save_polymer _Saveframe_category monomeric_polymer ############################## # Polymer residue sequence # ############################## _Residue_count 134 _Mol_residue_sequence ; MKILILINTNNDELIKKIKK EVENQGYQVRDVNDSDELKK EMKKLAEEKNFEKILIISND KQLLKEMLELISKLGYKVFL LLQDQDENELEEFKRKIESQ GYEVRKVTDDEEALKIVREF MQKAGSLEHHHHHH ; loop_ _Residue_seq_code _Residue_label 1 MET 2 LYS 3 ILE 4 LEU 5 ILE 6 LEU 7 ILE 8 ASN 9 THR 10 ASN 11 ASN 12 ASP 13 GLU 14 LEU 15 ILE 16 LYS 17 LYS 18 ILE 19 LYS 20 LYS 21 GLU 22 VAL 23 GLU 24 ASN 25 GLN 26 GLY 27 TYR 28 GLN 29 VAL 30 ARG 31 ASP 32 VAL 33 ASN 34 ASP 35 SER 36 ASP 37 GLU 38 LEU 39 LYS 40 LYS 41 GLU 42 MET 43 LYS 44 LYS 45 LEU 46 ALA 47 GLU 48 GLU 49 LYS 50 ASN 51 PHE 52 GLU 53 LYS 54 ILE 55 LEU 56 ILE 57 ILE 58 SER 59 ASN 60 ASP 61 LYS 62 GLN 63 LEU 64 LEU 65 LYS 66 GLU 67 MET 68 LEU 69 GLU 70 LEU 71 ILE 72 SER 73 LYS 74 LEU 75 GLY 76 TYR 77 LYS 78 VAL 79 PHE 80 LEU 81 LEU 82 LEU 83 GLN 84 ASP 85 GLN 86 ASP 87 GLU 88 ASN 89 GLU 90 LEU 91 GLU 92 GLU 93 PHE 94 LYS 95 ARG 96 LYS 97 ILE 98 GLU 99 SER 100 GLN 101 GLY 102 TYR 103 GLU 104 VAL 105 ARG 106 LYS 107 VAL 108 THR 109 ASP 110 ASP 111 GLU 112 GLU 113 ALA 114 LEU 115 LYS 116 ILE 117 VAL 118 ARG 119 GLU 120 PHE 121 MET 122 GLN 123 LYS 124 ALA 125 GLY 126 SER 127 LEU 128 GLU 129 HIS 130 HIS 131 HIS 132 HIS 133 HIS 134 HIS stop_ ################################### # Assigned chemical shift lists # ################################### ################################################################### # Chemical Shift Ambiguity Index Value Definitions # # # # The values other than 1 are used for those atoms with different # # chemical shifts that cannot be assigned to stereospecific atoms # # or to specific residues or chains. # # # # Index Value Definition # # # # 1 Unique (including isolated methyl protons, # # geminal atoms, and geminal methyl # # groups with identical chemical shifts) # # (e.g. ILE HD11, HD12, HD13 protons) # # 2 Ambiguity of geminal atoms or geminal methyl # # proton groups (e.g. ASP HB2 and HB3 # # protons, LEU CD1 and CD2 carbons, or # # LEU HD11, HD12, HD13 and HD21, HD22, # # HD23 methyl protons) # # 3 Aromatic atoms on opposite sides of # # symmetrical rings (e.g. TYR HE1 and HE2 # # protons) # # 4 Intraresidue ambiguities (e.g. LYS HG and # # HD protons or TRP HZ2 and HZ3 protons) # # 5 Interresidue ambiguities (LYS 12 vs. LYS 27) # # 6 Intermolecular ambiguities (e.g. ASP 31 CA # # in monomer 1 and ASP 31 CA in monomer 2 # # of an asymmetrical homodimer, duplex # # DNA assignments, or other assignments # # that may apply to atoms in one or more # # molecule in the molecular assembly) # # 9 Ambiguous, specific ambiguity not defined # # # ################################################################### save_shift_set_1 _Saveframe_category assigned_chemical_shifts loop_ _Atom_shift_assign_ID _Residue_author_seq_code _Residue_seq_code _Residue_label _Atom_name _Atom_type _Chem_shift_value _Chem_shift_value_error _Chem_shift_ambiguity_type 1 1 1 MET CA C 54.500 0.400 1 2 1 1 MET HA H 4.118 0.020 1 3 1 1 MET CB C 33.173 0.400 1 4 1 1 MET HB2 H 2.030 0.020 2 5 1 1 MET HB3 H 2.198 0.020 2 6 1 1 MET CG C 30.985 0.400 1 7 1 1 MET HG2 H 2.429 0.020 2 8 1 1 MET HG3 H 2.602 0.020 2 9 2 2 LYS CG C 25.517 0.400 1 10 2 2 LYS HG2 H 1.068 0.020 2 11 2 2 LYS HG3 H 1.035 0.020 2 12 2 2 LYS CD C 28.798 0.400 1 13 2 2 LYS HD2 H 1.261 0.020 2 14 2 2 LYS HD3 H 0.960 0.020 2 15 2 2 LYS CE C 42.469 0.400 1 16 2 2 LYS HE2 H 2.758 0.020 2 17 2 2 LYS HE3 H 2.881 0.020 2 18 3 3 ILE H H 8.444 0.020 1 19 3 3 ILE CA C 59.556 0.400 1 20 3 3 ILE HA H 4.826 0.020 1 21 3 3 ILE CB C 40.508 0.400 1 22 3 3 ILE HB H 1.806 0.020 1 23 3 3 ILE CG2 C 17.852 0.400 1 24 3 3 ILE HG21 H 1.077 0.020 1 25 3 3 ILE HG22 H 1.077 0.020 1 26 3 3 ILE HG23 H 1.077 0.020 1 27 3 3 ILE CG1 C 27.378 0.400 1 28 3 3 ILE HG12 H 1.561 0.020 2 29 3 3 ILE HG13 H 1.222 0.020 2 30 3 3 ILE CD1 C 13.477 0.400 1 31 3 3 ILE HD11 H 0.969 0.020 1 32 3 3 ILE HD12 H 0.969 0.020 1 33 3 3 ILE HD13 H 0.969 0.020 1 34 3 3 ILE C C 173.405 0.400 1 35 4 4 LEU N N 127.785 0.400 1 36 4 4 LEU H H 9.081 0.020 1 37 4 4 LEU CA C 53.341 0.400 1 38 4 4 LEU HA H 5.459 0.020 1 39 4 4 LEU CB C 45.313 0.400 1 40 4 4 LEU HB2 H 1.437 0.020 1 41 4 4 LEU HB3 H 1.437 0.020 1 42 4 4 LEU CG C 28.192 0.400 1 43 4 4 LEU HG H 1.451 0.020 1 44 4 4 LEU CD1 C 25.457 0.400 1 45 4 4 LEU HD11 H 0.642 0.020 2 46 4 4 LEU HD12 H 0.642 0.020 2 47 4 4 LEU HD13 H 0.642 0.020 2 48 4 4 LEU CD2 C 25.983 0.400 1 49 4 4 LEU HD21 H 0.678 0.020 2 50 4 4 LEU HD22 H 0.678 0.020 2 51 4 4 LEU HD23 H 0.678 0.020 2 52 4 4 LEU C C 174.832 0.400 1 53 5 5 ILE N N 123.010 0.400 1 54 5 5 ILE H H 8.765 0.020 1 55 5 5 ILE CA C 60.544 0.400 1 56 5 5 ILE HA H 4.833 0.020 1 57 5 5 ILE CB C 39.532 0.400 1 58 5 5 ILE HB H 1.646 0.020 1 59 5 5 ILE CG2 C 17.116 0.400 1 60 5 5 ILE HG21 H 0.841 0.020 1 61 5 5 ILE HG22 H 0.841 0.020 1 62 5 5 ILE HG23 H 0.841 0.020 1 63 5 5 ILE CG1 C 27.650 0.400 1 64 5 5 ILE HG12 H 1.807 0.020 2 65 5 5 ILE HG13 H 0.846 0.020 2 66 5 5 ILE CD1 C 13.410 0.400 1 67 5 5 ILE HD11 H 0.624 0.020 1 68 5 5 ILE HD12 H 0.624 0.020 1 69 5 5 ILE HD13 H 0.624 0.020 1 70 5 5 ILE C C 173.357 0.400 1 71 6 6 LEU N N 129.320 0.400 1 72 6 6 LEU H H 9.235 0.020 1 73 6 6 LEU CA C 53.000 0.400 1 74 6 6 LEU HA H 5.346 0.020 1 75 6 6 LEU CB C 44.528 0.400 1 76 6 6 LEU HB2 H 1.508 0.020 2 77 6 6 LEU HB3 H 1.458 0.020 2 78 6 6 LEU CG C 27.906 0.400 1 79 6 6 LEU HG H 1.520 0.020 1 80 6 6 LEU CD1 C 25.511 0.400 1 81 6 6 LEU HD11 H 0.715 0.020 2 82 6 6 LEU HD12 H 0.715 0.020 2 83 6 6 LEU HD13 H 0.715 0.020 2 84 6 6 LEU CD2 C 25.367 0.400 1 85 6 6 LEU HD21 H 0.735 0.020 2 86 6 6 LEU HD22 H 0.735 0.020 2 87 6 6 LEU HD23 H 0.735 0.020 2 88 6 6 LEU C C 174.795 0.400 1 89 7 7 ILE N N 120.746 0.400 1 90 7 7 ILE H H 8.931 0.020 1 91 7 7 ILE CA C 58.215 0.400 1 92 7 7 ILE HA H 5.181 0.020 1 93 7 7 ILE CB C 40.154 0.400 1 94 7 7 ILE HB H 1.892 0.020 1 95 7 7 ILE CG2 C 16.613 0.400 1 96 7 7 ILE HG21 H 0.744 0.020 1 97 7 7 ILE HG22 H 0.744 0.020 1 98 7 7 ILE HG23 H 0.744 0.020 1 99 7 7 ILE CG1 C 27.098 0.400 1 100 7 7 ILE HG12 H 1.459 0.020 2 101 7 7 ILE HG13 H 1.253 0.020 2 102 7 7 ILE CD1 C 14.164 0.400 1 103 7 7 ILE HD11 H 0.767 0.020 1 104 7 7 ILE HD12 H 0.767 0.020 1 105 7 7 ILE HD13 H 0.767 0.020 1 106 7 7 ILE C C 173.819 0.400 1 107 8 8 ASN N N 125.539 0.400 1 108 8 8 ASN H H 8.634 0.020 1 109 8 8 ASN CA C 51.104 0.400 1 110 8 8 ASN HA H 5.902 0.020 1 111 8 8 ASN CB C 42.582 0.400 1 112 8 8 ASN HB2 H 2.891 0.020 2 113 8 8 ASN HB3 H 2.273 0.020 2 114 8 8 ASN ND2 N 107.513 0.400 1 115 8 8 ASN HD21 H 7.368 0.020 2 116 8 8 ASN HD22 H 6.251 0.020 2 117 8 8 ASN C C 176.478 0.400 1 118 9 9 THR N N 118.493 0.400 1 119 9 9 THR H H 8.044 0.020 1 120 9 9 THR CA C 60.689 0.400 1 121 9 9 THR HA H 4.739 0.020 1 122 9 9 THR CB C 67.766 0.400 1 123 9 9 THR HB H 4.321 0.020 1 124 9 9 THR HG1 H 6.178 0.020 1 125 9 9 THR CG2 C 19.209 0.400 1 126 9 9 THR HG21 H 0.863 0.020 1 127 9 9 THR HG22 H 0.863 0.020 1 128 9 9 THR HG23 H 0.863 0.020 1 129 9 9 THR C C 170.114 0.400 1 130 10 10 ASN N N 123.266 0.400 1 131 10 10 ASN H H 8.440 0.020 1 132 10 10 ASN CA C 51.844 0.400 1 133 10 10 ASN HA H 4.967 0.020 1 134 10 10 ASN CB C 39.316 0.400 1 135 10 10 ASN HB2 H 2.906 0.020 2 136 10 10 ASN HB3 H 2.817 0.020 2 137 10 10 ASN ND2 N 111.462 0.400 1 138 10 10 ASN HD21 H 7.641 0.020 2 139 10 10 ASN HD22 H 6.927 0.020 2 140 10 10 ASN C C 174.601 0.400 1 141 11 11 ASN N N 120.920 0.400 1 142 11 11 ASN H H 8.366 0.020 1 143 11 11 ASN CA C 52.436 0.400 1 144 11 11 ASN HA H 4.693 0.020 1 145 11 11 ASN CB C 38.349 0.400 1 146 11 11 ASN HB2 H 3.027 0.020 2 147 11 11 ASN HB3 H 2.744 0.020 2 148 11 11 ASN ND2 N 114.074 0.400 1 149 11 11 ASN HD21 H 7.334 0.020 1 150 11 11 ASN HD22 H 7.335 0.020 1 151 11 11 ASN C C 174.333 0.400 1 152 12 12 ASP N N 126.315 0.400 1 153 12 12 ASP H H 8.586 0.020 1 154 12 12 ASP CA C 57.608 0.400 1 155 12 12 ASP