E-02 ppm1 7.335 ppm2 6.815 CV 1 OR { 9241} (( segid " " and resid 75 and name HN )) ( segid " " and resid 78 and name HD% ) ASSI { 9264} (( segid " " and resid 52 and name HN )) ( segid " " and resid 1 and name HE% ) 2.700 0.900 0.900 peak 9264 spectrum 1 weight 0.10000E+01 volume 0.20797E-02 ppm1 8.574 ppm2 1.894 CV 1 OR { 9264} (( segid " " and resid 52 and name HN )) (( segid " " and resid 1 and name HB1 )) OR { 9264} (( segid " " and resid 52 and name HN )) (( segid " " and resid 2 and name HB1 )) ASSI { 9271} (( segid " " and resid 53 and name HN )) (( segid " " and resid 44 and name HB )) 3.000 3.000 3.000 peak 9271 spectrum 1 weight 0.10000E+01 volume 0.11206E-02 ppm1 9.144 ppm2 1.916 CV 1 OR { 9271} (( segid " " and resid 53 and name HN )) (( segid " " and resid 51 and name HB )) OR { 9271} (( segid " " and resid 53 and name HN )) (( segid " " and resid 173 and name HG12)) ASSI { 9273} (( segid " " and resid 53 and name HN )) (( segid " " and resid 53 and name HG )) 3.100 1.200 1.200 peak 9273 spectrum 1 weight 0.10000E+01 volume 0.10334E-02 ppm1 9.135 ppm2 1.379 CV 1 OR { 9273} (( segid " " and resid 53 and name HN )) ( segid " " and resid 3 and name HB% ) ASSI { 9286} (( segid " " and resid 169 and name HN )) ( segid " " and resid 172 and name HB% ) 3.000 1.100 1.100 peak 9286 spectrum 1 weight 0.10000E+01 volume 0.12368E-02 ppm1 6.235 ppm2 1.208 CV 1 OR { 9286} (( segid " " and resid 169 and name HN )) ( segid " " and resid 167 and name HG2%) ASSI { 9318} (( segid " " and resid 142 and name HN )) ( segid " " and resid 138 and name HG2%) 2.700 0.900 0.900 peak 9318 spectrum 1 weight 0.10000E+01 volume 0.20216E-02 ppm1 8.085 ppm2 1.160 CV 1 OR { 9318} (( segid " " and resid 142 and name HN )) (( segid " " and resid 143 and name HB1 )) ASSI { 9326} (( segid " " and resid 147 and name HN )) ( segid " " and resid 112 and name HD1%) 2.600 2.600 3.400 peak 9326 spectrum 1 weight 0.10000E+01 volume 0.30033E-02 ppm1 7.787 ppm2 0.786 CV 1 OR { 9326} (( segid " " and resid 23 and name HN )) ( segid " " and resid 55 and name HD2%) OR { 9326} (( segid " " and resid 23 and name HN )) ( segid " " and resid 20 and name HD1%) OR { 9326} (( segid " " and resid 23 and name HN )) ( segid " " and resid 20 and name HD2%) ASSI { 9328} (( segid " " and resid 147 and name HN )) (( segid " " and resid 148 and name HB2 )) 2.700 2.700 3.300 peak 9328 spectrum 1 weight 0.10000E+01 volume 0.21701E-02 ppm1 7.778 ppm2 1.977 CV 1 OR { 9328} (( segid " " and resid 147 and name HN )) (( segid " " and resid 148 and name HB1 )) OR { 9328} (( segid " " and resid 23 and name HN )) (( segid " " and resid 20 and name HG )) ASSI { 9329} (( segid " " and resid 147 and name HN )) (( segid " " and resid 147 and name HE1 )) 3.000 1.200 1.200 peak 9329 spectrum 1 weight 0.10000E+01 volume 0.10657E-02 ppm1 7.775 ppm2 2.862 CV 1 OR { 9329} (( segid " " and resid 147 and name HN )) (( segid " " and resid 147 and name HE2 )) OR { 9329} (( segid " " and resid 95 and name HN )) (( segid " " and resid 92 and name HB1 )) ASSI { 9330} (( segid " " and resid 23 and name HN )) (( segid " " and resid 22 and name HB2 )) 2.300 0.600 0.600 peak 9330 spectrum 1 weight 0.10000E+01 volume 0.60195E-02 ppm1 7.778 ppm2 3.944 CV 1 OR { 9330} (( segid " " and resid 147 and name HN )) (( segid " " and resid 147 and name HA )) ASSI { 9359} (( segid " " and resid 166 and name HN )) (( segid " " and resid 165 and name HB2 )) 2.200 0.600 0.600 peak 9359 spectrum 1 weight 0.10000E+01 volume 0.66653E-02 ppm1 8.543 ppm2 1.949 CV 1 OR { 9359} (( segid " " and resid 166 and name HN )) (( segid " " and resid 166 and name HB1 )) ASSI { 9364} (( segid " " and resid 166 and name HN )) (( segid " " and resid 157 and name HB2 )) 3.100 3.100 2.900 peak 9364 spectrum 1 weight 0.10000E+01 volume 0.96880E-03 ppm1 8.546 ppm2 2.552 CV 1 OR { 9364} (( segid " " and resid 166 and name HN )) (( segid " " and resid 169 and name HB2 )) ASSI { 9367} (( segid " " and resid 167 and name HN )) (( segid " " and resid 169 and name HN )) 3.100 1.200 1.200 peak 9367 spectrum 1 weight 0.10000E+01 volume 0.92036E-03 ppm1 7.710 ppm2 6.227 CV 1 OR { 9367} (( segid " " and resid 167 and name HN )) ( segid " " and resid 23 and name HE% ) ASSI { 9368} (( segid " " and resid 167 and name HN )) (( segid " " and resid 166 and name HG2 )) 2.600 2.600 3.400 peak 9368 spectrum 1 weight 0.10000E+01 volume 0.25738E-02 ppm1 7.704 ppm2 1.684 CV 1 OR { 9368} (( segid " " and resid 167 and name HN )) (( segid " " and resid 168 and name HB )) OR { 9368} (( segid " " and resid 167 and name HN )) (( segid " " and resid 166 and name HD1 )) ASSI { 9372} (( segid " " and resid 167 and name HN )) (( segid " " and resid 170 and name HB2 )) 3.000 1.100 1.100 peak 9372 spectrum 1 weight 0.10000E+01 volume 0.12595E-02 ppm1 7.697 ppm2 2.597 CV 1 OR { 9372} (( segid " " and resid 167 and name HN )) (( segid " " and resid 169 and name HB2 )) OR { 9372} (( segid " " and resid 167 and name HN )) (( segid " " and resid 157 and name HB2 )) ASSI { 9388} (( segid " " and resid 53 and name HN )) (( segid " " and resid 52 and name HN )) 3.300 1.300 1.300 peak 9388 spectrum 1 weight 0.10000E+01 volume 0.69753E-03 ppm1 9.130 ppm2 8.532 CV 1 OR { 9388} (( segid " " and resid 53 and name HN )) (( segid " " and resid 43 and name HN )) ASSI { 9446} (( segid " " and resid 80 and name HN )) (( segid " " and resid 81 and name HN )) 2.900 1.100 1.100 peak 9446 spectrum 1 weight 0.10000E+01 volume 0.13822E-02 ppm1 8.519 ppm2 8.819 CV 1 OR { 9446} (( segid " " and resid 80 and name HN )) (( segid " " and resid 79 and name HN )) ASSI {12059} (( segid " " and resid 182 and name HN )) (( segid " " and resid 176 and name HA )) 2.700 2.700 3.300 peak 12059 spectrum 1 weight 0.10000E+01 volume 0.22024E-02 ppm1 8.106 ppm2 3.737 CV 1 OR {12059} (( segid " " and resid 182 and name HN )) (( segid " " and resid 181 and name HD2 )) OR {12059} (( segid " " and resid 170 and name HN )) (( segid " " and resid 165 and name HA )) ASSI {12060} (( segid " " and resid 175 and name HN )) (( segid " " and resid 171 and name HB2 )) 2.900 2.900 3.100 peak 12060 spectrum 1 weight 0.10000E+01 volume 0.15533E-02 ppm1 7.781 ppm2 2.023 CV 1 OR {12060} (( segid " " and resid 175 and name HN )) (( segid " " and resid 152 and name HB )) OR {12060} (( segid " " and resid 175 and name HN )) (( segid " " and resid 77 and name HB )) OR {12060} (( segid " " and resid 175 and name HN )) (( segid " " and resid 109 and name HG1 )) ASSI {12078} (( segid " " and resid 92 and name HD22)) (( segid " " and resid 97 and name HN )) 3.200 3.200 2.800 peak 12078 spectrum 1 weight 0.10000E+01 volume 0.77504E-03 ppm1 10.265 ppm2 7.807 CV 1 OR {12078} (( segid " " and resid 92 and name HD22)) (( segid " " and resid 95 and name HN )) ASSI {12095} (( segid " " and resid 43 and name HD22)) ( segid " " and resid 44 and name HG1%) 3.000 1.100 1.100 peak 12095 spectrum 1 weight 0.10000E+01 volume 0.12724E-02 ppm1 7.172 ppm2 0.804 CV 1 OR {12095} (( segid " " and resid 43 and name HD22)) ( segid " " and resid 51 and name HG2%) OR {12095} (( segid " " and resid 43 and name HD22)) ( segid " " and resid 44 and name HG2%) ASSI {12105} (( segid " " and resid 2 and name HE21)) (( segid " " and resid 4 and name HB )) 2.900 2.900 3.100 peak 12105 spectrum 1 weight 0.10000E+01 volume 0.15565E-02 ppm1 6.731 ppm2 1.588 CV 1 OR {12105} (( segid " " and resid 2 and name HE21)) (( segid " " and resid 177 and name HB2 )) OR {12105} (( segid " " and resid 2 and name HE21)) (( segid " " and resid 177 and name HB1 )) OR {12105} (( segid " " and resid 2 and name HE21)) (( segid " " and resid 183 and name HD1 )) ASSI {12107} (( segid " " and resid 2 and name HE22)) (( segid " " and resid 4 and name HB )) 2.900 2.900 3.100 peak 12107 spectrum 1 weight 0.10000E+01 volume 0.15436E-02 ppm1 7.558 ppm2 1.583 CV 1 OR {12107} (( segid " " and resid 2 and name HE22)) (( segid " " and resid 177 and name HB2 )) ASSI {12111} (( segid " " and resid 162 and name HE22)) (( segid " " and resid 22 and name HB1 )) 2.800 1.000 1.000 peak 12111 spectrum 1 weight 0.10000E+01 volume 0.17310E-02 ppm1 7.195 ppm2 3.903 CV 1 OR {12111} (( segid " " and resid 162 and name HE22)) (( segid " " and resid 22 and name HB2 )) OR {12111} (( segid " " and resid 162 and name HE22)) (( segid " " and resid 162 and name HA )) ASSI {12112} (( segid " " and resid 162 and name HE22)) (( segid " " and resid 159 and name HA )) 2.900 1.000 1.000 peak 12112 spectrum 1 weight 0.10000E+01 volume 0.15404E-02 ppm1 7.180 ppm2 4.147 CV 1 OR {12112} (( segid " " and resid 162 and name HE22)) (( segid " " and resid 23 and name HA )) ASSI {12125} (( segid " " and resid 74 and name HE21)) (( segid " " and resid 5 and name HD1 )) 2.800 2.800 3.200 peak 12125 spectrum 1 weight 0.10000E+01 volume 0.16728E-02 ppm1 6.756 ppm2 1.559 CV 1 OR {12125} (( segid " " and resid 74 and name HE21)) (( segid " " and resid 5 and name HD2 )) OR {12125} (( segid " " and resid 74 and name HE21)) (( segid " " and resid 183 and name HD2 )) ASSI {12135} (( segid " " and resid 163 and name HN )) (( segid " " and resid 157 and name HB2 )) 3.000 1.100 1.100 peak 12135 spectrum 1 weight 0.10000E+01 volume 0.11141E-02 ppm1 7.824 ppm2 2.564 CV 1 OR {12135} (( segid " " and resid 163 and name HN )) (( segid " " and resid 162 and name HB2 )) ASSI {12136} (( segid " " and resid 162 and name HN )) (( segid " " and resid 165 and name HG )) 3.100 1.200 1.200 peak 12136 spectrum 1 weight 0.10000E+01 volume 0.94943E-03 ppm1 7.319 ppm2 1.630 CV 1 OR {12136} (( segid " " and resid 162 and name HN )) (( segid " " and resid 163 and name HB2 )) ASSI {12146} (( segid " " and resid 148 and name HN )) (( segid " " and resid 146 and name HA )) 3.100 1.200 1.200 peak 12146 spectrum 1 weight 0.10000E+01 volume 0.10334E-02 ppm1 7.829 ppm2 3.553 CV 1 OR {12146} (( segid " " and resid 148 and name HN )) (( segid " " and resid 149 and name HA )) ASSI {12163} (( segid " " and resid 124 and name HN )) (( segid " " and resid 122 and name HA )) 2.600 2.600 3.400 peak 12163 spectrum 1 weight 0.10000E+01 volume 0.30388E-02 ppm1 8.429 ppm2 4.553 CV 1 OR {12163} (( segid " " and resid 124 and name HN )) (( segid " " and resid 125 and name HB )) ASSI {12165} (( segid " " and resid 122 and name HN )) (( segid " " and resid 123 and name HA )) 3.200 3.200 2.800 peak 12165 spectrum 1 weight 0.10000E+01 volume 0.82348E-03 ppm1 7.158 ppm2 3.792 CV 1 OR {12165} (( segid " " and resid 122 and name HN )) (( segid " " and resid 117 and name HA )) ASSI {12170} (( segid " " and resid 110 and name HN )) (( segid " " and resid 152 and name HA )) 3.200 1.300 1.300 peak 12170 spectrum 1 weight 0.10000E+01 volume 0.78796E-03 ppm1 8.561 ppm2 3.840 CV 1 OR {12170} (( segid " " and resid 110 and name HN )) (( segid " " and resid 109 and name HD1 )) ASSI {12192} (( segid " " and resid 82 and name HN )) ( segid " " and resid 93 and name HG1%) 2.800 1.000 1.000 peak 12192 spectrum 1 weight 0.10000E+01 volume 0.17019E-02 ppm1 8.887 ppm2 0.768 CV 1 OR {12192} (( segid " " and resid 82 and name HN )) ( segid " " and resid 80 and name HG2%) ASSI {12194} (( segid " " and resid 82 and name HN )) ( segid " " and resid 84 and name HD1%) 3.000 3.000 3.000 peak 12194 spectrum 1 weight 0.10000E+01 volume 0.10850E-02 ppm1 8.894 ppm2 0.535 CV 1 OR {12194} (( segid " " and resid 82 and name HN )) ( segid " " and resid 85 and name HG1%) ASSI {12202} (( segid " " and resid 82 and name HN )) ( segid " " and resid 112 and name HD2%) 3.100 3.100 2.900 peak 12202 spectrum 1 weight 0.10000E+01 volume 0.92359E-03 ppm1 8.875 ppm2 1.161 CV 1 OR {12202} (( segid " " and resid 82 and name HN )) (( segid " " and resid 157 and name HG )) ASSI {12227} (( segid " " and resid 47 and name HN )) (( segid " " and resid 49 and name HB1 )) 3.100 3.100 2.900 peak 12227 spectrum 1 weight 0.10000E+01 volume 0.91067E-03 ppm1 9.196 ppm2 1.705 CV 1 OR {12227} (( segid " " and resid 47 and name HN )) (( segid " " and resid 45 and name HB1 )) ASSI {12228} (( segid " " and resid 44 and name HN )) (( segid " " and resid 52 and name HA )) 3.000 1.100 1.100 peak 12228 spectrum 1 weight 0.10000E+01 volume 0.11981E-02 ppm1 8.933 ppm2 5.086 CV 1 OR {12228} (( segid " " and resid 44 and name HN )) (( segid " " and resid 45 and name HA )) ASSI {12234} (( segid " " and resid 147 and name HN )) (( segid " " and resid 149 and name HN )) 3.000 1.100 1.100 peak 12234 spectrum 1 weight 0.10000E+01 volume 0.11884E-02 ppm1 7.764 ppm2 7.488 CV 1 OR {12234} (( segid " " and resid 147 and name HN )) (( segid " " and resid 144 and name HN )) ASSI {12246} (( segid " " and resid 9 and name HN )) (( segid " " and resid 79 and name HB1 )) 2.700 0.900 0.900 peak 12246 spectrum 1 weight 0.10000E+01 volume 0.20732E-02 ppm1 8.653 ppm2 0.986 CV 1 OR {12246} (( segid " " and resid 9 and name HN )) ( segid " " and resid 8 and name HG2%) ASSI {12278} (( segid " " and resid 52 and name HD21)) (( segid " " and resid 52 and name HN )) 3.200 3.200 2.800 peak 12278 spectrum 1 weight 0.10000E+01 volume 0.83639E-03 ppm1 6.568 ppm2 8.533 CV 1 OR {12278} (( segid " " and resid 52 and name HD21)) (( segid " " and resid 43 and name HN )) ASSI {12284} (( segid " " and resid 52 and name HD22)) ( segid " " and resid 51 and name HG1%) 3.000 1.100 1.100 peak 12284 spectrum 1 weight 0.10000E+01 volume 0.12304E-02 ppm1 7.324 ppm2 0.764 CV 1 OR {12284} (( segid " " and resid 52 and name HD22)) ( segid " " and resid 44 and name HG1%) OR {12284} (( segid " " and resid 52 and name HD22)) ( segid " " and resid 53 and name HD1%) OR {12284} (( segid " " and resid 52 and name HD22)) ( segid " " and resid 51 and name HG2%) ASSI {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 53 and name HD1%) 3.000 3.000 3.000 peak 12288 spectrum 1 weight 0.10000E+01 volume 0.11948E-02 ppm1 6.579 ppm2 0.789 CV 1 OR {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 55 and name HD2%) OR {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 51 and name HG1%) OR {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 44 and name HG1%) OR {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 51 and name HG2%) OR {12288} (( segid " " and resid 52 and name HD21)) ( segid " " and resid 173 and name HD1%) ASSI {12298} (( segid " " and resid 43 and name HD21)) ( segid " " and resid 44 and name HG1%) 2.900 1.000 1.000 peak 12298 spectrum 1 weight 0.10000E+01 volume 0.15242E-02 ppm1 6.443 ppm2 0.801 CV 1 OR {12298} (( segid " " and resid 43 and name HD21)) ( segid " " and resid 44 and name HG2%) OR {12298} (( segid " " and resid 43 and name HD21)) ( segid " " and resid 51 and name HG2%) ASSI {12311} (( segid " " and resid 142 and name HN )) (( segid " " and resid 145 and name HB1 )) 3.100 3.100 2.900 peak 12311 spectrum 1 weight 0.10000E+01 volume 0.94301E-03 ppm1 8.109 ppm2 1.910 CV 1 OR {12311} (( segid " " and resid 142 and name HN )) (( segid " " and resid 137 and name HB )) ASSI { 212} ( segid " " and resid 1137 and name HD1%) (( segid " " and resid 1134 and name HN )) 2.900 1.000 1.000 peak 212 spectrum 1 weight 0.10000E+01 volume 0.15684E-02 ppm1 0.773 ppm2 7.832 CV 1 OR { 212} ( segid " " and resid 1179 and name HD1%) (( segid " " and resid 1182 and name HN )) ASSI { 437} (( segid " " and resid 1168 and name HG2 )) ( segid " " and resid 1164 and name HD1%) 2.500 0.800 0.800 peak 437 spectrum 1 weight 0.10000E+01 volume 0.37417E-02 ppm1 2.420 ppm2 0.826 CV 1 OR { 437} (( segid " " and resid 1150 and name HG2 )) ( segid " " and resid 1149 and name HG2%) ASSI { 1085} (( segid " " and resid 1183 and name HB2 )) ( segid " " and resid 1131 and name HD2%) 3.000 1.100 1.100 peak 1085 spectrum 1 weight 0.10000E+01 volume 0.13076E-02 ppm1 2.319 ppm2 0.848 CV 1 OR { 1085} (( segid " " and resid 1183 and name HB2 )) ( segid " " and resid 1179 and name HG2%) ASSI { 1629} ( segid " " and resid 1164 and name HD2%) (( segid " " and resid 1164 and name HN )) 2.500 2.500 3.500 peak 1629 spectrum 1 weight 0.10000E+01 volume 0.37308E-02 ppm1 0.864 ppm2 7.822 CV 1 OR { 1629} ( segid " " and resid 1164 and name HD2%) (( segid " " and resid 1165 and name HN )) ASSI { 1784} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1145 and name HN )) 2.600 0.800 0.800 peak 1784 spectrum 1 weight 0.10000E+01 volume 0.29991E-02 ppm1 1.509 ppm2 8.506 CV 1 OR { 1784} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1146 and name HN )) ASSI { 1787} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1133 and name HN )) 3.000 1.100 1.100 peak 1787 spectrum 1 weight 0.10000E+01 volume 0.13184E-02 ppm1 1.494 ppm2 7.825 CV 1 OR { 1787} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1134 and name HN )) ASSI { 1789} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1136 and name HN )) 2.000 0.500 0.500 peak 1789 spectrum 1 weight 0.10000E+01 volume 0.13155E-01 ppm1 1.486 ppm2 7.648 CV 1 OR { 1789} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1137 and name HN )) ASSI { 1872} ( segid " " and resid 1136 and name HB% ) ( segid " " and resid 1139 and name HD2%) 2.200 0.600 0.600 peak 1872 spectrum 1 weight 0.10000E+01 volume 0.85771E-02 ppm1 1.489 ppm2 0.817 CV 1 OR { 1872} ( segid " " and resid 1136 and name HB% ) ( segid " " and resid 1135 and name HD1%) ASSI { 1894} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1139 and name HB2 )) 2.900 1.000 1.000 peak 1894 spectrum 1 weight 0.10000E+01 volume 0.16082E-02 ppm1 1.490 ppm2 1.814 CV 1 OR { 1894} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1149 and name HG12)) ASSI { 1895} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1146 and name HB1 )) 2.400 2.400 3.600 peak 1895 spectrum 1 weight 0.10000E+01 volume 0.47051E-02 ppm1 1.491 ppm2 1.931 CV 1 OR { 1895} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1137 and name HB )) OR { 1895} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1133 and name HB2 )) OR { 1895} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1133 and name HB1 )) OR { 1895} ( segid " " and resid 1136 and name HB% ) (( segid " " and resid 1132 and name HB1 )) ASSI { 1932} (( segid " " and resid 1142 and name HE2 )) (( segid " " and resid 1174 and name HG1 )) 1.900 0.400 0.400 peak 1932 spectrum 1 weight 0.10000E+01 volume 0.21642E-01 ppm1 2.914 ppm2 1.339 CV 1 OR { 1932} (( segid " " and resid 1133 and name HE1 )) (( segid " " and resid 1133 and name HG1 )) OR { 1932} (( segid " " and resid 1158 and name HE1 )) (( segid " " and resid 1158 and name HG2 )) OR { 1932} (( segid " " and resid 1158 and name HE2 )) (( segid " " and resid 1158 and name HG2 )) ASSI { 1936} (( segid " " and resid 1133 and name HE1 )) (( segid " " and resid 1137 and name HG11)) 2.600 0.800 0.800 peak 1936 spectrum 1 weight 0.10000E+01 volume 0.31693E-02 ppm1 2.919 ppm2 1.027 CV 1 OR { 1936} (( segid " " and