data_nef_c25859_2n8r save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 7089 PDB 2N8R PDB 2poj stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 2 2 PRO C 2 3 HYP N 2 3 HYP C 2 4 GLY N 2 5 PRO C 2 6 HYP N 2 6 HYP C 2 7 GLY N 2 8 PRO C 2 9 HYP N 2 9 HYP C 2 10 GLY N 2 11 PRO C 2 12 HYP N 2 12 HYP C 2 13 GLY N 2 26 PRO C 2 27 HYP N 2 27 HYP C 2 28 GLY N 2 29 PRO C 2 30 HYP N 2 30 HYP C 2 31 GLY N 2 32 PRO C 2 33 HYP N 2 33 HYP C 2 34 GLY N 2 35 PRO C 2 36 HYP N 3 2 PRO C 3 3 HYP N 3 3 HYP C 3 4 GLY N 3 5 PRO C 3 6 HYP N 3 6 HYP C 3 7 GLY N 3 8 PRO C 3 9 HYP N 3 9 HYP C 3 10 GLY N 3 11 PRO C 3 12 HYP N 3 12 HYP C 3 13 GLY N 3 26 PRO C 3 27 HYP N 3 27 HYP C 3 28 GLY N 3 29 PRO C 3 30 HYP N 3 30 HYP C 3 31 GLY N 3 32 PRO C 3 33 HYP N 3 33 HYP C 3 34 GLY N 3 35 PRO C 3 36 HYP N 4 2 PRO C 4 3 HYP N 4 3 HYP C 4 4 GLY N 4 5 PRO C 4 6 HYP N 4 6 HYP C 4 7 GLY N 4 8 PRO C 4 9 HYP N 4 9 HYP C 4 10 GLY N 4 11 PRO C 4 12 HYP N 4 12 HYP C 4 13 GLY N 4 26 PRO C 4 27 HYP N 4 27 HYP C 4 28 GLY N 4 29 PRO C 4 30 HYP N 4 30 HYP C 4 31 GLY N 4 32 PRO C 4 33 HYP N 4 33 HYP C 4 34 GLY N 4 35 PRO C 4 36 HYP N 1 71 ASP OD1 5 2 ZN ZN 5 1 ZN ZN . . . . 4 16 GLY O 5 1 ZN ZN 4 15 PRO O 5 1 ZN ZN 1 69 HIS NE2 5 2 ZN ZN 1 84 HIS NE2 5 2 ZN ZN 1 97 HIS ND1 5 2 ZN ZN 1 119 HIS NE2 5 1 ZN ZN 1 123 HIS NE2 5 1 ZN ZN 1 129 HIS NE2 5 1 ZN ZN 1 71 ASP OD2 5 2 ZN ZN 1 25 ASP OD2 6 3 CA CA 1 102 GLU OE2 6 1 CA CA 1 25 ASP OD1 6 3 CA CA 1 95 ASP OD1 6 2 CA CA 1 59 ASP O 6 2 CA CA 1 100 GLU OE2 6 3 CA CA 1 79 GLY O 6 1 CA CA 1 91 GLY O 6 2 CA CA 1 81 ILE O 6 1 CA CA 1 76 ASP OD1 6 1 CA CA 1 77 GLY O 6 1 CA CA 1 99 ASP OD2 6 1 CA CA 1 102 GLU O 6 3 CA CA 1 93 GLY O 6 2 CA CA 1 100 GLU O 6 3 CA CA stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 100 PHE start . . 2 A 101 ARG middle . . 3 A 102 GLU middle . . 4 A 103 MET middle . . 5 A 104 PRO middle . false 6 A 105 GLY middle . false 7 A 106 GLY middle . false 8 A 107 PRO middle . false 9 A 108 VAL middle . . 10 A 109 TRP middle . . 11 A 110 ARG middle . . 12 A 111 LYS middle . . 13 A 112 HIS middle . . 14 A 113 TYR middle . . 15 A 114 ILE middle . . 16 A 115 THR middle . . 17 A 116 TYR middle . . 18 A 117 ARG middle . . 19 A 118 ILE middle . . 20 A 119 ASN middle . . 21 A 120 ASN middle . . 22 A 121 TYR middle . . 23 A 122 THR middle . . 24 A 123 PRO middle . false 25 A 124 ASP middle . . 26 A 125 MET middle . . 27 A 126 ASN middle . . 28 A 127 ARG middle . . 29 A 128 GLU middle . . 30 A 129 ASP middle . . 31 A 130 VAL middle . . 32 A 131 ASP middle . . 33 A 132 TYR middle . . 34 A 133 ALA middle . . 35 A 134 ILE middle . . 36 A 135 ARG middle . . 37 A 136 LYS middle . . 38 A 137 ALA middle . . 39 A 138 PHE middle . . 40 A 139 GLN middle . . 41 A 140 VAL middle . . 42 A 141 TRP middle . . 43 A 142 SER middle . . 44 A 143 ASN middle . . 45 A 144 VAL middle . . 46 A 145 THR middle . . 47 A 146 PRO middle . false 48 A 147 LEU middle . . 49 A 148 LYS middle . . 50 A 149 PHE middle . . 51 A 150 SER middle . . 52 A 151 LYS middle . . 53 A 152 ILE middle . . 54 A 153 ASN middle . . 55 A 154 THR middle . . 56 A 155 GLY middle . false 57 A 156 MET middle . . 58 A 157 ALA middle . . 59 A 158 ASP middle . . 60 A 159 ILE middle . . 61 A 160 LEU middle . . 62 A 161 VAL middle . . 63 A 162 VAL middle . . 64 A 163 PHE middle . . 65 A 164 ALA middle . . 66 A 165 ARG middle . . 67 A 166 GLY middle . false 68 A 167 ALA middle . . 69 A 168 HIS middle -HE2 . 70 A 169 GLY middle . false 71 A 170 ASP middle . . 72 A 171 PHE middle . . 73 A 172 HIS middle . . 74 A 173 ALA middle . . 75 A 174 PHE middle . . 76 A 175 ASP middle . . 77 A 176 GLY middle . false 78 A 177 LYS middle . . 79 A 178 GLY middle . false 80 A 179 GLY middle . false 81 A 180 ILE middle . . 