1 1 Met HA H 3.82 . 1 2 1 Met HB2 H 1.97 . 2 3 1 Met HB3 H 2.21 . 2 4 1 Met HG2 H 2.19 . 2 5 1 Met HG3 H 2.32 . 2 6 1 Met CA C 58.8 . 1 7 1 Met CB C 30.6 . 1 8 1 Met CG C 36.0 . 1 9 2 Ala H H 8.30 . 1 10 2 Ala HA H 3.90 . 1 11 2 Ala HB H 1.21 . 1 12 2 Ala CA C 51.6 . 1 13 2 Ala CB C 19.7 . 1 14 2 Ala N N 120.7 . 1 15 3 Leu H H 8.11 . 1 16 3 Leu HA H 4.62 . 1 17 3 Leu HB2 H 1.35 . 2 18 3 Leu HB3 H 1.62 . 2 19 3 Leu HG H 1.83 . 1 20 3 Leu HD1 H 0.82 . 2 21 3 Leu HD2 H 0.87 . 2 22 3 Leu CA C 54.0 . 1 23 3 Leu CB C 44.2 . 1 24 3 Leu CG C 26.8 . 1 25 3 Leu CD1 C 26.1 . 2 26 3 Leu CD2 C 23.7 . 2 27 3 Leu N N 120.4 . 1 28 4 Thr H H 8.80 . 1 29 4 Thr HA H 4.76 . 1 30 4 Thr HB H 3.62 . 1 31 4 Thr HG2 H 0.28 . 1 32 4 Thr CA C 62.7 . 1 33 4 Thr CB C 70.8 . 1 34 4 Thr CG2 C 20.9 . 1 35 4 Thr N N 117.4 . 1 36 5 Leu H H 9.00 . 1 37 5 Leu HA H 4.88 . 1 38 5 Leu HB2 H 0.60 . 2 39 5 Leu HB3 H 1.75 . 2 40 5 Leu HG H 0.94 . 1 41 5 Leu HD1 H 0.37 . 1 42 5 Leu HD2 H 0.58 . 1 43 5 Leu CA C 52.7 . 1 44 5 Leu CB C 43.8 . 1 45 5 Leu CG C 27.6 . 1 46 5 Leu CD1 C 26.7 . 1 47 5 Leu CD2 C 23.3 . 1 48 5 Leu N N 128.4 . 1 49 6 Tyr H H 9.33 . 1 50 6 Tyr HA H 4.76 . 1 51 6 Tyr HB2 H 2.00 . 1 52 6 Tyr HB3 H 2.34 . 1 53 6 Tyr HD1 H 6.21 . 1 54 6 Tyr HD2 H 6.21 . 1 55 6 Tyr HE1 H 6.29 . 1 56 6 Tyr HE2 H 6.29 . 1 57 6 Tyr CA C 58.1 . 1 58 6 Tyr CB C 38.6 . 1 59 6 Tyr CD1 C 130.8 . 1 60 6 Tyr CD2 C 130.8 . 1 61 6 Tyr CE1 C 117.3 . 1 62 6 Tyr CE2 C 117.3 . 1 63 6 Tyr N N 128.7 . 1 64 7 Gln H H 8.51 . 1 65 7 Gln HA H 4.67 . 1 66 7 Gln HB2 H 1.37 . 2 67 7 Gln HG2 H 1.70 . 2 68 7 Gln HG3 H 1.71 . 2 69 7 Gln CB C 33.9 . 1 70 7 Gln CG C 34.8 . 1 71 7 Gln N N 118.2 . 1 72 8 Arg HA H 5.08 . 1 73 8 Arg HB2 H 1.57 . 2 74 8 Arg HB3 H 1.74 . 2 75 8 Arg HG2 H 1.38 . 2 76 8 Arg HG3 H 1.45 . 2 77 8 Arg HD2 H 3.04 . 2 78 8 Arg HD3 H 3.10 . 2 79 8 Arg HE H 7.57 . 1 80 8 Arg CA C 54.5 . 1 81 8 Arg CB C 33.5 . 1 82 8 Arg CG C 27.4 . 1 83 8 Arg CD C 43.1 . 1 84 8 Arg NE N 83.9 . 1 85 9 Asp H H 9.74 . 1 86 9 Asp HA H 4.29 . 1 87 9 Asp HB2 H 2.36 . 2 88 9 Asp HB3 H 2.31 . 2 89 9 Asp CA C 55.9 . 1 90 9 Asp CB C 40.8 . 1 91 9 Asp N N 123.8 . 1 92 10 Asp H H 8.31 . 1 93 10 Asp HA H 4.20 . 1 94 10 Asp HB2 H 2.29 . 1 95 10 Asp HB3 H 2.25 . 1 96 10 Asp CA C 54.1 . 1 97 10 Asp CB C 39.5 . 1 98 10 Asp N N 120.0 . 1 99 11 Cys H H 8.02 . 1 100 11 Cys N N 122.0 . 1 101 12 His HD2 H 6.91 . 1 102 12 His HE1 H 7.91 . 1 103 12 His CD2 C 119.7 . 1 104 12 His CE1 C 135.7 . 