resid 1133 and name HE2 )) (( segid " " and resid 1137 and name HG11)) OR { 1936} (( segid " " and resid 1142 and name HE2 )) ( segid " " and resid 1170 and name HD2%) ASSI { 1979} (( segid " " and resid 1171 and name HG1 )) (( segid " " and resid 1171 and name HN )) 2.400 2.400 3.600 peak 1979 spectrum 1 weight 0.10000E+01 volume 0.42994E-02 ppm1 2.412 ppm2 7.835 CV 1 OR { 1979} (( segid " " and resid 1171 and name HG2 )) (( segid " " and resid 1171 and name HN )) OR { 1979} (( segid " " and resid 1168 and name HG2 )) (( segid " " and resid 1165 and name HN )) ASSI { 1983} (( segid " " and resid 1171 and name HB2 )) (( segid " " and resid 1171 and name HA )) 2.100 0.500 0.500 peak 1983 spectrum 1 weight 0.10000E+01 volume 0.11391E-01 ppm1 2.143 ppm2 3.937 CV 1 OR { 1983} (( segid " " and resid 1150 and name HB2 )) (( segid " " and resid 1150 and name HA )) OR { 1983} (( segid " " and resid 1150 and name HB1 )) (( segid " " and resid 1150 and name HA )) ASSI { 1999} (( segid " " and resid 1145 and name HA )) (( segid " " and resid 1148 and name HB1 )) 2.700 0.900 0.900 peak 1999 spectrum 1 weight 0.10000E+01 volume 0.21515E-02 ppm1 4.120 ppm2 1.988 CV 1 OR { 1999} (( segid " " and resid 1166 and name HA )) ( segid " " and resid 1169 and name HE% ) OR { 1999} (( segid " " and resid 1166 and name HA )) (( segid " " and resid 1169 and name HB1 )) ASSI { 2037} (( segid " " and resid 1127 and name HB1 )) ( segid " " and resid 1120 and name HD1%) 2.400 0.700 0.700 peak 2037 spectrum 1 weight 0.10000E+01 volume 0.45965E-02 ppm1 1.855 ppm2 0.831 CV 1 OR { 2037} (( segid " " and resid 1194 and name HB1 )) ( segid " " and resid 1193 and name HD1%) OR { 2037} (( segid " " and resid 1127 and name HB2 )) ( segid " " and resid 1120 and name HD1%) OR { 2037} (( segid " " and resid 1160 and name HB2 )) ( segid " " and resid 1164 and name HD2%) OR { 2037} (( segid " " and resid 1160 and name HB2 )) ( segid " " and resid 1163 and name HD1%) OR { 2037} (( segid " " and resid 1127 and name HB2 )) ( segid " " and resid 1128 and name HG1%) OR { 2037} (( segid " " and resid 1185 and name HB1 )) ( segid " " and resid 1188 and name HD2%) OR { 2037} (( segid " " and resid 1160 and name HB1 )) ( segid " " and resid 1163 and name HD1%) ASSI { 2080} (( segid " " and resid 1133 and name HD2 )) (( segid " " and resid 1133 and name HE2 )) 1.800 0.400 0.400 peak 2080 spectrum 1 weight 0.10000E+01 volume 0.28524E-01 ppm1 1.636 ppm2 2.895 CV 1 OR { 2080} (( segid " " and resid 1161 and name HD1 )) (( segid " " and resid 1161 and name HE2 )) OR { 2080} (( segid " " and resid 1140 and name HD2 )) (( segid " " and resid 1140 and name HE2 )) OR { 2080} (( segid " " and resid 1140 and name HD1 )) (( segid " " and resid 1140 and name HE1 )) OR { 2080} (( segid " " and resid 1161 and name HD2 )) (( segid " " and resid 1161 and name HE1 )) OR { 2080} (( segid " " and resid 1133 and name HD2 )) (( segid " " and resid 1133 and name HE1 )) OR { 2080} (( segid " " and resid 1133 and name HD1 )) (( segid " " and resid 1133 and name HE2 )) OR { 2080} (( segid " " and resid 1133 and name HD1 )) (( segid " " and resid 1133 and name HE1 )) ASSI { 2096} (( segid " " and resid 1176 and name HG1 )) (( segid " " and resid 1173 and name HA )) 3.300 1.300 1.300 peak 2096 spectrum 1 weight 0.10000E+01 volume 0.72442E-03 ppm1 1.323 ppm2 4.302 CV 1 OR { 2096} (( segid " " and resid 1176 and name HG1 )) (( segid " " and resid 1175 and name HB )) ASSI { 2485} (( segid " " and resid 1167 and name HG1 )) ( segid " " and resid 1163 and name HD1%) 2.200 0.600 0.600 peak 2485 spectrum 1 weight 0.10000E+01 volume 0.74144E-02 ppm1 2.317 ppm2 0.826 CV 1 OR { 2485} (( segid " " and resid 1189 and name HG1 )) ( segid " " and resid 1193 and name HD2%) OR { 2485} (( segid " " and resid 1183 and name HG1 )) ( segid " " and resid 1179 and name HG2%) ASSI { 2497} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 70 and name HA )) 2.800 1.000 1.000 peak 2497 spectrum 1 weight 0.10000E+01 volume 0.18074E-02 ppm1 2.006 ppm2 3.914 CV 1 OR { 2497} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 1165 and name HA )) ASSI { 2498} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1143 and name HA )) 3.100 1.200 1.200 peak 2498 spectrum 1 weight 0.10000E+01 volume 0.10576E-02 ppm1 1.026 ppm2 4.106 CV 1 OR { 2498} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1166 and name HA )) ASSI { 2505} (( segid " " and resid 1134 and name HB1 )) (( segid " " and resid 1134 and name HN )) 2.300 0.700 0.700 peak 2505 spectrum 1 weight 0.10000E+01 volume 0.57338E-02 ppm1 2.131 ppm2 7.841 CV 1 OR { 2505} (( segid " " and resid 1143 and name HB1 )) (( segid " " and resid 1143 and name HN )) ASSI { 2531} (( segid " " and resid 1128 and name HB )) (( segid " " and resid 1129 and name HA )) 2.700 2.700 3.300 peak 2531 spectrum 1 weight 0.10000E+01 volume 0.21262E-02 ppm1 2.001 ppm2 4.133 CV 1 OR { 2531} (( segid " " and resid 1128 and name HB )) (( segid " " and resid 1127 and name HA )) ASSI { 2537} (( segid " " and resid 1168 and name HG2 )) (( segid " " and resid 188 and name HD2 )) 2.900 1.100 1.100 peak 2537 spectrum 1 weight 0.10000E+01 volume 0.14633E-02 ppm1 2.416 ppm2 1.548 CV 1 OR { 2537} (( segid " " and resid 1168 and name HG2 )) (( segid " " and resid 188 and name HD1 )) OR { 2537} (( segid " " and resid 1168 and name HG2 )) (( segid " " and resid 1164 and name HB1 )) OR { 2537} (( segid " " and resid 1171 and name HG1 )) (( segid " " and resid 1174 and name HD2 )) ASSI { 2648} (( segid " " and resid 1121 and name HD2 )) (( segid " " and resid 1121 and name HB1 )) 2.600 2.600 3.400 peak 2648 spectrum 1 weight 0.10000E+01 volume 0.30172E-02 ppm1 3.869 ppm2 1.809 CV 1 OR { 2648} (( segid " " and resid 1121 and name HD2 )) (( segid " " and resid 1120 and name HB )) ASSI { 2677} ( segid " " and resid 1139 and name HD1%) (( segid " " and resid 1136 and name HN )) 2.800 0.900 0.900 peak 2677 spectrum 1 weight 0.10000E+01 volume 0.20211E-02 ppm1 0.809 ppm2 7.672 CV 1 OR { 2677} ( segid " " and resid 1139 and name HD1%) (( segid " " and resid 1137 and name HN )) ASSI { 2692} (( segid " " and resid 1133 and name HA )) (( segid " " and resid 1133 and name HN )) 2.600 0.800 0.800 peak 2692 spectrum 1 weight 0.10000E+01 volume 0.31476E-02 ppm1 4.093 ppm2 7.826 CV 1 OR { 2692} (( segid " " and resid 1133 and name HA )) (( segid " " and resid 1134 and name HN )) ASSI { 2694} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1144 and name HN )) 3.000 1.100 1.100 peak 2694 spectrum 1 weight 0.10000E+01 volume 0.12750E-02 ppm1 1.510 ppm2 8.273 CV 1 OR { 2694} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1147 and name HN )) OR { 2694} ( segid " " and resid 1145 and name HB% ) (( segid " " and resid 1169 and name HN )) ASSI { 2743} (( segid " " and resid 1172 and name HA )) (( segid " " and resid 1172 and name HB1 )) 2.400 0.700 0.700 peak 2743 spectrum 1 weight 0.10000E+01 volume 0.45457E-02 ppm1 4.365 ppm2 2.621 CV 1 OR { 2743} (( segid " " and resid 1178 and name HA )) (( segid " " and resid 1178 and name HB1 )) ASSI { 2973} (( segid " " and resid 1126 and name HA )) (( segid " " and resid 1129 and name HN )) 3.100 1.200 1.200 peak 2973 spectrum 1 weight 0.10000E+01 volume 0.10613E-02 ppm1 4.305 ppm2 8.005 CV 1 OR { 2973} (( segid " " and resid 1126 and name HA )) (( segid " " and resid 1128 and name HN )) ASSI { 3047} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 1165 and name HN )) 2.500 0.800 0.800 peak 3047 spectrum 1 weight 0.10000E+01 volume 0.37162E-02 ppm1 0.830 ppm2 7.825 CV 1 OR { 3047} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 1164 and name HN )) ASSI { 3093} ( segid " " and resid 1152 and name HE% ) ( segid " " and resid 1166 and name HB% ) 3.000 1.100 1.100 peak 3093 spectrum 1 weight 0.10000E+01 volume 0.11446E-02 ppm1 6.675 ppm2 1.578 CV 1 OR { 3093} ( segid " " and resid 1152 and name HE% ) (( segid " " and resid 5 and name HD2 )) OR { 3093} ( segid " " and resid 1152 and name HE% ) (( segid " " and resid 1158 and name HD1 )) ASSI { 3116} ( segid " " and resid 1152 and name HE% ) (( segid " " and resid 1163 and name HA )) 3.200 1.300 1.300 peak 3116 spectrum 1 weight 0.10000E+01 volume 0.75340E-03 ppm1 6.677 ppm2 3.858 CV 1 OR { 3116} ( segid " " and resid 1152 and name HE% ) (( segid " " and resid 1162 and name HA )) ASSI { 3147} (( segid " " and resid 1142 and name HD2 )) (( segid " " and resid 1139 and name HA )) 2.900 1.100 1.100 peak 3147 spectrum 1 weight 0.10000E+01 volume 0.14126E-02 ppm1 1.501 ppm2 3.912 CV 1 OR { 3147} (( segid " " and resid 1142 and name HD1 )) (( segid " " and resid 1139 and name HA )) OR { 3147} (( segid " " and resid 1142 and name HD1 )) (( segid " " and resid 1173 and name HB2 )) ASSI { 3148} ( segid " " and resid 1179 and name HD1%) (( segid " " and resid 1179 and name HN )) 2.300 0.700 0.700 peak 3148 spectrum 1 weight 0.10000E+01 volume 0.52665E-02 ppm1 0.775 ppm2 7.659 CV 1 OR { 3148} ( segid " " and resid 1137 and name HD1%) (( segid " " and resid 1137 and name HN )) ASSI { 3160} ( segid " " and resid 1175 and name HG2%) (( segid " " and resid 1176 and name HN )) 2.400 0.700 0.700 peak 3160 spectrum 1 weight 0.10000E+01 volume 0.41546E-02 ppm1 1.223 ppm2 7.842 CV 1 OR { 3160} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1165 and name HN )) ASSI { 3165} (( segid " " and resid 1192 and name HA )) (( segid " " and resid 1192 and name HN )) 2.500 0.800 0.800 peak 3165 spectrum 1 weight 0.10000E+01 volume 0.34845E-02 ppm1 4.219 ppm2 8.015 CV 1 OR { 3165} (( segid " " and resid 1192 and name HA )) (( segid " " and resid 1193 and name HN )) ASSI { 3595} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1133 and name HN )) 2.500 2.500 3.500 peak 3595 spectrum 1 weight 0.10000E+01 volume 0.35642E-02 ppm1 1.405 ppm2 7.833 CV 1 OR { 3595} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1131 and name HN )) ASSI { 4504} (( segid " " and resid 1145 and name HA )) ( segid " " and resid 67 and name HD1%) 2.600 0.800 0.800 peak 4504 spectrum 1 weight 0.10000E+01 volume 0.31114E-02 ppm1 4.143 ppm2 0.825 CV 1 OR { 4504} (( segid " " and resid 1145 and name HA )) (( segid " " and resid 1149 and name HG11)) OR { 4504} (( segid " " and resid 1145 and name HA )) ( segid " " and resid 70 and name HD1%) ASSI { 5360} (( segid " " and resid 1165 and name HA )) (( segid " " and resid 1165 and name HN )) 2.800 1.000 1.000 peak 5360 spectrum 1 weight 0.10000E+01 volume 0.17096E-02 ppm1 3.937 ppm2 7.863 CV 1 OR { 5360} (( segid " " and resid 1175 and name HA )) (( segid " " and resid 1176 and name HN )) ASSI { 5751} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1166 and name HN )) 2.700 0.900 0.900 peak 5751 spectrum 1 weight 0.10000E+01 volume 0.23001E-02 ppm1 1.219 ppm2 8.212 CV 1 OR { 5751} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1169 and name HN )) ASSI { 5754} (( segid " " and resid 1164 and name HB1 )) (( segid " " and resid 1165 and name HN )) 2.700 0.900 0.900 peak 5754 spectrum 1 weight 0.10000E+01 volume 0.21805E-02 ppm1 1.581 ppm2 7.825 CV 1 OR { 5754} (( segid " " and resid 1164 and name HB1 )) (( segid " " and resid 1164 and name HN )) ASSI { 5758} ( segid " " and resid 1152 and name HD% ) ( segid " " and resid 1151 and name HG2%) 3.000 1.100 1.100 peak 5758 spectrum 1 weight 0.10000E+01 volume 0.11700E-02 ppm1 7.014 ppm2 0.802 CV 1 OR { 5758} ( segid " " and resid 1152 and name HD% ) ( segid " " and resid 1149 and name HG2%) OR { 5758} ( segid " " and resid 1152 and name HD% ) ( segid " " and resid 1163 and name HD1%) ASSI { 5792} (( segid " " and resid 1164 and name HA )) (( segid " " and resid 1164 and name HN )) 2.500 0.800 0.800 peak 5792 spectrum 1 weight 0.10000E+01 volume 0.34193E-02 ppm1 4.107 ppm2 7.833 CV 1 OR { 5792} (( segid " " and resid 1164 and name HA )) (( segid " " and resid 1165 and name HN )) ASSI { 5851} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1132 and name HG1 )) 2.800 2.800 3.200 peak 5851 spectrum 1 weight 0.10000E+01 volume 0.18944E-02 ppm1 1.405 ppm2 2.085 CV 1 OR { 5851} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1131 and name HB2 )) ASSI { 5861} (( segid " " and resid 1161 and name HB2 )) (( segid " " and resid 1164 and name HN )) 3.100 3.100 2.900 peak 5861 spectrum 1 weight 0.10000E+01 volume 0.10468E-02 ppm1 1.845 ppm2 7.810 CV 1 OR { 5861} (( segid " " and resid 1161 and name HB2 )) (( segid " " and resid 1165 and name HN )) ASSI { 5863} (( segid " " and resid 1161 and name HB1 )) (( segid " " and resid 1164 and name HN )) 3.200 3.200 2.800 peak 5863 spectrum 1 weight 0.10000E+01 volume 0.84032E-03 ppm1 1.811 ppm2 7.810 CV 1 OR { 5863} (( segid " " and resid 1161 and name HB1 )) (( segid " " and resid 1165 and name HN )) ASSI { 5929} (( segid " " and resid 1195 and name HB1 )) (( segid " " and resid 1196 and name HA )) 3.000 1.200 1.200 peak 5929 spectrum 1 weight 0.10000E+01 volume 0.11228E-02 ppm1 2.699 ppm2 4.199 CV 1 OR { 5929} (( segid " " and resid 1195 and name HB1 )) (( segid " " and resid 1197 and name HA )) ASSI { 5933} (( segid " " and resid 1167 and name HB2 )) ( segid " " and resid 1164 and name HD1%) 2.800 1.000 1.000 peak 5933 spectrum 1 weight 0.10000E+01 volume 0.16843E-02 ppm1 2.321 ppm2 0.827 CV 1 OR { 5933} (( segid " " and resid 1167 and name HB2 )) ( segid " " and resid 1164 and name HD2%) OR { 5933} (( segid " " and resid 1167 and name HB2 )) ( segid " " and resid 1163 and name HD1%) ASSI { 5948} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1132 and name HB1 )) 2.700 0.900 0.900 peak 5948 spectrum 1 weight 0.10000E+01 volume 0.21624E-02 ppm1 1.406 ppm2 1.948 CV 1 OR { 5948} ( segid " " and resid 1129 and name HB% ) (( segid " " and resid 1133 and name HB2 )) ASSI { 5957} (( segid " " and resid 1128 and name HA )) (( segid " " and resid 1128 and name HN )) 3.000 1.100 1.100 peak 5957 spectrum 1 weight 0.10000E+01 volume 0.12496E-02 ppm1 3.462 ppm2 7.996 CV 1 OR { 5957} (( segid " " and resid 1128 and name HA )) (( segid " " and resid 1129 and name HN )) ASSI { 5959} (( segid " " and resid 1128 and name HA )) (( segid " " and resid 1129 and name HA )) 3.100 1.200 1.200 peak 5959 spectrum 1 weight 0.10000E+01 volume 0.93816E-03 ppm1 3.459 ppm2 4.127 CV 1 OR { 5959} (( segid " " and resid 1128 and name HA )) (( segid " " and resid 1127 and name HA )) OR { 5959} (( segid " " and resid 1128 and name HA )) (( segid " " and resid 1187 and name HA )) ASSI { 5960} (( segid " " and resid 1128 and name HA )) ( segid " " and resid 1184 and name HD1%) 2.300 0.600 0.600 peak 5960 spectrum 1 weight 0.10000E+01 volume 0.64292E-02 ppm1 3.458 ppm2 0.868 CV 1 OR { 5960} (( segid " " and resid 1128 and name HA )) ( segid " " and resid 1188 and name HD2%) ASSI { 5963} (( segid " " and resid 1141 and name HA )) ( segid " " and resid 1141 and name HG1%) 2.500 0.800 0.800 peak 5963 spectrum 1 weight 0.10000E+01 volume 0.38974E-02 ppm1 3.574 ppm2 0.918 CV 1 OR { 5963} (( segid " " and resid 1141 and name HA )) ( segid " " and resid 67 and name HD2%) ASSI { 5990} ( segid " " and resid 1128 and name HG1%) (( segid " " and resid 1129 and name HN )) 2.500 0.800 0.800 peak 5990 spectrum 1 weight 0.10000E+01 volume 0.34736E-02 ppm1 0.820 ppm2 7.997 CV 1 OR { 5990} ( segid " " and resid 1128 and name HG1%) (( segid " " and resid 1128 and name HN )) ASSI { 5994} ( segid " " and resid 1128 and name HG1%) (( segid " " and resid 1188 and name HG )) 2.900 1.000 1.000 peak 5994 spectrum 1 weight 0.10000E+01 volume 0.15177E-02 ppm1 0.816 ppm2 1.671 CV 1 OR { 5994} ( segid " " and resid 1128 and name HG1%) (( segid " " and resid 1184 and name HB1 )) ASSI { 5999} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1142 and name HB2 )) 2.500 2.500 3.500 peak 5999 spectrum 1 weight 0.10000E+01 volume 0.34555E-02 ppm1 0.907 ppm2 1.989 CV 1 OR { 5999} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 61 and name HB2 )) OR { 5999} ( segid " " and resid 1141 and name HG1%) ( segid " " and resid 1169 and name HE% ) ASSI { 6007} (( segid " " and resid 1139 and name HA )) (( segid " " and resid 1139 and name HB1 )) 2.600 0.900 0.900 peak 6007 spectrum 1 weight 0.10000E+01 volume 0.26695E-02 ppm1 3.951 ppm2 1.353 CV 1 OR { 6007} (( segid " " and resid 1184 and name HA )) ( segid " " and resid 1187 and name HB% ) ASSI { 6024} (( segid " " and resid 1131 and name HB1 )) ( segid " " and resid 1131 and name HD2%) 2.900 1.000 1.000 peak 6024 spectrum 1 weight 0.10000E+01 volume 0.16372E-02 ppm1 1.189 ppm2 0.866 CV 1 OR { 6024} (( segid " " and resid 1131 and name HB1 )) ( segid " " and resid 1180 and name HG2%) ASSI { 6197} (( segid " " and resid 1127 and name HB2 )) ( segid " " and resid 1187 and name HB% ) 2.800 1.000 1.000 peak 6197 spectrum 1 weight 0.10000E+01 volume 0.17639E-02 ppm1 1.869 ppm2 1.363 CV 1 OR { 6197} (( segid " " and resid 1186 and name HB2 )) ( segid " " and resid 1187 and name HB% ) OR { 6197} (( segid " " and resid 1186 and name HB1 )) ( segid " " and resid 1190 and name HB% ) OR { 6197} (( segid " " and resid 1186 and name HB1 )) ( segid " " and resid 1187 and name HB% ) OR { 6197} (( segid " " and resid 1186 and name HB2 )) ( segid " " and resid 1190 and name HB% ) ASSI { 6215} ( segid " " and resid 1131 and name HD1%) ( segid " " and resid 1131 and name HD2%) 2.000 0.500 0.500 peak 6215 spectrum 1 weight 0.10000E+01 volume 0.13688E-01 ppm1 0.689 ppm2 0.869 CV 1 OR { 6215} ( segid " " and resid 1131 and name HD1%) ( segid " " and resid 1184 and name HD1%) ASSI { 6259} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1149 and name HN )) 3.200 1.300 1.300 peak 6259 spectrum 1 weight 0.10000E+01 volume 0.83670E-03 ppm1 3.854 ppm2 8.293 CV 1 OR { 6259} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1147 and name HN )) ASSI { 6273} (( segid " " and resid 1132 and name HA )) (( segid " " and resid 1131 and name HA )) 3.100 1.200 1.200 peak 6273 spectrum 1 weight 0.10000E+01 volume 0.10866E-02 ppm1 3.847 ppm2 4.104 CV 1 OR { 6273} (( segid " " and resid 1132 and name HA )) (( segid " " and resid 1133 and name HA )) OR { 6273} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1143 and name HA )) ASSI { 6588} (( segid " " and resid 1133 and name HG1 )) (( segid " " and resid 1134 and name HN )) 2.800 1.000 1.000 peak 6588 spectrum 1 weight 0.10000E+01 volume 0.16734E-02 ppm1 1.368 ppm2 7.828 CV 1 OR { 6588} (( segid " " and resid 1133 and name HG1 )) (( segid " " and resid 1133 and name HN )) ASSI { 6598} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1168 and name HB1 )) 2.100 0.500 0.500 peak 6598 spectrum 1 weight 0.10000E+01 volume 0.10739E-01 ppm1 3.940 ppm2 2.126 CV 1 OR { 6598} (( segid " " and resid 1171 and name HA )) (( segid " " and resid 1171 and name HB2 )) OR { 6598} (( segid " " and resid 1150 and