NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
570629 | 2m7c | 19180 | cing | 1-original | 1 | XPLOR/CNS | distance | NOE | simple |
! Start Here d d- d+ # ppm1 ppm2 intens. codes assign (resid 10 and name he# ) (resid 10 and name hd# ) 1.96 0.06 1.02 ! 142 6.76 7.01 6295.83 Se Se Ca Ca assign (resid 10 and name hb* ) (resid 10 and name hd# ) 2.48 0.25 0.65 ! 145 3.11 7 1614.76 Se Ca assign (resid 10 and name hb* ) (resid 10 and name hn ) 2.56 0.29 0.25 ! 144 3.12 8.54 1151.31 assign (resid 10 and name hb* ) (resid 10 and name hn ) 2.7 0.34 0.28 ! 147 3.19 8.54 886.452 assign (resid 10 and name hb* ) (resid 10 and name hd# ) 2.71 0.32 0.69 ! 148 3.18 7 1046.99 Se Ca assign (resid 10 and name ha ) (resid 10 and name hb* ) 2.98 0.43 0.34 ! 135 3.94 3.2 542.666 assign (resid 10 and name ha ) (resid 10 and name hb* ) 2.71 0.37 0.32 ! 134 3.94 3.13 440.941 assign (resid 10 and name ha ) (resid 10 and name hd1 ) 3.12 0.45 0.78 ! 133 3.94 7 525.386 Se Ca assign (resid 10 and name ha ) (resid 10 and name hn ) 3.18 0.49 0.39 ! 132 3.94 8.54 398.851 assign (resid 10 and name hn ) (resid 11 and name hn ) 2.68 0.27 0.24 ! 129 8.53 8.4 1348.55 assign (resid 10 and name hb* ) (resid 11 and name hn ) 2.96 0.42 0.33 ! 149 3.19 8.41 568.624 assign (resid 10 and name hb* ) (resid 11 and name hn ) 3.8 0.69 0.62 ! 146 3.12 8.4 164.882 assign (resid 10 and name ha ) (resid 11 and name hn ) 3.76 0.69 0.64 ! 136 3.94 8.41 109.619 assign (resid 10 and name ha ) (resid 13 and name hb1 ) 3.07 0.42 0.34 ! 139 3.94 3.52 558.972 assign (resid 10 and name ha ) (resid 13 and name hn ) 3.21 0.5 0.4 ! 137 3.94 7.95 380.1 assign (resid 10 and name ha ) (resid 13 and name he3 ) 3.77 0.68 0.8 ! 138 3.94 6.81 173.16 Ss assign (resid 10 and name ha ) (resid 13 and name hb2 ) 3.48 0.68 0.61 ! 140 3.93 3 170.304 assign (resid 10 and name ha ) (resid 14 and name hn ) 3.93 0.73 0.68 ! 141 3.94 8.45 141.399 assign (resid 10 and name ha ) (resid 4 and name hg1 ) 3.05 0.51 0.42 ! 131 3.94 1.78 354.998 assign (resid 10 and name ha ) (resid 4 and name hd2 ) 2.78 0.55 0.45 ! 130 3.94 2.71 296.158 assign (resid 10 and name he1 ) (resid 7 and name hn ) 4.59 0.94 1.31 ! 143 6.76 8.72 65.3547 Ss assign (resid 11 and name hn ) (resid 10 and name hd# ) 3.65 0.62 0.94 ! 150 8.43 7 245.179 Se Ca assign (resid 11 and name ha ) (resid 10 and name hd# ) 4.06 0.75 1.11 ! 151 4.13 7 144.798 Se Ca assign (resid 11 and name ha ) (resid 11 and name hb# ) 2.53 0.18 0.22 ! 153 4.14 1.6 2984.29 C3 assign (resid 11 and name hb# ) (resid 11 and name hn ) 2.86 0.29 0.26 ! 159 1.59 8.41 1630.87 C3 assign (resid 11 and name ha ) (resid 11 and name hn ) 2.87 0.39 0.31 ! 152 4.13 8.41 652.716 assign (resid 11 and name hb# ) (resid 12 and name hn ) 3.12 0.37 0.31 ! 160 1.59 8.15 1070.81 C3 assign (resid 11 and name ha ) (resid 12 and name hn ) 3.55 0.61 0.51 ! 154 4.13 8.15 233.034 assign (resid 11 and name ha ) (resid 14 and name hn ) 3.04 0.45 0.35 ! 155 4.13 8.45 497.507 assign (resid 11 and name ha ) (resid 14 and name hb2 ) 3.72 0.5 0.4 ! 158 4.13 1.73 375.899 assign (resid 11 and name ha ) (resid 14 and name hd1# ) 3.59 0.52 0.41 ! 156 4.13 0.94 535.395 C3 assign (resid 11 and name hb# ) (resid 14 and name hn ) 4.56 0.82 0.74 ! 161 1.59 8.45 166.356 C3 assign (resid 12 and name hn ) (resid 11 and name hn ) 2.89 0.4 0.32 ! 162 8.16 8.41 636.113 assign (resid 12 and name hg# ) (resid 12 and name hb* ) 2.26 0.2 0.2 ! 179 2.4 2.18 2115.24 assign (resid 12 and name hg# ) (resid 12 and name he# ) 2.29 0.21 0.2 ! 178 2.41 8.01 1997.83 D_2 assign (resid 12 and name ha ) (resid 12 and name hb* ) 2.41 0.25 0.22 ! 