1 105 13 Leu H H 8.67 . 1 106 13 Leu HA H 3.41 . 1 107 13 Leu HB2 H -0.15 . 2 108 13 Leu HB3 H 1.19 . 2 109 13 Leu HG H 1.19 . 1 110 13 Leu HD1 H 0.52 . 1 111 13 Leu HD2 H 0.51 . 1 112 13 Leu CA C 56.6 . 1 113 13 Leu CB C 39.7 . 1 114 13 Leu CG C 26.5 . 1 115 13 Leu CD1 C 24.6 . 1 116 13 Leu CD2 C 21.9 . 1 117 13 Leu N N 124.3 . 1 118 14 Cys H H 8.56 . 1 119 14 Cys HA H 3.51 . 1 120 14 Cys HB2 H 2.91 . 2 121 14 Cys HB3 H 3.17 . 2 122 14 Cys CB C 27.6 . 1 123 14 Cys N N 122.7 . 1 124 15 Asp H H 7.58 . 1 125 15 Asp HA H 4.16 . 1 126 15 Asp HB2 H 2.54 . 2 127 15 Asp HB3 H 2.62 . 2 128 15 Asp CA C 57.4 . 1 129 15 Asp CB C 39.6 . 1 130 15 Asp N N 118.6 . 1 131 16 Gln H H 7.39 . 1 132 16 Gln HA H 3.92 . 1 133 16 Gln HB2 H 2.00 . 2 134 16 Gln HB3 H 2.08 . 2 135 16 Gln HG2 H 2.20 . 1 136 16 Gln HG3 H 2.34 . 1 137 16 Gln HE21 H 7.04 . 2 138 16 Gln HE22 H 6.86 . 2 139 16 Gln CA C 58.8 . 1 140 16 Gln CB C 29.4 . 1 141 16 Gln CG C 34.9 . 1 142 16 Gln N N 120.0 . 1 143 16 Gln NE2 N 110.9 . 1 144 17 Ala H H 7.84 . 1 145 17 Ala HA H 3.93 . 1 146 17 Ala HB H 1.18 . 1 147 17 Ala CA C 55.3 . 1 148 17 Ala CB C 18.7 . 1 149 17 Ala N N 125.0 . 1 150 18 Val H H 7.70 . 1 151 18 Val HA H 3.21 . 1 152 18 Val HB H 2.08 . 1 153 18 Val HG1 H 0.91 . 1 154 18 Val HG2 H 0.86 . 1 155 18 Val CA C 67.1 . 1 156 18 Val CB C 31.7 . 1 157 18 Val CG1 C 21.2 . 1 158 18 Val CG2 C 23.1 . 1 159 18 Val N N 118.2 . 1 160 19 Glu H H 7.44 . 1 161 19 Glu HA H 4.08 . 1 162 19 Glu HB2 H 1.99 . 2 163 19 Glu HB3 H 1.95 . 2 164 19 Glu HG2 H 2.25 . 2 165 19 Glu HG3 H 2.15 . 2 166 19 Glu CA C 58.7 . 1 167 19 Glu CB C 29.1 . 1 168 19 Glu CG C 35.8 . 1 169 19 Glu N N 120.1 . 1 170 20 Ala H H 8.06 . 1 171 20 Ala HA H 4.09 . 1 172 20 Ala HB H 1.43 . 1 173 20 Ala CA C 55.2 . 1 174 20 Ala CB C 17.1 . 1 175 20 Ala N N 122.9 . 1 176 21 Leu H H 7.89 . 1 177 21 Leu HA H 3.52 . 1 178 21 Leu HB2 H 1.15 . 1 179 21 Leu HB3 H 1.64 . 1 180 21 Leu HG H 1.25 . 1 181 21 Leu HD1 H -0.19 . 1 182 21 Leu HD2 H 0.33 . 1 183 21 Leu CA C 58.8 . 1 184 21 Leu CB C 41.1 . 1 185 21 Leu CG C 27.7 . 1 186 21 Leu CD1 C 24.9 . 1 187 21 Leu CD2 C 25.1 . 1 188 21 Leu N N 118.8 . 1 189 22 Ala H H 7.39 . 1 190 22 Ala HA H 4.10 . 1 191 22 Ala HB H 1.48 . 1 192 22 Ala CA C 54.8 . 1 193 22 Ala CB C 17.8 . 1 194 22 Ala N N 120.9 . 1 195 23 Gln H H 8.53 . 1 196 23 Gln HA H 3.90 . 1 197 23 Gln HB2 H 1.96 . 1 198 23 Gln HB3 H 2.08 . 1 199 23 Gln HG2 H 2.33 . 2 200 23 Gln HG3 H 2.48 . 