save_monomeric_polymer _Saveframe_category monomeric_polymer _Mol_type . _Mol_polymer_class . _Name_common . _Residue_count 175 _Mol_residue_sequence ; MADEATRRVV SEIPVLKTNA GPRDRELWVQ RLKEEYQSLI RYVENNKNAD NDWFRLESNK EGTRWFGKCW YIHDLLKYEF DIEFDIPITY PTTAPEIAVP ELDGKTAKMY RGGKICLTDH FKPLWARNVP KFGLAHLMAL GLGPWLAVEI PDLIQKGVIQ HKEKCNQLEH HHHHH ; loop_ _Residue_seq_code _Residue_label 1 Met 2 Ala 3 Asp 4 Glu 5 Ala 6 Thr 7 Arg 8 Arg 9 Val 10 Val 11 Ser 12 Glu 13 Ile 14 Pro 15 Val 16 Leu 17 Lys 18 Thr 19 Asn 20 Ala 21 Gly 22 Pro 23 Arg 24 Asp 25 Arg 26 Glu 27 Leu 28 Trp 29 Val 30 Gln 31 Arg 32 Leu 33 Lys 34 Glu 35 Glu 36 Tyr 37 Gln 38 Ser 39 Leu 40 Ile 41 Arg 42 Tyr 43 Val 44 Glu 45 Asn 46 Asn 47 Lys 48 Asn 49 Ala 50 Asp 51 Asn 52 Asp 53 Trp 54 Phe 55 Arg 56 Leu 57 Glu 58 Ser 59 Asn 60 Lys 61 Glu 62 Gly 63 Thr 64 Arg 65 Trp 66 Phe 67 Gly 68 Lys 69 Cys 70 Trp 71 Tyr 72 Ile 73 His 74 Asp 75 Leu 76 Leu 77 Lys 78 Tyr 79 Glu 80 Phe 81 Asp 82 Ile 83 Glu 84 Phe 85 Asp 86 Ile 87 Pro 88 Ile 89 Thr 90 Tyr 91 Pro 92 Thr 93 Thr 94 Ala 95 Pro 96 Glu 97 Ile 98 Ala 99 Val 100 Pro 101 Glu 102 Leu 103 Asp 104 Gly 105 Lys 106 Thr 107 Ala 108 Lys 109 Met 110 Tyr 111 Arg 112 Gly 113 Gly 114 Lys 115 Ile 116 Cys 117 Leu 118 Thr 119 Asp 120 His 121 Phe 122 Lys 123 Pro 124 Leu 125 Trp 126 Ala 127 Arg 128 Asn 129 Val 130 Pro 131 Lys 132 Phe 133 Gly 134 Leu 135 Ala 136 His 137 Leu 138 Met 139 Ala 140 Leu 141 Gly 142 Leu 143 Gly 144 Pro 145 Trp 146 Leu 147 Ala 148 Val 149 Glu 150 Ile 151 Pro 152 Asp 153 Leu 154 Ile 155 Gln 156 Lys 157 Gly 158 Val 159 Ile 160 Gln 161 His 162 Lys 163 Glu 164 Lys 165 Cys 166 Asn 167 Gln 168 Leu 169 Glu 170 His 171 His 172 His 173 His 174 His 175 His stop_ save_ save_assigned_chemical_shifts _Saveframe_category assigned_chemical_shifts loop_ _Atom_shift_assign_ID _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_code 1 3 Asp HA H 4.65 . 1 2 3 Asp HB2 H 2.76 . 1 3 3 Asp HB3 H 2.76 . 1 4 3 Asp CA C 54.1 . 1 5 3 Asp CB C 40.9 . 1 6 4 Glu H H 8.75 . 1 7 4 Glu HA H 4.11 . 1 8 4 Glu HB2 H 2.03 . 1 9 4 Glu HB3 H 2.03 . 1 10 4 Glu HG2 H 2.32 . 1 11 4 Glu HG3 H 2.32 . 1 12 4 Glu CA C 58.2 . 1 13 4 Glu CB C 29.4 . 1 14 4 Glu CG C 35.9 . 1 15 4 Glu N N 122.1 . 1 16 5 Ala H H 8.44 . 1 17 5 Ala HA H 4.21 . 1 18 5 Ala HB H 1.47 . 1 19 5 Ala CA C 54.2 . 1 20 5 Ala CB C 18.5 . 1 21 5 Ala N N 122.6 . 1 22 6 Thr H H 7.95 . 1 23 6 Thr HA H 4.07 . 1 24 6 Thr HB H 4.20 . 1 25 6 Thr HG2 H 1.24 . 1 26 6 Thr CA C 64.2 . 1 27 6 Thr CB C 68.6 . 1 28 6 Thr CG2 C 22.0 . 1 29 6 Thr N N 113.2 . 1 30 7 Arg H H 8.07 . 1 31 7 Arg HA H 4.10 . 1 32 7 Arg HB2 H 1.87 . 1 33 7 Arg HB3 H 1.87 . 1 34 7 Arg HG2 H 1.59 . 2 35 7 Arg HG3 H 1.72 . 2 36 7 Arg HD2 H 3.21 . 1 37 7 Arg HD3 H 3.21 . 1 38 7 Arg CA C 58.2 . 1 39 7 Arg CB C 30.1 . 1 40 7 Arg CG C 27.3 . 1 41 7 Arg CD C 43.1 . 1 42 7 Arg N N 121.6 . 1 43 8 Arg H H 8.18 . 1 44 8 Arg HA H 4.19 . 1 45 8 Arg HB2 H 1.90 . 1 46 8 Arg HB3 H 1.90 . 1 47 8 Arg HG2 H 1.60 . 1 48 8 Arg HG3 H 1.60 . 1 49 8 Arg HD2 H 3.21 . 1 50 8 Arg HD3 H 3.21 . 1 51 8 Arg CA C 57.8 . 1 52 8 Arg CB C 30.2 . 1 53 8 Arg CG C 27.3 . 1 54 8 Arg CD C 43.2 . 1 55 8 Arg N N 120.5 . 1 56 9 Val H H 7.90 . 1 57 9 Val HA H 3.95 . 1 58 9 Val HB H 2.21 . 1 59 9 Val HG1 H 1.01 . 2 60 9 Val HG2 H 1.10 . 2 61 9 Val CA C 64.5 . 1 62 9 Val CB C 32.2 . 1 63 9 Val CG1 C 21.1 . 1 64 9 Val CG2 C 21.8 . 1 65 9 Val N N 119.6 . 1 66 10 Val H H 8.12 . 1 67 10 Val HA H 3.81 . 1 68 10 Val HB H 2.19 . 1 69 10 Val HG1 H 0.94 . 2 70 10 Val HG2 H 1.01 . 2 71 10 Val CA C 64.2 . 1 72 10 Val CB C 31.9 . 1 73 10 Val CG1 C 21.7 . 1 74 10 Val CG2 C 22.0 . 1 75 10 Val N N 118.3 . 1 76 11 Ser H H 8.07 . 1 77 11 Ser HA H 4.33 . 1 78 11 Ser HB2 H 3.98 . 1 79 11 Ser HB3 H 3.98 . 1 80 11 Ser CA C 60.1 . 1 81 11 Ser CB C 63.2 . 1 82 11 Ser N N 116.9 . 1 83 12 Glu H H 7.79 . 1 84 12 Glu HA H 4.35 . 1 85 12 Glu HB2 H 1.96 . 1 86 12 Glu HB3 H 2.19 . 1 87 12 Glu HG2 H 2.21 . 2 88 12 Glu HG3 H 2.40 . 2 89 12 Glu CA C 56.0 . 1 90 12 Glu CB C 30.1 . 1 91 12 Glu CG C 36.3 . 1 92 12 Glu N N 119.8 . 1 93 13 Ile H H 7.66 . 1 94 13 Ile HA H 4.14 . 1 95 13 Ile HB H 1.29 . 1 96 13 Ile HG12 H 0.36 . 2 97 13 Ile HG13 H 1.61 . 2 98 13 Ile HG2 H 0.18 . 1 99 13 Ile HD1 H -0.19 . 1 100 13 Ile CA C 59.2 . 1 101 13 Ile CB C 39.1 . 1 102 13 Ile CG1 C 27.5 . 1 103 13 Ile CG2 C 17.2 . 1 104 13 Ile CD1 C 13.1 . 1 105 13 Ile N N 122.5 . 1 106 14 Pro HA H 4.51 . 1 107 14 Pro HB2 H 1.93 . 1 108 14 Pro HB3 H 2.46 . 1 109 14 Pro HG2 H 2.10 . 1 110 14 Pro HG3 H 2.10 . 1 111 14 Pro HD2 H 3.72 . 2 112 14 Pro HD3 H 4.08 . 2 113 14 Pro CA C 63.3 . 1 114 14 Pro CB C 31.8 . 1 115 14 Pro CG C 27.7 . 1 116 14 Pro CD C 50.7 . 1 117 15 Val H H 8.04 . 1 118 15 Val HA H 4.44 . 1 119 15 Val HB H 2.37 . 1 120 15 Val HG1 H 0.96 . 2 121 15 Val HG2 H 1.13 . 2 122 15 Val CA C 61.6 . 1 123 15 Val CB C 32.8 . 1 124 15 Val CG1 C 18.2 . 1 125 15 Val CG2 C 22.0 . 1 126 15 Val N N 116.5 . 1 127 16 Leu H H 9.12 . 1 128 16 Leu HA H 4.56 . 1 129 16 Leu HB2 H 1.51 . 1 130 16 Leu HB3 H 1.88 . 1 131 16 Leu HG H 1.70 . 1 132 16 Leu HD1 H 1.00 . 2 133 16 Leu HD2 H 1.18 . 2 134 16 Leu CA C 56.0 . 1 135 16 Leu CB C 41.3 . 1 136 16 Leu CG C 31.1 . 1 137 16 Leu CD1 C 27.0 . 1 138 16 Leu CD2 C 25.5 . 1 139 16 Leu N N 126.3 . 1 140 17 Lys H H 8.31 . 1 141 17 Lys HA H 4.41 . 1 142 17 Lys HB2 H 1.76 . 1 143 17 Lys HB3 H 1.76 . 1 144 17 Lys HG2 H 1.29 . 1 145 17 Lys HG3 H 1.29 . 1 146 17 Lys HD2 H 1.60 . 1 147 17 Lys HD3 H 1.60 . 1 148 17 Lys HE2 H 2.92 . 1 149 17 Lys HE3 H 2.92 . 1 150 17 Lys CA C 57.0 . 1 151 17 Lys CB C 35.9 . 1 152 17 Lys CG C 24.6 . 1 153 17 Lys CD C 29.2 . 1 154 17 Lys CE C 41.8 . 1 155 17 Lys N N 116.8 . 1 156 18 Thr H H 10.39 . 1 157 18 Thr HA H 3.89 . 1 158 18 Thr HB H 3.96 . 1 159 18 Thr HG2 H 1.25 . 1 160 18 Thr CA C 65.4 . 1 161 18 Thr CB C 68.1 . 1 162 18 Thr CG2 C 22.0 . 1 163 18 Thr N N 121.3 . 1 164 19 Asn H H 9.34 . 1 165 19 Asn HA H 4.60 . 1 166 19 Asn HB2 H 2.32 . 1 167 19 Asn HB3 H 3.25 . 1 168 19 Asn HD21 H 6.50 . 2 169 19 Asn HD22 H 7.45 . 2 170 19 Asn CA C 51.1 . 1 171 19 Asn CB C 36.8 . 1 172 19 Asn N N 128.7 . 1 173 19 Asn ND2 N 107.7 . 1 174 20 Ala H H 7.02 . 1 175 20 Ala HA H 4.74 . 1 176 20 Ala HB H 1.47 . 1 177 20 Ala CA C 51.9 . 1 178 20 Ala CB C 24.4 . 1 179 20 Ala N N 123.5 . 