1 2 Ala HA H 4.14 . 1 2 2 Ala HB H 1.51 . 1 3 2 Ala C C 173.8 . 1 4 2 Ala CA C 51.8 . 1 5 2 Ala CB C 19.6 . 1 6 3 Ile H H 8.54 . 1 7 3 Ile HA H 4.19 . 1 8 3 Ile HB H 1.85 . 1 9 3 Ile HG12 H 1.21 . 2 10 3 Ile HG13 H 1.49 . 2 11 3 Ile HG2 H 0.92 . 1 12 3 Ile HD1 H 0.87 . 1 13 3 Ile C C 176.0 . 1 14 3 Ile CA C 61.3 . 1 15 3 Ile CB C 38.8 . 1 16 3 Ile CG1 C 27.4 . 1 17 3 Ile CG2 C 17.5 . 1 18 3 Ile CD1 C 13.0 . 1 19 3 Ile N N 120.5 . 1 20 4 Gln H H 8.57 . 1 21 4 Gln HA H 4.40 . 1 22 4 Gln HB2 H 2.01 . 2 23 4 Gln HB3 H 2.09 . 2 24 4 Gln HG2 H 2.39 . 2 25 4 Gln HG3 H 2.39 . 2 26 4 Gln HE21 H 7.53 . 1 27 4 Gln HE22 H 6.90 . 1 28 4 Gln C C 175.7 . 1 29 4 Gln CA C 55.8 . 1 30 4 Gln CB C 29.6 . 1 31 4 Gln CG C 33.7 . 1 32 4 Gln CD C 180.5 . 1 33 4 Gln N N 125.1 . 1 34 4 Gln NE2 N 112.5 . 1 35 5 Ser H H 8.44 . 1 36 5 Ser HA H 4.42 . 1 37 5 Ser HB2 H 3.81 . 2 38 5 Ser HB3 H 3.88 . 2 39 5 Ser C C 174.3 . 1 40 5 Ser CA C 58.2 . 1 41 5 Ser CB C 64.0 . 1 42 5 Ser N N 118.1 . 1 43 6 Lys H H 8.32 . 1 44 6 Lys HA H 4.11 . 1 45 6 Lys HB2 H 1.53 . 2 46 6 Lys HB3 H 1.53 . 2 47 6 Lys HG2 H 1.03 . 2 48 6 Lys HG3 H 1.15 . 2 49 6 Lys HD2 H 1.58 . 2 50 6 Lys HD3 H 1.58 . 2 51 6 Lys HE2 H 2.92 . 2 52 6 Lys HE3 H 2.92 . 2 53 6 Lys C C 176.0 . 1 54 6 Lys CA C 57.2 . 1 55 6 Lys CB C 33.1 . 1 56 6 Lys CG C 24.6 . 1 57 6 Lys CD C 29.2 . 1 58 6 Lys CE C 42.1 . 1 59 6 Lys N N 123.6 . 1 60 7 Tyr H H 8.00 . 1 61 7 Tyr HA H 4.80 . 1 62 7 Tyr HB2 H 2.64 . 2 63 7 Tyr HB3 H 3.02 . 2 64 7 Tyr HD1 H 7.08 . 3 65 7 Tyr HD2 H 7.08 . 3 66 7 Tyr HE1 H 6.77 . 3 67 7 Tyr HE2 H 6.77 . 3 68 7 Tyr C C 175.8 . 1 69 7 Tyr CA C 57.0 . 1 70 7 Tyr CB C 39.9 . 1 71 7 Tyr CD1 C 133.6 . 3 72 7 Tyr CD2 C 133.6 . 3 73 7 Tyr CE1 C 118.3 . 3 74 7 Tyr CE2 C 118.3 . 3 75 7 Tyr N N 118.9 . 1 76 8 Ser H H 8.77 . 1 77 8 Ser HA H 4.51 . 1 78 8 Ser HB2 H 3.99 . 2 79 8 Ser HB3 H 4.22 . 2 80 8 Ser C C 175.0 . 1 81 8 Ser CA C 57.5 . 1 82 8 Ser CB C 64.7 . 1 83 8 Ser N N 118.6 . 1 84 9 Asn H H 8.91 . 1 85 9 Asn HA H 4.54 . 1 86 9 Asn HB2 H 2.88 . 2 87 9 Asn HB3 H 2.88 . 2 88 9 Asn HD21 H 7.73 . 1 89 9 Asn HD22 H 6.96 . 1 90 9 Asn C C 177.2 . 1 91 9 Asn CA C 55.9 . 1 92 9 Asn CB C 38.2 . 1 93 9 Asn CG C 176.5 . 1 94 9 Asn N N 121.4 . 1 95 9 Asn ND2 N 113.3 . 1 96 10 Thr H H 8.18 . 1 97 10 Thr HA H 4.07 . 1 98 10 Thr HB H 4.16 . 1 99 10 Thr HG2 H 1.27 . 1 100 10 Thr C C 176.6 . 1 101 10 Thr CA C 65.3 . 1 102 10 Thr CB C 68.8 . 1 103 10 Thr CG2 C 21.8 . 1 104 10 Thr N N 113.5 . 1 105 11 Gln H H 7.95 . 1 106 11 Gln HA H 4.16 . 1 107 11 Gln HB2 H 2.11 . 2 108 11 Gln HB3 H 2.34 . 2 109 11 Gln HG2 H 2.38 . 2 110 11 Gln HG3 H 2.48 . 2 111 11 Gln HE21 H 7.66 . 1 112 11 Gln HE22 H 7.07 . 1 113 11 Gln C C 178.4 . 1 114 11 Gln CA C 59.0 . 1 115 11 Gln CB C 29.2 . 1 116 11 Gln CG C 34.7 . 1 117 11 Gln CD C 179.8 . 