2 201 23 Gln HE21 H 7.60 . 2 202 23 Gln HE22 H 6.80 . 2 203 23 Gln CA C 58.3 . 1 204 23 Gln CB C 28.6 . 1 205 23 Gln CG C 33.5 . 1 206 23 Gln N N 120.2 . 1 207 23 Gln NE2 N 112.2 . 1 208 24 Ala H H 8.25 . 1 209 24 Ala HA H 4.14 . 1 210 24 Ala HB H 1.32 . 1 211 24 Ala CA C 51.9 . 1 212 24 Ala CB C 19.4 . 1 213 24 Ala N N 119.1 . 1 214 25 Arg H H 7.78 . 1 215 25 Arg HA H 3.88 . 1 216 25 Arg HB2 H 1.71 . 1 217 25 Arg HB3 H 1.90 . 1 218 25 Arg HG2 H 1.44 . 1 219 25 Arg HG3 H 1.44 . 1 220 25 Arg HD2 H 3.08 . 1 221 25 Arg HD3 H 3.08 . 1 222 25 Arg HE H 7.05 . 1 223 25 Arg CA C 56.3 . 1 224 25 Arg CB C 26.1 . 1 225 25 Arg CG C 27.3 . 1 226 25 Arg CD C 43.4 . 1 227 25 Arg N N 114.9 . 1 228 25 Arg NE N 85.0 . 1 229 26 Ala H H 7.76 . 1 230 26 Ala HA H 3.77 . 1 231 26 Ala HB H 1.16 . 1 232 26 Ala CA C 53.5 . 1 233 26 Ala CB C 20.9 . 1 234 26 Ala N N 117.9 . 1 235 27 Gly H H 8.22 . 1 236 27 Gly HA2 H 4.03 . 2 237 27 Gly HA3 H 3.52 . 2 238 27 Gly CA C 43.7 . 1 239 27 Gly N N 105.8 . 1 240 28 Ala H H 8.05 . 1 241 28 Ala HA H 4.00 . 1 242 28 Ala HB H 1.09 . 1 243 28 Ala CA C 52.6 . 1 244 28 Ala CB C 19.1 . 1 245 28 Ala N N 121.7 . 1 246 29 Phe H H 7.80 . 1 247 29 Phe HA H 5.09 . 1 248 29 Phe HB2 H 2.43 . 1 249 29 Phe HB3 H 2.63 . 1 250 29 Phe HD1 H 6.86 . 1 251 29 Phe HD2 H 6.86 . 1 252 29 Phe HE1 H 7.07 . 1 253 29 Phe HE2 H 7.07 . 1 254 29 Phe HZ H 7.10 . 1 255 29 Phe CA C 54.7 . 1 256 29 Phe CB C 42.0 . 1 257 29 Phe CD1 C 131.7 . 1 258 29 Phe CD2 C 131.7 . 1 259 29 Phe CE1 C 130.7 . 1 260 29 Phe CE2 C 130.7 . 1 261 29 Phe CZ C 130.7 . 1 262 29 Phe N N 117.0 . 1 263 30 Phe H H 8.84 . 1 264 30 Phe HA H 4.56 . 1 265 30 Phe HB2 H 2.73 . 1 266 30 Phe HB3 H 2.89 . 1 267 30 Phe HD1 H 7.00 . 1 268 30 Phe HD2 H 7.00 . 1 269 30 Phe HE1 H 7.04 . 1 270 30 Phe HE2 H 7.04 . 1 271 30 Phe HZ H 7.03 . 1 272 30 Phe CA C 56.1 . 1 273 30 Phe CB C 40.7 . 1 274 30 Phe CD1 C 131.0 . 1 275 30 Phe CD2 C 131.0 . 1 276 30 Phe CE1 C 130.8 . 1 277 30 Phe CE2 C 130.8 . 1 278 30 Phe CZ C 129.8 . 1 279 30 Phe N N 120.7 . 1 280 31 Ser H H 8.65 . 1 281 31 Ser HA H 4.91 . 1 282 31 Ser HB2 H 3.12 . 2 283 31 Ser HB3 H 3.50 . 2 284 31 Ser CA C 57.9 . 1 285 31 Ser CB C 64.4 . 1 286 31 Ser N N 119.9 . 1 287 32 Val H H 8.23 . 1 288 32 Val HA H 3.84 . 1 289 32 Val HB H 1.09 . 1 290 32 Val HG1 H 0.40 . 1 291 32 Val HG2 H 0.68 . 1 292 32 Val CA C 61.2 . 1 293 32 Val CB C 33.9 . 1 294 32 Val CG1 C 21.2 . 1 295 32 Val CG2 C 21.2 . 1 296 32 Val N N 126.8 . 