1 1 Met HA H 3.823 . 1 2 1 Met HB2 H 1.956 . 2 3 1 Met HB3 H 1.976 . 2 4 1 Met HG2 H 2.151 . 2 5 1 Met HG3 H 2.036 . 2 6 1 Met C C 170.978 . 1 7 1 Met CA C 55.193 . 1 8 1 Met CB C 34.019 . 1 9 1 Met CG C 31.136 . 1 10 2 Lys H H 8.560 . 1 11 2 Lys HA H 4.620 . 1 12 2 Lys HB2 H 1.494 . 2 13 2 Lys HB3 H 1.329 . 2 14 2 Lys HG2 H 1.384 . 2 15 2 Lys HG3 H 1.223 . 2 16 2 Lys HD2 H 1.604 . 2 17 2 Lys HD3 H 1.651 . 2 18 2 Lys HE2 H 2.909 . 2 19 2 Lys C C 174.608 . 1 20 2 Lys CA C 54.206 . 1 21 2 Lys CB C 35.916 . 1 22 2 Lys CG C 24.011 . 1 23 2 Lys CD C 29.373 . 1 24 2 Lys CE C 42.086 . 1 25 2 Lys N N 122.783 . 1 26 3 Ile H H 8.373 . 1 27 3 Ile HA H 3.659 . 1 28 3 Ile HB H 1.486 . 1 29 3 Ile HG12 H 0.781 . 2 30 3 Ile HG13 H 0.060 . 2 31 3 Ile HG2 H 0.595 . 1 32 3 Ile HD1 H 0.775 . 1 33 3 Ile C C 176.569 . 1 34 3 Ile CA C 62.565 . 1 35 3 Ile CB C 38.792 . 1 36 3 Ile CG1 C 27.255 . 1 37 3 Ile CG2 C 17.200 . 1 38 3 Ile CD1 C 14.332 . 1 39 3 Ile N N 120.076 . 1 40 4 Ile H H 9.159 . 1 41 4 Ile HA H 4.135 . 1 42 4 Ile HB H 1.613 . 1 43 4 Ile HG12 H 1.164 . 2 44 4 Ile HG13 H 1.025 . 2 45 4 Ile HG2 H 0.802 . 1 46 4 Ile HD1 H 0.640 . 1 47 4 Ile C C 176.194 . 1 48 4 Ile CA C 60.586 . 1 49 4 Ile CB C 37.466 . 1 50 4 Ile CG1 C 26.368 . 1 51 4 Ile CG2 C 16.570 . 1 52 4 Ile CD1 C 10.304 . 1 53 4 Ile N N 127.239 . 1 54 5 Ser H H 7.482 . 1 55 5 Ser HA H 4.545 . 1 56 5 Ser HB2 H 3.784 . 2 57 5 Ser HB3 H 3.784 . 2 58 5 Ser C C 171.580 . 1 59 5 Ser CA C 57.655 . 1 60 5 Ser CB C 65.178 . 1 61 5 Ser N N 112.465 . 1 62 6 Ile H H 8.402 . 1 63 6 Ile HA H 4.683 . 1 64 6 Ile HB H 1.604 . 1 65 6 Ile HG12 H 1.557 . 2 66 6 Ile HG13 H 0.890 . 2 67 6 Ile HG2 H 0.702 . 1 68 6 Ile HD1 H 0.829 . 1 69 6 Ile C C 175.289 . 1 70 6 Ile CA C 61.373 . 1 71 6 Ile CB C 40.612 . 1 72 6 Ile CG1 C 28.113 . 1 73 6 Ile CG2 C 17.923 . 1 74 6 Ile CD1 C 13.730 . 1 75 6 Ile N N 122.071 . 1 76 7 Ser H H 9.201 . 1 77 7 Ser HA H 4.814 . 1 78 7 Ser HB2 H 3.622 . 2 79 7 Ser HB3 H 3.744 . 2 80 7 Ser C C 172.681 . 1 81 7 Ser CA C 56.896 . 1 82 7 Ser CB C 66.053 . 1 83 7 Ser N N 121.348 . 1 84 8 Glu H H 8.542 . 1 85 8 Glu HA H 4.669 . 1 86 8 Glu HB2 H 2.113 . 2 87 8 Glu HB3 H 1.938 . 2 88 8 Glu HG2 H 2.241 . 2 89 8 Glu HG3 H 2.241 . 2 90 8 Glu C C 176.388 . 1 91 8 Glu CA C 56.702 . 1 92 8 Glu CB C 30.736 . 1 93 8 Glu CG C 36.787 . 1 94 8 Glu N N 123.371 . 1 95 9 Thr H H 8.663 . 1 96 9 Thr HA H 4.958 . 1 97 9 Thr HB H 4.516 . 1 98 9 Thr HG2 H 1.108 . 1 99 9 Thr CA C 60.316 . 1 100 9 Thr CB C 69.478 . 1 101 9 Thr CG2 C 21.130 . 1 102 9 Thr N N 112.855 . 1 103 10 Pro HA H 4.376 . 1 104 10 Pro HB2 H 2.465 . 2 105 10 Pro HB3 H 1.842 . 2 106 10 Pro HG2 H 2.072 . 2 107 10 Pro HG3 H 1.915 . 2 108 10 Pro HD2 H 3.839 . 2 109 10 Pro HD3 H 3.643 . 2 110 10 Pro C C 176.126 . 1 111 10 Pro CA C 64.454 . 1 112 10 Pro CB C 32.008 . 1 113 10 Pro CG C 27.971 . 1 114 10 Pro CD C 51.341 . 1 115 11 Asn H H 7.621 . 1 116 11 Asn HA H 4.933 . 1 117 11 Asn HB2 H 2.860 . 2 118 11 Asn HB3 H 2.663 . 2 119 11 Asn HD21 H 7.634 . 1 120 11 Asn HD22 H 6.983 . 1 121 11 Asn CA C 51.559 . 1 122 11 Asn CB C 39.809 . 1 123 11 Asn N N 114.720 . 1 124 11 Asn ND2 N 113.599 . 1 125 12 His HA H 4.702 . 1 126 12 His HB2 H 3.491 . 2 127 12 His HB3 H 3.409 . 2 1271 12 His HD2 H 7.311 . 1 128 12 His C C 175.663 . 1 129 12 His CA C 58.463 . 