1 118 11 Gln N N 122.5 . 1 119 11 Gln NE2 N 111.7 . 1 120 12 Val H H 7.85 . 1 121 12 Val HA H 3.54 . 1 122 12 Val HB H 2.16 . 1 123 12 Val HG1 H 0.90 . 1 124 12 Val HG2 H 1.01 . 1 125 12 Val C C 177.4 . 1 126 12 Val CA C 66.4 . 1 127 12 Val CB C 32.3 . 1 128 12 Val CG1 C 21.2 . 1 129 12 Val CG2 C 22.8 . 1 130 12 Val N N 119.0 . 1 131 13 Glu H H 8.55 . 1 132 13 Glu HA H 3.91 . 1 133 13 Glu HB2 H 2.06 . 2 134 13 Glu HB3 H 2.06 . 2 135 13 Glu HG2 H 2.34 . 2 136 13 Glu HG3 H 2.41 . 2 137 13 Glu C C 179.5 . 1 138 13 Glu CA C 59.7 . 1 139 13 Glu CB C 29.1 . 1 140 13 Glu CG C 36.2 . 1 141 13 Glu N N 118.3 . 1 142 14 Ser H H 8.08 . 1 143 14 Ser HA H 4.26 . 1 144 14 Ser HB2 H 3.98 . 2 145 14 Ser HB3 H 3.98 . 2 146 14 Ser C C 176.2 . 1 147 14 Ser CA C 61.7 . 1 148 14 Ser CB C 62.8 . 1 149 14 Ser N N 114.6 . 1 150 15 Leu H H 7.11 . 1 151 15 Leu HA H 3.69 . 1 152 15 Leu HB2 H 1.44 . 2 153 15 Leu HB3 H 1.55 . 2 154 15 Leu HG H 1.39 . 1 155 15 Leu HD1 H 0.56 . 1 156 15 Leu HD2 H 0.51 . 1 157 15 Leu C C 177.8 . 1 158 15 Leu CA C 57.7 . 1 159 15 Leu CB C 42.3 . 1 160 15 Leu CG C 26.7 . 1 161 15 Leu CD1 C 24.3 . 1 162 15 Leu CD2 C 24.8 . 1 163 15 Leu N N 122.2 . 1 164 16 Ile H H 8.03 . 1 165 16 Ile HA H 3.22 . 1 166 16 Ile HB H 1.75 . 1 167 16 Ile HG12 H 1.10 . 2 168 16 Ile HG13 H 1.78 . 2 169 16 Ile HG2 H 0.81 . 1 170 16 Ile HD1 H 0.81 . 1 171 16 Ile C C 177.2 . 1 172 16 Ile CA C 66.0 . 1 173 16 Ile CB C 39.1 . 1 174 16 Ile CG1 C 29.2 . 1 175 16 Ile CG2 C 16.6 . 1 176 16 Ile CD1 C 16.6 . 1 177 16 Ile N N 117.9 . 1 178 17 Ala H H 7.96 . 1 179 17 Ala HA H 3.93 . 1 180 17 Ala HB H 1.48 . 1 181 17 Ala C C 180.6 . 1 182 17 Ala CA C 55.4 . 1 183 17 Ala CB C 18.0 . 1 184 17 Ala N N 118.3 . 1 185 18 Glu H H 7.63 . 1 186 18 Glu HA H 4.03 . 1 187 18 Glu HB2 H 2.09 . 2 188 18 Glu HB3 H 2.14 . 2 189 18 Glu HG2 H 2.34 . 2 190 18 Glu HG3 H 2.60 . 2 191 18 Glu C C 179.4 . 1 192 18 Glu CA C 59.8 . 1 193 18 Glu CB C 30.3 . 1 194 18 Glu CG C 37.3 . 1 195 18 Glu N N 116.3 . 1 196 19 Ile H H 8.11 . 1 197 19 Ile HA H 3.59 . 1 198 19 Ile HB H 2.03 . 1 199 19 Ile HG12 H 0.78 . 2 200 19 Ile HG13 H 2.03 . 2 201 19 Ile HG2 H 0.89 . 1 202 19 Ile HD1 H 0.66 . 1 203 19 Ile C C 177.8 . 1 204 19 Ile CA C 66.5 . 1 205 19 Ile CB C 37.5 . 1 206 19 Ile CG1 C 29.5 . 1 207 19 Ile CG2 C 18.7 . 1 208 19 Ile CD1 C 13.6 . 1 209 19 Ile N N 121.1 . 1 210 20 Leu H H 8.48 . 1 211 20 Leu HA H 4.02 . 1 212 20 Leu HB2 H 1.44 . 2 213 20 Leu HB3 H 1.93 . 2 214 20 Leu HG H 2.03 . 1 215 20 Leu HD1 H 0.51 . 1 216 20 Leu HD2 H 0.77 . 1 217 20 Leu C C 180.5 . 1 218 20 Leu CA C 58.6 . 1 219 20 Leu CB C 40.4 . 1 220 20 Leu CG C 26.3 . 1 221 20 Leu CD1 C 25.8 . 1 222 20 Leu CD2 C 22.3 . 1 223 20 Leu N N 118.3 . 1 224 21 Val H H 7.81 . 1 225 21 Val HA H 3.77 . 1 226 21 Val HB H 2.27 . 