165 3.96 2.1 1537.36 assign (resid 12 and name ha ) (resid 12 and name hn ) 2.64 0.26 0.23 ! 163 3.96 8.15 1463.62 assign (resid 12 and name hb* ) (resid 12 and name hn ) 2.52 0.28 0.24 ! 174 2.19 8.15 1249.67 assign (resid 12 and name hb* ) (resid 12 and name hn ) 2.62 0.31 0.26 ! 172 2.1 8.15 1023.35 assign (resid 12 and name ha ) (resid 12 and name hb* ) 2.71 0.34 0.28 ! 166 3.97 2.19 866.486 assign (resid 12 and name ha ) (resid 12 and name hg# ) 2.84 0.38 0.31 ! 168 3.96 2.4 689.174 assign (resid 12 and name ha ) (resid 12 and name he# ) 3.54 0.6 0.51 ! 164 3.96 8.01 236.249 D_1 assign (resid 12 and name hg# ) (resid 12 and name hn ) 3.78 0.68 0.61 ! 177 2.4 8.15 169.822 assign (resid 12 and name hb* ) (resid 13 and name hn ) 2.89 0.4 0.32 ! 173 2.1 7.96 637.006 assign (resid 12 and name hb* ) (resid 13 and name hn ) 3.26 0.52 0.42 ! 175 2.19 7.96 352 assign (resid 12 and name ha ) (resid 15 and name hb# ) 2.61 0.18 0.31 ! 170 3.96 1.46 3066.11 C3 assign (resid 12 and name ha ) (resid 15 and name hn ) 3.05 0.45 0.36 ! 169 3.96 7.92 483.675 assign (resid 12 and name ha ) (resid 16 and name hn ) 3.85 0.7 0.64 ! 171 3.96 8.09 155.286 assign (resid 13 and name hn ) (resid 12 and name hn ) 2.47 0.27 0.23 ! 181 7.97 8.15 1356.38 assign (resid 13 and name hz3 ) (resid 13 and name he3 ) 1.8 0 0.54 ! 200 6.88 6.82 9710.9 Ss Ss assign (resid 13 and name hb1 ) (resid 13 and name hn ) 2.33 0.22 0.21 ! 201 3.52 7.96 1832.11 assign (resid 13 and name hh2 ) (resid 13 and name hz3 ) 2.41 0.25 0.62 ! 193 6.54 6.88 1555.03 Ss Ss assign (resid 13 and name hb2 ) (resid 13 and name hn ) 2.5 0.27 0.24 ! 206 3 7.96 1293.1 assign (resid 13 and name hz2 ) (resid 13 and name hh2 ) 2.5 0.27 0.64 ! 197 6.1 6.53 1293.56 Ss Ss assign (resid 13 and name hd1 ) (resid 13 and name he1 ) 2.6 0.31 0.66 ! 191 6.76 9.21 1071.07 Ss Ss assign (resid 13 and name ha ) (resid 13 and name hn ) 2.65 0.32 0.27 ! 183 4.12 7.95 961.804 assign (resid 13 and name hb2 ) (resid 13 and name hd1 ) 2.66 0.32 0.47 ! 207 3 6.75 959.779 Ss assign (resid 13 and name hb1 ) (resid 13 and name he3 ) 2.78 0.36 0.49 ! 203 3.52 6.81 768.251 Ss assign (resid 13 and name ha ) (resid 13 and name hb2 ) 2.82 0.38 0.3 ! 186 4.12 3 719.105 assign (resid 13 and name ha ) (resid 13 and name hd1 ) 2.92 0.41 0.53 ! 184 4.12 6.75 602.17 Ss assign (resid 13 and name ha ) (resid 13 and name hb1 ) 3.04 0.45 0.36 ! 185 4.14 3.54 493.644 assign (resid 13 and name hz2 ) (resid 13 and name he1 ) 3.11 0.47 0.77 ! 196 6.1 9.21 440.451 Ss Ss assign (resid 13 and name hb2 ) (resid 13 and name he3 ) 3.73 0.66 0.79 ! 208 3 6.81 182.623 Ss assign (resid 13 and name hb1 ) (resid 13 and name hd1 ) 3.81 0.69 0.82 ! 202 3.52 6.75 164.128 Ss assign (resid 13 and name hb1 ) (resid 14 and name hn ) 2.65 0.32 0.27 ! 204 3.52 8.45 976.838 assign (resid 13 and name hn ) (resid 14 and name hn ) 2.67 0.33 0.27 ! 182 7.97 8.45 930.498 assign (resid 13 and name he3 ) (resid 14 and name hn ) 2.9 0.4 0.52 ! 192 6.82 8.45 622.76 Ss assign (resid 13 and name hb2 ) (resid 14 and name hn ) 3.61 0.63 0.54 ! 209 3 8.45 212.683 assign (resid 13 and name ha ) (resid 16 and name hb* ) 3.17 0.49 0.39 ! 189 4.12 2.71 404.413 assign (resid 13 and name ha ) (resid 16 and name hb* ) 3.64 0.64 0.55 ! 188 4.12 2.8 204.187 assign (resid 13 and name ha ) (resid 16 and name hn ) 3.91 0.72 0.67 ! 187 4.12 8.09 144.937 assign (resid 13 and name hh2 ) (resid 19 and name hd1 ) 3.62 0.63 0.94 ! 195 6.53 7.56 211.085 Ss Ss assign (resid 13 and name hz2 ) (resid 19 and name hd1 ) 3.69 0.65 0.97 ! 