82 A 181 LEU middle . . 83 A 182 ALA middle . . 84 A 183 HIS middle -HE2 . 85 A 184 ALA middle . . 86 A 185 PHE middle . . 87 A 186 GLY middle . false 88 A 187 PRO middle . false 89 A 188 GLY middle . false 90 A 189 SER middle . . 91 A 190 GLY middle . false 92 A 191 ILE middle . . 93 A 192 GLY middle . false 94 A 193 GLY middle . false 95 A 194 ASP middle . . 96 A 195 ALA middle . . 97 A 196 HIS middle -HD1 . 98 A 197 PHE middle . . 99 A 198 ASP middle . . 100 A 199 GLU middle . . 101 A 200 ASP middle . . 102 A 201 GLU middle . . 103 A 202 PHE middle . . 104 A 203 TRP middle . . 105 A 204 THR middle . . 106 A 205 THR middle . . 107 A 206 HIS middle . . 108 A 207 SER middle . . 109 A 208 GLY middle . false 110 A 209 GLY middle . false 111 A 210 THR middle . . 112 A 211 ASN middle . . 113 A 212 LEU middle . . 114 A 213 PHE middle . . 115 A 214 LEU middle . . 116 A 215 THR middle . . 117 A 216 ALA middle . . 118 A 217 VAL middle . . 119 A 218 HIS middle -HE2 . 120 A 219 GLU middle . . 121 A 220 ILE middle . . 122 A 221 GLY middle . false 123 A 222 HIS middle -HE2 . 124 A 223 SER middle . . 125 A 224 LEU middle . . 126 A 225 GLY middle . false 127 A 226 LEU middle . . 128 A 227 GLY middle . false 129 A 228 HIS middle -HE2 . 130 A 229 SER middle . . 131 A 230 SER middle . . 132 A 231 ASP middle . . 133 A 232 PRO middle . false 134 A 233 LYS middle . . 135 A 234 ALA middle . . 136 A 235 VAL middle . . 137 A 236 MET middle . . 138 A 237 PHE middle . . 139 A 238 PRO middle . false 140 A 239 THR middle . . 141 A 240 TYR middle . . 142 A 241 LYS middle . . 143 A 242 TYR middle . . 144 A 243 VAL middle . . 145 A 244 ASP middle . . 146 A 245 ILE middle . . 147 A 246 ASN middle . . 148 A 247 THR middle . . 149 A 248 PHE middle . . 150 A 249 ARG middle . . 151 A 250 LEU middle . . 152 A 251 SER middle . . 153 A 252 ALA middle . . 154 A 253 ASP middle . . 155 A 254 ASP middle . . 156 A 255 ILE middle . . 157 A 256 ARG middle . . 158 A 257 GLY middle . false 159 A 258 ILE middle . . 160 A 259 GLN middle . . 161 A 260 SER middle . . 162 A 261 LEU middle . . 163 A 262 TYR middle . . 164 A 263 GLY end . false 165 B 1 GLY start . false 166 B 2 PRO middle . false 167 B 3 HYP middle . . 168 B 4 GLY middle . false 169 B 5 PRO middle . false 170 B 6 HYP middle . . 171 B 7 GLY middle . false 172 B 8 PRO middle . false 173 B 9 HYP middle . . 174 B 10 GLY middle . false 175 B 11 PRO middle . false 176 B 12 HYP middle . . 177 B 13 GLY middle . false 178 B 14 PRO middle . false 179 B 15 PRO middle . false 180 B 16 GLY middle . false 181 B 17 VAL middle . . 182 B 18 VAL middle . . 183 B 19 GLY middle . false 184 B 20 GLU middle . . 185 B 21 GLN middle . . 186 B 22 GLY middle . false 187 B 23 GLU middle . . 188 B 24 GLN middle . . 189 B 25 GLY middle . false 190 B 26 PRO middle . false 191 B 27 HYP middle . . 192 B 28 GLY middle . false 193 B 29 PRO middle . false 194 B 30 HYP middle . . 195 B 31 GLY middle . false 196 B 32 PRO middle . false 197 B 33 HYP middle . . 198 B 34 GLY middle . false 199 B 35 PRO middle . false 200 B 36 HYP end . . 201 C 37 GLY start . false 202 C 38 PRO middle . false 203 C 39 HYP middle . . 204 C 40 GLY middle . false 205 C 41 PRO middle . false 206 C 42 HYP middle . . 207 C 43 GLY middle . false 208 C 44 PRO middle . false 209 C 45 HYP middle . . 210 C 46 GLY middle . false 211 C 47 PRO middle . false 212 C 48 HYP middle . . 213 C 49 GLY middle . false 214 C 50 PRO middle . false 215 C 51 PRO middle . false 216 C 52 GLY middle . false 217 C 53 VAL middle . . 218 C 54 VAL middle . . 219 C 55 GLY middle . false 220 C 56 GLU middle . . 221 C 57 GLN middle . . 222 C 58 GLY middle . false 223 C 59 GLU middle . . 224 C 60 GLN middle . . 225 C 61 GLY middle . false 226 C 62 PRO middle . false 227 C 63 HYP middle . . 