1 180 21 Gly H H 8.82 . 1 181 21 Gly HA2 H 3.95 . 2 182 21 Gly HA3 H 4.82 . 2 183 21 Gly CA C 44.9 . 1 184 21 Gly N N 107.0 . 1 185 22 Pro HA H 2.52 . 1 186 22 Pro HB2 H 1.05 . 1 187 22 Pro HB3 H 1.42 . 1 188 22 Pro HG2 H 1.05 . 2 189 22 Pro HG3 H 1.44 . 2 190 22 Pro HD2 H 2.45 . 2 191 22 Pro HD3 H 3.47 . 2 192 22 Pro CA C 63.2 . 1 193 22 Pro CB C 31.7 . 1 194 22 Pro CG C 27.2 . 1 195 22 Pro CD C 48.9 . 1 196 23 Arg H H 8.50 . 1 197 23 Arg HA H 4.34 . 1 198 23 Arg HB2 H 1.82 . 2 199 23 Arg HB3 H 2.02 . 2 200 23 Arg HG2 H 1.58 . 2 201 23 Arg HG3 H 1.65 . 2 202 23 Arg HD2 H 3.17 . 1 203 23 Arg HD3 H 3.17 . 1 204 23 Arg CA C 56.1 . 1 205 23 Arg CB C 29.5 . 1 206 23 Arg CG C 27.1 . 1 207 23 Arg CD C 43.1 . 1 208 23 Arg N N 116.8 . 1 209 24 Asp H H 8.17 . 1 210 24 Asp HA H 4.90 . 1 211 24 Asp HB2 H 3.17 . 2 212 24 Asp HB3 H 3.09 . 2 213 24 Asp CA C 55.0 . 1 214 24 Asp CB C 40.8 . 1 215 24 Asp N N 119.3 . 1 216 25 Arg H H 8.58 . 1 217 25 Arg HA H 3.99 . 1 218 25 Arg HB2 H 2.00 . 1 219 25 Arg HB3 H 2.12 . 1 220 25 Arg HG2 H 1.72 . 2 221 25 Arg HG3 H 1.85 . 2 222 25 Arg HD2 H 3.34 . 1 223 25 Arg HD3 H 3.34 . 1 224 25 Arg CA C 58.8 . 1 225 25 Arg CB C 28.7 . 1 226 25 Arg CG C 27.3 . 1 227 25 Arg CD C 43.1 . 1 228 25 Arg N N 121.0 . 1 229 26 Glu H H 9.25 . 1 230 26 Glu HA H 4.24 . 1 231 26 Glu HB2 H 2.16 . 1 232 26 Glu HB3 H 2.16 . 1 233 26 Glu HG2 H 2.42 . 1 234 26 Glu HG3 H 2.42 . 1 235 26 Glu CA C 59.6 . 1 236 26 Glu CB C 28.8 . 1 237 26 Glu CG C 36.3 . 1 238 26 Glu N N 121.5 . 1 239 27 Leu H H 8.01 . 1 240 27 Leu HA H 4.34 . 1 241 27 Leu HB2 H 1.46 . 1 242 27 Leu HB3 H 1.81 . 1 243 27 Leu HG H 1.77 . 1 244 27 Leu HD1 H 0.91 . 2 245 27 Leu HD2 H 1.01 . 2 246 27 Leu CA C 56.6 . 1 247 27 Leu CB C 42.7 . 1 248 27 Leu CG C 27.0 . 1 249 27 Leu CD1 C 22.8 . 1 250 27 Leu CD2 C 25.2 . 1 251 27 Leu N N 119.1 . 1 252 28 Trp H H 8.01 . 1 253 28 Trp HA H 4.72 . 1 254 28 Trp HB2 H 3.29 . 1 255 28 Trp HB3 H 3.79 . 1 256 28 Trp HD1 H 7.34 . 1 257 28 Trp HE1 H 9.86 . 1 258 28 Trp HE3 H 7.31 . 1 259 28 Trp HZ2 H 7.92 . 1 260 28 Trp HZ3 H 7.51 . 1 261 28 Trp HH2 H 7.05 . 1 262 28 Trp CA C 58.7 . 1 263 28 Trp CB C 29.5 . 1 264 28 Trp CD1 C 127.0 . 1 265 28 Trp CE3 C 122.1 . 1 266 28 Trp CZ2 C 114.2 . 1 267 28 Trp CZ3 C 120.3 . 1 268 28 Trp CH2 C 122.2 . 1 269 28 Trp N N 121.6 . 1 270 28 Trp NE1 N 125.7 . 1 271 29 Val H H 7.50 . 1 272 29 Val HA H 3.36 . 1 273 29 Val HB H 2.20 . 1 274 29 Val HG1 H 0.99 . 2 275 29 Val HG2 H 1.13 . 2 276 29 Val CA C 66.4 . 1 277 29 Val CB C 31.3 . 1 278 29 Val CG1 C 21.0 . 1 279 29 Val CG2 C 22.1 . 1 280 29 Val N N 116.1 . 1 281 30 Gln H H 7.16 . 1 282 30 Gln HA H 4.09 . 1 283 30 Gln HB2 H 2.23 . 1 284 30 Gln HB3 H 2.23 . 1 285 30 Gln HG2 H 2.45 . 1 286 30 Gln HG3 H 2.45 . 1 287 30 Gln HE21 H 6.95 . 2 288 30 Gln HE22 H 8.08 . 2 289 30 Gln CA C 58.3 . 1 290 30 Gln CB C 28.0 . 1 291 30 Gln CG C 33.3 . 1 292 30 Gln N N 118.6 . 1 293 30 Gln NE2 N 113.9 . 1 294 31 Arg H H 8.20 . 1 295 31 Arg HA H 4.12 . 1 296 31 Arg HB2 H 1.78 . 2 297 31 Arg HB3 H 2.31 . 2 298 31 Arg HG2 H 1.47 . 1 299 31 Arg HG3 H 1.47 . 1 300 31 Arg HD2 H 2.71 . 1 301 31 Arg HD3 H 2.71 . 1 302 31 Arg CA C 58.1 . 1 303 31 Arg CB C 29.8 . 1 304 31 Arg CG C 26.9 . 1 305 31 Arg N N 121.0 . 1 306 32 Leu H H 8.86 . 1 307 32 Leu HA H 3.56 . 1 308 32 Leu HB2 H 0.97 . 2 309 32 Leu HB3 H 1.42 . 2 310 32 Leu HG H 0.96 . 1 311 32 Leu HD1 H 0.84 . 2 312 32 Leu HD2 H 0.86 . 2 313 32 Leu CA C 57.5 . 1 314 32 Leu CB C 41.3 . 1 315 32 Leu CG C 26.0 . 1 316 32 Leu CD1 C 24.3 . 1 317 32 Leu CD2 C 24.3 . 1 318 32 Leu N N 120.3 . 1 319 33 Lys H H 7.57 . 1 320 33 Lys HA H 4.16 . 1 321 33 Lys HB2 H 2.06 . 1 322 33 Lys HB3 H 2.06 . 1 323 33 Lys HG2 H 1.45 . 2 324 33 Lys HG3 H 1.73 . 2 325 33 Lys HD2 H 1.74 . 1 326 33 Lys HD3 H 1.74 . 1 327 33 Lys HE2 H 2.96 . 1 328 33 Lys HE3 H 2.96 . 1 329 33 Lys CA C 60.1 . 1 330 33 Lys CB C 32.0 . 1 331 33 Lys CG C 25.0 . 1 332 33 Lys CD C 29.5 . 1 333 33 Lys CE C 42.2 . 1 334 33 Lys N N 118.4 . 1 335 34 Glu H H 7.68 . 1 336 34 Glu HA H 4.12 . 1 337 34 Glu HB2 H 2.27 . 1 338 34 Glu HB3 H 2.71 . 1 339 34 Glu HG2 H 2.40 . 2 340 34 Glu HG3 H 2.69 . 2 341 34 Glu CA C 59.1 . 1 342 34 Glu CB C 29.2 . 1 343 34 Glu CG C 35.5 . 1 344 34 Glu N N 119.4 . 1 345 35 Glu H H 8.98 . 1 346 35 Glu HA H 4.33 . 1 347 35 Glu HB2 H 2.22 . 1 348 35 Glu HB3 H 2.34 . 1 349 35 Glu HG2 H 2.14 . 2 350 35 Glu HG3 H 2.75 . 2 351 35 Glu CA C 58.5 . 1 352 35 Glu CB C 28.4 . 1 353 35 Glu CG C 34.7 . 1 354 35 Glu N N 120.6 . 1 355 36 Tyr H H 8.83 . 1 356 36 Tyr HA H 4.50 . 1 357 36 Tyr HB2 H 3.17 . 1 358 36 Tyr HB3 H 3.25 . 1 359 36 Tyr HD1 H 7.33 . 1 360 36 Tyr HD2 H 7.33 . 1 361 36 Tyr HE1 H 6.81 . 1 362 36 Tyr HE2 H 6.81 . 1 363 36 Tyr CA C 62.3 . 1 364 36 Tyr CB C 37.9 . 1 365 36 Tyr CD1 C 131.7 . 1 366 36 Tyr CD2 C 131.7 . 1 367 36 Tyr CE1 C 117.8 . 1 368 36 Tyr CE2 C 117.8 . 1 369 36 Tyr N N 118.4 . 1 370 37 Gln H H 8.21 . 1 371 37 Gln HA H 4.15 . 1 372 37 Gln HB2 H 2.23 . 2 373 37 Gln HB3 H 2.34 . 2 374 37 Gln HG2 H 2.54 . 2 375 37 Gln HG3 H 2.64 . 2 376 37 Gln HE21 H 7.61 . 2 377 37 Gln HE22 H 6.94 . 2 378 37 Gln CA C 59.3 . 1 379 37 Gln CB C 28.3 . 1 380 37 Gln CG C 34.2 . 1 381 37 Gln N N 117.4 . 1 382 37 Gln NE2 N 111.4 . 1 383 38 Ser H H 8.30 . 1 384 38 Ser HA H 4.12 . 1 385 38 Ser HB2 H 3.98 . 1 386 38 Ser HB3 H 3.98 . 1 387 38 Ser HG H 5.22 . 1 388 38 Ser CA C 62.8 . 1 389 38 Ser CB C 62.7 . 1 390 38 Ser N N 114.9 . 1 391 39 Leu H H 8.42 . 1 392 39 Leu HA H 4.23 . 1 393 39 Leu HB2 H 1.79 . 1 394 39 Leu HB3 H 2.21 . 1 395 39 Leu HG H 1.91 . 1 396 39 Leu HD1 H 0.93 . 1 397 39 Leu HD2 H 0.98 . 1 398 39 Leu CA C 58.8 . 1 399 39 Leu CB C 42.7 . 1 400 39 Leu CG C 27.4 . 1 401 39 Leu CD1 C 25.4 . 1 402 39 Leu CD2 C 23.9 . 1 403 39 Leu N N 120.8 . 1 404 40 Ile H H 8.86 . 1 405 40 Ile HA H 3.79 . 1 406 40 Ile HB H 1.98 . 1 407 40 Ile HG12 H 1.26 . 2 408 40 Ile HG13 H 1.86 . 2 409 40 Ile HG2 H 0.97 . 1 410 40 Ile HD1 H 0.92 . 1 411 40 Ile CA C 65.0 . 1 412 40 Ile CB C 37.8 . 1 413 40 Ile CG1 C 29.8 . 1 414 40 Ile CG2 C 17.0 . 1 415 40 Ile CD1 C 13.2 . 1 416 40 Ile N N 118.5 . 1 417 41 Arg H H 7.64 . 1 418 41 Arg HA H 4.23 . 1 419 41 Arg HB2 H 1.95 . 2 420 41 Arg HB3 H 2.07 . 2 421 41 Arg HG2 H 1.74 . 2 422 41 Arg HG3 H 1.93 . 2 423 41 Arg HD2 H 3.37 . 