1 130 12 His CB C 28.533 . 1 1301 12 His CD2 C 120.513 . 1 131 13 Asn H H 8.511 . 1 132 13 Asn HA H 5.018 . 1 133 13 Asn HB2 H 2.723 . 2 134 13 Asn HB3 H 3.330 . 2 135 13 Asn HD21 H 7.375 . 1 136 13 Asn HD22 H 7.222 . 1 137 13 Asn C C 174.367 . 1 138 13 Asn CA C 53.890 . 1 139 13 Asn CB C 38.854 . 1 140 13 Asn N N 115.359 . 1 141 13 Asn ND2 N 113.227 . 1 142 14 Thr H H 8.234 . 1 143 14 Thr HA H 5.980 . 1 144 14 Thr HB H 3.824 . 1 145 14 Thr HG2 H 1.213 . 1 146 14 Thr C C 174.278 . 1 147 14 Thr CA C 62.729 . 1 148 14 Thr CB C 71.595 . 1 149 14 Thr CG2 C 22.584 . 1 150 14 Thr N N 117.676 . 1 151 15 Met H H 8.994 . 1 152 15 Met HA H 4.868 . 1 153 15 Met HB2 H 1.282 . 2 154 15 Met HB3 H 0.912 . 2 155 15 Met HG2 H 1.282 . 2 156 15 Met HG3 H 1.252 . 2 1561 15 Met HE H 1.149 . 1 157 15 Met C C 173.748 . 1 158 15 Met CA C 53.076 . 1 159 15 Met CB C 34.692 . 1 160 15 Met CG C 31.698 . 1 1601 15 Met CE C 15.886 . 1 161 15 Met N N 127.785 . 1 162 16 Lys H H 8.740 . 1 163 16 Lys HA H 5.017 . 1 164 16 Lys HB2 H 1.347 . 2 165 16 Lys HB3 H 1.672 . 2 166 16 Lys HG2 H 1.058 . 2 167 16 Lys HG3 H 0.877 . 2 168 16 Lys HD2 H 1.087 . 2 169 16 Lys HD3 H 1.087 . 2 170 16 Lys HE2 H 2.033 . 2 171 16 Lys HE3 H 1.431 . 2 172 16 Lys C C 175.183 . 1 173 16 Lys CA C 55.840 . 1 174 16 Lys CB C 34.524 . 1 175 16 Lys CG C 25.371 . 1 176 16 Lys CD C 29.625 . 1 177 16 Lys CE C 41.036 . 1 178 16 Lys N N 125.158 . 1 179 17 Ile H H 9.821 . 1 180 17 Ile HA H 4.738 . 1 181 17 Ile HB H 2.089 . 1 182 17 Ile HG12 H 0.993 . 2 183 17 Ile HG13 H 1.552 . 2 184 17 Ile HG2 H 0.706 . 1 185 17 Ile HD1 H 0.796 . 1 186 17 Ile C C 175.153 . 1 187 17 Ile CA C 60.903 . 1 188 17 Ile CB C 39.202 . 1 189 17 Ile CG1 C 27.425 . 1 190 17 Ile CG2 C 18.505 . 1 191 17 Ile CD1 C 13.630 . 1 192 17 Ile N N 131.726 . 1 193 18 Thr H H 9.005 . 1 194 18 Thr HA H 4.707 . 1 195 18 Thr HB H 4.056 . 1 196 18 Thr HG2 H 1.303 . 1 197 18 Thr C C 174.158 . 1 198 18 Thr CA C 63.777 . 1 199 18 Thr CB C 68.945 . 1 200 18 Thr CG2 C 21.426 . 1 201 18 Thr N N 124.752 . 1 202 19 Leu H H 9.640 . 1 203 19 Leu HA H 5.008 . 1 204 19 Leu HB2 H 1.870 . 2 205 19 Leu HB3 H 1.622 . 2 206 19 Leu HG H 1.816 . 1 207 19 Leu HD1 H 0.871 . 1 208 19 Leu HD2 H 0.339 . 1 209 19 Leu C C 177.145 . 1 210 19 Leu CA C 53.302 . 1 211 19 Leu CB C 45.236 . 1 212 19 Leu CG C 27.274 . 1 213 19 Leu CD1 C 25.636 . 1 214 19 Leu CD2 C 23.644 . 1 215 19 Leu N N 128.781 . 1 216 20 Ser H H 8.121 . 1 217 20 Ser HA H 4.033 . 1 218 20 Ser HB2 H 4.268 . 2 219 20 Ser HB3 H 3.584 . 2 220 20 Ser C C 173.483 . 1 221 20 Ser CA C 59.557 . 1 222 20 Ser CB C 63.159 . 1 223 20 Ser N N 110.268 . 1 224 21 Glu H H 6.961 . 1 225 21 Glu HA H 4.734 . 1 226 21 Glu HB2 H 1.735 . 2 227 21 Glu HB3 H 2.082 . 2 228 21 Glu HG2 H 2.227 . 2 229 21 Glu HG3 H 2.265 . 2 230 21 Glu C C 174.805 . 1 231 21 Glu CA C 54.655 . 1 232 21 Glu CB C 33.366 . 1 233 21 Glu CG C 36.076 . 1 234 21 Glu N N 118.393 . 1 235 22 Ser H H 8.623 . 1 236 22 Ser HA H 4.670 . 1 237 22 Ser HB2 H 3.678 . 2 238 22 Ser HB3 H 3.679 . 2 239 22 Ser C C 175.260 . 1 240 22 Ser CA C 57.137 . 1 241 22 Ser CB C 65.168 . 1 242 22 Ser N N 115.935 . 1 243 23 Arg H H 8.191 . 1 244 23 Arg HA H 4.188 . 1 245 23 Arg HB2 H 1.625 . 2 246 23 Arg HB3 H 1.804 . 2 247 23 Arg HG2 H 1.535 . 2 248 23 Arg HG3 H 1.282 . 2 249 23 Arg HD2 H 2.422 . 