1 1 GLU HA H 4.33 . 1 2 1 GLU HB2 H 1.88 . 2 3 1 GLU HB3 H 2.04 . 2 4 1 GLU HG2 H 2.23 . 2 5 1 GLU HG3 H 2.23 . 2 6 1 GLU CA C 56.2 . 1 7 1 GLU CB C 30.1 . 1 8 1 GLU CG C 36.0 . 1 9 2 ASP H H 8.56 . 1 10 2 ASP HA H 4.85 . 1 11 2 ASP HB2 H 2.52 . 2 12 2 ASP HB3 H 2.76 . 2 13 2 ASP CA C 52.2 . 1 14 2 ASP CB C 40.9 . 1 15 2 ASP N N 123.0 . 1 16 3 PRO HA H 4.38 . 1 17 3 PRO HB2 H 1.92 . 2 18 3 PRO HB3 H 2.29 . 2 19 3 PRO HG2 H 2.00 . 2 20 3 PRO HG3 H 2.00 . 2 21 3 PRO HD2 H 3.78 . 2 22 3 PRO HD3 H 3.86 . 2 23 3 PRO CA C 63.5 . 1 24 3 PRO CB C 32.1 . 1 25 3 PRO CG C 27.1 . 1 26 3 PRO CD C 50.7 . 1 27 4 GLU H H 8.41 . 1 28 4 GLU HA H 4.25 . 1 29 4 GLU HB2 H 1.89 . 2 30 4 GLU HB3 H 2.06 . 2 31 4 GLU HG2 H 2.19 . 2 32 4 GLU HG3 H 2.29 . 2 33 4 GLU CA C 55.9 . 1 34 4 GLU CB C 30.1 . 1 35 4 GLU CG C 36.2 . 1 36 4 GLU N N 118.3 . 1 37 5 ASP H H 8.03 . 1 38 5 ASP HA H 4.73 . 1 39 5 ASP HB2 H 2.84 . 2 40 5 ASP HB3 H 2.82 . 2 41 5 ASP CA C 52.6 . 1 42 5 ASP CB C 41.7 . 1 43 5 ASP N N 123.7 . 1 44 6 PRO HA H 3.94 . 1 45 6 PRO HB2 H 0.94 . 2 46 6 PRO HB3 H 1.61 . 2 47 6 PRO HG2 H 1.77 . 2 48 6 PRO HG3 H 1.84 . 2 49 6 PRO HD2 H 3.75 . 2 50 6 PRO HD3 H 3.88 . 2 51 6 PRO CA C 64.9 . 1 52 6 PRO CB C 31.0 . 1 53 6 PRO CG C 27.3 . 1 54 6 PRO CD C 50.8 . 1 55 7 PHE H H 8.13 . 1 56 7 PHE HA H 4.22 . 1 57 7 PHE HB2 H 3.05 . 2 58 7 PHE HB3 H 3.31 . 2 59 7 PHE HD1 H 7.33 . 3 60 7 PHE HD2 H 7.33 . 3 61 7 PHE HE1 H 7.37 . 3 62 7 PHE HE2 H 7.37 . 3 63 7 PHE HZ H 7.32 . 1 64 7 PHE CA C 60.8 . 1 65 7 PHE CB C 38.3 . 1 66 7 PHE CD1 C 131.9 . 1 67 7 PHE CE1 C 131.2 . 1 68 7 PHE CZ C 129.5 . 1 69 7 PHE N N 117.2 . 1 70 8 THR H H 7.83 . 1 71 8 THR HA H 3.71 . 1 72 8 THR HB H 4.25 . 1 73 8 THR HG2 H 1.19 . 1 74 8 THR CA C 66.2 . 1 75 8 THR CB C 68.3 . 1 76 8 THR CG2 C 21.8 . 1 77 8 THR N N 115.7 . 1 78 9 ARG H H 7.30 . 1 79 9 ARG HA H 3.84 . 1 80 9 ARG HB2 H 1.69 . 2 81 9 ARG HB3 H 1.83 . 2 82 9 ARG HG2 H 1.58 . 2 83 9 ARG HG3 H 1.65 . 2 84 9 ARG HD2 H 3.04 . 2 85 9 ARG HD3 H 3.19 . 2 86 9 ARG HE H 6.71 . 1 87 9 ARG CA C 59.7 . 1 88 9 ARG CB C 30.4 . 1 89 9 ARG CG C 28.0 . 1 90 9 ARG CD C 43.7 . 1 91 9 ARG N N 121.4 . 1 92 9 ARG NE N 85.1 . 1 93 10 TYR H H 8.48 . 1 94 10 TYR HA H 3.80 . 1 95 10 TYR HB2 H 2.95 . 2 96 10 TYR HB3 H 3.13 . 2 97 10 TYR HD1 H 7.05 . 3 98 10 TYR HD2 H 7.05 . 3 99 10 TYR HE1 H 6.78 . 3 100 10 TYR HE2 H 6.78 . 3 101 10 TYR CA C 61.4 . 1 102 10 TYR CB C 38.3 . 1 103 10 TYR CD1 C 133.3 . 1 104 10 TYR CE1 C 117.9 . 1 105 10 TYR N N 121.7 . 1 106 11 ALA H H 8.50 . 1 107 11 ALA HA H 3.70 . 1 108 11 ALA HB H 1.14 . 1 109 11 ALA CA C 54.4 . 1 110 11 ALA CB C 17.3 . 1 111 11 ALA N N 121.7 . 1 112 12 LEU H H 7.69 . 1 113 12 LEU HA H 3.92 . 1 114 12 LEU HB2 H 1.61 . 2 115 12 LEU HB3 H 1.62 . 2 116 12 LEU HG H 1.42 . 1 117 12 LEU HD1 H 0.73 . 2 118 12 LEU HD2 H 0.83 . 2 119 12 LEU CA C 57.1 . 1 120 12 LEU CB C 41.5 . 1 121 12 LEU CG C 26.4 . 1 122 12 LEU CD1 C 23.3 . 2 123 12 LEU CD2 C 24.5 . 2 124 12 LEU N N 120.9 . 1 125 13 ALA H H 8.01 . 1 126 13 ALA HA H 3.50 . 1 127 13 ALA HB H 0.55 . 