1 297 33 Phe H H 8.77 . 1 298 33 Phe HA H 4.78 . 1 299 33 Phe HB2 H 2.78 . 2 300 33 Phe HB3 H 3.00 . 2 301 33 Phe HD1 H 6.92 . 1 302 33 Phe HD2 H 6.92 . 1 303 33 Phe HE1 H 7.02 . 1 304 33 Phe HE2 H 7.02 . 1 305 33 Phe HZ H 7.05 . 1 306 33 Phe CA C 58.2 . 1 307 33 Phe CB C 39.2 . 1 308 33 Phe CD1 C 130.6 . 1 309 33 Phe CD2 C 130.6 . 1 310 33 Phe CE1 C 130.8 . 1 311 33 Phe CE2 C 130.8 . 1 312 33 Phe CZ C 128.9 . 1 313 33 Phe N N 126.3 . 1 314 34 Ile H H 8.56 . 1 315 34 Ile HA H 4.09 . 1 316 34 Ile HB H 1.80 . 1 317 34 Ile HG12 H 1.14 . 2 318 34 Ile HG13 H 0.98 . 2 319 34 Ile HG2 H 0.82 . 1 320 34 Ile HD1 H 0.60 . 1 321 34 Ile CA C 62.1 . 1 322 34 Ile CB C 38.3 . 1 323 34 Ile CG1 C 25.3 . 1 324 34 Ile CG2 C 18.5 . 1 325 34 Ile CD1 C 16.0 . 1 326 34 Ile N N 115.7 . 1 327 35 Asp H H 8.09 . 1 328 35 Asp HA H 4.05 . 1 329 35 Asp HB2 H 2.28 . 2 330 35 Asp HB3 H 2.36 . 2 331 35 Asp CA C 55.4 . 1 332 35 Asp CB C 41.5 . 1 333 35 Asp N N 115.7 . 1 334 36 Asp H H 9.00 . 1 335 36 Asp HA H 4.27 . 1 336 36 Asp HB2 H 2.75 . 2 337 36 Asp HB3 H 2.61 . 2 338 36 Asp CA C 55.3 . 1 339 36 Asp CB C 40.1 . 1 340 36 Asp N N 116.6 . 1 341 37 Asp H H 7.71 . 1 342 37 Asp HA H 4.71 . 1 343 37 Asp HB2 H 2.23 . 2 344 37 Asp HB3 H 2.94 . 2 345 37 Asp CA C 52.8 . 1 346 37 Asp CB C 42.8 . 1 347 37 Asp N N 121.0 . 1 348 38 Ala H H 8.77 . 1 349 38 Ala HA H 3.97 . 1 350 38 Ala HB H 1.30 . 1 351 38 Ala CA C 55.4 . 1 352 38 Ala CB C 18.2 . 1 353 38 Ala N N 128.3 . 1 354 39 Ala H H 8.11 . 1 355 39 Ala HA H 4.07 . 1 356 39 Ala HB H 1.33 . 1 357 39 Ala CA C 54.9 . 1 358 39 Ala CB C 18.2 . 1 359 39 Ala N N 120.7 . 1 360 40 Leu H H 8.31 . 1 361 40 Leu HA H 4.11 . 1 362 40 Leu HB2 H 1.23 . 2 363 40 Leu HB3 H 2.05 . 2 364 40 Leu HG H 1.66 . 1 365 40 Leu HD1 H 0.78 . 2 366 40 Leu HD2 H 0.83 . 2 367 40 Leu CA C 57.3 . 1 368 40 Leu CB C 41.6 . 1 369 40 Leu CG C 26.7 . 1 370 40 Leu CD1 C 22.6 . 2 371 40 Leu CD2 C 27.0 . 2 372 40 Leu N N 120.7 . 1 373 41 Glu H H 9.14 . 1 374 41 Glu HA H 3.79 . 1 375 41 Glu HB2 H 1.86 . 2 376 41 Glu HB3 H 2.02 . 2 377 41 Glu HG2 H 2.19 . 1 378 41 Glu HG3 H 2.19 . 1 379 41 Glu CA C 59.9 . 1 380 41 Glu CB C 28.9 . 1 381 41 Glu CG C 35.7 . 1 382 41 Glu N N 121.2 . 1 383 42 Ser H H 7.86 . 1 384 42 Ser HA H 3.99 . 1 385 42 Ser HB2 H 3.82 . 2 386 42 Ser HB3 H 3.78 . 2 387 42 Ser CA C 61.3 . 1 388 42 Ser CB C 62.4 . 1 389 42 Ser N N 114.2 . 1 390 43 Ala H H 7.32 . 1 391 43 Ala HA H 3.85 . 1 392 43 Ala HB H 0.72 . 