2 250 23 Arg HD3 H 2.421 . 2 251 23 Arg C C 176.502 . 1 252 23 Arg CA C 56.683 . 1 253 23 Arg CB C 31.369 . 1 254 23 Arg CG C 27.264 . 1 255 23 Arg CD C 41.989 . 1 256 23 Arg N N 123.783 . 1 257 24 Glu H H 8.661 . 1 258 24 Glu HA H 4.203 . 1 259 24 Glu HB2 H 2.084 . 2 260 24 Glu HB3 H 1.987 . 2 261 24 Glu HG2 H 2.269 . 2 262 24 Glu HG3 H 2.269 . 2 263 24 Glu C C 177.273 . 1 264 24 Glu CA C 56.863 . 1 265 24 Glu CB C 29.913 . 1 266 24 Glu CG C 36.206 . 1 267 24 Glu N N 122.151 . 1 268 25 Gly H H 8.463 . 1 269 25 Gly HA2 H 3.981 . 2 270 25 Gly HA3 H 3.989 . 2 271 25 Gly C C 174.562 . 1 272 25 Gly CA C 45.348 . 1 273 25 Gly N N 111.861 . 1 274 26 Met H H 8.661 . 1 275 26 Met HA H 4.681 . 1 276 26 Met HB2 H 2.272 . 2 277 26 Met HB3 H 1.913 . 2 278 26 Met HG2 H 2.646 . 2 279 26 Met HG3 H 2.621 . 2 2791 26 Met HE H 1.723 . 1 280 26 Met C C 176.411 . 1 281 26 Met CA C 54.635 . 1 282 26 Met CB C 32.103 . 1 283 26 Met CG C 32.262 . 1 2831 26 Met CE C 17.385 . 1 284 26 Met N N 118.985 . 1 285 27 Thr H H 7.601 . 1 286 27 Thr HA H 4.276 . 1 287 27 Thr HB H 4.234 . 1 288 27 Thr HG2 H 1.233 . 1 289 27 Thr C C 173.646 . 1 290 27 Thr CA C 62.137 . 1 291 27 Thr CB C 70.256 . 1 292 27 Thr CG2 C 21.838 . 1 293 27 Thr N N 112.356 . 1 294 28 Ser H H 8.370 . 1 295 28 Ser HA H 4.937 . 1 296 28 Ser HB2 H 3.473 . 2 297 28 Ser HB3 H 3.530 . 2 298 28 Ser C C 172.911 . 1 299 28 Ser CA C 56.309 . 1 300 28 Ser CB C 67.031 . 1 301 28 Ser N N 116.874 . 1 302 29 Asp H H 7.885 . 1 303 29 Asp HA H 4.823 . 1 304 29 Asp HB2 H 1.969 . 2 305 29 Asp HB3 H 1.723 . 2 306 29 Asp C C 173.762 . 1 307 29 Asp CA C 54.208 . 1 308 29 Asp CB C 47.234 . 1 309 29 Asp N N 117.074 . 1 310 30 Thr H H 8.189 . 1 311 30 Thr HA H 5.123 . 1 312 30 Thr HB H 3.917 . 1 313 30 Thr HG2 H 1.145 . 1 314 30 Thr C C 173.612 . 1 315 30 Thr CA C 61.941 . 1 316 30 Thr CB C 70.143 . 1 317 30 Thr CG2 C 21.130 . 1 318 30 Thr N N 115.249 . 1 319 31 Tyr H H 9.791 . 1 320 31 Tyr HA H 5.153 . 1 321 31 Tyr HB2 H 2.881 . 2 322 31 Tyr HB3 H 2.635 . 2 323 31 Tyr HD1 H 6.928 . 2 324 31 Tyr HE1 H 6.727 . 2 3231 31 Tyr HD2 H 6.928 . 2 3241 31 Tyr HE2 H 6.727 . 2 325 31 Tyr C C 175.531 . 1 326 31 Tyr CA C 55.813 . 1 327 31 Tyr CB C 41.157 . 1 328 31 Tyr CD1 C 133.633 . 2 329 31 Tyr CE1 C 117.584 . 2 3281 31 Tyr CD2 C 133.633 . 2 3291 31 Tyr CE2 C 117.584 . 2 330 31 Tyr N N 127.894 . 1 331 32 Thr H H 9.143 . 1 332 32 Thr HA H 4.593 . 1 333 32 Thr HB H 4.460 . 1 334 32 Thr HG2 H 1.179 . 1 335 32 Thr C C 173.565 . 1 336 32 Thr CA C 61.611 . 1 337 32 Thr CB C 71.109 . 1 338 32 Thr CG2 C 22.032 . 1 339 32 Thr N N 111.101 . 1 340 33 Lys H H 8.351 . 1 341 33 Lys HA H 4.717 . 1 342 33 Lys HB2 H 1.657 . 2 343 33 Lys HB3 H 1.337 . 2 344 33 Lys HG2 H 1.514 . 2 345 33 Lys HD2 H 1.677 . 2 346 33 Lys HD3 H 1.775 . 2 347 33 Lys HE2 H 2.966 . 2 348 33 Lys C C 174.595 . 1 349 33 Lys CA C 54.424 . 1 350 33 Lys CB C 35.335 . 1 351 33 Lys CG C 23.313 . 1 352 33 Lys CD C 29.126 . 1 353 33 Lys CE C 42.253 . 1 354 33 Lys N N 122.475 . 1 355 34 Val H H 8.480 . 1 356 34 Val HA H 3.618 . 1 357 34 Val HB H 1.799 . 1 358 34 Val HG1 H 0.714 . 1 359 34 Val HG2 H 0.914 . 1 360 34 Val C C 175.796 . 1 361 34 Val CA C 63.644 . 1 362 34 Val CB C 31.891 . 1 363 34 Val CG1 C 21.249 . 1 364 34 Val CG2 C 22.395 . 1 365 34 Val N N 122.663 . 