198 6.1 7.56 192.54 Ss Ss assign (resid 13 and name hz2 ) (resid 19 and name he3 ) 4.2 0.81 1.23 ! 199 6.1 7.83 101.389 Ss Ss assign (resid 13 and name hh2 ) (resid 19 and name hn ) 4.46 0.89 1.2 ! 194 6.53 8.73 75.8318 Ss assign (resid 13 and name hd1 ) (resid 1 and name he ) 3.63 0.63 0.75 ! 190 6.76 7.4 208.13 Ss assign (resid 13 and name hb2 ) (resid 4 and name hg1 ) 3.45 0.58 0.48 ! 205 3 1.78 265.227 assign (resid 14 and name hd1# ) (resid 10 and name he2 ) 3.24 0.4 0.57 ! 224 0.94 6.75 889.97 Ss C3 !assign (resid 14 and name hb1 ) (resid 10 and name he2 ) 3.3 0.53 0.63 ! 240 1.43 6.75 329.502 Ss assign (resid 14 and name hd2# ) (resid 10 and name he2 ) 3.39 0.45 0.6 ! 229 0.87 6.75 713.472 Ss C3 assign (resid 14 and name hg ) (resid 10 and name he2 ) 3.57 0.61 0.72 ! 234 1.52 6.75 224.222 Ss assign (resid 14 and name hg ) (resid 10 and name hd2 ) 3.84 0.7 0.64 ! 235 1.51 7 157.826 assign (resid 14 and name hd1# ) (resid 10 and name hd2 ) 4.23 0.72 0.61 ! 225 0.94 7 239.014 C3 assign (resid 14 and name hd2# ) (resid 10 and name hd2 ) 4.79 0.9 0.86 ! 230 0.87 7 130.217 C3 assign (resid 14 and name hg ) (resid 11 and name hn ) 4.59 0.7 0.69 ! 236 1.51 8.4 1085.99 assign (resid 14 and name hg ) (resid 13 and name he3 ) 2.92 0.41 0.52 ! 237 1.51 6.81 604.911 Ss assign (resid 14 and name ha ) (resid 13 and name he3 ) 3.37 0.55 0.65 ! 210 3.25 6.81 297.93 Ss assign (resid 14 and name hb2 ) (resid 13 and name he3 ) 3.62 0.63 0.74 ! 244 1.73 6.81 210.485 Ss assign (resid 14 and name hd2# ) (resid 13 and name he3 ) 3.64 0.53 0.66 ! 231 0.88 6.81 503.193 Ss C3 assign (resid 14 and name hd2# ) (resid 13 and name hz3 ) 2.72 0.56 0.68 ! 232 0.88 6.87 451.261 Ss C3 assign (resid 14 and name hg ) (resid 13 and name hz3 ) 3.87 0.71 0.85 ! 238 1.52 6.87 150.885 Ss assign (resid 14 and name ha ) (resid 13 and name hz3 ) 3.93 0.73 0.88 ! 211 3.25 6.87 140.856 Ss assign (resid 14 and name hb1 ) (resid 13 and name he3 ) 4.14 0.79 0.99 ! 241 1.44 6.81 108.807 Ss assign (resid 14 and name hd1# ) (resid 13 and name hz3 ) 4.32 0.75 0.88 ! 227 0.94 6.87 216.288 Ss C3 assign (resid 14 and name hd1# ) (resid 13 and name he3 ) 4.62 0.84 1.01 ! 226 0.94 6.81 156.101 Ss C3 assign (resid 14 and name hb2 ) (resid 14 and name hn ) 2.64 0.25 0.23 ! 245 1.73 8.45 1466.3 assign (resid 14 and name hg ) (resid 14 and name hn ) 2.55 0.29 0.25 ! 239 1.52 8.45 1165.63 assign (resid 14 and name ha ) (resid 14 and name hn ) 2.69 0.33 0.27 ! 212 3.25 8.45 903.391 assign (resid 14 and name ha ) (resid 14 and name hb1 ) 2.51 0.34 0.28 ! 216 3.25 1.44 865.559 assign (resid 14 and name hb1 ) (resid 14 and name hn ) 3.31 0.37 0.3 ! 242 1.44 8.45 734.066 assign (resid 14 and name ha ) (resid 14 and name hb2 ) 3.08 0.39 0.31 ! 217 3.24 1.71 650.601 assign (resid 14 and name ha ) (resid 14 and name hd2# ) 2.74 0.37 0.31 ! 214 3.25 0.88 1031 C3 assign (resid 14 and name hb2 ) (resid 14 and name hd1# ) 3.33 0.43 0.35 ! 246 1.74 0.94 778.731 C3 assign (resid 14 and name ha ) (resid 14 and name hg ) 3.39 0.62 0.53 ! 215 3.25 1.51 219.476 assign (resid 14 and name hb2 ) (resid 14 and name hd2# ) 3.72 0.56 0.45 ! 247 1.73 0.88 449.311 C3 assign (resid 14 and name ha ) (resid 14 and name hd1# ) 4.09 0.58 0.67 ! 213 3.25 0.93 409.27 C3 assign (resid 14 and name hd2# ) (resid 14 and name hn ) 3.54 0.62 0.74 ! 233 0.88 8.45 168.814 C3 assign (resid 14 and name hd1# ) (resid 14 and name hn ) 3.49 0.54 0.76 ! 228 0.94 8.45 113.918 C3 assign (resid 14 and name hb1 ) (resid 15 and name hn ) 2.71 0.41 0.46 ! 243 1.44 7.92 1045.29 assign (resid 14 and name hb2 ) (resid 15 and name hn ) 2.82 0.37 0.3 ! 