1 393 43 Ala CA C 54.4 . 1 394 43 Ala CB C 19.5 . 1 395 43 Ala N N 120.1 . 1 396 44 Tyr H H 8.44 . 1 397 44 Tyr HA H 4.36 . 1 398 44 Tyr HB2 H 2.40 . 1 399 44 Tyr HB3 H 2.93 . 1 400 44 Tyr HD1 H 6.44 . 1 401 44 Tyr HD2 H 6.44 . 1 402 44 Tyr HE1 H 6.08 . 1 403 44 Tyr HE2 H 6.08 . 1 404 44 Tyr CA C 58.7 . 1 405 44 Tyr CB C 40.0 . 1 406 44 Tyr CD1 C 130.9 . 1 407 44 Tyr CD2 C 130.9 . 1 408 44 Tyr CE1 C 116.8 . 1 409 44 Tyr CE2 C 116.8 . 1 410 44 Tyr N N 111.5 . 1 411 45 Gly H H 8.44 . 1 412 45 Gly HA2 H 4.17 . 2 413 45 Gly HA3 H 3.47 . 2 414 45 Gly CA C 48.2 . 1 415 45 Gly N N 111.5 . 1 416 46 Leu H H 8.30 . 1 417 46 Leu HA H 4.38 . 1 418 46 Leu HB2 H 1.43 . 1 419 46 Leu HB3 H 1.52 . 1 420 46 Leu HG H 1.54 . 1 421 46 Leu HD1 H 0.70 . 2 422 46 Leu HD2 H 0.74 . 2 423 46 Leu CA C 54.9 . 1 424 46 Leu CB C 41.6 . 1 425 46 Leu CG C 26.7 . 1 426 46 Leu CD1 C 22.3 . 2 427 46 Leu CD2 C 25.0 . 2 428 46 Leu N N 117.1 . 1 429 47 Arg H H 7.67 . 1 430 47 Arg HA H 4.22 . 1 431 47 Arg HB2 H 1.14 . 1 432 47 Arg HB3 H 1.93 . 1 433 47 Arg HG2 H 1.31 . 2 434 47 Arg HG3 H 1.55 . 2 435 47 Arg HD2 H 2.95 . 1 436 47 Arg HD3 H 3.23 . 1 437 47 Arg HE H 8.20 . 1 438 47 Arg CA C 55.8 . 1 439 47 Arg CB C 35.9 . 1 440 47 Arg CG C 25.6 . 1 441 47 Arg CD C 44.2 . 1 442 47 Arg N N 117.2 . 1 443 47 Arg NE N 83.2 . 1 444 48 Val H H 7.02 . 1 445 48 Val HA H 3.83 . 1 446 48 Val HB H 1.88 . 1 447 48 Val HG1 H 0.75 . 2 448 48 Val HG2 H 0.82 . 2 449 48 Val CA C 60.7 . 1 450 48 Val CB C 31.8 . 1 451 48 Val CG1 C 18.3 . 2 452 48 Val CG2 C 24.0 . 2 453 48 Val N N 109.0 . 1 454 49 Pro HA H 4.76 . 1 455 49 Pro HB2 H 1.68 . 2 456 49 Pro HB3 H 2.21 . 2 457 49 Pro HG2 H 1.12 . 2 458 49 Pro HG3 H 1.49 . 2 459 49 Pro HD2 H 2.77 . 2 460 49 Pro HD3 H 2.93 . 2 461 49 Pro CA C 62.5 . 1 462 49 Pro CB C 34.9 . 1 463 49 Pro CG C 25.5 . 1 464 49 Pro CD C 49.8 . 1 465 50 Val H H 7.70 . 1 466 50 Val HA H 4.85 . 1 467 50 Val HB H 1.53 . 1 468 50 Val HG1 H 0.71 . 1 469 50 Val HG2 H 0.84 . 1 470 50 Val CA C 60.5 . 1 471 50 Val CB C 37.1 . 1 472 50 Val CG1 C 21.1 . 1 473 50 Val CG2 C 23.5 . 1 474 50 Val N N 120.0 . 1 475 51 Leu H H 8.85 . 1 476 51 Leu HA H 5.14 . 1 477 51 Leu HB2 H 0.78 . 1 478 51 Leu HB3 H 1.07 . 1 479 51 Leu HG H 1.19 . 1 480 51 Leu HD1 H 0.32 . 2 481 51 Leu HD2 H 0.42 . 2 482 51 Leu CA C 52.0 . 1 483 51 Leu CB C 46.1 . 1 484 51 Leu CG C 26.4 . 1 485 51 Leu CD1 C 25.9 . 2 486 51 Leu CD2 C 26.7 . 2 487 51 Leu N N 128.4 . 1 488 52 Arg H H 9.42 . 