2 424 41 Arg HD3 H 3.42 . 2 425 41 Arg CA C 57.4 . 1 426 41 Arg CB C 29.4 . 1 427 41 Arg CG C 26.1 . 1 428 41 Arg CD C 42.2 . 1 429 41 Arg N N 119.0 . 1 430 42 Tyr H H 8.25 . 1 431 42 Tyr HA H 4.78 . 1 432 42 Tyr HB2 H 3.32 . 1 433 42 Tyr HB3 H 3.32 . 1 434 42 Tyr HD1 H 7.26 . 1 435 42 Tyr HD2 H 7.26 . 1 436 42 Tyr HE1 H 6.97 . 1 437 42 Tyr HE2 H 6.97 . 1 438 42 Tyr CA C 58.8 . 1 439 42 Tyr CB C 38.5 . 1 440 42 Tyr CD1 C 131.7 . 1 441 42 Tyr CD2 C 131.7 . 1 442 42 Tyr CE1 C 118.8 . 1 443 42 Tyr CE2 C 118.8 . 1 444 42 Tyr N N 119.9 . 1 445 43 Val H H 8.77 . 1 446 43 Val HA H 3.25 . 1 447 43 Val HB H 2.10 . 1 448 43 Val HG1 H 0.78 . 2 449 43 Val HG2 H 0.80 . 2 450 43 Val CA C 67.2 . 1 451 43 Val CB C 31.5 . 1 452 43 Val CG1 C 23.6 . 1 453 43 Val CG2 C 21.0 . 1 454 43 Val N N 118.9 . 1 455 44 Glu H H 8.37 . 1 456 44 Glu HA H 3.88 . 1 457 44 Glu HB2 H 2.10 . 2 458 44 Glu HB3 H 2.21 . 2 459 44 Glu HG2 H 2.31 . 2 460 44 Glu HG3 H 2.42 . 2 461 44 Glu CA C 59.7 . 1 462 44 Glu CB C 29.2 . 1 463 44 Glu CG C 36.4 . 1 464 44 Glu N N 119.7 . 1 465 45 Asn H H 8.47 . 1 466 45 Asn HA H 4.48 . 1 467 45 Asn HB2 H 3.00 . 2 468 45 Asn HB3 H 3.26 . 2 469 45 Asn HD21 H 7.98 . 2 470 45 Asn HD22 H 6.74 . 2 471 45 Asn CA C 55.6 . 1 472 45 Asn CB C 37.4 . 1 473 45 Asn N N 119.5 . 1 474 45 Asn ND2 N 110.8 . 1 475 46 Asn H H 8.75 . 1 476 46 Asn HA H 4.38 . 1 477 46 Asn HB2 H 3.06 . 1 478 46 Asn HB3 H 3.06 . 1 479 46 Asn HD21 H 4.55 . 2 480 46 Asn HD22 H 7.24 . 2 481 46 Asn CA C 55.3 . 1 482 46 Asn CB C 36.9 . 1 483 46 Asn N N 122.2 . 1 484 46 Asn ND2 N 104.6 . 1 485 47 Lys H H 8.89 . 1 486 47 Lys HA H 3.93 . 1 487 47 Lys HB2 H 1.91 . 1 488 47 Lys HB3 H 1.91 . 1 489 47 Lys HG2 H 1.31 . 2 490 47 Lys HG3 H 1.59 . 2 491 47 Lys HD2 H 1.60 . 1 492 47 Lys HD3 H 1.60 . 1 493 47 Lys HE2 H 2.84 . 1 494 47 Lys HE3 H 2.84 . 1 495 47 Lys CA C 60.5 . 1 496 47 Lys CB C 32.2 . 1 497 47 Lys CG C 25.6 . 1 498 47 Lys CD C 29.7 . 1 499 47 Lys CE C 41.8 . 1 500 47 Lys N N 122.1 . 1 501 48 Asn H H 8.20 . 1 502 48 Asn HA H 4.54 . 1 503 48 Asn HB2 H 2.93 . 1 504 48 Asn HB3 H 2.93 . 1 505 48 Asn HD21 H 7.04 . 2 506 48 Asn HD22 H 7.75 . 2 507 48 Asn CA C 55.3 . 1 508 48 Asn CB C 38.1 . 1 509 48 Asn N N 118.9 . 1 510 48 Asn ND2 N 112.3 . 1 511 49 Ala H H 7.52 . 1 512 49 Ala HA H 4.51 . 1 513 49 Ala HB H 1.50 . 1 514 49 Ala CA C 51.2 . 1 515 49 Ala CB C 19.0 . 1 516 49 Ala N N 121.1 . 1 517 50 Asp H H 7.96 . 1 518 50 Asp HA H 4.38 . 1 519 50 Asp HB2 H 2.55 . 1 520 50 Asp HB3 H 3.11 . 1 521 50 Asp CA C 55.3 . 1 522 50 Asp CB C 39.1 . 1 523 50 Asp N N 116.9 . 1 524 51 Asn H H 8.55 . 1 525 51 Asn HA H 5.05 . 1 526 51 Asn HB2 H 2.37 . 2 527 51 Asn HB3 H 2.76 . 2 528 51 Asn HD21 H 6.69 . 2 529 51 Asn HD22 H 7.70 . 2 530 51 Asn CA C 51.8 . 1 531 51 Asn CB C 39.9 . 1 532 51 Asn N N 116.4 . 1 533 51 Asn ND2 N 110.7 . 1 534 52 Asp H H 8.49 . 1 535 52 Asp HA H 4.40 . 1 536 52 Asp HB2 H 2.19 . 1 537 52 Asp HB3 H 2.96 . 1 538 52 Asp CA C 54.1 . 1 539 52 Asp CB C 40.5 . 1 540 52 Asp N N 120.0 . 1 541 53 Trp H H 7.49 . 1 542 53 Trp HA H 4.27 . 1 543 53 Trp HB2 H 2.65 . 1 544 53 Trp HB3 H 4.08 . 1 545 53 Trp HD1 H 7.87 . 1 546 53 Trp HE1 H 9.85 . 1 547 53 Trp HE3 H 7.90 . 1 548 53 Trp HZ2 H 7.45 . 1 549 53 Trp HZ3 H 6.87 . 1 550 53 Trp HH2 H 7.04 . 1 551 53 Trp CA C 56.9 . 1 552 53 Trp CB C 29.6 . 1 553 53 Trp CD1 C 128.3 . 1 554 53 Trp CE3 C 122.4 . 1 555 53 Trp CZ2 C 113.7 . 1 556 53 Trp CZ3 C 120.2 . 1 557 53 Trp CH2 C 123.3 . 1 558 53 Trp N N 121.9 . 1 559 53 Trp NE1 N 127.8 . 1 560 54 Phe H H 6.81 . 1 561 54 Phe HA H 4.91 . 1 562 54 Phe HB2 H 2.10 . 2 563 54 Phe HB3 H 2.50 . 2 564 54 Phe HD1 H 5.47 . 1 565 54 Phe HD2 H 5.47 . 1 566 54 Phe HE1 H 5.55 . 1 567 54 Phe HE2 H 5.55 . 1 568 54 Phe HZ H 5.65 . 1 569 54 Phe CA C 57.0 . 1 570 54 Phe CB C 40.9 . 1 571 54 Phe CD1 C 132.0 . 1 572 54 Phe CD2 C 132.0 . 1 573 54 Phe CE1 C 133.7 . 1 574 54 Phe CE2 C 133.7 . 1 575 54 Phe CZ C 131.9 . 1 576 54 Phe N N 115.3 . 1 577 55 Arg H H 8.75 . 1 578 55 Arg HA H 4.37 . 1 579 55 Arg HB2 H 1.82 . 1 580 55 Arg HB3 H 1.82 . 1 581 55 Arg HG2 H 1.60 . 2 582 55 Arg HG3 H 1.74 . 2 583 55 Arg HD2 H 3.25 . 1 584 55 Arg HD3 H 3.25 . 1 585 55 Arg HE H 7.37 . 1 586 55 Arg CA C 54.8 . 1 587 55 Arg CB C 33.8 . 1 588 55 Arg CG C 26.9 . 1 589 55 Arg CD C 42.6 . 1 590 55 Arg N N 118.8 . 1 591 56 Leu H H 8.70 . 1 592 56 Leu HA H 5.07 . 1 593 56 Leu HB2 H 1.83 . 2 594 56 Leu HB3 H 1.86 . 2 595 56 Leu HG H 1.83 . 1 596 56 Leu HD1 H 0.91 . 1 597 56 Leu HD2 H 0.91 . 1 598 56 Leu CA C 54.3 . 1 599 56 Leu CB C 48.2 . 1 600 56 Leu CG C 27.3 . 1 601 56 Leu CD1 C 24.3 . 1 602 56 Leu CD2 C 24.2 . 1 603 56 Leu N N 123.1 . 1 604 57 Glu H H 8.90 . 1 605 57 Glu HA H 4.51 . 1 606 57 Glu HB2 H 1.55 . 1 607 57 Glu HB3 H 1.81 . 1 608 57 Glu HG2 H 1.89 . 2 609 57 Glu HG3 H 2.03 . 2 610 57 Glu CA C 54.6 . 1 611 57 Glu CB C 34.1 . 1 612 57 Glu CG C 36.3 . 1 613 57 Glu N N 122.0 . 1 614 58 Ser H H 7.80 . 1 615 58 Ser HA H 4.75 . 1 616 58 Ser HB2 H 0.91 . 1 617 58 Ser HB3 H 2.44 . 1 618 58 Ser CA C 55.8 . 1 619 58 Ser CB C 66.8 . 1 620 58 Ser N N 111.7 . 1 621 59 Asn H H 8.15 . 1 622 59 Asn HA H 4.76 . 1 623 59 Asn HB2 H 3.07 . 1 624 59 Asn HB3 H 3.59 . 1 625 59 Asn HD21 H 7.79 . 2 626 59 Asn HD22 H 6.71 . 2 627 59 Asn CA C 51.6 . 1 628 59 Asn CB C 37.3 . 1 629 59 Asn N N 116.8 . 1 630 59 Asn ND2 N 110.7 . 1 631 60 Lys H H 8.83 . 1 632 60 Lys HA H 3.96 . 1 633 60 Lys HB2 H 1.81 . 2 634 60 Lys HB3 H 1.89 . 2 635 60 Lys HG2 H 1.46 . 1 636 60 Lys HG3 H 1.46 . 1 637 60 Lys HD2 H 1.69 . 1 638 60 Lys HD3 H 1.69 . 1 639 60 Lys HE2 H 3.00 . 1 640 60 Lys HE3 H 3.00 . 1 641 60 Lys CA C 59.8 . 1 642 60 Lys CB C 31.8 . 1 643 60 Lys CG C 24.4 . 1 644 60 Lys CD C 28.9 . 1 645 60 Lys CE C 41.8 . 1 646 60 Lys N N 123.1 . 1 647 61 Glu H H 8.77 . 1 648 61 Glu HA H 4.19 . 1 649 61 Glu HB2 H 2.10 . 2 650 61 Glu HB3 H 2.23 . 2 651 61 Glu HG2 H 2.34 . 2 652 61 Glu HG3 H 2.54 . 2 653 61 Glu CA C 58.0 . 1 654 61 Glu CB C 29.6 . 1 655 61 Glu CG C 37.3 . 1 656 61 Glu N N 115.4 . 1 657 62 Gly H H 7.82 . 1 658 62 Gly HA2 H 4.53 . 2 659 62 Gly HA3 H 3.53 . 2 660 62 Gly CA C 46.2 . 1 661 62 Gly N N 107.1 . 1 662 63 Thr H H 8.33 . 1 663 63 Thr HA H 4.41 . 1 664 63 Thr HB H 4.57 . 1 665 63 Thr HG2 H 1.10 . 1 666 63 Thr CA C 61.7 . 1 667 63 Thr CB C 69.3 . 