248 1.73 7.92 721.643 assign (resid 14 and name ha ) (resid 15 and name hn ) 3.52 0.6 0.5 ! 218 3.25 7.92 241.013 assign (resid 14 and name ha ) (resid 16 and name hn ) 4.05 0.76 0.74 ! 219 3.25 8.09 121.915 assign (resid 14 and name ha ) (resid 17 and name hn ) 3.65 0.64 0.55 ! 220 3.25 7.28 202.068 assign (resid 14 and name ha ) (resid 18 and name hn ) 2.98 0.43 0.34 ! 221 3.25 8.18 541.467 assign (resid 14 and name ha ) (resid 18 and name ha2 ) 3.69 0.65 0.57 ! 223 3.24 2.81 191.505 assign (resid 14 and name ha ) (resid 18 and name ha1 ) 4.23 0.82 0.85 ! 222 3.25 0.65 98.0946 assign (resid 15 and name hb# ) (resid 12 and name he# ) 3.88 0.61 0.49 ! 256 1.46 7.04 364.668 C3 D_3 assign (resid 15 and name hb# ) (resid 12 and name hn ) 4.63 0.85 0.78 ! 254 1.47 8.16 153.757 C3 assign (resid 15 and name hn ) (resid 14 and name hn ) 2.64 0.32 0.27 ! 249 7.93 8.45 981.746 assign (resid 15 and name ha ) (resid 15 and name hb# ) 2.24 0.09 0.18 ! 251 3.98 1.45 5392.15 C3 assign (resid 15 and name hb# ) (resid 15 and name hn ) 2.57 0.2 0.22 ! 257 1.46 7.92 2735.05 C3 assign (resid 15 and name ha ) (resid 15 and name hn ) 2.66 0.33 0.27 ! 250 3.98 7.91 948.141 assign (resid 15 and name hb# ) (resid 16 and name hn ) 3.28 0.42 0.34 ! 258 1.47 8.09 836.293 C3 assign (resid 15 and name ha ) (resid 16 and name hn ) 3.63 0.63 0.55 ! 252 3.98 8.09 208.356 assign (resid 15 and name ha ) (resid 17 and name hn ) 3.93 0.73 0.68 ! 253 3.98 7.28 140.366 !assign (resid 16 and name hb* ) (resid 13 and name hd1 ) 3.63 0.63 0.75 ! 265 2.72 6.75 207.278 Ss assign (resid 16 and name hb* ) (resid 16 and name hn ) 2.52 0.28 0.24 ! 266 2.71 8.09 1249 assign (resid 16 and name ha ) (resid 16 and name hb* ) 2.93 0.41 0.33 ! 260 4.46 2.79 591.603 assign (resid 16 and name hb* ) (resid 16 and name hn ) 3.28 0.52 0.42 ! 263 2.8 8.09 340.654 assign (resid 16 and name ha ) (resid 16 and name hn ) 3.35 0.54 0.45 ! 259 4.45 8.08 308.24 assign (resid 16 and name ha ) (resid 16 and name hb* ) 3.03 0.56 0.49 ! 261 4.46 2.72 182.392 assign (resid 16 and name ha ) (resid 17 and name hn ) 3.83 0.7 0.63 ! 262 4.46 7.28 160.079 assign (resid 16 and name hb* ) (resid 17 and name hn ) 3.99 0.75 0.71 ! 264 2.8 7.31 130.775 assign (resid 16 and name hb* ) (resid 17 and name hn ) 4.42 0.88 0.98 ! 267 2.72 7.28 78.847 assign (resid 16 and name hb* ) (resid 18 and name hn ) 4.04 0.76 0.74 ! 268 2.71 8.18 123.444 assign (resid 17 and name hn ) (resid 16 and name hn ) 2.81 0.37 0.3 ! 269 7.29 8.09 724.83 assign (resid 17 and name ha ) (resid 17 and name hb# ) 2.16 0.06 0.17 ! 272 4.34 1.22 6524.24 C3 assign (resid 17 and name ha ) (resid 17 and name hn ) 2.51 0.28 0.24 ! 271 4.33 7.28 1264.34 assign (resid 17 and name hb# ) (resid 17 and name hn ) 3.02 0.34 0.29 ! 274 1.22 7.28 1244.69 C3 assign (resid 17 and name hn ) (resid 18 and name hn ) 2.36 0.23 0.22 ! 270 7.29 8.18 1712.98 assign (resid 17 and name ha ) (resid 18 and name hn ) 3.59 0.62 0.53 ! 273 4.34 8.18 219.815 assign (resid 17 and name hb# ) (resid 18 and name hn ) 4.26 0.73 0.62 ! 275 1.22 8.18 230.205 C3 assign (resid 18 and name ha1 ) (resid 13 and name hz3 ) 4.07 0.77 0.96 ! 276 0.66 6.87 117.783 Ss assign (resid 18 and name ha2 ) (resid 17 and name hn ) 4.25 0.83 0.86 ! 279 2.81 7.28 95.4393 assign (resid 18 and name ha1 ) (resid 18 and name hn ) 2.65 0.35 0.29 ! 277 0.66 8.19 810.627 assign (resid 18 and name ha2 ) (resid 18 and name hn ) 2.53 0.3 0.29 ! 280 2.81 8.18 615.904 assign (resid 18 and name ha2 ) (resid 19 and name hn ) 2.65 0.32 0.27 ! 282 2.81 8.75 978.663 assign (resid 18 and name ha1 ) (resid 19 and name hn ) 3.48 0.59 0.49 ! 