1 128 13 ALA CA C 55.4 . 1 129 13 ALA CB C 17.4 . 1 130 13 ALA N N 123.0 . 1 131 14 GLN H H 7.66 . 1 132 14 GLN HA H 3.91 . 1 133 14 GLN HB2 H 1.86 . 2 134 14 GLN HB3 H 1.89 . 2 135 14 GLN HG2 H 1.75 . 2 136 14 GLN HG3 H 2.01 . 2 137 14 GLN HE21 H 5.54 . 2 138 14 GLN HE22 H 5.21 . 2 139 14 GLN CA C 58.2 . 1 140 14 GLN CB C 27.7 . 1 141 14 GLN CG C 32.2 . 1 142 14 GLN N N 114.0 . 1 143 14 GLN NE2 N 105.5 . 1 144 15 GLU H H 7.90 . 1 145 15 GLU HA H 3.90 . 1 146 15 GLU HB2 H 1.96 . 2 147 15 GLU HB3 H 1.96 . 2 148 15 GLU HG2 H 2.10 . 2 149 15 GLU HG3 H 2.10 . 2 150 15 GLU CA C 58.8 . 1 151 15 GLU CB C 28.6 . 1 152 15 GLU CG C 35.5 . 1 153 15 GLU N N 122.4 . 1 154 16 HIS H H 8.22 . 1 155 16 HIS HA H 4.52 . 1 156 16 HIS HB2 H 2.97 . 2 157 16 HIS HB3 H 3.21 . 2 158 16 HIS HD2 H 6.41 . 1 159 16 HIS HE1 H 7.64 . 1 160 16 HIS CA C 59.7 . 1 161 16 HIS CB C 29.6 . 1 162 16 HIS CD2 C 118.6 . 1 163 16 HIS CE1 C 139.2 . 1 164 16 HIS N N 119.1 . 1 165 17 LEU H H 8.09 . 1 166 17 LEU HA H 3.87 . 1 167 17 LEU HB2 H 1.72 . 2 168 17 LEU HB3 H 1.72 . 2 169 17 LEU HG H 1.65 . 1 170 17 LEU HD1 H 0.97 . 2 171 17 LEU HD2 H 0.92 . 2 172 17 LEU CA C 57.9 . 1 173 17 LEU CB C 41.4 . 1 174 17 LEU CG C 26.5 . 1 175 17 LEU CD1 C 24.9 . 2 176 17 LEU CD2 C 24.4 . 2 177 17 LEU N N 120.5 . 1 178 18 LYS H H 7.96 . 1 179 18 LYS HA H 4.03 . 1 180 18 LYS HB2 H 1.77 . 2 181 18 LYS HB3 H 1.77 . 2 182 18 LYS HG2 H 1.26 . 2 183 18 LYS HG3 H 1.45 . 2 184 18 LYS HD2 H 1.56 . 2 185 18 LYS HD3 H 1.58 . 2 186 18 LYS HE2 H 2.85 . 2 187 18 LYS HE3 H 2.84 . 2 188 18 LYS CA C 58.4 . 1 189 18 LYS CB C 31.8 . 1 190 18 LYS CG C 24.7 . 1 191 18 LYS CD C 28.9 . 1 192 18 LYS CE C 41.8 . 1 193 18 LYS N N 121.0 . 1 194 19 HIS H H 7.41 . 1 195 19 HIS HA H 4.72 . 1 196 19 HIS HB2 H 3.04 . 2 197 19 HIS HB3 H 3.58 . 2 198 19 HIS HD2 H 7.24 . 1 199 19 HIS CA C 54.7 . 1 200 19 HIS CB C 28.5 . 1 201 19 HIS CD2 C 120.0 . 1 202 19 HIS N N 115.8 . 1 203 20 ASP H H 8.01 . 1 204 20 ASP HA H 4.37 . 1 205 20 ASP HB2 H 2.61 . 2 206 20 ASP HB3 H 3.14 . 2 207 20 ASP CA C 55.6 . 1 208 20 ASP CB C 39.6 . 1 209 20 ASP N N 115.9 . 1 210 21 ASN H H 8.45 . 1 211 21 ASN HA H 5.13 . 1 212 21 ASN HB2 H 2.65 . 2 213 21 ASN HB3 H 3.06 . 2 214 21 ASN HD21 H 6.78 . 2 215 21 ASN HD22 H 7.82 . 2 216 21 ASN CA C 50.6 . 1 217 21 ASN CB C 37.0 . 1 218 21 ASN N N 118.7 . 1 219 21 ASN ND2 N 112.2 . 1 220 22 ALA H H 8.01 . 1 221 22 ALA HA H 3.84 . 1 222 22 ALA HB H 1.41 . 1 223 22 ALA CA C 55.3 . 1 224 22 ALA CB C 18.3 . 1 225 22 ALA N N 123.3 . 1 226 23 SER H H 8.67 . 1 227 23 SER HA H 4.07 . 1 228 23 SER HB2 H 3.89 . 2 229 23 SER HB3 H 3.87 . 2 230 23 SER CA C 61.8 . 1 231 23 SER CB C 61.9 . 1 232 23 SER N N 112.5 . 1 233 24 ARG H H 7.23 . 1 234 24 ARG HA H 3.96 . 1 235 24 ARG HB2 H 0.90 . 2 236 24 ARG HB3 H 1.13 . 2 237 24 ARG HG2 H 1.03 . 2 238 24 ARG HG3 H 1.16 . 2 239 24 ARG HD2 H 2.79 . 2 240 24 ARG HD3 H 2.93 . 2 241 24 ARG CA C 57.0 . 1 242 24 ARG CB C 29.1 . 1 243 24 ARG CG C 25.9 . 1 244 24 ARG CD C 42.2 . 1 245 24 ARG N N 122.3 . 1 246 25 ALA H H 7.34 . 1 247 25 ALA HA H 3.57 . 