NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | type | subsubtype |
5774 | 1hy8 | 4989 | cing | recoord | 1-original | 5 | chemical shift | format 3 |
1 -5 GLY CA C 43.5300 . . 2 -5 GLY HA1|2 H 4.0400 . . 3 -4 PRO CA C 63.2000 . . 4 -4 PRO CB C 32.3700 . . 5 -4 PRO CG C 27.0500 . . 6 -4 PRO CD C 49.6300 . . 7 -4 PRO HA H 4.5300 . . 8 -4 PRO HB1|2 H 2.3178 . . 9 -4 PRO HG1|2 H 2.0400 . . 10 -4 PRO HD1|2 H 3.6200 . . 11 -3 LEU HN H 8.6200 . . 12 -3 LEU N N 122.6100 . . 13 -3 LEU CA C 55.2500 . . 14 -3 LEU CB C 42.3400 . . 15 -3 LEU CG C 27.0700 . . 16 -3 LEU CD1|2 C 25.0500 . . 17 -3 LEU CD1|2 C 23.5000 . . 18 -3 LEU HA H 4.4363 . . 19 -3 LEU HB1|2 H 1.7309 . . 20 -3 LEU HG H 1.6317 . . 21 -3 LEU HD1#|2# H 0.9565 . . 22 -2 GLY HN H 8.5200 . . 23 -2 GLY N N 110.2000 . . 24 -2 GLY CA C 45.2500 . . 25 -2 GLY HA1|2 H 4.0770 . . 26 -1 SER HN H 8.4000 . . 27 -1 SER N N 116.8400 . . 28 -1 SER CA C 59.4000 . . 29 -1 SER CB C 63.3460 . . 30 -1 SER HA H 4.3522 . . 31 -1 SER HB1|2 H 3.9247 . . 32 1 ALA HN H 8.4600 . . 33 1 ALA N N 126.0900 . . 34 1 ALA CA C 53.7885 . . 35 1 ALA CB C 18.8033 . . 36 1 ALA HA H 4.3491 . . 37 1 ALA HB# H 1.4860 . . 38 2 ASP HN H 8.2500 . . 39 2 ASP N N 119.9000 . . 40 2 ASP CA C 55.4285 . . 41 2 ASP CB C 41.4332 . . 42 2 ASP HA H 4.6202 . . 43 2 ASP HB1|2 H 2.8817 . . 44 2 ASP HB1|2 H 2.7724 . . 45 3 THR HN H 8.1500 . . 46 3 THR N N 117.0800 . . 47 3 THR CA C 67.7352 . . 48 3 THR CB C 68.2100 . . 49 3 THR 2 2 23.3870 . . 50 3 THR HA H 3.9529 . . 51 3 THR HB H 4.1633 . . 52 3 THR 2# 2 1.1180 . . 53 4 LEU HN H 8.5374 . . 54 4 LEU N N 121.3981 . . 55 4 LEU CA C 58.4930 . . 56 4 LEU CB C 40.7890 . . 57 4 LEU CG C 27.2552 . . 58 4 LEU CD1|2 C 22.6690 . . 59 4 LEU CD1|2 C 25.5125 . . 60 4 LEU HA H 3.9866 . . 61 4 LEU HB1|2 H 1.9854 . . 62 4 LEU 2|HB1 2 1.5600 . . 63 4 LEU HG H 1.5509 . . 64 4 LEU HD1#|2# H 0.7700 . . 65 4 LEU HD1#|2# H 0.9600 . . 66 5 GLU HN H 8.7000 . . 67 5 GLU N N 124.1800 . . 68 5 GLU CA C 60.2906 . . 69 5 GLU CB C 29.3541 . . 70 5 GLU CG C 36.2910 . . 71 5 GLU HA H 4.0247 . . 72 5 GLU HB1|2 H 2.1800 . . 73 5 GLU HB1|2 H 2.2300 . . 74 5 GLU HG1|2 H 2.3100 . . 75 5 GLU HG1|2 H 2.4200 . . 76 6 ARG HN H 8.1200 . . 77 6 ARG N N 119.7400 . . 78 6 ARG CA C 59.7246 . . 79 6 ARG CB C 32.5726 . . 80 6 ARG CG C 27.2190 . . 81 6 ARG CD C 44.6792 . . 82 6 ARG HA H 4.0843 . . 83 6 ARG HB1|2 H 2.0789 . . 84 6 ARG HB1|2 H 1.9608 . . 85 6 ARG HG1|2 H 1.7141 . . 86 6 ARG HG1|2 H 1.9800 . . 87 6 ARG HD1|2 H 3.3015 . . 88 6 ARG HD1|2 H 3.0257 . . 89 7 VAL HN H 8.7900 . . 90 7 VAL N N 119.2200 . . 91 7 VAL CA C 66.9383 . . 92 7 VAL CB C 31.9191 . . 93 7 VAL CG1|2 C 24.3348 . . 94 7 VAL CG1|2 C 21.4790 . . 