278 0.65 8.75 255.548 assign (resid 19 and name ha ) (resid 13 and name hz2 ) 3.87 0.71 0.85 ! 284 4.63 6.09 250.423 Ss assign (resid 19 and name ha ) (resid 13 and name he1 ) 4.29 0.84 1.09 ! 283 4.63 9.21 91.6007 Ss assign (resid 19 and name ha ) (resid 18 and name ha2 ) 4.07 0.77 0.76 ! 285 4.63 2.81 117.846 assign (resid 19 and name hh2 ) (resid 19 and name hz2 ) 2.19 0.18 0.59 ! 294 7.35 7.58 2452.65 Ss Ss assign (resid 19 and name hd1 ) (resid 19 and name he1 ) 2.3 0.21 0.61 ! 293 7.57 10.52 1936.81 Ss Ss assign (resid 19 and name hz3 ) (resid 19 and name he3 ) 2.43 0.25 0.63 ! 295 7.23 7.83 1480.26 Ss Ss assign (resid 19 and name ha ) (resid 19 and name he3 ) 2.57 0.3 0.45 ! 288 4.64 7.84 1136.73 Ss assign (resid 19 and name hb2 ) (resid 19 and name he3 ) 4.1 0.76 0.81 ! 301 3.51 7.84 798.066 Ss assign (resid 19 and name hb1 ) (resid 19 and name hd1 ) 3.21 0.37 0.5 ! 297 3.17 7.56 730.544 Ss assign (resid 19 and name hb1 ) (resid 19 and name hn ) 3.62 0.41 0.33 ! 296 3.17 8.75 598.72 assign (resid 19 and name ha ) (resid 19 and name hb1 ) 2.6 0.27 0.31 ! 289 4.65 3.19 448.915 assign (resid 19 and name ha ) (resid 19 and name hn ) 2.54 0.48 0.38 ! 286 4.64 8.75 423.513 assign (resid 19 and name hb1 ) (resid 19 and name he3 ) 3.19 0.49 0.6 ! 298 3.17 7.84 392.667 Ss assign (resid 19 and name ha ) (resid 19 and name hb2 ) 3.27 0.52 0.42 ! 290 4.63 3.51 343.795 assign (resid 19 and name hd1 ) (resid 19 and name hn ) 3.46 0.58 0.68 ! 292 7.57 8.75 263.228 Ss assign (resid 19 and name hb2 ) (resid 19 and name hd1 ) 2.69 0.59 0.69 ! 300 3.52 7.56 253.303 Ss assign (resid 19 and name hb2 ) (resid 19 and name hn ) 2.72 0.43 0.48 ! 299 3.52 8.75 142.035 assign (resid 19 and name ha ) (resid 19 and name hd1 ) 4.23 0.82 1.05 ! 287 4.64 7.56 97.8588 Ss assign (resid 19 and name ha ) (resid 20 and name hn ) 2.99 0.39 0.45 ! 291 4.63 7.84 1094.44 assign (resid 1 and name hg* ) (resid 13 and name hd1 ) 2.74 0.35 0.49 ! 19 1.65 6.75 819.796 Ss assign (resid 1 and name hg* ) (resid 13 and name hd1 ) 2.95 0.42 0.53 ! 16 1.82 6.75 571.746 Ss assign (resid 1 and name hd# ) (resid 13 and name hd1 ) 3.2 0.5 0.6 ! 14 3.17 6.75 385.099 Ss assign (resid 1 and name hg* ) (resid 13 and name he1 ) 3.37 0.55 0.65 ! 20 1.65 9.21 297.429 Ss assign (resid 1 and name hb* ) (resid 13 and name hd1 ) 3.78 0.68 0.81 ! 10 1.97 6.75 169.335 Ss assign (resid 1 and name hg* ) (resid 13 and name he1 ) 3.96 0.74 0.9 ! 17 1.81 9.21 134.887 Ss assign (resid 1 and name hb* ) (resid 13 and name hd1 ) 4.03 0.76 0.93 ! 8 1.93 6.75 123.927 Ss assign (resid 1 and name hd# ) (resid 1 and name he ) 2.41 0.25 0.22 ! 11 3.18 7.42 1542.94 assign (resid 1 and name ha ) (resid 1 and name hb* ) 3.05 0.45 0.36 ! 0 4.51 1.93 489.341 assign (resid 1 and name hd# ) (resid 1 and name hb* ) 3.08 0.46 0.37 ! 12 3.18 1.93 466.059 assign (resid 1 and name ha ) (resid 1 and name hb* ) 2.7 0.5 0.4 ! 1 4.51 1.96 386.882 assign (resid 1 and name hd# ) (resid 1 and name hb* ) 3.29 0.53 0.43 ! 13 3.18 1.97 335.876 assign (resid 1 and name hg* ) (resid 1 and name he ) 3.51 0.6 0.5 ! 18 1.65 7.41 243.494 assign (resid 1 and name hg* ) (resid 1 and name he ) 3.56 0.61 0.52 ! 15 1.82 7.41 228.996 assign (resid 1 and name hb* ) (resid 1 and name he ) 3.95 0.73 0.69 ! 6 1.93 7.41 137.169 assign (resid 1 and name ha ) (resid 1 and name hg* ) 3.99 0.75 0.71 ! 3 4.51 1.63 130.398 assign (resid 1 and name ha ) (resid 1 and name hg* ) 4.25 0.83 0.86 ! 2 4.51 1.81 96.2012 assign (resid 1 and name ha ) (resid 2 and name hd1 ) 2.35 0.23 0.21 ! 