1 248 25 ALA HB H 1.25 . 1 249 25 ALA CA C 55.3 . 1 250 25 ALA CB C 18.7 . 1 251 25 ALA N N 120.2 . 1 252 26 LEU H H 8.42 . 1 253 26 LEU HA H 3.80 . 1 254 26 LEU HB2 H 1.47 . 2 255 26 LEU HB3 H 1.86 . 2 256 26 LEU HG H 1.37 . 1 257 26 LEU HD1 H 0.66 . 2 258 26 LEU HD2 H 0.87 . 2 259 26 LEU CA C 58.3 . 1 260 26 LEU CB C 41.8 . 1 261 26 LEU CG C 26.4 . 1 262 26 LEU CD1 C 24.3 . 2 263 26 LEU CD2 C 25.5 . 2 264 26 LEU N N 116.5 . 1 265 27 ALA H H 7.19 . 1 266 27 ALA HA H 4.12 . 1 267 27 ALA HB H 1.41 . 1 268 27 ALA CA C 54.7 . 1 269 27 ALA CB C 18.0 . 1 270 27 ALA N N 118.2 . 1 271 28 LEU H H 7.50 . 1 272 28 LEU HA H 4.07 . 1 273 28 LEU HB2 H 1.67 . 2 274 28 LEU HB3 H 1.11 . 2 275 28 LEU HG H 1.63 . 1 276 28 LEU HD1 H 0.74 . 2 277 28 LEU HD2 H 0.86 . 2 278 28 LEU CA C 57.6 . 1 279 28 LEU CB C 43.1 . 1 280 28 LEU CG C 27.0 . 1 281 28 LEU CD1 C 26.1 . 2 282 28 LEU CD2 C 23.1 . 2 283 28 LEU N N 118.3 . 1 284 29 PHE H H 8.69 . 1 285 29 PHE HA H 4.63 . 1 286 29 PHE HB2 H 3.03 . 2 287 29 PHE HB3 H 3.08 . 2 288 29 PHE HD1 H 7.00 . 3 289 29 PHE HD2 H 7.00 . 3 290 29 PHE HE1 H 7.01 . 3 291 29 PHE HE2 H 7.01 . 3 292 29 PHE HZ H 6.72 . 1 293 29 PHE CA C 58.7 . 1 294 29 PHE CB C 40.3 . 1 295 29 PHE CD1 C 130.0 . 1 296 29 PHE CE1 C 130.7 . 1 297 29 PHE CZ C 128.8 . 1 298 29 PHE N N 119.0 . 1 299 30 GLU H H 8.99 . 1 300 30 GLU HA H 3.79 . 1 301 30 GLU HB2 H 1.88 . 2 302 30 GLU HB3 H 2.17 . 2 303 30 GLU HG2 H 2.18 . 2 304 30 GLU HG3 H 2.67 . 2 305 30 GLU CA C 60.1 . 1 306 30 GLU CB C 29.1 . 1 307 30 GLU CG C 37.9 . 1 308 30 GLU N N 117.4 . 1 309 31 GLU H H 7.83 . 1 310 31 GLU HA H 4.16 . 1 311 31 GLU HB2 H 2.13 . 2 312 31 GLU HB3 H 2.21 . 2 313 31 GLU HG2 H 2.36 . 2 314 31 GLU HG3 H 2.36 . 2 315 31 GLU CA C 58.8 . 1 316 31 GLU CB C 29.9 . 1 317 31 GLU CG C 36.6 . 1 318 31 GLU N N 119.5 . 1 319 32 LEU H H 7.92 . 1 320 32 LEU HA H 4.13 . 1 321 32 LEU HB2 H 1.63 . 2 322 32 LEU HB3 H 2.28 . 2 323 32 LEU HG H 1.66 . 1 324 32 LEU HD1 H 0.99 . 2 325 32 LEU HD2 H 0.88 . 2 326 32 LEU CA C 58.2 . 1 327 32 LEU CB C 43.0 . 1 328 32 LEU CG C 28.3 . 1 329 32 LEU CD1 C 24.4 . 2 330 32 LEU CD2 C 24.7 . 2 331 32 LEU N N 122.0 . 1 332 33 VAL H H 7.46 . 1 333 33 VAL HA H 3.59 . 1 334 33 VAL HB H 2.03 . 1 335 33 VAL HG1 H 0.92 . 2 336 33 VAL HG2 H 0.75 . 2 337 33 VAL CA C 65.8 . 1 338 33 VAL CB C 31.5 . 1 339 33 VAL CG1 C 21.5 . 2 340 33 VAL CG2 C 22.1 . 2 341 33 VAL N N 116.0 . 1 342 34 GLU H H 7.21 . 1 343 34 GLU HA H 4.13 . 1 344 34 GLU HB2 H 2.20 . 2 345 34 GLU HB3 H 2.21 . 2 346 34 GLU HG2 H 2.21 . 2 347 34 GLU HG3 H 2.37 . 2 348 34 GLU CA C 58.5 . 1 349 34 GLU CB C 29.9 . 1 350 34 GLU CG C 36.0 . 1 351 34 GLU N N 117.4 . 1 352 35 THR H H 9.10 . 1 353 35 THR HA H 4.18 . 1 354 35 THR HB H 4.31 . 1 355 35 THR HG2 H 1.29 . 1 356 35 THR CA C 63.9 . 1 357 35 THR CB C 69.3 . 1 358 35 THR CG2 C 20.8 . 1 359 35 THR N N 109.9 . 1 360 36 ASP H H 8.63 . 1 361 36 ASP HA H 5.30 . 1 362 36 ASP HB2 H 2.67 . 2 363 36 ASP HB3 H 2.52 . 2 364 36 ASP CA C 52.7 . 1 365 36 ASP CB C 42.4 . 1 366 36 ASP N N 122.8 . 1 367 37 PRO HA H 4.56 . 