HA H 4.273 0.020 1 156 12 12 ASP CB C 41.161 0.400 1 157 12 12 ASP HB2 H 2.642 0.020 1 158 12 12 ASP HB3 H 2.642 0.020 1 159 12 12 ASP C C 178.089 0.400 1 160 13 13 GLU N N 119.325 0.400 1 161 13 13 GLU H H 8.289 0.020 1 162 13 13 GLU CA C 59.006 0.400 1 163 13 13 GLU HA H 4.026 0.020 1 164 13 13 GLU CB C 28.709 0.400 1 165 13 13 GLU HB2 H 2.064 0.020 2 166 13 13 GLU HB3 H 2.160 0.020 2 167 13 13 GLU CG C 36.010 0.400 1 168 13 13 GLU HG2 H 2.361 0.020 2 169 13 13 GLU HG3 H 2.310 0.020 2 170 13 13 GLU C C 178.893 0.400 1 171 14 14 LEU N N 121.683 0.400 1 172 14 14 LEU H H 7.577 0.020 1 173 14 14 LEU CA C 57.261 0.400 1 174 14 14 LEU HA H 3.985 0.020 1 175 14 14 LEU CB C 40.105 0.400 1 176 14 14 LEU HB2 H 1.823 0.020 2 177 14 14 LEU HB3 H 1.498 0.020 2 178 14 14 LEU CG C 27.050 0.400 1 179 14 14 LEU HG H 1.378 0.020 1 180 14 14 LEU CD1 C 22.485 0.400 1 181 14 14 LEU HD11 H 0.859 0.020 2 182 14 14 LEU HD12 H 0.859 0.020 2 183 14 14 LEU HD13 H 0.859 0.020 2 184 14 14 LEU CD2 C 24.529 0.400 1 185 14 14 LEU HD21 H 0.763 0.020 2 186 14 14 LEU HD22 H 0.763 0.020 2 187 14 14 LEU HD23 H 0.763 0.020 2 188 14 14 LEU C C 178.309 0.400 1 189 15 15 ILE N N 119.483 0.400 1 190 15 15 ILE H H 8.238 0.020 1 191 15 15 ILE CA C 66.590 0.400 1 192 15 15 ILE HA H 3.219 0.020 1 193 15 15 ILE CB C 37.424 0.400 1 194 15 15 ILE HB H 1.915 0.020 1 195 15 15 ILE CG2 C 17.078 0.400 1 196 15 15 ILE HG21 H 0.847 0.020 1 197 15 15 ILE HG22 H 0.847 0.020 1 198 15 15 ILE HG23 H 0.847 0.020 1 199 15 15 ILE CG1 C 30.331 0.400 1 200 15 15 ILE HG12 H 1.726 0.020 2 201 15 15 ILE HG13 H 0.636 0.020 2 202 15 15 ILE CD1 C 13.066 0.400 1 203 15 15 ILE HD11 H 0.764 0.020 1 204 15 15 ILE HD12 H 0.764 0.020 1 205 15 15 ILE HD13 H 0.764 0.020 1 206 15 15 ILE C C 177.138 0.400 1 207 16 16 LYS N N 117.596 0.400 1 208 16 16 LYS H H 7.604 0.020 1 209 16 16 LYS CA C 60.169 0.400 1 210 16 16 LYS HA H 3.843 0.020 1 211 16 16 LYS CB C 32.164 0.400 1 212 16 16 LYS HB2 H 1.880 0.020 1 213 16 16 LYS HB3 H 1.881 0.020 1 214 16 16 LYS CG C 25.305 0.400 1 215 16 16 LYS HG2 H 1.627 0.020 2 216 16 16 LYS HG3 H 1.396 0.020 2 217 16 16 LYS CD C 29.236 0.400 1 218 16 16 LYS HD2 H 1.685 0.020 2 219 16 16 LYS HD3 H 1.688 0.020 2 220 16 16 LYS CE C 41.780 0.400 1 221 16 16 LYS HE2 H 2.910 0.020 1 222 16 16 LYS HE3 H 2.910 0.020 1 223 16 16 LYS C C 179.577 0.400 1 224 17 17 LYS N N 118.832 0.400 1 225 17 17 LYS H H 7.583 0.020 1 226 17 17 LYS CA C 59.840 0.400 1 227 17 17 LYS HA H 3.992 0.020 1 228 17 17 LYS CB C 33.065 0.400 1 229 17 17 LYS HB2 H 1.993 0.020 2 230 17 17 LYS HB3 H 1.922 0.020 2 231 17 17 LYS CG C 25.822 0.400 1 232 17 17 LYS HG2 H 1.755 0.020 2 233 17 17 LYS HG3 H 1.429 0.020 2 234 17 17 LYS CD C 29.705 0.400 1 235 17 17 LYS HD2 H 1.680 0.020 2 236 17 17 LYS HD3 H 1.517 0.020 2 237 17 17 LYS CE C 41.780 0.400 1 238 17 17 LYS HE2 H 2.848 0.020 2 239 17 17 LYS HE3 H 2.900 0.020 2 240 17 17 LYS C C 179.380 0.400 1 241 18 18 ILE N N 120.961 0.400 1 242 18 18 ILE H H 8.785 0.020 1 243 18 18 ILE CA C 65.474 0.400 1 244 18 18 ILE HA H 3.372 0.020 1 245 18 18 ILE CB C 37.556 0.400 1 246 18 18 ILE HB H 1.821 0.020 1 247 18 18 ILE CG2 C 17.360 0.400 1 248 18 18 ILE HG21 H 0.718 0.020 1 249 18 18 ILE HG22 H 0.718 0.020 1 250 18 18 ILE HG23 H 0.718 0.020 1 251 18 18 ILE CG1 C 29.494 0.400 1 252 18 18 ILE HG12 H 1.765 0.020 2 253 18 18 ILE HG13 H 0.729 0.020 2 254 18 18 ILE CD1 C 13.410 0.400 1 255 18 18 ILE HD11 H 0.613 0.020 1 256 18 18 ILE HD12 H 0.613 0.020 1 257 18 18 ILE HD13 H 0.613 0.020 1 258 18 18 ILE C C 176.967 0.400 1 259 19 19 LYS N N 118.324 0.400 1 260 19 19 LYS H H 8.532 0.020 1 261 19 19 LYS CA C 60.853 0.400 1 262 19 19 LYS HA H 3.680 0.020 1 263 19 19 LYS CB C 32.326 0.400 1 264 19 19 LYS HB2 H 1.788 0.020 2 265 19 19 LYS HB3 H 1.834 0.020 2 266 19 19 LYS CG C 27.091 0.400 1 267 19 19 LYS HG2 H 1.098 0.020 2 268 19 19 LYS HG3 H 1.596 0.020 2 269 19 19 LYS CD C 29.871 0.400 1 270 19 19 LYS HD2 H 1.594 0.020 1 271 19 19 LYS HD3 H 1.594 0.020 1 272 19 19 LYS CE C 41.780 0.400 1 273 19 19 LYS HE2 H 2.699 0.020 1 274 19 19 LYS HE3 H 2.699 0.020 1 275 19 19 LYS C C 177.746 0.400 1 276 20 20 LYS N N 116.284 0.400 1 277 20 20 LYS H H 7.303 0.020 1 278 20 20 LYS CA C 58.539 0.400 1 279 20 20 LYS HA H 4.087 0.020 1 280 20 20 LYS CB C 31.981 0.400 1 281 20 20 LYS HB2 H 1.890 0.020 1 282 20 20 LYS HB3 H 1.890 0.020 1 283 20 20 LYS CG C 24.444 0.400 1 284 20 20 LYS HG2 H 1.506 0.020 2 285 20 20 LYS HG3 H 1.476 0.020 2 286 20 20 LYS CD C 28.780 0.400 1 287 20 20 LYS HD2 H 1.687 0.020 1 288 20 20 LYS HD3 H 1.686 0.020 1 289 20 20 LYS CE C 41.780 0.400 1 290 20 20 LYS HE2 H 2.964 0.020 1 291 20 20 LYS HE3 H 2.964 0.020 1 292 20 20 LYS C C 178.406 0.400 1 293 21 21 GLU N N 118.488 0.400 1 294 21 21 GLU H H 7.665 0.020 1 295 21 21 GLU CA C 58.894 0.400 1 296 21 21 GLU HA H 3.963 0.020 1 297 21 21 GLU CB C 29.434 0.400 1 298 21 21 GLU HB2 H 2.116 0.020 2 299 21 21 GLU HB3 H 1.973 0.020 2 300 21 21 GLU CG C 35.314 0.400 1 301 21 21 GLU HG2 H 2.106 0.020 2 302 21 21 GLU HG3 H 2.104 0.020 2 303 21 21 GLU C C 179.088 0.400 1 304 22 22 VAL N N 109.032 0.400 1 305 22 22 VAL H H 8.037 0.020 1 306 22 22 VAL CA C 62.799 0.400 1 307 22 22 VAL HA H 4.132 0.020 1 308 22 22 VAL CB C 29.829 0.400 1 309 22 22 VAL HB H 1.984 0.020 1 310 22 22 VAL CG1 C 20.110 0.400 1 311 22 22 VAL HG11 H 0.638 0.020 2 312 22 22 VAL HG12 H 0.638 0.020 2 313 22 22 VAL HG13 H 0.638 0.020 2 314 22 22 VAL CG2 C 19.942 0.400 1 315 22 22 VAL HG21 H 0.854 0.020 2 316 22 22 VAL HG22 H 0.854 0.020 2 317 22 22 VAL HG23 H 0.854 0.020 2 318 24 24 ASN CA C 58.808 0.400 1 319 24 24 ASN HA H 4.717 0.020 1 320 24 24 ASN CB C 38.171 0.400 1 321 24 24 ASN HB2 H 2.967 0.020 1 322 24 24 ASN HB3 H 2.967 0.020 1 323 24 24 ASN ND2 N 112.830 0.400 1 324 24 24 ASN HD21 H 7.693 0.020 2 325 24 24 ASN HD22 H 6.941 0.020 2 326 25 25 GLN HA H 4.646 0.020 1 327 25 25 GLN CB C 29.018 0.400 1 328 25 25 GLN HB2 H 2.021 0.020 2 329 25 25 GLN HB3 H 2.815 0.020 2 330 25 25 GLN CG C 33.393 0.400 1 331 25 25 GLN HG2 H 2.383 0.020 2 332 25 25 GLN HG3 H 2.518 0.020 2 333 25 25 GLN NE2 N 112.873 0.400 1 334 25 25 GLN HE21 H 7.563 0.020 2 335 25 25 GLN HE22 H 6.876 0.020 2 336 25 25 GLN C C 175.692 0.400 1 337 26 26 GLY N N 106.368 0.400 1 338 26 26 GLY H H 8.020 0.020 1 339 26 26 GLY CA C 45.957 0.400 1 340 26 26 GLY HA2 H 3.815 0.020 2 341 26 26 GLY HA3 H 4.126 0.020 2 342 26 26 GLY C C 174.382 0.400 1 343 27 27 TYR N N 119.082 0.400 1 344 27 27 TYR H H 7.845 0.020 1 345 27 27 TYR CA C 58.054 0.400 1 346 27 27 TYR HA H 4.433 0.020 1 347 27 27 TYR CB C 39.005 0.400 1 348 27 27 TYR HB2 H 2.663 0.020 2 349 27 27 TYR HB3 H 2.372 0.020 2 350 27 27 TYR CD1 C 132.650 0.400 1 351 27 27 TYR HD1 H 6.787 0.020 1 352 27 27 TYR CE1 C 117.793 0.400 1 353 27 27 TYR HE1 H 6.586 0.020 1 354 27 27 TYR CE2 C 117.910 0.400 1 355 27 27 TYR HE2 H 6.586 0.020 1 356 27 27 TYR CD2 C 132.816 0.400 1 357 27 27 TYR HD2 H 6.787 0.020 1 358 27 27 TYR C C 174.528 0.400 1 359 28 28 GLN N N 120.362 0.400 1 360 28 28 GLN H H 8.338 0.020 1 361 28 28 GLN CA C 54.380 0.400 1 362 28 28 GLN HA H 4.499 0.020 1 363 28 28 GLN CB C 30.455 0.400 1 364 28 28 GLN HB2 H 2.062 0.020 2 365 28 28 GLN HB3 H 1.783 0.020 2 366 28 28 GLN CG C 33.720 0.400 1 367 28 28 GLN HG2 H 2.239 0.020 2 368 28 28 GLN HG3 H 2.202 0.020 2 369 28 28 GLN NE2 N 113.892 0.400 1 370 28 28 GLN HE21 H 7.522 0.020 2 371 28 28 GLN HE22 H 7.013 0.020 2 372 28 28 GLN C C 174.625 0.400 1 373 29 29 VAL N N 123.482 0.400 1 374 29 29 VAL H H 8.776 0.020 1 375 29 29 VAL CA C 61.488 0.400 1 376 29 29 VAL HA H 5.043 0.020 1 377 29 29 VAL CB C 32.473 0.400 1 378 29 29 VAL HB H 1.953 0.020 1 379 29 29 VAL CG1 C 21.461 0.400 1 380 29 29 VAL HG11 H 0.800 0.020 2 381 29 29 VAL HG12 H 0.800 0.020 2 382 29 29 VAL HG13 H 0.800 0.020 2 383 29 29 VAL CG2 C 21.871 0.400 1 384 29 29 VAL HG21 H 0.896 0.020 2 385 29 29 VAL HG22 H 0.896 0.020 2 386 29 29 VAL HG23 H 0.896 0.020 2 387 29 29 VAL C C 175.820 