name HA )) (( segid " " and resid 1150 and name HB2 )) OR { 6598} (( segid " " and resid 1134 and name HA )) (( segid " " and resid 1134 and name HB1 )) OR { 6598} (( segid " " and resid 1150 and name HA )) (( segid " " and resid 1150 and name HB1 )) ASSI { 6601} (( segid " " and resid 1134 and name HA )) (( segid " " and resid 1134 and name HN )) 2.400 0.700 0.700 peak 6601 spectrum 1 weight 0.10000E+01 volume 0.43393E-02 ppm1 3.934 ppm2 7.850 CV 1 OR { 6601} (( segid " " and resid 1171 and name HA )) (( segid " " and resid 1171 and name HN )) ASSI { 6604} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1168 and name HB1 )) 2.100 0.600 0.600 peak 6604 spectrum 1 weight 0.10000E+01 volume 0.89357E-02 ppm1 3.976 ppm2 2.141 CV 1 OR { 6604} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1171 and name HB1 )) ASSI { 6605} (( segid " " and resid 1150 and name HA )) (( segid " " and resid 1150 and name HN )) 2.600 0.800 0.800 peak 6605 spectrum 1 weight 0.10000E+01 volume 0.28216E-02 ppm1 3.934 ppm2 7.679 CV 1 OR { 6605} (( segid " " and resid 1183 and name HA )) (( segid " " and resid 1186 and name HN )) OR { 6605} (( segid " " and resid 1134 and name HA )) (( segid " " and resid 1137 and name HN )) ASSI { 6606} (( segid " " and resid 1176 and name HA )) (( segid " " and resid 1179 and name HN )) 3.000 1.200 1.200 peak 6606 spectrum 1 weight 0.10000E+01 volume 0.11119E-02 ppm1 3.893 ppm2 7.704 CV 1 OR { 6606} (( segid " " and resid 1176 and name HA )) (( segid " " and resid 1178 and name HN )) ASSI { 6610} (( segid " " and resid 1170 and name HA )) (( segid " " and resid 1170 and name HB1 )) 2.400 0.700 0.700 peak 6610 spectrum 1 weight 0.10000E+01 volume 0.42524E-02 ppm1 3.903 ppm2 1.512 CV 1 OR { 6610} (( segid " " and resid 1170 and name HA )) ( segid " " and resid 1145 and name HB% ) ASSI { 6654} (( segid " " and resid 1135 and name HB1 )) ( segid " " and resid 1135 and name HD1%) 2.100 0.600 0.600 peak 6654 spectrum 1 weight 0.10000E+01 volume 0.97579E-02 ppm1 1.575 ppm2 0.829 CV 1 OR { 6654} (( segid " " and resid 1164 and name HB1 )) ( segid " " and resid 1164 and name HD1%) ASSI { 6672} (( segid " " and resid 1136 and name HA )) (( segid " " and resid 1136 and name HN )) 2.800 1.000 1.000 peak 6672 spectrum 1 weight 0.10000E+01 volume 0.17857E-02 ppm1 3.997 ppm2 7.650 CV 1 OR { 6672} (( segid " " and resid 1136 and name HA )) (( segid " " and resid 1137 and name HN )) ASSI { 6685} (( segid " " and resid 1137 and name HB )) (( segid " " and resid 1137 and name HN )) 2.700 0.900 0.900 peak 6685 spectrum 1 weight 0.10000E+01 volume 0.24811E-02 ppm1 1.945 ppm2 7.669 CV 1 OR { 6685} (( segid " " and resid 1179 and name HB )) (( segid " " and resid 1179 and name HN )) ASSI { 6707} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1167 and name HG1 )) 2.500 0.800 0.800 peak 6707 spectrum 1 weight 0.10000E+01 volume 0.33830E-02 ppm1 0.827 ppm2 2.325 CV 1 OR { 6707} ( segid " " and resid 1137 and name HG2%) (( segid " " and resid 1141 and name HB )) OR { 6707} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1146 and name HB2 )) OR { 6707} ( segid " " and resid 1137 and name HG2%) (( segid " " and resid 1138 and name HG2 )) OR { 6707} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1150 and name HG1 )) ASSI { 6708} ( segid " " and resid 1177 and name HG2%) (( segid " " and resid 1177 and name HB )) 1.900 0.500 0.500 peak 6708 spectrum 1 weight 0.10000E+01 volume 0.16024E-01 ppm1 0.820 ppm2 1.864 CV 1 OR { 6708} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1149 and name HB )) OR { 6708} ( segid " " and resid 1177 and name HG2%) (( segid " " and resid 1177 and name HG12)) ASSI { 6712} ( segid " " and resid 1177 and name HG2%) (( segid " " and resid 1181 and name HB1 )) 2.400 0.700 0.700 peak 6712 spectrum 1 weight 0.10000E+01 volume 0.46580E-02 ppm1 0.820 ppm2 1.519 CV 1 OR { 6712} ( segid " " and resid 1177 and name HG2%) (( segid " " and resid 1142 and name HD1 )) ASSI { 6717} ( segid " " and resid 1179 and name HD1%) (( segid " " and resid 1178 and name HA )) 3.100 1.200 1.200 peak 6717 spectrum 1 weight 0.10000E+01 volume 0.10649E-02 ppm1 0.787 ppm2 4.325 CV 1 OR { 6717} ( segid " " and resid 1179 and name HD1%) (( segid " " and resid 1175 and name HB )) ASSI { 6721} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1153 and name HB1 )) 2.300 0.600 0.600 peak 6721 spectrum 1 weight 0.10000E+01 volume 0.62843E-02 ppm1 0.824 ppm2 3.888 CV 1 OR { 6721} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1150 and name HA )) ASSI { 6725} ( segid " " and resid 1149 and name HG2%) (( segid " " and resid 1150 and name HN )) 2.300 0.700 0.700 peak 6725 spectrum 1 weight 0.10000E+01 volume 0.53208E-02 ppm1 0.818 ppm2 7.665 CV 1 OR { 6725} ( segid " " and resid 1177 and name HG2%) (( segid " " and resid 1178 and name HN )) OR { 6725} ( segid " " and resid 1137 and name HG2%) (( segid " " and resid 1137 and name HN )) ASSI { 7256} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1170 and name HN )) 3.000 1.100 1.100 peak 7256 spectrum 1 weight 0.10000E+01 volume 0.11591E-02 ppm1 3.978 ppm2 8.442 CV 1 OR { 7256} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1172 and name HN )) ASSI { 7289} (( segid " " and resid 1139 and name HB2 )) (( segid " " and resid 1136 and name HA )) 2.900 1.000 1.000 peak 7289 spectrum 1 weight 0.10000E+01 volume 0.16335E-02 ppm1 1.833 ppm2 3.975 CV 1 OR { 7289} (( segid " " and resid 1139 and name HB2 )) (( segid " " and resid 1139 and name HA )) ASSI { 7729} (( segid " " and resid 1163 and name HB1 )) (( segid " " and resid 1163 and name HB2 )) 2.900 2.900 3.100 peak 7729 spectrum 1 weight 0.10000E+01 volume 0.16372E-02 ppm1 1.374 ppm2 1.825 CV 1 OR { 7729} (( segid " " and resid 1139 and name HB1 )) (( segid " " and resid 1139 and name HB2 )) ASSI { 7733} (( segid " " and resid 1185 and name HG2 )) (( segid " " and resid 1185 and name HA )) 2.300 0.700 0.700 peak 7733 spectrum 1 weight 0.10000E+01 volume 0.52448E-02 ppm1 1.757 ppm2 3.957 CV 1 OR { 7733} (( segid " " and resid 1135 and name HG )) (( segid " " and resid 1136 and name HA )) OR { 7733} (( segid " " and resid 1131 and name HG )) (( segid " " and resid 1130 and name HA2 )) ASSI { 7736} (( segid " " and resid 1171 and name HA )) (( segid " " and resid 1174 and name HG2 )) 2.400 0.700 0.700 peak 7736 spectrum 1 weight 0.10000E+01 volume 0.48536E-02 ppm1 3.951 ppm2 1.652 CV 1 OR { 7736} (( segid " " and resid 1183 and name HA )) (( segid " " and resid 1186 and name HG1 )) ASSI { 7846} (( segid " " and resid 1168 and name HA )) (( segid " " and resid 1168 and name HG1 )) 2.200 2.200 3.800 peak 7846 spectrum 1 weight 0.10000E+01 volume 0.74181E-02 ppm1 3.939 ppm2 2.366 CV 1 OR { 7846} (( segid " " and resid 1134 and name HA )) (( segid " " and resid 1134 and name HG1 )) OR { 7846} (( segid " " and resid 1150 and name HA )) (( segid " " and resid 1150 and name HG1 )) ASSI { 7847} (( segid " " and resid 1143 and name HA )) (( segid " " and resid 1146 and name HB1 )) 2.200 0.600 0.600 peak 7847 spectrum 1 weight 0.10000E+01 volume 0.68747E-02 ppm1 4.127 ppm2 1.893 CV 1 OR { 7847} (( segid " " and resid 1182 and name HA )) (( segid " " and resid 1185 and name HB1 )) ASSI { 7899} (( segid " " and resid 1169 and name HA )) (( segid " " and resid 1171 and name HB1 )) 2.300 2.300 3.700 peak 7899 spectrum 1 weight 0.10000E+01 volume 0.63025E-02 ppm1 4.123 ppm2 2.131 CV 1 OR { 7899} (( segid " " and resid 1169 and name HA )) (( segid " " and resid 1168 and name HB1 )) ASSI { 7953} (( segid " " and resid 1169 and name HA )) (( segid " " and resid 1172 and name HB1 )) 2.600 0.900 0.900 peak 7953 spectrum 1 weight 0.10000E+01 volume 0.25464E-02 ppm1 4.132 ppm2 2.665 CV 1 OR { 7953} (( segid " " and resid 1169 and name HA )) (( segid " " and resid 1169 and name HG2 )) ASSI { 8028} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1142 and name HD1 )) 2.900 2.900 3.100 peak 8028 spectrum 1 weight 0.10000E+01 volume 0.13475E-02 ppm1 0.902 ppm2 1.466 CV 1 OR { 8028} ( segid " " and resid 1141 and name HG1%) ( segid " " and resid 1136 and name HB% ) OR { 8028} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1142 and name HD2 )) OR { 8028} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1170 and name HB1 )) ASSI { 8029} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1173 and name HB2 )) 2.700 0.900 0.900 peak 8029 spectrum 1 weight 0.10000E+01 volume 0.21624E-02 ppm1 0.902 ppm2 3.896 CV 1 OR { 8029} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1144 and name HA2 )) OR { 8029} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1170 and name HA )) OR { 8029} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1144 and name HA1 )) OR { 8029} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1135 and name HA )) ASSI { 8032} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 1173 and name HA )) 3.200 1.300 1.300 peak 8032 spectrum 1 weight 0.10000E+01 volume 0.80048E-03 ppm1 0.904 ppm2 4.282 CV 1 OR { 8032} ( segid " " and resid 1141 and name HG1%) (( segid " " and resid 67 and name HA )) ASSI { 8143} (( segid " " and resid 1142 and name HA )) ( segid " " and resid 67 and name HD2%) 2.900 1.100 1.100 peak 8143 spectrum 1 weight 0.10000E+01 volume 0.14163E-02 ppm1 3.763 ppm2 0.854 CV 1 OR { 8143} (( segid " " and resid 1142 and name HA )) ( segid " " and resid 1139 and name HD1%) ASSI { 8847} (( segid " " and resid 1142 and name HG1 )) (( segid " " and resid 1142 and name HE2 )) 2.500 0.800 0.800 peak 8847 spectrum 1 weight 0.10000E+01 volume 0.36148E-02 ppm1 1.255 ppm2 2.915 CV 1 OR { 8847} (( segid " " and resid 1158 and name HG1 )) (( segid " " and resid 1158 and name HE1 )) OR { 8847} (( segid " " and resid 1142 and name HG2 )) (( segid " " and resid 1142 and name HE2 )) ASSI { 8853} (( segid " " and resid 1133 and name HB1 )) (( segid " " and resid 1133 and name HN )) 2.400 0.700 0.700 peak 8853 spectrum 1 weight 0.10000E+01 volume 0.44769E-02 ppm1 1.933 ppm2 7.829 CV 1 OR { 8853} (( segid " " and resid 1133 and name HB1 )) (( segid " " and resid 1134 and name HN )) OR { 8853} (( segid " " and resid 1133 and name HB2 )) (( segid " " and resid 1133 and name HN )) ASSI { 9246} (( segid " " and resid 1142 and name HE1 )) ( segid " " and resid 1139 and name HD1%) 2.800 2.800 3.200 peak 9246 spectrum 1 weight 0.10000E+01 volume 0.18147E-02 ppm1 2.734 ppm2 0.829 CV 1 OR { 9246} (( segid " " and resid 1142 and name HE1 )) ( segid " " and resid 1177 and name HG2%) OR { 9246} (( segid " " and resid 1142 and name HE1 )) ( segid " " and resid 1139 and name HD2%) ASSI { 9274} (( segid " " and resid 1142 and name HE1 )) (( segid " " and resid 1142 and name HB1 )) 3.200 1.300 1.300 peak 9274 spectrum 1 weight 0.10000E+01 volume 0.82946E-03 ppm1 2.724 ppm2 1.869 CV 1 OR { 9274} (( segid " " and resid 1142 and name HE1 )) (( segid " " and resid 1174 and name HB2 )) OR { 9274} (( segid " " and resid 1142 and name HE1 )) (( segid " " and resid 1146 and name HB1 )) OR { 9274} (( segid " " and resid 1142 and name HE1 )) (( segid " " and resid 1177 and name HG12)) ASSI { 9467} (( segid " " and resid 1142 and name HD2 )) ( segid " " and resid 1139 and name HD1%) 2.600 0.800 0.800 peak 9467 spectrum 1 weight 0.10000E+01 volume 0.31729E-02 ppm1 1.503 ppm2 0.821 CV 1 OR { 9467} (( segid " " and resid 1142 and name HD1 )) ( segid " " and resid 1177 and name HG2%) OR { 9467} (( segid " " and resid 1142 and name HD1 )) ( segid " " and resid 1139 and name HD1%) ASSI { 9733} ( segid " " and resid 1180 and name HD1%) (( segid " " and resid 1176 and name HG2 )) 2.600 0.800 0.800 peak 9733 spectrum 1 weight 0.10000E+01 volume 0.29375E-02 ppm1 0.701 ppm2 1.529 CV 1 OR { 9733} ( segid " " and resid 1180 and name HD1%) (( segid " " and resid 1135 and name HB1 )) ASSI { 9737} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1186 and name HG2 )) 3.000 1.100 1.100 peak 9737 spectrum 1 weight 0.10000E+01 volume 0.12026E-02 ppm1 2.670 ppm2 1.727 CV 1 OR { 9737} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1185 and name HG2 )) ASSI { 9738} (( segid " " and resid 1142 and name HD1 )) (( segid " " and resid 1174 and name HA )) 3.000 1.200 1.200 peak 9738 spectrum 1 weight 0.10000E+01 volume 0.11119E-02 ppm1 1.492 ppm2 3.788 CV 1 OR { 9738} (( segid " " and resid 1142 and name HD1 )) (( segid " " and resid 1142 and name HA )) ASSI { 9749} (( segid " " and resid 1134 and name HB1 )) ( segid " " and resid 1131 and name HD2%) 2.500 0.800 0.800 peak 9749 spectrum 1 weight 0.10000E+01 volume 0.35207E-02 ppm1 2.113 ppm2 0.852 CV 1 OR { 9749} (( segid " " and resid 1134 and name HB1 )) (( segid " " and resid 1180 and name HG11)) ASSI { 9750} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1170 and name HG )) 2.800 1.000 1.000 peak 9750 spectrum 1 weight 0.10000E+01 volume 0.19161E-02 ppm1 3.872 ppm2 1.524 CV 1 OR { 9750} (( segid " " and resid 1146 and name HA )) ( segid " " and resid 1145 and name HB% ) ASSI { 9759} (( segid " " and resid 1189 and name HG1 )) (( segid " " and resid 1189 and name HA )) 2.200 0.600 0.600 peak 9759 spectrum 1 weight 0.10000E+01 volume 0.71065E-02 ppm1 2.326 ppm2 4.138 CV 1 OR { 9759} (( segid " " and resid 1143 and name HG1 )) (( segid " " and resid 1143 and name HA )) OR { 9759} (( segid " " and resid 1143 and name HG1 )) (( segid " " and resid 1140 and name HA )) ASSI { 9763} (( segid " " and resid 1168 and name HG2 )) (( segid " " and resid 1165 and name HA )) 2.100 0.500 0.500 peak 9763 spectrum 1 weight 0.10000E+01 volume 0.10921E-01 ppm1 2.421 ppm2 3.940 CV 1 OR { 9763} (( segid " " and resid 1171 and name HG1 )) (( segid " " and resid 1171 and name HA )) OR { 9763} (( segid " " and resid 1150 and name HG2 )) (( segid " " and resid 1150 and name HA )) ASSI { 9774} (( segid " " and resid 1160 and name HB2 )) (( segid " " and resid 1160 and name HG1 )) 2.000 0.500 0.500 peak 9774 spectrum 1 weight 0.10000E+01 volume 0.15944E-01 ppm1 1.853 ppm2 1.644 CV 1 OR { 9774} (( segid " " and resid 1186 and name HB2 )) (( segid " " and resid 1186 and name HG1 )) OR { 9774} (( segid " " and resid 1160 and name HB1 )) (( segid " " and resid 1160 and name HG2 )) OR { 9774} (( segid " " and resid 1127 and name HB1 )) (( segid " " and resid 1127 and name HG2 )) OR { 9774} (( segid " " and resid 1160 and name HB1 )) (( segid " " and resid 1160 and name HG1 )) OR { 9774} (( segid " " and resid 1160 and name HB2 )) (( segid " " and resid 1160 and name HG2 )) ASSI { 9790} (( segid " " and resid 1146 and name HG1 )) (( segid " " and resid 1170 and name HG )) 3.200 1.300 1.300 peak 9790 spectrum 1 weight 0.10000E+01 volume 0.86206E-03 ppm1 2.155 ppm2 1.471 CV 1 OR { 9790} (( segid " " and resid 1146 and name HG1 )) ( segid " " and resid 1145 and name HB% ) ASSI { 9917} (( segid " " and resid 1132 and name HG2 )) ( segid " " and resid 1129 and name HB% ) 3.200 1.300 1.300 peak 9917 spectrum 1 weight 0.10000E+01 volume 0.77513E-03 ppm1 2.499 ppm2 1.405 CV 1 OR { 9917} (( segid " " and resid 1132 and name HG2 )) ( segid " " and resid 1187 and name HB% ) ASSI { 9922} (( segid " " and resid 1177 and name HA )) (( segid " " and resid 1135 and name HA )) 3.200 1.300 1.300 peak 9922 spectrum 1 weight 0.10000E+01 volume 0.78962E-03 ppm1 3.356 ppm2 3.863 CV 1 OR { 9922} (( segid " " and resid 1177 and name HA )) (( segid " " and resid 1176 and name HA )) ASSI { 9924} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1142 and name HB1 )) 2.700 0.900 0.900 peak 9924 spectrum 1 weight 0.10000E+01 volume 0.22420E-02 ppm1 1.027 ppm2 1.868 CV 1 OR { 9924} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1146 and name HB1 )) OR { 9924} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1174 and name HB1 )) ASSI { 9939} (( segid " " and resid 1167 and name HG2 )) ( segid " " and resid 1163 and name HD1%) 2.400 0.700 0.700 peak 9939 spectrum 1 weight 0.10000E+01 volume 0.47486E-02 ppm1 2.581 ppm2 0.834 CV 1 OR { 9939} (( segid " " and resid 1183 and name HG2 )) ( segid " " and resid 1179 and name HG2%) ASSI { 9943} (( segid " " and resid 1181 and name HD1 )) ( segid " " and resid 1177 and name HG2%) 2.500 0.800 0.800 peak 9943 spectrum 1 weight 0.10000E+01 volume 0.35714E-02 ppm1 3.103 ppm2 0.821 CV 1 OR { 9943} (( segid " " and resid 1181 and name HD1 )) ( segid " " and resid 1135 and name HD1%) ASSI { 9948} (( segid " " and resid 1178 and name HA )) (( segid " " and resid 1178 and name HB2 )) 2.500 0.800 0.800 peak 9948 spectrum 1 weight 0.10000E+01 volume 0.37488E-02 ppm1 4.363 ppm2 2.788 CV 1 OR { 9948} (( segid " " and resid 1172 and name HA )) (( segid " " and resid 1172 and name HB2 )) ASSI { 9963} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1146 and name HB2 )) 2.600 0.900 0.900 peak 9963 spectrum 1 weight 0.10000E+01 volume 0.25499E-02 ppm1 0.788 ppm2 2.300 CV 1 OR { 9963} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1167 and name HG1 )) OR { 9963} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1167 and name HB2 )) ASSI { 9964} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1146 and name HG2 )) 2.900 1.000 1.000 peak 9964 spectrum 1 weight 0.10000E+01 volume 0.15647E-02 ppm1 0.791 ppm2 2.537 CV 1 OR { 9964} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1167 and name HG2 )) ASSI { 9966} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1146 and name HA )) 2.400 0.700 0.700 peak 9966 spectrum 1 weight 0.10000E+01 volume 0.41364E-02 ppm1 0.789 ppm2 3.897 CV 1 OR { 9966} ( segid " " and resid 1149 and name HD1%) (( segid " " and resid 1167 and name HA )) ASSI { 9973} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1169 and name HG1 )) 2.700 0.900 0.900 peak 9973 spectrum 1 weight 0.10000E+01 volume 0.24811E-02 ppm1 1.219 ppm2 2.399 CV 1 OR { 9973} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1168 and name HG2 )) ASSI { 9987} (( segid " " and resid 1173 and name HB2 )) ( segid " " and resid 1170 and name HD1%) 2.700 0.900 0.900 peak 9987 spectrum 1 weight 0.10000E+01 volume 0.21515E-02 ppm1 3.922 ppm2 0.860 CV 1 OR { 9987} (( segid " " and resid 1173 and name HB2 )) ( segid " " and resid 67 and name HD2%) ASSI { 9999} (( segid " " and resid 1140 and name HG1 )) ( segid " " and resid 1137 and name HG2%) 2.700 2.700 3.300 peak 9999 spectrum 1 weight 0.10000E+01 volume 0.21080E-02 ppm1 1.409 ppm2 0.795 CV 1 OR { 9999} (( segid " " and resid 1140 and name HG1 )) ( segid " " and resid 1139 and name HD1%) ASSI {10000} (( segid " " and resid 1140 and name HD2 )) (( segid " " and resid 1140 and name HE2 )) 2.000 0.500 0.500 peak 10000 spectrum 1 weight 0.10000E+01 volume 0.13300E-01 ppm1 1.578 ppm2 2.890 CV 1 OR {10000} (( segid " " and resid 1140 and name HD1 )) (( segid " " and resid 1140 and name HE1 )) OR {10000} (( segid " " and resid 1158 and name HD2 )) (( segid " " and resid 1158 and name HE2 )) OR {10000} (( segid " " and resid 1158 and name HD1 )) (( segid " " and resid 1158 and name HE1 )) OR {10000} (( segid " " and resid 1158 and name HD1 )) (( segid " " and resid 1158 and name HE2 )) OR {10000} (( segid " " and resid 1158 and name HD2 )) (( segid " " and resid 1158 and name HE1 )) ASSI {10005} (( segid " " and resid 1176 and name HD2 )) (( segid " " and resid 1173 and name HA )) 3.100 1.200 1.200 peak 10005 spectrum 1 weight 0.10000E+01 volume 0.10142E-02 ppm1 1.583 ppm2 4.313 CV 1 OR {10005} (( segid " " and resid 1176 and name HD2 )) (( segid " " and resid 1175 and name HB )) ASSI {10006} (( segid " " and resid 1133 and name HD2 )) (( segid " " and resid 1133 and name HN )) 2.700 2.700 3.300 peak 10006 spectrum 1 weight 0.10000E+01 volume 0.22385E-02 ppm1 1.653 ppm2 7.826 CV 1 OR {10006} (( segid " " and resid 1133 and name HD2 )) (( segid " " and resid 1134 and name HN )) OR {10006} (( segid " " and resid 1133 and name HD1 )) (( segid " " and resid 1133 and name HN )) ASSI {10014} (( segid " " and resid 1174 and name HE2 )) (( segid " " and resid 1171 and name HN )) 2.900 2.900 3.100 peak 10014 spectrum 1 weight 0.10000E+01 volume 0.15177E-02 ppm1 2.913 ppm2 7.847 CV 1 OR {10014} (( segid " " and resid 1133 and name HE1 )) (( segid " " and resid 1134 and name HN )) OR {10014} (( segid " " and resid 1161 and name HE2 )) (( segid " " and resid 1165 and name HN )) OR {10014} (( segid " " and resid 1140 and name HE2 )) (( segid " " and resid 1143 and name HN )) OR {10014} (( segid " " and resid 1133 and name HE2 )) (( segid " " and resid 1134 and name HN )) OR {10014} (( segid " " and resid 1133 and name HE1 )) (( segid " " and resid 1133 and name HN )) OR {10014} (( segid " " and resid 1142 and name HE2 )) (( segid " " and resid 1143 and name HN )) OR {10014} (( segid " " and resid 1133 and name HE2 )) (( segid " " and resid 1133 and name HN )) OR {10014} (( segid " " and resid 1161 and name HE1 )) (( segid " " and resid 1165 and name HN )) ASSI {10015} (( segid " " and resid 1161 and name HE2 )) (( segid " " and resid 1162 and name HN )) 3.200 1.300 1.300 peak 10015 spectrum 1 weight 0.10000E+01 volume 0.80773E-03 ppm1 2.907 ppm2 7.642 CV 1 OR {10015} (( segid " " and resid 1133 and name HE1 )) (( segid " " and resid 1137 and name HN )) OR {10015} (( segid " " and resid 1133 and name HE2 )) (( segid " " and resid 1137 and name HN )) OR {10015} (( segid " " and resid 1161 and name HE1 )) (( segid " " and resid 1162 and name HN )) ASSI {10018} (( segid " " and resid 1167 and name HG2 )) (( segid " " and resid 1167 and name HB1 )) 2.600 0.800 0.800 peak 10018 spectrum 1 weight 0.10000E+01 volume 0.30861E-02 ppm1 2.581 ppm2 1.960 CV 1 OR {10018} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1183 and name HB1 )) ASSI {10021} (( segid " " and resid 1127 and name HB2 )) (( segid " " and resid 1127 and name HD1 )) 2.200 0.600 0.600 peak 10021 spectrum 1 weight 0.10000E+01 volume 0.71717E-02 ppm1 1.858 ppm2 3.155 CV 1 OR {10021} (( segid " " and resid 1127 and name HB2 )) (( segid " " and resid 1127 and name HD2 )) OR {10021} (( segid " " and resid 1186 and name HB1 )) (( segid " " and resid 1186 and name HD1 )) OR {10021} (( segid " " and resid 1160 and name HB2 )) (( segid " " and resid 1160 and name HD2 )) OR {10021} (( segid " " and resid 1160 and name HB2 )) (( segid " " and resid 1160 and name HD1 )) ASSI {10026} (( segid " " and resid 1135 and name HG )) (( segid " " and resid 1136 and name HN )) 2.600 0.900 0.900 peak 10026 spectrum 1 weight 0.10000E+01 volume 0.27527E-02 ppm1 1.758 ppm2 7.676 CV 1 OR {10026} (( segid " " and resid 1186 and name HG2 )) (( segid " " and resid 1186 and name HN )) OR {10026} (( segid " " and resid 1185 and name HG2 )) (( segid " " and resid 1186 and name HN )) ASSI {10039} (( segid " " and resid 1127 and name HD2 )) (( segid " " and resid 1127 and name HG2 )) 1.900 0.400 0.400 peak 10039 spectrum 1 weight 0.10000E+01 volume 0.21714E-01 ppm1 3.179 ppm2 1.645 CV 1 OR {10039} (( segid " " and resid 1160 and name HD2 )) (( segid " " and resid 1160 and name HG1 )) OR {10039} (( segid " " and resid 1160 and name HD1 )) (( segid " " and resid 1160 and name HG2 )) OR {10039} (( segid " " and resid 1160 and name HD2 )) (( segid " " and resid 1160 and name HG2 )) ASSI {10043} (( segid " " and resid 1189 and name HA )) (( segid " " and resid 1189 and name HG1 )) 2.400 0.700 0.700 peak 10043 spectrum 1 weight 0.10000E+01 volume 0.46653E-02 ppm1 4.166 ppm2 2.341 CV 1 OR {10043} (( segid " " and resid 1189 and name HA )) (( segid " " and resid 1192 and name HG1 )) ASSI {10062} (( segid " " and resid 1186 and name HG2 )) (( segid " " and resid 1186 and name HD2 )) 2.100 0.500 0.500 peak 10062 spectrum 1 weight 0.10000E+01 volume 0.10381E-01 ppm1 1.760 ppm2 3.138 CV 1 OR {10062} (( segid " " and resid 1185 and name HG2 )) (( segid " " and resid 1185 and name HD1 )) OR {10062} (( segid " " and resid 1185 and name HG2 )) (( segid " " and resid 1185 and name HD2 )) ASSI {10073} (( segid " " and resid 1183 and name HB1 )) ( segid " " and resid 1179 and name HG2%) 2.500 2.500 3.500 peak 10073 spectrum 1 weight 0.10000E+01 volume 0.38322E-02 ppm1 1.975 ppm2 0.833 CV 1 OR {10073} (( segid " " and resid 1183 and name HB1 )) ( segid " " and resid 1188 and name HD2%) ASSI {10088} (( segid " " and resid 1172 and name HB2 )) (( segid " " and resid 1173 and name HB2 )) 3.200 1.300 1.300 peak 10088 spectrum 1 weight 0.10000E+01 volume 0.78599E-03 ppm1 2.782 ppm2 3.910 CV 1 OR {10088} (( segid " " and resid 1172 and name HB2 )) (( segid " " and resid 1170 and name HA )) OR {10088} (( segid " " and resid 1172 and name HB2 )) (( segid " " and resid 1171 and name HA )) ASSI {10107} ( segid " " and resid 1187 and name HB% ) ( segid " " and resid 1188 and name HD2%) 2.100 0.500 0.500 peak 10107 spectrum 1 weight 0.10000E+01 volume 0.11591E-01 ppm1 1.372 ppm2 0.866 CV 1 OR {10107} ( segid " " and resid 1187 and name HB% ) ( segid " " and resid 1184 and name HD1%) ASSI {10112} (( segid " " and resid 1187 and name HA )) ( segid " " and resid 1188 and name HD2%) 3.000 1.100 1.100 peak 10112 spectrum 1 weight 0.10000E+01 volume 0.12641E-02 ppm1 4.119 ppm2 0.871 CV 1 OR {10112} (( segid " " and resid 1187 and name HA )) ( segid " " and resid 1184 and name HD1%) ASSI {10114} (( segid " " and resid 1184 and name HB1 )) (( segid " " and resid 1184 and name HA )) 2.600 0.900 0.900 peak 10114 spectrum 1 weight 0.10000E+01 volume 0.26985E-02 ppm1 1.709 ppm2 3.906 CV 1 OR {10114} (( segid " " and resid 1184 and name HB2 )) (( segid " " and resid 1181 and name HA )) OR {10114} (( segid " " and resid 1184 and name HB2 )) (( segid " " and resid 1184 and name HA )) ASSI {10132} (( segid " " and resid 1187 and name HA )) (( segid " " and resid 1187 and name HN )) 2.500 0.800 0.800 peak 10132 spectrum 1 weight 0.10000E+01 volume 0.32019E-02 ppm1 4.111 ppm2 8.039 CV 1 OR {10132} (( segid " " and resid 1187 and name HA )) (( segid " " and resid 1188 and name HN )) ASSI {10138} ( segid " " and resid 1187 and name HB% ) (( segid " " and resid 1186 and name HN )) 2.800 1.000 1.000 peak 10138 spectrum 1 weight 0.10000E+01 volume 0.18219E-02 ppm1 1.374 ppm2 7.654 CV 1 OR {10138} ( segid " " and resid 1187 and name HB% ) (( segid " " and resid 1189 and name HN )) ASSI {10139} ( segid " " and resid 1187 and name HB% ) (( segid " " and resid 1187 and name HN )) 2.100 0.600 0.600 peak 10139 spectrum 1 weight 0.10000E+01 volume 0.92690E-02 ppm1 1.374 ppm2 8.036 CV 1 OR {10139} ( segid " " and resid 1187 and name HB% ) (( segid " " and resid 1188 and name HN )) ASSI {10154} (( segid " " and resid 1170 and name HG )) (( segid " " and resid 1170 and name HA )) 2.900 1.100 1.100 peak 10154 spectrum 1 weight 0.10000E+01 volume 0.14560E-02 ppm1 1.498 ppm2 3.918 CV 1 OR {10154} (( segid " " and resid 1170 and name HG )) (( segid " " and resid 1167 and name HA )) ASSI {10171} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1149 and name HB )) 2.500 0.800 0.800 peak 10171 spectrum 1 weight 0.10000E+01 volume 0.38105E-02 ppm1 3.877 ppm2 1.903 CV 1 OR {10171} (( segid " " and resid 1146 and name HA )) (( segid " " and resid 1146 and name HB1 )) ASSI {10172} (( segid " " and resid 1127 and name HD1 )) (( segid " " and resid 1127 and name HB2 )) 2.000 0.500 0.500 peak 10172 spectrum 1 weight 0.10000E+01 volume 0.13977E-01 ppm1 3.177 ppm2 1.843 CV 1 OR {10172} (( segid " " and resid 1127 and name HD2 )) (( segid " " and resid 1127 and name HB2 )) OR {10172} (( segid " " and resid 1186 and name HD1 )) (( segid " " and resid 1186 and name HB1 )) OR {10172} (( segid " " and resid 1160 and name HD2 )) (( segid " " and resid 1160 and name HB2 )) OR {10172} (( segid " " and resid 1160 and name HD1 )) (( segid " " and resid 1160 and name HB2 )) OR {10172} (( segid " " and resid 1160 and name HD1 )) (( segid " " and resid 1160 and name HB1 )) ASSI {10185} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1131 and name HN )) 2.700 0.900 0.900 peak 10185 spectrum 1 weight 0.10000E+01 volume 0.22711E-02 ppm1 0.891 ppm2 7.858 CV 1 OR {10185} ( segid " " and resid 1184 and name HD2%) (( segid " " and resid 1131 and name HN )) OR {10185} ( segid " " and resid 1184 and name HD2%) (( segid " " and resid 1133 and name HN )) ASSI {10188} ( segid " " and resid 1184 and name HD2%) (( segid " " and resid 1132 and name HG1 )) 2.200 0.600 0.600 peak 10188 spectrum 1 weight 0.10000E+01 volume 0.75086E-02 ppm1 0.893 ppm2 2.042 CV 1 OR {10188} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1131 and name HB2 )) ASSI {10190} ( segid " " and resid 1184 and name HD2%) (( segid " " and resid 1131 and name HA )) 2.500 2.500 3.500 peak 10190 spectrum 1 weight 0.10000E+01 volume 0.34917E-02 ppm1 0.892 ppm2 4.105 CV 1 OR {10190} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1131 and name HA )) OR {10190} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1188 and name HA )) OR {10190} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1187 and name HA )) ASSI {10195} (( segid " " and resid 1167 and name HG2 )) (( segid " " and resid 1167 and name HA )) 2.600 0.800 0.800 peak 10195 spectrum 1 weight 0.10000E+01 volume 0.31621E-02 ppm1 2.586 ppm2 3.914 CV 1 OR {10195} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1183 and name HA )) ASSI {10202} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1186 and name HG2 )) 3.100 1.200 1.200 peak 10202 spectrum 1 weight 0.10000E+01 volume 0.10142E-02 ppm1 2.581 ppm2 1.768 CV 1 OR {10202} (( segid " " and resid 1167 and name HG2 )) (( segid " " and resid 1163 and name HB2 )) OR {10202} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1180 and name HG12)) OR {10202} (( segid " " and resid 1167 and name HG2 )) (( segid " " and resid 1164 and name HB2 )) OR {10202} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1180 and name HB )) ASSI {10239} (( segid " " and resid 1180 and name HA )) (( segid " " and resid 1180 and name HG11)) 2.400 0.700 0.700 peak 10239 spectrum 1 weight 0.10000E+01 volume 0.48681E-02 ppm1 3.661 ppm2 0.853 CV 1 OR {10239} (( segid " " and resid 1180 and name HA )) ( segid " " and resid 1179 and name HG2%) ASSI {10261} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1183 and name HB2 )) 3.100 1.200 1.200 peak 10261 spectrum 1 weight 0.10000E+01 volume 0.10214E-02 ppm1 0.894 ppm2 2.334 CV 1 OR {10261} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1138 and name HG2 )) ASSI {10266} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1136 and name HN )) 3.300 1.300 1.300 peak 10266 spectrum 1 weight 0.10000E+01 volume 0.74253E-03 ppm1 0.892 ppm2 7.657 CV 1 OR {10266} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1137 and name HN )) ASSI {10267} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1134 and name HN )) 3.000 1.100 1.100 peak 10267 spectrum 1 weight 0.10000E+01 volume 0.11808E-02 ppm1 0.896 ppm2 7.839 CV 1 OR {10267} ( segid " " and resid 1180 and name HG2%) (( segid " " and resid 1131 and name HN )) ASSI {10269} ( segid " " and resid 1180 and name HD1%) (( segid " " and resid 1179 and name HN )) 3.200 1.300 1.300 peak 10269 spectrum 1 weight 0.10000E+01 volume 0.86931E-03 ppm1 0.703 ppm2 7.657 CV 1 OR {10269} ( segid " " and resid 1180 and name HD1%) (( segid " " and resid 1136 and name HN )) OR {10269} ( segid " " and resid 1180 and name HD1%) (( segid " " and resid 1137 and name HN )) ASSI {10291} (( segid " " and resid 1178 and name HA )) (( segid " " and resid 1181 and name HG2 )) 3.000 1.100 1.100 peak 10291 spectrum 1 weight 0.10000E+01 volume 0.12532E-02 ppm1 4.361 ppm2 1.745 CV 1 OR {10291} (( segid " " and resid 1178 and name HA )) (( segid " " and resid 1179 and name HG12)) OR {10291} (( segid " " and resid 1178 and name HA )) (( segid " " and resid 1181 and name HG1 )) ASSI {10301} (( segid " " and resid 1178 and name HB1 )) (( segid " " and resid 1179 and name HN )) 2.600 0.900 0.900 peak 10301 spectrum 1 weight 0.10000E+01 volume 0.25790E-02 ppm1 2.637 ppm2 7.677 CV 1 OR {10301} (( segid " " and resid 1178 and name HB1 )) (( segid " " and resid 1178 and name HN )) ASSI {10316} ( segid " " and resid 1177 and name HD1%) (( segid " " and resid 1173 and name HB1 )) 2.600 0.900 0.900 peak 10316 spectrum 1 weight 0.10000E+01 volume 0.25861E-02 ppm1 0.730 ppm2 3.879 CV 1 OR {10316} ( segid " " and resid 1177 and name HD1%) (( segid " " and resid 1135 and name HA )) OR {10316} ( segid " " and resid 1177 and name HD1%) (( segid " " and resid 1176 and name HA )) ASSI {10326} (( segid " " and resid 1133 and name HB1 )) (( segid " " and resid 1130 and name HA1 )) 2.600 0.900 0.900 peak 10326 spectrum 1 weight 0.10000E+01 volume 0.26296E-02 ppm1 1.928 ppm2 3.869 CV 1 OR {10326} (( segid " " and resid 1176 and name HB2 )) (( segid " " and resid 1176 and name HA )) ASSI {10328} (( segid " " and resid 1133 and name HB1 )) (( segid " " and resid 1132 and name HN )) 3.200 1.300 1.300 peak 10328 spectrum 1 weight 0.10000E+01 volume 0.87655E-03 ppm1 1.927 ppm2 8.636 CV 1 OR {10328} (( segid " " and resid 1133 and name HB2 )) (( segid " " and resid 1132 and name HN )) OR {10328} (( segid " " and resid 1133 and name HB1 )) (( segid " " and resid 1135 and name HN )) ASSI {10336} (( segid " " and resid 1176 and name HE2 )) (( segid " " and resid 1176 and name HD2 )) 2.000 0.500 0.500 peak 10336 spectrum 1 weight 0.10000E+01 volume 0.13036E-01 ppm1 2.834 ppm2 1.558 CV 1 OR {10336} (( segid " " and resid 1174 and name HE1 )) (( segid " " and resid 1174 and name HD1 )) OR {10336} (( segid " " and resid 1176 and name HE2 )) (( segid " " and resid 1176 and name HG2 )) OR {10336} (( segid " " and resid 1176 and name HE2 )) (( segid " " and resid 1176 and name HD1 )) ASSI {10337} (( segid " " and resid 1176 and name HE2 )) (( segid " " and resid 1176 and name HG1 )) 2.500 0.800 0.800 peak 10337 spectrum 1 weight 0.10000E+01 volume 0.35424E-02 ppm1 2.834 ppm2 1.296 CV 1 OR {10337} (( segid " " and resid 1174 and name HE1 )) (( segid " " and resid 1174 and name HG1 )) ASSI {10339} (( segid " " and resid 1176 and name HE2 )) ( segid " " and resid 1180 and name HD1%) 2.900 2.900 3.100 peak 10339 spectrum 1 weight 0.10000E+01 volume 0.14307E-02 ppm1 2.841 ppm2 0.701 CV 1 OR {10339} (( segid " " and resid 1174 and name HE1 )) ( segid " " and resid 1177 and name HD1%) OR {10339} (( segid " " and resid 1176 and name HE2 )) ( segid " " and resid 1177 and name HD1%) ASSI {10341} (( segid " " and resid 1165 and name HA )) ( segid " " and resid 1165 and name HG2%) 2.200 0.600 0.600 peak 10341 spectrum 1 weight 0.10000E+01 volume 0.72877E-02 ppm1 3.937 ppm2 1.209 CV 1 OR {10341} (( segid " " and resid 1175 and name HA )) ( segid " " and resid 1175 and name HG2%) ASSI {10343} (( segid " " and resid 1165 and name HA )) ( segid " " and resid 1164 and name HD1%) 2.900 1.100 1.100 peak 10343 spectrum 1 weight 0.10000E+01 volume 0.14416E-02 ppm1 3.933 ppm2 0.793 CV 1 OR {10343} (( segid " " and resid 1175 and name HA )) ( segid " " and resid 1179 and name HD1%) ASSI {10344} (( segid " " and resid 1165 and name HA )) (( segid " " and resid 1164 and name HB1 )) 3.100 1.200 1.200 peak 10344 spectrum 1 weight 0.10000E+01 volume 0.10105E-02 ppm1 3.936 ppm2 1.559 CV 1 OR {10344} (( segid " " and resid 1165 and name HA )) (( segid " " and resid 188 and name HD2 )) OR {10344} (( segid " " and resid 1165 and name HA )) (( segid " " and resid 188 and name HD1 )) OR {10344} (( segid " " and resid 1165 and name HA )) ( segid " " and resid 1166 and name HB% ) ASSI {10357} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 1165 and name HA )) 2.000 0.500 0.500 peak 10357 spectrum 1 weight 0.10000E+01 volume 0.15017E-01 ppm1 1.222 ppm2 3.914 CV 1 OR {10357} ( segid " " and resid 1175 and name HG2%) (( segid " " and resid 1175 and name HA )) OR {10357} ( segid " " and resid 1165 and name HG2%) (( segid " " and resid 70 and name HA )) ASSI {10367} ( segid " " and resid 1175 and name HG2%) ( segid " " and resid 1179 and name HD1%) 2.000 0.500 0.500 peak 10367 spectrum 1 weight 0.10000E+01 volume 0.14590E-01 ppm1 1.226 ppm2 0.780 CV 1 OR {10367} ( segid " " and resid 1165 and name HG2%) ( segid " " and resid 70 and name HD1%) ASSI {10394} ( segid " " and resid 1170 and name HD1%) (( segid " " and resid 1170 and name HN )) 2.800 2.800 3.200 peak 10394 spectrum 1 weight 0.10000E+01 volume 0.18618E-02 ppm1 0.909 ppm2 8.430 CV 1 OR {10394} ( segid " " and resid 1170 and name HD1%) (( segid " " and resid 1172 and name HN )) ASSI {10397} ( segid " " and resid 1170 and name HD2%) ( segid " " and resid 1145 and name HB% ) 2.000 0.500 0.500 peak 10397 spectrum 1 weight 0.10000E+01 volume 0.11993E-01 ppm1 1.025 ppm2 1.486 CV 1 OR {10397} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1170 and name HG )) ASSI {10400} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1171 and name HN )) 3.100 1.200 1.200 peak 10400 spectrum 1 weight 0.10000E+01 volume 0.98519E-03 ppm1 1.024 ppm2 7.820 CV 1 OR {10400} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1143 and name HN )) ASSI {10401} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1170 and name HN )) 2.700 2.700 3.300 peak 10401 spectrum 1 weight 0.10000E+01 volume 0.24268E-02 ppm1 1.025 ppm2 8.444 CV 1 OR {10401} ( segid " " and resid 1170 and name HD2%) (( segid " " and resid 1142 and name HN )) ASSI {10406} (( segid " " and resid 1169 and name HG2 )) ( segid " " and resid 67 and name HD2%) 2.800 1.000 1.000 peak 10406 spectrum 1 weight 0.10000E+01 volume 0.18545E-02 ppm1 2.694 ppm2 0.866 CV 1 OR {10406} (( segid " " and resid 1169 and name HG2 )) ( segid " " and resid 70 and name HD2%) ASSI {10411} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1186 and name HB2 )) 3.000 3.000 3.000 