1 368 37 PRO HB2 H 2.71 . 2 369 37 PRO HB3 H 2.03 . 2 370 37 PRO HG2 H 2.09 . 2 371 37 PRO HG3 H 1.94 . 2 372 37 PRO HD2 H 3.34 . 2 373 37 PRO HD3 H 3.67 . 2 374 37 PRO CA C 64.4 . 1 375 37 PRO CB C 31.1 . 1 376 37 PRO CG C 27.1 . 1 377 37 PRO CD C 50.4 . 1 378 38 ASP H H 8.63 . 1 379 38 ASP HA H 4.57 . 1 380 38 ASP HB2 H 2.73 . 2 381 38 ASP HB3 H 2.73 . 2 382 38 ASP CA C 53.8 . 1 383 38 ASP CB C 39.5 . 1 384 38 ASP N N 113.7 . 1 385 39 TYR H H 8.11 . 1 386 39 TYR HA H 4.54 . 1 387 39 TYR HB2 H 2.84 . 2 388 39 TYR HB3 H 3.47 . 2 389 39 TYR HD1 H 7.25 . 3 390 39 TYR HD2 H 7.25 . 3 391 39 TYR HE1 H 6.35 . 3 392 39 TYR HE2 H 6.35 . 3 393 39 TYR CA C 58.5 . 1 394 39 TYR CB C 36.5 . 1 395 39 TYR CD1 C 133.4 . 1 396 39 TYR CE1 C 117.4 . 1 397 39 TYR N N 123.7 . 1 398 40 VAL H H 7.88 . 1 399 40 VAL HA H 3.77 . 1 400 40 VAL HB H 1.87 . 1 401 40 VAL HG1 H 0.81 . 2 402 40 VAL HG2 H 0.92 . 2 403 40 VAL CA C 65.0 . 1 404 40 VAL CB C 32.5 . 1 405 40 VAL CG1 C 20.3 . 2 406 40 VAL CG2 C 23.1 . 2 407 40 VAL N N 128.1 . 1 408 41 GLY HA2 H 3.41 . 2 409 41 GLY H H 7.53 . 1 410 41 GLY HA3 H 3.88 . 2 411 41 GLY CA C 46.4 . 1 412 41 GLY N N 105.9 . 1 413 42 THR H H 7.15 . 1 414 42 THR HA H 3.58 . 1 415 42 THR HB H 3.27 . 1 416 42 THR HG1 H 5.58 . 1 417 42 THR HG2 H 1.08 . 1 418 42 THR CA C 65.6 . 1 419 42 THR CB C 68.9 . 1 420 42 THR CG2 C 25.5 . 1 421 42 THR N N 111.9 . 1 422 43 TYR H H 7.04 . 1 423 43 TYR HA H 3.46 . 1 424 43 TYR HB2 H 2.93 . 2 425 43 TYR HB3 H 3.02 . 2 426 43 TYR HD1 H 7.56 . 3 427 43 TYR HD2 H 7.56 . 3 428 43 TYR HE1 H 6.88 . 3 429 43 TYR HE2 H 6.88 . 3 430 43 TYR CA C 64.1 . 1 431 43 TYR CB C 38.3 . 1 432 43 TYR CD1 C 132.9 . 1 433 43 TYR CE1 C 118.4 . 1 434 43 TYR N N 113.5 . 1 435 44 TYR H H 9.77 . 1 436 44 TYR HA H 3.99 . 1 437 44 TYR HB2 H 2.54 . 2 438 44 TYR HB3 H 3.01 . 2 439 44 TYR HD1 H 6.03 . 3 440 44 TYR HD2 H 6.03 . 3 441 44 TYR HE1 H 6.54 . 3 442 44 TYR HE2 H 6.54 . 3 443 44 TYR CA C 61.9 . 1 444 44 TYR CB C 38.8 . 1 445 44 TYR CD1 C 132.1 . 1 446 44 TYR CE1 C 118.3 . 1 447 44 TYR N N 119.8 . 1 448 45 HIS H H 6.38 . 1 449 45 HIS HA H 3.77 . 1 450 45 HIS HB2 H 2.17 . 2 451 45 HIS HB3 H 2.66 . 2 452 45 HIS HD2 H 7.82 . 1 453 45 HIS HE1 H 7.95 . 1 454 45 HIS CA C 58.5 . 1 455 45 HIS CB C 31.6 . 1 456 45 HIS CD2 C 120.3 . 1 457 45 HIS CE1 C 139.2 . 1 458 45 HIS N N 114.5 . 1 459 46 LEU H H 8.36 . 1 460 46 LEU HA H 3.66 . 1 461 46 LEU HB2 H 0.79 . 2 462 46 LEU HB3 H 1.48 . 2 463 46 LEU HG H 1.17 . 1 464 46 LEU HD1 H 0.39 . 2 465 46 LEU HD2 H 0.70 . 2 466 46 LEU CA C 57.1 . 1 467 46 LEU CB C 40.8 . 1 468 46 LEU CG C 26.7 . 1 469 46 LEU CD1 C 21.6 . 2 470 46 LEU CD2 C 25.8 . 2 471 46 LEU N N 121.1 . 1 472 47 GLY HA2 H 3.35 . 2 473 47 GLY H H 8.44 . 1 474 47 GLY HA3 H 3.53 . 2 475 47 GLY CA C 47.2 . 1 476 47 GLY N N 106.5 . 1 477 48 LYS H H 7.97 . 1 478 48 LYS HA H 3.80 . 1 479 48 LYS HB2 H 1.50 . 2 480 48 LYS HB3 H 1.83 . 2 481 48 LYS HG2 H 0.85 . 2 482 48 LYS HG3 H 1.17 . 2 483 48 LYS HD2 H 1.36 . 2 484 48 LYS HD3 H 1.51 . 2 485 48 LYS HE2 H 2.55 . 