228 C 64 GLY middle . false 229 C 65 PRO middle . false 230 C 66 HYP middle . . 231 C 67 GLY middle . false 232 C 68 PRO middle . false 233 C 69 HYP middle . . 234 C 70 GLY middle . false 235 C 71 PRO middle . false 236 C 72 HYP end . . 237 D 73 GLY start . false 238 D 74 PRO middle . false 239 D 75 HYP middle . . 240 D 76 GLY middle . false 241 D 77 PRO middle . false 242 D 78 HYP middle . . 243 D 79 GLY middle . false 244 D 80 PRO middle . false 245 D 81 HYP middle . . 246 D 82 GLY middle . false 247 D 83 PRO middle . false 248 D 84 HYP middle . . 249 D 85 GLY middle . false 250 D 86 PRO middle . false 251 D 87 PRO middle . false 252 D 88 GLY middle . false 253 D 89 VAL middle . . 254 D 90 VAL middle . . 255 D 91 GLY middle . false 256 D 92 GLU middle . . 257 D 93 GLN middle . . 258 D 94 GLY middle . false 259 D 95 GLU middle . . 260 D 96 GLN middle . . 261 D 97 GLY middle . false 262 D 98 PRO middle . false 263 D 99 HYP middle . . 264 D 100 GLY middle . false 265 D 101 PRO middle . false 266 D 102 HYP middle . . 267 D 103 GLY middle . false 268 D 104 PRO middle . false 269 D 105 HYP middle . . 270 D 106 GLY middle . false 271 D 107 PRO middle . false 272 D 108 HYP end . . 273 F 1 ZN . . . 274 F 2 ZN . . . 275 E 1 CA . . . 276 E 2 CA . . . 277 E 3 CA . . . stop_ save_ save_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode chem_shift_list_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 101 ARG H H 1 9.060 0.04 A 101 ARG HA H 1 4.550 0.04 A 101 ARG HBy H 1 1.820 0.04 A 101 ARG HDy H 1 3.110 0.04 A 101 ARG HGx H 1 1.670 0.04 A 101 ARG C C 13 175.600 0.30 A 101 ARG CA C 13 57.880 0.30 A 101 ARG CB C 13 29.530 0.30 A 101 ARG CD C 13 41.500 0.30 A 101 ARG CG C 13 26.900 0.30 A 101 ARG N N 15 118.080 0.40 A 102 GLU H H 1 8.950 0.04 A 102 GLU HA H 1 4.220 0.04 A 102 GLU HBy H 1 1.570 0.04 A 102 GLU HGy H 1 2.360 0.04 A 102 GLU C C 13 173.300 0.30 A 102 GLU CA C 13 61.720 0.30 A 102 GLU CB C 13 35.300 0.30 A 102 GLU CG C 13 39.600 0.30 A 102 GLU N N 15 124.230 0.40 A 103 MET H H 1 7.620 0.04 A 103 MET HA H 1 4.690 0.04 A 103 MET HBy H 1 1.690 0.04 A 103 MET HBx H 1 1.470 0.04 A 103 MET CA C 13 53.600 0.30 A 103 MET CE C 13 19.000 0.30 A 103 MET N N 15 130.090 0.40 A 104 PRO HA H 1 4.350 0.04 A 104 PRO HBy H 1 2.310 0.04 A 104 PRO HDy H 1 3.700 0.04 A 104 PRO HGy H 1 1.990 0.04 A 104 PRO C C 13 177.400 0.30 A 104 PRO CA C 13 63.540 0.30 A 104 PRO CB C 13 32.450 0.30 A 104 PRO CD C 13 47.600 0.30 A 104 PRO CG C 13 27.400 0.30 A 105 GLY H H 1 8.420 0.04 A 105 GLY HAx H 1 3.920 0.04 A 105 GLY HAy H 1 4.380 0.04 A 105 GLY CA C 13 45.360 0.30 A 105 GLY N N 15 109.410 0.40 A 106 GLY H H 1 7.960 0.04 A 106 GLY HAx H 1 3.890 0.04 A 106 GLY HAy H 1 4.090 0.04 A 106 GLY CA C 13 44.490 0.30 A 106 GLY N N 15 108.230 0.40 A 107 PRO HA H 1 3.830 0.04 A 107 PRO HBy H 1 2.220 0.04 A 107 PRO HBx H 1 2.000 0.04 A 107 PRO HDy H 1 3.600 0.04 A 107 PRO HDx H 1 3.490 0.04 A 107 PRO HGy H 1 1.750 0.04 A 107 PRO CA C 13 64.520 0.30 A 107 PRO CB C 13 35.000 0.30 A 108 VAL H H 1 7.010 0.04 A 108 VAL HA H 1 4.630 0.04 A 108 VAL HB H 1 1.740 0.04 A 108 VAL HGx% H 1 0.690 0.04 A 108 VAL HGy% H 1 0.600 0.04 A 108 VAL CA C 13 59.040 0.30 A 108 VAL N N 15 109.090 0.40 A 109 TRP HBy H 1 2.950 0.04 A 109 TRP HBx H 1 2.810 0.04 A 109 TRP HD1 H 1 7.200 0.04 A 109 TRP HE1 H 1 10.100 0.04 A 109 TRP HE3 H 1 7.800 0.04 A 109 TRP HH2 H 1 7.190 0.04 A 109 TRP HZ2 H 1 7.430 0.04 A 109 TRP CB C 13 27.000 0.30 A 109 TRP CD1 C 13 122.500 0.30 A 109 TRP CE3 C 13 119.000 0.30 A 109 TRP CH2 C 13 122.300 0.30 A 109 TRP CZ2 C 13 112.000 0.30 A 109 TRP NE1 N 15 130.000 0.40 A 110 ARG H H 1 8.550 0.04 A 110 ARG HA H 1 4.560 0.04 A 110 ARG HBy H 1 1.720 0.04 A 110 ARG HDy H 1 3.170 0.04 A 110 