4 4.51 3.81 1763.86 assign (resid 1 and name ha ) (resid 2 and name hd2 ) 2.86 0.39 0.31 ! 5 4.51 3.52 666.692 assign (resid 1 and name hb* ) (resid 2 and name hd2 ) 2.89 0.4 0.32 ! 9 1.97 3.52 631.486 assign (resid 1 and name hb* ) (resid 2 and name hd2 ) 3.3 0.53 0.43 ! 7 1.93 3.52 332.578 assign (resid 20 and name ha ) (resid 20 and name hb# ) 2.36 0.13 0.19 ! 303 4.48 1.4 4198.34 C3 assign (resid 20 and name ha ) (resid 20 and name hn ) 2.49 0.27 0.24 ! 302 4.49 7.85 1312.12 assign (resid 20 and name hb# ) (resid 20 and name hn ) 2.82 0.27 0.26 ! 305 1.4 7.84 1742.83 C3 assign (resid 20 and name ha ) (resid 21 and name hn ) 3.39 0.56 0.46 ! 304 4.49 7.57 288.23 assign (resid 20 and name hb# ) (resid 21 and name hn ) 4.5 0.81 0.72 ! 306 1.4 7.57 176.178 C3 assign (resid 21 and name hb* ) (resid 18 and name ha2 ) 3.33 0.54 0.44 ! 310 3.86 2.81 315.305 assign (resid 21 and name hb* ) (resid 18 and name hn ) 3.66 0.64 0.56 ! 313 3.47 8.18 199.49 assign (resid 21 and name hb* ) (resid 18 and name ha2 ) 4.02 0.76 0.73 ! 314 3.46 2.8 125.18 assign (resid 21 and name ha ) (resid 21 and name hb* ) 2.4 0.24 0.22 ! 308 4.05 3.87 1586.53 assign (resid 21 and name ha ) (resid 21 and name hb* ) 2.73 0.35 0.28 ! 309 4.05 3.46 844.322 assign (resid 21 and name ha ) (resid 21 and name hn ) 2.85 0.38 0.31 ! 307 4.06 7.58 684.26 assign (resid 21 and name hb* ) (resid 21 and name hn ) 3.11 0.47 0.37 ! 315 3.48 7.57 441.745 assign (resid 21 and name hb* ) (resid 21 and name hn ) 3.69 0.65 0.57 ! 311 3.87 7.57 191.705 !assign (resid 2 and name hd2 ) (resid 10 and name he# ) 3.7 0.63 0.96 ! 37 3.5 6.75 228.721 Se Ca !assign (resid 2 and name hd2 ) (resid 10 and name hd# ) 4.6 0.92 1.43 ! 36 3.5 7.01 79.0532 Se Ca !assign (resid 2 and name hd2 ) (resid 13 and name hz3 ) 3.83 0.7 0.83 ! 38 3.52 6.87 158.928 Ss assign (resid 2 and name ha ) (resid 13 and name hz2 ) 3.33 0.53 0.68 ! 25 4.03 6.1 140.473 Ss assign (resid 2 and name ha ) (resid 19 and name hz3 ) 2.99 0.42 0.53 ! 27 4.01 7.24 217.851 Ss assign (resid 2 and name ha ) (resid 19 and name he3 ) 3.9 0.72 0.86 ! 26 4 7.83 146.686 Ss assign (resid 2 and name hb1 ) (resid 19 and name hz3 ) 3.4 0.52 0.66 ! 29 2.42 7.23 146.866 Ss assign (resid 2 and name hb1 ) (resid 19 and name hh2 ) 2.28 0.35 0.31 ! 28 2.42 7.34 131.496 Ss assign (resid 2 and name ha ) (resid 2 and name hb1 ) 2.76 0.36 0.29 ! 21 4.01 2.43 795.316 assign (resid 2 and name hd1 ) (resid 2 and name hg2 ) 3.01 0.44 0.35 ! 33 3.82 2.11 516.711 assign (resid 2 and name hd1 ) (resid 2 and name hg1 ) 2.77 0.49 0.39 ! 32 3.82 2.01 404.015 assign (resid 2 and name ha ) (resid 2 and name hb2 ) 3.26 0.51 0.42 ! 22 4.01 1.7 353.723 assign (resid 2 and name hd2 ) (resid 2 and name hg1 ) 3.31 0.53 0.43 ! 35 3.52 2.02 324.695 assign (resid 2 and name hd2 ) (resid 2 and name hb2 ) 3.76 0.67 0.6 ! 34 3.53 1.72 174.575 assign (resid 2 and name hd1 ) (resid 2 and name hb1 ) 4.8 1 1.29 ! 30 3.81 2.41 52.8275 assign (resid 2 and name ha ) (resid 3 and name hd1 ) 2.61 0.31 0.26 ! 23 4.01 3.24 1049.2 assign (resid 2 and name ha ) (resid 3 and name hd2 ) 2.93 0.41 0.33 ! 24 4.01 2.55 591.784 assign (resid 3 and name hb2 ) (resid 10 and name he1 ) 3.17 0.49 0.59 ! 50 1.12 6.75 401.117 Ss assign (resid 3 and name hb1 ) (resid 10 and name he1 ) 3.5 0.59 0.7 ! 44 -0.08 6.75 247.015 Ss assign (resid 3 and name hb2 ) (resid 10 and name hd1 ) 3.5 0.59 0.7 ! 49 1.12 7 247.131 Ss assign (resid 3 and name hb1 ) (resid 10 and name hd1 ) 4.53 0.92 1.26 ! 43 -0.09 7 69.7854 Ss assign (resid 3 and name hd2 ) (resid 13 and name hz2 ) 3.14 0.48 0.58 ! 