1 668 63 Thr CG2 C 23.0 . 1 669 63 Thr N N 107.9 . 1 670 64 Arg H H 7.61 . 1 671 64 Arg HA H 5.02 . 1 672 64 Arg HB2 H 1.63 . 1 673 64 Arg HB3 H 1.73 . 1 674 64 Arg HG2 H 1.50 . 2 675 64 Arg HG3 H 1.63 . 2 676 64 Arg HD2 H 3.09 . 2 677 64 Arg HD3 H 3.19 . 2 678 64 Arg CA C 56.1 . 1 679 64 Arg CB C 32.8 . 1 680 64 Arg CG C 27.4 . 1 681 64 Arg CD C 43.1 . 1 682 64 Arg N N 123.7 . 1 683 65 Trp H H 8.77 . 1 684 65 Trp HA H 4.72 . 1 685 65 Trp HB2 H 1.04 . 2 686 65 Trp HB3 H 2.21 . 2 687 65 Trp HD1 H 6.40 . 1 688 65 Trp HE1 H 9.32 . 1 689 65 Trp HE3 H 7.03 . 1 690 65 Trp HZ2 H 7.02 . 1 691 65 Trp HZ3 H 6.65 . 1 692 65 Trp HH2 H 6.46 . 1 693 65 Trp CA C 55.4 . 1 694 65 Trp CB C 30.6 . 1 695 65 Trp CD1 C 123.5 . 1 696 65 Trp CE3 C 119.8 . 1 697 65 Trp CZ2 C 113.1 . 1 698 65 Trp CZ3 C 120.1 . 1 699 65 Trp CH2 C 123.7 . 1 700 65 Trp N N 125.1 . 1 701 65 Trp NE1 N 127.0 . 1 702 66 Phe H H 8.53 . 1 703 66 Phe HA H 5.33 . 1 704 66 Phe HB2 H 3.10 . 2 705 66 Phe HB3 H 3.22 . 2 706 66 Phe HD1 H 6.87 . 1 707 66 Phe HD2 H 6.87 . 1 708 66 Phe HE1 H 7.00 . 1 709 66 Phe HE2 H 7.00 . 1 710 66 Phe HZ H 6.92 . 1 711 66 Phe CA C 54.9 . 1 712 66 Phe CB C 40.5 . 1 713 66 Phe CD1 C 131.7 . 1 714 66 Phe CD2 C 131.7 . 1 715 66 Phe CE1 C 130.0 . 1 716 66 Phe CE2 C 130.0 . 1 717 66 Phe CZ C 129.4 . 1 718 66 Phe N N 117.0 . 1 719 67 Gly H H 8.54 . 1 720 67 Gly HA2 H 4.93 . 2 721 67 Gly HA3 H 4.31 . 2 722 67 Gly CA C 45.8 . 1 723 67 Gly N N 107.1 . 1 724 68 Lys H H 8.54 . 1 725 68 Lys HA H 5.61 . 1 726 68 Lys HB2 H 1.44 . 1 727 68 Lys HB3 H 1.49 . 1 728 68 Lys HG2 H 1.43 . 2 729 68 Lys HG3 H 1.57 . 2 730 68 Lys HD2 H 1.55 . 2 731 68 Lys HD3 H 1.68 . 2 732 68 Lys HE2 H 2.95 . 1 733 68 Lys HE3 H 2.95 . 1 734 68 Lys CA C 53.9 . 1 735 68 Lys CB C 38.2 . 1 736 68 Lys CG C 24.8 . 1 737 68 Lys CD C 29.6 . 1 738 68 Lys CE C 42.2 . 1 739 68 Lys N N 121.3 . 1 740 69 Cys H H 9.17 . 1 741 69 Cys HA H 5.55 . 1 742 69 Cys HB2 H 2.94 . 2 743 69 Cys HB3 H 3.39 . 2 744 69 Cys CA C 55.2 . 1 745 69 Cys CB C 32.7 . 1 746 69 Cys N N 114.4 . 1 747 70 Trp H H 9.24 . 1 748 70 Trp HA H 6.21 . 1 749 70 Trp HB2 H 3.11 . 1 750 70 Trp HB3 H 3.29 . 1 751 70 Trp HD1 H 7.03 . 1 752 70 Trp HE1 H 10.66 . 1 753 70 Trp HE3 H 7.27 . 1 754 70 Trp HZ2 H 7.17 . 1 755 70 Trp HZ3 H 6.61 . 1 756 70 Trp HH2 H 6.84 . 1 757 70 Trp CA C 56.7 . 1 758 70 Trp CB C 32.6 . 1 759 70 Trp CD1 C 125.9 . 1 760 70 Trp CE3 C 119.9 . 1 761 70 Trp CZ2 C 114.1 . 1 762 70 Trp CZ3 C 120.5 . 1 763 70 Trp CH2 C 123.5 . 1 764 70 Trp N N 117.5 . 1 765 70 Trp NE1 N 131.3 . 1 766 71 Tyr H H 9.23 . 1 767 71 Tyr HA H 4.84 . 1 768 71 Tyr HB2 H 3.01 . 1 769 71 Tyr HB3 H 3.01 . 1 770 71 Tyr HD1 H 6.96 . 1 771 71 Tyr HD2 H 6.96 . 1 772 71 Tyr HE1 H 6.69 . 1 773 71 Tyr HE2 H 6.69 . 1 774 71 Tyr CA C 57.7 . 1 775 71 Tyr CB C 44.0 . 1 776 71 Tyr CD1 C 131.9 . 1 777 71 Tyr CD2 C 131.9 . 1 778 71 Tyr CE1 C 117.3 . 1 779 71 Tyr CE2 C 117.3 . 1 780 71 Tyr N N 121.1 . 1 781 72 Ile H H 8.07 . 1 782 72 Ile HA H 5.13 . 1 783 72 Ile HB H 1.63 . 1 784 72 Ile HG12 H 0.96 . 2 785 72 Ile HG13 H 1.57 . 2 786 72 Ile HG2 H 0.64 . 1 787 72 Ile HD1 H 0.82 . 1 788 72 Ile CA C 59.6 . 1 789 72 Ile CB C 38.1 . 1 790 72 Ile CG1 C 27.8 . 1 791 72 Ile CG2 C 17.1 . 1 792 72 Ile CD1 C 12.7 . 1 793 72 Ile N N 128.9 . 1 794 73 His H H 9.14 . 1 795 73 His HA H 4.82 . 1 796 73 His HB2 H 2.85 . 1 797 73 His HB3 H 3.25 . 1 798 73 His HD2 H 7.19 . 1 799 73 His CA C 55.6 . 1 800 73 His CB C 34.3 . 1 801 73 His CD2 C 119.9 . 1 802 73 His N N 126.2 . 1 803 74 Asp H H 9.03 . 1 804 74 Asp HA H 4.02 . 1 805 74 Asp HB2 H 2.25 . 2 806 74 Asp HB3 H 2.87 . 2 807 74 Asp CA C 55.4 . 1 808 74 Asp CB C 39.0 . 1 809 74 Asp N N 131.6 . 1 810 75 Leu H H 8.23 . 1 811 75 Leu HA H 3.58 . 1 812 75 Leu HB2 H 1.57 . 2 813 75 Leu HB3 H 2.10 . 2 814 75 Leu HG H 1.45 . 1 815 75 Leu HD1 H 0.82 . 2 816 75 Leu HD2 H 0.77 . 2 817 75 Leu CA C 57.1 . 1 818 75 Leu CB C 39.8 . 1 819 75 Leu CG C 26.8 . 1 820 75 Leu CD1 C 25.2 . 1 821 75 Leu CD2 C 22.5 . 1 822 75 Leu N N 108.0 . 1 823 76 Leu H H 7.90 . 1 824 76 Leu HA H 4.47 . 1 825 76 Leu HB2 H 0.60 . 1 826 76 Leu HB3 H 1.93 . 1 827 76 Leu HG H 1.54 . 1 828 76 Leu HD1 H 0.41 . 2 829 76 Leu HD2 H 0.64 . 2 830 76 Leu CA C 53.6 . 1 831 76 Leu CB C 43.1 . 1 832 76 Leu CG C 25.9 . 1 833 76 Leu CD1 C 22.3 . 1 834 76 Leu CD2 C 24.8 . 1 835 76 Leu N N 121.8 . 1 836 77 Lys H H 8.45 . 1 837 77 Lys HA H 4.75 . 1 838 77 Lys HB2 H 1.51 . 2 839 77 Lys HB3 H 1.74 . 2 840 77 Lys HG2 H 1.18 . 1 841 77 Lys HG3 H 1.18 . 1 842 77 Lys HD2 H 1.27 . 2 843 77 Lys HD3 H 1.28 . 2 844 77 Lys HE2 H 2.27 . 2 845 77 Lys HE3 H 2.37 . 2 846 77 Lys CA C 56.1 . 1 847 77 Lys CB C 34.2 . 1 848 77 Lys CG C 25.6 . 1 849 77 Lys CD C 29.2 . 1 850 77 Lys CE C 41.3 . 1 851 77 Lys N N 121.7 . 1 852 78 Tyr H H 9.53 . 1 853 78 Tyr HA H 4.52 . 1 854 78 Tyr HB2 H 2.88 . 2 855 78 Tyr HB3 H 3.29 . 2 856 78 Tyr HD1 H 7.33 . 1 857 78 Tyr HD2 H 7.33 . 1 858 78 Tyr HE1 H 6.77 . 1 859 78 Tyr HE2 H 6.77 . 1 860 78 Tyr CA C 57.5 . 1 861 78 Tyr CB C 39.5 . 1 862 78 Tyr CD1 C 132.9 . 1 863 78 Tyr CD2 C 132.9 . 1 864 78 Tyr CE1 C 117.5 . 1 865 78 Tyr CE2 C 117.5 . 1 866 78 Tyr N N 129.3 . 1 867 79 Glu H H 8.12 . 1 868 79 Glu HA H 5.28 . 1 869 79 Glu HB2 H 1.90 . 1 870 79 Glu HB3 H 1.90 . 1 871 79 Glu HG2 H 2.00 . 1 872 79 Glu HG3 H 2.00 . 1 873 79 Glu CA C 54.3 . 1 874 79 Glu CB C 34.7 . 1 875 79 Glu CG C 37.4 . 1 876 79 Glu N N 122.6 . 1 877 80 Phe H H 9.09 . 1 878 80 Phe HA H 5.09 . 1 879 80 Phe HB2 H 2.71 . 2 880 80 Phe HB3 H 3.07 . 2 881 80 Phe HD1 H 7.16 . 1 882 80 Phe HD2 H 7.16 . 1 883 80 Phe HE1 H 7.18 . 1 884 80 Phe HE2 H 7.18 . 1 885 80 Phe HZ H 7.05 . 1 886 80 Phe CA C 56.0 . 1 887 80 Phe CB C 42.6 . 1 888 80 Phe CD1 C 131.7 . 1 889 80 Phe CD2 C 131.7 . 1 890 80 Phe CE1 C 129.6 . 1 891 80 Phe CE2 C 129.6 . 1 892 80 Phe CZ C 128.3 . 1 893 80 Phe N N 121.3 . 1 894 81 Asp H H 8.46 . 1 895 81 Asp HA H 5.42 . 1 896 81 Asp HB2 H 2.72 . 2 897 81 Asp HB3 H 2.91 . 2 898 81 Asp CA C 54.7 . 1 899 81 Asp CB C 41.3 . 1 900 81 Asp N N 122.9 . 1 901 82 Ile H H 8.46 . 1 902 82 Ile HA H 5.66 . 1 903 82 Ile HB H 1.75 . 1 904 82 Ile HG12 H 0.84 . 2 905 82 Ile HG13 H 1.29 . 2 906 82 Ile HG2 H 1.02 . 1 907 82 Ile HD1 H 0.71 . 1 908 82 Ile CA C 58.5 . 1 909 82 Ile CB C 42.8 . 1 910 82 Ile CG1 C 25.7 . 