ARG HDx H 1 2.970 0.04 A 110 ARG HGx H 1 1.560 0.04 A 110 ARG C C 13 176.500 0.30 A 110 ARG CA C 13 55.600 0.30 A 110 ARG CB C 13 28.800 0.30 A 110 ARG CD C 13 43.300 0.30 A 110 ARG CG C 13 27.300 0.30 A 110 ARG N N 15 118.180 0.40 A 111 LYS H H 1 7.530 0.04 A 111 LYS HA H 1 4.540 0.04 A 111 LYS HBy H 1 2.130 0.04 A 111 LYS HBx H 1 1.970 0.04 A 111 LYS HDx H 1 1.750 0.04 A 111 LYS HEx H 1 3.470 0.04 A 111 LYS HGy H 1 1.400 0.04 A 111 LYS HGx H 1 1.190 0.04 A 111 LYS C C 13 174.100 0.30 A 111 LYS CA C 13 54.530 0.30 A 111 LYS CB C 13 26.800 0.30 A 111 LYS CD C 13 27.600 0.30 A 111 LYS CG C 13 22.500 0.30 A 111 LYS N N 15 115.550 0.40 A 112 HIS H H 1 8.390 0.04 A 112 HIS HA H 1 4.820 0.04 A 112 HIS HBx H 1 2.800 0.04 A 112 HIS HBy H 1 3.310 0.04 A 112 HIS HD2 H 1 6.680 0.04 A 112 HIS HE1 H 1 8.110 0.04 A 112 HIS C C 13 173.300 0.30 A 112 HIS CA C 13 54.600 0.30 A 112 HIS CB C 13 31.500 0.30 A 112 HIS CD2 C 13 114.300 0.30 A 112 HIS CE1 C 13 136.300 0.30 A 112 HIS N N 15 114.390 0.40 A 113 TYR H H 1 7.000 0.04 A 113 TYR HA H 1 4.540 0.04 A 113 TYR HBx H 1 2.740 0.04 A 113 TYR HBy H 1 2.860 0.04 A 113 TYR HD2 H 1 7.170 0.04 A 113 TYR HE2 H 1 6.690 0.04 A 113 TYR C C 13 173.900 0.30 A 113 TYR CA C 13 56.850 0.30 A 113 TYR CB C 13 38.640 0.30 A 113 TYR CD2 C 13 131.100 0.30 A 113 TYR CE2 C 13 116.100 0.30 A 113 TYR N N 15 120.160 0.40 A 114 ILE H H 1 8.320 0.04 A 114 ILE HA H 1 4.180 0.04 A 114 ILE HB H 1 2.220 0.04 A 114 ILE HD1% H 1 0.420 0.04 A 114 ILE HG1x H 1 1.100 0.04 A 114 ILE HG1y H 1 1.370 0.04 A 114 ILE HG2% H 1 0.750 0.04 A 114 ILE C C 13 175.400 0.30 A 114 ILE CA C 13 59.030 0.30 A 114 ILE CB C 13 40.830 0.30 A 114 ILE CG1 C 13 27.900 0.30 A 114 ILE CG2 C 13 17.000 0.30 A 114 ILE N N 15 128.600 0.40 A 115 THR H H 1 9.270 0.04 A 115 THR HA H 1 5.320 0.04 A 115 THR HB H 1 4.110 0.04 A 115 THR HG2% H 1 1.100 0.04 A 115 THR C C 13 174.600 0.30 A 115 THR CA C 13 58.900 0.30 A 115 THR CB C 13 72.400 0.30 A 115 THR CG2 C 13 22.100 0.30 A 115 THR N N 15 117.430 0.40 A 116 TYR H H 1 8.660 0.04 A 116 TYR HA H 1 5.860 0.04 A 116 TYR HBx H 1 2.330 0.04 A 116 TYR HBy H 1 2.960 0.04 A 116 TYR HD2 H 1 6.890 0.04 A 116 TYR HE2 H 1 6.850 0.04 A 116 TYR C C 13 171.900 0.30 A 116 TYR CA C 13 55.190 0.30 A 116 TYR CB C 13 43.640 0.30 A 116 TYR CD2 C 13 129.600 0.30 A 116 TYR CE2 C 13 116.200 0.30 A 116 TYR N N 15 117.440 0.40 A 117 ARG H H 1 8.360 0.04 A 117 ARG HA H 1 4.700 0.04 A 117 ARG HBy H 1 1.770 0.04 A 117 ARG HDy H 1 3.030 0.04 A 117 ARG HGx H 1 1.530 0.04 A 117 ARG C C 13 174.200 0.30 A 117 ARG CA C 13 54.740 0.30 A 117 ARG CB C 13 35.790 0.30 A 117 ARG CD C 13 43.900 0.30 A 117 ARG CG C 13 27.000 0.30 A 117 ARG N N 15 119.030 0.40 A 118 ILE H H 1 9.180 0.04 A 118 ILE HA H 1 4.340 0.04 A 118 ILE HB H 1 2.170 0.04 A 118 ILE HD1% H 1 0.870 0.04 A 118 ILE HG1x H 1 1.570 0.04 A 118 ILE HG1y H 1 1.760 0.04 A 118 ILE HG2% H 1 0.990 0.04 A 118 ILE C C 13 175.200 0.30 A 118 ILE CA C 13 61.550 0.30 A 118 ILE CB C 13 37.120 0.30 A 118 ILE CG1 C 13 28.000 0.30 A 118 ILE CG2 C 13 16.900 0.30 A 118 ILE N N 15 127.200 0.40 A 119 ASN H H 1 9.690 0.04 A 119 ASN HA H 1 4.340 0.04 A 119 ASN HBx H 1 2.530 0.04 A 119 ASN HBy H 1 3.090 0.04 A 119 ASN HD2y H 1 7.600 0.04 A 119 ASN HD2x H 1 6.990 0.04 A 119 ASN C C 13 173.900 0.30 A 119 ASN CA C 13 56.530 0.30 A 119 ASN CB C 13 41.990 0.30 A 119 ASN N N 15 128.510 0.40 A 119 ASN ND2 N 15 111.400 0.40 A 120 ASN H H 1 7.820 0.04 A 120 ASN HA H 1 4.670 0.04 A 120 ASN HBy H 1 3.080 0.04 A 120 ASN HBx H 1 2.940 0.04 A 120 ASN HD2y H 1 7.540 0.04 A 120 ASN HD2x H 1 7.050 0.04 A 120 ASN C C 13 169.800 0.30 A 120 ASN CA C 13 52.080 0.30 A 120 ASN CB C 13 39.030 0.30 A 120 ASN N N 15 113.290 0.40 A 120 ASN ND2 N 15 114.200 0.40 A 121 TYR H H 1 8.580 0.04 