1 227 21 Val HG1 H 1.00 . 2 228 21 Val HG2 H 1.13 . 2 229 21 Val C C 178.2 . 1 230 21 Val CA C 66.8 . 1 231 21 Val CB C 31.6 . 1 232 21 Val CG1 C 21.6 . 1 233 21 Val CG2 C 23.6 . 1 234 21 Val N N 119.7 . 1 235 22 Val H H 7.53 . 1 236 22 Val HA H 3.61 . 1 237 22 Val HB H 2.49 . 1 238 22 Val HG1 H 0.93 . 1 239 22 Val HG2 H 1.15 . 1 240 22 Val C C 178.5 . 1 241 22 Val CA C 67.3 . 1 242 22 Val CB C 31.5 . 1 243 22 Val CG1 C 22.5 . 1 244 22 Val CG2 C 22.9 . 1 245 22 Val N N 121.4 . 1 246 23 Leu H H 7.61 . 1 247 23 Leu HA H 3.88 . 1 248 23 Leu HB2 H 1.59 . 2 249 23 Leu HB3 H 2.09 . 2 250 23 Leu HG H 1.98 . 1 251 23 Leu HD1 H 0.94 . 1 252 23 Leu HD2 H 0.85 . 1 253 23 Leu C C 179.7 . 1 254 23 Leu CA C 58.4 . 1 255 23 Leu CB C 40.9 . 1 256 23 Leu CG C 26.6 . 1 257 23 Leu CD1 C 26.1 . 1 258 23 Leu CD2 C 22.5 . 1 259 23 Leu N N 116.8 . 1 260 24 Glu H H 8.16 . 1 261 24 Glu HA H 4.17 . 1 262 24 Glu HB2 H 2.13 . 2 263 24 Glu HB3 H 2.16 . 2 264 24 Glu HG2 H 2.31 . 2 265 24 Glu HG3 H 2.39 . 2 266 24 Glu C C 180.9 . 1 267 24 Glu CA C 59.0 . 1 268 24 Glu CB C 29.7 . 1 269 24 Glu CG C 36.0 . 1 270 24 Glu N N 119.2 . 1 271 25 Lys H H 8.98 . 1 272 25 Lys HA H 4.05 . 1 273 25 Lys HB2 H 1.85 . 2 274 25 Lys HB3 H 2.01 . 2 275 25 Lys HG2 H 1.33 . 2 276 25 Lys HG3 H 1.45 . 2 277 25 Lys HD2 H 1.63 . 2 278 25 Lys HD3 H 1.63 . 2 279 25 Lys HE2 H 2.88 . 2 280 25 Lys HE3 H 2.88 . 2 281 25 Lys C C 178.6 . 1 282 25 Lys CA C 59.3 . 1 283 25 Lys CB C 32.1 . 1 284 25 Lys CG C 25.0 . 1 285 25 Lys CD C 29.5 . 1 286 25 Lys CE C 42.0 . 1 287 25 Lys N N 122.9 . 1 288 26 His H H 7.40 . 1 289 26 His HA H 4.46 . 1 290 26 His HB2 H 2.92 . 2 291 26 His HB3 H 3.43 . 2 292 26 His HD2 H 7.62 . 1 293 26 His HE1 H 8.28 . 1 294 26 His C C 173.6 . 1 295 26 His CA C 56.5 . 1 296 26 His CB C 29.2 . 1 297 26 His CD2 C 121.3 . 1 298 26 His CE1 C 137.5 . 1 299 26 His N N 113.8 . 1 300 27 Lys H H 8.20 . 1 301 27 Lys HA H 3.95 . 1 302 27 Lys HB2 H 1.94 . 2 303 27 Lys HB3 H 1.94 . 2 304 27 Lys HG2 H 1.41 . 2 305 27 Lys HG3 H 1.41 . 2 306 27 Lys HD2 H 1.67 . 2 307 27 Lys HD3 H 1.78 . 2 308 27 Lys HE2 H 3.03 . 2 309 27 Lys HE3 H 3.03 . 2 310 27 Lys C C 176.5 . 1 311 27 Lys CA C 56.6 . 1 312 27 Lys CB C 29.6 . 1 313 27 Lys CG C 24.9 . 1 314 27 Lys CD C 29.3 . 1 315 27 Lys CE C 42.4 . 1 316 27 Lys N N 119.5 . 1 317 28 Ala H H 7.76 . 1 318 28 Ala HA H 4.49 . 1 319 28 Ala HB H 1.20 . 1 320 28 Ala CA C 51.0 . 1 321 28 Ala CB C 19.2 . 1 322 28 Ala N N 121.5 . 1 323 29 Pro HA H 4.72 . 1 324 29 Pro HB2 H 2.20 . 2 325 29 Pro HB3 H 2.62 . 2 326 29 Pro HG2 H 2.18 . 2 327 29 Pro HG3 H 2.29 . 2 328 29 Pro HD2 H 3.49 . 2 329 29 Pro HD3 H 4.31 . 2 330 29 Pro C C 177.4 . 1 331 29 Pro CA C 62.1 . 1 332 29 Pro CB C 33.0 . 1 333 29 Pro CG C 28.0 . 1 334 29 Pro CD C 51.4 . 1 335 30 Thr H H 8.83 . 