1 911 82 Ile CG2 C 19.5 . 1 912 82 Ile CD1 C 14.6 . 1 913 82 Ile N N 113.7 . 1 914 83 Glu H H 8.61 . 1 915 83 Glu HA H 5.29 . 1 916 83 Glu HB2 H 2.07 . 1 917 83 Glu HB3 H 2.38 . 1 918 83 Glu HG2 H 2.13 . 1 919 83 Glu HG3 H 2.13 . 1 920 83 Glu CA C 55.2 . 1 921 83 Glu CB C 33.5 . 1 922 83 Glu CG C 35.4 . 1 923 83 Glu N N 117.4 . 1 924 84 Phe H H 8.46 . 1 925 84 Phe HA H 4.95 . 1 926 84 Phe HB2 H 2.77 . 1 927 84 Phe HB3 H 3.68 . 1 928 84 Phe HD1 H 6.51 . 1 929 84 Phe HD2 H 6.51 . 1 930 84 Phe HE1 H 6.63 . 1 931 84 Phe HE2 H 6.63 . 1 932 84 Phe HZ H 6.45 . 1 933 84 Phe CA C 57.4 . 1 934 84 Phe CB C 40.4 . 1 935 84 Phe CD1 C 131.3 . 1 936 84 Phe CD2 C 131.3 . 1 937 84 Phe CE1 C 129.9 . 1 938 84 Phe CE2 C 129.9 . 1 939 84 Phe CZ C 127.8 . 1 940 84 Phe N N 112.7 . 1 941 85 Asp H H 8.57 . 1 942 85 Asp HA H 5.58 . 1 943 85 Asp HB2 H 2.51 . 1 944 85 Asp HB3 H 2.67 . 1 945 85 Asp CA C 52.0 . 1 946 85 Asp CB C 43.0 . 1 947 85 Asp N N 118.3 . 1 948 86 Ile H H 8.43 . 1 949 86 Ile HA H 4.37 . 1 950 86 Ile HB H 2.04 . 1 951 86 Ile HG12 H 1.78 . 2 952 86 Ile HG13 H 2.13 . 2 953 86 Ile HG2 H 0.70 . 1 954 86 Ile HD1 H 0.45 . 1 955 86 Ile CA C 55.2 . 1 956 86 Ile CB C 36.4 . 1 957 86 Ile CG1 C 26.8 . 1 958 86 Ile CG2 C 16.8 . 1 959 86 Ile CD1 C 8.7 . 1 960 86 Ile N N 121.6 . 1 961 87 Pro HA H 4.62 . 1 962 87 Pro HB2 H 1.84 . 1 963 87 Pro HB3 H 2.39 . 1 964 87 Pro HG2 H 1.84 . 2 965 87 Pro HG3 H 1.91 . 2 966 87 Pro HD2 H 3.51 . 1 967 87 Pro HD3 H 3.51 . 1 968 87 Pro CA C 62.1 . 1 969 87 Pro CB C 32.4 . 1 970 87 Pro CG C 27.0 . 1 971 87 Pro CD C 50.6 . 1 972 88 Ile H H 8.69 . 1 973 88 Ile HA H 3.78 . 1 974 88 Ile HB H 1.90 . 1 975 88 Ile HG12 H 1.32 . 2 976 88 Ile HG13 H 1.48 . 2 977 88 Ile HG2 H 0.98 . 1 978 88 Ile HD1 H 0.87 . 1 979 88 Ile CA C 64.5 . 1 980 88 Ile CB C 37.7 . 1 981 88 Ile CG1 C 27.8 . 1 982 88 Ile CG2 C 18.1 . 1 983 88 Ile CD1 C 13.2 . 1 984 88 Ile N N 118.2 . 1 985 89 Thr H H 7.01 . 1 986 89 Thr HA H 4.43 . 1 987 89 Thr HB H 4.67 . 1 988 89 Thr HG2 H 1.17 . 1 989 89 Thr CA C 60.5 . 1 990 89 Thr CB C 67.7 . 1 991 89 Thr CG2 C 22.0 . 1 992 89 Thr N N 103.6 . 1 993 90 Tyr H H 7.67 . 1 994 90 Tyr HA H 4.69 . 1 995 90 Tyr HB2 H 2.76 . 2 996 90 Tyr HB3 H 3.27 . 2 997 90 Tyr HD1 H 7.86 . 1 998 90 Tyr HD2 H 7.38 . 1 999 90 Tyr HE1 H 6.93 . 1 1000 90 Tyr HE2 H 7.33 . 1 1001 90 Tyr CA C 58.3 . 1 1002 90 Tyr CB C 42.0 . 1 1003 90 Tyr CD1 C 132.8 . 1 1004 90 Tyr CD2 C 133.8 . 1 1005 90 Tyr CE1 C 118.2 . 1 1006 90 Tyr CE2 C 116.0 . 1 1007 90 Tyr N N 128.0 . 1 1008 91 Pro HA H 3.55 . 1 1009 91 Pro HB2 H 1.45 . 2 1010 91 Pro HB3 H 2.20 . 2 1011 91 Pro HG2 H 1.50 . 2 1012 91 Pro HG3 H 1.77 . 2 1013 91 Pro HD2 H 3.44 . 2 1014 91 Pro HD3 H 3.80 . 2 1015 91 Pro CA C 62.8 . 1 1016 91 Pro CB C 33.2 . 1 1017 91 Pro CG C 25.1 . 1 1018 91 Pro CD C 49.5 . 1 1019 92 Thr H H 8.20 . 1 1020 92 Thr HA H 4.12 . 1 1021 92 Thr HB H 4.44 . 1 1022 92 Thr HG2 H 1.25 . 1 1023 92 Thr CA C 67.1 . 1 1024 92 Thr CB C 67.9 . 1 1025 92 Thr CG2 C 21.6 . 1 1026 92 Thr N N 122.2 . 1 1027 93 Thr H H 7.25 . 1 1028 93 Thr HA H 4.28 . 1 1029 93 Thr HB H 3.67 . 1 1030 93 Thr HG2 H 1.08 . 1 1031 93 Thr CA C 59.6 . 1 1032 93 Thr CB C 69.9 . 1 1033 93 Thr CG2 C 21.0 . 1 1034 93 Thr N N 114.3 . 1 1035 94 Ala H H 7.94 . 1 1036 94 Ala HA H 3.87 . 1 1037 94 Ala HB H 0.01 . 1 1038 94 Ala CA C 49.7 . 1 1039 94 Ala CB C 15.4 . 1 1040 94 Ala N N 126.2 . 1 1041 95 Pro HA H 4.23 . 1 1042 95 Pro HB2 H 0.87 . 2 1043 95 Pro HB3 H 2.45 . 2 1044 95 Pro HG2 H 1.32 . 2 1045 95 Pro HG3 H 1.47 . 2 1046 95 Pro HD2 H 2.95 . 2 1047 95 Pro HD3 H 3.85 . 2 1048 95 Pro CA C 61.6 . 1 1049 95 Pro CB C 31.9 . 1 1050 95 Pro CG C 27.9 . 1 1051 95 Pro CD C 49.2 . 1 1052 96 Glu H H 8.60 . 1 1053 96 Glu HA H 4.26 . 1 1054 96 Glu HB2 H 1.71 . 2 1055 96 Glu HB3 H 1.85 . 2 1056 96 Glu HG2 H 2.07 . 2 1057 96 Glu HG3 H 2.24 . 2 1058 96 Glu CA C 54.1 . 1 1059 96 Glu CB C 30.1 . 1 1060 96 Glu CG C 35.9 . 1 1061 96 Glu N N 119.5 . 1 1062 97 Ile H H 8.55 . 1 1063 97 Ile HA H 3.79 . 1 1064 97 Ile HB H 1.26 . 1 1065 97 Ile HG12 H 0.33 . 2 1066 97 Ile HG13 H 1.15 . 2 1067 97 Ile HG2 H 0.67 . 1 1068 97 Ile HD1 H 0.43 . 1 1069 97 Ile CA C 62.8 . 1 1070 97 Ile CB C 38.7 . 1 1071 97 Ile CG1 C 27.6 . 1 1072 97 Ile CG2 C 17.5 . 1 1073 97 Ile CD1 C 14.7 . 1 1074 97 Ile N N 124.1 . 1 1075 98 Ala H H 8.88 . 1 1076 98 Ala HA H 5.09 . 1 1077 98 Ala HB H 1.34 . 1 1078 98 Ala CA C 50.2 . 1 1079 98 Ala CB C 21.6 . 1 1080 98 Ala N N 128.8 . 1 1081 99 Val H H 8.02 . 1 1082 99 Val HA H 4.90 . 1 1083 99 Val HB H 1.96 . 1 1084 99 Val HG1 H 0.58 . 2 1085 99 Val HG2 H 0.93 . 2 1086 99 Val CA C 58.3 . 1 1087 99 Val CB C 31.4 . 1 1088 99 Val CG1 C 20.0 . 1 1089 99 Val CG2 C 22.2 . 1 1090 99 Val N N 119.5 . 1 1091 100 Pro HA H 4.13 . 1 1092 100 Pro HB2 H 2.03 . 1 1093 100 Pro HB3 H 2.40 . 1 1094 100 Pro HG2 H 1.88 . 2 1095 100 Pro HG3 H 2.12 . 2 1096 100 Pro HD2 H 3.48 . 2 1097 100 Pro HD3 H 3.77 . 2 1098 100 Pro CA C 66.4 . 1 1099 100 Pro CB C 32.3 . 1 1100 100 Pro CG C 27.1 . 1 1101 100 Pro CD C 49.8 . 1 1102 101 Glu H H 9.68 . 1 1103 101 Glu HA H 4.30 . 1 1104 101 Glu HB2 H 2.17 . 1 1105 101 Glu HB3 H 2.39 . 1 1106 101 Glu HG2 H 2.43 . 1 1107 101 Glu HG3 H 2.43 . 1 1108 101 Glu CA C 58.3 . 1 1109 101 Glu CB C 30.2 . 1 1110 101 Glu CG C 36.8 . 1 1111 101 Glu N N 116.4 . 1 1112 102 Leu H H 7.93 . 1 1113 102 Leu HA H 4.34 . 1 1114 102 Leu HB2 H 1.60 . 1 1115 102 Leu HB3 H 1.60 . 1 1116 102 Leu HG H 1.35 . 1 1117 102 Leu HD1 H 0.50 . 2 1118 102 Leu HD2 H 0.68 . 2 1119 102 Leu CA C 53.9 . 1 1120 102 Leu CB C 42.1 . 1 1121 102 Leu CG C 26.9 . 1 1122 102 Leu CD1 C 25.1 . 1 1123 102 Leu CD2 C 22.5 . 1 1124 102 Leu N N 116.5 . 1 1125 103 Asp H H 7.36 . 1 1126 103 Asp HA H 4.44 . 1 1127 103 Asp HB2 H 2.60 . 2 1128 103 Asp HB3 H 2.72 . 2 1129 103 Asp CA C 56.4 . 1 1130 103 Asp CB C 41.0 . 1 1131 103 Asp N N 119.9 . 1 1132 104 Gly H H 8.62 . 1 1133 104 Gly HA2 H 4.25 . 2 1134 104 Gly HA3 H 3.79 . 2 1135 104 Gly CA C 45.8 . 1 1136 104 Gly N N 115.0 . 1 1137 105 Lys H H 8.33 . 1 1138 105 Lys HA H 4.41 . 1 1139 105 Lys HB2 H 1.76 . 2 1140 105 Lys HB3 H 1.82 . 2 1141 105 Lys HG2 H 1.30 . 2 1142 105 Lys HG3 H 1.36 . 2 1143 105 Lys HD2 H 1.60 . 1 1144 105 Lys HD3 H 1.60 . 1 1145 105 Lys HE2 H 3.12 . 1 1146 105 Lys HE3 H 3.12 . 