A 121 TYR HA H 1 4.110 0.04 A 121 TYR HBx H 1 2.600 0.04 A 121 TYR HBy H 1 2.850 0.04 A 121 TYR HD2 H 1 6.950 0.04 A 121 TYR HE2 H 1 6.850 0.04 A 121 TYR C C 13 176.300 0.30 A 121 TYR CA C 13 58.650 0.30 A 121 TYR CB C 13 41.170 0.30 A 121 TYR CD2 C 13 131.200 0.30 A 121 TYR CE2 C 13 115.900 0.30 A 121 TYR N N 15 114.590 0.40 A 123 PRO HA H 1 4.640 0.04 A 123 PRO HBx H 1 2.110 0.04 A 123 PRO HBy H 1 2.250 0.04 A 123 PRO HDy H 1 3.590 0.04 A 123 PRO HDx H 1 3.420 0.04 A 123 PRO HGx H 1 1.930 0.04 A 123 PRO HGy H 1 2.070 0.04 A 123 PRO CA C 13 63.000 0.30 A 123 PRO CB C 13 32.000 0.30 A 123 PRO CD C 13 49.900 0.30 A 123 PRO CG C 13 27.300 0.30 A 124 ASP H H 1 8.830 0.04 A 124 ASP HA H 1 4.100 0.04 A 124 ASP HBx H 1 2.550 0.04 A 124 ASP HBy H 1 2.760 0.04 A 124 ASP C C 13 175.900 0.30 A 124 ASP CA C 13 56.180 0.30 A 124 ASP CB C 13 41.800 0.30 A 124 ASP N N 15 121.860 0.40 A 125 MET H H 1 6.970 0.04 A 125 MET HA H 1 4.620 0.04 A 125 MET HBx H 1 1.770 0.04 A 125 MET HBy H 1 2.090 0.04 A 125 MET HE% H 1 1.400 0.04 A 125 MET HGx H 1 2.270 0.04 A 125 MET C C 13 174.900 0.30 A 125 MET CA C 13 53.650 0.30 A 125 MET CB C 13 39.350 0.30 A 125 MET CE C 13 20.800 0.30 A 125 MET CG C 13 31.900 0.30 A 125 MET N N 15 113.330 0.40 A 126 ASN H H 1 8.930 0.04 A 126 ASN HA H 1 4.610 0.04 A 126 ASN HBy H 1 2.860 0.04 A 126 ASN HBx H 1 2.620 0.04 A 126 ASN HD2y H 1 7.470 0.04 A 126 ASN HD2x H 1 6.840 0.04 A 126 ASN C C 13 177.300 0.30 A 126 ASN CA C 13 53.500 0.30 A 126 ASN CB C 13 38.650 0.30 A 126 ASN N N 15 118.800 0.40 A 126 ASN ND2 N 15 112.100 0.40 A 127 ARG H H 1 8.980 0.04 A 127 ARG HA H 1 4.760 0.04 A 127 ARG HBx H 1 1.360 0.04 A 127 ARG HBy H 1 1.460 0.04 A 127 ARG HDy H 1 3.760 0.04 A 127 ARG HGy H 1 1.000 0.04 A 127 ARG C C 13 178.000 0.30 A 127 ARG CA C 13 60.530 0.30 A 127 ARG CB C 13 30.250 0.30 A 127 ARG CD C 13 43.600 0.30 A 127 ARG CG C 13 26.600 0.30 A 127 ARG N N 15 126.020 0.40 A 128 GLU H H 1 9.090 0.04 A 128 GLU HA H 1 4.130 0.04 A 128 GLU HBx H 1 1.940 0.04 A 128 GLU HBy H 1 2.000 0.04 A 128 GLU HGy H 1 2.330 0.04 A 128 GLU C C 13 179.400 0.30 A 128 GLU CA C 13 59.700 0.30 A 128 GLU CB C 13 28.800 0.30 A 128 GLU CG C 13 36.300 0.30 A 128 GLU N N 15 116.400 0.40 A 129 ASP H H 1 7.500 0.04 A 129 ASP HA H 1 4.660 0.04 A 129 ASP HBy H 1 2.860 0.04 A 129 ASP HBx H 1 2.630 0.04 A 129 ASP C C 13 179.200 0.30 A 129 ASP CA C 13 57.230 0.30 A 129 ASP CB C 13 41.800 0.30 A 129 ASP N N 15 119.790 0.40 A 130 VAL H H 1 7.790 0.04 A 130 VAL HA H 1 4.130 0.04 A 130 VAL HB H 1 2.320 0.04 A 130 VAL HGx% H 1 0.990 0.04 A 130 VAL HGy% H 1 0.800 0.04 A 130 VAL C C 13 177.400 0.30 A 130 VAL CA C 13 66.960 0.30 A 130 VAL CB C 13 31.450 0.30 A 130 VAL CG1 C 13 24.100 0.30 A 130 VAL CG2 C 13 21.500 0.30 A 130 VAL N N 15 123.990 0.40 A 131 ASP H H 1 8.420 0.04 A 131 ASP HA H 1 4.360 0.04 A 131 ASP HBx H 1 2.630 0.04 A 131 ASP HBy H 1 2.820 0.04 A 131 ASP C C 13 179.700 0.30 A 131 ASP CA C 13 58.080 0.30 A 131 ASP CB C 13 40.600 0.30 A 131 ASP N N 15 118.590 0.40 A 132 TYR H H 1 8.230 0.04 A 132 TYR HA H 1 4.200 0.04 A 132 TYR HBy H 1 3.310 0.04 A 132 TYR HBx H 1 3.120 0.04 A 132 TYR HD2 H 1 6.970 0.04 A 132 TYR HE2 H 1 6.730 0.04 A 132 TYR C C 13 176.300 0.30 A 132 TYR CA C 13 61.720 0.30 A 132 TYR CB C 13 38.860 0.30 A 132 TYR CD2 C 13 131.100 0.30 A 132 TYR CE2 C 13 116.120 0.30 A 132 TYR N N 15 119.720 0.40 A 133 ALA H H 1 8.080 0.04 A 133 ALA HA H 1 3.920 0.04 A 133 ALA HB% H 1 1.500 0.04 A 133 ALA C C 13 179.400 0.30 A 133 ALA CA C 13 55.720 0.30 A 133 ALA CB C 13 18.800 0.30 A 133 ALA N N 15 121.470 0.40 A 134 ILE H H 1 8.090 0.04 A 134 ILE HA H 1 3.530 0.04 A 134 ILE HB H 1 2.170 0.04 A 134 ILE HD1% H 1 0.320 0.04 A 134 ILE HG1x H 1 1.500 0.04 A 134 ILE HG1y H 1 1.640 0.04 A 134 ILE HG2% H 