95 7 VAL HA H 3.6607 . . 96 7 VAL HB H 2.1885 . . 97 7 VAL HG1#|2# H 1.1000 . . 98 7 VAL HG1#|2# H 0.9500 . . 99 8 THR HN H 8.6500 . . 100 8 THR N N 116.8600 . . 101 8 THR CA C 68.4050 . . 102 8 THR CB C 68.5100 . . 103 8 THR 2 2 20.4200 . . 104 8 THR HA H 3.7100 . . 105 8 THR HB H 4.4300 . . 106 8 THR 2# 2 1.2508 . . 107 9 LYS HN H 7.6039 . . 108 9 LYS N N 120.3407 . . 109 9 LYS CA C 59.6130 . . 110 9 LYS CB C 32.1445 . . 111 9 LYS CG C 24.7739 . . 112 9 LYS CD C 28.9239 . . 113 9 LYS CE C 42.2060 . . 114 9 LYS HA H 3.9581 . . 115 9 LYS HB1|2 H 1.9560 . . 116 9 LYS HG1|2 H 1.4525 . . 117 9 LYS HG1|2 H 1.5800 . . 118 9 LYS HD1|2 H 1.6565 . . 119 9 LYS HE1|2 H 3.0046 . . 120 10 ILE HN H 7.1800 . . 121 10 ILE N N 118.4300 . . 122 10 ILE CA C 64.5400 . . 123 10 ILE CB C 38.4500 . . 124 10 ILE CG1 C 29.5214 . . 125 10 ILE CG2 C 17.1736 . . 126 10 ILE CD C 14.1182 . . 127 10 ILE HA H 3.8757 . . 128 10 ILE HB H 2.0135 . . 129 10 ILE HG11|12 H 1.8000 . . 130 10 ILE HG11|12 H 1.3100 . . 131 10 ILE HG2# H 0.8900 . . 132 10 ILE HD# H 0.8800 . . 133 11 ILE HN H 8.1627 . . 134 11 ILE N N 120.1274 . . 135 11 ILE CA C 66.1900 . . 136 11 ILE CB C 38.0900 . . 137 11 ILE CG1 C 30.0393 . . 138 11 ILE CG2 C 18.6231 . . 139 11 ILE CD C 16.6970 . . 140 11 ILE HA H 3.4970 . . 141 11 ILE HB H 2.0413 . . 142 11 ILE HG11|12 H 2.0900 . . 143 11 ILE HG11|12 H 1.0400 . . 144 11 ILE HG2# H 0.9100 . . 145 11 ILE HD# H 0.9155 . . 146 12 VAL HN H 8.7870 . . 147 12 VAL N N 120.9983 . . 148 12 VAL CA C 66.8968 . . 149 12 VAL CB C 32.0926 . . 150 12 VAL CG1|2 C 20.5609 . . 151 12 VAL CG1|2 C 22.5660 . . 152 12 VAL HA H 3.5299 . . 153 12 VAL HB H 2.1953 . . 154 12 VAL HG1#|2# H 1.0865 . . 155 12 VAL HG1#|2# H 0.9876 . . 156 13 ASP HN H 8.1600 . . 157 13 ASP N N 119.4400 . . 158 13 ASP CA C 57.1600 . . 159 13 ASP CB C 40.8400 . . 160 13 ASP HA H 4.4033 . . 161 13 ASP HB1|2 H 2.8353 . . 162 13 ASP HB1|2 H 2.6861 . . 163 14 ARG HN H 8.3200 . . 164 14 ARG N N 116.4000 . . 165 14 ARG CA C 57.4000 . . 166 14 ARG CB C 30.4258 . . 167 14 ARG CG C 26.6580 . . 168 14 ARG CD C 42.0691 . . 169 14 ARG HA H 4.3434 . . 170 14 ARG HB1|2 H 2.0615 . . 171 14 ARG HB1|2 H 1.8969 . . 172 14 ARG HG1|2 H 1.5687 . . 173 14 ARG HG1|2 H 1.6605 . . 174 14 ARG HD1|2 H 3.2000 . . 175 14 ARG HD1|2 H 3.3000 . . 176 15 LEU HN H 8.7400 . . 177 15 LEU N N 114.5500 . . 178 15 LEU CA C 54.6100 . . 179 15 LEU CB C 42.3000 . . 180 15 LEU CG C 26.7210 . . 181 15 LEU CD1|2 C 22.2021 . . 182 15 LEU HA H 4.6180 . . 183 15 LEU HB1|2 H 1.9902 . . 184 15 LEU 2|HB1 2 1.7580 . . 185 15 LEU HD1#|2# H 0.8227 . . 186 15 LEU HD1#|2# H 0.9935 . . 187 16 GLY HN H 8.0400 . . 188 16 GLY N N 108.9600 . . 189 16 GLY CA C 47.0084 . . 