1 1147 105 Lys CA C 56.4 . 1 1148 105 Lys CB C 33.3 . 1 1149 105 Lys CG C 25.6 . 1 1150 105 Lys CD C 29.1 . 1 1151 105 Lys CE C 42.5 . 1 1152 105 Lys N N 117.5 . 1 1153 106 Thr H H 7.31 . 1 1154 106 Thr HA H 4.63 . 1 1155 106 Thr HB H 4.20 . 1 1156 106 Thr HG2 H 1.17 . 1 1157 106 Thr CA C 58.4 . 1 1158 106 Thr CB C 68.6 . 1 1159 106 Thr CG2 C 20.7 . 1 1160 106 Thr N N 110.1 . 1 1161 107 Ala H H 8.73 . 1 1162 107 Ala HA H 4.47 . 1 1163 107 Ala HB H 1.43 . 1 1164 107 Ala CA C 52.6 . 1 1165 107 Ala CB C 18.9 . 1 1166 107 Ala N N 128.2 . 1 1167 108 Lys H H 8.32 . 1 1168 108 Lys HA H 4.00 . 1 1169 108 Lys HB2 H 2.00 . 1 1170 108 Lys HB3 H 2.00 . 1 1171 108 Lys CA C 56.2 . 1 1172 108 Lys CB C 29.0 . 1 1173 108 Lys N N 119.1 . 1 1174 109 Met HG2 H 2.30 . 2 1175 109 Met HG3 H 2.40 . 2 1176 109 Met HE H 1.89 . 1 1177 109 Met CG C 36.0 . 1 1178 109 Met CE C 18.0 . 1 1179 110 Tyr HA H 4.86 . 1 1180 110 Tyr HB2 H 2.84 . 2 1181 110 Tyr HB3 H 3.08 . 2 1182 110 Tyr HD1 H 7.00 . 1 1183 110 Tyr HD2 H 7.00 . 1 1184 110 Tyr HE1 H 6.74 . 1 1185 110 Tyr HE2 H 6.74 . 1 1186 110 Tyr CA C 53.1 . 1 1187 110 Tyr CB C 39.5 . 1 1188 110 Tyr CD1 C 132.5 . 1 1189 110 Tyr CD2 C 132.5 . 1 1190 110 Tyr CE1 C 117.4 . 1 1191 110 Tyr CE2 C 117.4 . 1 1192 111 Arg H H 8.40 . 1 1193 111 Arg HA H 4.25 . 1 1194 111 Arg HB2 H 1.79 . 1 1195 111 Arg HB3 H 1.79 . 1 1196 111 Arg HG2 H 1.58 . 2 1197 111 Arg HG3 H 1.68 . 2 1198 111 Arg HD2 H 3.21 . 1 1199 111 Arg HD3 H 3.21 . 1 1200 111 Arg CA C 57.4 . 1 1201 111 Arg CB C 30.5 . 1 1202 111 Arg CG C 27.1 . 1 1203 111 Arg CD C 42.9 . 1 1204 111 Arg N N 120.9 . 1 1205 112 Gly H H 8.98 . 1 1206 112 Gly HA2 H 4.10 . 2 1207 112 Gly HA3 H 3.69 . 2 1208 112 Gly CA C 45.5 . 1 1209 112 Gly N N 113.5 . 1 1210 113 Gly H H 8.15 . 1 1211 113 Gly HA2 H 3.93 . 1 1212 113 Gly HA3 H 3.93 . 1 1213 113 Gly CA C 45.6 . 1 1214 113 Gly N N 107.3 . 1 1215 114 Lys H H 7.00 . 1 1216 114 Lys HA H 4.58 . 1 1217 114 Lys HB2 H 1.25 . 2 1218 114 Lys HB3 H 1.47 . 2 1219 114 Lys HG2 H 1.04 . 2 1220 114 Lys HG3 H 1.23 . 2 1221 114 Lys HD2 H 1.60 . 2 1222 114 Lys HD3 H 1.73 . 2 1223 114 Lys HE2 H 2.91 . 1 1224 114 Lys HE3 H 2.91 . 1 1225 114 Lys CA C 55.1 . 1 1226 114 Lys CB C 32.9 . 1 1227 114 Lys CG C 25.6 . 1 1228 114 Lys CD C 28.9 . 1 1229 114 Lys CE C 41.8 . 1 1230 114 Lys N N 118.4 . 1 1231 115 Ile H H 7.91 . 1 1232 115 Ile HA H 3.77 . 1 1233 115 Ile HB H 0.37 . 1 1234 115 Ile HG12 H 0.57 . 2 1235 115 Ile HG13 H 0.70 . 2 1236 115 Ile HG2 H -0.36 . 1 1237 115 Ile HD1 H -0.19 . 1 1238 115 Ile CA C 61.9 . 1 1239 115 Ile CB C 37.5 . 1 1240 115 Ile CG1 C 24.8 . 1 1241 115 Ile CG2 C 17.0 . 1 1242 115 Ile CD1 C 13.5 . 1 1243 115 Ile N N 117.1 . 1 1244 116 Cys H H 7.71 . 1 1245 116 Cys HA H 4.44 . 1 1246 116 Cys HB2 H 2.23 . 2 1247 116 Cys HB3 H 2.78 . 2 1248 116 Cys CA C 57.6 . 1 1249 116 Cys CB C 27.0 . 1 1250 116 Cys N N 121.7 . 1 1251 117 Leu H H 8.42 . 1 1252 117 Leu HA H 4.45 . 1 1253 117 Leu HB2 H 1.43 . 2 1254 117 Leu HB3 H 1.68 . 2 1255 117 Leu HG H 1.35 . 1 1256 117 Leu HD1 H 0.13 . 2 1257 117 Leu HD2 H 0.33 . 2 1258 117 Leu CA C 54.2 . 1 1259 117 Leu CB C 41.7 . 1 1260 117 Leu CG C 26.3 . 1 1261 117 Leu CD1 C 25.2 . 1 1262 117 Leu CD2 C 22.6 . 1 1263 117 Leu N N 126.2 . 1 1264 118 Thr H H 8.22 . 1 1265 118 Thr HA H 4.28 . 1 1266 118 Thr HB H 4.54 . 1 1267 118 Thr HG2 H 1.41 . 1 1268 118 Thr CA C 62.4 . 1 1269 118 Thr CB C 69.5 . 1 1270 118 Thr CG2 C 21.7 . 1 1271 118 Thr N N 111.5 . 1 1272 119 Asp H H 8.77 . 1 1273 119 Asp HA H 4.38 . 1 1274 119 Asp HB2 H 2.61 . 2 1275 119 Asp HB3 H 2.68 . 2 1276 119 Asp CA C 56.8 . 1 1277 119 Asp CB C 40.2 . 1 1278 119 Asp N N 122.0 . 1 1279 120 His H H 7.93 . 1 1280 120 His HA H 4.57 . 1 1281 120 His HB2 H 3.23 . 1 1282 120 His HB3 H 3.23 . 1 1283 120 His HD2 H 7.06 . 1 1284 120 His HE1 H 8.19 . 1 1285 120 His CA C 57.1 . 1 1286 120 His CB C 30.4 . 1 1287 120 His CD2 C 120.2 . 1 1288 120 His CE1 C 136.2 . 1 1289 120 His N N 114.8 . 1 1290 121 Phe H H 7.96 . 1 1291 121 Phe HA H 4.07 . 1 1292 121 Phe HB2 H 3.10 . 2 1293 121 Phe HB3 H 3.22 . 2 1294 121 Phe HD1 H 7.05 . 1 1295 121 Phe HD2 H 7.05 . 1 1296 121 Phe HE1 H 6.99 . 1 1297 121 Phe HE2 H 6.99 . 1 1298 121 Phe HZ H 6.93 . 1 1299 121 Phe CA C 62.4 . 1 1300 121 Phe CB C 39.5 . 1 1301 121 Phe CD1 C 131.7 . 1 1302 121 Phe CD2 C 131.7 . 1 1303 121 Phe CE1 C 129.8 . 1 1304 121 Phe CE2 C 129.8 . 1 1305 121 Phe CZ C 129.2 . 1 1306 121 Phe N N 121.3 . 1 1307 122 Lys H H 8.59 . 1 1308 122 Lys HA H 3.99 . 1 1309 122 Lys HB2 H 1.96 . 1 1310 122 Lys HB3 H 2.04 . 1 1311 122 Lys HG2 H 1.42 . 2 1312 122 Lys HG3 H 1.72 . 2 1313 122 Lys HD2 H 1.73 . 2 1314 122 Lys HD3 H 1.74 . 2 1315 122 Lys HE2 H 2.99 . 1 1316 122 Lys HE3 H 2.99 . 1 1317 122 Lys CA C 62.3 . 1 1318 122 Lys CB C 29.7 . 1 1319 122 Lys CG C 26.5 . 1 1320 122 Lys CD C 29.4 . 1 1321 122 Lys CE C 41.8 . 1 1322 122 Lys N N 118.4 . 1 1323 123 Pro HA H 4.38 . 1 1324 123 Pro HB2 H 1.83 . 2 1325 123 Pro HB3 H 2.29 . 2 1326 123 Pro HG2 H 1.99 . 2 1327 123 Pro HG3 H 2.12 . 2 1328 123 Pro HD2 H 3.64 . 2 1329 123 Pro HD3 H 3.77 . 2 1330 123 Pro CA C 65.5 . 1 1331 123 Pro CB C 30.7 . 1 1332 123 Pro CG C 27.9 . 1 1333 123 Pro CD C 50.3 . 1 1334 124 Leu H H 6.93 . 1 1335 124 Leu HA H 3.95 . 1 1336 124 Leu HB2 H 1.61 . 2 1337 124 Leu HB3 H 1.92 . 2 1338 124 Leu HG H 1.53 . 1 1339 124 Leu HD1 H 0.93 . 2 1340 124 Leu HD2 H 1.04 . 2 1341 124 Leu CA C 57.9 . 1 1342 124 Leu CB C 41.9 . 1 1343 124 Leu CG C 27.0 . 1 1344 124 Leu CD1 C 23.5 . 1 1345 124 Leu CD2 C 26.2 . 1 1346 124 Leu N N 119.9 . 1 1347 125 Trp H H 8.49 . 1 1348 125 Trp HA H 3.57 . 1 1349 125 Trp HB2 H 2.49 . 1 1350 125 Trp HB3 H 3.07 . 1 1351 125 Trp HD1 H 6.93 . 1 1352 125 Trp HE1 H 9.60 . 1 1353 125 Trp HE3 H 7.41 . 1 1354 125 Trp HZ2 H 7.26 . 1 1355 125 Trp HZ3 H 7.04 . 1 1356 125 Trp HH2 H 7.06 . 1 1357 125 Trp CA C 61.0 . 1 1358 125 Trp CB C 27.6 . 1 1359 125 Trp CD1 C 126.6 . 1 1360 125 Trp CE3 C 120.1 . 1 1361 125 Trp CZ2 C 113.9 . 1 1362 125 Trp CZ3 C 123.0 . 1 1363 125 Trp CH2 C 123.1 . 1 1364 125 Trp N N 120.6 . 1 1365 125 Trp NE1 N 130.6 . 1 1366 126 Ala H H 8.33 . 1 1367 126 Ala HA H 4.17 . 1 1368 126 Ala HB H 1.50 . 1 1369 126 Ala CA C 54.7 . 1 1370 126 Ala CB C 18.5 . 1 1371 126 Ala N N 117.9 . 1 1372 127 Arg H H 7.50 . 1 1373 127 Arg HA H 4.14 . 