1 336 30 Thr HA H 3.68 . 1 337 30 Thr HB H 4.11 . 1 338 30 Thr HG2 H 1.03 . 1 339 30 Thr C C 175.2 . 1 340 30 Thr CA C 67.4 . 1 341 30 Thr CB C 68.5 . 1 342 30 Thr CG2 C 22.3 . 1 343 30 Thr N N 120.4 . 1 344 31 Asp H H 8.88 . 1 345 31 Asp HA H 4.22 . 1 346 31 Asp HB2 H 2.79 . 2 347 31 Asp HB3 H 2.88 . 2 348 31 Asp C C 179.0 . 1 349 31 Asp CA C 57.4 . 1 350 31 Asp CB C 38.7 . 1 351 31 Asp N N 118.6 . 1 352 32 Leu H H 7.54 . 1 353 32 Leu HA H 3.97 . 1 354 32 Leu HB2 H 1.47 . 2 355 32 Leu HB3 H 0.89 . 2 356 32 Leu HG H 1.31 . 1 357 32 Leu HD1 H 0.61 . 1 358 32 Leu HD2 H 0.67 . 1 359 32 Leu C C 178.1 . 1 360 32 Leu CA C 57.5 . 1 361 32 Leu CB C 40.6 . 1 362 32 Leu CG C 27.0 . 1 363 32 Leu CD1 C 23.8 . 1 364 32 Leu CD2 C 25.2 . 1 365 32 Leu N N 124.3 . 1 366 33 Ser H H 8.42 . 1 367 33 Ser HA H 3.86 . 1 368 33 Ser HB2 H 3.56 . 2 369 33 Ser HB3 H 4.15 . 2 370 33 Ser C C 175.9 . 1 371 33 Ser CA C 63.1 . 1 372 33 Ser CB C 62.9 . 1 373 33 Ser N N 116.0 . 1 374 34 Leu H H 8.40 . 1 375 34 Leu HA H 4.01 . 1 376 34 Leu HB2 H 1.60 . 2 377 34 Leu HB3 H 2.00 . 2 378 34 Leu HG H 1.77 . 1 379 34 Leu HD1 H 0.72 . 1 380 34 Leu HD2 H 0.64 . 1 381 34 Leu C C 179.5 . 1 382 34 Leu CA C 58.7 . 1 383 34 Leu CB C 41.5 . 1 384 34 Leu CG C 27.2 . 1 385 34 Leu CD1 C 25.7 . 1 386 34 Leu CD2 C 24.0 . 1 387 34 Leu N N 120.4 . 1 388 35 Met H H 7.97 . 1 389 35 Met HA H 4.21 . 1 390 35 Met HB2 H 2.16 . 2 391 35 Met HB3 H 2.31 . 2 392 35 Met HG2 H 2.49 . 2 393 35 Met HG3 H 2.70 . 2 394 35 Met HE H 2.14 . 1 395 35 Met C C 178.9 . 1 396 35 Met CA C 59.1 . 1 397 35 Met CB C 33.1 . 1 398 35 Met CG C 31.6 . 1 399 35 Met CE C 17.1 . 1 400 35 Met N N 120.3 . 1 401 36 Ala H H 8.71 . 1 402 36 Ala HA H 3.90 . 1 403 36 Ala HB H 1.34 . 1 404 36 Ala C C 179.7 . 1 405 36 Ala CA C 55.4 . 1 406 36 Ala CB C 18.6 . 1 407 36 Ala N N 121.7 . 1 408 37 Leu H H 8.75 . 1 409 37 Leu HA H 3.98 . 1 410 37 Leu HB2 H 1.30 . 2 411 37 Leu HB3 H 2.08 . 2 412 37 Leu HG H 1.93 . 1 413 37 Leu HD1 H 0.76 . 1 414 37 Leu HD2 H 0.94 . 1 415 37 Leu C C 179.6 . 1 416 37 Leu CA C 59.0 . 1 417 37 Leu CB C 42.0 . 1 418 37 Leu CG C 27.6 . 1 419 37 Leu CD1 C 26.8 . 1 420 37 Leu CD2 C 24.0 . 1 421 37 Leu N N 118.1 . 1 422 38 Gly H H 8.78 . 1 423 38 Gly HA2 H 3.65 . 2 424 38 Gly HA3 H 3.94 . 2 425 38 Gly C C 175.6 . 1 426 38 Gly CA C 48.3 . 1 427 38 Gly N N 105.6 . 1 428 39 Asn H H 8.18 . 1 429 39 Asn HA H 4.55 . 1 430 39 Asn HB2 H 2.60 . 2 431 39 Asn HB3 H 2.85 . 2 432 39 Asn HD21 H 7.12 . 1 433 39 Asn HD22 H 7.05 . 1 434 39 Asn C C 178.4 . 1 435 39 Asn CA C 56.0 . 1 436 39 Asn CB C 39.2 . 1 437 39 Asn CG C 175.9 . 1 438 39 Asn N N 120.0 . 1 439 39 Asn ND2 N 110.5 . 1 440 40 Cys H H 8.42 . 1 441 40 Cys HA H 4.01 . 1 442 40 Cys HB2 H 2.59 . 2 443 40 Cys HB3 H 3.41 . 2 444 40 Cys C C 176.0 . 