59 2.55 6.09 421.894 Ss assign (resid 3 and name ha ) (resid 13 and name he1 ) 3.83 0.7 0.83 ! 42 2.27 9.21 159.75 Ss assign (resid 3 and name ha ) (resid 13 and name hd1 ) 3.9 0.72 0.87 ! 41 2.27 6.75 145.888 Ss assign (resid 3 and name hd2 ) (resid 13 and name hh2 ) 4.27 0.84 1.08 ! 58 2.53 6.52 93.254 Ss assign (resid 3 and name hb1 ) (resid 13 and name hz3 ) 4.32 0.85 1.11 ! 47 -0.09 6.87 88.183 Ss assign (resid 3 and name hb1 ) (resid 13 and name hz2 ) 4.42 0.88 1.18 ! 46 -0.08 6.09 78.9507 Ss assign (resid 3 and name hb1 ) (resid 13 and name he3 ) 4.69 0.97 1.38 ! 45 -0.09 6.8 59.3886 Ss !assign (resid 3 and name hg1 ) (resid 14 and name hn ) 3.49 0.59 0.49 ! 61 1.65 8.45 252.189 assign (resid 3 and name hd1 ) (resid 19 and name hh2 ) 3.72 0.66 0.79 ! 54 3.23 7.34 183.24 Ss assign (resid 3 and name hd1 ) (resid 19 and name hz3 ) 3.91 0.72 0.87 ! 55 3.23 7.24 144.496 Ss assign (resid 3 and name hd1 ) (resid 2 and name hb1 ) 3.43 0.57 0.47 ! 51 3.24 2.42 272.369 assign (resid 3 and name hd2 ) (resid 3 and name hg2 ) 2.67 0.46 0.37 ! 57 2.54 1.45 465.154 assign (resid 3 and name hd1 ) (resid 3 and name hg1 ) 2.33 0.27 0.38 ! 53 3.24 1.66 430.01 assign (resid 3 and name hd2 ) (resid 3 and name hg1 ) 3.02 0.33 0.44 ! 56 2.56 1.66 321.085 assign (resid 3 and name ha ) (resid 3 and name hb2 ) 2.93 0.26 0.39 ! 40 2.27 1.11 182.267 assign (resid 3 and name ha ) (resid 3 and name hb1 ) 2.3 0.47 0.4 ! 39 2.26 -0.09 177.772 assign (resid 3 and name hg2 ) (resid 3 and name hb1 ) 3.01 0.39 0.43 ! 62 1.42 -0.08 162.644 assign (resid 3 and name hg1 ) (resid 3 and name hb1 ) 2.28 0.32 0.47 ! 60 1.66 -0.05 144.726 assign (resid 4 and name hd2 ) (resid 10 and name hd1 ) 3.08 0.39 0.49 ! 84 2.71 7.01 255.004 Ss assign (resid 4 and name hg2 ) (resid 10 and name hd1 ) 3.5 0.65 0.57 ! 87 1.73 7.01 190.004 Ss assign (resid 4 and name hg2 ) (resid 10 and name hn ) 3.98 0.74 0.71 ! 86 1.71 8.54 132.015 assign (resid 4 and name hb2 ) (resid 10 and name hn ) 4.12 0.79 0.78 ! 69 1.94 8.54 111.166 assign (resid 4 and name hg1 ) (resid 10 and name hn ) 4.22 0.82 0.84 ! 85 1.79 8.54 99.2652 assign (resid 4 and name hd1 ) (resid 13 and name hd1 ) 3.01 0.44 0.55 ! 76 3.05 6.75 521.686 Ss assign (resid 4 and name hd1 ) (resid 3 and name ha ) 2.95 0.42 0.33 ! 70 3.05 2.26 574.216 assign (resid 4 and name hd2 ) (resid 3 and name ha ) 3.15 0.48 0.38 ! 77 2.71 2.27 418.214 assign (resid 4 and name hd2 ) (resid 3 and name hb2 ) 3.8 0.69 0.62 ! 79 2.71 1.11 165.653 assign (resid 4 and name hd2 ) (resid 3 and name hb1 ) 4.03 0.76 0.73 ! 78 2.72 -0.07 125.013 assign (resid 4 and name hd1 ) (resid 3 and name hb2 ) 4.13 0.79 0.79 ! 71 3.05 1.12 110.249 assign (resid 4 and name ha ) (resid 4 and name hb1 ) 2.59 0.3 0.25 ! 63 4.34 2.15 1095.33 assign (resid 4 and name hd1 ) (resid 4 and name hg1 ) 2.88 0.4 0.32 ! 74 3.06 1.78 645.47 assign (resid 4 and name hd2 ) (resid 4 and name hg2 ) 2.48 0.49 0.39 ! 83 2.72 1.73 398.173 assign (resid 4 and name hd2 ) (resid 4 and name hg1 ) 3.33 0.54 0.44 ! 82 2.71 1.79 316.285 assign (resid 4 and name ha ) (resid 4 and name hb2 ) 3.4 0.56 0.46 ! 64 4.34 1.95 284.029 assign (resid 4 and name hd1 ) (resid 4 and name hg2 ) 3.41 0.56 0.47 ! 75 3.04 1.71 280.824 assign (resid 4 and name hd1 ) (resid 4 and name hb1 ) 3.57 0.61 0.52 ! 72 3.06 2.15 225.575 assign (resid 4 and name hd2 ) (resid 4 and name hb2 ) 4 0.75 0.71 ! 81 2.71 1.95 129.713 assign (resid 4 and name hd2 ) (resid 4 and name hb1 ) 4.18 0.81 0.82 ! 80 2.71 2.15 104.439 assign (resid 4 and name ha ) (resid 5 and name hn ) 2.78 0.3 0.35 ! 65 4.34 8.22 1107.68 assign (resid 4 and name hb2 ) (resid 5 and name hn ) 3.68 0.65 0.57 ! 