2 486 48 LYS HE3 H 2.81 . 2 487 48 LYS CA C 58.2 . 1 488 48 LYS CB C 31.6 . 1 489 48 LYS CG C 23.4 . 1 490 48 LYS CD C 28.2 . 1 491 48 LYS CE C 41.8 . 1 492 48 LYS N N 120.5 . 1 493 49 LEU H H 7.80 . 1 494 49 LEU HA H 4.17 . 1 495 49 LEU HB2 H 1.61 . 2 496 49 LEU HB3 H 1.86 . 2 497 49 LEU HG H 1.60 . 1 498 49 LEU HD1 H 0.99 . 2 499 49 LEU HD2 H 0.96 . 2 500 49 LEU CA C 57.5 . 1 501 49 LEU CB C 41.0 . 1 502 49 LEU CG C 27.0 . 1 503 49 LEU CD1 C 23.5 . 2 504 49 LEU CD2 C 26.2 . 2 505 49 LEU N N 124.0 . 1 506 50 TYR H H 8.61 . 1 507 50 TYR HA H 4.42 . 1 508 50 TYR HB2 H 2.91 . 2 509 50 TYR HB3 H 3.39 . 2 510 50 TYR HD1 H 6.54 . 3 511 50 TYR HD2 H 6.54 . 3 512 50 TYR HE1 H 6.72 . 3 513 50 TYR HE2 H 6.72 . 3 514 50 TYR CA C 59.6 . 1 515 50 TYR CB C 35.6 . 1 516 50 TYR CD1 C 129.6 . 1 517 50 TYR CE1 C 118.9 . 1 518 50 TYR N N 119.0 . 1 519 51 GLU H H 8.41 . 1 520 51 GLU HA H 3.76 . 1 521 51 GLU HB2 H 2.24 . 2 522 51 GLU HB3 H 2.16 . 2 523 51 GLU HG2 H 1.89 . 2 524 51 GLU HG3 H 2.65 . 2 525 51 GLU CA C 61.6 . 1 526 51 GLU CB C 29.8 . 1 527 51 GLU CG C 38.4 . 1 528 51 GLU N N 118.6 . 1 529 52 ARG H H 7.91 . 1 530 52 ARG HA H 4.15 . 1 531 52 ARG HB2 H 2.17 . 2 532 52 ARG HB3 H 2.10 . 2 533 52 ARG HG2 H 1.67 . 2 534 52 ARG HG3 H 1.90 . 2 535 52 ARG HD2 H 3.13 . 2 536 52 ARG HD3 H 3.21 . 2 537 52 ARG CA C 58.6 . 1 538 52 ARG CB C 29.6 . 1 539 52 ARG CG C 26.9 . 1 540 52 ARG CD C 43.8 . 1 541 52 ARG N N 122.2 . 1 542 53 LEU H H 7.74 . 1 543 53 LEU HA H 4.40 . 1 544 53 LEU HB2 H 1.84 . 2 545 53 LEU HB3 H 1.77 . 2 546 53 LEU HG H 1.84 . 1 547 53 LEU HD1 H 0.91 . 2 548 53 LEU HD2 H 0.82 . 2 549 53 LEU CA C 54.1 . 1 550 53 LEU CB C 41.4 . 1 551 53 LEU CG C 26.3 . 1 552 53 LEU CD1 C 26.5 . 2 553 53 LEU CD2 C 21.6 . 2 554 53 LEU N N 119.4 . 1 555 54 ASP H H 8.09 . 1 556 54 ASP HA H 4.41 . 1 557 54 ASP HB2 H 2.69 . 2 558 54 ASP HB3 H 3.19 . 2 559 54 ASP CA C 55.5 . 1 560 54 ASP CB C 38.9 . 1 561 54 ASP N N 116.3 . 1 562 55 ARG H H 8.42 . 1 563 55 ARG HA H 4.68 . 1 564 55 ARG HB2 H 1.45 . 2 565 55 ARG HB3 H 2.19 . 2 566 55 ARG HG2 H 1.55 . 2 567 55 ARG HG3 H 1.72 . 2 568 55 ARG HD2 H 2.87 . 2 569 55 ARG HD3 H 3.48 . 2 570 55 ARG HE H 7.41 . 1 571 55 ARG CA C 54.0 . 1 572 55 ARG CB C 29.8 . 1 573 55 ARG CG C 24.6 . 1 574 55 ARG CD C 44.5 . 1 575 55 ARG N N 120.8 . 1 576 55 ARG NE N 83.1 . 1 577 56 THR H H 7.87 . 1 578 56 THR HA H 3.51 . 1 579 56 THR HB H 3.96 . 1 580 56 THR HG2 H 1.22 . 1 581 56 THR CA C 67.5 . 1 582 56 THR CB C 68.0 . 1 583 56 THR CG2 C 23.1 . 1 584 56 THR N N 117.3 . 1 585 57 ASP H H 8.45 . 1 586 57 ASP HA H 4.26 . 1 587 57 ASP HB2 H 2.56 . 2 588 57 ASP HB3 H 2.64 . 2 589 57 ASP CA C 57.9 . 1 590 57 ASP CB C 39.1 . 1 591 57 ASP N N 120.3 . 1 592 58 ASP H H 7.54 . 1 593 58 ASP HA H 4.17 . 1 594 58 ASP HB2 H 1.41 . 2 595 58 ASP HB3 H 1.86 . 2 596 58 ASP CA C 56.9 . 1 597 58 ASP CB C 38.4 . 1 598 58 ASP N N 120.2 . 1 599 59 ALA H H 8.11 . 1 600 59 ALA HA H 3.76 . 1 601 59 ALA HB H 1.51 . 1 602 59 ALA CA C 56.0 . 1 603 59 ALA CB C 19.2 . 1 604 59 ALA N N 124.7 . 1 605 60 ILE H H 8.23 . 