peak 10411 spectrum 1 weight 0.10000E+01 volume 0.12351E-02 ppm1 2.661 ppm2 1.867 CV 1 OR {10411} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1185 and name HB1 )) OR {10411} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1186 and name HB1 )) ASSI {10414} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1182 and name HB1 )) 2.000 0.500 0.500 peak 10414 spectrum 1 weight 0.10000E+01 volume 0.12177E-01 ppm1 2.667 ppm2 2.226 CV 1 OR {10414} (( segid " " and resid 1169 and name HG2 )) (( segid " " and resid 1169 and name HB2 )) ASSI {10418} (( segid " " and resid 1169 and name HG2 )) (( segid " " and resid 1166 and name HA )) 2.400 0.700 0.700 peak 10418 spectrum 1 weight 0.10000E+01 volume 0.48753E-02 ppm1 2.670 ppm2 4.138 CV 1 OR {10418} (( segid " " and resid 1182 and name HG2 )) (( segid " " and resid 1182 and name HA )) OR {10418} (( segid " " and resid 1169 and name HG2 )) (( segid " " and resid 1169 and name HA )) ASSI {10426} (( segid " " and resid 1169 and name HG1 )) ( segid " " and resid 1145 and name HB% ) 3.000 1.100 1.100 peak 10426 spectrum 1 weight 0.10000E+01 volume 0.11736E-02 ppm1 2.430 ppm2 1.502 CV 1 OR {10426} (( segid " " and resid 1169 and name HG1 )) (( segid " " and resid 1170 and name HB1 )) ASSI {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1179 and name HG12)) 2.900 2.900 3.100 peak 10437 spectrum 1 weight 0.10000E+01 volume 0.13981E-02 ppm1 2.536 ppm2 1.722 CV 1 OR {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1181 and name HG2 )) OR {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1186 and name HG2 )) OR {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1185 and name HG2 )) OR {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1180 and name HB )) OR {10437} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1184 and name HB2 )) ASSI {10438} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1185 and name HB1 )) 3.200 3.200 2.800 peak 10438 spectrum 1 weight 0.10000E+01 volume 0.78237E-03 ppm1 2.530 ppm2 1.843 CV 1 OR {10438} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1186 and name HB2 )) OR {10438} (( segid " " and resid 1182 and name HG1 )) (( segid " " and resid 1186 and name HB1 )) ASSI {10444} ( segid " " and resid 1169 and name HE% ) ( segid " " and resid 70 and name HD2%) 2.100 0.500 0.500 peak 10444 spectrum 1 weight 0.10000E+01 volume 0.11410E-01 ppm1 2.006 ppm2 0.879 CV 1 OR {10444} ( segid " " and resid 1169 and name HE% ) ( segid " " and resid 67 and name HD2%) ASSI {10446} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 70 and name HB1 )) 2.700 2.700 3.300 peak 10446 spectrum 1 weight 0.10000E+01 volume 0.23363E-02 ppm1 2.010 ppm2 1.455 CV 1 OR {10446} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 1170 and name HB1 )) ASSI {10451} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 1166 and name HA )) 2.400 0.700 0.700 peak 10451 spectrum 1 weight 0.10000E+01 volume 0.46435E-02 ppm1 2.007 ppm2 4.108 CV 1 OR {10451} ( segid " " and resid 1169 and name HE% ) (( segid " " and resid 1169 and name HA )) ASSI {10459} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1181 and name HD2 )) 2.700 2.700 3.300 peak 10459 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 2.052 ppm2 3.122 CV 1 OR {10459} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1186 and name HD2 )) OR {10459} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1181 and name HD1 )) ASSI {10461} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1175 and name HA )) 3.000 3.000 3.000 peak 10461 spectrum 1 weight 0.10000E+01 volume 0.12894E-02 ppm1 2.050 ppm2 3.912 CV 1 OR {10461} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1183 and name HA )) OR {10461} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1181 and name HA )) OR {10461} ( segid " " and resid 1182 and name HE% ) (( segid " " and resid 1176 and name HA )) ASSI {10474} ( segid " " and resid 1162 and name HD1%) (( segid " " and resid 70 and name HB2 )) 2.900 1.100 1.100 peak 10474 spectrum 1 weight 0.10000E+01 volume 0.13728E-02 ppm1 0.626 ppm2 1.806 CV 1 OR {10474} ( segid " " and resid 1162 and name HD1%) (( segid " " and resid 1161 and name HB1 )) ASSI {10483} (( segid " " and resid 1192 and name HB2 )) (( segid " " and resid 1192 and name HN )) 2.900 1.000 1.000 peak 10483 spectrum 1 weight 0.10000E+01 volume 0.16408E-02 ppm1 2.098 ppm2 8.015 CV 1 OR {10483} (( segid " " and resid 1192 and name HB2 )) (( segid " " and resid 1193 and name HN )) ASSI {10489} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 1167 and name HB2 )) 2.600 0.800 0.800 peak 10489 spectrum 1 weight 0.10000E+01 volume 0.29231E-02 ppm1 0.831 ppm2 2.305 CV 1 OR {10489} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 1168 and name HG1 )) ASSI {10491} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 188 and name HE1 )) 3.200 1.300 1.300 peak 10491 spectrum 1 weight 0.10000E+01 volume 0.81498E-03 ppm1 0.836 ppm2 2.878 CV 1 OR {10491} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 188 and name HE2 )) OR {10491} ( segid " " and resid 1164 and name HD1%) (( segid " " and resid 1161 and name HE2 )) ASSI {10499} ( segid " " and resid 1193 and name HD2%) (( segid " " and resid 1194 and name HN )) 3.200 1.300 1.300 peak 10499 spectrum 1 weight 0.10000E+01 volume 0.78599E-03 ppm1 0.856 ppm2 8.246 CV 1 OR {10499} ( segid " " and resid 1193 and name HD2%) (( segid " " and resid 1195 and name HN )) ASSI {10502} ( segid " " and resid 1139 and name HD2%) (( segid " " and resid 1140 and name HN )) 3.000 1.200 1.200 peak 10502 spectrum 1 weight 0.10000E+01 volume 0.11011E-02 ppm1 0.845 ppm2 7.368 CV 1 OR {10502} ( segid " " and resid 1139 and name HD2%) (( segid " " and resid 1143 and name HE22)) ASSI {10513} ( segid " " and resid 1166 and name HB% ) (( segid " " and resid 1165 and name HN )) 3.300 1.300 1.300 peak 10513 spectrum 1 weight 0.10000E+01 volume 0.70269E-03 ppm1 1.589 ppm2 7.836 CV 1 OR {10513} ( segid " " and resid 1166 and name HB% ) (( segid " " and resid 1164 and name HN )) ASSI {10530} (( segid " " and resid 1183 and name HG2 )) (( segid " " and resid 1183 and name HG1 )) 2.100 0.500 0.500 peak 10530 spectrum 1 weight 0.10000E+01 volume 0.10986E-01 ppm1 2.582 ppm2 2.306 CV 1 OR {10530} (( segid " " and resid 1167 and name HG2 )) (( segid " " and resid 1167 and name HG1 )) ASSI {10697} ( segid " " and resid 1170 and name HD1%) (( segid " " and resid 1171 and name HA )) 2.200 0.600 0.600 peak 10697 spectrum 1 weight 0.10000E+01 volume 0.69979E-02 ppm1 0.903 ppm2 3.902 CV 1 OR {10697} ( segid " " and resid 1170 and name HD1%) (( segid " " and resid 1170 and name HA )) ASSI {11095} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1188 and name HN )) 2.800 1.000 1.000 peak 11095 spectrum 1 weight 0.10000E+01 volume 0.16770E-02 ppm1 0.887 ppm2 7.997 CV 1 OR {11095} ( segid " " and resid 1184 and name HD1%) (( segid " " and resid 1129 and name HN )) ASSI {12493} (( segid " " and resid 1176 and name HG1 )) ( segid " " and resid 1179 and name HG2%) 2.600 2.600 3.400 peak 12493 spectrum 1 weight 0.10000E+01 volume 0.26659E-02 ppm1 1.318 ppm2 0.830 CV 1 OR {12493} (( segid " " and resid 1176 and name HG1 )) ( segid " " and resid 1177 and name HG2%) OR {12493} (( segid " " and resid 1176 and name HG1 )) ( segid " " and resid 1137 and name HG2%) OR {12493} (( segid " " and resid 1176 and name HG1 )) ( segid " " and resid 67 and name HD1%) ASSI { 355} ( segid " " and resid 101 and name HG2%) ( segid " " and resid 78 and name HD% ) 3.200 1.300 1.300 peak 355 spectrum 1 weight 0.10000E+01 volume 0.84757E-03 ppm1 0.381 ppm2 6.855 CV 1 OR { 355} ( segid " " and resid 101 and name HG2%) ( segid " " and resid 98 and name HD% ) ASSI { 962} ( segid " " and resid 111 and name HD1%) ( segid " " and resid 172 and name HB% ) 2.100 2.100 3.900 peak 962 spectrum 1 weight 0.10000E+01 volume 0.11105E-01 ppm1 0.466 ppm2 1.251 CV 1 OR { 962} ( segid " " and resid 111 and name HD1%) (( segid " " and resid 153 and name HG1 )) ASSI { 1001} ( segid " " and resid 51 and name HG2%) (( segid " " and resid 52 and name HA )) 2.800 2.800 3.200 peak 1001 spectrum 1 weight 0.10000E+01 volume 0.19849E-02 ppm1 0.796 ppm2 5.114 CV 1 OR { 1001} ( segid " " and resid 44 and name HG2%) (( segid " " and resid 52 and name HA )) ASSI { 1025} ( segid " " and resid 88 and name HB% ) ( segid " " and resid 134 and name HD2%) 2.100 0.500 0.500 peak 1025 spectrum 1 weight 0.10000E+01 volume 0.10471E-01 ppm1 1.381 ppm2 0.844 CV 1 OR { 1025} ( segid " " and resid 146 and name HB% ) ( segid " " and resid 143 and name HD2%) ASSI { 1027} (( segid " " and resid 111 and name HA )) (( segid " " and resid 112 and name HB2 )) 3.100 1.200 1.200 peak 1027 spectrum 1 weight 0.10000E+01 volume 0.10540E-02 ppm1 4.320 ppm2 2.017 CV 1 OR { 1027} (( segid " " and resid 111 and name HA )) (( segid " " and resid 152 and name HB )) ASSI { 1040} ( segid " " and resid 112 and name HD2%) ( segid " " and resid 112 and name HD1%) 2.200 0.600 0.600 peak 1040 spectrum 1 weight 0.10000E+01 volume 0.75702E-02 ppm1 1.185 ppm2 0.806 CV 1 OR { 1040} ( segid " " and resid 112 and name HD2%) ( segid " " and resid 80 and name HG2%) ASSI { 1047} (( segid " " and resid 111 and name HA )) ( segid " " and resid 152 and name HG2%) 3.100 1.200 1.200 peak 1047 spectrum 1 weight 0.10000E+01 volume 0.10722E-02 ppm1 4.307 ppm2 1.034 CV 1 OR { 1047} (( segid " " and resid 111 and name HA )) (( segid " " and resid 111 and name HG12)) ASSI { 1060} (( segid " " and resid 135 and name HB )) ( segid " " and resid 126 and name HG2%) 2.900 2.900 3.100 peak 1060 spectrum 1 weight 0.10000E+01 volume 0.15684E-02 ppm1 4.098 ppm2 0.828 CV 1 OR { 1060} (( segid " " and resid 135 and name HB )) ( segid " " and resid 134 and name HD2%) ASSI { 1062} ( segid " " and resid 125 and name HG2%) (( segid " " and resid 125 and name HN )) 2.700 0.900 0.900 peak 1062 spectrum 1 weight 0.10000E+01 volume 0.22420E-02 ppm1 1.162 ppm2 8.025 CV 1 OR { 1062} ( segid " " and resid 125 and name HG2%) (( segid " " and resid 128 and name HN )) ASSI { 1069} ( segid " " and resid 79 and name HD2%) (( segid " " and resid 111 and name HG11)) 2.400 0.700 0.700 peak 1069 spectrum 1 weight 0.10000E+01 volume 0.47486E-02 ppm1 0.280 ppm2 1.020 CV 1 OR { 1069} ( segid " " and resid 79 and name HD2%) (( segid " " and resid 6 and name HG )) ASSI { 1094} ( segid " " and resid 79 and name HD2%) ( segid " " and resid 111 and name HG2%) 2.100 0.600 0.600 peak 1094 spectrum 1 weight 0.10000E+01 volume 0.99898E-02 ppm1 0.278 ppm2 0.499 CV 1 OR { 1094} ( segid " " and resid 79 and name HD2%) ( segid " " and resid 113 and name HG2%) ASSI { 1096} (( segid " " and resid 109 and name HG1 )) ( segid " " and resid 182 and name HG2%) 2.600 0.800 0.800 peak 1096 spectrum 1 weight 0.10000E+01 volume 0.29665E-02 ppm1 2.006 ppm2 0.851 CV 1 OR { 1096} (( segid " " and resid 109 and name HG2 )) ( segid " " and resid 182 and name HG2%) OR { 1096} (( segid " " and resid 109 and name HG1 )) ( segid " " and resid 176 and name HG2%) OR { 1096} (( segid " " and resid 109 and name HG1 )) ( segid " " and resid 176 and name HG1%) ASSI { 1099} (( segid " " and resid 110 and name HG12)) ( segid " " and resid 151 and name HB% ) 2.700 0.900 0.900 peak 1099 spectrum 1 weight 0.10000E+01 volume 0.23254E-02 ppm1 1.838 ppm2 1.221 CV 1 OR { 1099} (( segid " " and resid 110 and name HG12)) (( segid " " and resid 149 and name HG12)) ASSI { 1107} ( segid " " and resid 4 and name HG2%) (( segid " " and resid 76 and name HA )) 3.000 1.100 1.100 peak 1107 spectrum 1 weight 0.10000E+01 volume 0.12206E-02 ppm1 0.664 ppm2 4.684 CV 1 OR { 1107} ( segid " " and resid 4 and name HG2%) (( segid " " and resid 53 and name HA )) ASSI { 1110} ( segid " " and resid 110 and name HD1%) (( segid " " and resid 109 and name HA )) 3.000 3.000 3.000 peak 1110 spectrum 1 weight 0.10000E+01 volume 0.13112E-02 ppm1 0.832 ppm2 4.431 CV 1 OR { 1110} ( segid " " and resid 110 and name HD1%) (( segid " " and resid 77 and name HA )) ASSI { 1492} ( segid " " and resid 113 and name HG1%) ( segid " " and resid 165 and name HD2%) 2.800 1.000 1.000 peak 1492 spectrum 1 weight 0.10000E+01 volume 0.19813E-02 ppm1 0.357 ppm2 1.017 CV 1 OR { 1492} ( segid " " and resid 113 and name HG1%) ( segid " " and resid 84 and name HD2%) OR { 1492} ( segid " " and resid 113 and name HG1%) (( segid " " and resid 155 and name HB1 )) ASSI { 1519} (( segid " " and resid 170 and name HA )) ( segid " " and resid 173 and name HD1%) 2.400 0.700 0.700 peak 1519 spectrum 1 weight 0.10000E+01 volume 0.45204E-02 ppm1 4.252 ppm2 0.809 CV 1 OR { 1519} (( segid " " and resid 170 and name HA )) ( segid " " and resid 46 and name HG2%) ASSI { 1568} (( segid " " and resid 95 and name HA )) (( segid " " and resid 99 and name HG1 )) 3.000 1.200 1.200 peak 1568 spectrum 1 weight 0.10000E+01 volume 0.11156E-02 ppm1 4.097 ppm2 1.680 CV 1 OR { 1568} (( segid " " and resid 95 and name HA )) (( segid " " and resid 94 and name HB1 )) ASSI { 1591} ( segid " " and resid 95 and name HB% ) (( segid " " and resid 91 and name HA )) 3.200 1.300 1.300 peak 1591 spectrum 1 weight 0.10000E+01 volume 0.74978E-03 ppm1 1.366 ppm2 3.703 CV 1 OR { 1591} ( segid " " and resid 95 and name HB% ) (( segid " " and resid 93 and name HA )) ASSI { 1594} ( segid " " and resid 3 and name HB% ) (( segid " " and resid 5 and name HG2 )) 2.300 2.300 3.700 peak 1594 spectrum 1 weight 0.10000E+01 volume 0.54404E-02 ppm1 1.368 ppm2 0.832 CV 1 OR { 1594} ( segid " " and resid 3 and name HB% ) ( segid " " and resid 51 and name HG2%) OR { 1594} ( segid " " and resid 3 and name HB% ) ( segid " " and resid 173 and name HD1%) ASSI { 1618} (( segid " " and resid 152 and name HB )) ( segid " " and resid 151 and name HB% ) 2.800 2.800 3.200 peak 1618 spectrum 1 weight 0.10000E+01 volume 0.17568E-02 ppm1 2.010 ppm2 1.228 CV 1 OR { 1618} (( segid " " and resid 152 and name HB )) ( segid " " and resid 172 and name HB% ) ASSI { 1654} ( segid " " and resid 44 and name HG2%) (( segid " " and resid 44 and name HB )) 1.800 0.400 0.400 peak 1654 spectrum 1 weight 0.10000E+01 volume 0.28340E-01 ppm1 0.797 ppm2 1.908 CV 1 OR { 1654} ( segid " " and resid 51 and name HG2%) (( segid " " and resid 51 and name HB )) ASSI { 1655} ( segid " " and resid 51 and name HG2%) ( segid " " and resid 3 and name HB% ) 2.400 2.400 3.600 peak 1655 spectrum 1 weight 0.10000E+01 volume 0.47196E-02 ppm1 0.794 ppm2 1.377 CV 1 OR { 1655} ( segid " " and resid 51 and name HG2%) (( segid " " and resid 53 and name HG )) ASSI { 1670} ( segid " " and resid 21 and name HG2%) (( segid " " and resid 27 and name HN )) 3.100 1.200 1.200 peak 1670 spectrum 1 weight 0.10000E+01 volume 0.90552E-03 ppm1 0.673 ppm2 7.593 CV 1 OR { 1670} ( segid " " and resid 4 and name HG2%) (( segid " " and resid 2 and name HE22)) ASSI { 1715} (( segid " " and resid 26 and name HB1 )) (( segid " " and resid 25 and name HG1 )) 3.000 3.000 3.000 peak 1715 spectrum 1 weight 0.10000E+01 volume 0.12243E-02 ppm1 2.801 ppm2 4.219 CV 1 OR { 1715} (( segid " " and resid 26 and name HB1 )) (( segid " " and resid 22 and name HA )) OR { 1715} (( segid " " and resid 26 and name HB1 )) (( segid " " and resid 25 and name HB )) ASSI { 1735} ( segid " " and resid 126 and name HD1%) (( segid " " and resid 125 and name HB )) 3.100 1.200 1.200 peak 1735 spectrum 1 weight 0.10000E+01 volume 0.95260E-03 ppm1 0.735 ppm2 4.566 CV 1 OR { 1735} ( segid " " and resid 126 and name HD1%) (( segid " " and resid 122 and name HA )) ASSI { 1737} (( segid " " and resid 127 and name HG1 )) (( segid " " and resid 128 and name HN )) 2.600 2.600 3.400 peak 1737 spectrum 1 weight 0.10000E+01 volume 0.30897E-02 ppm1 2.289 ppm2 8.020 CV 1 OR { 1737} (( segid " " and resid 127 and name HG1 )) (( segid " " and resid 125 and name HN )) OR { 1737} (( segid " " and resid 131 and name HG1 )) (( segid " " and resid 128 and name HN )) ASSI { 1758} (( segid " " and resid 91 and name HG2 )) ( segid " " and resid 145 and name HE% ) 2.800 2.800 3.200 peak 1758 spectrum 1 weight 0.10000E+01 volume 0.19342E-02 ppm1 2.255 ppm2 0.790 CV 1 OR { 1758} (( segid " " and resid 91 and name HG1 )) ( segid " " and resid 145 and name HE% ) OR { 1758} (( segid " " and resid 91 and name HG2 )) ( segid " " and resid 93 and name HG1%) OR { 1758} (( segid " " and resid 91 and name HG1 )) ( segid " " and resid 93 and name HG1%) ASSI { 1807} (( segid " " and resid 2 and name HB2 )) (( segid " " and resid 4 and name HG12)) 2.800 2.800 3.200 peak 1807 spectrum 1 weight 0.10000E+01 volume 0.19052E-02 ppm1 1.991 ppm2 1.394 CV 1 OR { 1807} (( segid " " and resid 2 and name HB2 )) ( segid " " and resid 3 and name HB% ) ASSI { 1812} (( segid " " and resid 86 and name HA )) ( segid " " and resid 134 and name HD2%) 2.700 0.900 0.900 peak 1812 spectrum 1 weight 0.10000E+01 volume 0.24159E-02 ppm1 5.065 ppm2 0.821 CV 1 OR { 1812} (( segid " " and resid 86 and name HA )) ( segid " " and resid 134 and name HD1%) OR { 1812} (( segid " " and resid 45 and name HA )) ( segid " " and resid 46 and name HG2%) ASSI { 1864} ( segid " " and resid 67 and name HD2%) (( segid " " and resid 1144 and name HN )) 2.900 1.100 1.100 peak 1864 spectrum 1 weight 0.10000E+01 volume 0.13438E-02 ppm1 0.892 ppm2 8.262 CV 1 OR { 1864} ( segid " " and resid 67 and name HD2%) (( segid " " and resid 1147 and name HN )) ASSI { 1876} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1162 and name HA )) 2.300 0.600 0.600 peak 1876 spectrum 1 weight 0.10000E+01 volume 0.65523E-02 ppm1 0.883 ppm2 3.924 CV 1 OR { 1876} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 70 and name HA )) ASSI { 1884} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1169 and name HG1 )) 2.700 0.900 0.900 peak 1884 spectrum 1 weight 0.10000E+01 volume 0.23001E-02 ppm1 0.880 ppm2 2.407 CV 1 OR { 1884} ( segid " " and resid 67 and name HD2%) (( segid " " and resid 1169 and name HG1 )) ASSI { 1893} (( segid " " and resid 128 and name HG2 )) (( segid " " and resid 127 and name HN )) 3.000 3.000 3.000 peak 1893 spectrum 1 weight 0.10000E+01 volume 0.12134E-02 ppm1 1.552 ppm2 8.353 CV 1 OR { 1893} (( segid " " and resid 128 and name HG2 )) (( segid " " and resid 130 and name HN )) ASSI { 1898} ( segid " " and resid 70 and name HD2%) ( segid " " and resid 1166 and name HB% ) 1.800 0.400 0.400 peak 1898 spectrum 1 weight 0.10000E+01 volume 0.22196E-01 ppm1 0.884 ppm2 1.582 CV 1 OR { 1898} ( segid " " and resid 67 and name HD2%) (( segid " " and resid 67 and name HB2 )) OR { 1898} ( segid " " and resid 67 and name HD2%) (( segid " " and resid 67 and name HB1 )) ASSI { 1900} ( segid " " and resid 85 and name HG1%) (( segid " " and resid 136 and name HB1 )) 2.600 0.900 0.900 peak 1900 spectrum 1 weight 0.10000E+01 volume 0.27600E-02 ppm1 0.547 ppm2 1.624 