190 16 GLY HA1|2 H 4.0624 . . 191 16 GLY HA1|2 H 3.9487 . . 192 17 VAL HN H 6.4000 . . 193 17 VAL N N 109.4500 . . 194 17 VAL CA C 58.8975 . . 195 17 VAL CB C 32.6744 . . 196 17 VAL CG1|2 C 19.4285 . . 197 17 VAL CG1|2 C 22.4646 . . 198 17 VAL HA H 4.4320 . . 199 17 VAL HB H 2.4872 . . 200 17 VAL HG1#|2# H 0.6950 . . 201 17 VAL HG1#|2# H 0.9700 . . 202 18 ASP HN H 8.5635 . . 203 18 ASP N N 121.1378 . . 204 18 ASP CA C 53.9500 . . 205 18 ASP CB C 42.5500 . . 206 18 ASP HA H 4.5844 . . 207 18 ASP HB1|2 H 2.5682 . . 208 18 ASP HB1|2 H 2.6697 . . 209 19 GLU HN H 8.9600 . . 210 19 GLU N N 125.6200 . . 211 19 GLU CA C 60.2381 . . 212 19 GLU CB C 29.2443 . . 213 19 GLU CG C 36.2356 . . 214 19 GLU HA H 3.6353 . . 215 19 GLU HB1|2 H 2.0245 . . 216 19 GLU HB1|2 H 1.9800 . . 217 19 GLU HG1|2 H 2.2585 . . 218 20 ALA HN H 8.7104 . . 219 20 ALA N N 120.2743 . . 220 20 ALA CA C 53.9615 . . 221 20 ALA CB C 18.5750 . . 222 20 ALA HA H 4.0690 . . 223 20 ALA HB# H 1.3773 . . 224 21 ASP HN H 7.7552 . . 225 21 ASP N N 114.9379 . . 226 21 ASP CA C 54.8256 . . 227 21 ASP CB C 40.9824 . . 228 21 ASP HA H 4.5786 . . 229 21 ASP HB1|2 H 2.6869 . . 230 22 VAL HN H 7.6000 . . 231 22 VAL N N 121.5400 . . 232 22 VAL CA C 63.8477 . . 233 22 VAL CB C 29.2863 . . 234 22 VAL CG1|2 C 24.0204 . . 235 22 VAL CG1|2 C 22.3278 . . 236 22 VAL HA H 3.5340 . . 237 22 VAL HB H 2.3698 . . 238 22 VAL HG1#|2# H 0.9300 . . 239 22 VAL HG1#|2# H 0.8800 . . 240 23 LYS HN H 6.7100 . . 241 23 LYS N N 125.2300 . . 242 23 LYS CA C 53.4424 . . 243 23 LYS CB C 35.2857 . . 244 23 LYS CG C 24.5975 . . 245 23 LYS CD C 29.0238 . . 246 23 LYS CE C 42.2352 . . 247 23 LYS HA H 4.6457 . . 248 23 LYS HB1|2 H 2.1148 . . 249 23 LYS HB1|2 H 1.4828 . . 250 23 LYS HG1 H 1.3000 . . 251 23 LYS 2 2 1.3800 . . 252 23 LYS HD1|2 H 1.7100 . . 253 23 LYS HE1|2 H 3.0251 . . 254 24 LEU HN H 8.8133 . . 255 24 LEU N N 121.3330 . . 256 24 LEU CA C 58.0785 . . 257 24 LEU CB C 41.2714 . . 258 24 LEU CG C 26.9730 . . 259 24 LEU CD1|2 C 23.0091 . . 260 24 LEU CD1|2 C 25.2563 . . 261 24 LEU HA H 3.6800 . . 262 24 LEU HB1|2 H 1.8000 . . 263 24 LEU HB1|2 H 1.4200 . . 264 24 LEU HG H 1.8300 . . 265 24 LEU HD1#|2# H 0.8500 . . 266 24 LEU HD1#|2# H 0.9600 . . 267 25 GLU HN H 9.0400 . . 268 25 GLU N N 114.2600 . . 269 25 GLU CA C 56.7800 . . 270 25 GLU CB C 28.8120 . . 271 25 GLU CG C 36.0469 . . 272 25 GLU HA H 4.1964 . . 273 25 GLU HB1|2 H 2.0000 . . 274 25 GLU HB1|2 H 2.0800 . . 275 25 GLU HG1|2 H 2.2500 . . 276 26 ALA HN H 7.6900 . . 277 26 ALA N N 123.1000 . . 278 26 ALA CA C 52.2181 . . 279 26 ALA CB C 18.7904 . . 280 26 ALA HA H 4.3491 . . 281 26 ALA HB# H 1.4044 . . 282 27 SER HN H 10.0100 . . 283 27 SER N N 118.5700 . . 