1 0.780 0.04 A 134 ILE C C 13 177.300 0.30 A 134 ILE CA C 13 62.220 0.30 A 134 ILE CB C 13 35.740 0.30 A 134 ILE CG1 C 13 27.600 0.30 A 134 ILE CG2 C 13 19.100 0.30 A 134 ILE N N 15 114.080 0.40 A 135 ARG H H 1 8.290 0.04 A 135 ARG HA H 1 4.130 0.04 A 135 ARG HBy H 1 2.060 0.04 A 135 ARG HBx H 1 1.780 0.04 A 135 ARG HDy H 1 3.330 0.04 A 135 ARG HGx H 1 1.520 0.04 A 135 ARG HGy H 1 1.620 0.04 A 135 ARG C C 13 179.800 0.30 A 135 ARG CA C 13 60.310 0.30 A 135 ARG CB C 13 30.540 0.30 A 135 ARG CD C 13 44.100 0.30 A 135 ARG CG C 13 27.200 0.30 A 135 ARG N N 15 119.830 0.40 A 136 LYS H H 1 8.550 0.04 A 136 LYS HA H 1 3.910 0.04 A 136 LYS HBy H 1 2.510 0.04 A 136 LYS HBx H 1 2.270 0.04 A 136 LYS HDy H 1 1.540 0.04 A 136 LYS HEx H 1 2.920 0.04 A 136 LYS HGx H 1 1.290 0.04 A 136 LYS C C 13 178.700 0.30 A 136 LYS CA C 13 58.400 0.30 A 136 LYS CB C 13 31.560 0.30 A 136 LYS CD C 13 28.100 0.30 A 136 LYS CE C 13 41.800 0.30 A 136 LYS CG C 13 24.700 0.30 A 136 LYS N N 15 119.290 0.40 A 137 ALA H H 1 8.000 0.04 A 137 ALA HA H 1 3.920 0.04 A 137 ALA HB% H 1 1.100 0.04 A 137 ALA C C 13 178.600 0.30 A 137 ALA CA C 13 55.650 0.30 A 137 ALA CB C 13 19.000 0.30 A 137 ALA N N 15 123.200 0.40 A 138 PHE H H 1 7.720 0.04 A 138 PHE HA H 1 3.750 0.04 A 138 PHE HBx H 1 2.270 0.04 A 138 PHE HBy H 1 2.580 0.04 A 138 PHE HD2 H 1 5.600 0.04 A 138 PHE HE2 H 1 5.900 0.04 A 138 PHE HZ H 1 6.400 0.04 A 138 PHE C C 13 178.700 0.30 A 138 PHE CA C 13 63.890 0.30 A 138 PHE CB C 13 38.670 0.30 A 138 PHE CD2 C 13 129.200 0.30 A 138 PHE CE2 C 13 127.800 0.30 A 138 PHE CZ C 13 124.000 0.30 A 138 PHE N N 15 113.900 0.40 A 139 GLN H H 1 8.110 0.04 A 139 GLN HA H 1 4.190 0.04 A 139 GLN HBy H 1 2.280 0.04 A 139 GLN HBx H 1 2.070 0.04 A 139 GLN HE2x H 1 6.920 0.04 A 139 GLN HE2y H 1 7.620 0.04 A 139 GLN HGy H 1 2.580 0.04 A 139 GLN HGx H 1 2.460 0.04 A 139 GLN C C 13 177.900 0.30 A 139 GLN CA C 13 58.540 0.30 A 139 GLN CB C 13 28.820 0.30 A 139 GLN CG C 13 34.100 0.30 A 139 GLN N N 15 119.100 0.40 A 139 GLN NE2 N 15 112.600 0.40 A 140 VAL H H 1 7.700 0.04 A 140 VAL HA H 1 3.630 0.04 A 140 VAL HB H 1 2.060 0.04 A 140 VAL HGx% H 1 1.120 0.04 A 140 VAL HGy% H 1 0.470 0.04 A 140 VAL C C 13 178.200 0.30 A 140 VAL CA C 13 66.070 0.30 A 140 VAL CB C 13 31.300 0.30 A 140 VAL CG1 C 13 21.700 0.30 A 140 VAL CG2 C 13 23.100 0.30 A 140 VAL N N 15 117.170 0.40 A 141 TRP H H 1 6.730 0.04 A 141 TRP HA H 1 4.370 0.04 A 141 TRP HBx H 1 3.070 0.04 A 141 TRP HBy H 1 3.190 0.04 A 141 TRP HD1 H 1 7.360 0.04 A 141 TRP HE1 H 1 9.920 0.04 A 141 TRP HE3 H 1 6.70 0.04 A 141 TRP HH2 H 1 6.380 0.04 A 141 TRP HZ2 H 1 6.950 0.04 A 141 TRP HZ3 H 1 6.870 0.04 A 141 TRP C C 13 180.700 0.30 A 141 TRP CA C 13 58.590 0.30 A 141 TRP CB C 13 30.420 0.30 A 141 TRP CD1 C 13 120.700 0.30 A 141 TRP CE3 C 13 119.00 0.30 A 141 TRP CH2 C 13 128.00 0.30 A 141 TRP CZ2 C 13 114.200 0.30 A 141 TRP CZ3 C 13 126.00 0.30 A 141 TRP N N 15 116.910 0.40 A 141 TRP NE1 N 15 127.600 0.40 A 142 SER H H 1 9.080 0.04 A 142 SER HA H 1 4.370 0.04 A 142 SER HBx H 1 4.190 0.04 A 142 SER C C 13 175.700 0.30 A 142 SER CA C 13 61.490 0.30 A 142 SER CB C 13 63.720 0.30 A 142 SER N N 15 118.490 0.40 A 143 ASN H H 1 7.970 0.04 A 143 ASN HA H 1 4.730 0.04 A 143 ASN HBx H 1 2.840 0.04 A 143 ASN HBy H 1 2.990 0.04 A 143 ASN HD2y H 1 7.960 0.04 A 143 ASN HD2x H 1 6.910 0.04 A 143 ASN C C 13 176.700 0.30 A 143 ASN CA C 13 55.040 0.30 A 143 ASN CB C 13 39.210 0.30 A 143 ASN N N 15 115.220 0.40 A 143 ASN ND2 N 15 114.400 0.40 A 144 VAL H H 1 7.170 0.04 A 144 VAL HA H 1 4.860 0.04 A 144 VAL HB H 1 2.680 0.04 A 144 VAL HGx% H 1 1.160 0.04 A 144 VAL HGy% H 1 0.940 0.04 A 144 VAL C C 13 174.600 0.30 A 144 VAL CA C 13 60.440 0.30 A 144 VAL CB C 13 32.940 0.30 A 144 VAL CG1 C 13 19.200 0.30 A 144 VAL