CV 1 OR { 1900} ( segid " " and resid 85 and name HG1%) (( segid " " and resid 126 and name HG12)) ASSI { 1957} (( segid " " and resid 181 and name HD1 )) ( segid " " and resid 182 and name HG2%) 3.000 3.000 3.000 peak 1957 spectrum 1 weight 0.10000E+01 volume 0.11917E-02 ppm1 3.584 ppm2 0.861 CV 1 OR { 1957} (( segid " " and resid 181 and name HD1 )) ( segid " " and resid 182 and name HG1%) OR { 1957} (( segid " " and resid 181 and name HD1 )) ( segid " " and resid 176 and name HG1%) ASSI { 1990} (( segid " " and resid 22 and name HB1 )) (( segid " " and resid 22 and name HA )) 2.700 0.900 0.900 peak 1990 spectrum 1 weight 0.10000E+01 volume 0.20754E-02 ppm1 3.931 ppm2 4.217 CV 1 OR { 1990} (( segid " " and resid 71 and name HB2 )) (( segid " " and resid 71 and name HA )) ASSI { 2054} (( segid " " and resid 187 and name HD2 )) ( segid " " and resid 1165 and name HG2%) 3.100 3.100 2.900 peak 2054 spectrum 1 weight 0.10000E+01 volume 0.95623E-03 ppm1 3.106 ppm2 1.186 CV 1 OR { 2054} (( segid " " and resid 187 and name HD1 )) ( segid " " and resid 1165 and name HG2%) OR { 2054} (( segid " " and resid 185 and name HD2 )) (( segid " " and resid 1162 and name HB2 )) OR { 2054} (( segid " " and resid 185 and name HD1 )) (( segid " " and resid 1162 and name HB2 )) OR { 2054} (( segid " " and resid 187 and name HD2 )) (( segid " " and resid 1162 and name HB2 )) OR { 2054} (( segid " " and resid 163 and name HD2 )) (( segid " " and resid 155 and name HG )) OR { 2054} (( segid " " and resid 185 and name HD1 )) ( segid " " and resid 1165 and name HG2%) OR { 2054} (( segid " " and resid 185 and name HD2 )) ( segid " " and resid 1165 and name HG2%) OR { 2054} (( segid " " and resid 187 and name HD1 )) (( segid " " and resid 1162 and name HB2 )) OR { 2054} (( segid " " and resid 174 and name HD2 )) (( segid " " and resid 155 and name HG )) OR { 2054} (( segid " " and resid 163 and name HD2 )) (( segid " " and resid 165 and name HB1 )) OR { 2054} (( segid " " and resid 174 and name HD2 )) ( segid " " and resid 151 and name HB% ) OR { 2054} (( segid " " and resid 174 and name HD1 )) (( segid " " and resid 155 and name HG )) ASSI { 2180} ( segid " " and resid 79 and name HD1%) ( segid " " and resid 8 and name HG2%) 2.200 0.600 0.600 peak 2180 spectrum 1 weight 0.10000E+01 volume 0.69798E-02 ppm1 0.221 ppm2 0.963 CV 1 OR { 2180} ( segid " " and resid 79 and name HD1%) (( segid " " and resid 79 and name HB1 )) ASSI { 2192} ( segid " " and resid 79 and name HD1%) ( segid " " and resid 111 and name HG2%) 2.400 2.400 3.600 peak 2192 spectrum 1 weight 0.10000E+01 volume 0.51108E-02 ppm1 0.220 ppm2 0.528 CV 1 OR { 2192} ( segid " " and resid 79 and name HD1%) ( segid " " and resid 77 and name HG1%) ASSI { 2216} ( segid " " and resid 79 and name HD2%) ( segid " " and resid 175 and name HB% ) 2.900 2.900 3.100 peak 2216 spectrum 1 weight 0.10000E+01 volume 0.15756E-02 ppm1 0.282 ppm2 1.400 CV 1 OR { 2216} ( segid " " and resid 79 and name HD2%) (( segid " " and resid 81 and name HG )) OR { 2216} ( segid " " and resid 79 and name HD2%) (( segid " " and resid 110 and name HB )) ASSI { 2299} (( segid " " and resid 6 and name HA )) ( segid " " and resid 7 and name HG1%) 3.100 1.200 1.200 peak 2299 spectrum 1 weight 0.10000E+01 volume 0.99246E-03 ppm1 5.524 ppm2 0.627 CV 1 OR { 2299} (( segid " " and resid 6 and name HA )) (( segid " " and resid 5 and name HG1 )) ASSI { 2419} (( segid " " and resid 130 and name HB2 )) (( segid " " and resid 131 and name HN )) 2.600 0.800 0.800 peak 2419 spectrum 1 weight 0.10000E+01 volume 0.29701E-02 ppm1 1.987 ppm2 7.743 CV 1 OR { 2419} (( segid " " and resid 166 and name HB2 )) (( segid " " and resid 167 and name HN )) ASSI { 2512} ( segid " " and resid 77 and name HG1%) (( segid " " and resid 6 and name HG )) 2.500 0.800 0.800 peak 2512 spectrum 1 weight 0.10000E+01 volume 0.37561E-02 ppm1 0.558 ppm2 1.058 CV 1 OR { 2512} ( segid " " and resid 77 and name HG1%) (( segid " " and resid 111 and name HG12)) ASSI { 2520} ( segid " " and resid 77 and name HG2%) (( segid " " and resid 77 and name HA )) 2.200 0.600 0.600 peak 2520 spectrum 1 weight 0.10000E+01 volume 0.70703E-02 ppm1 0.763 ppm2 4.432 CV 1 OR { 2520} ( segid " " and resid 44 and name HG1%) (( segid " " and resid 44 and name HA )) ASSI { 2529} ( segid " " and resid 64 and name HE% ) ( segid " " and resid 1137 and name HG2%) 2.500 0.800 0.800 peak 2529 spectrum 1 weight 0.10000E+01 volume 0.35895E-02 ppm1 6.787 ppm2 0.844 CV 1 OR { 2529} ( segid " " and resid 64 and name HE% ) ( segid " " and resid 67 and name HD1%) ASSI { 2626} (( segid " " and resid 70 and name HA )) ( segid " " and resid 1169 and name HE% ) 3.000 1.100 1.100 peak 2626 spectrum 1 weight 0.10000E+01 volume 0.12677E-02 ppm1 3.949 ppm2 1.971 CV 1 OR { 2626} (( segid " " and resid 70 and name HA )) ( segid " " and resid 1148 and name HE% ) ASSI { 2947} (( segid " " and resid 1 and name HG1 )) ( segid " " and resid 51 and name HG2%) 2.400 2.400 3.600 peak 2947 spectrum 1 weight 0.10000E+01 volume 0.42668E-02 ppm1 2.293 ppm2 0.799 CV 1 OR { 2947} (( segid " " and resid 1 and name HG1 )) ( segid " " and resid 44 and name HG1%) OR { 2947} (( segid " " and resid 1 and name HG1 )) ( segid " " and resid 173 and name HD1%) ASSI { 2959} (( segid " " and resid 53 and name HB2 )) ( segid " " and resid 53 and name HD1%) 2.800 1.000 1.000 peak 2959 spectrum 1 weight 0.10000E+01 volume 0.18002E-02 ppm1 2.068 ppm2 0.795 CV 1 OR { 2959} (( segid " " and resid 53 and name HB2 )) ( segid " " and resid 44 and name HG1%) ASSI { 3053} (( segid " " and resid 52 and name HA )) ( segid " " and resid 44 and name HG1%) 2.900 1.000 1.000 peak 3053 spectrum 1 weight 0.10000E+01 volume 0.16046E-02 ppm1 5.119 ppm2 0.794 CV 1 OR { 3053} (( segid " " and resid 52 and name HA )) ( segid " " and resid 51 and name HG2%) OR { 3053} (( segid " " and resid 52 and name HA )) ( segid " " and resid 173 and name HD1%) OR { 3053} (( segid " " and resid 52 and name HA )) ( segid " " and resid 53 and name HD1%) ASSI { 3105} (( segid " " and resid 52 and name HB1 )) ( segid " " and resid 51 and name HG1%) 2.700 2.700 3.300 peak 3105 spectrum 1 weight 0.10000E+01 volume 0.23869E-02 ppm1 2.617 ppm2 0.779 CV 1 OR { 3105} (( segid " " and resid 52 and name HB1 )) ( segid " " and resid 51 and name HG2%) OR { 3105} (( segid " " and resid 52 and name HB1 )) ( segid " " and resid 44 and name HG1%) OR { 3105} (( segid " " and resid 52 and name HB1 )) ( segid " " and resid 173 and name HD1%) ASSI { 3115} (( segid " " and resid 52 and name HB2 )) ( segid " " and resid 51 and name HG1%) 3.000 1.100 1.100 peak 3115 spectrum 1 weight 0.10000E+01 volume 0.11518E-02 ppm1 2.662 ppm2 0.787 CV 1 OR { 3115} (( segid " " and resid 52 and name HB2 )) ( segid " " and resid 51 and name HG2%) OR { 3115} (( segid " " and resid 52 and name HB2 )) ( segid " " and resid 44 and name HG1%) OR { 3115} (( segid " " and resid 52 and name HB2 )) ( segid " " and resid 173 and name HG2%) ASSI { 3203} ( segid " " and resid 44 and name HG2%) (( segid " " and resid 43 and name HA )) 3.100 3.100 2.900 peak 3203 spectrum 1 weight 0.10000E+01 volume 0.97439E-03 ppm1 0.797 ppm2 5.494 CV 1 OR { 3203} ( segid " " and resid 51 and name HG2%) (( segid " " and resid 43 and name HA )) ASSI { 5782} (( segid " " and resid 46 and name HB )) ( segid " " and resid 46 and name HG2%) 2.200 0.600 0.600 peak 5782 spectrum 1 weight 0.10000E+01 volume 0.70631E-02 ppm1 1.722 ppm2 0.790 CV 1 OR { 5782} (( segid " " and resid 46 and name HB )) ( segid " " and resid 51 and name HG2%) ASSI { 5846} ( segid " " and resid 77 and name HG2%) (( segid " " and resid 78 and name HB1 )) 3.000 1.100 1.100 peak 5846 spectrum 1 weight 0.10000E+01 volume 0.11554E-02 ppm1 0.766 ppm2 2.652 CV 1 OR { 5846} ( segid " " and resid 77 and name HG2%) (( segid " " and resid 76 and name HB2 )) OR { 5846} ( segid " " and resid 44 and name HG1%) (( segid " " and resid 170 and name HB2 )) OR { 5846} ( segid " " and resid 77 and name HG2%) (( segid " " and resid 76 and name HB1 )) ASSI { 5869} (( segid " " and resid 41 and name HA )) (( segid " " and resid 41 and name HB2 )) 2.900 1.100 1.100 peak 5869 spectrum 1 weight 0.10000E+01 volume 0.13837E-02 ppm1 5.438 ppm2 3.658 CV 1 OR { 5869} (( segid " " and resid 41 and name HA )) (( segid " " and resid 54 and name HA2 )) ASSI { 6002} ( segid " " and resid 161 and name HG2%) (( segid " " and resid 163 and name HN )) 2.600 2.600 3.400 peak 6002 spectrum 1 weight 0.10000E+01 volume 0.29411E-02 ppm1 1.065 ppm2 7.848 CV 1 OR { 6002} ( segid " " and resid 161 and name HG2%) (( segid " " and resid 119 and name HN )) ASSI { 6004} ( segid " " and resid 161 and name HG2%) (( segid " " and resid 162 and name HB2 )) 2.900 2.900 3.100 peak 6004 spectrum 1 weight 0.10000E+01 volume 0.15430E-02 ppm1 1.068 ppm2 2.583 CV 1 OR { 6004} ( segid " " and resid 161 and name HG2%) (( segid " " and resid 157 and name HB2 )) ASSI { 6028} ( segid " " and resid 23 and name HD% ) ( segid " " and resid 165 and name HD1%) 3.000 1.100 1.100 peak 6028 spectrum 1 weight 0.10000E+01 volume 0.11301E-02 ppm1 6.223 ppm2 1.012 CV 1 OR { 6028} ( segid " " and resid 23 and name HD% ) ( segid " " and resid 24 and name HG2%) ASSI { 6033} ( segid " " and resid 177 and name HD2%) (( segid " " and resid 177 and name HN )) 2.700 0.900 0.900 peak 6033 spectrum 1 weight 0.10000E+01 volume 0.24450E-02 ppm1 0.663 ppm2 8.142 CV 1 OR { 6033} ( segid " " and resid 177 and name HD2%) (( segid " " and resid 178 and name HN )) ASSI { 6041} ( segid " " and resid 111 and name HD1%) (( segid " " and resid 110 and name HN )) 3.000 3.000 3.000 peak 6041 spectrum 1 weight 0.10000E+01 volume 0.13003E-02 ppm1 0.469 ppm2 8.525 CV 1 OR { 6041} ( segid " " and resid 111 and name HD1%) (( segid " " and resid 78 and name HN )) ASSI { 6044} ( segid " " and resid 145 and name HE% ) (( segid " " and resid 95 and name HN )) 2.800 2.800 3.200 peak 6044 spectrum 1 weight 0.10000E+01 volume 0.19704E-02 ppm1 0.760 ppm2 7.809 CV 1 OR { 6044} ( segid " " and resid 145 and name HE% ) (( segid " " and resid 148 and name HN )) ASSI { 6115} ( segid " " and resid 44 and name HG1%) (( segid " " and resid 51 and name HN )) 2.600 0.800 0.800 peak 6115 spectrum 1 weight 0.10000E+01 volume 0.31150E-02 ppm1 0.766 ppm2 9.116 CV 1 OR { 6115} ( segid " " and resid 44 and name HG1%) (( segid " " and resid 53 and name HN )) ASSI { 6130} (( segid " " and resid 181 and name HD1 )) (( segid " " and resid 180 and name HA )) 1.800 1.800 4.200 peak 6130 spectrum 1 weight 0.10000E+01 volume 0.22200E-01 ppm1 3.573 ppm2 4.667 CV 1 OR { 6130} (( segid " " and resid 180 and name HD1 )) (( segid " " and resid 179 and name HA )) ASSI { 6145} (( segid " " and resid 181 and name HB1 )) ( segid " " and resid 182 and name HG2%) 2.600 2.600 3.400 peak 6145 spectrum 1 weight 0.10000E+01 volume 0.31585E-02 ppm1 1.789 ppm2 0.877 CV 1 OR { 6145} (( segid " " and resid 181 and name HB1 )) ( segid " " and resid 182 and name HG1%) OR { 6145} (( segid " " and resid 181 and name HB1 )) ( segid " " and resid 176 and name HG1%) ASSI { 6250} (( segid " " and resid 2 and name HG1 )) ( segid " " and resid 51 and name HG2%) 2.300 0.700 0.700 peak 6250 spectrum 1 weight 0.10000E+01 volume 0.54621E-02 ppm1 2.193 ppm2 0.772 CV 1 OR { 6250} (( segid " " and resid 2 and name HG1 )) ( segid " " and resid 4 and name HD1%) OR { 6250} (( segid " " and resid 2 and name HG1 )) ( segid " " and resid 173 and name HG2%) ASSI { 6254} (( segid " " and resid 2 and name HG2 )) ( segid " " and resid 51 and name HG2%) 2.300 0.700 0.700 peak 6254 spectrum 1 weight 0.10000E+01 volume 0.61721E-02 ppm1 2.249 ppm2 0.763 CV 1 OR { 6254} (( segid " " and resid 2 and name HG2 )) ( segid " " and resid 173 and name HG2%) OR { 6254} (( segid " " and resid 2 and name HG2 )) ( segid " " and resid 51 and name HG1%) ASSI { 6262} (( segid " " and resid 1 and name HB1 )) ( segid " " and resid 51 and name HG2%) 2.500 2.500 3.500 peak 6262 spectrum 1 weight 0.10000E+01 volume 0.33650E-02 ppm1 1.870 ppm2 0.810 CV 1 OR { 6262} (( segid " " and resid 1 and name HB2 )) ( segid " " and resid 51 and name HG2%) OR { 6262} (( segid " " and resid 1 and name HB1 )) ( segid " " and resid 173 and name HD1%) OR { 6262} (( segid " " and resid 1 and name HB2 )) ( segid " " and resid 173 and name HD1%) OR { 6262} (( segid " " and resid 1 and name HB1 )) ( segid " " and resid 44 and name HG2%) ASSI { 6263} (( segid " " and resid 1 and name HG2 )) ( segid " " and resid 51 and name HG2%) 2.600 2.600 3.400 peak 6263 spectrum 1 weight 0.10000E+01 volume 0.30897E-02 ppm1 2.356 ppm2 0.797 CV 1 OR { 6263} (( segid " " and resid 1 and name HG2 )) ( segid " " and resid 44 and name HG1%) OR { 6263} (( segid " " and resid 1 and name HG2 )) ( segid " " and resid 173 and name HD1%) ASSI { 6281} ( segid " " and resid 169 and name HE% ) ( segid " " and resid 20 and name HD1%) 2.700 0.900 0.900 peak 6281 spectrum 1 weight 0.10000E+01 volume 0.21226E-02 ppm1 6.600 ppm2 0.797 CV 1 OR { 6281} ( segid " " and resid 169 and name HE% ) ( segid " " and resid 53 and name HD1%) OR { 6281} ( segid " " and resid 169 and name HE% ) ( segid " " and resid 20 and name HD2%) ASSI { 6309} ( segid " " and resid 165 and name HD2%) ( segid " " and resid 23 and name HD% ) 2.900 2.900 3.100 peak 6309 spectrum 1 weight 0.10000E+01 volume 0.14851E-02 ppm1 1.052 ppm2 6.265 CV 1 OR { 6309} ( segid " " and resid 165 and name HD2%) (( segid " " and resid 169 and name HN )) ASSI { 6355} ( segid " " and resid 146 and name HB% ) (( segid " " and resid 112 and name HN )) 2.900 2.900 3.100 peak 6355 spectrum 1 weight 0.10000E+01 volume 0.13655E-02 ppm1 1.385 ppm2 8.292 CV 1 OR { 6355} ( segid " " and resid 146 and name HB% ) (( segid " " and resid 155 and name HN )) ASSI { 6390} (( segid " " and resid 132 and name HB1 )) (( segid " " and resid 132 and name HN )) 2.900 1.000 1.000 peak 6390 spectrum 1 weight 0.10000E+01 volume 0.14959E-02 ppm1 2.113 ppm2 7.223 CV 1 OR { 6390} (( segid " " and resid 176 and name HB )) (( segid " " and resid 176 and name HN )) ASSI { 6421} (( segid " " and resid 123 and name HA )) (( segid " " and resid 126 and name HN )) 3.000 1.200 1.200 peak 6421 spectrum 1 weight 0.10000E+01 volume 0.10939E-02 ppm1 3.802 ppm2 8.447 CV 1 OR { 6421} (( segid " " and resid 123 and name HA )) (( segid " " and resid 124 and name HN )) ASSI { 6484} (( segid " " and resid 45 and name HG1 )) (( segid " " and resid 48 and name HN )) 2.700 2.700 3.300 peak 6484 spectrum 1 weight 0.10000E+01 volume 0.25210E-02 ppm1 2.234 ppm2 8.411 CV 1 OR { 6484} (( segid " " and resid 45 and name HG1 )) (( segid " " and resid 45 and name HN )) ASSI { 6506} (( segid " " and resid 26 and name HB1 )) (( segid " " and resid 26 and name HN )) 2.700 0.900 0.900 peak 6506 spectrum 1 weight 0.10000E+01 volume 0.22203E-02 ppm1 2.800 ppm2 7.568 CV 1 OR { 6506} (( segid " " and resid 26 and name HB1 )) (( segid " " and resid 27 and name HN )) ASSI { 6565} ( segid " " and resid 1 and name HE% ) (( segid " " and resid 53 and name HN )) 2.700 0.900 0.900 peak 6565 spectrum 1 weight 0.10000E+01 volume 0.21117E-02 ppm1 1.872 ppm2 9.114 CV 1 OR { 6565} ( segid " " and resid 1 and name HE% ) (( segid " " and resid 51 and name HN )) ASSI { 6580} ( segid " " and resid 23 and name HE% ) ( segid " " and resid 53 and name HD1%) 2.900 1.100 1.100 peak 6580 spectrum 1 weight 0.10000E+01 volume 0.14815E-02 ppm1 6.236 ppm2 0.805 CV 1 OR { 6580} ( segid " " and resid 23 and name HE% ) ( segid " " and resid 55 and name HD2%) OR { 6580} ( segid " " and resid 23 and name HE% ) ( segid " " and resid 44 and name HG2%) ASSI { 6581} ( segid " " and resid 23 and name HE% ) ( segid " " and resid 24 and name HG2%) 3.200 1.300 1.300 peak 6581 spectrum 1 weight 0.10000E+01 volume 0.81135E-03 ppm1 6.241 ppm2 1.015 CV 1 OR { 6581} ( segid " " and resid 23 and name HE% ) ( segid " " and resid 165 and name HD1%) ASSI { 6585} ( segid " " and resid 40 and name HD% ) ( segid " " and resid 55 and name HD2%) 2.500 0.800 0.800 peak 6585 spectrum 1 weight 0.10000E+01 volume 0.33142E-02 ppm1 6.831 ppm2 0.822 CV 1 OR { 6585} ( segid " " and resid 40 and name HD% ) ( segid " " and resid 20 and name HD2%) ASSI { 6587} ( segid " " and resid 40 and name HE% ) ( segid " " and resid 20 and name HD2%) 2.600 0.800 0.800 peak 6587 spectrum 1 weight 0.10000E+01 volume 0.30280E-02 ppm1 6.538 ppm2 0.820 CV 1 OR { 6587} ( segid " " and resid 154 and name HE% ) ( segid " " and resid 143 and name HD1%) OR { 6587} ( segid " " and resid 40 and name HE% ) ( segid " " and resid 55 and name HD2%) OR { 6587} ( segid " " and resid 40 and name HE% ) ( segid " " and resid 20 and name HD1%) OR { 6587} ( segid " " and resid 154 and name HE% ) ( segid " " and resid 112 and name HD1%) ASSI { 6749} ( segid " " and resid 64 and name HE% ) (( segid " " and resid 67 and name HB2 )) 3.000 1.100 1.100 peak 6749 spectrum 1 weight 0.10000E+01 volume 0.11989E-02 ppm1 6.783 ppm2 1.619 CV 1 OR { 6749} ( segid " " and resid 64 and name HE% ) (( segid " " and resid 67 and name HB1 )) OR { 6749} ( segid " " and resid 64 and name HE% ) (( segid " " and resid 1140 and name HG2 )) ASSI {10565} (( segid " " and resid 175 and name HA )) (( segid " " and resid 77 and name HB )) 3.200 3.200 2.800 peak 10565 spectrum 1 weight 0.10000E+01 volume 0.82946E-03 ppm1 3.972 ppm2 2.082 CV 1 OR {10565} (( segid " " and resid 175 and name HA )) (( segid " " and resid 176 and name HB )) ASSI {10566} ( segid " " and resid 144 and name HB% ) (( segid " " and resid 146 and name HN )) 2.600 2.600 3.400 peak 10566 spectrum 1 weight 0.10000E+01 volume 0.29919E-02 ppm1 1.369 ppm2 8.137 CV 1 OR {10566} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 177 and name HN )) ASSI {10578} ( segid " " and resid 169 and name HE% ) (( segid " " and resid 168 and name HB )) 3.100 1.200 1.200 peak 10578 spectrum 1 weight 0.10000E+01 volume 0.10504E-02 ppm1 6.594 ppm2 1.717 CV 1 OR {10578} ( segid " " and resid 169 and name HE% ) (( segid " " and resid 19 and name HB1 )) ASSI {10585} (( segid " " and resid 166 and name HE2 )) ( segid " " and resid 44 and name HG2%) 2.500 2.500 3.500 peak 10585 spectrum 1 weight 0.10000E+01 volume 0.32925E-02 ppm1 3.060 ppm2 0.814 CV 1 OR {10585} (( segid " " and resid 166 and name HE1 )) ( segid " " and resid 44 and name HG2%) OR {10585} (( segid " " and resid 166 and name HE2 )) ( segid " " and resid 46 and name HG2%) OR {10585} (( segid " " and resid 166 and name HE2 )) ( segid " " and resid 173 and name HD1%) ASSI {10642} (( segid " " and resid 123 and name HE1 )) ( segid " " and resid 126 and name HD1%) 2.000 0.500 0.500 peak 10642 spectrum 1 weight 0.10000E+01 volume 0.13377E-01 ppm1 2.935 ppm2 0.751 CV 1 OR {10642} (( segid " " and resid 132 and name HE2 )) ( segid " " and resid 129 and name HD2%) OR {10642} (( segid " " and resid 132 and name HE1 )) ( segid " " and resid 129 and name HD2%) OR {10642} (( segid " " and resid 49 and name HE2 )) ( segid " " and resid 46 and name HG1%) ASSI {10666} ( segid " " and resid 90 and name HE% ) ( segid " " and resid 80 and name HG2%) 3.000 3.000 3.000 peak 10666 spectrum 1 weight 0.10000E+01 volume 0.12568E-02 ppm1 6.655 ppm2 0.831 CV 1 OR {10666} ( segid " " and resid 90 and name HE% ) ( segid " " and resid 93 and name HG1%) ASSI {10687} (( segid " " and resid 47 and name HA )) ( segid " " and resid 46 and name HG2%) 2.700 2.700 3.300 peak 10687 spectrum 1 weight 0.10000E+01 volume 0.21877E-02 ppm1 4.130 ppm2 0.789 CV 1 OR {10687} (( segid " " and resid 47 and name HA )) ( segid " " and resid 51 and name HG2%) OR {10687} (( segid " " and resid 47 and name HA )) ( segid " " and resid 44 and name HG2%) OR {10687} (( segid " " and resid 47 and name HA )) ( segid " " and resid 173 and name HG2%) ASSI {10695} ( segid " " and resid 20 and name HD1%) ( segid " " and resid 169 and name HE% ) 2.600 0.900 0.900 peak 10695 spectrum 1 weight 0.10000E+01 volume 0.25790E-02 ppm1 0.772 ppm2 6.574 CV 1 OR {10695} ( segid " " and resid 20 and name HD2%) ( segid " " and resid 169 and name HE% ) OR {10695} ( segid " " and resid 20 and name HD2%) ( segid " " and resid 40 and name HE% ) ASSI {10705} ( segid " " and resid 4 and name HD1%) (( segid " " and resid 2 and name HB1 )) 2.500 2.500 3.500 peak 10705 spectrum 1 weight 0.10000E+01 volume 0.32816E-02 ppm1 0.738 ppm2 1.934 CV 1 OR {10705} ( segid " " and resid 4 and name HD1%) (( segid " " and resid 173 and name HB )) OR {10705} ( segid " " and resid 4 and name HD1%) (( segid " " and resid 182 and name HB )) ASSI {10713} ( segid " " and resid 1 and name HE% ) ( segid " " and resid 51 and name HG2%) 2.000 2.000 4.000 peak 10713 spectrum 1 weight 0.10000E+01 volume 0.15705E-01 ppm1 1.877 ppm2 0.831 CV 1 OR {10713} ( segid " " and resid 1 and name HE% ) ( segid " " and resid 44 and name HG2%) OR {10713} ( segid " " and resid 1 and name HE% ) ( segid " " and resid 173 and name HD1%) ASSI {10815} ( segid " " and resid 98 and name HD% ) (( segid " " and resid 101 and name HB )) 3.200 1.300 1.300 peak 10815 spectrum 1 weight 0.10000E+01 volume 0.87655E-03 ppm1 6.862 ppm2 1.378 CV 1 OR {10815} ( segid " " and resid 98 and name HD% ) (( segid " " and resid 94 and name HG2 )) OR {10815} ( segid " " and resid 98 and name HD% ) (( segid " " and resid 94 and name HG1 )) ASSI {10876} ( segid " " and resid 182 and name HG1%) (( segid " " and resid 183 and name HA )) 2.700 0.900 0.900 peak 10876 spectrum 1 weight 0.10000E+01 volume 0.24847E-02 ppm1 0.850 ppm2 4.252 CV 1 OR {10876} ( segid " " and resid 182 and name HG1%) (( segid " " and resid 108 and name HB )) ASSI {10883} (( segid " " and resid 181 and name HA )) ( segid " " and resid 182 and name HG2%) 2.400 0.700 0.700 peak 10883 spectrum 1 weight 0.10000E+01 volume 0.42704E-02 ppm1 4.374 ppm2 0.898 CV 1 OR {10883} (( segid " " and resid 181 and name HA )) ( segid " " and resid 176 and name HG1%) ASSI {10909} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 175 and name HA )) 1.800 0.400 0.400 peak 10909 spectrum 1 weight 0.10000E+01 volume 0.22635E-01 ppm1 1.367 ppm2 3.964 CV 1 OR {10909} ( segid " " and resid 144 and name HB% ) (( segid " " and resid 144 and name HA )) ASSI {10935} ( segid " " and resid 84 and name HD2%) (( segid " " and resid 120 and name HB1 )) 2.700 2.700 3.300 peak 10935 spectrum 1 weight 0.10000E+01 volume 0.24123E-02 ppm1 0.991 ppm2 1.574 CV 1 OR {10935} ( segid " " and resid 84 and name HD2%) (( segid " " and resid 112 and name HB1 )) OR {10935} ( segid " " and resid 84 and name HD2%) (( segid " " and resid 136 and name HB1 )) OR {10935} ( segid " " and resid 84 and name HD2%) (( segid " " and resid 80 and name HB )) ASSI {10944} (( segid " " and resid 181 and name HB2 )) ( segid " " and resid 182 and name HG2%) 2.800 1.000 1.000 peak 10944 spectrum 1 weight 0.10000E+01 volume 0.17857E-02 ppm1 2.200 ppm2 0.872 CV 1 OR {10944} (( segid " " and resid 181 and name HB2 )) ( segid " " and resid 176 and name HG1%) OR {10944} (( segid " " and resid 181 and name HB2 )) ( segid " " and resid 176 and name HG2%) ASSI {10949} ( segid " " and resid 192 and name HD1%) (( segid " " and resid 1167 and name HB2 )) 2.600 0.900 0.900 peak 10949 spectrum 1 weight 0.10000E+01 volume 0.26731E-02 ppm1 0.760 ppm2 2.329 CV 1 OR {10949} ( segid " " and resid 192 and name HD1%) (( segid " " and resid 1168 and name HG1 )) OR {10949} ( segid " " and resid 192 and name HD1%) (( segid " " and resid 1167 and name HG1 )) ASSI {10962} (( segid " " and resid 132 and name HE1 )) ( segid " " and resid 134 and name HD1%) 2.000 0.500 0.500 peak 10962 spectrum 1 weight 0.10000E+01 volume 0.14094E-01 ppm1 2.927 ppm2 0.866 CV 1 OR {10962} (( segid " " and resid 123 and name HE1 )) ( segid " " and resid 126 and name HG2%) ASSI {10968} (( segid " " and resid 132 and name HE1 )) (( segid " " and resid 133 and name HN )) 2.500 2.500 3.500 peak 10968 spectrum 1 weight 0.10000E+01 volume 0.37996E-02 ppm1 2.929 ppm2 8.012 CV 1 OR {10968} (( segid " " and resid 133 and name HE2 )) (( segid " " and resid 133 and name HN )) OR {10968} (( segid " " and resid 133 and name HE1 )) (( segid " " and resid 133 and name HN )) OR {10968} (( segid " " and resid 132 and name HE2 )) (( segid " " and resid 128 and name HN )) OR {10968} (( segid " " and resid 123 and name HE1 )) (( segid " " and resid 125 and name HN )) OR {10968} (( segid " " and resid 132 and name HE2 )) (( segid " " and resid 133 and name HN )) ASSI {10969} (( segid " " and resid 123 and name HE1 )) (( segid " " and resid 126 and name HN )) 2.600 2.600 3.400 peak 10969 spectrum 1 weight 0.10000E+01 volume 0.27527E-02 ppm1 2.922 ppm2 8.473 CV 1 OR {10969} (( segid " " and resid 123 and name HE1 )) (( segid " " and resid 124 and name HN )) OR {10969} (( segid " " and resid 123 and name HE2 )) (( segid " " and resid 126 and name HN )) ASSI {10972} (( segid " " and resid 181 and name HD2 )) ( segid " " and resid 182 and name HG2%) 2.900 2.900 3.100 peak 10972 spectrum 1 weight 0.10000E+01 volume 0.14126E-02 ppm1 3.752 ppm2 0.851 CV 1 OR {10972} (( segid " " and resid 181 and name HD2 )) ( segid " " and resid 176 and name HG1%) OR {10972} (( segid " " and resid 181 and name HD2 )) ( segid " " and resid 176 and name HG2%) ASSI {10974} (( segid " " and resid 181 and name HD1 )) (( segid " " and resid 181 and name HG2 )) 1.800 0.400 0.400 peak 10974 spectrum 1 weight 0.10000E+01 volume 0.27104E-01 ppm1 3.569 ppm2 1.976 CV 1 OR {10974} (( segid " " and resid 180 and name HD1 )) (( segid " " and resid 180 and name HG1 )) OR {10974} (( segid " " and resid 181 and name HD1 )) (( segid " " and resid 181 and name HG1 )) ASSI {10977} (( segid " " and resid 179 and name HB2 )) (( segid " " and resid 180 and name HD1 )) 2.000 0.500 0.500 peak 10977 spectrum 1 weight 0.10000E+01 volume 0.13253E-01 ppm1 2.293 ppm2 3.592 CV 1 OR {10977} (( segid " " and resid 180 and name HB2 )) (( segid " " and resid 181 and name HD1 )) ASSI {10978} (( segid " " and resid 179 and name HB2 )) (( segid " " and resid 180 and name HD2 )) 2.200 2.200 3.800 peak 10978 spectrum 1 weight 0.10000E+01 volume 0.77622E-02 ppm1 2.292 ppm2 3.831 CV 1 OR {10978} (( segid " " and resid 179 and name HB2 )) (( segid " " and resid 109 and name HD1 )) OR {10978} (( segid " " and resid 180 and name HB2 )) (( segid " " and resid 180 and name HD2 )) ASSI {10989} (( segid " " and resid 179 and name HB2 )) (( segid " " and resid 179 and name HB1 )) 1.600 0.300 0.600 peak 10989 spectrum 1 weight 0.10000E+01 volume 0.60399E-01 ppm1 2.292 ppm2 1.866 CV 1 OR {10989} (( segid " " and resid 180 and name HB2 )) (( segid " " and resid 180 and name HB1 )) ASSI {10991} ( segid " " and resid 144 and name HB% ) (( segid " " and resid 147 and name HB2 )) 2.400 2.400 3.600 peak 10991 spectrum 1 weight 0.10000E+01 volume 0.52050E-02 ppm1 1.366 ppm2 1.800 CV 1 OR {10991} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 111 and name HB )) ASSI {11089} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 77 and name HB )) 2.400 0.700 0.700 peak 11089 spectrum 1 weight 0.10000E+01 volume 0.41690E-02 ppm1 1.361 ppm2 2.048 CV 1 OR {11089} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 152 and name HB )) ASSI {11102} (( segid " " and resid 174 and name HA )) ( segid " " and resid 173 and name HG2%) 2.800 1.000 1.000 peak 11102 spectrum 1 weight 0.10000E+01 volume 0.16770E-02 ppm1 3.690 ppm2 0.723 CV 1 OR {11102} (( segid " " and resid 174 and name HA )) ( segid " " and resid 46 and name HG1%) ASSI {11118} (( segid " " and resid 173 and name HB )) ( segid " " and resid 173 and name HD1%) 2.500 0.800 0.800 peak 11118 spectrum 1 weight 0.10000E+01 volume 0.35170E-02 ppm1 1.959 ppm2 0.798 CV 1 OR {11118} (( segid " " and resid 173 and name HB )) ( segid " " and resid 46 and name HG2%) ASSI {11119} (( segid " " and resid 173 and name HB )) (( segid " " and resid 46 and name HB )) 3.100 1.200 1.200 peak 11119 spectrum 1 weight 0.10000E+01 volume 0.10396E-02 ppm1 1.956 ppm2 1.716 CV 1 OR {11119} (( segid " " and resid 173 and name HB )) (( segid " " and resid 174 and name HB1 )) OR {11119} (( segid " " and resid 173 and name HB )) (( segid " " and resid 174 and name HB2 )) ASSI {11125} (( segid " " and resid 2 and name HB1 )) (( segid " " and resid 4 and name HG12)) 2.900 2.900 3.100 peak 11125 spectrum 1 weight 0.10000E+01 volume 0.14597E-02 ppm1 1.880 ppm2 1.389 CV 1 OR {11125} (( segid " " and resid 2 and name HB1 )) ( segid " " and resid 3 and name HB% ) ASSI {11128} ( segid " " and resid 173 and name HG2%) (( segid " " and resid 172 and name HA )) 3.000 3.000 3.000 peak 11128 spectrum 1 weight 0.10000E+01 volume 0.11518E-02 ppm1 0.748 ppm2 3.735 CV 1 OR {11128} ( segid " " and resid 173 and name HG2%) (( segid " " and resid 176 and name HA )) ASSI {11131} ( segid " " and resid 45 and name HE% ) ( segid " " and resid 46 and name HG2%) 2.100 2.100 3.900 peak 11131 spectrum 1 weight 0.10000E+01 volume 0.10135E-01 ppm1 1.749 ppm2 0.817 CV 1 OR {11131} ( segid " " and resid 45 and name HE% ) ( segid " " and resid 51 and name HG2%) OR {11131} ( segid " " and resid 45 and name HE% ) ( segid " " and resid 44 and name HG2%) ASSI {11143} ( segid " " and resid 113 and name HG2%) ( segid " " and resid 165 and name HD2%) 2.800 2.800 3.200 peak 11143 spectrum 1 weight 0.10000E+01 volume 0.20066E-02 ppm1 0.491 ppm2 1.039 CV 1 OR {11143} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 111 and name HG11)) OR {11143} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 155 and name HB1 )) OR {11143} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 111 and name HG12)) OR {11143} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 6 and name HG )) ASSI {11145} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 79 and name HG )) 2.600 0.900 0.900 peak 11145 spectrum 1 weight 0.10000E+01 volume 0.26079E-02 ppm1 0.484 ppm2 1.214 CV 1 OR {11145} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 155 and name HG )) OR {11145} ( segid " " and resid 113 and name HG2%) ( segid " " and resid 112 and name HD2%) OR {11145} ( segid " " and resid 113 and name HG2%) ( segid " " and resid 172 and name HB% ) ASSI {11151} ( segid " " and resid 149 and name HD1%) ( segid " " and resid 151 and name HB% ) 2.300 0.700 0.700 peak 11151 spectrum 1 weight 0.10000E+01 volume 0.59149E-02 ppm1 0.496 ppm2 1.216 CV 1 OR {11151} ( segid " " and resid 149 and name HD1%) (( segid " " and resid 149 and name HG12)) ASSI {11152} ( segid " " and resid 111 and name HG2%) (( segid " " and resid 112 and name HB2 )) 2.900 1.000 1.000 peak 11152 spectrum 1 weight 0.10000E+01 volume 0.14851E-02 ppm1 0.490 ppm2 2.030 CV 1 OR {11152} ( segid " " and resid 111 and name HG2%) (( segid " " and resid 171 and name HB2 )) ASSI {11155} ( segid " " and resid 79 and name HD2%) (( segid " " and resid 79 and name HG )) 2.200 0.600 0.600 peak 11155 spectrum 1 weight 0.10000E+01 volume 0.73383E-02 ppm1 0.277 ppm2 1.236 CV 1 OR {11155} ( segid " " and resid 79 and name HD2%) ( segid " " and resid 172 and name HB% ) ASSI {11157} ( segid " " and resid 80 and name HG2%) ( segid " " and resid 112 and name HD2%) 2.500 0.800 0.800 peak 11157 spectrum 1 weight 0.10000E+01 volume 0.37308E-02 ppm1 0.799 ppm2 1.220 CV 1 OR {11157} ( segid " " and resid 80 and name HG2%) ( segid " " and resid 93 and name HG2%) ASSI {11161} ( segid " " and resid 172 and name HB% ) (( segid " " and resid 173 and name HB )) 2.900 1.100 1.100 peak 11161 spectrum 1 weight 0.10000E+01 volume 0.13366E-02 ppm1 1.235 ppm2 1.988 CV 1 OR {11161} ( segid " " and resid 172 and name HB% ) (( segid " " and resid 171 and name HB2 )) ASSI {11171} (( segid " " and resid 169 and name HA )) ( segid " " and resid 173 and name HD1%) 3.000 1.100 1.100 peak 11171 spectrum 1 weight 0.10000E+01 volume 0.12931E-02 ppm1 3.668 ppm2 0.839 CV 1 OR {11171} (( segid " " and resid 169 and name HA )) ( segid " " and resid 44 and name HG2%) OR {11171} (( segid " " and resid 169 and name HA )) ( segid " " and resid 46 and name HG2%) ASSI {11195} (( segid " " and resid 168 and name HA )) ( segid " " and resid 155 and name HD2%) 2.900 1.100 1.100 peak 11195 spectrum 1 weight 0.10000E+01 volume 0.13692E-02 ppm1 3.023 ppm2 0.745 CV 1 OR {11195} (( segid " " and resid 168 and name HA )) ( segid " " and resid 168 and name HG2%) ASSI {11197} (( segid " " and resid 168 and name HA )) ( segid " " and resid 167 and name HG2%) 3.100 1.200 1.200 peak 11197 spectrum 1 weight 0.10000E+01 volume 0.90915E-03 ppm1 3.029 ppm2 1.263 CV 1 OR {11197} (( segid " " and resid 168 and name HA )) ( segid " " and resid 172 and name HB% ) ASSI {11199} (( segid " " and resid 140 and name HB1 )) ( segid " " and resid 143 and name HD1%) 2.800 1.000 1.000 peak 11199 spectrum 1 weight 0.10000E+01 volume 0.19414E-02 ppm1 1.662 ppm2 0.833 CV 1 OR {11199} (( segid " " and resid 140 and name HB1 )) ( segid " " and resid 143 and name HD2%) OR {11199} (( segid " " and resid 187 and name HB1 )) ( segid " " and resid 1164 and name HD1%) OR {11199} (( segid " " and resid 187 and name HB1 )) ( segid " " and resid 1164 and name HD2%) ASSI {11211} ( segid " " and resid 168 and name HG1%) ( segid " " and resid 165 and name HD2%) 3.000 1.100 1.100 peak 11211 spectrum 1 weight 0.10000E+01 volume 0.11880E-02 ppm1 -0.286 ppm2 1.041 CV 1 OR {11211} ( segid " " and resid 168 and name HG1%) (( segid " " and resid 111 and name HG11)) OR {11211} ( segid " " and resid 168 and name HG1%) (( segid " " and resid 6 and name HG )) ASSI {11219} ( segid " " and resid 165 and name HD2%) (( segid " " and resid 22 and name HB2 )) 2.500 0.800 0.800 peak 11219 spectrum 1 weight 0.10000E+01 volume 0.33650E-02 ppm1 1.055 ppm2 3.895 CV 1 OR {11219} ( segid " " and resid 165 and name HD2%) (( segid " " and resid 162 and name HA )) ASSI {11227} (( segid " " and resid 167 and name HB )) (( segid " " and resid 168 and name HB )) 3.100 3.100 2.900 peak 11227 spectrum 1 weight 0.10000E+01 volume 0.10323E-02 ppm1 3.814 ppm2 1.700 CV 1 OR {11227} (( segid " " and resid 167 and name HB )) (( segid " " and resid 171 and name HB1 )) OR {11227} (( segid " " and resid 167 and name HB )) (( segid " " and resid 166 and name HG2 )) ASSI {11231} ( segid " " and resid 93 and name HG2%) ( segid " " and resid 93 and name HG1%) 1.900 0.400 0.400 peak 11231 spectrum 1 weight 0.10000E+01 volume 0.19111E-01 ppm1 1.224 ppm2 0.800 CV 1 OR {11231} ( segid " " and resid 167 and name HG2%) ( segid " " and resid 155 and name HD2%) ASSI {11234} ( segid " " and resid 167 and name HG2%) (( segid " " and resid 155 and name HB2 )) 2.600 0.800 0.800 peak 11234 spectrum 1 weight 0.10000E+01 volume 0.30027E-02 ppm1 1.224 ppm2 1.577 CV 1 OR {11234} ( segid " " and resid 93 and name HG2%) (( segid " " and resid 80 and name HB )) ASSI {11235} ( segid " " and resid 93 and name HG2%) (( segid " " and resid 94 and name HB1 )) 2.600 0.800 0.800 peak 11235 spectrum 1 weight 0.10000E+01 volume 0.28832E-02 ppm1 1.227 ppm2 1.706 CV 1 OR {11235} ( segid " " and resid 167 and name HG2%) (( segid " " and resid 171 and name HB1 )) ASSI {11582} (( segid " " and resid 165 and name HA )) ( segid " " and resid 19 and name HD2%) 2.800 1.000 1.000 peak 11582 spectrum 1 weight 0.10000E+01 volume 0.17277E-02 ppm1 3.721 ppm2 0.747 CV 1 OR {11582} (( segid " " and resid 165 and name HA )) ( segid " " and resid 155 and name HD2%) ASSI {11592} (( segid " " and resid 165 and name HG )) ( segid " " and resid 23 and name HD% ) 3.100 3.100 2.900 peak 11592 spectrum 1 weight 0.10000E+01 volume 0.10323E-02 ppm1 1.635 ppm2 6.239 CV 1 OR {11592} (( segid " " and resid 165 and name HG )) (( segid " " and resid 169 and name HN )) ASSI {11600} ( segid " " and resid 165 and name HD1%) (( segid " " and resid 162 and name HB2 )) 3.200 1.200 1.200 peak 11600 spectrum 1 weight 0.10000E+01 volume 0.88380E-03 ppm1 0.981 ppm2 2.581 CV 1 OR {11600} ( segid " " and resid 165 and name HD1%) (( segid " " and resid 157 and name HB2 )) ASSI {11601} ( segid " " and resid 165 and name HD1%) (( segid " " and resid 162 and name HA )) 2.400 0.700 0.700 peak 11601 spectrum 1 weight 0.10000E+01 volume 0.42016E-02 ppm1 0.980 ppm2 3.913 CV 1 OR {11601} ( segid " " and resid 165 and name HD1%) (( segid " " and resid 22 and name HB2 )) ASSI {11611} ( segid " " and resid 165 and name HD2%) ( segid " " and resid 159 and name HB% ) 2.200 0.600 0.600 peak 11611 spectrum 1 weight 0.10000E+01 volume 0.80628E-02 ppm1 1.057 ppm2 1.698 CV 1 OR {11611} ( segid " " and resid 165 and name HD2%) (( segid " " and resid 19 and name HG )) OR {11611} ( segid " " and resid 165 and name HD2%) (( segid " " and resid 168 and name HB )) ASSI {11623} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 80 and name HB )) 3.000 1.100 1.100 peak 11623 spectrum 1 weight 0.10000E+01 volume 0.13003E-02 ppm1 0.480 ppm2 1.582 CV 1 OR {11623} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 112 and name HB1 )) OR {11623} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 153 and name HD1 )) ASSI {11624} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 19 and name HG )) 3.000 1.200 1.200 peak 11624 spectrum 1 weight 0.10000E+01 volume 0.10975E-02 ppm1 0.488 ppm2 1.708 CV 1 OR {11624} ( segid " " and resid 113 and name HG2%) (( segid " " and resid 168 and name HB )) ASSI {11626} ( segid " " and resid 117 and name HD1%) (( segid " " and resid 161 and name HG1 )) 2.900 1.100 1.100 peak 11626 spectrum 1 weight 0.10000E+01 volume 0.13475E-02 ppm1 0.474 ppm2 5.190 CV 1 OR {11626} ( segid " " and resid 117 and name HD1%) (( segid " " and resid 157 and name HA )) ASSI {11638} (( segid " " and resid 163 and name HD2 )) (( segid " " and resid 163 and name HG2 )) 1.700 0.400 0.500 peak 11638 spectrum 1 weight 0.10000E+01 volume 0.36503E-01 ppm1 3.121 ppm2 1.579 CV 1 OR {11638} (( segid " " and resid 163 and name HD2 )) (( segid " " and resid 163 and name HG1 )) OR {11638} (( segid " " and resid 187 and name HD2 )) (( segid " " and resid 187 and name HG1 )) OR {11638} (( segid " " and resid 187 and name HD1 )) (( segid " " and resid 187 and name HG1 )) OR {11638} (( segid " " and resid 187 and name HD2 )) (( segid " " and resid 187 and name HG2 )) ASSI {11682} ( segid " " and resid 160 and name HD2%) (( segid " " and resid 160 and name HB2 )) 2.200 0.600 0.600 peak 11682 spectrum 1 weight 0.10000E+01 volume 0.86532E-02 ppm1 0.438 ppm2 1.085 CV 1 OR {11682} ( segid " " and resid 160 and name HD2%) ( segid " " and resid 161 and name HG2%) ASSI {11686} (( segid " " and resid 159 and name HA )) (( segid " " and resid 22 and name HB2 )) 3.200 1.300 1.300 peak 11686 spectrum 1 weight 0.10000E+01 volume 0.83670E-03 ppm1 4.152 ppm2 3.893 CV 1 OR {11686} (( segid " " and resid 159 and name HA )) (( segid " " and resid 162 and name HA )) OR {11686} (( segid " " and resid 159 and name HA )) (( segid " " and resid 22 and name HB1 )) ASSI {11689} ( segid " " and resid 159 and name HB% ) (( segid " " and resid 158 and name HA )) 3.100 1.200 1.200 peak 11689 spectrum 1 weight 0.10000E+01 volume 0.97076E-03 ppm1 1.693 ppm2 5.165 CV 1 OR {11689} ( segid " " and resid 159 and name HB% ) (( segid " " and resid 115 and name HA )) ASSI {11692} ( segid " " and resid 19 and name HD2%) (( segid " " and resid 19 and name HG )) 2.100 0.600 0.600 peak 11692 spectrum 1 weight 0.10000E+01 volume 0.96312E-02 ppm1 0.708 ppm2 1.723 CV 1 OR {11692} ( segid " " and resid 19 and name HD2%) ( segid " " and resid 159 and name HB% ) ASSI {11695} (( segid " " and resid 157 and name HA )) (( segid " " and resid 117 and name HB2 )) 3.100 1.200 1.200 peak 11695 spectrum 1 weight 0.10000E+01 volume 0.92726E-03 ppm1 5.179 ppm2 1.116 CV 1 OR {11695} (( segid " " and resid 157 and name HA )) (( segid " " and resid 157 and name HG )) ASSI {11708} (( segid " " and resid 112 and name HA )) ( segid " " and resid 111 and name HG2%) 2.900 1.100 1.100 peak 11708 spectrum 1 weight 0.10000E+01 volume 0.13619E-02 ppm1 5.139 ppm2 0.508 CV 1 OR {11708} (( segid " " and resid 112 and name HA )) ( segid " " and resid 113 and name HG2%) ASSI {11722} (( segid " " and resid 155 and name HG )) ( segid " " and resid 113 and name HG2%) 2.700 2.700 3.300 peak 11722 spectrum 1 weight 0.10000E+01 volume 0.20501E-02 ppm1 1.176 ppm2 0.512 CV 1 OR {11722} (( segid " " and resid 155 and name HG )) ( segid " " and resid 111 and name HG2%) ASSI {11729} ( segid " " and resid 155 and name HD1%) (( segid " " and resid 153 and name HD2 )) 2.700 0.900 0.900 peak 11729 spectrum 1 weight 0.10000E+01 volume 0.24341E-02 ppm1 0.580 ppm2 1.738 CV 1 OR {11729} ( segid " " and resid 155 and name HD1%) (( segid " " and resid 171 and name HB1 )) OR {11729} ( segid " " and resid 155 and name HD1%) (( segid " " and resid 156 and name HB1 )) ASSI {11749} (( segid " " and resid 153 and name HB1 )) (( segid " " and resid 152 and name HB )) 3.100 1.200 1.200 peak 11749 spectrum 1 weight 0.10000E+01 volume 0.96713E-03 ppm1 1.542 ppm2 2.030 CV 1 OR {11749} (( segid " " and resid 153 and name HB1 )) (( segid " " and resid 171 and name HB2 )) OR {11749} (( segid " " and resid 153 and name HB2 )) (( segid " " and resid 171 and name HB2 )) ASSI {11752} (( segid " " and resid 153 and name HB1 )) ( segid " " and resid 152 and name HG2%) 2.500 0.800 0.800 peak 11752 spectrum 1 weight 0.10000E+01 volume 0.39952E-02 ppm1 1.543 ppm2 1.024 CV 1 OR {11752} (( segid " " and resid 153 and name HB2 )) ( segid " " and resid 152 and name HG2%) OR {11752} (( segid " " and resid 153 and name HB1 )) (( segid " " and resid 111 and name HG11)) ASSI {11768} (( segid " " and resid 153 and name HD2 )) (( segid " " and resid 155 and name HB1 )) 2.700 0.900 0.900 peak 11768 spectrum 1 weight 0.10000E+01 volume 0.20900E-02 ppm1 1.716 ppm2 1.019 CV 1 OR {11768} (( segid " " and resid 153 and name HD2 )) (( segid " " and resid 111 and name HG11)) OR {11768} (( segid " " and resid 153 and name HD2 )) ( segid " " and resid 152 and name HG2%) ASSI {11779} (( segid " " and resid 152 and name HA )) ( segid " " and resid 175 and name HB% ) 3.100 3.100 2.900 peak 11779 spectrum 1 weight 0.10000E+01 volume 0.90552E-03 ppm1 3.835 ppm2 1.359 CV 1 OR {11779} (( segid " " and resid 152 and name HA )) ( segid " " and resid 146 and name HB% ) ASSI {11818} ( segid " " and resid 151 and name HB% ) ( segid " " and resid 146 and name HB% ) 2.300 0.600 0.600 peak 11818 spectrum 1 weight 0.10000E+01 volume 0.63495E-02 ppm1 1.193 ppm2 1.404 CV 1 OR {11818} ( segid " " and resid 151 and name HB% ) (( segid " " and resid 110 and name HG11)) ASSI {11820} ( segid " " and resid 151 and name HB% ) ( segid " " and resid 112 and name HD1%) 2.400 0.700 0.700 peak 11820 spectrum 1 weight 0.10000E+01 volume 0.50094E-02 ppm1 1.196 ppm2 0.798 CV 1 OR {11820} ( segid " " and resid 151 and name HB% ) ( segid " " and resid 110 and name HD1%) ASSI {11840} ( segid " " and resid 70 and name HD2%) ( segid " " and resid 1169 and name HE% ) 2.100 0.500 0.500 peak 11840 spectrum 1 weight 0.10000E+01 volume 0.10638E-01 ppm1 0.885 ppm2 2.004 CV 1 OR {11840} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1148 and name HB2 )) OR {11840} ( segid " " and resid 70 and name HD2%) (( segid " " and resid 1148 and name HB1 )) ASSI {11844} ( segid " " and resid 149 and name HG2%) (( segid " " and resid 148 and name HA )) 3.100 3.100 2.900 peak 11844 spectrum 1 weight 0.10000E+01 volume 0.10396E-02 ppm1 0.221 ppm2 3.792 CV 1 OR {11844} ( segid " " and resid 149 and name HG2%) (( segid " " and resid 150 and name HA2 )) ASSI {11855} ( segid " " and resid 149 and name HD1%) (( segid " " and resid 110 and name HG11)) 2.700 0.900 0.900 peak 11855 spectrum 1 weight 0.10000E+01 volume 0.21262E-02 ppm1 0.494 ppm2 1.404 CV 1 OR {11855} ( segid " " and resid 149 and name HD1%) (( segid " " and resid 110 and name HB )) OR {11855} ( segid " " and resid 149 and name HD1%) ( segid " " and resid 146 and name HB% ) ASSI {11856} ( segid " " and resid 149 and name HD1%) ( segid " " and resid 112 and name HD1%) 2.100 0.600 0.600 peak 11856 spectrum 1 weight 0.10000E+01 volume 0.96061E-02 ppm1 0.494 ppm2 0.808 CV 1 OR {11856} ( segid " " and resid 149 and name HD1%) ( segid " " and resid 110 and name HD1%) ASSI {11880} ( segid " " and resid 3 and name HB% ) ( segid " " and resid 4 and name HD1%) 2.300 2.300 3.700 peak 11880 spectrum 1 weight 0.10000E+01 volume 0.54404E-02 ppm1 1.368 ppm2 0.752 CV 1 OR {11880} ( segid " " and resid 3 and name HB% ) ( segid " " and resid 51 and name HG1%) OR {11880} ( segid " " and resid 3 and name HB% ) ( segid " " and resid 173 and name HG2%) ASSI {11887} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 174 and name HN )) 3.200 1.300 1.300 peak 11887 spectrum 1 weight 0.10000E+01 volume 0.76065E-03 ppm1 1.360 ppm2 8.455 CV 1 OR {11887} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 78 and name HN )) ASSI {11888} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 77 and name HA )) 3.200 1.300 1.300 peak 11888 spectrum 1 weight 0.10000E+01 volume 0.85844E-03 ppm1 1.359 ppm2 4.471 CV 1 OR {11888} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 109 and name HA )) ASSI {11889} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 6 and name HB2 )) 3.000 3.000 3.000 peak 11889 spectrum 1 weight 0.10000E+01 volume 0.13184E-02 ppm1 1.371 ppm2 2.862 CV 1 OR {11889} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 153 and name HE2 )) OR {11889} ( segid " " and resid 175 and name HB% ) (( segid " " and resid 178 and name HB2 )) ASSI {11890} (( segid " " and resid 143 and name HA )) (( segid " " and resid 143 and name HB2 )) 2.800 1.000 1.000 peak 11890 spectrum 1 weight 0.10000E+01 volume 0.19740E-02 ppm1 3.388 ppm2 1.362 CV 1 OR {11890} (( segid " " and resid 143 and name HA )) ( segid " " and resid 146 and name HB% ) ASSI {11902} ( segid " " and resid 143 and name HD2%) (( segid " " and resid 146 and name HN )) 2.500 2.500 3.500 peak 11902 spectrum 1 weight 0.10000E+01 volume 0.33069E-02 ppm1 0.849 ppm2 8.088 CV 1 OR {11902} ( segid " " and resid 143 and name HD1%) (( segid " " and resid 142 and name HN )) OR {11902} ( segid " " and resid 143 and name HD1%) (( segid " " and resid 146 and name HN )) ASSI {11918} (( segid " " and resid 136 and name HA )) ( segid " " and resid 85 and name HG2%) 3.000 1.100 1.100 peak 11918 spectrum 1 weight 0.10000E+01 volume 0.12206E-02 ppm1 4.271 ppm2 0.622 CV 1 OR {11918} (( segid " " and resid 136 and name HA )) ( segid " " and resid 129 and name HD1%) ASSI {11921} ( segid " " and resid 138 and name HG2%) (( segid " " and resid 141 and name HA )) 2.500 0.800 0.800 peak 11921 spectrum 1 weight 0.10000E+01 volume 0.35931E-02 ppm1 1.165 ppm2 3.896 CV 1 OR {11921} ( segid " " and resid 138 and name HG2%) (( segid " " and resid 137 and name HA )) ASSI {11926} (( segid " " and resid 19 and name HA )) ( segid " " and resid 159 and name HB% ) 2.700 0.900 0.900 peak 11926 spectrum 1 weight 0.10000E+01 volume 0.22349E-02 ppm1 3.849 ppm2 1.720 CV 1 OR {11926} (( segid " " and resid 19 and name HA )) (( segid " " and resid 19 and name HB1 )) ASSI {11935} (( segid " " and resid 33 and name HG11)) (( segid " " and resid 31 and name HG2 )) 2.900 1.000 1.000 peak 11935 spectrum 1 weight 0.10000E+01 volume 0.15937E-02 ppm1 0.704 ppm2 2.009 CV 1 OR {11935} (( segid " " and resid 137 and name HG11)) (( segid " " and resid 87 and name HG1 )) OR {11935} (( segid " " and resid 33 and name HG11)) (( segid " " and resid 31 and name HG1 )) OR {11935} ( segid " " and resid 19 and name HD2%) (( segid " " and resid 113 and name HB )) ASSI {11960} ( segid " " and resid 137 and name HD1%) ( segid " " and resid 134 and name HD2%) 2.600 2.600 3.400 peak 11960 spectrum 1 weight 0.10000E+01 volume 0.28977E-02 ppm1 0.370 ppm2 0.822 CV 1 OR {11960} ( segid " " and resid 137 and name HD1%) ( segid " " and resid 93 and name HG1%) OR {11960} ( segid " " and resid 137 and name HD1%) ( segid " " and resid 134 and name HD1%) OR {11960} ( segid " " and resid 137 and name HD1%) ( segid " " and resid 80 and name HG2%) ASSI {11970} ( segid " " and resid 135 and name HG2%) (( segid " " and resid 87 and name HG2 )) 2.700 2.700 3.300 peak 11970 spectrum 1 weight 0.10000E+01 volume 0.23761E-02 ppm1 1.097 ppm2 2.190 CV 1 OR {11970} ( segid " " and resid 135 and name HG2%) (( segid " " and resid 136 and name HG1 )) OR {11970} ( segid " " and resid 135 and name HG2%) (( segid " " and resid 136 and name HG2 )) ASSI {11981} (( segid " " and resid 130 and name HD2 )) (( segid " " and resid 131 and name HN )) 2.700 2.700 3.300 peak 11981 spectrum 1 weight 0.10000E+01 volume 0.21769E-02 ppm1 1.646 ppm2 7.755 CV 1 OR {11981} (( segid " " and resid 130 and name HD1 )) (( segid " " and resid 131 and name HN )) OR {11981} (( segid " " and resid 130 and name HD2 )) (( segid " " and resid 135 and name HN )) ASSI {11998} (( segid " " and resid 130 and name HG1 )) (( segid " " and resid 127 and name HG1 )) 2.900 2.900 3.100 peak 11998 spectrum 1 weight 0.10000E+01 volume 0.14669E-02 ppm1 1.408 ppm2 2.321 CV 1 OR {11998} (( segid " " and resid 130 and name HG1 )) (( segid " " and resid 131 and name HG1 )) ASSI {12012} (( segid " " and resid 128 and name HA )) (( segid " " and resid 127 and name HB1 )) 2.300 2.300 3.700 peak 12012 spectrum 1 weight 0.10000E+01 volume 0.58859E-02 ppm1 4.052 ppm2 1.614 CV 1 OR {12012} (( segid " " and resid 128 and name HA )) (( segid " " and resid 132 and name HD1 )) OR {12012} (( segid " " and resid 128 and name HA )) (( segid " " and resid 132 and name HD2 )) OR {12012} (( segid " " and resid 128 and name HA )) (( segid " " and resid 130 and name HG2 )) ASSI {12028} (( segid " " and resid 127 and name HG1 )) (( segid " " and resid 127 and name HB1 )) 2.200 0.600 0.600 peak 12028 spectrum 1 weight 0.10000E+01 volume 0.78490E-02 ppm1 2.289 ppm2 1.631 CV 1 OR {12028} (( segid " " and resid 131 and name HG1 )) (( segid " " and resid 132 and name HD1 )) ASSI {12029} (( segid " " and resid 127 and name HG1 )) (( segid " " and resid 123 and name HG2 )) 2.400 2.400 3.600 peak 12029 spectrum 1 weight 0.10000E+01 volume 0.41836E-02 ppm1 2.287 ppm2 1.450 CV 1 OR {12029} (( segid " " and resid 131 and name HG1 )) (( segid " " and resid 128 and name HG1 )) OR {12029} (( segid " " and resid 127 and name HG1 )) (( segid " " and resid 130 and name HG1 )) ASSI {12037} (( segid " " and resid 131 and name HG2 )) (( segid " " and resid 132 and name HD1 )) 2.400 2.400 3.600 peak 12037 spectrum 1 weight 0.10000E+01 volume 0.40929E-02 ppm1 2.510 ppm2 1.619 CV 1 OR {12037} (( segid " " and resid 131 and name HG2 )) (( segid " " and resid 132 and name HD2 )) OR {12037} (( segid " " and resid 131 and name HG2 )) (( segid " " and resid 130 and name HG2 )) ASSI {12038} (( segid " " and resid 131 and name HG2 )) (( segid " " and resid 128 and name HG1 )) 2.700 2.700 3.300 peak 12038 spectrum 1 weight 0.10000E+01 volume 0.20537E-02 ppm1 2.510 ppm2 1.450 CV 1 OR {12038} (( segid " " and resid 131 and name HG2 )) (( segid " " and resid 130 and name HG1 )) ASSI {12068} (( segid " " and resid 85 and name HB )) ( segid " " and resid 85 and name HG2%) 2.700 0.900 0.900 peak 12068 spectrum 1 weight 0.10000E+01 volume 0.22892E-02 ppm1 2.388 ppm2 0.615 CV 1 OR {12068} (( segid " " and resid 85 and name HB )) ( segid " " and resid 129 and name HD1%) ASSI {12075} ( segid " " and resid 85 and name HG2%) (( segid " " and resid 136 and name HB1 )) 2.900 1.000 1.000 peak 12075 spectrum 1 weight 0.10000E+01 volume 0.15321E-02 ppm1 0.612 ppm2 1.580 CV 1 OR {12075} ( segid " " and resid 85 and name HG2%) (( segid " " and resid 126 and name HG12)) ASSI {12117} ( segid " " and resid 85 and name HG2%) (( segid " " and resid 119 and name HB1 )) 3.100 1.200 1.200 peak 12117 spectrum 1 weight 0.10000E+01 volume 0.94170E-03 ppm1 0.612 ppm2 1.835 CV 1 OR {12117} ( segid " " and resid 85 and name HG2%) (( segid " " and resid 129 and name HB2 )) ASSI {12260} ( segid " " and resid 129 and name HD1%) (( segid " " and resid 87 and name HG1 )) 2.700 2.700 3.300 peak 12260 spectrum 1 weight 0.10000E+01 volume 0.23797E-02 ppm1 0.616 ppm2 2.000 CV 1 OR {12260} ( segid " " and resid 129 and name HD1%) (( segid " " and resid 130 and name HB2 )) OR {12260} ( segid " " and resid 129 and name HD1%) (( segid " " and resid 130 and name HB1 )) ASSI {12267} ( segid " " and resid 125 and name HG2%) ( segid " " and resid 85 and name HG2%) 2.000 0.500 0.500 peak 12267 spectrum 1 weight 0.10000E+01 volume 0.13467E-01 ppm1 1.162 ppm2 0.631 CV 1 OR {12267} ( segid " " and resid 125 and name HG2%) ( segid " " and resid 129 and name HD1%) ASSI {12281} ( segid " " and resid 129 and name HD2%) (( segid " " and resid 129 and name HA )) 2.100 0.500 0.500 peak 12281 spectrum 1 weight 0.10000E+01 volume 0.11123E-01 ppm1 0.763 ppm2 3.956 CV 1 OR {12281} ( segid " " and resid 70 and name HD1%) (( segid " " and resid 70 and name HA )) ASSI {12349} ( segid " " and resid 126 and name HG2%) (( segid " " and resid 130 and name HE2 )) 2.400 0.700 0.700 peak 12349 spectrum 1 weight 0.10000E+01 volume 0.44588E-02 ppm1 0.857 ppm2 2.897 CV 1 OR {12349} ( segid " " and resid 126 and name HG2%) (( segid " " and resid 123 and name HE1 )) ASSI {12352} ( segid " " and resid 126 and name HG2%) (( segid " " and resid 126 and name HG12)) 2.100 0.500 0.500 peak 12352 spectrum 1 weight 0.10000E+01 volume 0.11410E-01 ppm1 0.856 ppm2 1.634 CV 1 OR {12352} ( segid " " and resid 126 and name HG2%) (( segid " " and resid 130 and name HG2 )) OR {12352} ( segid " " and resid 126 and name HG2%) (( segid " " and resid 130 and name HD2 )) ASSI {12361} ( segid " " and resid 126 and name HD1%) (( segid " " and resid 121 and name HB1 )) 2.700 2.700 3.300 peak 12361 spectrum 1 weight 0.10000E+01 volume 0.24956E-02 ppm1 0.738 ppm2 2.408 CV 1 OR {12361} ( segid " " and resid 126 and name HD1%) (( segid " " and resid 127 and name HG2 )) ASSI {12365} (( segid " " and resid 125 and name HA )) (( segid " " and resid 125 and name HN )) 3.100 1.200 1.200 peak 12365 spectrum 1 weight 0.10000E+01 volume 0.96713E-03 ppm1 3.759 ppm2 8.020 CV 1 OR {12365} (( segid " " and resid 125 and name HA )) (( segid " " and resid 128 and name HN )) ASSI {12373} ( segid " " and resid 125 and name HG2%) (( segid " " and resid 125 and name HB )) 2.200 0.600 0.600 peak 12373 spectrum 1 weight 0.10000E+01 volume 0.72514E-02 ppm1 1.146 ppm2 4.557 CV 1 OR {12373} ( segid " " and resid 25 and name HG2%) (( segid " " and resid 25 and name HA )) ASSI {12376} ( segid " " and resid 125 and name HG2%) (( segid " " and resid 126 and name HG12)) 2.500 2.500 3.500 peak 12376 spectrum 1 weight 0.10000E+01 volume 0.38974E-02 ppm1 1.162 ppm2 1.630 CV 1 OR {12376} ( segid " " and resid 125 and name HG2%) (( segid " " and resid 136 and name HB1 )) ASSI {12388} (( segid " " and resid 123 and name HA )) (( segid " " and resid 126 and name HB )) 2.400 0.700 0.700 peak 12388 spectrum 1 weight 0.10000E+01 volume 0.42632E-02 ppm1 3.795 ppm2 1.866 CV 1 OR {12388} (( segid " " and resid 123 and name HA )) (( segid " " and resid 123 and name HB2 )) ASSI {12410} ( segid " " and resid 119 and name HD1%) ( segid " " and resid 84 and name HD1%) 2.600 2.600 3.400 peak 12410 spectrum 1 weight 0.10000E+01 volume 0.29557E-02 ppm1 0.652 ppm2 0.480 CV 1 OR {12410} ( segid " " and resid 119 and name HD1%) ( segid " " and resid 117 and name HD1%) OR {12410} ( segid " " and resid 119 and name HD1%) ( segid " " and resid 160 and name HD2%) ASSI {12412} (( segid " " and resid 117 and name HA )) ( segid " " and resid 117 and name HD1%) 3.000 1.100 1.100 peak 12412 spectrum 1 weight 0.10000E+01 volume 0.12243E-02 ppm1 3.765 ppm2 0.498 CV 1 OR {12412} (( segid " " and resid 117 and name HA )) ( segid " " and resid 84 and name HD1%) ASSI {12419} ( segid " " and resid 117 and name HD1%) (( segid " " and resid 120 and name HB2 )) 3.100 1.200 1.200 peak 12419 spectrum 1 weight 0.10000E+01 volume 0.92001E-03 ppm1 0.480 ppm2 1.971 CV 1 OR {12419} ( segid " " and resid 117 and name HD1%) (( segid " " and resid 156 and name HG1 )) ASSI {12429} ( segid " " and resid 117 and name HD2%) ( segid " " and resid 84 and name HD1%) 2.000 0.500 0.500 peak 12429 spectrum 1 weight 0.10000E+01 volume 0.13496E-01 ppm1 0.704 ppm2 0.516 CV 1 OR {12429} ( segid " " and resid 117 and name HD2%) ( segid " " and resid 117 and name HD1%)
Contact the webmaster for help, if required. Thursday, May 2, 2024 6:27:55 PM GMT (wattos1)