1 445 40 Cys CA C 65.3 . 1 446 40 Cys CB C 27.2 . 1 447 40 Cys N N 120.2 . 1 448 41 Val H H 7.83 . 1 449 41 Val HA H 3.25 . 1 450 41 Val HB H 2.28 . 1 451 41 Val HG1 H 0.26 . 1 452 41 Val HG2 H 0.92 . 1 453 41 Val C C 177.5 . 1 454 41 Val CA C 67.5 . 1 455 41 Val CB C 30.8 . 1 456 41 Val CG1 C 21.0 . 1 457 41 Val CG2 C 23.7 . 1 458 41 Val N N 119.4 . 1 459 42 Thr H H 8.27 . 1 460 42 Thr HA H 3.52 . 1 461 42 Thr HB H 4.18 . 1 462 42 Thr HG2 H 1.12 . 1 463 42 Thr C C 176.2 . 1 464 42 Thr CA C 67.8 . 1 465 42 Thr CB C 67.8 . 1 466 42 Thr CG2 C 22.1 . 1 467 42 Thr N N 113.6 . 1 468 43 His H H 8.25 . 1 469 43 His HA H 4.31 . 1 470 43 His HB2 H 3.29 . 2 471 43 His HB3 H 3.29 . 2 472 43 His HD2 H 6.88 . 1 473 43 His HE1 H 8.41 . 1 474 43 His C C 177.2 . 1 475 43 His CA C 59.3 . 1 476 43 His CB C 28.9 . 1 477 43 His CD2 C 120.1 . 1 478 43 His CE1 C 136.4 . 1 479 43 His N N 120.0 . 1 480 43 His ND1 N 184.3 . 1 481 43 His NE2 N 195.8 . 1 482 44 Leu H H 8.07 . 1 483 44 Leu HA H 3.96 . 1 484 44 Leu HB2 H 1.38 . 2 485 44 Leu HB3 H 1.86 . 2 486 44 Leu HG H 1.78 . 1 487 44 Leu HD1 H 0.81 . 1 488 44 Leu HD2 H 0.87 . 1 489 44 Leu C C 179.3 . 1 490 44 Leu CA C 58.4 . 1 491 44 Leu CB C 42.2 . 1 492 44 Leu CG C 27.3 . 1 493 44 Leu CD1 C 26.1 . 1 494 44 Leu CD2 C 24.0 . 1 495 44 Leu N N 119.4 . 1 496 45 Leu H H 8.41 . 1 497 45 Leu HA H 3.85 . 1 498 45 Leu HB2 H 1.10 . 2 499 45 Leu HB3 H 1.96 . 2 500 45 Leu HG H 1.82 . 1 501 45 Leu HD1 H 0.67 . 1 502 45 Leu HD2 H 0.73 . 1 503 45 Leu C C 178.7 . 1 504 45 Leu CA C 58.2 . 1 505 45 Leu CB C 41.8 . 1 506 45 Leu CG C 27.0 . 1 507 45 Leu CD1 C 26.2 . 1 508 45 Leu CD2 C 24.2 . 1 509 45 Leu N N 118.1 . 1 510 46 Glu H H 8.12 . 1 511 46 Glu HA H 3.74 . 1 512 46 Glu HB2 H 1.96 . 2 513 46 Glu HB3 H 2.10 . 2 514 46 Glu HG2 H 2.19 . 2 515 46 Glu HG3 H 2.42 . 2 516 46 Glu C C 178.0 . 1 517 46 Glu CA C 58.9 . 1 518 46 Glu CB C 29.7 . 1 519 46 Glu CG C 36.5 . 1 520 46 Glu N N 115.0 . 1 521 47 Arg H H 7.74 . 1 522 47 Arg HA H 4.27 . 1 523 47 Arg HB2 H 1.69 . 2 524 47 Arg HB3 H 1.84 . 2 525 47 Arg HG2 H 1.53 . 2 526 47 Arg HG3 H 1.53 . 2 527 47 Arg HD2 H 2.96 . 2 528 47 Arg HD3 H 3.05 . 2 529 47 Arg HE H 7.27 . 1 530 47 Arg C C 178.5 . 1 531 47 Arg CA C 57.0 . 1 532 47 Arg CB C 31.6 . 1 533 47 Arg CG C 27.1 . 1 534 47 Arg CD C 42.8 . 1 535 47 Arg N N 114.0 . 1 536 47 Arg NE N 84.6 . 1 537 48 Lys H H 8.21 . 1 538 48 Lys HA H 4.62 . 1 539 48 Lys HB2 H 1.88 . 2 540 48 Lys HB3 H 2.05 . 2 541 48 Lys HG2 H 1.35 . 2 542 48 Lys HG3 H 1.53 . 2 543 48 Lys HD2 H 1.62 . 2 544 48 Lys HD3 H 1.67 . 2 545 48 Lys HE2 H 2.91 . 2 546 48 Lys HE3 H 3.00 . 2 547 48 Lys C C 176.4 . 1 548 48 Lys CA C 55.5 . 1 549 48 Lys CB C 34.5 . 1 550 48 Lys CG C 24.8 . 1 551 48 Lys CD C 28.3 . 1 552 48 Lys CE C 42.1 . 1 553 48 Lys N N 114.0 . 1 554 49 Val H H 7.63 . 