284 27 SER CA C 55.9287 . . 285 27 SER CB C 63.5943 . . 286 27 SER HA H 4.7630 . . 287 27 SER HB1|2 H 3.9156 . . 288 27 SER HB1|2 H 4.0782 . . 289 28 PHE HN H 8.2233 . . 290 28 PHE N N 125.9693 . . 291 28 PHE CA C 61.9737 . . 292 28 PHE CB C 38.2329 . . 293 28 PHE CD C 130.7500 . . 294 28 PHE CE C 127.7200 . . 295 28 PHE HA H 4.1367 . . 296 28 PHE HB1|2 H 2.8759 . . 297 28 PHE HB1|2 H 2.9881 . . 298 28 PHE HD1|2 H 6.9700 . . 299 28 PHE HE1|2 H 6.7800 . . 300 29 LYS HN H 8.7200 . . 301 29 LYS N N 115.8600 . . 302 29 LYS CA C 58.4806 . . 303 29 LYS CB C 33.0113 . . 304 29 LYS CG C 25.1185 . . 305 29 LYS CD C 29.4451 . . 306 29 LYS CE C 41.9547 . . 307 29 LYS HA H 4.7572 . . 308 29 LYS HB1|2 H 1.8320 . . 309 29 LYS HG1|2 H 1.5489 . . 310 29 LYS HG1|2 H 1.3000 . . 311 29 LYS HD1|2 H 1.7400 . . 312 29 LYS HE1|2 H 2.9542 . . 313 30 GLU HN H 8.1800 . . 314 30 GLU N N 115.5900 . . 315 30 GLU CA C 59.3800 . . 316 30 GLU CB C 29.7610 . . 317 30 GLU CG C 36.8294 . . 318 30 GLU HA H 4.2049 . . 319 30 GLU HB1|2 H 2.0786 . . 320 30 GLU HB1|2 H 1.9079 . . 321 30 GLU HG1|2 H 2.3278 . . 322 31 ASP HN H 7.8700 . . 323 31 ASP N N 114.8400 . . 324 31 ASP CA C 56.2510 . . 325 31 ASP CB C 42.0997 . . 326 31 ASP HA H 4.9900 . . 327 31 ASP HB1|2 H 2.7740 . . 328 31 ASP HB1|2 H 3.1416 . . 329 32 LEU HN H 7.3700 . . 330 32 LEU N N 115.5900 . . 331 32 LEU CA C 54.3359 . . 332 32 LEU CB C 41.4647 . . 333 32 LEU CG C 26.4600 . . 334 32 LEU CD1|2 C 22.4000 . . 335 32 LEU CD1|2 C 26.2900 . . 336 32 LEU HA H 4.5850 . . 337 32 LEU HB1|2 H 2.3229 . . 338 32 LEU HB1|2 H 1.7106 . . 339 32 LEU HG H 1.5200 . . 340 32 LEU HD1#|2# H 0.7450 . . 341 32 LEU HD1#|2# H 0.6900 . . 342 33 GLY HN H 7.2600 . . 343 33 GLY N N 105.8600 . . 344 33 GLY CA C 46.4980 . . 345 33 GLY HA1|2 H 3.8674 . . 346 33 GLY HA1|2 H 3.9528 . . 347 34 ALA HN H 8.4600 . . 348 34 ALA N N 123.3500 . . 349 34 ALA CA C 51.4851 . . 350 34 ALA CB C 20.5511 . . 351 34 ALA HA H 4.5962 . . 352 34 ALA HB# H 1.2508 . . 353 35 ASP HN H 9.2400 . . 354 35 ASP N N 122.5100 . . 355 35 ASP CA C 52.1307 . . 356 35 ASP CB C 41.8246 . . 357 35 ASP HA H 4.9020 . . 358 35 ASP HB1|2 H 3.1981 . . 359 35 ASP HB1|2 H 2.8247 . . 360 36 SER HN H 8.7600 . . 361 36 SER N N 112.7300 . . 362 36 SER CA C 60.9389 . . 363 36 SER CB C 65.5145 . . 364 36 SER HA H 4.1796 . . 365 36 SER HB1|2 H 4.1280 . . 366 37 LEU HN H 7.9900 . . 367 37 LEU N N 124.4100 . . 368 37 LEU CA C 57.6143 . . 369 37 LEU CB C 40.8533 . . 370 37 LEU CG C 27.1738 . . 371 37 LEU CD1|2 C 24.1673 . . 372 37 LEU CD1|2 C 24.3700 . . 373 37 LEU HA H 4.1987 . . 374 37 LEU HB1|2 H 1.7690 . . 375 37 LEU HG H 1.6600 . . 376 37 LEU HD1#|2# H 0.9407 . . 377 37 LEU HD1#|2# H 0.9000 . . 