1 1374 127 Arg HB2 H 1.71 . 2 1375 127 Arg HB3 H 1.86 . 2 1376 127 Arg HG2 H 1.59 . 2 1377 127 Arg HG3 H 1.72 . 2 1378 127 Arg HD2 H 3.11 . 1 1379 127 Arg HD3 H 3.11 . 1 1380 127 Arg CA C 57.0 . 1 1381 127 Arg CB C 30.1 . 1 1382 127 Arg CG C 27.0 . 1 1383 127 Arg CD C 43.4 . 1 1384 127 Arg N N 113.5 . 1 1385 128 Asn H H 7.18 . 1 1386 128 Asn HA H 4.26 . 1 1387 128 Asn HB2 H 0.92 . 1 1388 128 Asn HB3 H 1.28 . 1 1389 128 Asn HD21 H 6.92 . 2 1390 128 Asn HD22 H 7.29 . 2 1391 128 Asn CA C 53.4 . 1 1392 128 Asn CB C 40.4 . 1 1393 128 Asn N N 116.3 . 1 1394 128 Asn ND2 N 116.8 . 1 1395 129 Val H H 6.64 . 1 1396 129 Val HA H 4.01 . 1 1397 129 Val HB H 1.75 . 1 1398 129 Val HG1 H 0.66 . 1 1399 129 Val HG2 H 1.08 . 1 1400 129 Val CA C 60.5 . 1 1401 129 Val CB C 33.3 . 1 1402 129 Val CG1 C 20.4 . 1 1403 129 Val CG2 C 22.9 . 1 1404 129 Val N N 122.5 . 1 1405 130 Pro HA H 4.86 . 1 1406 130 Pro HB2 H 1.22 . 1 1407 130 Pro HB3 H 1.47 . 1 1408 130 Pro HG2 H 1.25 . 2 1409 130 Pro HG3 H 1.72 . 2 1410 130 Pro HD2 H 3.23 . 2 1411 130 Pro HD3 H 3.45 . 2 1412 130 Pro CA C 64.6 . 1 1413 130 Pro CB C 32.6 . 1 1414 130 Pro CG C 24.1 . 1 1415 130 Pro CD C 48.1 . 1 1416 131 Lys H H 8.76 . 1 1417 131 Lys HA H 4.17 . 1 1418 131 Lys HB2 H 1.74 . 2 1419 131 Lys HB3 H 1.60 . 2 1420 131 Lys HG2 H 1.26 . 2 1421 131 Lys HG3 H 1.46 . 2 1422 131 Lys HD2 H 1.56 . 2 1423 131 Lys HD3 H 1.62 . 2 1424 131 Lys HE2 H 2.87 . 2 1425 131 Lys HE3 H 2.91 . 2 1426 131 Lys CA C 57.9 . 1 1427 131 Lys CB C 32.6 . 1 1428 131 Lys CG C 25.7 . 1 1429 131 Lys CD C 29.3 . 1 1430 131 Lys CE C 41.9 . 1 1431 131 Lys N N 122.6 . 1 1432 132 Phe H H 6.28 . 1 1433 132 Phe HA H 4.03 . 1 1434 132 Phe HB2 H 1.98 . 1 1435 132 Phe HB3 H 2.06 . 1 1436 132 Phe HD1 H 6.20 . 1 1437 132 Phe HD2 H 6.20 . 1 1438 132 Phe HE1 H 6.77 . 1 1439 132 Phe HE2 H 6.77 . 1 1440 132 Phe HZ H 6.20 . 1 1441 132 Phe CA C 51.9 . 1 1442 132 Phe CB C 36.4 . 1 1443 132 Phe CD1 C 127.3 . 1 1444 132 Phe CD2 C 127.3 . 1 1445 132 Phe CE1 C 129.7 . 1 1446 132 Phe CE2 C 129.7 . 1 1447 132 Phe CZ C 130.1 . 1 1448 132 Phe N N 113.4 . 1 1449 133 Gly H H 9.74 . 1 1450 133 Gly HA2 H 5.14 . 2 1451 133 Gly HA3 H 4.14 . 2 1452 133 Gly CA C 44.0 . 1 1453 133 Gly N N 112.9 . 1 1454 134 Leu H H 10.28 . 1 1455 134 Leu HA H 3.92 . 1 1456 134 Leu HB2 H 0.74 . 1 1457 134 Leu HB3 H 1.60 . 1 1458 134 Leu HG H 1.64 . 1 1459 134 Leu HD1 H -0.51 . 2 1460 134 Leu HD2 H 0.37 . 2 1461 134 Leu CA C 57.5 . 1 1462 134 Leu CB C 40.4 . 1 1463 134 Leu CG C 26.2 . 1 1464 134 Leu CD1 C 23.0 . 1 1465 134 Leu CD2 C 22.0 . 1 1466 134 Leu N N 125.0 . 1 1467 135 Ala H H 9.24 . 1 1468 135 Ala HA H 3.75 . 1 1469 135 Ala HB H 1.04 . 1 1470 135 Ala CA C 55.6 . 1 1471 135 Ala CB C 18.0 . 1 1472 135 Ala N N 120.1 . 1 1473 136 His H H 7.37 . 1 1474 136 His HA H 3.57 . 1 1475 136 His HB2 H 2.35 . 2 1476 136 His HB3 H 3.34 . 2 1477 136 His HD2 H 5.82 . 1 1478 136 His HE1 H 7.71 . 1 1479 136 His CA C 61.9 . 1 1480 136 His CB C 29.7 . 1 1481 136 His CD2 C 115.6 . 1 1482 136 His CE1 C 136.3 . 1 1483 136 His N N 115.4 . 1 1484 137 Leu H H 8.62 . 1 1485 137 Leu HA H 4.15 . 1 1486 137 Leu HB2 H 1.42 . 2 1487 137 Leu HB3 H 2.33 . 2 1488 137 Leu HG H 1.11 . 1 1489 137 Leu HD1 H -0.05 . 2 1490 137 Leu HD2 H 0.45 . 2 1491 137 Leu CA C 58.4 . 1 1492 137 Leu CB C 42.1 . 1 1493 137 Leu CG C 26.4 . 1 1494 137 Leu CD1 C 25.8 . 1 1495 137 Leu CD2 C 23.3 . 1 1496 137 Leu N N 121.2 . 1 1497 138 Met H H 7.93 . 1 1498 138 Met HA H 4.36 . 1 1499 138 Met HB2 H 2.20 . 1 1500 138 Met HB3 H 2.46 . 1 1501 138 Met HG2 H 2.21 . 1 1502 138 Met HG3 H 2.21 . 1 1503 138 Met CA C 57.0 . 1 1504 138 Met CB C 31.6 . 1 1505 138 Met CG C 32.2 . 1 1506 138 Met N N 117.1 . 1 1507 139 Ala H H 8.35 . 1 1508 139 Ala HA H 4.49 . 1 1509 139 Ala HB H 1.22 . 1 1510 139 Ala CA C 55.8 . 1 1511 139 Ala CB C 20.6 . 1 1512 139 Ala N N 120.5 . 1 1513 140 Leu H H 8.89 . 1 1514 140 Leu HA H 4.51 . 1 1515 140 Leu HB2 H 1.74 . 2 1516 140 Leu HB3 H 2.08 . 2 1517 140 Leu HG H 1.64 . 1 1518 140 Leu HD1 H 0.80 . 2 1519 140 Leu HD2 H 0.92 . 2 1520 140 Leu CA C 54.5 . 1 1521 140 Leu CB C 43.3 . 1 1522 140 Leu CG C 27.0 . 1 1523 140 Leu CD1 C 26.1 . 1 1524 140 Leu CD2 C 22.7 . 1 1525 140 Leu N N 110.9 . 1 1526 141 Gly H H 7.41 . 1 1527 141 Gly HA2 H 4.05 . 2 1528 141 Gly HA3 H 3.16 . 2 1529 141 Gly CA C 45.7 . 1 1530 141 Gly N N 107.1 . 1 1531 142 Leu H H 7.83 . 1 1532 142 Leu HA H 4.08 . 1 1533 142 Leu HB2 H 1.36 . 2 1534 142 Leu HB3 H 2.33 . 2 1535 142 Leu HG H 1.88 . 1 1536 142 Leu HD1 H 0.87 . 2 1537 142 Leu HD2 H 1.16 . 2 1538 142 Leu CA C 57.9 . 1 1539 142 Leu CB C 42.2 . 1 1540 142 Leu CG C 27.0 . 1 1541 142 Leu CD1 C 23.0 . 1 1542 142 Leu CD2 C 27.2 . 1 1543 142 Leu N N 125.1 . 1 1544 143 Gly H H 9.07 . 1 1545 143 Gly HA2 H 3.12 . 2 1546 143 Gly HA3 H 3.72 . 2 1547 143 Gly CA C 49.3 . 1 1548 143 Gly N N 105.7 . 1 1549 144 Pro HA H 4.25 . 1 1550 144 Pro HB2 H 1.82 . 2 1551 144 Pro HB3 H 2.44 . 2 1552 144 Pro HG2 H 1.84 . 2 1553 144 Pro HG3 H 2.09 . 2 1554 144 Pro HD2 H 3.08 . 2 1555 144 Pro HD3 H 3.60 . 2 1556 144 Pro CA C 64.6 . 1 1557 144 Pro CB C 32.1 . 1 1558 144 Pro CG C 28.3 . 1 1559 144 Pro CD C 51.4 . 1 1560 145 Trp H H 7.20 . 1 1561 145 Trp HA H 4.06 . 1 1562 145 Trp HB2 H 3.23 . 2 1563 145 Trp HB3 H 3.56 . 2 1564 145 Trp HD1 H 7.36 . 1 1565 145 Trp HE1 H 9.70 . 1 1566 145 Trp HE3 H 7.08 . 1 1567 145 Trp HZ2 H 7.16 . 1 1568 145 Trp HZ3 H 6.36 . 1 1569 145 Trp HH2 H 6.62 . 1 1570 145 Trp CA C 62.3 . 1 1571 145 Trp CB C 29.6 . 1 1572 145 Trp CD1 C 127.0 . 1 1573 145 Trp CE3 C 119.6 . 1 1574 145 Trp CZ2 C 113.9 . 1 1575 145 Trp CZ3 C 119.6 . 1 1576 145 Trp CH2 C 122.7 . 1 1577 145 Trp N N 118.4 . 1 1578 145 Trp NE1 N 127.7 . 1 1579 146 Leu H H 8.68 . 1 1580 146 Leu HA H 3.58 . 1 1581 146 Leu HB2 H 1.24 . 2 1582 146 Leu HB3 H 2.04 . 2 1583 146 Leu HG H 2.08 . 1 1584 146 Leu HD1 H 0.88 . 2 1585 146 Leu HD2 H 1.14 . 2 1586 146 Leu CA C 57.8 . 1 1587 146 Leu CB C 42.6 . 1 1588 146 Leu CG C 26.8 . 1 1589 146 Leu CD1 C 23.0 . 1 1590 146 Leu CD2 C 27.6 . 1 1591 146 Leu N N 118.8 . 1 1592 147 Ala H H 7.31 . 1 1593 147 Ala HA H 3.86 . 1 1594 147 Ala HB H 1.43 . 1 1595 147 Ala CA C 53.8 . 1 1596 147 Ala CB C 18.2 . 1 1597 147 Ala N N 115.0 . 1 1598 148 Val H H 6.91 . 1 1599 148 Val HA H 3.87 . 