1 555 49 Val HA H 4.71 . 1 556 49 Val HB H 2.48 . 1 557 49 Val HG1 H 1.02 . 1 558 49 Val HG2 H 0.98 . 1 559 49 Val CA C 59.4 . 1 560 49 Val CB C 33.6 . 1 561 49 Val CG1 C 20.7 . 1 562 49 Val CG2 C 21.9 . 1 563 49 Val N N 121.8 . 1 564 50 Pro HA H 4.46 . 1 565 50 Pro HB2 H 2.04 . 2 566 50 Pro HB3 H 2.48 . 2 567 50 Pro HG2 H 2.04 . 2 568 50 Pro HG3 H 2.09 . 2 569 50 Pro HD2 H 3.70 . 2 570 50 Pro HD3 H 3.94 . 2 571 50 Pro C C 177.9 . 1 572 50 Pro CA C 63.2 . 1 573 50 Pro CB C 32.9 . 1 574 50 Pro CG C 27.8 . 1 575 50 Pro CD C 51.8 . 1 576 51 Ser H H 8.95 . 1 577 51 Ser HA H 3.91 . 1 578 51 Ser HB2 H 3.72 . 2 579 51 Ser HB3 H 3.72 . 2 580 51 Ser C C 176.3 . 1 581 51 Ser CA C 62.8 . 1 582 51 Ser CB C 62.7 . 1 583 51 Ser N N 119.0 . 1 584 52 Glu H H 9.48 . 1 585 52 Glu HA H 4.22 . 1 586 52 Glu HB2 H 2.11 . 2 587 52 Glu HB3 H 2.11 . 2 588 52 Glu HG2 H 2.38 . 2 589 52 Glu HG3 H 2.38 . 2 590 52 Glu C C 177.0 . 1 591 52 Glu CA C 59.2 . 1 592 52 Glu CB C 28.7 . 1 593 52 Glu CG C 36.0 . 1 594 52 Glu N N 118.9 . 1 595 53 Ser H H 7.77 . 1 596 53 Ser HA H 4.94 . 1 597 53 Ser HB2 H 3.72 . 2 598 53 Ser HB3 H 3.97 . 2 599 53 Ser C C 174.2 . 1 600 53 Ser CA C 58.2 . 1 601 53 Ser CB C 64.8 . 1 602 53 Ser N N 112.5 . 1 603 54 Arg H H 7.38 . 1 604 54 Arg HA H 3.63 . 1 605 54 Arg HB2 H 1.60 . 2 606 54 Arg HB3 H 1.97 . 2 607 54 Arg HG2 H 1.50 . 2 608 54 Arg HG3 H 1.59 . 2 609 54 Arg HD2 H 2.95 . 2 610 54 Arg HD3 H 3.20 . 2 611 54 Arg HE H 6.69 . 1 612 54 Arg HH11 H 7.26 . 2 613 54 Arg HH12 H 7.26 . 2 614 54 Arg HH21 H 7.26 . 2 615 54 Arg HH22 H 7.26 . 2 616 54 Arg C C 177.2 . 1 617 54 Arg CA C 61.4 . 1 618 54 Arg CB C 31.2 . 1 619 54 Arg CG C 28.7 . 1 620 54 Arg CD C 44.0 . 1 621 54 Arg N N 122.1 . 1 622 54 Arg NE N 85.6 . 1 623 55 Gln H H 9.01 . 1 624 55 Gln HA H 3.84 . 1 625 55 Gln HB2 H 2.03 . 2 626 55 Gln HB3 H 2.05 . 2 627 55 Gln HG2 H 2.32 . 2 628 55 Gln HG3 H 2.32 . 2 629 55 Gln HE21 H 7.73 . 1 630 55 Gln HE22 H 6.79 . 1 631 55 Gln C C 178.0 . 1 632 55 Gln CA C 59.7 . 1 633 55 Gln CB C 28.1 . 1 634 55 Gln CG C 33.9 . 1 635 55 Gln CD C 179.5 . 1 636 55 Gln N N 118.0 . 1 637 55 Gln NE2 N 111.2 . 1 638 56 Ala H H 8.28 . 1 639 56 Ala HA H 4.19 . 1 640 56 Ala HB H 1.50 . 1 641 56 Ala C C 181.2 . 1 642 56 Ala CA C 55.2 . 1 643 56 Ala CB C 17.9 . 1 644 56 Ala N N 122.3 . 1 645 57 Val H H 8.15 . 1 646 57 Val HA H 3.74 . 1 647 57 Val HB H 1.97 . 1 648 57 Val HG1 H 0.92 . 1 649 57 Val HG2 H 1.10 . 1 650 57 Val C C 178.9 . 1 651 57 Val CA C 66.7 . 1 652 57 Val CB C 31.7 . 1 653 57 Val CG1 C 22.3 . 1 654 57 Val CG2 C 23.1 . 1 655 57 Val N N 119.6 . 1 656 58 Ala H H 8.37 . 1 657 58 Ala HA H 3.91 . 1 658 58 Ala HB H 1.46 . 1 659 58 Ala C C 179.5 . 1 660 58 Ala CA C 55.8 . 1 661 58 Ala CB C 18.5 . 1 662 58 Ala N N 123.0 . 1 663 59 Glu H H 8.63 . 