1 606 60 ILE HA H 3.52 . 1 607 60 ILE HB H 1.88 . 1 608 60 ILE HG12 H 0.94 . 2 609 60 ILE HG13 H 1.89 . 2 610 60 ILE HG2 H 0.99 . 1 611 60 ILE HD1 H 0.76 . 1 612 60 ILE CA C 66.8 . 1 613 60 ILE CB C 38.4 . 1 614 60 ILE CG1 C 31.2 . 1 615 60 ILE CG2 C 17.7 . 1 616 60 ILE CD1 C 14.1 . 1 617 60 ILE N N 117.6 . 1 618 61 ASP H H 7.75 . 1 619 61 ASP HA H 4.44 . 1 620 61 ASP HB2 H 2.71 . 2 621 61 ASP HB3 H 2.74 . 2 622 61 ASP CA C 57.1 . 1 623 61 ASP CB C 40.5 . 1 624 61 ASP N N 118.3 . 1 625 62 THR H H 8.04 . 1 626 62 THR HA H 4.07 . 1 627 62 THR HB H 4.25 . 1 628 62 THR HG2 H 1.35 . 1 629 62 THR CA C 68.0 . 1 630 62 THR CB C 68.6 . 1 631 62 THR CG2 C 22.3 . 1 632 62 THR N N 119.8 . 1 633 63 TYR H H 8.97 . 1 634 63 TYR HA H 4.48 . 1 635 63 TYR HB2 H 3.23 . 2 636 63 TYR HB3 H 2.89 . 2 637 63 TYR HD1 H 6.74 . 3 638 63 TYR HD2 H 6.74 . 3 639 63 TYR HE1 H 6.71 . 3 640 63 TYR HE2 H 6.71 . 3 641 63 TYR CA C 59.2 . 1 642 63 TYR CB C 37.7 . 1 643 63 TYR CD1 C 129.2 . 1 644 63 TYR CE1 C 119.0 . 1 645 63 TYR N N 121.7 . 1 646 64 ALA H H 8.69 . 1 647 64 ALA HA H 4.00 . 1 648 64 ALA HB H 1.58 . 1 649 64 ALA CA C 55.5 . 1 650 64 ALA CB C 17.8 . 1 651 64 ALA N N 119.4 . 1 652 65 GLN H H 8.10 . 1 653 65 GLN HA H 4.01 . 1 654 65 GLN HB2 H 2.33 . 2 655 65 GLN HB3 H 2.13 . 2 656 65 GLN HG2 H 2.42 . 2 657 65 GLN HG3 H 2.50 . 2 658 65 GLN HE21 H 6.89 . 2 659 65 GLN HE22 H 7.37 . 2 660 65 GLN CA C 58.6 . 1 661 65 GLN CB C 28.5 . 1 662 65 GLN CG C 33.9 . 1 663 65 GLN N N 119.6 . 1 664 65 GLN NE2 N 111.7 . 1 665 66 GLY HA2 H 3.08 . 2 666 66 GLY H H 8.43 . 1 667 66 GLY HA3 H 2.52 . 2 668 66 GLY CA C 46.8 . 1 669 66 GLY N N 108.2 . 1 670 67 ILE H H 8.57 . 1 671 67 ILE HA H 3.32 . 1 672 67 ILE HB H 1.90 . 1 673 67 ILE HG12 H 0.75 . 2 674 67 ILE HG13 H 1.98 . 2 675 67 ILE HG2 H 0.80 . 1 676 67 ILE HD1 H 0.76 . 1 677 67 ILE CA C 65.9 . 1 678 67 ILE CB C 38.4 . 1 679 67 ILE CG1 C 32.1 . 1 680 67 ILE CG2 C 16.1 . 1 681 67 ILE CD1 C 14.7 . 1 682 67 ILE N N 123.5 . 1 683 68 GLU H H 7.03 . 1 684 68 GLU HA H 3.96 . 1 685 68 GLU HB2 H 2.10 . 2 686 68 GLU HB3 H 2.10 . 2 687 68 GLU HG2 H 2.31 . 2 688 68 GLU HG3 H 2.41 . 2 689 68 GLU CA C 58.7 . 1 690 68 GLU CB C 28.5 . 1 691 68 GLU CG C 35.6 . 1 692 68 GLU N N 116.5 . 1 693 69 VAL H H 7.44 . 1 694 69 VAL HA H 3.74 . 1 695 69 VAL HB H 1.87 . 1 696 69 VAL HG1 H 0.90 . 2 697 69 VAL HG2 H 1.00 . 2 698 69 VAL CA C 65.7 . 1 699 69 VAL CB C 32.0 . 1 700 69 VAL CG1 C 20.9 . 2 701 69 VAL CG2 C 21.5 . 2 702 69 VAL N N 119.5 . 1 703 70 ALA H H 9.29 . 1 704 70 ALA HA H 3.82 . 1 705 70 ALA HB H 1.26 . 1 706 70 ALA CA C 54.4 . 1 707 70 ALA CB C 18.0 . 1 708 70 ALA N N 122.5 . 1 709 71 ARG H H 8.28 . 1 710 71 ARG HA H 3.87 . 1 711 71 ARG HB2 H 1.91 . 2 712 71 ARG HB3 H 1.85 . 2 713 71 ARG HG2 H 1.58 . 2 714 71 ARG HG3 H 1.82 . 2 715 71 ARG HD2 H 3.17 . 2 716 71 ARG HD3 H 3.17 . 2 717 71 ARG HE H 7.27 . 1 718 71 ARG CA C 59.5 . 1 719 71 ARG CB C 30.0 . 1 720 71 ARG CG C 27.7 . 1 721 71 ARG CD C 43.1 . 1 722 71 ARG N N 116.9 . 1 723 71 ARG NE N 84.1 . 1 724 72 GLU H H 7.39 . 1 725 72 GLU HA H 4.30 . 