0.400 1 388 30 30 ARG N N 127.787 0.400 1 389 30 30 ARG H H 9.135 0.020 1 390 30 30 ARG CA C 53.788 0.400 1 391 30 30 ARG HA H 4.740 0.020 1 392 30 30 ARG CB C 32.391 0.400 1 393 30 30 ARG HB2 H 1.654 0.020 2 394 30 30 ARG HB3 H 1.514 0.020 2 395 30 30 ARG CG C 26.702 0.400 1 396 30 30 ARG HG2 H 1.497 0.020 2 397 30 30 ARG HG3 H 1.452 0.020 2 398 30 30 ARG CD C 42.856 0.400 1 399 30 30 ARG HD2 H 3.333 0.020 2 400 30 30 ARG HD3 H 2.933 0.020 2 401 30 30 ARG C C 173.332 0.400 1 402 31 31 ASP N N 121.895 0.400 1 403 31 31 ASP H H 8.377 0.020 1 404 31 31 ASP CA C 53.370 0.400 1 405 31 31 ASP HA H 5.210 0.020 1 406 31 31 ASP CB C 42.722 0.400 1 407 31 31 ASP HB2 H 2.467 0.020 1 408 31 31 ASP HB3 H 2.468 0.020 1 409 31 31 ASP C C 175.282 0.400 1 410 32 32 VAL N N 120.426 0.400 1 411 32 32 VAL H H 8.441 0.020 1 412 32 32 VAL CA C 61.557 0.400 1 413 32 32 VAL HA H 4.248 0.020 1 414 32 32 VAL CB C 33.884 0.400 1 415 32 32 VAL HB H 1.776 0.020 1 416 32 32 VAL CG1 C 21.735 0.400 1 417 32 32 VAL HG11 H 0.867 0.020 2 418 32 32 VAL HG12 H 0.867 0.020 2 419 32 32 VAL HG13 H 0.867 0.020 2 420 32 32 VAL CG2 C 21.142 0.400 1 421 32 32 VAL HG21 H 0.763 0.020 2 422 32 32 VAL HG22 H 0.763 0.020 2 423 32 32 VAL HG23 H 0.763 0.020 2 424 32 32 VAL C C 174.114 0.400 1 425 33 33 ASN N N 122.700 0.400 1 426 33 33 ASN H H 9.550 0.020 1 427 33 33 ASN CA C 53.396 0.400 1 428 33 33 ASN HA H 4.977 0.020 1 429 33 33 ASN CB C 40.869 0.400 1 430 33 33 ASN HB2 H 2.910 0.020 2 431 33 33 ASN HB3 H 2.689 0.020 2 432 33 33 ASN ND2 N 114.609 0.400 1 433 33 33 ASN HD21 H 7.938 0.020 2 434 33 33 ASN HD22 H 7.020 0.020 2 435 33 33 ASN C C 174.235 0.400 1 436 34 34 ASP N N 114.885 0.400 1 437 34 34 ASP H H 7.616 0.020 1 438 34 34 ASP CA C 53.483 0.400 1 439 34 34 ASP HA H 4.703 0.020 1 440 34 34 ASP CB C 42.396 0.400 1 441 34 34 ASP HB2 H 2.909 0.020 2 442 34 34 ASP HB3 H 3.086 0.020 2 443 34 34 ASP C C 175.626 0.400 1 444 35 35 SER N N 114.381 0.400 1 445 35 35 SER H H 8.869 0.020 1 446 35 35 SER CA C 61.446 0.400 1 447 35 35 SER HA H 4.046 0.020 1 448 35 35 SER CB C 62.764 0.400 1 449 35 35 SER HB2 H 3.919 0.020 2 450 35 35 SER HB3 H 3.949 0.020 2 451 35 35 SER C C 175.991 0.400 1 452 36 36 ASP N N 124.695 0.400 1 453 36 36 ASP H H 8.388 0.020 1 454 36 36 ASP CA C 57.668 0.400 1 455 36 36 ASP HA H 4.519 0.020 1 456 36 36 ASP CB C 40.284 0.400 1 457 36 36 ASP HB2 H 2.842 0.020 2 458 36 36 ASP HB3 H 2.662 0.020 2 459 36 36 ASP C C 179.136 0.400 1 460 37 37 GLU N N 122.449 0.400 1 461 37 37 GLU H H 9.009 0.020 1 462 37 37 GLU CA C 59.209 0.400 1 463 37 37 GLU HA H 4.059 0.020 1 464 37 37 GLU CB C 29.721 0.400 1 465 37 37 GLU HB2 H 2.269 0.020 2 466 37 37 GLU HB3 H 2.175 0.020 2 467 37 37 GLU CG C 36.545 0.400 1 468 37 37 GLU HG2 H 2.442 0.020 2 469 37 37 GLU HG3 H 2.728 0.020 2 470 37 37 GLU C C 178.698 0.400 1 471 38 38 LEU N N 119.580 0.400 1 472 38 38 LEU H H 8.203 0.020 1 473 38 38 LEU CA C 59.133 0.400 1 474 38 38 LEU HA H 3.911 0.020 1 475 38 38 LEU CB C 41.069 0.400 1 476 38 38 LEU HB2 H 2.114 0.020 2 477 38 38 LEU HB3 H 1.461 0.020 2 478 38 38 LEU CG C 27.177 0.400 1 479 38 38 LEU HG H 1.521 0.020 1 480 38 38 LEU CD1 C 25.761 0.400 1 481 38 38 LEU HD11 H 0.962 0.020 2 482 38 38 LEU HD12 H 0.962 0.020 2 483 38 38 LEU HD13 H 0.962 0.020 2 484 38 38 LEU CD2 C 25.562 0.400 1 485 38 38 LEU HD21 H 0.889 0.020 2 486 38 38 LEU HD22 H 0.889 0.020 2 487 38 38 LEU HD23 H 0.889 0.020 2 488 38 38 LEU C C 177.649 0.400 1 489 39 39 LYS N N 118.404 0.400 1 490 39 39 LYS H H 7.829 0.020 1 491 39 39 LYS CA C 59.866 0.400 1 492 39 39 LYS HA H 3.841 0.020 1 493 39 39 LYS CB C 32.048 0.400 1 494 39 39 LYS HB2 H 1.934 0.020 2 495 39 39 LYS HB3 H 1.948 0.020 2 496 39 39 LYS CG C 25.419 0.400 1 497 39 39 LYS HG2 H 1.457 0.020 2 498 39 39 LYS HG3 H 1.698 0.020 2 499 39 39 LYS CD C 29.306 0.400 1 500 39 39 LYS HD2 H 1.705 0.020 1 501 39 39 LYS HD3 H 1.704 0.020 1 502 39 39 LYS CE C 41.780 0.400 1 503 39 39 LYS HE2 H 2.979 0.020 2 504 39 39 LYS HE3 H 2.981 0.020 2 505 39 39 LYS C C 179.577 0.400 1 506 40 40 LYS N N 119.271 0.400 1 507 40 40 LYS H H 7.779 0.020 1 508 40 40 LYS CA C 59.590 0.400 1 509 40 40 LYS HA H 4.022 0.020 1 510 40 40 LYS CB C 32.400 0.400 1 511 40 40 LYS HB2 H 1.990 0.020 2 512 40 40 LYS HB3 H 1.945 0.020 2 513 40 40 LYS CG C 24.982 0.400 1 514 40 40 LYS HG2 H 1.379 0.020 2 515 40 40 LYS HG3 H 1.620 0.020 2 516 40 40 LYS CD C 29.333 0.400 1 517 40 40 LYS HD2 H 1.681 0.020 1 518 40 40 LYS HD3 H 1.680 0.020 1 519 40 40 LYS CE C 41.780 0.400 1 520 40 40 LYS HE2 H 2.968 0.020 2 521 40 40 LYS HE3 H 2.966 0.020 2 522 40 40 LYS C C 179.577 0.400 1 523 41 41 GLU N N 119.647 0.400 1 524 41 41 GLU H H 8.721 0.020 1 525 41 41 GLU CA C 58.074 0.400 1 526 41 41 GLU HA H 4.263 0.020 1 527 41 41 GLU CB C 28.246 0.400 1 528 41 41 GLU HB2 H 1.950 0.020 1 529 41 41 GLU HB3 H 1.949 0.020 1 530 41 41 GLU CG C 34.904 0.400 1 531 41 41 GLU HG2 H 2.133 0.020 2 532 41 41 GLU HG3 H 2.459 0.020 2 533 41 41 GLU C C 179.504 0.400 1 534 42 42 MET N N 118.114 0.400 1 535 42 42 MET H H 8.779 0.020 1 536 42 42 MET CA C 57.054 0.400 1 537 42 42 MET HA H 4.383 0.020 1 538 42 42 MET CB C 31.254 0.400 1 539 42 42 MET HB2 H 2.191 0.020 2 540 42 42 MET HB3 H 1.950 0.020 2 541 42 42 MET CG C 32.468 0.400 1 542 42 42 MET HG2 H 2.656 0.020 2 543 42 42 MET HG3 H 2.761 0.020 2 544 42 42 MET CE C 17.857 0.400 1 545 42 42 MET HE1 H 1.866 0.020 1 546 42 42 MET HE2 H 1.866 0.020 1 547 42 42 MET HE3 H 1.866 0.020 1 548 42 42 MET C C 179.185 0.400 1 549 43 43 LYS N N 120.740 0.400 1 550 43 43 LYS H H 7.499 0.020 1 551 43 43 LYS CA C 59.390 0.400 1 552 43 43 LYS HA H 4.088 0.020 1 553 43 43 LYS CB C 31.962 0.400 1 554 43 43 LYS HB2 H 1.907 0.020 2 555 43 43 LYS HB3 H 1.901 0.020 2 556 43 43 LYS CG C 24.910 0.400 1 557 43 43 LYS HG2 H 1.513 0.020 2 558 43 43 LYS HG3 H 1.370 0.020 2 559 43 43 LYS CD C 28.780 0.400 1 560 43 43 LYS HD2 H 1.678 0.020 2 561 43 43 LYS HD3 H 1.683 0.020 2 562 43 43 LYS CE C 41.780 0.400 1 563 43 43 LYS HE2 H 2.980 0.020 2 564 43 43 LYS HE3 H 2.975 0.020 2 565 43 43 LYS C C 178.187 0.400 1 566 44 44 LYS N N 118.269 0.400 1 567 44 44 LYS H H 7.445 0.020 1 568 44 44 LYS CA C 59.500 0.400 1 569 44 44 LYS HA H 4.061 0.020 1 570 44 44 LYS CB C 32.070 0.400 1 571 44 44 LYS HB2 H 1.911 0.020 2 572 44 44 LYS HB3 H 1.906 0.020 2 573 44 44 LYS CG C 24.910 0.400 1 574 44 44 LYS HG2 H 1.582 0.020 2 575 44 44 LYS HG3 H 1.438 0.020 2 576 44 44 LYS CD C 29.133 0.400 1 577 44 44 LYS HD2 H 1.700 0.020 2 578 44 44 LYS HD3 H 1.702 0.020 2 579 44 44 LYS CE C 41.780 0.400 1 580 44 44 LYS HE2 H 2.930 0.020 1 581 44 44 LYS HE3 H 2.930 0.020 1 582 44 44 LYS C C 179.601 0.400 1 583 45 45 LEU N N 117.785 0.400 1 584 45 45 LEU H H 8.161 0.020 1 585 45 45 LEU CA C 57.187 0.400 1 586 45 45 LEU HA H 4.148 0.020 1 587 45 45 LEU CB C 41.773 0.400 1 588 45 45 LEU HB2 H 1.904 0.020 2 589 45 45 LEU HB3 H 1.486 0.020 2 590 45 45 LEU CG C 26.770 0.400 1 591 45 45 LEU HG H 1.882 0.020 1 592 45 45 LEU CD1 C 25.491 0.400 1 593 45 45 LEU HD11 H 0.754 0.020 2 594 45 45 LEU HD12 H 0.754 0.020 2 595 45 45 LEU HD13 H 0.754 0.020 2 596 45 45 LEU CD2 C 23.696 0.400 1 597 45 45 LEU HD21 H 0.725 0.020 2 598 45 45 LEU HD22 H 0.725 0.020 2 599 45 45 LEU HD23 H 0.725 0.020 2 600 45 45 LEU C C 178.357 0.400 1 601 46 46 ALA N N 118.538 0.400 1 602 46 46 ALA H H 7.637 0.020 1 603 46 46 ALA CA C 53.672 0.400 1 604 46 46 ALA HA H 4.252 0.020 1 605 46 46 ALA CB C 18.882 0.400 1 606 46 46 ALA HB1 H 1.550 0.020 1 607 46 46 ALA HB2 H 1.550 0.020 1 608 46 46 ALA HB3 H 1.550 0.020 1 609 46 46 ALA C C 178.893 0.400 1 610 47 47 GLU N N 115.492 0.400 1 611 47 47 GLU H H 7.713 0.020 1 612 47 47 GLU CA C 56.931 0.400 1 613 47 47 GLU HA H 4.250 0.020 1 614 47 47 GLU CB C 30.417 0.400 1 615 47 47 GLU HB2 H 2.056 0.020 2 616 47 47 GLU HB3 H 2.110 0.020 2 617 47 47 GLU CG C 36.271 0.400 1 618 47 47 GLU HG2 H 2.295 0.020 2 619 47 47 GLU HG3 H 2.500 0.020 2 620 47 47 GLU C C 176.478 0.400 1 621 48 48 GLU