1 664 59 Glu HA H 4.10 . 1 665 59 Glu HB2 H 2.13 . 2 666 59 Glu HB3 H 2.23 . 2 667 59 Glu HG2 H 2.32 . 2 668 59 Glu HG3 H 2.53 . 2 669 59 Glu C C 179.4 . 1 670 59 Glu CA C 59.6 . 1 671 59 Glu CB C 29.3 . 1 672 59 Glu CG C 36.7 . 1 673 59 Glu N N 118.4 . 1 674 60 Gln H H 8.28 . 1 675 60 Gln HA H 4.09 . 1 676 60 Gln HB2 H 2.29 . 2 677 60 Gln HB3 H 2.29 . 2 678 60 Gln HG2 H 2.51 . 2 679 60 Gln HG3 H 2.58 . 2 680 60 Gln HE21 H 7.48 . 1 681 60 Gln HE22 H 6.88 . 1 682 60 Gln C C 178.7 . 1 683 60 Gln CA C 59.1 . 1 684 60 Gln CB C 28.1 . 1 685 60 Gln CG C 33.8 . 1 686 60 Gln CD C 180.1 . 1 687 60 Gln N N 120.4 . 1 688 60 Gln NE2 N 111.5 . 1 689 61 Phe H H 8.40 . 1 690 61 Phe HA H 4.16 . 1 691 61 Phe HB2 H 3.19 . 2 692 61 Phe HB3 H 3.44 . 2 693 61 Phe HD1 H 7.18 . 3 694 61 Phe HD2 H 7.18 . 3 695 61 Phe HE1 H 7.41 . 3 696 61 Phe HE2 H 7.41 . 3 697 61 Phe HZ H 6.94 . 1 698 61 Phe C C 177.6 . 1 699 61 Phe CA C 61.4 . 1 700 61 Phe CB C 39.1 . 1 701 61 Phe CD1 C 132.1 . 3 702 61 Phe CD2 C 132.1 . 3 703 61 Phe CE1 C 131.0 . 3 704 61 Phe CE2 C 131.0 . 3 705 61 Phe CZ C 129.1 . 1 706 61 Phe N N 122.0 . 1 707 62 Ala H H 8.62 . 1 708 62 Ala HA H 3.98 . 1 709 62 Ala HB H 1.72 . 1 710 62 Ala C C 179.7 . 1 711 62 Ala CA C 55.5 . 1 712 62 Ala CB C 18.9 . 1 713 62 Ala N N 122.0 . 1 714 63 Lys H H 8.47 . 1 715 63 Lys HA H 4.05 . 1 716 63 Lys HB2 H 1.89 . 2 717 63 Lys HB3 H 1.95 . 2 718 63 Lys HG2 H 1.42 . 2 719 63 Lys HG3 H 1.63 . 2 720 63 Lys HD2 H 1.69 . 2 721 63 Lys HD3 H 1.69 . 2 722 63 Lys HE2 H 2.96 . 2 723 63 Lys HE3 H 2.96 . 2 724 63 Lys C C 179.2 . 1 725 63 Lys CA C 59.6 . 1 726 63 Lys CB C 32.6 . 1 727 63 Lys CG C 25.5 . 1 728 63 Lys CD C 29.5 . 1 729 63 Lys CE C 42.2 . 1 730 63 Lys N N 119.5 . 1 731 64 Ala H H 8.00 . 1 732 64 Ala HA H 4.10 . 1 733 64 Ala HB H 1.41 . 1 734 64 Ala C C 180.7 . 1 735 64 Ala CA C 55.0 . 1 736 64 Ala CB C 17.7 . 1 737 64 Ala N N 122.0 . 1 738 65 Leu H H 7.83 . 1 739 65 Leu HA H 3.95 . 1 740 65 Leu HB2 H 1.38 . 2 741 65 Leu HB3 H 1.68 . 2 742 65 Leu HG H 1.48 . 1 743 65 Leu HD1 H 0.74 . 1 744 65 Leu HD2 H 0.81 . 1 745 65 Leu C C 178.9 . 1 746 65 Leu CA C 57.8 . 1 747 65 Leu CB C 41.7 . 1 748 65 Leu CG C 27.1 . 1 749 65 Leu CD1 C 25.2 . 1 750 65 Leu CD2 C 25.9 . 1 751 65 Leu N N 120.6 . 1 752 66 Ala H H 7.99 . 1 753 66 Ala HA H 3.84 . 1 754 66 Ala HB H 1.49 . 1 755 66 Ala C C 180.3 . 1 756 66 Ala CA C 55.5 . 1 757 66 Ala CB C 17.9 . 1 758 66 Ala N N 120.9 . 1 759 67 Gln H H 8.14 . 1 760 67 Gln HA H 4.07 . 1 761 67 Gln HB2 H 2.11 . 2 762 67 Gln HB3 H 2.18 . 2 763 67 Gln HG2 H 2.46 . 2 764 67 Gln HG3 H 2.46 . 2 765 67 Gln HE21 H 7.46 . 1 766 67 Gln HE22 H 6.91 . 1 767 67 Gln C C 178.4 . 1 768 67 Gln CA C 58.3 . 1 769 67 Gln CB C 28.4 . 1 770 67 Gln CG C 33.9 . 1 771 67 Gln CD C 180.2 . 1 772 67 Gln N N 116.6 . 