1 489 52 Arg HA H 5.87 . 1 490 52 Arg HB2 H 1.58 . 2 491 52 Arg HB3 H 1.72 . 2 492 52 Arg HG2 H 1.98 . 2 493 52 Arg HG3 H 1.97 . 2 494 52 Arg HD2 H 3.18 . 1 495 52 Arg HD3 H 3.44 . 1 496 52 Arg HE H 7.30 . 1 497 52 Arg CA C 53.6 . 1 498 52 Arg CB C 35.6 . 1 499 52 Arg CG C 28.3 . 1 500 52 Arg CD C 44.2 . 1 501 52 Arg N N 124.6 . 1 502 52 Arg NE N 85.9 . 1 503 53 Asp H H 9.01 . 1 504 53 Asp HA H 5.07 . 1 505 53 Asp HB2 H 2.39 . 2 506 53 Asp HB3 H 3.01 . 2 507 53 Asp CA C 51.8 . 1 508 53 Asp CB C 41.0 . 1 509 53 Asp N N 128.8 . 1 510 54 Pro HA H 4.30 . 1 511 54 Pro HB2 H 1.70 . 2 512 54 Pro HB3 H 2.33 . 2 513 54 Pro HG2 H 1.96 . 2 514 54 Pro HG3 H 1.95 . 2 515 54 Pro HD2 H 3.53 . 2 516 54 Pro HD3 H 3.59 . 2 517 54 Pro CA C 65.0 . 1 518 54 Pro CB C 31.9 . 1 519 54 Pro CG C 28.3 . 1 520 54 Pro CD C 51.9 . 1 521 55 Met H H 7.56 . 1 522 55 Met HA H 4.39 . 1 523 55 Met HB2 H 2.03 . 2 524 55 Met HB3 H 2.05 . 2 525 55 Met HG2 H 2.36 . 2 526 55 Met HG3 H 2.37 . 2 527 55 Met HE H 1.84 . 1 528 55 Met CA C 55.1 . 1 529 55 Met CB C 31.8 . 1 530 55 Met CG C 32.5 . 1 531 55 Met CE C 17.0 . 1 532 55 Met N N 113.9 . 1 533 56 Gly H H 8.27 . 1 534 56 Gly HA2 H 4.12 . 2 535 56 Gly HA3 H 3.36 . 2 536 56 Gly CA C 44.8 . 1 537 56 Gly N N 108.8 . 1 538 57 Arg H H 8.28 . 1 539 57 Arg HA H 4.22 . 1 540 57 Arg HB2 H 1.77 . 2 541 57 Arg HB3 H 1.79 . 2 542 57 Arg HG2 H 1.45 . 2 543 57 Arg HG3 H 1.51 . 2 544 57 Arg HD2 H 2.90 . 2 545 57 Arg HD3 H 3.03 . 2 546 57 Arg HE H 7.33 . 1 547 57 Arg CA C 56.4 . 1 548 57 Arg CB C 30.8 . 1 549 57 Arg CG C 27.1 . 1 550 57 Arg CD C 44.0 . 1 551 57 Arg N N 121.5 . 1 552 57 Arg NE N 83.7 . 1 553 58 Glu H H 8.54 . 1 554 58 Glu HA H 5.73 . 1 555 58 Glu HB2 H 1.46 . 2 556 58 Glu HB3 H 1.75 . 2 557 58 Glu HG2 H 2.00 . 2 558 58 Glu HG3 H 2.41 . 2 559 58 Glu CA C 54.2 . 1 560 58 Glu CB C 33.0 . 1 561 58 Glu CG C 37.0 . 1 562 58 Glu N N 119.1 . 1 563 59 Leu H H 8.83 . 1 564 59 Leu HA H 3.94 . 1 565 59 Leu HB2 H -0.09 . 2 566 59 Leu HB3 H 0.16 . 2 567 59 Leu HG H 0.52 . 1 568 59 Leu HD1 H -0.65 . 2 569 59 Leu HD2 H 0.11 . 2 570 59 Leu CA C 53.1 . 1 571 59 Leu CB C 42.3 . 1 572 59 Leu CG C 25.9 . 1 573 59 Leu CD1 C 25.2 . 2 574 59 Leu CD2 C 22.1 . 2 575 59 Leu N N 127.5 . 1 576 60 Asp H H 8.29 . 1 577 60 Asp HA H 4.87 . 1 578 60 Asp HB2 H 2.45 . 2 579 60 Asp HB3 H 2.74 . 2 580 60 Asp CA C 53.2 . 1 581 60 Asp CB C 40.8 . 1 582 60 Asp N N 126.9 . 1 583 61 Trp H H 7.88 . 1 584 61 Trp HA H 3.99 . 