N N 120.573 0.400 1 622 48 48 GLU H H 7.748 0.020 1 623 48 48 GLU CA C 56.021 0.400 1 624 48 48 GLU HA H 4.373 0.020 1 625 48 48 GLU CB C 29.910 0.400 1 626 48 48 GLU HB2 H 2.040 0.020 1 627 48 48 GLU HB3 H 2.040 0.020 1 628 48 48 GLU CG C 36.010 0.400 1 629 48 48 GLU HG2 H 2.202 0.020 2 630 48 48 GLU HG3 H 2.319 0.020 2 631 48 48 GLU C C 173.624 0.400 1 632 49 49 LYS N N 124.420 0.400 1 633 49 49 LYS H H 8.607 0.020 1 634 49 49 LYS CA C 56.517 0.400 1 635 49 49 LYS HA H 4.318 0.020 1 636 49 49 LYS CB C 32.462 0.400 1 637 49 49 LYS HB2 H 1.899 0.020 2 638 49 49 LYS HB3 H 1.755 0.020 2 639 49 49 LYS CG C 24.653 0.400 1 640 49 49 LYS HG2 H 1.458 0.020 1 641 49 49 LYS HG3 H 1.458 0.020 1 642 49 49 LYS CD C 28.780 0.400 1 643 49 49 LYS HD2 H 1.653 0.020 1 644 49 49 LYS HD3 H 1.653 0.020 1 645 49 49 LYS CE C 41.780 0.400 1 646 49 49 LYS HE2 H 3.015 0.020 1 647 49 49 LYS HE3 H 3.015 0.020 1 648 49 49 LYS C C 176.843 0.400 1 649 50 50 ASN N N 117.993 0.400 1 650 50 50 ASN H H 8.723 0.020 1 651 50 50 ASN CA C 53.555 0.400 1 652 50 50 ASN HA H 4.624 0.020 1 653 50 50 ASN CB C 39.036 0.400 1 654 50 50 ASN HB2 H 2.706 0.020 1 655 50 50 ASN HB3 H 2.707 0.020 1 656 50 50 ASN ND2 N 113.384 0.400 1 657 50 50 ASN HD21 H 7.633 0.020 2 658 50 50 ASN HD22 H 6.878 0.020 2 659 50 50 ASN C C 176.454 0.400 1 660 51 51 PHE N N 120.700 0.400 1 661 51 51 PHE H H 8.341 0.020 1 662 51 51 PHE CA C 57.935 0.400 1 663 51 51 PHE HA H 4.758 0.020 1 664 51 51 PHE CB C 38.975 0.400 1 665 51 51 PHE HB2 H 3.027 0.020 2 666 51 51 PHE HB3 H 2.967 0.020 2 667 51 51 PHE CD1 C 131.731 0.400 1 668 51 51 PHE HD1 H 7.124 0.020 1 669 51 51 PHE CD2 C 131.836 0.400 1 670 51 51 PHE HD2 H 7.124 0.020 1 671 52 52 GLU CA C 56.254 0.400 1 672 52 52 GLU HA H 4.258 0.020 1 673 52 52 GLU CB C 33.459 0.400 1 674 52 52 GLU HB2 H 1.656 0.020 2 675 52 52 GLU HB3 H 1.952 0.020 2 676 52 52 GLU CG C 36.666 0.400 1 677 52 52 GLU HG2 H 2.100 0.020 2 678 52 52 GLU HG3 H 2.044 0.020 2 679 52 52 GLU C C 173.600 0.400 1 680 53 53 LYS N N 119.964 0.400 1 681 53 53 LYS H H 7.962 0.020 1 682 53 53 LYS CA C 55.356 0.400 1 683 53 53 LYS HA H 4.689 0.020 1 684 53 53 LYS CB C 31.445 0.400 1 685 53 53 LYS HB2 H 0.111 0.020 2 686 53 53 LYS HB3 H 1.130 0.020 2 687 53 53 LYS CG C 24.593 0.400 1 688 53 53 LYS HG2 H 1.087 0.020 2 689 53 53 LYS HG3 H 0.935 0.020 2 690 53 53 LYS CD C 28.780 0.400 1 691 53 53 LYS HD2 H 1.480 0.020 2 692 53 53 LYS HD3 H 1.268 0.020 2 693 53 53 LYS CE C 41.700 0.400 1 694 53 53 LYS HE2 H 2.628 0.020 2 695 53 53 LYS HE3 H 2.717 0.020 2 696 53 53 LYS C C 174.430 0.400 1 697 54 54 ILE N N 124.730 0.400 1 698 54 54 ILE H H 8.804 0.020 1 699 54 54 ILE CA C 59.264 0.400 1 700 54 54 ILE HA H 4.846 0.020 1 701 54 54 ILE CB C 41.953 0.400 1 702 54 54 ILE HB H 1.681 0.020 1 703 54 54 ILE CG2 C 17.835 0.400 1 704 54 54 ILE HG21 H 0.746 0.020 1 705 54 54 ILE HG22 H 0.746 0.020 1 706 54 54 ILE HG23 H 0.746 0.020 1 707 54 54 ILE CG1 C 27.420 0.400 1 708 54 54 ILE HG12 H 1.249 0.020 2 709 54 54 ILE HG13 H 0.911 0.020 2 710 54 54 ILE CD1 C 13.410 0.400 1 711 54 54 ILE HD11 H 0.635 0.020 1 712 54 54 ILE HD12 H 0.635 0.020 1 713 54 54 ILE HD13 H 0.635 0.020 1 714 54 54 ILE C C 173.089 0.400 1 715 55 55 LEU N N 130.086 0.400 1 716 55 55 LEU H H 9.103 0.020 1 717 55 55 LEU CA C 53.502 0.400 1 718 55 55 LEU HA H 5.641 0.020 1 719 55 55 LEU CB C 45.202 0.400 1 720 55 55 LEU HB2 H 1.761 0.020 2 721 55 55 LEU HB3 H 1.320 0.020 2 722 55 55 LEU CG C 27.373 0.400 1 723 55 55 LEU HG H 1.566 0.020 1 724 55 55 LEU CD1 C 26.265 0.400 1 725 55 55 LEU HD11 H 0.684 0.020 2 726 55 55 LEU HD12 H 0.684 0.020 2 727 55 55 LEU HD13 H 0.684 0.020 2 728 55 55 LEU CD2 C 26.632 0.400 1 729 55 55 LEU HD21 H 0.736 0.020 2 730 55 55 LEU HD22 H 0.736 0.020 2 731 55 55 LEU HD23 H 0.736 0.020 2 732 55 55 LEU C C 174.430 0.400 1 733 56 56 ILE N N 125.983 0.400 1 734 56 56 ILE H H 9.182 0.020 1 735 56 56 ILE CA C 59.110 0.400 1 736 56 56 ILE HA H 5.057 0.020 1 737 56 56 ILE CB C 39.823 0.400 1 738 56 56 ILE HB H 1.688 0.020 1 739 56 56 ILE CG2 C 17.086 0.400 1 740 56 56 ILE HG21 H 0.694 0.020 1 741 56 56 ILE HG22 H 0.694 0.020 1 742 56 56 ILE HG23 H 0.694 0.020 1 743 56 56 ILE CG1 C 27.650 0.400 1 744 56 56 ILE HG12 H 1.427 0.020 2 745 56 56 ILE HG13 H 0.958 0.020 2 746 56 56 ILE CD1 C 12.573 0.400 1 747 56 56 ILE HD11 H 0.661 0.020 1 748 56 56 ILE HD12 H 0.661 0.020 1 749 56 56 ILE HD13 H 0.661 0.020 1 750 56 56 ILE C C 174.089 0.400 1 751 57 57 ILE N N 127.241 0.400 1 752 57 57 ILE H H 8.541 0.020 1 753 57 57 ILE CA C 59.255 0.400 1 754 57 57 ILE HA H 4.912 0.020 1 755 57 57 ILE CB C 38.951 0.400 1 756 57 57 ILE HB H 1.823 0.020 1 757 57 57 ILE CG2 C 17.770 0.400 1 758 57 57 ILE HG21 H 0.840 0.020 1 759 57 57 ILE HG22 H 0.840 0.020 1 760 57 57 ILE HG23 H 0.840 0.020 1 761 57 57 ILE CG1 C 27.650 0.400 1 762 57 57 ILE HG12 H 1.460 0.020 2 763 57 57 ILE HG13 H 0.859 0.020 2 764 57 57 ILE CD1 C 13.942 0.400 1 765 57 57 ILE HD11 H 0.707 0.020 1 766 57 57 ILE HD12 H 0.707 0.020 1 767 57 57 ILE HD13 H 0.707 0.020 1 768 57 57 ILE C C 174.869 0.400 1 769 58 58 SER N N 119.270 0.400 1 770 58 58 SER H H 8.810 0.020 1 771 58 58 SER CA C 56.727 0.400 1 772 58 58 SER HA H 5.007 0.020 1 773 58 58 SER CB C 66.615 0.400 1 774 58 58 SER HB2 H 3.780 0.020 2 775 58 58 SER HB3 H 3.419 0.020 2 776 58 58 SER HG H 5.092 0.020 1 777 58 58 SER C C 174.211 0.400 1 778 59 59 ASN N N 122.382 0.400 1 779 59 59 ASN H H 8.794 0.020 1 780 59 59 ASN CA C 52.507 0.400 1 781 59 59 ASN HA H 4.711 0.020 1 782 59 59 ASN CB C 38.962 0.400 1 783 59 59 ASN HB2 H 3.007 0.020 2 784 59 59 ASN HB3 H 2.870 0.020 2 785 59 59 ASN ND2 N 109.566 0.400 1 786 59 59 ASN HD21 H 7.523 0.020 2 787 59 59 ASN HD22 H 6.755 0.020 2 788 59 59 ASN C C 174.795 0.400 1 789 60 60 ASP N N 119.744 0.400 1 790 60 60 ASP H H 7.857 0.020 1 791 60 60 ASP CA C 53.097 0.400 1 792 60 60 ASP HA H 4.863 0.020 1 793 60 60 ASP CB C 42.949 0.400 1 794 60 60 ASP HB2 H 2.735 0.020 2 795 60 60 ASP HB3 H 2.568 0.020 2 796 60 60 ASP C C 176.015 0.400 1 797 61 61 LYS N N 125.818 0.400 1 798 61 61 LYS H H 8.904 0.020 1 799 61 61 LYS CA C 59.632 0.400 1 800 61 61 LYS HA H 3.722 0.020 1 801 61 61 LYS CB C 31.518 0.400 1 802 61 61 LYS HB2 H 1.517 0.020 2 803 61 61 LYS HB3 H 1.432 0.020 2 804 61 61 LYS CG C 24.910 0.400 1 805 61 61 LYS HG2 H 1.029 0.020 2 806 61 61 LYS HG3 H 1.257 0.020 2 807 61 61 LYS CD C 28.780 0.400 1 808 61 61 LYS HD2 H 1.173 0.020 2 809 61 61 LYS HD3 H 1.096 0.020 2 810 61 61 LYS CE C 41.780 0.400 1 811 61 61 LYS HE2 H 2.686 0.020 2 812 61 61 LYS HE3 H 2.674 0.020 2 813 61 61 LYS C C 177.673 0.400 1 814 62 62 GLN N N 118.918 0.400 1 815 62 62 GLN H H 8.434 0.020 1 816 62 62 GLN CA C 58.301 0.400 1 817 62 62 GLN HA H 4.105 0.020 1 818 62 62 GLN CB C 27.448 0.400 1 819 62 62 GLN HB2 H 2.167 0.020 1 820 62 62 GLN HB3 H 2.167 0.020 1 821 62 62 GLN CG C 33.720 0.400 1 822 62 62 GLN HG2 H 2.413 0.020 1 823 62 62 GLN HG3 H 2.412 0.020 1 824 62 62 GLN NE2 N 112.559 0.400 1 825 62 62 GLN HE21 H 7.847 0.020 2 826 62 62 GLN HE22 H 6.890 0.020 2 827 62 62 GLN C C 178.747 0.400 1 828 63 63 LEU N N 120.071 0.400 1 829 63 63 LEU H H 7.671 0.020 1 830 63 63 LEU CA C 56.643 0.400 1 831 63 63 LEU HA H 4.134 0.020 1 832 63 63 LEU CB C 40.894 0.400 1 833 63 63 LEU HB2 H 1.871 0.020 2 834 63 63 LEU HB3 H 1.426 0.020 2 835 63 63 LEU CG C 26.770 0.400 1 836 63 63 LEU HG H 1.620 0.020 1 837 63 63 LEU CD1 C 25.212 0.400 1 838 63 63 LEU HD11 H 0.741 0.020 2 839 63 63 LEU HD12 H 0.741 0.020 2 840 63 63 LEU HD13 H 0.741 0.020 2 841 63 63 LEU CD2 C 22.932 0.400 1 842 63 63 LEU HD21 H 0.709 0.020 2 843 63 63 LEU HD22 H 0.709 0.020 2 844 63 63 LEU HD23 H 0.709 0.020 2 845 63 63 LEU C C 178.552 0.400 1 846 64 64 LEU N N 117.705 0.400 1 847 64 64 LEU H H 7.626 0.020 1 848 64 64 LEU CA C 57.778 0.400 1 849 64 64 LEU HA H 3.907 0.020 1 850 64 64 LEU CB C 41.350 0.400 1 851 64 64 LEU HB2 H 1.789 0.020 2 852 64 64 LEU HB3 H 1.629 0.020 2 853 64 64 LEU CG C 26.770 0.400 1 