CG2 C 13 21.700 0.30 A 144 VAL N N 15 106.340 0.40 A 145 THR H H 1 7.490 0.04 A 145 THR HA H 1 4.370 0.04 A 145 THR HB H 1 4.010 0.04 A 145 THR HG2% H 1 1.450 0.04 A 145 THR C C 13 173.400 0.30 A 145 THR CA C 13 59.760 0.30 A 145 THR CB C 13 72.630 0.30 A 145 THR N N 15 110.440 0.40 A 146 PRO HA H 1 4.370 0.04 A 146 PRO HBy H 1 2.740 0.04 A 146 PRO HDx H 1 3.310 0.04 A 146 PRO HDy H 1 3.710 0.04 A 146 PRO HGy H 1 2.100 0.04 A 146 PRO HGx H 1 1.970 0.04 A 146 PRO C C 13 176.100 0.30 A 146 PRO CA C 13 62.370 0.30 A 146 PRO CB C 13 31.100 0.30 A 146 PRO CD C 13 50.700 0.30 A 146 PRO CG C 13 26.800 0.30 A 147 LEU H H 1 7.010 0.04 A 147 LEU HA H 1 4.140 0.04 A 147 LEU HBx H 1 1.330 0.04 A 147 LEU HBy H 1 1.440 0.04 A 147 LEU HDx% H 1 0.470 0.04 A 147 LEU HDy% H 1 0.270 0.04 A 147 LEU HG H 1 1.100 0.04 A 147 LEU C C 13 176.300 0.30 A 147 LEU CA C 13 54.930 0.30 A 147 LEU CB C 13 43.230 0.30 A 147 LEU CD1 C 13 22.000 0.30 A 147 LEU CD2 C 13 25.200 0.30 A 147 LEU CG C 13 27.400 0.30 A 147 LEU N N 15 116.360 0.40 A 148 LYS H H 1 8.250 0.04 A 148 LYS HA H 1 4.270 0.04 A 148 LYS HBx H 1 1.620 0.04 A 148 LYS HDx H 1 1.390 0.04 A 148 LYS HEx H 1 3.310 0.04 A 148 LYS HGx H 1 1.270 0.04 A 148 LYS C C 13 175.500 0.30 A 148 LYS CA C 13 54.300 0.30 A 148 LYS CB C 13 35.400 0.30 A 148 LYS CD C 13 28.900 0.30 A 148 LYS CE C 13 42.500 0.30 A 148 LYS CG C 13 24.700 0.30 A 148 LYS N N 15 122.800 0.40 A 149 PHE H H 1 8.240 0.04 A 149 PHE HA H 1 5.700 0.04 A 149 PHE HBx H 1 2.210 0.04 A 149 PHE HBy H 1 2.530 0.04 A 149 PHE HD1 H 1 7.160 0.04 A 149 PHE HE1 H 1 7.040 0.04 A 149 PHE HZ H 1 6.800 0.04 A 149 PHE C C 13 176.600 0.30 A 149 PHE CA C 13 55.700 0.30 A 149 PHE CB C 13 42.070 0.30 A 149 PHE CD1 C 13 131.400 0.30 A 149 PHE CE1 C 13 130.300 0.30 A 149 PHE CZ C 13 126.600 0.30 A 149 PHE N N 15 119.370 0.40 A 150 SER H H 1 8.100 0.04 A 150 SER HA H 1 4.620 0.04 A 150 SER HBx H 1 3.430 0.04 A 150 SER HBy H 1 3.540 0.04 A 150 SER C C 13 171.100 0.30 A 150 SER CA C 13 56.870 0.30 A 150 SER CB C 13 65.800 0.30 A 150 SER N N 15 116.770 0.40 A 151 LYS H H 1 8.150 0.04 A 151 LYS HA H 1 4.590 0.04 A 151 LYS HBx H 1 1.420 0.04 A 151 LYS HBy H 1 1.510 0.04 A 151 LYS HDy H 1 1.780 0.04 A 151 LYS HEx H 1 3.040 0.04 A 151 LYS HGx H 1 1.120 0.04 A 151 LYS C C 13 176.600 0.30 A 151 LYS CA C 13 55.500 0.30 A 151 LYS CB C 13 33.440 0.30 A 151 LYS CD C 13 30.100 0.30 A 151 LYS CE C 13 40.500 0.30 A 151 LYS CG C 13 25.000 0.30 A 151 LYS N N 15 127.660 0.40 A 152 ILE H H 1 8.750 0.04 A 152 ILE HA H 1 4.640 0.04 A 152 ILE HB H 1 1.930 0.04 A 152 ILE HD1% H 1 0.800 0.04 A 152 ILE HG1x H 1 1.120 0.04 A 152 ILE HG1y H 1 1.630 0.04 A 152 ILE HG2% H 1 0.920 0.04 A 152 ILE C C 13 175.400 0.30 A 152 ILE CA C 13 59.030 0.30 A 152 ILE CB C 13 38.300 0.30 A 152 ILE CG1 C 13 32.700 0.30 A 152 ILE CG2 C 13 17.300 0.30 A 152 ILE N N 15 123.710 0.40 A 153 ASN H H 1 8.840 0.04 A 153 ASN HA H 1 4.100 0.04 A 153 ASN HBx H 1 2.720 0.04 A 153 ASN HBy H 1 2.910 0.04 A 153 ASN HD2y H 1 7.930 0.04 A 153 ASN HD2x H 1 6.670 0.04 A 153 ASN C C 13 175.100 0.30 A 153 ASN CA C 13 53.850 0.30 A 153 ASN CB C 13 40.200 0.30 A 153 ASN N N 15 119.440 0.40 A 153 ASN ND2 N 15 110.000 0.40 A 154 THR H H 1 7.480 0.04 A 154 THR HA H 1 4.750 0.04 A 154 THR HB H 1 4.400 0.04 A 154 THR HG2% H 1 1.110 0.04 A 154 THR C C 13 172.600 0.30 A 154 THR CA C 13 60.430 0.30 A 154 THR CB C 13 70.900 0.30 A 154 THR CG2 C 13 20.800 0.30 A 154 THR N N 15 111.660 0.40 A 155 GLY H H 1 8.300 0.04 A 155 GLY HAx H 1 3.750 0.04 A 155 GLY HAy H 1 4.150 0.04 A 155 GLY C C 13 175.600 0.30 A 155 GLY CA C 13 44.210 0.30 A 155 GLY N N 15 109.870 0.40 A 156 MET H H 1 8.280 0.04 A 156 MET HA H 1 4.440 0.04 A 156 MET HBx H 1 1.920 0.04 A 156 MET HBy H 1 2.090 0.04 A 156 MET HE% H 1 1.970 