1 585 61 Trp HB2 H 2.77 . 2 586 61 Trp HB3 H 3.46 . 2 587 61 Trp HD1 H 7.01 . 1 588 61 Trp HE1 H 10.25 . 1 589 61 Trp HE3 H 5.90 . 1 590 61 Trp HZ2 H 7.20 . 1 591 61 Trp HZ3 H 6.00 . 1 592 61 Trp HH2 H 6.76 . 1 593 61 Trp CA C 55.5 . 1 594 61 Trp CB C 29.9 . 1 595 61 Trp CD1 C 126.8 . 1 596 61 Trp CE3 C 118.1 . 1 597 61 Trp CZ2 C 114.7 . 1 598 61 Trp CZ3 C 121.8 . 1 599 61 Trp CH2 C 124.4 . 1 600 61 Trp N N 121.0 . 1 601 61 Trp NE1 N 131.8 . 1 602 62 Pro HG2 H 1.80 . 2 603 62 Pro HG3 H 1.90 . 2 604 62 Pro HD2 H 3.50 . 2 605 62 Pro HD3 H 3.60 . 2 606 62 Pro CG C 27.3 . 1 607 62 Pro CD C 50.4 . 1 608 63 Phe H H 6.58 . 1 609 63 Phe HA H 4.29 . 1 610 63 Phe HB2 H 2.73 . 2 611 63 Phe HB3 H 2.56 . 2 612 63 Phe HD1 H 6.58 . 1 613 63 Phe HD2 H 6.58 . 1 614 63 Phe HE1 H 7.02 . 1 615 63 Phe HE2 H 7.02 . 1 616 63 Phe HZ H 6.71 . 1 617 63 Phe CA C 54.9 . 1 618 63 Phe CB C 40.0 . 1 619 63 Phe CD1 C 132.6 . 1 620 63 Phe CD2 C 132.6 . 1 621 63 Phe CE1 C 129.7 . 1 622 63 Phe CE2 C 129.7 . 1 623 63 Phe CZ C 128.6 . 1 624 64 Asp H H 7.04 . 1 625 64 Asp HA H 4.55 . 1 626 64 Asp HB2 H 2.55 . 2 627 64 Asp HB3 H 2.94 . 2 628 64 Asp CA C 50.5 . 1 629 64 Asp CB C 42.1 . 1 630 64 Asp N N 118.2 . 1 631 65 Ala H H 9.06 . 1 632 65 Ala HA H 4.17 . 1 633 65 Ala HB H 1.40 . 1 634 65 Ala CA C 57.1 . 1 635 65 Ala CB C 16.2 . 1 636 65 Ala N N 120.7 . 1 637 66 Pro HA H 4.13 . 1 638 66 Pro HB2 H 1.70 . 2 639 66 Pro HB3 H 2.12 . 2 640 66 Pro HG2 H 1.74 . 2 641 66 Pro HG3 H 2.00 . 2 642 66 Pro HD2 H 3.52 . 2 643 66 Pro HD3 H 3.54 . 2 644 66 Pro CA C 66.2 . 1 645 66 Pro CB C 30.6 . 1 646 66 Pro CG C 28.1 . 1 647 66 Pro CD C 49.4 . 1 648 67 Arg H H 7.85 . 1 649 67 Arg HA H 4.00 . 1 650 67 Arg HB2 H 1.69 . 2 651 67 Arg HB3 H 1.91 . 2 652 67 Arg HG2 H 1.51 . 2 653 67 Arg HG3 H 1.59 . 2 654 67 Arg HD2 H 3.05 . 2 655 67 Arg HD3 H 3.15 . 2 656 67 Arg HE H 7.24 . 1 657 67 Arg CA C 58.9 . 1 658 67 Arg CB C 30.4 . 1 659 67 Arg CG C 28.4 . 1 660 67 Arg CD C 43.2 . 1 661 67 Arg N N 119.3 . 1 662 67 Arg NE N 85.2 . 1 663 68 Leu H H 8.45 . 1 664 68 Leu HA H 3.71 . 1 665 68 Leu HB2 H 1.34 . 2 666 68 Leu HB3 H 1.55 . 2 667 68 Leu HG H 1.17 . 1 668 68 Leu HD1 H -0.65 . 1 669 68 Leu HD2 H 0.44 . 1 670 68 Leu CA C 58.3 . 1 671 68 Leu CB C 42.0 . 1 672 68 Leu CG C 27.5 . 1 673 68 Leu CD1 C 25.2 . 1 674 68 Leu CD2 C 25.6 . 1 675 68 Leu N N 121.6 . 1 676 69 Arg H H 8.73 . 1 677 69 Arg HA H 3.81 . 1 678 69 Arg HB2 H 1.78 . 2 679 69 Arg HB3 H 1.95 . 