378 38 ASP HN H 8.3455 . . 379 38 ASP N N 119.9904 . . 380 38 ASP CA C 57.4600 . . 381 38 ASP CB C 41.6700 . . 382 38 ASP HA H 4.3200 . . 383 38 ASP HB1|2 H 2.3300 . . 384 38 ASP HB1|2 H 3.1500 . . 385 39 VAL HN H 7.8100 . . 386 39 VAL N N 117.5100 . . 387 39 VAL CA C 67.3524 . . 388 39 VAL CB C 31.1756 . . 389 39 VAL CG1|2 C 23.1085 . . 390 39 VAL CG1|2 C 21.4147 . . 391 39 VAL HA H 3.3027 . . 392 39 VAL HB H 2.1159 . . 393 39 VAL HG1#|2# H 0.8653 . . 394 39 VAL HG1#|2# H 0.8100 . . 395 40 VAL HN H 7.4000 . . 396 40 VAL N N 119.8000 . . 397 40 VAL CA C 66.5814 . . 398 40 VAL CB C 31.7889 . . 399 40 VAL CG1|2 C 22.9102 . . 400 40 VAL CG1|2 C 21.1243 . . 401 40 VAL HA H 3.5869 . . 402 40 VAL HB H 2.2681 . . 403 40 VAL HG1#|2# H 1.1219 . . 404 40 VAL HG1#|2# H 1.0167 . . 405 41 GLU HN H 7.9600 . . 406 41 GLU N N 118.7100 . . 407 41 GLU CA C 59.3822 . . 408 41 GLU CB C 28.8964 . . 409 41 GLU CG C 36.3286 . . 410 41 GLU HA H 4.0812 . . 411 41 GLU HB1|2 H 2.0800 . . 412 41 GLU HG1|2 H 2.5189 . . 413 41 GLU HG1|2 H 2.2700 . . 414 42 LEU HN H 8.5000 . . 415 42 LEU N N 121.9700 . . 416 42 LEU CA C 58.3224 . . 417 42 LEU CB C 41.9720 . . 418 42 LEU CG C 27.0072 . . 419 42 LEU CD1|2 C 25.3810 . . 420 42 LEU HA H 3.8922 . . 421 42 LEU HB1|2 H 1.6805 . . 422 42 LEU HB1|2 H 1.5149 . . 423 42 LEU HG H 1.5600 . . 424 42 LEU HD1#|2# H 0.5404 . . 425 42 LEU HD1#|2# H 0.4900 . . 426 43 VAL HN H 8.4621 . . 427 43 VAL N N 119.9763 . . 428 43 VAL CA C 67.7089 . . 429 43 VAL CB C 30.9822 . . 430 43 VAL CG1|2 C 23.1656 . . 431 43 VAL CG1|2 C 21.7771 . . 432 43 VAL HA H 3.3715 . . 433 43 VAL HB H 2.2236 . . 434 43 VAL HG1#|2# H 0.9200 . . 435 43 VAL HG1#|2# H 0.8200 . . 436 44 MET HN H 7.7613 . . 437 44 MET N N 118.3709 . . 438 44 MET CA C 59.2503 . . 439 44 MET CB C 32.8491 . . 440 44 MET CG C 32.3337 . . 441 44 MET CE C 16.9800 . . 442 44 MET HA H 4.4569 . . 443 44 MET HB1|2 H 2.2610 . . 444 44 MET HG1|2 H 2.8200 . . 445 44 MET HG1|2 H 2.6100 . . 446 44 MET HE# H 2.1200 . . 447 45 GLU HN H 8.0700 . . 448 45 GLU N N 120.0500 . . 449 45 GLU CA C 59.6273 . . 450 45 GLU CB C 29.1870 . . 451 45 GLU CG C 35.9909 . . 452 45 GLU HA H 4.2785 . . 453 45 GLU HB1|2 H 2.2545 . . 454 45 GLU HB1|2 H 2.1605 . . 455 45 GLU HG1|2 H 2.4245 . . 456 45 GLU HG1|2 H 2.5200 . . 457 46 LEU HN H 8.6500 . . 458 46 LEU N N 121.3800 . . 459 46 LEU CA C 58.4227 . . 460 46 LEU CB C 41.3227 . . 461 46 LEU CG C 26.2046 . . 462 46 LEU CD1|2 C 24.1527 . . 463 46 LEU CD1|2 C 24.9277 . . 464 46 LEU HA H 4.2027 . . 465 46 LEU HB1|2 H 2.3200 . . 466 46 LEU HB1|2 H 1.3600 . . 467 46 LEU HG H 0.9800 . . 468 46 LEU HD1#|2# H 1.0264 . . 469 46 LEU HD1#|2# H 0.7700 . . 470 47 GLU HN H 8.5500 . . 