1 726 72 GLU HB2 H 2.10 . 2 727 72 GLU HB3 H 2.19 . 2 728 72 GLU HG2 H 2.32 . 2 729 72 GLU HG3 H 2.39 . 2 730 72 GLU CA C 57.7 . 1 731 72 GLU CB C 30.5 . 1 732 72 GLU CG C 35.6 . 1 733 72 GLU N N 116.8 . 1 734 73 GLU H H 8.49 . 1 735 73 GLU HA H 4.55 . 1 736 73 GLU HB2 H 2.32 . 2 737 73 GLU HB3 H 1.78 . 2 738 73 GLU HG2 H 2.37 . 2 739 73 GLU HG3 H 2.47 . 2 740 73 GLU CA C 55.9 . 1 741 73 GLU CB C 30.8 . 1 742 73 GLU CG C 34.9 . 1 743 73 GLU N N 115.0 . 1 744 74 GLY HA2 H 4.45 . 2 745 74 GLY H H 8.07 . 1 746 74 GLY HA3 H 3.83 . 2 747 74 GLY CA C 44.6 . 1 748 74 GLY N N 108.1 . 1 749 75 THR H H 8.76 . 1 750 75 THR HA H 4.67 . 1 751 75 THR HB H 4.58 . 1 752 75 THR HG2 H 1.30 . 1 753 75 THR CA C 59.0 . 1 754 75 THR CB C 70.9 . 1 755 75 THR CG2 C 21.1 . 1 756 75 THR N N 111.4 . 1 757 76 GLN H H 8.71 . 1 758 76 GLN HA H 3.94 . 1 759 76 GLN HB2 H 2.08 . 2 760 76 GLN HB3 H 2.08 . 2 761 76 GLN HG2 H 2.42 . 2 762 76 GLN HG3 H 2.41 . 2 763 76 GLN HE21 H 6.86 . 2 764 76 GLN HE22 H 7.50 . 2 765 76 GLN CA C 58.7 . 1 766 76 GLN CB C 27.9 . 1 767 76 GLN CG C 33.6 . 1 768 76 GLN N N 123.1 . 1 769 76 GLN NE2 N 112.9 . 1 770 77 LYS H H 8.24 . 1 771 77 LYS HA H 4.00 . 1 772 77 LYS HB2 H 1.64 . 2 773 77 LYS HB3 H 1.79 . 2 774 77 LYS HG2 H 1.27 . 2 775 77 LYS HG3 H 1.34 . 2 776 77 LYS HD2 H 1.57 . 2 777 77 LYS HD3 H 1.57 . 2 778 77 LYS HE2 H 2.86 . 2 779 77 LYS HE3 H 2.86 . 2 780 77 LYS CA C 59.2 . 1 781 77 LYS CB C 31.9 . 1 782 77 LYS CG C 24.4 . 1 783 77 LYS CD C 28.9 . 1 784 77 LYS CE C 41.9 . 1 785 77 LYS N N 121.0 . 1 786 78 ASP H H 7.39 . 1 787 78 ASP HA H 4.17 . 1 788 78 ASP HB2 H 2.39 . 2 789 78 ASP HB3 H 2.65 . 2 790 78 ASP CA C 57.0 . 1 791 78 ASP CB C 41.4 . 1 792 78 ASP N N 117.8 . 1 793 79 LEU H H 7.69 . 1 794 79 LEU HA H 3.77 . 1 795 79 LEU HB2 H 1.37 . 2 796 79 LEU HB3 H 1.84 . 2 797 79 LEU HG H 1.44 . 1 798 79 LEU HD1 H 0.90 . 2 799 79 LEU HD2 H 0.85 . 2 800 79 LEU CA C 58.1 . 1 801 79 LEU CB C 42.1 . 1 802 79 LEU CG C 27.0 . 1 803 79 LEU CD1 C 25.3 . 2 804 79 LEU CD2 C 25.8 . 2 805 79 LEU N N 118.4 . 1 806 80 SER H H 8.40 . 1 807 80 SER HA H 4.17 . 1 808 80 SER HB2 H 3.92 . 2 809 80 SER HB3 H 3.92 . 2 810 80 SER CA C 61.5 . 1 811 80 SER CB C 62.5 . 1 812 80 SER N N 114.0 . 1 813 81 GLU H H 7.93 . 1 814 81 GLU HA H 4.03 . 1 815 81 GLU HB2 H 1.89 . 2 816 81 GLU HB3 H 1.98 . 2 817 81 GLU HG2 H 2.00 . 2 818 81 GLU HG3 H 2.00 . 2 819 81 GLU CA C 59.0 . 1 820 81 GLU CB C 29.0 . 1 821 81 GLU CG C 36.0 . 1 822 81 GLU N N 121.0 . 1 823 82 LEU H H 7.87 . 1 824 82 LEU HA H 3.89 . 1 825 82 LEU HB2 H 1.98 . 2 826 82 LEU HB3 H 1.37 . 2 827 82 LEU HG H 1.95 . 1 828 82 LEU HD1 H 0.73 . 2 829 82 LEU HD2 H 1.24 . 2 830 82 LEU CA C 57.9 . 1 831 82 LEU CB C 43.9 . 1 832 82 LEU CG C 27.5 . 1 833 82 LEU CD1 C 25.1 . 2 834 82 LEU CD2 C 23.9 . 2 835 82 LEU N N 120.9 . 1 836 83 GLN H H 8.52 . 1 837 83 GLN HA H 3.90 . 1 838 83 GLN HB2 H 2.22 . 2 839 83 GLN HB3 H 1.95 . 2 840 83 GLN HG2 H 2.27 . 2 841 83 GLN HG3 H 2.53 . 2 842 83 GLN HE21 H 7.10 . 2 843 83 GLN HE22 H 6.81 . 2 844 83 GLN CA C 59.2 . 