854 64 64 LEU HG H 1.642 0.020 1 855 64 64 LEU CD1 C 24.933 0.400 1 856 64 64 LEU HD11 H 0.814 0.020 2 857 64 64 LEU HD12 H 0.814 0.020 2 858 64 64 LEU HD13 H 0.814 0.020 2 859 64 64 LEU CD2 C 24.573 0.400 1 860 64 64 LEU HD21 H 0.783 0.020 2 861 64 64 LEU HD22 H 0.783 0.020 2 862 64 64 LEU HD23 H 0.783 0.020 2 863 64 64 LEU C C 172.526 0.400 1 864 65 65 LYS N N 118.311 0.400 1 865 65 65 LYS H H 8.038 0.020 1 866 65 65 LYS CA C 60.226 0.400 1 867 65 65 LYS HA H 3.794 0.020 1 868 65 65 LYS CB C 32.266 0.400 1 869 65 65 LYS HB2 H 1.934 0.020 1 870 65 65 LYS HB3 H 1.933 0.020 1 871 65 65 LYS CG C 24.910 0.400 1 872 65 65 LYS HG2 H 1.549 0.020 2 873 65 65 LYS HG3 H 1.344 0.020 2 874 65 65 LYS CD C 29.497 0.400 1 875 65 65 LYS HD2 H 1.654 0.020 2 876 65 65 LYS HD3 H 1.651 0.020 2 877 65 65 LYS CE C 41.780 0.400 1 878 65 65 LYS HE2 H 2.916 0.020 1 879 65 65 LYS HE3 H 2.916 0.020 1 880 65 65 LYS C C 178.479 0.400 1 881 66 66 GLU N N 119.362 0.400 1 882 66 66 GLU H H 7.803 0.020 1 883 66 66 GLU CA C 59.119 0.400 1 884 66 66 GLU HA H 4.026 0.020 1 885 66 66 GLU CB C 29.262 0.400 1 886 66 66 GLU HB2 H 2.040 0.020 2 887 66 66 GLU HB3 H 2.093 0.020 2 888 66 66 GLU CG C 36.010 0.400 1 889 66 66 GLU HG2 H 2.391 0.020 2 890 66 66 GLU HG3 H 2.187 0.020 2 891 66 66 GLU C C 178.893 0.400 1 892 67 67 MET N N 118.398 0.400 1 893 67 67 MET H H 8.394 0.020 1 894 67 67 MET CA C 59.963 0.400 1 895 67 67 MET HA H 3.948 0.020 1 896 67 67 MET CB C 33.443 0.400 1 897 67 67 MET HB2 H 2.203 0.020 2 898 67 67 MET HB3 H 2.049 0.020 2 899 67 67 MET CG C 32.070 0.400 1 900 67 67 MET HG2 H 2.567 0.020 2 901 67 67 MET HG3 H 2.395 0.020 2 902 67 67 MET CE C 16.759 0.400 1 903 67 67 MET HE1 H 1.880 0.020 1 904 67 67 MET HE2 H 1.880 0.020 1 905 67 67 MET HE3 H 1.880 0.020 1 906 67 67 MET C C 177.527 0.400 1 907 68 68 LEU N N 118.269 0.400 1 908 68 68 LEU H H 8.471 0.020 1 909 68 68 LEU CA C 57.941 0.400 1 910 68 68 LEU HA H 3.779 0.020 1 911 68 68 LEU CB C 40.875 0.400 1 912 68 68 LEU HB2 H 1.747 0.020 2 913 68 68 LEU HB3 H 1.381 0.020 2 914 68 68 LEU CG C 26.447 0.400 1 915 68 68 LEU HG H 1.588 0.020 1 916 68 68 LEU CD1 C 25.266 0.400 1 917 68 68 LEU HD11 H 0.507 0.020 2 918 68 68 LEU HD12 H 0.507 0.020 2 919 68 68 LEU HD13 H 0.507 0.020 2 920 68 68 LEU CD2 C 23.070 0.400 1 921 68 68 LEU HD21 H 0.384 0.020 2 922 68 68 LEU HD22 H 0.384 0.020 2 923 68 68 LEU HD23 H 0.384 0.020 2 924 68 68 LEU C C 178.869 0.400 1 925 69 69 GLU N N 118.681 0.400 1 926 69 69 GLU H H 7.627 0.020 1 927 69 69 GLU CA C 59.424 0.400 1 928 69 69 GLU HA H 4.055 0.020 1 929 69 69 GLU CB C 29.140 0.400 1 930 69 69 GLU HB2 H 2.201 0.020 2 931 69 69 GLU HB3 H 2.089 0.020 2 932 69 69 GLU CG C 36.010 0.400 1 933 69 69 GLU HG2 H 2.273 0.020 2 934 69 69 GLU HG3 H 2.437 0.020 2 935 69 69 GLU C C 179.063 0.400 1 936 70 70 LEU N N 119.503 0.400 1 937 70 70 LEU H H 7.717 0.020 1 938 70 70 LEU CA C 57.774 0.400 1 939 70 70 LEU HA H 4.161 0.020 1 940 70 70 LEU CB C 41.944 0.400 1 941 70 70 LEU HB2 H 1.942 0.020 2 942 70 70 LEU HB3 H 1.570 0.020 2 943 70 70 LEU CG C 26.770 0.400 1 944 70 70 LEU HG H 1.848 0.020 1 945 70 70 LEU CD1 C 25.175 0.400 1 946 70 70 LEU HD11 H 0.906 0.020 2 947 70 70 LEU HD12 H 0.906 0.020 2 948 70 70 LEU HD13 H 0.906 0.020 2 949 70 70 LEU CD2 C 23.168 0.400 1 950 70 70 LEU HD21 H 0.903 0.020 2 951 70 70 LEU HD22 H 0.903 0.020 2 952 70 70 LEU HD23 H 0.903 0.020 2 953 70 70 LEU C C 179.699 0.400 1 954 71 71 ILE N N 116.791 0.400 1 955 71 71 ILE H H 8.598 0.020 1 956 71 71 ILE CA C 64.242 0.400 1 957 71 71 ILE HA H 3.737 0.020 1 958 71 71 ILE CB C 37.901 0.400 1 959 71 71 ILE HB H 1.896 0.020 1 960 71 71 ILE CG2 C 18.372 0.400 1 961 71 71 ILE HG21 H 0.817 0.020 1 962 71 71 ILE HG22 H 0.817 0.020 1 963 71 71 ILE HG23 H 0.817 0.020 1 964 71 71 ILE CG1 C 28.690 0.400 1 965 71 71 ILE HG12 H 1.693 0.020 2 966 71 71 ILE HG13 H 1.022 0.020 2 967 71 71 ILE CD1 C 14.719 0.400 1 968 71 71 ILE HD11 H 0.654 0.020 1 969 71 71 ILE HD12 H 0.654 0.020 1 970 71 71 ILE HD13 H 0.654 0.020 1 971 71 71 ILE C C 178.357 0.400 1 972 72 72 SER N N 116.517 0.400 1 973 72 72 SER H H 8.023 0.020 1 974 72 72 SER CA C 61.365 0.400 1 975 72 72 SER HA H 4.365 0.020 1 976 72 72 SER CB C 62.780 0.400 1 977 72 72 SER HB2 H 4.122 0.020 1 978 72 72 SER HB3 H 4.122 0.020 1 979 72 72 SER C C 176.845 0.400 1 980 73 73 LYS N N 120.731 0.400 1 981 73 73 LYS H H 7.723 0.020 1 982 73 73 LYS CA C 57.476 0.400 1 983 73 73 LYS HA H 4.291 0.020 1 984 73 73 LYS CB C 32.146 0.400 1 985 73 73 LYS HB2 H 1.895 0.020 1 986 73 73 LYS HB3 H 1.894 0.020 1 987 73 73 LYS CG C 24.910 0.400 1 988 73 73 LYS HG2 H 1.597 0.020 2 989 73 73 LYS HG3 H 1.478 0.020 2 990 73 73 LYS CD C 28.780 0.400 1 991 73 73 LYS HD2 H 1.684 0.020 1 992 73 73 LYS HD3 H 1.683 0.020 1 993 73 73 LYS CE C 41.780 0.400 1 994 73 73 LYS HE2 H 2.982 0.020 2 995 73 73 LYS HE3 H 2.977 0.020 2 996 73 73 LYS C C 177.771 0.400 1 997 74 74 LEU N N 117.572 0.400 1 998 74 74 LEU H H 7.609 0.020 1 999 74 74 LEU CA C 55.199 0.400 1 1000 74 74 LEU HA H 4.227 0.020 1 1001 74 74 LEU CB C 41.486 0.400 1 1002 74 74 LEU HB2 H 1.466 0.020 2 1003 74 74 LEU HB3 H 1.197 0.020 2 1004 74 74 LEU CG C 26.267 0.400 1 1005 74 74 LEU HG H 1.703 0.020 1 1006 74 74 LEU CD1 C 25.818 0.400 1 1007 74 74 LEU HD11 H 0.817 0.020 2 1008 74 74 LEU HD12 H 0.817 0.020 2 1009 74 74 LEU HD13 H 0.817 0.020 2 1010 74 74 LEU CD2 C 21.875 0.400 1 1011 74 74 LEU HD21 H 0.819 0.020 2 1012 74 74 LEU HD22 H 0.819 0.020 2 1013 74 74 LEU HD23 H 0.819 0.020 2 1014 74 74 LEU C C 177.332 0.400 1 1015 75 75 GLY N N 105.991 0.400 1 1016 75 75 GLY H H 7.925 0.020 1 1017 75 75 GLY CA C 45.842 0.400 1 1018 75 75 GLY HA2 H 3.836 0.020 2 1019 75 75 GLY HA3 H 4.012 0.020 2 1020 75 75 GLY C C 174.771 0.400 1 1021 76 76 TYR N N 118.452 0.400 1 1022 76 76 TYR H H 7.366 0.020 1 1023 76 76 TYR CA C 55.504 0.400 1 1024 76 76 TYR HA H 4.778 0.020 1 1025 76 76 TYR CB C 37.962 0.400 1 1026 76 76 TYR HB2 H 2.664 0.020 2 1027 76 76 TYR HB3 H 2.848 0.020 2 1028 76 76 TYR CD1 C 132.040 0.400 1 1029 76 76 TYR HD1 H 6.856 0.020 1 1030 76 76 TYR CE1 C 118.075 0.400 1 1031 76 76 TYR HE1 H 6.715 0.020 1 1032 76 76 TYR CE2 C 117.910 0.400 1 1033 76 76 TYR HE2 H 6.715 0.020 1 1034 76 76 TYR CD2 C 132.146 0.400 1 1035 76 76 TYR HD2 H 6.856 0.020 1 1036 76 76 TYR C C 175.234 0.400 1 1037 77 77 LYS N N 122.866 0.400 1 1038 77 77 LYS H H 8.290 0.020 1 1039 77 77 LYS CA C 55.070 0.400 1 1040 77 77 LYS HA H 4.548 0.020 1 1041 77 77 LYS CB C 32.217 0.400 1 1042 77 77 LYS HB2 H 1.843 0.020 2 1043 77 77 LYS HB3 H 1.841 0.020 2 1044 77 77 LYS CG C 24.491 0.400 1 1045 77 77 LYS HG2 H 1.355 0.020 2 1046 77 77 LYS HG3 H 1.171 0.020 2 1047 77 77 LYS CD C 28.205 0.400 1 1048 77 77 LYS HD2 H 1.624 0.020 1 1049 77 77 LYS HD3 H 1.623 0.020 1 1050 77 77 LYS CE C 41.931 0.400 1 1051 77 77 LYS HE2 H 2.825 0.020 2 1052 77 77 LYS HE3 H 2.576 0.020 2 1053 77 77 LYS C C 174.138 0.400 1 1054 78 78 VAL N N 124.071 0.400 1 1055 78 78 VAL H H 7.830 0.020 1 1056 78 78 VAL CA C 60.229 0.400 1 1057 78 78 VAL HA H 5.166 0.020 1 1058 78 78 VAL CB C 34.355 0.400 1 1059 78 78 VAL HB H 1.557 0.020 1 1060 78 78 VAL CG1 C 21.108 0.400 1 1061 78 78 VAL HG11 H 0.615 0.020 2 1062 78 78 VAL HG12 H 0.615 0.020 2 1063 78 78 VAL HG13 H 0.615 0.020 2 1064 78 78 VAL CG2 C 22.145 0.400 1 1065 78 78 VAL HG21 H 0.725 0.020 2 1066 78 78 VAL HG22 H 0.725 0.020 2 1067 78 78 VAL HG23 H 0.725 0.020 2 1068 78 78 VAL C C 174.162 0.400 1 1069 79 79 PHE N N 126.174 0.400 1 1070 79 79 PHE H H 8.374 0.020 1 1071 79 79 PHE CA C 55.953 0.400 1 1072 79 79 PHE HA H 4.567 0.020 1 1073 79 79 PHE CB C 40.184 0.400 1 1074 79 79 PHE HB2 H 1.042 0.020 2 1075 79 79 PHE HB3 H 2.075 0.020 2 1076 79 79 PHE CD1 C 131.806 0.400 1 1077 79 79 PHE HD1 H 6.720 0.020 1 1078 79 79 PHE CE1 C 130.139 0.400 1 1079 79 79 PHE HE1 H 7.097 0.020 1 1080 79 79 PHE CZ C 128.170 0.400 1 1081 79 79 PHE HZ H 6.990 0.020 1 1082 79 79 PHE CE2 C 130.226 0.400 1 1083 79 79 PHE HE2 H 7.097 0.020 