1 366 35 Asp H H 7.714 . 1 367 35 Asp HA H 4.705 . 1 368 35 Asp HB2 H 2.535 . 2 369 35 Asp HB3 H 2.194 . 2 370 35 Asp C C 176.718 . 1 371 35 Asp CA C 54.310 . 1 372 35 Asp CB C 46.385 . 1 373 35 Asp N N 125.352 . 1 374 36 Asp H H 9.090 . 1 375 36 Asp HA H 4.341 . 1 376 36 Asp HB2 H 2.686 . 2 377 36 Asp HB3 H 2.684 . 2 378 36 Asp C C 176.050 . 1 379 36 Asp CA C 57.092 . 1 380 36 Asp CB C 40.630 . 1 381 36 Asp N N 128.363 . 1 382 37 Ser H H 8.950 . 1 383 37 Ser HA H 4.370 . 1 384 37 Ser HB2 H 3.945 . 2 385 37 Ser HB3 H 4.008 . 2 386 37 Ser C C 174.959 . 1 387 37 Ser CA C 59.738 . 1 388 37 Ser CB C 63.838 . 1 389 37 Ser N N 114.863 . 1 390 38 Gln H H 7.631 . 1 391 38 Gln HA H 4.519 . 1 392 38 Gln HB2 H 2.012 . 2 393 38 Gln HB3 H 1.311 . 2 394 38 Gln HG2 H 2.390 . 2 395 38 Gln HG3 H 2.398 . 2 396 38 Gln HE21 H 7.284 . 1 397 38 Gln HE22 H 8.204 . 1 398 38 Gln CA C 53.582 . 1 399 38 Gln CB C 26.372 . 1 400 38 Gln CG C 35.863 . 1 401 38 Gln N N 121.850 . 1 402 38 Gln NE2 N 112.222 . 1 403 39 Pro HA H 4.310 . 1 404 39 Pro HB2 H 2.474 . 2 405 39 Pro HB3 H 1.134 . 2 406 39 Pro HG2 H 2.051 . 2 407 39 Pro HG3 H 1.956 . 2 408 39 Pro HD2 H 3.895 . 2 409 39 Pro HD3 H 2.667 . 2 410 39 Pro C C 177.152 . 1 411 39 Pro CA C 62.492 . 1 412 39 Pro CB C 32.913 . 1 413 39 Pro CG C 27.862 . 1 414 39 Pro CD C 50.001 . 1 415 40 Ala H H 8.729 . 1 416 40 Ala HA H 3.972 . 1 417 40 Ala HB H 1.426 . 1 418 40 Ala C C 179.843 . 1 419 40 Ala CA C 56.013 . 1 420 40 Ala CB C 17.680 . 1 421 40 Ala N N 127.083 . 1 422 41 Phe H H 8.059 . 1 423 41 Phe HA H 4.129 . 1 424 41 Phe HB2 H 2.491 . 2 425 41 Phe HB3 H 2.847 . 2 426 41 Phe HD1 H 7.092 . 2 4261 41 Phe HD2 H 7.092 . 2 4262 41 Phe HE1 H 6.749 . 2 4263 41 Phe HE2 H 6.749 . 2 4626 41 Phe HZ H 7.108 . 1 427 41 Phe C C 175.662 . 1 428 41 Phe CA C 59.819 . 1 429 41 Phe CB C 36.834 . 1 430 41 Phe CD1 C 132.191 . 2 4301 41 Phe CD2 C 132.191 . 2 4302 41 Phe CE1 C 128.727 . 2 4303 41 Phe CE2 C 128.727 . 2 4304 41 Phe CZ C 131.398 . 1 431 41 Phe N N 112.471 . 1 432 42 Ile H H 5.614 . 1 433 42 Ile HA H 3.098 . 1 434 42 Ile HB H 1.563 . 1 435 42 Ile HG12 H 0.310 . 2 436 42 Ile HG13 H -0.078 . 2 437 42 Ile HG2 H -0.131 . 1 438 42 Ile HD1 H 0.166 . 1 439 42 Ile C C 177.110 . 1 440 42 Ile CA C 59.822 . 1 441 42 Ile CB C 34.539 . 1 442 42 Ile CG1 C 24.886 . 1 443 42 Ile CG2 C 16.343 . 1 444 42 Ile CD1 C 9.941 . 1 445 42 Ile N N 120.594 . 1 446 43 Asn H H 7.082 . 1 447 43 Asn HA H 4.223 . 1 448 43 Asn HB2 H 2.484 . 2 449 43 Asn HB3 H 2.761 . 2 450 43 Asn HD21 H 7.386 . 1 451 43 Asn HD22 H 6.898 . 1 452 43 Asn C C 176.972 . 1 453 43 Asn CA C 55.562 . 1 454 43 Asn CB C 37.808 . 1 455 43 Asn N N 117.481 . 1 456 43 Asn ND2 N 114.020 . 1 457 44 Asp H H 8.379 . 1 458 44 Asp HA H 4.247 . 1 459 44 Asp HB2 H 2.500 . 2 460 44 Asp HB3 H 2.567 . 2 461 44 Asp C C 179.368 . 1 462 44 Asp CA C 57.538 . 1 463 44 Asp CB C 40.670 . 1 464 44 Asp N N 117.588 . 1 465 45 Ile H H 7.604 . 1 466 45 Ile HA H 3.687 . 1 467 45 Ile HB H 1.872 . 1 468 45 Ile HG12 H 2.358 . 2 469 45 Ile HG13 H 0.845 . 2 470 45 Ile HG2 H 0.974 . 1 471 45 Ile HD1 H 0.941 . 1 472 45 Ile C C 177.480 . 1 473 45 Ile CA C 65.907 . 1 474 45 Ile CB C 37.886 . 1 475 45 Ile CG1 C 30.284 . 1 476 45 Ile CG2 C 19.491 . 1 477 45 Ile CD1 C 14.733 . 1 478 45 Ile N N 121.473 . 1 479 46 Leu H H 7.863 . 