1 845 83 GLN CB C 28.3 . 1 846 83 GLN CG C 34.4 . 1 847 83 GLN N N 118.3 . 1 848 83 GLN NE2 N 110.2 . 1 849 84 ASP H H 8.14 . 1 850 84 ASP HA H 4.34 . 1 851 84 ASP HB2 H 2.57 . 2 852 84 ASP HB3 H 2.73 . 2 853 84 ASP CA C 57.1 . 1 854 84 ASP CB C 41.0 . 1 855 84 ASP N N 119.7 . 1 856 85 ALA H H 7.74 . 1 857 85 ALA HA H 3.81 . 1 858 85 ALA HB H 0.78 . 1 859 85 ALA CA C 54.6 . 1 860 85 ALA CB C 16.2 . 1 861 85 ALA N N 121.6 . 1 862 86 LYS H H 8.07 . 1 863 86 LYS HA H 3.81 . 1 864 86 LYS HB2 H 1.70 . 2 865 86 LYS HB3 H 1.93 . 2 866 86 LYS HG2 H 1.41 . 2 867 86 LYS HG3 H 1.63 . 2 868 86 LYS HD2 H 1.59 . 2 869 86 LYS HD3 H 1.59 . 2 870 86 LYS HE2 H 3.10 . 2 871 86 LYS HE3 H 2.89 . 2 872 86 LYS CA C 60.6 . 1 873 86 LYS CB C 33.3 . 1 874 86 LYS CG C 25.4 . 1 875 86 LYS CD C 30.7 . 1 876 86 LYS CE C 41.9 . 1 877 86 LYS N N 120.2 . 1 878 87 LEU H H 7.78 . 1 879 87 LEU HA H 4.16 . 1 880 87 LEU HB2 H 1.62 . 2 881 87 LEU HB3 H 1.74 . 2 882 87 LEU HG H 1.66 . 1 883 87 LEU HD1 H 0.87 . 2 884 87 LEU HD2 H 0.86 . 2 885 87 LEU CA C 57.5 . 1 886 87 LEU CB C 41.9 . 1 887 87 LEU CG C 26.7 . 1 888 87 LEU CD1 C 24.5 . 2 889 87 LEU CD2 C 24.1 . 2 890 87 LEU N N 118.4 . 1 891 88 LYS H H 7.90 . 1 892 88 LYS HA H 3.96 . 1 893 88 LYS HB2 H 1.79 . 2 894 88 LYS HB3 H 1.81 . 2 895 88 LYS HG2 H 1.50 . 2 896 88 LYS HG3 H 1.38 . 2 897 88 LYS HD2 H 1.61 . 2 898 88 LYS HD3 H 1.60 . 2 899 88 LYS HE2 H 2.94 . 2 900 88 LYS HE3 H 2.94 . 2 901 88 LYS CA C 59.2 . 1 902 88 LYS CB C 32.0 . 1 903 88 LYS CG C 25.4 . 1 904 88 LYS CD C 28.9 . 1 905 88 LYS CE C 41.8 . 1 906 88 LYS N N 118.7 . 1 907 89 ALA H H 8.00 . 1 908 89 ALA HA H 4.15 . 1 909 89 ALA HB H 1.53 . 1 910 89 ALA CA C 54.5 . 1 911 89 ALA CB C 17.8 . 1 912 89 ALA N N 122.4 . 1 913 90 GLU H H 8.30 . 1 914 90 GLU HA H 3.93 . 1 915 90 GLU HB2 H 2.24 . 2 916 90 GLU HB3 H 1.98 . 2 917 90 GLU HG2 H 2.23 . 2 918 90 GLU HG3 H 2.59 . 2 919 90 GLU CA C 58.0 . 1 920 90 GLU CB C 29.7 . 1 921 90 GLU CG C 37.2 . 1 922 90 GLU N N 116.7 . 1 923 91 GLY HA2 H 4.07 . 2 924 91 GLY H H 7.71 . 1 925 91 GLY HA3 H 3.87 . 2 926 91 GLY CA C 45.5 . 1 927 91 GLY N N 106.0 . 1 928 92 LEU H H 7.64 . 1 929 92 LEU HA H 4.27 . 1 930 92 LEU HB2 H 1.76 . 2 931 92 LEU HB3 H 1.52 . 2 932 92 LEU HG H 1.75 . 1 933 92 LEU HD1 H 0.91 . 2 934 92 LEU HD2 H 0.84 . 2 935 92 LEU CA C 55.2 . 1 936 92 LEU CB C 42.1 . 1 937 92 LEU CG C 26.6 . 1 938 92 LEU CD1 C 25.2 . 2 939 92 LEU CD2 C 22.7 . 2 940 92 LEU N N 121.2 . 1 941 93 GLU H H 8.29 . 1 942 93 GLU HA H 4.13 . 1 943 93 GLU HB2 H 1.90 . 2 944 93 GLU HB3 H 1.89 . 2 945 93 GLU HG2 H 2.10 . 2 946 93 GLU HG3 H 2.19 . 2 947 93 GLU CA C 56.7 . 1 948 93 GLU CB C 29.7 . 1 949 93 GLU CG C 36.0 . 1 950 93 GLU N N 120.2 . 1 951 94 HIS H H 8.26 . 1 952 94 HIS HA H 4.56 . 1 953 94 HIS HB2 H 3.07 . 2 954 94 HIS HB3 H 3.08 . 2 955 94 HIS CA C 55.4 . 1 956 94 HIS CB C 29.7 . 1 957 94 HIS N N 118.9 . 1 958 95 HIS H H 8.17 . 1 959 95 HIS HA H 4.41 . 1 960 95 HIS HB2 H 3.19 . 2 961 95 HIS HB3 H 3.18 . 2 962 95 HIS CA C 57.0 . 1 963 95 HIS CB C 30.0 . 1 964 95 HIS N N 125.4 . 1