471 47 GLU N N 119.0600 . . 472 47 GLU CA C 60.1410 . . 473 47 GLU CB C 30.1427 . . 474 47 GLU CG C 37.1136 . . 475 47 GLU HA H 3.9667 . . 476 47 GLU HB1|2 H 2.2300 . . 477 47 GLU HB1|2 H 2.5800 . . 478 47 GLU HG1|2 H 2.8000 . . 479 47 GLU HG1|2 H 2.2100 . . 480 48 ASP HN H 7.6284 . . 481 48 ASP N N 117.4887 . . 482 48 ASP CA C 56.5762 . . 483 48 ASP CB C 41.2471 . . 484 48 ASP HA H 4.5681 . . 485 48 ASP HB1|2 H 2.8267 . . 486 49 GLU HN H 8.4700 . . 487 49 GLU N N 120.4500 . . 488 49 GLU CA C 58.1193 . . 489 49 GLU CB C 29.4366 . . 490 49 GLU CG C 34.6928 . . 491 49 GLU HA H 4.0107 . . 492 49 GLU HB1|2 H 2.1200 . . 493 49 GLU HB1|2 H 1.7049 . . 494 49 GLU HG1|2 H 1.8900 . . 495 49 GLU HG1|2 H 0.9928 . . 496 50 PHE HN H 8.0600 . . 497 50 PHE N N 112.7100 . . 498 50 PHE CA C 58.4982 . . 499 50 PHE CB C 38.7773 . . 500 50 PHE CD C 132.4400 . . 501 50 PHE CE C 130.1300 . . 502 50 PHE HA H 4.4932 . . 503 50 PHE HB1|2 H 3.4188 . . 504 50 PHE HB1|2 H 2.7690 . . 505 50 PHE HD1|2 H 7.5800 . . 506 50 PHE HE1|2 H 7.1800 . . 507 51 ASP HN H 7.7864 . . 508 51 ASP N N 121.7356 . . 509 51 ASP CA C 54.8934 . . 510 51 ASP CB C 38.9500 . . 511 51 ASP HA H 4.4690 . . 512 51 ASP HB1|2 H 3.1510 . . 513 51 ASP HB1|2 H 2.5310 . . 514 52 MET HN H 8.4500 . . 515 52 MET N N 115.6500 . . 516 52 MET CA C 54.0768 . . 517 52 MET CB C 36.3670 . . 518 52 MET CG C 31.2293 . . 519 52 MET CE C 17.4600 . . 520 52 MET HA H 4.8938 . . 521 52 MET HB1|2 H 2.0900 . . 522 52 MET HB1|2 H 1.9500 . . 523 52 MET HG1|2 H 2.4842 . . 524 52 MET HG1|2 H 2.3380 . . 525 52 MET HE# H 2.0000 . . 526 53 GLU HN H 8.3645 . . 527 53 GLU N N 120.2770 . . 528 53 GLU CA C 55.1955 . . 529 53 GLU CB C 31.5860 . . 530 53 GLU CG C 36.1564 . . 531 53 GLU HA H 4.6500 . . 532 53 GLU HB1|2 H 2.1193 . . 533 53 GLU HB1|2 H 2.2074 . . 534 53 GLU HG1|2 H 1.9013 . . 535 54 ILE HN H 9.5600 . . 536 54 ILE N N 127.8600 . . 537 54 ILE CA C 60.7349 . . 538 54 ILE CB C 38.5086 . . 539 54 ILE CG1 C 27.4838 . . 540 54 ILE CG2 C 16.0969 . . 541 54 ILE CD C 12.5051 . . 542 54 ILE HA H 4.2891 . . 543 54 ILE HB H 1.5583 . . 544 54 ILE HG11|12 H 1.5000 . . 545 54 ILE HG11|12 H 0.9600 . . 546 54 ILE HG2# H 0.5700 . . 547 54 ILE HD# H 0.5830 . . 548 55 SER HN H 9.0500 . . 549 55 SER N N 125.4900 . . 550 55 SER CA C 57.9456 . . 551 55 SER CB C 64.4839 . . 552 55 SER HA H 4.4000 . . 553 55 SER HB1|2 H 4.3000 . . 554 55 SER HB1|2 H 4.0900 . . 555 56 ASP HN H 8.8600 . . 556 56 ASP N N 122.7500 . . 557 56 ASP CA C 57.7270 . . 558 56 ASP CB C 39.7000 . . 559 56 ASP HA H 4.3084 . . 560 56 ASP HB1|2 H 2.7206 . . 561 56 ASP HB1|2 H 2.6110 . . 562 57 GLU HN H 8.5800 . . 563 57 GLU N N 118.5700 . . 564 57 GLU CA C 59.3360 . . 565 57 GLU CB C 29.2075 . . 