1 480 46 Leu HA H 3.833 . 1 481 46 Leu HB2 H 1.838 . 2 482 46 Leu HB3 H 1.215 . 2 483 46 Leu HG H 1.632 . 1 484 46 Leu HD1 H 0.454 . 1 485 46 Leu HD2 H 0.550 . 1 486 46 Leu C C 178.165 . 1 487 46 Leu CA C 57.080 . 1 488 46 Leu CB C 41.967 . 1 489 46 Leu CG C 26.699 . 1 490 46 Leu CD1 C 27.035 . 1 491 46 Leu CD2 C 22.131 . 1 492 46 Leu N N 118.055 . 1 493 47 Lys H H 7.161 . 1 494 47 Lys HA H 4.044 . 1 495 47 Lys HB2 H 1.987 . 2 496 47 Lys HB3 H 1.732 . 2 497 47 Lys HG2 H 1.725 . 2 498 47 Lys HG3 H 1.357 . 2 499 47 Lys HD2 H 1.581 . 2 500 47 Lys HD3 H 1.709 . 2 501 47 Lys HE2 H 2.803 . 2 502 47 Lys HE3 H 2.792 . 2 503 47 Lys C C 177.017 . 1 504 47 Lys CA C 57.174 . 1 505 47 Lys CB C 33.031 . 1 506 47 Lys CG C 25.683 . 1 507 47 Lys CD C 29.714 . 1 508 47 Lys CE C 42.290 . 1 509 47 Lys N N 116.384 . 1 510 48 Val H H 7.791 . 1 511 48 Val HA H 3.626 . 1 512 48 Val HB H 2.524 . 1 513 48 Val HG1 H 1.011 . 1 514 48 Val HG2 H 0.994 . 1 515 48 Val C C 176.014 . 1 516 48 Val CA C 63.747 . 1 517 48 Val CB C 30.987 . 1 518 48 Val CG1 C 22.915 . 1 519 48 Val CG2 C 22.383 . 1 520 48 Val N N 124.655 . 1 521 49 Glu H H 8.569 . 1 522 49 Glu HA H 3.941 . 1 523 49 Glu HB2 H 1.996 . 2 524 49 Glu HB3 H 1.911 . 2 525 49 Glu HG2 H 2.253 . 2 526 49 Glu HG3 H 2.253 . 2 527 49 Glu C C 176.461 . 1 528 49 Glu CA C 58.393 . 1 529 49 Glu CB C 29.169 . 1 530 49 Glu CG C 36.101 . 1 531 49 Glu N N 130.358 . 1 532 50 Gly H H 8.768 . 1 533 50 Gly HA2 H 4.185 . 2 534 50 Gly HA3 H 3.384 . 2 535 50 Gly C C 173.991 . 1 536 50 Gly CA C 44.705 . 1 537 50 Gly N N 114.068 . 1 538 51 Val H H 7.751 . 1 539 51 Val HA H 3.768 . 1 540 51 Val HB H 2.306 . 1 541 51 Val HG1 H 0.806 . 1 542 51 Val HG2 H 0.754 . 1 543 51 Val C C 175.262 . 1 544 51 Val CA C 64.610 . 1 545 51 Val CB C 31.534 . 1 546 51 Val CG1 C 21.719 . 1 547 51 Val CG2 C 22.636 . 1 548 51 Val N N 120.498 . 1 549 52 Lys H H 9.379 . 1 550 52 Lys HA H 4.481 . 1 551 52 Lys HB2 H 1.512 . 2 552 52 Lys HB3 H 1.341 . 2 553 52 Lys HG2 H 1.434 . 2 554 52 Lys HG3 H 1.238 . 2 555 52 Lys HD2 H 1.666 . 2 556 52 Lys HE2 H 2.993 . 2 557 52 Lys C C 175.385 . 1 558 52 Lys CA C 57.163 . 1 559 52 Lys CB C 35.786 . 1 560 52 Lys CG C 24.515 . 1 561 52 Lys CD C 29.438 . 1 562 52 Lys CE C 41.825 . 1 563 52 Lys N N 129.475 . 1 564 53 Ser H H 7.655 . 1 565 53 Ser HA H 4.903 . 1 566 53 Ser HB2 H 3.881 . 2 567 53 Ser HB3 H 3.767 . 2 568 53 Ser C C 172.396 . 1 569 53 Ser CA C 57.730 . 1 570 53 Ser CB C 64.653 . 1 571 53 Ser N N 108.885 . 1 572 54 Ile H H 8.783 . 1 573 54 Ile HA H 5.054 . 1 574 54 Ile HB H 1.846 . 1 575 54 Ile HG12 H 1.660 . 2 576 54 Ile HG13 H 1.062 . 2 577 54 Ile HG2 H 1.021 . 1 578 54 Ile HD1 H 0.886 . 1 579 54 Ile C C 173.244 . 1 580 54 Ile CA C 60.602 . 1 581 54 Ile CB C 44.277 . 1 582 54 Ile CG1 C 27.818 . 1 583 54 Ile CG2 C 18.616 . 1 584 54 Ile CD1 C 18.297 . 1 585 54 Ile N N 119.458 . 1 586 55 Phe H H 9.142 . 1 587 55 Phe HA H 5.598 . 1 588 55 Phe HB2 H 3.256 . 2 589 55 Phe HB3 H 3.159 . 2 590 55 Phe HD1 H 7.333 . 2 5901 55 Phe HD2 H 7.333 . 2 5902 55 Phe HE1 H 7.264 . 2 5903 55 Phe HE2 H 7.264 . 2 5904 55 Phe HZ H 6.775 . 1 591 55 Phe C C 173.761 . 1 592 55 Phe CA C 55.938 . 1 593 55 Phe CB C 41.641 . 1 594 55 Phe CD1 C 131.916 . 2 5941 55 Phe CD2 C 131.916 . 2 5942 55 Phe CE1 C 131.172 . 2 5943 55 Phe CE2 C 131.172 . 