1 1084 79 79 PHE CD2 C 131.806 0.400 1 1085 79 79 PHE HD2 H 6.720 0.020 1 1086 79 79 PHE C C 173.357 0.400 1 1087 80 80 LEU N N 123.959 0.400 1 1088 80 80 LEU H H 8.601 0.020 1 1089 80 80 LEU CA C 53.998 0.400 1 1090 80 80 LEU HA H 5.546 0.020 1 1091 80 80 LEU CB C 45.667 0.400 1 1092 80 80 LEU HB2 H 1.753 0.020 2 1093 80 80 LEU HB3 H 1.288 0.020 2 1094 80 80 LEU CG C 28.308 0.400 1 1095 80 80 LEU HG H 1.441 0.020 1 1096 80 80 LEU CD1 C 25.505 0.400 1 1097 80 80 LEU HD11 H 0.775 0.020 1 1098 80 80 LEU HD12 H 0.775 0.020 1 1099 80 80 LEU HD13 H 0.775 0.020 1 1100 80 80 LEU CD2 C 27.658 0.400 1 1101 80 80 LEU HD21 H 0.776 0.020 1 1102 80 80 LEU HD22 H 0.776 0.020 1 1103 80 80 LEU HD23 H 0.776 0.020 1 1104 80 80 LEU C C 173.503 0.400 1 1105 81 81 LEU N N 126.694 0.400 1 1106 81 81 LEU H H 9.063 0.020 1 1107 81 81 LEU CA C 53.064 0.400 1 1108 81 81 LEU HA H 5.269 0.020 1 1109 81 81 LEU CB C 45.777 0.400 1 1110 81 81 LEU HB2 H 1.919 0.020 2 1111 81 81 LEU HB3 H 1.356 0.020 2 1112 81 81 LEU CG C 27.360 0.400 1 1113 81 81 LEU HG H 1.346 0.020 1 1114 81 81 LEU CD1 C 24.934 0.400 1 1115 81 81 LEU HD11 H 0.789 0.020 2 1116 81 81 LEU HD12 H 0.789 0.020 2 1117 81 81 LEU HD13 H 0.789 0.020 2 1118 81 81 LEU CD2 C 25.856 0.400 1 1119 81 81 LEU HD21 H 0.706 0.020 2 1120 81 81 LEU HD22 H 0.706 0.020 2 1121 81 81 LEU HD23 H 0.706 0.020 2 1122 81 81 LEU C C 173.649 0.400 1 1123 82 82 LEU N N 124.888 0.400 1 1124 82 82 LEU H H 8.864 0.020 1 1125 82 82 LEU CA C 53.135 0.400 1 1126 82 82 LEU HA H 4.911 0.020 1 1127 82 82 LEU CB C 44.222 0.400 1 1128 82 82 LEU HB2 H 1.621 0.020 2 1129 82 82 LEU HB3 H 1.736 0.020 2 1130 82 82 LEU CG C 26.760 0.400 1 1131 82 82 LEU HG H 1.598 0.020 1 1132 82 82 LEU CD1 C 26.011 0.400 1 1133 82 82 LEU HD11 H 0.778 0.020 2 1134 82 82 LEU HD12 H 0.778 0.020 2 1135 82 82 LEU HD13 H 0.778 0.020 2 1136 82 82 LEU CD2 C 23.860 0.400 1 1137 82 82 LEU HD21 H 0.825 0.020 2 1138 82 82 LEU HD22 H 0.825 0.020 2 1139 82 82 LEU HD23 H 0.825 0.020 2 1140 82 82 LEU C C 174.479 0.400 1 1141 83 83 GLN N N 122.153 0.400 1 1142 83 83 GLN H H 8.437 0.020 1 1143 83 83 GLN CA C 54.586 0.400 1 1144 83 83 GLN HA H 5.260 0.020 1 1145 83 83 GLN CB C 29.870 0.400 1 1146 83 83 GLN HB2 H 2.212 0.020 2 1147 83 83 GLN HB3 H 1.420 0.020 2 1148 83 83 GLN CG C 33.720 0.400 1 1149 83 83 GLN HG2 H 2.336 0.020 2 1150 83 83 GLN HG3 H 2.117 0.020 2 1151 83 83 GLN NE2 N 110.447 0.400 1 1152 83 83 GLN HE21 H 7.201 0.020 1 1153 83 83 GLN HE22 H 7.200 0.020 1 1154 83 83 GLN C C 174.333 0.400 1 1155 84 84 ASP N N 124.451 0.400 1 1156 84 84 ASP H H 8.205 0.020 1 1157 84 84 ASP CA C 54.015 0.400 1 1158 84 84 ASP HA H 4.502 0.020 1 1159 84 84 ASP CB C 43.771 0.400 1 1160 84 84 ASP HB2 H 2.588 0.020 2 1161 84 84 ASP HB3 H 2.664 0.020 2 1162 84 84 ASP C C 174.308 0.400 1 1163 85 85 GLN N N 120.202 0.400 1 1164 85 85 GLN H H 8.617 0.020 1 1165 85 85 GLN CA C 56.595 0.400 1 1166 85 85 GLN HA H 4.334 0.020 1 1167 85 85 GLN CB C 29.334 0.400 1 1168 85 85 GLN HB2 H 2.173 0.020 2 1169 85 85 GLN HB3 H 2.040 0.020 2 1170 85 85 GLN CG C 33.720 0.400 1 1171 85 85 GLN HG2 H 2.407 0.020 2 1172 85 85 GLN HG3 H 2.405 0.020 2 1173 85 85 GLN NE2 N 112.150 0.400 1 1174 85 85 GLN HE21 H 7.624 0.020 2 1175 85 85 GLN HE22 H 6.895 0.020 2 1176 85 85 GLN C C 175.431 0.400 1 1177 86 86 ASP N N 120.508 0.400 1 1178 86 86 ASP H H 8.691 0.020 1 1179 86 86 ASP CA C 53.512 0.400 1 1180 86 86 ASP HA H 4.685 0.020 1 1181 86 86 ASP CB C 40.957 0.400 1 1182 86 86 ASP HB2 H 2.927 0.020 2 1183 86 86 ASP HB3 H 2.566 0.020 2 1184 86 86 ASP C C 175.747 0.400 1 1185 87 87 GLU N N 123.604 0.400 1 1186 87 87 GLU H H 8.642 0.020 1 1187 87 87 GLU CA C 58.522 0.400 1 1188 87 87 GLU HA H 4.035 0.020 1 1189 87 87 GLU CB C 29.575 0.400 1 1190 87 87 GLU HB2 H 2.094 0.020 2 1191 87 87 GLU HB3 H 2.040 0.020 2 1192 87 87 GLU CG C 36.010 0.400 1 1193 87 87 GLU HG2 H 2.295 0.020 1 1194 87 87 GLU HG3 H 2.295 0.020 1 1195 87 87 GLU C C 177.771 0.400 1 1196 88 88 ASN N N 118.838 0.400 1 1197 88 88 ASN H H 8.527 0.020 1 1198 88 88 ASN CA C 55.642 0.400 1 1199 88 88 ASN HA H 4.561 0.020 1 1200 88 88 ASN CB C 38.166 0.400 1 1201 88 88 ASN HB2 H 2.850 0.020 2 1202 88 88 ASN HB3 H 2.905 0.020 2 1203 88 88 ASN ND2 N 114.317 0.400 1 1204 88 88 ASN HD21 H 7.890 0.020 2 1205 88 88 ASN HD22 H 7.028 0.020 2 1206 88 88 ASN C C 177.089 0.400 1 1207 89 89 GLU N N 120.947 0.400 1 1208 89 89 GLU H H 8.221 0.020 1 1209 89 89 GLU CA C 58.251 0.400 1 1210 89 89 GLU HA H 4.147 0.020 1 1211 89 89 GLU CB C 29.244 0.400 1 1212 89 89 GLU HB2 H 2.040 0.020 1 1213 89 89 GLU HB3 H 2.040 0.020 1 1214 89 89 GLU CG C 36.010 0.400 1 1215 89 89 GLU HG2 H 2.263 0.020 2 1216 89 89 GLU HG3 H 2.311 0.020 2 1217 89 89 GLU C C 178.357 0.400 1 1218 90 90 LEU N N 119.582 0.400 1 1219 90 90 LEU H H 8.047 0.020 1 1220 90 90 LEU CA C 56.944 0.400 1 1221 90 90 LEU HA H 4.205 0.020 1 1222 90 90 LEU CB C 42.456 0.400 1 1223 90 90 LEU HB2 H 1.776 0.020 2 1224 90 90 LEU HB3 H 1.722 0.020 2 1225 90 90 LEU CG C 26.770 0.400 1 1226 90 90 LEU HG H 1.639 0.020 1 1227 90 90 LEU CD1 C 24.861 0.400 1 1228 90 90 LEU HD11 H 0.903 0.020 2 1229 90 90 LEU HD12 H 0.903 0.020 2 1230 90 90 LEU HD13 H 0.903 0.020 2 1231 90 90 LEU CD2 C 24.744 0.400 1 1232 90 90 LEU HD21 H 0.882 0.020 2 1233 90 90 LEU HD22 H 0.882 0.020 2 1234 90 90 LEU HD23 H 0.882 0.020 2 1235 90 90 LEU C C 177.917 0.400 1 1236 91 91 GLU N N 119.029 0.400 1 1237 91 91 GLU H H 7.940 0.020 1 1238 91 91 GLU CA C 59.129 0.400 1 1239 91 91 GLU HA H 4.073 0.020 1 1240 91 91 GLU CB C 28.970 0.400 1 1241 91 91 GLU HB2 H 2.125 0.020 2 1242 91 91 GLU HB3 H 2.069 0.020 2 1243 91 91 GLU CG C 35.054 0.400 1 1244 91 91 GLU HG2 H 2.417 0.020 2 1245 91 91 GLU HG3 H 2.287 0.020 2 1246 91 91 GLU C C 178.284 0.400 1 1247 92 92 GLU N N 118.667 0.400 1 1248 92 92 GLU H H 8.088 0.020 1 1249 92 92 GLU CA C 59.252 0.400 1 1250 92 92 GLU HA H 4.032 0.020 1 1251 92 92 GLU CB C 28.932 0.400 1 1252 92 92 GLU HB2 H 2.053 0.020 2 1253 92 92 GLU HB3 H 2.107 0.020 2 1254 92 92 GLU CG C 36.010 0.400 1 1255 92 92 GLU HG2 H 2.316 0.020 2 1256 92 92 GLU HG3 H 2.265 0.020 2 1257 92 92 GLU C C 178.103 0.400 1 1258 93 93 PHE N N 120.118 0.400 1 1259 93 93 PHE H H 8.103 0.020 1 1260 93 93 PHE CA C 60.445 0.400 1 1261 93 93 PHE HA H 4.340 0.020 1 1262 93 93 PHE CB C 38.987 0.400 1 1263 93 93 PHE HB2 H 3.295 0.020 2 1264 93 93 PHE HB3 H 3.036 0.020 2 1265 93 93 PHE CD1 C 131.517 0.400 1 1266 93 93 PHE HD1 H 7.221 0.020 1 1267 93 93 PHE CE1 C 130.552 0.400 1 1268 93 93 PHE HE1 H 7.136 0.020 1 1269 93 93 PHE CZ C 129.169 0.400 1 1270 93 93 PHE HZ H 7.083 0.020 1 1271 93 93 PHE CE2 C 130.600 0.400 1 1272 93 93 PHE HE2 H 7.136 0.020 1 1273 93 93 PHE CD2 C 131.641 0.400 1 1274 93 93 PHE HD2 H 7.221 0.020 1 1275 93 93 PHE C C 176.894 0.400 1 1276 94 94 LYS N N 118.941 0.400 1 1277 94 94 LYS H H 8.606 0.020 1 1278 94 94 LYS CA C 60.076 0.400 1 1279 94 94 LYS HA H 3.617 0.020 1 1280 94 94 LYS CB C 32.465 0.400 1 1281 94 94 LYS HB2 H 2.070 0.020 2 1282 94 94 LYS HB3 H 1.735 0.020 2 1283 94 94 LYS CG C 24.715 0.400 1 1284 94 94 LYS HG2 H 1.369 0.020 2 1285 94 94 LYS HG3 H 1.321 0.020 2 1286 94 94 LYS CD C 30.102 0.400 1 1287 94 94 LYS HD2 H 1.537 0.020 1 1288 94 94 LYS HD3 H 1.537 0.020 1 1289 94 94 LYS CE C 41.780 0.400 1 1290 94 94 LYS HE2 H 3.019 0.020 2 1291 94 94 LYS HE3 H 2.917 0.020 2 1292 94 94 LYS C C 177.600 0.400 1 1293 95 95 ARG N N 117.194 0.400 1 1294 95 95 ARG H H 8.159 0.020 1 1295 95 95 ARG CA C 59.103 0.400 1 1296 95 95 ARG HA H 4.150 0.020 1 1297 95 95 ARG CB C 29.819 0.400 1 1298 95 95 ARG HB2 H 1.897 0.020 2 1299 95 95 ARG HB3 H 1.970 0.020 2 1300 95 95 ARG CG C 27.310 0.400 1 1301 95 95 ARG HG2 H 1.876 0.020 2 1302 95 95 ARG HG3 H 1.675 0.020 2 1303 95 95 ARG CD C 43.413 0.400 1 1304 95 95 ARG HD2 H 3.222 0.020 1 1305 95 95 ARG HD3 H 3.223 0.020 1 1306 95 95 ARG C C 179.404 0.400 1 1307 96 96 LYS N N 119.582 0.400 1 1308 96 96 LYS H H 7.786 0.020 1 1309 96 96 LYS CA C 58.934 0.400 1 1310 