67 1.95 8.22 193.94 assign (resid 4 and name hb1 ) (resid 5 and name hn ) 4.39 0.87 0.95 ! 66 2.15 8.22 82.0629 assign (resid 4 and name hb2 ) (resid 6 and name hn ) 3.05 0.45 0.36 ! 68 1.95 7.84 484.278 assign (resid 5 and name ha ) (resid 5 and name hb* ) 2.6 0.31 0.26 ! 89 4.2 3.76 1069.97 assign (resid 5 and name ha ) (resid 5 and name hb* ) 2.65 0.32 0.27 ! 90 4.19 3.83 975.697 assign (resid 5 and name ha ) (resid 5 and name hn ) 2.69 0.33 0.27 ! 88 4.19 8.21 906.169 assign (resid 5 and name hb* ) (resid 5 and name hn ) 3.23 0.51 0.41 ! 92 3.77 8.22 369.493 assign (resid 5 and name hb* ) (resid 5 and name hn ) 3.31 0.53 0.43 ! 94 3.84 8.22 327.664 assign (resid 5 and name ha ) (resid 6 and name hn ) 3.45 0.57 0.48 ! 91 4.19 7.85 268.125 assign (resid 5 and name hb* ) (resid 6 and name hn ) 4.05 0.77 0.74 ! 93 3.77 7.84 121.215 assign (resid 5 and name hb* ) (resid 6 and name hn ) 4.17 0.8 0.81 ! 96 3.85 7.84 105.164 assign (resid 6 and name hn ) (resid 5 and name hn ) 2.78 0.36 0.29 ! 97 7.85 8.22 773.48 assign (resid 6 and name ha ) (resid 6 and name hn ) 2.88 0.38 0.33 ! 99 4.51 7.85 2499.22 assign (resid 6 and name hb* ) (resid 6 and name hn ) 2.69 0.34 0.28 ! 103 2.62 7.84 896.996 assign (resid 6 and name hb* ) (resid 6 and name hn ) 2.72 0.35 0.28 ! 104 2.72 7.84 851.165 assign (resid 6 and name ha ) (resid 6 and name hb* ) 2.77 0.36 0.29 ! 100 4.51 2.62 777.155 assign (resid 6 and name ha ) (resid 6 and name hb* ) 3.25 0.43 0.39 ! 101 4.52 2.71 137.415 assign (resid 6 and name ha ) (resid 7 and name hn ) 2.88 0.51 0.48 ! 102 4.51 8.76 2036.13 assign (resid 6 and name hn ) (resid 7 and name hn ) 2.79 0.36 0.3 ! 98 7.86 8.75 455.611 assign (resid 6 and name hb* ) (resid 9 and name hb# ) 3.21 0.4 0.33 ! 105 2.72 1.54 927.612 C3 assign (resid 8 and name hb# ) (resid 7 and name hn ) 2.9 0.3 0.27 ! 114 1.5 8.76 1512.56 C3 assign (resid 8 and name hn ) (resid 7 and name hn ) 3.28 0.52 0.42 ! 110 8.34 8.76 340.959 assign (resid 8 and name ha ) (resid 8 and name hb# ) 2.16 0.06 0.17 ! 113 4.24 1.5 7794.79 C3 assign (resid 8 and name ha ) (resid 8 and name hn ) 2.67 0.33 0.32 ! 112 4.24 8.33 1671.86 assign (resid 8 and name hb# ) (resid 8 and name hn ) 2.4 0.14 0.2 ! 115 1.5 8.33 3835 C3 assign (resid 8 and name hn ) (resid 9 and name hn ) 2.24 0.19 0.2 ! 111 8.33 8.26 2214.22 assign (resid 8 and name hb# ) (resid 9 and name hn ) 3.32 0.43 0.35 ! 116 1.5 8.27 790.576 C3 assign (resid 9 and name hn ) (resid 10 and name hn ) 2.47 0.32 0.27 ! 117 8.27 8.54 972.308 D_0 assign (resid 9 and name hb# ) (resid 10 and name hn ) 3.55 0.5 0.4 ! 126 1.53 8.53 566.033 C3 assign (resid 9 and name ha ) (resid 10 and name hn ) 3.48 0.61 0.57 ! 120 4.48 8.54 170.972 assign (resid 9 and name ha ) (resid 12 and name hn ) 3.44 0.57 0.48 ! 121 4.48 8.15 270.363 assign (resid 9 and name ha ) (resid 12 and name hb* ) 3.81 0.69 0.62 ! 122 4.47 2.1 163.756 assign (resid 9 and name ha ) (resid 12 and name hb* ) 4.17 0.8 0.81 ! 123 4.47 2.18 105.631 assign (resid 9 and name hb# ) (resid 12 and name hn ) 5.22 1.03 1.11 ! 127 1.53 8.15 85.7904 C3 assign (resid 9 and name hb# ) (resid 6 and name hn ) 5.52 1.13 1.33 ! 124 1.53 7.84 65.0347 C3 assign (resid 9 and name ha ) (resid 9 and name hb# ) 2.48 0.16 0.21 ! 119 4.47 1.54 3303.7 C3 assign (resid 9 and name ha ) (resid 9 and name hn ) 2.62 0.31 0.26 ! 118 4.47 8.26 1035.61 assign (resid 9 and name hb# ) (resid 9 and name hn ) 2.74 0.25 0.24 ! 125 1.54 8.26 2014.24 C3
Contact the webmaster for help, if required. Saturday, June 1, 2024 4:26:37 AM GMT (wattos1)