2 680 69 Arg HG2 H 1.50 . 2 681 69 Arg HG3 H 1.73 . 2 682 69 Arg HD2 H 3.30 . 2 683 69 Arg HD3 H 3.14 . 2 684 69 Arg HE H 6.93 . 1 685 69 Arg CA C 58.5 . 1 686 69 Arg CB C 31.0 . 1 687 69 Arg CG C 25.4 . 1 688 69 Arg CD C 43.4 . 1 689 69 Arg N N 119.9 . 1 690 69 Arg NE N 84.4 . 1 691 70 Ala H H 7.74 . 1 692 70 Ala HA H 4.03 . 1 693 70 Ala HB H 1.37 . 1 694 70 Ala CA C 54.9 . 1 695 70 Ala CB C 18.0 . 1 696 70 Ala N N 119.6 . 1 697 71 Trp H H 8.03 . 1 698 71 Trp HA H 4.20 . 1 699 71 Trp HB2 H 3.06 . 1 700 71 Trp HB3 H 3.35 . 1 701 71 Trp HD1 H 7.11 . 1 702 71 Trp HE1 H 9.86 . 1 703 71 Trp HE3 H 7.13 . 1 704 71 Trp HZ2 H 6.68 . 1 705 71 Trp HZ3 H 6.45 . 1 706 71 Trp HH2 H 6.52 . 1 707 71 Trp CA C 61.5 . 1 708 71 Trp CB C 28.6 . 1 709 71 Trp CD1 C 127.4 . 1 710 71 Trp CE3 C 118.9 . 1 711 71 Trp CZ2 C 114.3 . 1 712 71 Trp CZ3 C 120.6 . 1 713 71 Trp CH2 C 122.6 . 1 714 71 Trp N N 120.7 . 1 715 71 Trp NE1 N 130.1 . 1 716 72 Leu H H 8.81 . 1 717 72 Leu HA H 3.51 . 1 718 72 Leu HB2 H 1.28 . 2 719 72 Leu HB3 H 1.86 . 2 720 72 Leu HG H 1.91 . 1 721 72 Leu HD1 H 0.78 . 2 722 72 Leu HD2 H 0.68 . 2 723 72 Leu CA C 57.5 . 1 724 72 Leu CB C 41.6 . 1 725 72 Leu CG C 26.8 . 1 726 72 Leu CD1 C 23.4 . 2 727 72 Leu CD2 C 25.7 . 2 728 72 Leu N N 121.5 . 1 729 73 Asp H H 8.14 . 1 730 73 Asp HA H 4.26 . 1 731 73 Asp HB2 H 2.57 . 2 732 73 Asp HB3 H 2.52 . 2 733 73 Asp CA C 55.8 . 1 734 73 Asp CB C 39.8 . 1 735 73 Asp N N 119.1 . 1 736 74 Ala H H 7.11 . 1 737 74 Ala HA H 4.11 . 1 738 74 Ala HB H 1.20 . 1 739 74 Ala CA C 51.7 . 1 740 74 Ala CB C 18.7 . 1 741 74 Ala N N 120.6 . 1 742 75 Ala H H 7.02 . 1 743 75 Ala HA H 3.86 . 1 744 75 Ala HB H 1.03 . 1 745 75 Ala CA C 51.2 . 1 746 75 Ala CB C 17.7 . 1 747 75 Ala N N 123.0 . 1 748 76 Pro HA H 4.13 . 1 749 76 Pro HB2 H 1.61 . 2 750 76 Pro HB3 H 2.04 . 2 751 76 Pro HG2 H 1.79 . 2 752 76 Pro HG3 H 1.80 . 2 753 76 Pro HD2 H 3.31 . 2 754 76 Pro HD3 H 3.49 . 2 755 76 Pro CA C 63.2 . 1 756 76 Pro CB C 31.6 . 1 757 76 Pro CG C 27.4 . 1 758 76 Pro CD C 49.8 . 1 759 77 His H H 8.23 . 1 760 77 His HA H 4.41 . 1 761 77 His HB2 H 3.00 . 2 762 77 His HB3 H 2.94 . 2 763 77 His HD2 H 6.99 . 1 764 77 His HE1 H 8.24 . 1 765 77 His CA C 55.4 . 1 766 77 His CB C 29.6 . 1 767 77 His CD2 C 119.5 . 1 768 77 His CE1 C 136.5 . 1 769 77 His N N 118.0 . 1 770 78 Ala H H 8.08 . 1 771 78 Ala HA H 4.06 . 1 772 78 Ala HB H 1.18 . 1 773 78 Ala CA C 52.7 . 1 774 78 Ala CB C 19.2 . 1 775 78 Ala N N 125.0 . 1