96 96 LYS HA H 4.065 0.020 1 1311 96 96 LYS CB C 32.069 0.400 1 1312 96 96 LYS HB2 H 1.901 0.020 2 1313 96 96 LYS HB3 H 1.971 0.020 2 1314 96 96 LYS CG C 24.910 0.400 1 1315 96 96 LYS HG2 H 1.440 0.020 2 1316 96 96 LYS HG3 H 1.570 0.020 2 1317 96 96 LYS CD C 28.889 0.400 1 1318 96 96 LYS HD2 H 1.680 0.020 2 1319 96 96 LYS HD3 H 1.682 0.020 2 1320 96 96 LYS CE C 41.780 0.400 1 1321 96 96 LYS HE2 H 2.930 0.020 1 1322 96 96 LYS HE3 H 2.930 0.020 1 1323 96 96 LYS C C 179.034 0.400 1 1324 97 97 ILE N N 118.550 0.400 1 1325 97 97 ILE H H 7.831 0.020 1 1326 97 97 ILE CA C 62.569 0.400 1 1327 97 97 ILE HA H 3.938 0.020 1 1328 97 97 ILE CB C 37.206 0.400 1 1329 97 97 ILE HB H 1.808 0.020 1 1330 97 97 ILE CG2 C 18.753 0.400 1 1331 97 97 ILE HG21 H 0.682 0.020 1 1332 97 97 ILE HG22 H 0.682 0.020 1 1333 97 97 ILE HG23 H 0.682 0.020 1 1334 97 97 ILE CG1 C 27.265 0.400 1 1335 97 97 ILE HG12 H 1.003 0.020 2 1336 97 97 ILE HG13 H 0.925 0.020 2 1337 97 97 ILE CD1 C 11.899 0.400 1 1338 97 97 ILE HD11 H 0.363 0.020 1 1339 97 97 ILE HD12 H 0.363 0.020 1 1340 97 97 ILE HD13 H 0.363 0.020 1 1341 97 97 ILE C C 178.284 0.400 1 1342 98 98 GLU N N 121.984 0.400 1 1343 98 98 GLU H H 8.670 0.020 1 1344 98 98 GLU CA C 58.950 0.400 1 1345 98 98 GLU HA H 4.336 0.020 1 1346 98 98 GLU CB C 29.435 0.400 1 1347 98 98 GLU HB2 H 2.179 0.020 2 1348 98 98 GLU HB3 H 2.053 0.020 2 1349 98 98 GLU CG C 36.433 0.400 1 1350 98 98 GLU HG2 H 2.377 0.020 2 1351 98 98 GLU HG3 H 2.437 0.020 2 1352 98 98 GLU C C 180.040 0.400 1 1353 99 99 SER N N 115.499 0.400 1 1354 99 99 SER H H 8.099 0.020 1 1355 99 99 SER CA C 60.410 0.400 1 1356 99 99 SER HA H 4.343 0.020 1 1357 99 99 SER CB C 62.680 0.400 1 1358 99 99 SER HB2 H 3.996 0.020 1 1359 99 99 SER HB3 H 3.996 0.020 1 1360 99 99 SER C C 174.820 0.400 1 1361 100 100 GLN N N 119.301 0.400 1 1362 100 100 GLN H H 7.623 0.020 1 1363 100 100 GLN CA C 55.926 0.400 1 1364 100 100 GLN HA H 4.310 0.020 1 1365 100 100 GLN CB C 29.212 0.400 1 1366 100 100 GLN HB2 H 2.210 0.020 2 1367 100 100 GLN HB3 H 2.048 0.020 2 1368 100 100 GLN CG C 34.179 0.400 1 1369 100 100 GLN HG2 H 2.441 0.020 2 1370 100 100 GLN HG3 H 2.351 0.020 2 1371 100 100 GLN NE2 N 110.232 0.400 1 1372 100 100 GLN HE21 H 7.286 0.020 2 1373 100 100 GLN HE22 H 6.755 0.020 2 1374 100 100 GLN C C 175.857 0.400 1 1375 101 101 GLY N N 105.765 0.400 1 1376 101 101 GLY H H 7.945 0.020 1 1377 101 101 GLY CA C 45.203 0.400 1 1378 101 101 GLY HA2 H 3.722 0.020 2 1379 101 101 GLY HA3 H 4.009 0.020 2 1380 101 101 GLY C C 173.748 0.400 1 1381 102 102 TYR N N 117.993 0.400 1 1382 102 102 TYR H H 6.890 0.020 1 1383 102 102 TYR CA C 56.254 0.400 1 1384 102 102 TYR HA H 4.672 0.020 1 1385 102 102 TYR CB C 39.048 0.400 1 1386 102 102 TYR HB2 H 2.472 0.020 2 1387 102 102 TYR HB3 H 2.751 0.020 2 1388 102 102 TYR CD1 C 132.425 0.400 1 1389 102 102 TYR HD1 H 6.984 0.020 1 1390 102 102 TYR CE1 C 118.203 0.400 1 1391 102 102 TYR HE1 H 6.716 0.020 1 1392 102 102 TYR CE2 C 118.264 0.400 1 1393 102 102 TYR HE2 H 6.716 0.020 1 1394 102 102 TYR CD2 C 132.425 0.400 1 1395 102 102 TYR HD2 H 6.984 0.020 1 1396 102 102 TYR C C 174.747 0.400 1 1397 103 103 GLU N N 122.864 0.400 1 1398 103 103 GLU H H 8.318 0.020 1 1399 103 103 GLU CA C 56.384 0.400 1 1400 103 103 GLU HA H 4.507 0.020 1 1401 103 103 GLU CB C 30.371 0.400 1 1402 103 103 GLU HB2 H 2.087 0.020 2 1403 103 103 GLU HB3 H 1.987 0.020 2 1404 103 103 GLU CG C 36.249 0.400 1 1405 103 103 GLU HG2 H 2.256 0.020 2 1406 103 103 GLU HG3 H 2.323 0.020 2 1407 103 103 GLU C C 174.162 0.400 1 1408 104 104 VAL N N 124.342 0.400 1 1409 104 104 VAL H H 8.651 0.020 1 1410 104 104 VAL CA C 59.280 0.400 1 1411 104 104 VAL HA H 5.228 0.020 1 1412 104 104 VAL CB C 34.167 0.400 1 1413 104 104 VAL HB H 1.946 0.020 1 1414 104 104 VAL CG1 C 20.686 0.400 1 1415 104 104 VAL HG11 H 0.929 0.020 2 1416 104 104 VAL HG12 H 0.929 0.020 2 1417 104 104 VAL HG13 H 0.929 0.020 2 1418 104 104 VAL CG2 C 22.008 0.400 1 1419 104 104 VAL HG21 H 0.884 0.020 2 1420 104 104 VAL HG22 H 0.884 0.020 2 1421 104 104 VAL HG23 H 0.884 0.020 2 1422 104 104 VAL C C 174.235 0.400 1 1423 105 105 ARG N N 124.856 0.400 1 1424 105 105 ARG H H 8.705 0.020 1 1425 105 105 ARG CA C 52.465 0.400 1 1426 105 105 ARG HA H 4.915 0.020 1 1427 105 105 ARG CB C 32.955 0.400 1 1428 105 105 ARG HB2 H 1.857 0.020 2 1429 105 105 ARG HB3 H 1.816 0.020 2 1430 105 105 ARG CG C 26.576 0.400 1 1431 105 105 ARG HG2 H 1.805 0.020 2 1432 105 105 ARG HG3 H 1.752 0.020 2 1433 105 105 ARG CD C 41.442 0.400 1 1434 105 105 ARG HD2 H 3.515 0.020 2 1435 105 105 ARG HD3 H 3.339 0.020 2 1436 105 105 ARG NE N 82.387 0.400 1 1437 105 105 ARG HE H 7.599 0.020 1 1438 105 105 ARG C C 173.917 0.400 1 1439 106 106 LYS N N 121.499 0.400 1 1440 106 106 LYS H H 8.807 0.020 1 1441 106 106 LYS CA C 53.868 0.400 1 1442 106 106 LYS HA H 5.578 0.020 1 1443 106 106 LYS CB C 35.299 0.400 1 1444 106 106 LYS HB2 H 1.716 0.020 2 1445 106 106 LYS HB3 H 1.714 0.020 2 1446 106 106 LYS CG C 24.003 0.400 1 1447 106 106 LYS HG2 H 1.460 0.020 2 1448 106 106 LYS HG3 H 1.402 0.020 2 1449 106 106 LYS CD C 29.231 0.400 1 1450 106 106 LYS HD2 H 1.561 0.020 1 1451 106 106 LYS HD3 H 1.562 0.020 1 1452 106 106 LYS CE C 41.780 0.400 1 1453 106 106 LYS HE2 H 2.952 0.020 1 1454 106 106 LYS HE3 H 2.953 0.020 1 1455 106 106 LYS C C 174.820 0.400 1 1456 107 107 VAL N N 118.792 0.400 1 1457 107 107 VAL H H 8.555 0.020 1 1458 107 107 VAL CA C 60.222 0.400 1 1459 107 107 VAL HA H 4.615 0.020 1 1460 107 107 VAL CB C 35.234 0.400 1 1461 107 107 VAL HB H 2.116 0.020 1 1462 107 107 VAL CG1 C 21.723 0.400 1 1463 107 107 VAL HG11 H 0.763 0.020 2 1464 107 107 VAL HG12 H 0.763 0.020 2 1465 107 107 VAL HG13 H 0.763 0.020 2 1466 107 107 VAL CG2 C 20.759 0.400 1 1467 107 107 VAL HG21 H 0.868 0.020 2 1468 107 107 VAL HG22 H 0.868 0.020 2 1469 107 107 VAL HG23 H 0.868 0.020 2 1470 107 107 VAL C C 173.332 0.400 1 1471 108 108 THR N N 114.072 0.400 1 1472 108 108 THR H H 8.604 0.020 1 1473 108 108 THR CA C 62.221 0.400 1 1474 108 108 THR HA H 4.781 0.020 1 1475 108 108 THR CB C 69.975 0.400 1 1476 108 108 THR HB H 4.218 0.020 1 1477 108 108 THR CG2 C 21.440 0.400 1 1478 108 108 THR HG21 H 1.248 0.020 1 1479 108 108 THR HG22 H 1.248 0.020 1 1480 108 108 THR HG23 H 1.248 0.020 1 1481 108 108 THR C C 174.625 0.400 1 1482 109 109 ASP N N 122.574 0.400 1 1483 109 109 ASP H H 8.036 0.020 1 1484 109 109 ASP CA C 53.849 0.400 1 1485 109 109 ASP HA H 4.738 0.020 1 1486 109 109 ASP CB C 43.688 0.400 1 1487 109 109 ASP HB2 H 2.816 0.020 2 1488 109 109 ASP HB3 H 2.729 0.020 2 1489 109 109 ASP C C 175.796 0.400 1 1490 110 110 ASP N N 122.852 0.400 1 1491 110 110 ASP H H 8.696 0.020 1 1492 110 110 ASP CA C 57.388 0.400 1 1493 110 110 ASP HA H 4.095 0.020 1 1494 110 110 ASP CB C 40.301 0.400 1 1495 110 110 ASP HB2 H 2.416 0.020 2 1496 110 110 ASP HB3 H 2.681 0.020 2 1497 110 110 ASP C C 177.527 0.400 1 1498 111 111 GLU N N 119.144 0.400 1 1499 111 111 GLU H H 8.213 0.020 1 1500 111 111 GLU CA C 59.357 0.400 1 1501 111 111 GLU HA H 3.988 0.020 1 1502 111 111 GLU CB C 28.496 0.400 1 1503 111 111 GLU HB2 H 2.099 0.020 2 1504 111 111 GLU HB3 H 2.023 0.020 2 1505 111 111 GLU CG C 36.010 0.400 1 1506 111 111 GLU HG2 H 2.287 0.020 2 1507 111 111 GLU HG3 H 2.269 0.020 2 1508 111 111 GLU C C 179.942 0.400 1 1509 112 112 GLU N N 121.400 0.400 1 1510 112 112 GLU H H 8.234 0.020 1 1511 112 112 GLU CA C 58.749 0.400 1 1512 112 112 GLU HA H 3.997 0.020 1 1513 112 112 GLU CB C 29.194 0.400 1 1514 112 112 GLU HB2 H 2.084 0.020 1 1515 112 112 GLU HB3 H 2.083 0.020 1 1516 112 112 GLU CG C 36.010 0.400 1 1517 112 112 GLU HG2 H 2.337 0.020 1 1518 112 112 GLU HG3 H 2.338 0.020 1 1519 112 112 GLU C C 178.430 0.400 1 1520 113 113 ALA N N 120.316 0.400 1 1521 113 113 ALA H H 8.118 0.020 1 1522 113 113 ALA CA C 55.382 0.400 1 1523 113 113 ALA HA H 3.800 0.020 1 1524 113 113 ALA CB C 18.602 0.400 1 1525 113 113 ALA HB1 H 1.410 0.020 1 1526 113 113 ALA HB2 H 1.410 0.020 1 1527 113 