2 5944 55 Phe CZ C 130.724 . 1 595 55 Phe N N 129.664 . 1 596 56 His H H 8.824 . 1 597 56 His HA H 5.531 . 1 598 56 His HB2 H 3.239 . 2 599 56 His HB3 H 2.670 . 2 600 56 His HD2 H 7.256 . 1 601 56 His C C 172.379 . 1 602 56 His CA C 52.836 . 1 603 56 His CB C 37.218 . 1 604 56 His CD2 C 118.543 . 1 605 56 His N N 129.160 . 1 606 57 Val H H 8.072 . 1 607 57 Val HA H 3.774 . 1 608 57 Val HB H 1.217 . 1 609 57 Val HG1 H 0.278 . 1 610 57 Val HG2 H 0.787 . 1 611 57 Val C C 169.848 . 1 612 57 Val CA C 60.176 . 1 613 57 Val CB C 34.140 . 1 614 57 Val CG1 C 21.368 . 1 615 57 Val CG2 C 22.132 . 1 616 57 Val N N 127.671 . 1 617 58 Met H H 9.140 . 1 618 58 Met HA H 3.804 . 1 619 58 Met HB2 H 2.136 . 2 620 58 Met HB3 H 2.212 . 2 621 58 Met HG2 H 2.666 . 2 622 58 Met HG3 H 2.668 . 2 623 58 Met C C 175.156 . 1 624 58 Met CA C 57.730 . 1 625 58 Met CB C 31.555 . 1 626 58 Met CG C 32.834 . 1 627 58 Met N N 119.988 . 1 628 59 Asp H H 8.751 . 1 629 59 Asp HA H 4.938 . 1 630 59 Asp HB2 H 2.431 . 2 631 59 Asp HB3 H 3.354 . 2 632 59 Asp C C 174.038 . 1 633 59 Asp CA C 52.397 . 1 634 59 Asp CB C 39.908 . 1 635 59 Asp N N 122.637 . 1 636 60 Phe H H 8.971 . 1 637 60 Phe HA H 5.885 . 1 638 60 Phe HB2 H 2.981 . 2 639 60 Phe HB3 H 2.938 . 2 640 60 Phe HD1 H 7.217 . 2 6401 60 Phe HD2 H 7.217 . 2 6402 60 Phe HE1 H 7.320 . 2 6403 60 Phe HE2 H 7.320 . 2 6404 60 Phe HZ H 7.181 . 2 641 60 Phe C C 173.686 . 1 642 60 Phe CA C 56.469 . 1 643 60 Phe CB C 42.851 . 1 644 60 Phe CD1 C 133.198 . 2 6441 60 Phe CD2 C 133.198 . 2 6442 60 Phe CE1 C 130.678 . 2 6443 60 Phe CE2 C 130.678 . 2 6444 60 Phe CZ C 129.380 . 1 645 60 Phe N N 115.459 . 1 646 61 Ile H H 8.965 . 1 647 61 Ile HA H 5.780 . 1 648 61 Ile HB H 1.766 . 1 649 61 Ile HG12 H 2.033 . 2 650 61 Ile HG13 H 1.270 . 2 651 61 Ile HG2 H 0.792 . 1 652 61 Ile HD1 H 0.923 . 1 653 61 Ile C C 175.675 . 1 654 61 Ile CA C 58.280 . 1 655 61 Ile CB C 41.093 . 1 656 61 Ile CG1 C 25.725 . 1 657 61 Ile CG2 C 18.323 . 1 658 61 Ile CD1 C 14.183 . 1 659 61 Ile N N 109.286 . 1 660 62 Ser H H 9.952 . 1 661 62 Ser HA H 5.645 . 1 662 62 Ser HB2 H 4.036 . 2 663 62 Ser HB3 H 4.036 . 2 664 62 Ser C C 175.117 . 1 665 62 Ser CA C 56.894 . 1 666 62 Ser CB C 64.262 . 1 667 62 Ser N N 121.046 . 1 668 63 Val H H 9.529 . 1 669 63 Val HA H 4.699 . 1 670 63 Val HB H 2.243 . 1 671 63 Val HG1 H 1.170 . 1 672 63 Val HG2 H 1.139 . 1 673 63 Val C C 173.893 . 1 674 63 Val CA C 61.707 . 1 675 63 Val CB C 34.447 . 1 676 63 Val CG1 C 22.012 . 1 677 63 Val CG2 C 22.190 . 1 678 63 Val N N 129.348 . 1 679 64 Asp H H 9.093 . 1 680 64 Asp HA H 6.215 . 1 681 64 Asp HB2 H 2.429 . 2 682 64 Asp HB3 H 2.828 . 2 683 64 Asp C C 176.649 . 1 684 64 Asp CA C 52.125 . 1 685 64 Asp CB C 41.773 . 1 686 64 Asp N N 127.869 . 1 687 65 Lys H H 9.071 . 1 688 65 Lys HA H 5.210 . 1 689 65 Lys HB2 H 1.118 . 2 690 65 Lys HB3 H 0.449 . 2 691 65 Lys HG2 H 0.968 . 2 692 65 Lys HG3 H 0.746 . 2 693 65 Lys HD2 H 0.173 . 2 694 65 Lys HD3 H -1.016 . 2 695 65 Lys HE2 H 2.639 . 2 696 65 Lys HE3 H 2.643 . 2 697 65 Lys C C 175.936 . 1 698 65 Lys CA C 52.981 . 1 699 65 Lys CB C 34.777 . 1 700 65 Lys CG C 22.321 . 1 701 65 Lys CD C 28.363 . 1 702 65 Lys CE C 42.792 . 1 703 65 Lys N N 120.964 . 1 704 66 Glu H H 8.282 . 1 705 66 Glu HA H 4.143 . 1 706 66 Glu HB2 H 2.186 . 2 707 66 Glu HB3 H 1.609 . 