1 773 67 Gln NE2 N 112.2 . 1 774 68 Ser H H 8.12 . 1 775 68 Ser HA H 4.22 . 1 776 68 Ser HB2 H 3.99 . 2 777 68 Ser HB3 H 3.99 . 2 778 68 Ser C C 176.5 . 1 779 68 Ser CA C 61.5 . 1 780 68 Ser CB C 63.0 . 1 781 68 Ser N N 116.7 . 1 782 69 Val H H 7.66 . 1 783 69 Val HA H 3.86 . 1 784 69 Val HB H 2.10 . 1 785 69 Val HG1 H 0.82 . 1 786 69 Val HG2 H 0.93 . 1 787 69 Val C C 177.4 . 1 788 69 Val CA C 64.9 . 1 789 69 Val CB C 31.9 . 1 790 69 Val CG1 C 21.2 . 1 791 69 Val CG2 C 22.5 . 1 792 69 Val N N 119.8 . 1 793 70 Lys H H 7.86 . 1 794 70 Lys HA H 4.04 . 1 795 70 Lys HB2 H 1.90 . 2 796 70 Lys HB3 H 1.90 . 2 797 70 Lys HG2 H 1.38 . 2 798 70 Lys HG3 H 1.47 . 2 799 70 Lys HD2 H 1.66 . 2 800 70 Lys HD3 H 1.66 . 2 801 70 Lys HE2 H 2.96 . 2 802 70 Lys HE3 H 2.96 . 2 803 70 Lys C C 178.4 . 1 804 70 Lys CA C 59.2 . 1 805 70 Lys CB C 32.8 . 1 806 70 Lys CG C 25.0 . 1 807 70 Lys CD C 29.5 . 1 808 70 Lys CE C 42.2 . 1 809 70 Lys N N 121.3 . 1 810 71 Ser H H 8.39 . 1 811 71 Ser HA H 4.28 . 1 812 71 Ser HB2 H 3.94 . 2 813 71 Ser HB3 H 3.94 . 2 814 71 Ser C C 176.0 . 1 815 71 Ser CA C 60.7 . 1 816 71 Ser CB C 63.3 . 1 817 71 Ser N N 114.4 . 1 818 72 Asn H H 7.94 . 1 819 72 Asn HA H 4.63 . 1 820 72 Asn HB2 H 2.87 . 2 821 72 Asn HB3 H 2.87 . 2 822 72 Asn HD21 H 7.76 . 1 823 72 Asn HD22 H 6.90 . 1 824 72 Asn C C 176.7 . 1 825 72 Asn CA C 55.0 . 1 826 72 Asn CB C 39.0 . 1 827 72 Asn CG C 176.7 . 1 828 72 Asn N N 119.7 . 1 829 72 Asn ND2 N 112.8 . 1 830 73 Leu H H 7.90 . 1 831 73 Leu HA H 4.18 . 1 832 73 Leu HB2 H 1.55 . 2 833 73 Leu HB3 H 1.86 . 2 834 73 Leu HG H 1.80 . 1 835 73 Leu HD1 H 0.95 . 1 836 73 Leu HD2 H 0.92 . 1 837 73 Leu C C 178.4 . 1 838 73 Leu CA C 56.7 . 1 839 73 Leu CB C 42.3 . 1 840 73 Leu CG C 26.9 . 1 841 73 Leu CD1 C 26.1 . 1 842 73 Leu CD2 C 23.9 . 1 843 73 Leu N N 121.0 . 1 844 74 Glu H H 8.06 . 1 845 74 Glu HA H 4.12 . 1 846 74 Glu HB2 H 1.96 . 2 847 74 Glu HB3 H 1.96 . 2 848 74 Glu HG2 H 2.20 . 2 849 74 Glu HG3 H 2.32 . 2 850 74 Glu C C 177.1 . 1 851 74 Glu CA C 57.4 . 1 852 74 Glu CB C 29.9 . 1 853 74 Glu CG C 36.1 . 1 854 74 Glu N N 119.3 . 1 855 75 His H H 8.14 . 1 856 75 His HA H 4.59 . 1 857 75 His HB2 H 3.13 . 2 858 75 His HB3 H 3.20 . 2 859 75 His HD2 H 7.20 . 1 860 75 His C C 174.9 . 1 861 75 His CA C 56.1 . 1 862 75 His CB C 29.0 . 1 863 75 His CD2 C 120.0 . 1 864 75 His N N 117.5 . 1 865 76 His H H 8.24 . 1 866 76 His C C 174.5 . 1 867 76 His CA C 55.9 . 1 868 76 His CB C 29.3 . 1 869 76 His N N 118.3 . 1 870 77 His H H 8.40 . 1 871 77 His HA H 4.64 . 1 872 77 His HB2 H 3.12 . 2 873 77 His HB3 H 3.20 . 2 874 77 His C C 173.7 . 1 875 77 His CA C 55.7 . 1 876 77 His CB C 29.7 . 1 877 77 His N N 119.3 . 1 878 78 His H H 8.33 . 1 879 78 His CA C 57.2 . 1 880 78 His CB C 29.9 . 1 881 78 His N N 125.4 . 1