566 57 GLU CG C 36.5248 . . 567 57 GLU HA H 4.0198 . . 568 57 GLU HB1|2 H 1.9606 . . 569 57 GLU HG1|2 H 2.3009 . . 570 58 ASP HN H 7.6649 . . 571 58 ASP N N 120.2465 . . 572 58 ASP CA C 56.6600 . . 573 58 ASP CB C 40.0926 . . 574 58 ASP HA H 4.4435 . . 575 58 ASP HB1|2 H 2.7022 . . 576 58 ASP HB1|2 H 2.2713 . . 577 59 ALA HN H 8.6172 . . 578 59 ALA N N 123.3045 . . 579 59 ALA CA C 54.9506 . . 580 59 ALA CB C 18.2274 . . 581 59 ALA HA H 3.6719 . . 582 59 ALA HB# H 1.3933 . . 583 60 GLU HN H 7.4900 . . 584 60 GLU N N 115.3200 . . 585 60 GLU CA C 57.9956 . . 586 60 GLU CB C 29.6806 . . 587 60 GLU CG C 36.0403 . . 588 60 GLU HA H 4.0250 . . 589 60 GLU HB1|2 H 2.0862 . . 590 60 GLU HG1|2 H 2.3482 . . 591 60 GLU HG1|2 H 2.4254 . . 592 61 LYS HN H 7.1900 . . 593 61 LYS N N 115.6200 . . 594 61 LYS CA C 55.8446 . . 595 61 LYS CB C 32.7785 . . 596 61 LYS CG C 25.1594 . . 597 61 LYS CD C 29.3103 . . 598 61 LYS CE C 42.2884 . . 599 61 LYS HA H 4.3166 . . 600 61 LYS HB1|2 H 2.1055 . . 601 61 LYS HB1|2 H 1.8855 . . 602 61 LYS HG1|2 H 1.6802 . . 603 61 LYS HG1|2 H 1.7000 . . 604 61 LYS HD1|2 H 1.4872 . . 605 61 LYS HE1|2 H 3.0407 . . 606 62 ILE HN H 7.3100 . . 607 62 ILE N N 121.6100 . . 608 62 ILE CA C 61.8550 . . 609 62 ILE CB C 36.7340 . . 610 62 ILE CG1 C 27.5037 . . 611 62 ILE CG2 C 17.3997 . . 612 62 ILE CD C 12.2600 . . 613 62 ILE HA H 3.9587 . . 614 62 ILE HB H 1.9630 . . 615 62 ILE HG11|12 H 1.6966 . . 616 62 ILE HG11|12 H 0.7500 . . 617 62 ILE HG2# H 0.8826 . . 618 62 ILE HD# H 0.4184 . . 619 63 ALA HN H 9.0700 . . 620 63 ALA N N 130.8100 . . 621 63 ALA CA C 52.8011 . . 622 63 ALA CB C 21.5856 . . 623 63 ALA HA H 4.8220 . . 624 63 ALA HB# H 1.6000 . . 625 64 THR HN H 8.4300 . . 626 64 THR N N 110.2500 . . 627 64 THR CA C 58.1844 . . 628 64 THR CB C 73.5000 . . 629 64 THR 2 2 21.2065 . . 630 64 THR HA H 5.0110 . . 631 64 THR HB H 4.2780 . . 632 64 THR 2# 2 1.0070 . . 633 65 VAL HN H 7.9468 . . 634 65 VAL N N 120.6196 . . 635 65 VAL CA C 66.6823 . . 636 65 VAL CB C 31.4222 . . 637 65 VAL CG1|2 C 23.1125 . . 638 65 VAL CG1|2 C 20.3657 . . 639 65 VAL HA H 3.2987 . . 640 65 VAL HB H 2.4422 . . 641 65 VAL HG1#|2# H 0.7921 . . 642 65 VAL HG1#|2# H 0.5854 . . 643 66 GLY HN H 9.3800 . . 644 66 GLY N N 107.7600 . . 645 66 GLY CA C 47.4230 . . 646 66 GLY HA1|2 H 3.6930 . . 647 66 GLY HA1|2 H 3.8946 . . 648 67 ASP HN H 8.2200 . . 649 67 ASP N N 122.1100 . . 650 67 ASP CA C 57.2803 . . 651 67 ASP CB C 41.8680 . . 652 67 ASP HA H 4.5089 . . 653 67 ASP HB1|2 H 2.8687 . . 654 67 ASP HB1|2 H 3.2668 . . 655 68 ALA HN H 7.7817 . . 656 68 ALA N N 122.8589 . . 657 68 ALA CA C 55.4620 . . 658 68 ALA CB C 16.7754 . . 659 68 ALA HA H 4.0200 . . 660 68 ALA HB# H 1.5700 . . 