2 708 66 Glu HG2 H 2.300 . 2 709 66 Glu HG3 H 2.051 . 2 710 66 Glu C C 178.756 . 1 711 66 Glu CA C 55.751 . 1 712 66 Glu CB C 30.121 . 1 713 66 Glu CG C 35.198 . 1 714 66 Glu N N 118.741 . 1 715 67 Asn H H 9.071 . 1 716 67 Asn HA H 4.385 . 1 717 67 Asn HB2 H 2.780 . 2 718 67 Asn HB3 H 2.778 . 2 719 67 Asn HD21 H 7.719 . 1 720 67 Asn HD22 H 6.991 . 1 721 67 Asn C C 176.421 . 1 722 67 Asn CA C 56.903 . 1 723 67 Asn CB C 39.018 . 1 724 67 Asn N N 122.060 . 1 725 67 Asn ND2 N 114.356 . 1 726 68 Asp H H 8.322 . 1 727 68 Asp HA H 4.527 . 1 728 68 Asp HB2 H 2.660 . 2 729 68 Asp HB3 H 2.672 . 2 730 68 Asp C C 176.143 . 1 731 68 Asp CA C 53.915 . 1 732 68 Asp CB C 40.124 . 1 733 68 Asp N N 112.268 . 1 734 69 Ala H H 7.131 . 1 735 69 Ala HA H 4.433 . 1 736 69 Ala HB H 1.282 . 1 737 69 Ala C C 175.954 . 1 738 69 Ala CA C 51.014 . 1 739 69 Ala CB C 20.183 . 1 740 69 Ala N N 122.269 . 1 741 70 Asn H H 9.052 . 1 742 70 Asn HA H 5.067 . 1 743 70 Asn HB2 H 2.861 . 2 744 70 Asn HB3 H 2.952 . 2 745 70 Asn HD21 H 7.759 . 1 746 70 Asn HD22 H 7.019 . 1 747 70 Asn C C 176.728 . 1 748 70 Asn CA C 51.256 . 1 749 70 Asn CB C 41.143 . 1 750 70 Asn N N 118.796 . 1 751 70 Asn ND2 N 114.632 . 1 752 71 Trp H H 9.490 . 1 753 71 Trp HA H 4.647 . 1 754 71 Trp HB2 H 3.356 . 2 755 71 Trp HB3 H 3.273 . 2 756 71 Trp HD1 H 7.431 . 1 757 71 Trp HE1 H 9.956 . 1 7571 71 Trp HZ2 H 7.494 . 1 7572 71 Trp HH2 H 7.224 . 1 7573 71 Trp HZ3 H 6.690 . 1 7574 71 Trp HE3 H 7.477 . 1 7575 71 Trp CZ2 C 115.95 . 1 7576 71 Trp CH2 C 125.27 . 1 7577 71 Trp CZ3 C 120.358 . 1 7578 71 Trp CE3 C 120.27 . 1 758 71 Trp C C 177.891 . 1 759 71 Trp CA C 60.624 . 1 760 71 Trp CB C 30.141 . 1 761 71 Trp CD1 C 128.442 . 1 762 71 Trp N N 125.989 . 1 763 71 Trp NE1 N 127.607 . 1 764 72 Glu H H 9.323 . 1 765 72 Glu HA H 4.171 . 1 766 72 Glu HB2 H 2.135 . 2 767 72 Glu HB3 H 2.058 . 2 768 72 Glu HG2 H 2.416 . 2 769 72 Glu HG3 H 2.416 . 2 770 72 Glu C C 177.775 . 1 771 72 Glu CA C 59.758 . 1 772 72 Glu CB C 29.002 . 1 773 72 Glu CG C 36.943 . 1 774 72 Glu N N 117.581 . 1 775 73 Thr H H 7.481 . 1 776 73 Thr HA H 4.344 . 1 777 73 Thr HB H 4.352 . 1 778 73 Thr HG2 H 1.274 . 1 779 73 Thr C C 176.175 . 1 780 73 Thr CA C 63.769 . 1 781 73 Thr CB C 69.156 . 1 782 73 Thr CG2 C 22.043 . 1 783 73 Thr N N 111.273 . 1 784 74 Val H H 8.012 . 1 785 74 Val HA H 3.707 . 1 786 74 Val HB H 1.887 . 1 787 74 Val HG1 H 0.862 . 1 788 74 Val HG2 H 0.970 . 1 789 74 Val C C 177.933 . 1 790 74 Val CA C 66.293 . 1 791 74 Val CB C 34.587 . 1 792 74 Val CG1 C 22.438 . 1 793 74 Val CG2 C 22.447 . 1 794 74 Val N N 121.666 . 1 795 75 Leu H H 9.422 . 1 796 75 Leu HA H 4.364 . 1 797 75 Leu HB2 H 2.040 . 2 798 75 Leu HB3 H 2.040 . 2 799 75 Leu HG H 2.041 . 1 800 75 Leu HD1 H 0.868 . 1 801 75 Leu HD2 H 0.845 . 1 802 75 Leu CA C 60.234 . 1 803 75 Leu CB C 39.556 . 1 804 75 Leu CG C 27.248 . 1 805 75 Leu CD1 C 23.644 . 1 806 75 Leu CD2 C 24.254 . 1 807 75 Leu N N 118.983 . 1 808 76 Pro HA H 4.518 . 1 809 76 Pro HB2 H 2.434 . 2 810 76 Pro HB3 H 1.823 . 2 811 76 Pro HG2 H 2.235 . 2 812 76 Pro HG3 H 2.067 . 2 813 76 Pro HD2 H 3.771 . 2 814 76 Pro HD3 H 3.487 . 2 815 76 Pro C C 180.268 . 1 816 76 Pro CA C 66.204 . 1 817 76 Pro CB C 31.224 . 1 818 76 Pro CG C 28.727 . 1 819 76 Pro CD C 50.483 . 1 820 77 Lys H H 6.904 . 1 821 77 Lys HA H 4.158 . 