113 ALA HB3 H 1.410 0.020 1 1528 113 113 ALA C C 178.430 0.400 1 1529 114 114 LEU N N 116.901 0.400 1 1530 114 114 LEU H H 7.743 0.020 1 1531 114 114 LEU CA C 57.675 0.400 1 1532 114 114 LEU HA H 3.713 0.020 1 1533 114 114 LEU CB C 40.936 0.400 1 1534 114 114 LEU HB2 H 1.735 0.020 2 1535 114 114 LEU HB3 H 1.397 0.020 2 1536 114 114 LEU CG C 26.770 0.400 1 1537 114 114 LEU HG H 1.651 0.020 1 1538 114 114 LEU CD1 C 24.730 0.400 1 1539 114 114 LEU HD11 H 0.805 0.020 2 1540 114 114 LEU HD12 H 0.805 0.020 2 1541 114 114 LEU HD13 H 0.805 0.020 2 1542 114 114 LEU CD2 C 23.240 0.400 1 1543 114 114 LEU HD21 H 0.670 0.020 2 1544 114 114 LEU HD22 H 0.670 0.020 2 1545 114 114 LEU HD23 H 0.670 0.020 2 1546 114 114 LEU C C 178.431 0.400 1 1547 115 115 LYS N N 119.066 0.400 1 1548 115 115 LYS H H 7.617 0.020 1 1549 115 115 LYS CA C 59.883 0.400 1 1550 115 115 LYS HA H 3.800 0.020 1 1551 115 115 LYS CB C 32.178 0.400 1 1552 115 115 LYS HB2 H 1.928 0.020 2 1553 115 115 LYS HB3 H 1.934 0.020 2 1554 115 115 LYS CG C 24.910 0.400 1 1555 115 115 LYS HG2 H 1.561 0.020 2 1556 115 115 LYS HG3 H 1.300 0.020 2 1557 115 115 LYS CD C 29.549 0.400 1 1558 115 115 LYS HD2 H 1.656 0.020 2 1559 115 115 LYS HD3 H 1.659 0.020 2 1560 115 115 LYS CE C 41.780 0.400 1 1561 115 115 LYS HE2 H 2.909 0.020 1 1562 115 115 LYS HE3 H 2.909 0.020 1 1563 115 115 LYS C C 179.404 0.400 1 1564 116 116 ILE N N 120.613 0.400 1 1565 116 116 ILE H H 8.004 0.020 1 1566 116 116 ILE CA C 64.122 0.400 1 1567 116 116 ILE HA H 3.460 0.020 1 1568 116 116 ILE CB C 36.323 0.400 1 1569 116 116 ILE HB H 1.630 0.020 1 1570 116 116 ILE CG2 C 18.105 0.400 1 1571 116 116 ILE HG21 H 0.043 0.020 1 1572 116 116 ILE HG22 H 0.043 0.020 1 1573 116 116 ILE HG23 H 0.043 0.020 1 1574 116 116 ILE CG1 C 28.888 0.400 1 1575 116 116 ILE HG12 H 1.584 0.020 2 1576 116 116 ILE HG13 H 0.970 0.020 2 1577 116 116 ILE CD1 C 13.410 0.400 1 1578 116 116 ILE HD11 H 0.680 0.020 1 1579 116 116 ILE HD12 H 0.680 0.020 1 1580 116 116 ILE HD13 H 0.680 0.020 1 1581 116 116 ILE C C 177.016 0.400 1 1582 117 117 VAL N N 120.234 0.400 1 1583 117 117 VAL H H 8.121 0.020 1 1584 117 117 VAL CA C 67.505 0.400 1 1585 117 117 VAL HA H 3.260 0.020 1 1586 117 117 VAL CB C 30.753 0.400 1 1587 117 117 VAL HB H 2.047 0.020 1 1588 117 117 VAL CG1 C 21.310 0.400 1 1589 117 117 VAL HG11 H 0.721 0.020 2 1590 117 117 VAL HG12 H 0.721 0.020 2 1591 117 117 VAL HG13 H 0.721 0.020 2 1592 117 117 VAL CG2 C 23.986 0.400 1 1593 117 117 VAL HG21 H 0.865 0.020 2 1594 117 117 VAL HG22 H 0.865 0.020 2 1595 117 117 VAL HG23 H 0.865 0.020 2 1596 117 117 VAL C C 177.746 0.400 1 1597 118 118 ARG N N 118.415 0.400 1 1598 118 118 ARG H H 8.026 0.020 1 1599 118 118 ARG CA C 60.169 0.400 1 1600 118 118 ARG HA H 3.893 0.020 1 1601 118 118 ARG CB C 29.702 0.400 1 1602 118 118 ARG HB2 H 1.799 0.020 2 1603 118 118 ARG HB3 H 1.871 0.020 2 1604 118 118 ARG CG C 28.010 0.400 1 1605 118 118 ARG HG2 H 1.729 0.020 2 1606 118 118 ARG HG3 H 1.483 0.020 2 1607 118 118 ARG CD C 43.758 0.400 1 1608 118 118 ARG HD2 H 3.151 0.020 2 1609 118 118 ARG HD3 H 2.971 0.020 2 1610 118 118 ARG NE N 85.297 0.400 1 1611 118 118 ARG HE H 7.666 0.020 1 1612 118 118 ARG C C 178.966 0.400 1 1613 119 119 GLU N N 122.419 0.400 1 1614 119 119 GLU H H 7.918 0.020 1 1615 119 119 GLU CA C 59.530 0.400 1 1616 119 119 GLU HA H 4.027 0.020 1 1617 119 119 GLU CB C 28.961 0.400 1 1618 119 119 GLU HB2 H 2.117 0.020 2 1619 119 119 GLU HB3 H 2.114 0.020 2 1620 119 119 GLU CG C 36.010 0.400 1 1621 119 119 GLU HG2 H 2.076 0.020 2 1622 119 119 GLU HG3 H 2.459 0.020 2 1623 119 119 GLU C C 179.429 0.400 1 1624 120 120 PHE N N 119.597 0.400 1 1625 120 120 PHE H H 8.826 0.020 1 1626 120 120 PHE CA C 56.868 0.400 1 1627 120 120 PHE HA H 4.022 0.020 1 1628 120 120 PHE CB C 36.753 0.400 1 1629 120 120 PHE HB2 H 3.218 0.020 2 1630 120 120 PHE HB3 H 2.343 0.020 2 1631 120 120 PHE CD1 C 129.643 0.400 1 1632 120 120 PHE HD1 H 6.789 0.020 1 1633 120 120 PHE CE1 C 131.362 0.400 1 1634 120 120 PHE HE1 H 7.137 0.020 1 1635 120 120 PHE CZ C 129.438 0.400 1 1636 120 120 PHE HZ H 7.019 0.020 1 1637 120 120 PHE CE2 C 131.152 0.400 1 1638 120 120 PHE HE2 H 7.137 0.020 1 1639 120 120 PHE CD2 C 129.603 0.400 1 1640 120 120 PHE HD2 H 6.789 0.020 1 1641 120 120 PHE C C 177.698 0.400 1 1642 121 121 MET N N 116.596 0.400 1 1643 121 121 MET H H 8.317 0.020 1 1644 121 121 MET CA C 59.785 0.400 1 1645 121 121 MET HA H 3.931 0.020 1 1646 121 121 MET CB C 33.643 0.400 1 1647 121 121 MET HB2 H 2.290 0.020 2 1648 121 121 MET HB3 H 2.077 0.020 2 1649 121 121 MET CG C 31.222 0.400 1 1650 121 121 MET HG2 H 1.917 0.020 2 1651 121 121 MET HG3 H 2.625 0.020 2 1652 121 121 MET CE C 16.539 0.400 1 1653 121 121 MET HE1 H 1.830 0.020 1 1654 121 121 MET HE2 H 1.830 0.020 1 1655 121 121 MET HE3 H 1.830 0.020 1 1656 121 121 MET C C 179.577 0.400 1 1657 122 122 GLN N N 120.565 0.400 1 1658 122 122 GLN H H 8.054 0.020 1 1659 122 122 GLN CA C 58.745 0.400 1 1660 122 122 GLN HA H 4.135 0.020 1 1661 122 122 GLN CB C 28.020 0.400 1 1662 122 122 GLN HB2 H 2.241 0.020 1 1663 122 122 GLN HB3 H 2.241 0.020 1 1664 122 122 GLN CG C 33.526 0.400 1 1665 122 122 GLN HG2 H 2.406 0.020 2 1666 122 122 GLN HG3 H 2.521 0.020 2 1667 122 122 GLN NE2 N 111.549 0.400 1 1668 122 122 GLN HE21 H 7.466 0.020 2 1669 122 122 GLN HE22 H 6.831 0.020 2 1670 122 122 GLN C C 178.893 0.400 1 1671 123 123 LYS N N 121.605 0.400 1 1672 123 123 LYS H H 8.400 0.020 1 1673 123 123 LYS CA C 59.243 0.400 1 1674 123 123 LYS HA H 4.025 0.020 1 1675 123 123 LYS CB C 32.306 0.400 1 1676 123 123 LYS HB2 H 1.934 0.020 2 1677 123 123 LYS HB3 H 1.914 0.020 2 1678 123 123 LYS CG C 25.679 0.400 1 1679 123 123 LYS HG2 H 1.575 0.020 2 1680 123 123 LYS HG3 H 1.698 0.020 2 1681 123 123 LYS CD C 29.286 0.400 1 1682 123 123 LYS HD2 H 1.843 0.020 2 1683 123 123 LYS HD3 H 1.748 0.020 2 1684 123 123 LYS CE C 41.780 0.400 1 1685 123 123 LYS HE2 H 3.013 0.020 2 1686 123 123 LYS HE3 H 3.009 0.020 2 1687 123 123 LYS C C 179.307 0.400 1 1688 124 124 ALA N N 121.873 0.400 1 1689 124 124 ALA H H 8.601 0.020 1 1690 124 124 ALA CA C 54.652 0.400 1 1691 124 124 ALA HA H 4.144 0.020 1 1692 124 124 ALA CB C 18.934 0.400 1 1693 124 124 ALA HB1 H 1.504 0.020 1 1694 124 124 ALA HB2 H 1.504 0.020 1 1695 124 124 ALA HB3 H 1.504 0.020 1 1696 124 124 ALA C C 179.112 0.400 1 1697 125 125 GLY N N 104.755 0.400 1 1698 125 125 GLY H H 7.949 0.020 1 1699 125 125 GLY CA C 46.291 0.400 1 1700 125 125 GLY HA2 H 4.052 0.020 2 1701 125 125 GLY HA3 H 4.063 0.020 2 1702 125 125 GLY C C 175.553 0.400 1 1703 126 126 SER N N 116.080 0.400 1 1704 126 126 SER H H 7.861 0.020 1 1705 126 126 SER CA C 59.965 0.400 1 1706 126 126 SER HA H 4.447 0.020 1 1707 126 126 SER CB C 63.460 0.400 1 1708 126 126 SER HB2 H 4.023 0.020 2 1709 126 126 SER HB3 H 4.030 0.020 2 1710 126 126 SER C C 175.504 0.400 1 1711 127 127 LEU N N 122.372 0.400 1 1712 127 127 LEU H H 7.882 0.020 1 1713 127 127 LEU CA C 56.217 0.400 1 1714 127 127 LEU HA H 4.282 0.020 1 1715 127 127 LEU CB C 42.073 0.400 1 1716 127 127 LEU HB2 H 1.933 0.020 2 1717 127 127 LEU HB3 H 1.613 0.020 2 1718 127 127 LEU CG C 26.770 0.400 1 1719 127 127 LEU HG H 1.858 0.020 1 1720 127 127 LEU CD1 C 25.524 0.400 1 1721 127 127 LEU HD11 H 1.012 0.020 2 1722 127 127 LEU HD12 H 1.012 0.020 2 1723 127 127 LEU HD13 H 1.012 0.020 2 1724 127 127 LEU CD2 C 22.960 0.400 1 1725 127 127 LEU HD21 H 0.931 0.020 2 1726 127 127 LEU HD22 H 0.931 0.020 2 1727 127 127 LEU HD23 H 0.931 0.020 2 1728 127 127 LEU C C 177.990 0.400 1 1729 128 128 GLU N N 119.775 0.400 1 1730 128 128 GLU H H 8.084 0.020 1 1731 128 128 GLU CA C 57.611 0.400 1 1732 128 128 GLU HA H 3.908 0.020 1 1733 128 128 GLU CB C 29.830 0.400 1 1734 128 128 GLU HB2 H 1.901 0.020 2 1735 128 128 GLU HB3 H 1.954 0.020 2 1736 128 128 GLU CG C 36.010 0.400 1 1737 128 128 GLU HG2 H 2.014 0.020 1 1738 128 128 GLU HG3 H 2.014 0.020 1 1739 131 131 HIS N N 125.272 0.400 1 1740 131 131 HIS H H 8.059 0.020 1 stop_ save_