661 69 VAL HN H 8.3000 . . 662 69 VAL N N 117.1200 . . 663 69 VAL CA C 66.8134 . . 664 69 VAL CB C 31.8068 . . 665 69 VAL CG1|2 C 23.1962 . . 666 69 VAL CG1|2 C 20.8322 . . 667 69 VAL HA H 3.2930 . . 668 69 VAL HB H 2.0770 . . 669 69 VAL HG1#|2# H 0.9200 . . 670 69 VAL HG1#|2# H 0.8955 . . 671 70 ASN HN H 8.7100 . . 672 70 ASN N N 117.2600 . . 673 70 ASN CA C 55.9496 . . 674 70 ASN CB C 38.0840 . . 675 70 ASN HA H 4.3744 . . 676 70 ASN HB1|2 H 2.7562 . . 677 70 ASN HB1|2 H 2.8747 . . 678 70 ASN ND2 N 111.9500 . . 679 70 ASN 21|HD22 2 7.5600 . . 680 70 ASN 21|HD22 2 6.8100 . . 681 71 TYR HN H 7.9519 . . 682 71 TYR N N 120.2556 . . 683 71 TYR CA C 62.1013 . . 684 71 TYR CB C 38.1900 . . 685 71 TYR CD C 132.3000 . . 686 71 TYR CE C 118.2000 . . 687 71 TYR HA H 4.0052 . . 688 71 TYR HB1|2 H 3.0828 . . 689 71 TYR HD1|2 H 6.9200 . . 690 71 TYR HE1|2 H 6.7300 . . 691 72 ILE HN H 7.8600 . . 692 72 ILE N N 119.0300 . . 693 72 ILE CA C 64.5374 . . 694 72 ILE CB C 38.1800 . . 695 72 ILE CG1 C 28.8876 . . 696 72 ILE CG2 C 17.4149 . . 697 72 ILE CD C 14.0131 . . 698 72 ILE HA H 3.3770 . . 699 72 ILE HB H 1.5290 . . 700 72 ILE HG11|12 H 1.5300 . . 701 72 ILE HG11|12 H 0.8300 . . 702 72 ILE HG2# H 0.1800 . . 703 72 ILE HD# H 0.2000 . . 704 73 GLN HN H 8.3600 . . 705 73 GLN N N 117.0800 . . 706 73 GLN CA C 58.0560 . . 707 73 GLN CB C 29.0270 . . 708 73 GLN CG C 34.8047 . . 709 73 GLN HA H 4.0290 . . 710 73 GLN HB1|2 H 2.1300 . . 711 73 GLN HB1|2 H 2.0800 . . 712 73 GLN HG1|2 H 2.5300 . . 713 73 GLN HG1|2 H 2.3500 . . 714 73 GLN NE2 N 110.4100 . . 715 73 GLN HE21|22 H 7.3200 . . 716 73 GLN HE21|22 H 6.8200 . . 717 74 ASN HN H 7.7704 . . 718 74 ASN N N 116.2448 . . 719 74 ASN CA C 53.9296 . . 720 74 ASN CB C 38.7038 . . 721 74 ASN HA H 4.6838 . . 722 74 ASN HB1|2 H 2.7695 . . 723 74 ASN ND2 N 112.3800 . . 724 74 ASN HD21|22 H 7.5000 . . 725 74 ASN HD21|22 H 6.8100 . . 726 75 GLN HN H 7.5300 . . 727 75 GLN N N 118.6100 . . 728 75 GLN CA C 55.3476 . . 729 75 GLN CB C 28.9238 . . 730 75 GLN CG C 33.4702 . . 731 75 GLN HA H 4.2820 . . 732 75 GLN HB1|2 H 2.2197 . . 733 75 GLN HB1|2 H 1.8918 . . 734 75 GLN HG1|2 H 2.3252 . . 735 75 GLN HG1|2 H 2.2300 . . 736 75 GLN NE2 N 113.3500 . . 737 75 GLN HE21|22 H 7.0800 . . 738 75 GLN HE21|22 H 6.6900 . . 739 76 GLN HN H 7.6300 . . 740 76 GLN N N 125.3500 . . 741 76 GLN CA C 57.3795 . . 742 76 GLN CB C 30.2137 . . 743 76 GLN CG C 34.2900 . . 744 76 GLN HA H 4.1300 . . 745 76 GLN HB1|2 H 2.1700 . . 746 76 GLN HB1|2 H 1.9900 . . 747 76 GLN HG1|2 H 2.3900 . . 748 76 GLN NE2 N 111.8800 . . 749 76 GLN HE21|22 H 7.4200 . . 750 76 GLN HE21|22 H 6.8400 . . stop_
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