1 1600 148 Val HB H 1.80 . 1 1601 148 Val HG1 H 0.75 . 2 1602 148 Val HG2 H 0.93 . 2 1603 148 Val CA C 63.4 . 1 1604 148 Val CB C 33.1 . 1 1605 148 Val CG1 C 21.1 . 1 1606 148 Val CG2 C 21.8 . 1 1607 148 Val N N 113.1 . 1 1608 149 Glu H H 7.92 . 1 1609 149 Glu HA H 3.85 . 1 1610 149 Glu HB2 H 0.27 . 2 1611 149 Glu HB3 H 0.96 . 2 1612 149 Glu HG2 H 0.82 . 2 1613 149 Glu HG3 H 1.28 . 2 1614 149 Glu CA C 57.3 . 1 1615 149 Glu CB C 29.2 . 1 1616 149 Glu CG C 34.2 . 1 1617 149 Glu N N 117.5 . 1 1618 150 Ile H H 7.94 . 1 1619 150 Ile HA H 3.54 . 1 1620 150 Ile HB H 1.56 . 1 1621 150 Ile HG12 H 0.82 . 2 1622 150 Ile HG13 H 1.49 . 2 1623 150 Ile HG2 H 0.42 . 1 1624 150 Ile HD1 H 0.18 . 1 1625 150 Ile CA C 63.4 . 1 1626 150 Ile CB C 30.6 . 1 1627 150 Ile CG1 C 28.2 . 1 1628 150 Ile CG2 C 18.6 . 1 1629 150 Ile CD1 C 8.6 . 1 1630 150 Ile N N 115.7 . 1 1631 151 Pro HA H 3.52 . 1 1632 151 Pro HB2 H 1.66 . 2 1633 151 Pro HB3 H 2.07 . 2 1634 151 Pro HG2 H 1.71 . 2 1635 151 Pro HG3 H 2.05 . 2 1636 151 Pro HD2 H 3.00 . 1 1637 151 Pro HD3 H 3.00 . 1 1638 151 Pro CA C 66.3 . 1 1639 151 Pro CB C 30.6 . 1 1640 151 Pro CG C 28.7 . 1 1641 151 Pro CD C 49.4 . 1 1642 152 Asp H H 6.55 . 1 1643 152 Asp HA H 4.33 . 1 1644 152 Asp HB2 H 2.55 . 1 1645 152 Asp HB3 H 2.55 . 1 1646 152 Asp CA C 57.2 . 1 1647 152 Asp CB C 41.7 . 1 1648 152 Asp N N 115.9 . 1 1649 153 Leu H H 7.82 . 1 1650 153 Leu HA H 3.88 . 1 1651 153 Leu HB2 H 1.16 . 2 1652 153 Leu HB3 H 1.90 . 2 1653 153 Leu HG H 1.91 . 1 1654 153 Leu HD1 H 0.66 . 2 1655 153 Leu HD2 H 0.73 . 2 1656 153 Leu CA C 57.4 . 1 1657 153 Leu CB C 41.4 . 1 1658 153 Leu CG C 26.2 . 1 1659 153 Leu CD1 C 26.1 . 1 1660 153 Leu CD2 C 22.9 . 1 1661 153 Leu N N 118.0 . 1 1662 154 Ile H H 8.16 . 1 1663 154 Ile HA H 3.68 . 1 1664 154 Ile HB H 1.39 . 1 1665 154 Ile HG12 H 0.32 . 2 1666 154 Ile HG13 H 1.33 . 2 1667 154 Ile HG2 H 0.81 . 1 1668 154 Ile HD1 H 0.01 . 1 1669 154 Ile CA C 65.1 . 1 1670 154 Ile CB C 38.3 . 1 1671 154 Ile CG1 C 29.2 . 1 1672 154 Ile CG2 C 16.7 . 1 1673 154 Ile CD1 C 14.9 . 1 1674 154 Ile N N 120.1 . 1 1675 155 Gln H H 8.10 . 1 1676 155 Gln HA H 4.04 . 1 1677 155 Gln HB2 H 2.24 . 1 1678 155 Gln HB3 H 2.24 . 1 1679 155 Gln HG2 H 2.49 . 1 1680 155 Gln HG3 H 2.49 . 1 1681 155 Gln HE21 H 7.42 . 2 1682 155 Gln HE22 H 6.84 . 2 1683 155 Gln CA C 58.8 . 1 1684 155 Gln CB C 27.9 . 1 1685 155 Gln CG C 33.7 . 1 1686 155 Gln N N 121.6 . 1 1687 155 Gln NE2 N 111.2 . 1 1688 156 Lys H H 7.88 . 1 1689 156 Lys HA H 4.19 . 1 1690 156 Lys HB2 H 1.76 . 2 1691 156 Lys HB3 H 2.04 . 2 1692 156 Lys HG2 H 1.45 . 2 1693 156 Lys HG3 H 1.66 . 2 1694 156 Lys HD2 H 1.50 . 2 1695 156 Lys HD3 H 1.59 . 2 1696 156 Lys HE2 H 2.92 . 1 1697 156 Lys HE3 H 2.92 . 1 1698 156 Lys CA C 56.9 . 1 1699 156 Lys CB C 34.1 . 1 1700 156 Lys CG C 26.3 . 1 1701 156 Lys CD C 29.2 . 1 1702 156 Lys CE C 41.8 . 1 1703 156 Lys N N 115.9 . 1 1704 157 Gly H H 7.93 . 1 1705 157 Gly HA2 H 3.97 . 2 1706 157 Gly HA3 H 4.11 . 2 1707 157 Gly CA C 45.6 . 1 1708 157 Gly N N 108.0 . 1 1709 158 Val H H 7.79 . 1 1710 158 Val HA H 4.04 . 1 1711 158 Val HB H 2.17 . 1 1712 158 Val HG1 H 1.00 . 1 1713 158 Val HG2 H 1.00 . 1 1714 158 Val CA C 63.3 . 1 1715 158 Val CB C 32.2 . 1 1716 158 Val CG1 C 21.8 . 1 1717 158 Val CG2 C 21.8 . 1 1718 158 Val N N 115.2 . 1 1719 159 Ile H H 6.85 . 1 1720 159 Ile HA H 4.64 . 1 1721 159 Ile HB H 1.86 . 1 1722 159 Ile HG12 H 0.81 . 2 1723 159 Ile HG13 H 1.30 . 2 1724 159 Ile HG2 H 0.95 . 1 1725 159 Ile HD1 H 0.85 . 1 1726 159 Ile CA C 59.4 . 1 1727 159 Ile CB C 40.7 . 1 1728 159 Ile CG1 C 25.3 . 1 1729 159 Ile CG2 C 18.1 . 1 1730 159 Ile CD1 C 14.6 . 1 1731 159 Ile N N 112.3 . 1 1732 160 Gln H H 8.64 . 1 1733 160 Gln HA H 4.83 . 1 1734 160 Gln HB2 H 1.92 . 2 1735 160 Gln HB3 H 2.09 . 2 1736 160 Gln HG2 H 2.32 . 2 1737 160 Gln HG3 H 2.35 . 2 1738 160 Gln HE21 H 6.76 . 2 1739 160 Gln HE22 H 7.47 . 2 1740 160 Gln CA C 54.4 . 1 1741 160 Gln CB C 31.6 . 1 1742 160 Gln CG C 33.7 . 1 1743 160 Gln N N 121.6 . 1 1744 160 Gln NE2 N 112.3 . 1 1745 161 His H H 8.65 . 1 1746 161 His HA H 4.05 . 1 1747 161 His HB2 H 2.59 . 2 1748 161 His HB3 H 2.88 . 2 1749 161 His HD2 H 7.31 . 1 1750 161 His CA C 57.3 . 1 1751 161 His CB C 30.1 . 1 1752 161 His CD2 C 120.5 . 1 1753 161 His N N 122.1 . 1 1754 162 Lys H H 8.48 . 1 1755 162 Lys HA H 4.24 . 1 1756 162 Lys HB2 H 1.70 . 1 1757 162 Lys HB3 H 1.70 . 1 1758 162 Lys HG2 H 1.38 . 1 1759 162 Lys HG3 H 1.38 . 1 1760 162 Lys HD2 H 1.60 . 1 1761 162 Lys HD3 H 1.60 . 1 1762 162 Lys HE2 H 2.96 . 1 1763 162 Lys HE3 H 2.96 . 1 1764 162 Lys CA C 56.7 . 1 1765 162 Lys CB C 33.5 . 1 1766 162 Lys CG C 24.8 . 1 1767 162 Lys CD C 29.2 . 1 1768 162 Lys CE C 41.8 . 1 1769 162 Lys N N 123.6 . 1 1770 163 Glu H H 8.55 . 1 1771 163 Glu HA H 4.39 . 1 1772 163 Glu HB2 H 1.93 . 2 1773 163 Glu HB3 H 2.09 . 2 1774 163 Glu HG2 H 2.20 . 1 1775 163 Glu HG3 H 2.20 . 1 1776 163 Glu CA C 55.9 . 1 1777 163 Glu CB C 31.0 . 1 1778 163 Glu CG C 36.0 . 1 1779 163 Glu N N 119.4 . 1 1780 164 Lys H H 8.44 . 1 1781 164 Lys HA H 4.40 . 1 1782 164 Lys HB2 H 1.72 . 2 1783 164 Lys HB3 H 1.85 . 2 1784 164 Lys HG2 H 1.35 . 2 1785 164 Lys HG3 H 1.43 . 2 1786 164 Lys HD2 H 1.65 . 1 1787 164 Lys HD3 H 1.65 . 1 1788 164 Lys HE2 H 2.95 . 1 1789 164 Lys HE3 H 2.95 . 1 1790 164 Lys CA C 56.3 . 1 1791 164 Lys CB C 32.8 . 1 1792 164 Lys CG C 24.7 . 1 1793 164 Lys CD C 29.1 . 1 1794 164 Lys CE C 41.8 . 1 1795 164 Lys N N 122.0 . 1 1796 165 Cys H H 8.40 . 1 1797 165 Cys HA H 4.42 . 1 1798 165 Cys HB2 H 2.81 . 2 1799 165 Cys HB3 H 2.88 . 2 1800 165 Cys CA C 58.6 . 1 1801 165 Cys CB C 27.8 . 1 1802 165 Cys N N 120.4 . 1 1803 166 Asn H H 8.55 . 1 1804 166 Asn HA H 4.67 . 1 1805 166 Asn HB2 H 2.77 . 2 1806 166 Asn HB3 H 2.83 . 2 1807 166 Asn HD21 H 7.61 . 2 1808 166 Asn HD22 H 6.91 . 2 1809 166 Asn CA C 53.2 . 1 1810 166 Asn CB C 38.6 . 1 1811 166 Asn N N 121.0 . 1 1812 166 Asn ND2 N 112.7 . 1 1813 167 Gln H H 8.36 . 1 1814 167 Gln HA H 4.26 . 1 1815 167 Gln HB2 H 1.94 . 2 1816 167 Gln HB3 H 2.08 . 2 1817 167 Gln HG2 H 2.31 . 1 1818 167 Gln HG3 H 2.31 . 1 1819 167 Gln HE21 H 7.50 . 2 1820 167 Gln HE22 H 6.84 . 2 1821 167 Gln CA C 56.0 . 1 1822 167 Gln CB C 29.2 . 1 1823 167 Gln CG C 33.7 . 1 1824 167 Gln N N 120.6 . 1 1825 167 Gln NE2 N 112.3 . 1 stop_ save_