1 822 77 Lys HB2 H 2.237 . 2 823 77 Lys HB3 H 1.970 . 2 824 77 Lys HG2 H 1.756 . 2 825 77 Lys HG3 H 1.512 . 2 826 77 Lys HD2 H 1.824 . 2 827 77 Lys HD3 H 1.835 . 2 828 77 Lys HE2 H 3.062 . 2 829 77 Lys HE3 H 3.059 . 2 830 77 Lys C C 178.997 . 1 831 77 Lys CA C 58.950 . 1 832 77 Lys CB C 33.671 . 1 833 77 Lys CG C 25.967 . 1 834 77 Lys CD C 29.728 . 1 835 77 Lys CE C 42.395 . 1 836 77 Lys N N 115.740 . 1 837 78 Val H H 8.054 . 1 838 78 Val HA H 3.664 . 1 839 78 Val HB H 2.570 . 1 840 78 Val HG1 H 1.060 . 1 841 78 Val HG2 H 1.174 . 1 842 78 Val C C 177.851 . 1 843 78 Val CA C 66.980 . 1 844 78 Val CB C 31.618 . 1 845 78 Val CG1 C 21.172 . 1 846 78 Val CG2 C 23.651 . 1 847 78 Val N N 121.351 . 1 848 79 Glu H H 8.853 . 1 849 79 Glu HA H 3.968 . 1 850 79 Glu HB2 H 2.095 . 2 851 79 Glu HB3 H 2.126 . 2 852 79 Glu HG2 H 2.446 . 2 853 79 Glu HG3 H 2.040 . 2 854 79 Glu C C 179.769 . 1 855 79 Glu CA C 60.369 . 1 856 79 Glu CB C 29.786 . 1 857 79 Glu CG C 36.953 . 1 858 79 Glu N N 117.081 . 1 859 80 Ala H H 7.603 . 1 860 80 Ala HA H 4.192 . 1 861 80 Ala HB H 1.537 . 1 862 80 Ala C C 179.560 . 1 863 80 Ala CA C 54.425 . 1 864 80 Ala CB C 18.257 . 1 865 80 Ala N N 119.149 . 1 866 81 Val H H 7.413 . 1 867 81 Val HA H 3.604 . 1 868 81 Val HB H 2.179 . 1 869 81 Val HG1 H 0.654 . 1 870 81 Val HG2 H 0.862 . 1 871 81 Val C C 177.465 . 1 872 81 Val CA C 65.286 . 1 873 81 Val CB C 31.278 . 1 874 81 Val CG1 C 21.069 . 1 875 81 Val CG2 C 21.805 . 1 876 81 Val N N 117.374 . 1 877 82 Phe H H 7.266 . 1 878 82 Phe HA H 4.310 . 1 879 82 Phe HB2 H 3.450 . 2 880 82 Phe HB3 H 2.908 . 2 881 82 Phe HD1 H 7.214 . 2 8811 82 Phe HD2 H 7.214 . 2 8812 82 Phe HE1 H 6.767 . 2 8813 82 Phe HE2 H 6.767 . 2 8814 82 Phe HZ H 6.915 . 1 882 82 Phe C C 176.057 . 1 883 82 Phe CA C 59.395 . 1 884 82 Phe CB C 39.404 . 1 885 82 Phe CD1 C 131.909 . 2 8851 82 Phe CD2 C 131.909 . 2 8852 82 Phe CE1 C 130.240 . 2 8853 82 Phe CE2 C 130.240 . 2 8854 82 Phe CZ C 128.924 . 1 886 82 Phe N N 115.771 . 1 887 83 Glu H H 7.681 . 1 888 83 Glu HA H 4.321 . 1 889 83 Glu HB2 H 2.187 . 2 890 83 Glu HB3 H 2.050 . 2 891 83 Glu HG2 H 2.350 . 2 892 83 Glu HG3 H 2.350 . 2 893 83 Glu C C 176.796 . 1 894 83 Glu CA C 56.783 . 1 895 83 Glu CB C 30.241 . 1 896 83 Glu CG C 36.147 . 1 897 83 Glu N N 119.191 . 1 898 84 Leu H H 7.903 . 1 899 84 Leu HA H 4.237 . 1 900 84 Leu HB2 H 1.657 . 2 901 84 Leu HB3 H 1.450 . 2 902 84 Leu HG H 1.680 . 1 903 84 Leu HD1 H 0.904 . 1 904 84 Leu HD2 H 0.861 . 1 905 84 Leu C C 177.692 . 1 906 84 Leu CA C 55.723 . 1 907 84 Leu CB C 42.338 . 1 908 84 Leu CG C 26.948 . 1 909 84 Leu CD1 C 24.950 . 1 910 84 Leu CD2 C 23.501 . 1 911 84 Leu N N 121.583 . 1 912 85 Glu H H 8.252 . 1 913 85 Glu HA H 4.123 . 1 914 85 Glu HB2 H 1.934 . 2 915 85 Glu HB3 H 1.934 . 2 916 85 Glu HG2 H 2.175 . 2 917 85 Glu HG3 H 2.175 . 2 918 85 Glu C C 176.561 . 1 919 85 Glu CA C 56.980 . 1 920 85 Glu CB C 30.050 . 1 921 85 Glu CG C 36.093 . 1 922 85 Glu N N 120.473 . 1 923 86 His H H 8.230 . 1 924 86 His HA H 4.587 . 1 925 86 His HB2 H 3.122 . 2 926 86 His HB3 H 3.127 . 2 927 86 His C C 173.902 . 1 928 86 His CA C 56.036 . 1 929 86 His CB C 29.924 . 1 930 86 His N N 118.888 . 1 931 87 His H H 8.163 . 1 932 87 His HA H 4.412 . 1 933 87 His CA C 57.230 . 1 934 87 His CB C 27.970 . 1 935 87 His N N 125.354 . 1