0.04 A 156 MET HGx H 1 2.530 0.04 A 156 MET C C 13 175.000 0.30 A 156 MET CA C 13 55.300 0.30 A 156 MET CB C 13 31.700 0.30 A 156 MET CE C 13 20.800 0.30 A 156 MET CG C 13 30.200 0.30 A 156 MET N N 15 119.190 0.40 A 157 ALA H H 1 7.950 0.04 A 157 ALA HA H 1 4.550 0.04 A 157 ALA HB% H 1 0.960 0.04 A 157 ALA C C 13 176.500 0.30 A 157 ALA CA C 13 50.080 0.30 A 157 ALA CB C 13 22.600 0.30 A 157 ALA N N 15 127.230 0.40 A 158 ASP H H 1 8.110 0.04 A 158 ASP HA H 1 4.540 0.04 A 158 ASP HBy H 1 3.070 0.04 A 158 ASP C C 13 177.100 0.30 A 158 ASP CA C 13 58.070 0.30 A 158 ASP CB C 13 41.700 0.30 A 158 ASP N N 15 121.540 0.40 A 159 ILE H H 1 8.870 0.04 A 159 ILE HA H 1 4.220 0.04 A 159 ILE HB H 1 2.300 0.04 A 159 ILE HD1% H 1 0.960 0.04 A 159 ILE HG1y H 1 1.870 0.04 A 159 ILE HG1x H 1 1.460 0.04 A 159 ILE HG2% H 1 1.140 0.04 A 159 ILE C C 13 173.200 0.30 A 159 ILE CA C 13 61.830 0.30 A 159 ILE CB C 13 37.800 0.30 A 159 ILE CD1 C 13 13.300 0.30 A 159 ILE CG2 C 13 19.200 0.30 A 159 ILE N N 15 124.130 0.40 A 160 LEU H H 1 7.690 0.04 A 160 LEU HA H 1 5.080 0.04 A 160 LEU HBx H 1 1.720 0.04 A 160 LEU HDx% H 1 0.990 0.04 A 160 LEU HDy% H 1 1.140 0.04 A 160 LEU HG H 1 1.460 0.04 A 160 LEU C C 13 175.700 0.30 A 160 LEU CA C 13 53.540 0.30 A 160 LEU CB C 13 43.600 0.30 A 160 LEU CD1 C 13 24.200 0.30 A 160 LEU CD2 C 13 20.300 0.30 A 160 LEU CG C 13 24.900 0.30 A 160 LEU N N 15 130.080 0.40 A 161 VAL H H 1 8.790 0.04 A 161 VAL HA H 1 5.220 0.04 A 161 VAL HB H 1 2.180 0.04 A 161 VAL HGx% H 1 0.880 0.04 A 161 VAL HGy% H 1 0.750 0.04 A 161 VAL C C 13 175.200 0.30 A 161 VAL CA C 13 61.830 0.30 A 161 VAL CB C 13 30.600 0.30 A 161 VAL CG1 C 13 20.300 0.30 A 161 VAL CG2 C 13 20.500 0.30 A 161 VAL N N 15 125.500 0.40 A 162 VAL H H 1 8.630 0.04 A 162 VAL HA H 1 4.570 0.04 A 162 VAL HB H 1 1.720 0.04 A 162 VAL HGx% H 1 0.870 0.04 A 162 VAL HGy% H 1 0.730 0.04 A 162 VAL C C 13 174.800 0.30 A 162 VAL CA C 13 60.720 0.30 A 162 VAL CB C 13 37.880 0.30 A 162 VAL CG1 C 13 20.900 0.30 A 162 VAL CG2 C 13 20.900 0.30 A 162 VAL N N 15 126.840 0.40 A 163 PHE H H 1 8.580 0.04 A 163 PHE HA H 1 5.370 0.04 A 163 PHE HBy H 1 3.050 0.04 A 163 PHE HBx H 1 2.740 0.04 A 163 PHE HD1 H 1 6.970 0.04 A 163 PHE HE1 H 1 6.500 0.04 A 163 PHE HZ H 1 6.060 0.04 A 163 PHE C C 13 176.100 0.30 A 163 PHE CA C 13 57.220 0.30 A 163 PHE CB C 13 41.030 0.30 A 163 PHE CD1 C 13 131.500 0.30 A 163 PHE CE1 C 13 129.500 0.30 A 163 PHE CZ C 13 127.200 0.30 A 163 PHE N N 15 125.680 0.40 A 164 ALA H H 1 9.110 0.04 A 164 ALA HA H 1 4.830 0.04 A 164 ALA HB% H 1 0.910 0.04 A 164 ALA C C 13 174.800 0.30 A 164 ALA CA C 13 51.390 0.30 A 164 ALA CB C 13 22.900 0.30 A 164 ALA N N 15 126.020 0.40 A 165 ARG H H 1 8.840 0.04 A 165 ARG HA H 1 5.260 0.04 A 165 ARG HBy H 1 1.920 0.04 A 165 ARG HDy H 1 3.090 0.04 A 165 ARG HGx H 1 1.630 0.04 A 165 ARG C C 13 175.700 0.30 A 165 ARG CA C 13 54.200 0.30 A 165 ARG CB C 13 34.170 0.30 A 165 ARG CD C 13 43.400 0.30 A 165 ARG CG C 13 26.100 0.30 A 165 ARG N N 15 118.190 0.40 A 166 GLY H H 1 9.530 0.04 A 166 GLY HAy H 1 3.910 0.04 A 166 GLY HAx H 1 3.790 0.04 A 166 GLY C C 13 175.500 0.30 A 166 GLY CA C 13 46.660 0.30 A 166 GLY N N 15 108.410 0.40 A 167 ALA H H 1 9.210 0.04 A 167 ALA HA H 1 4.760 0.04 A 167 ALA HB% H 1 1.470 0.04 A 167 ALA CA C 13 53.340 0.30 A 167 ALA CB C 13 18.200 0.30 A 167 ALA N N 15 134.120 0.40 A 168 HIS H H 1 9.330 0.04 A 168 HIS HA H 1 4.760 0.04 A 168 HIS HBx H 1 3.170 0.04 A 168 HIS HBy H 1 3.440 0.04 A 168 HIS HD2 H 1 6.400 0.04 A 168 HIS HE1 H 1 6.820 0.04 A 168 HIS CD2 C 13 124.000 0.30 A 168 HIS CE1 C 13 137.600 0.30 A 168 HIS N N 15 120.790 0.40 A 169 GLY H H 1 8.600 0.04 A 169 GLY HAy H 1 3.690 0.04 A 169 GLY HAx H 1 3.330 0.04 A 169 GLY CA C 13 45.210 0.30 A 169 GLY N N 15 106.010 0.40 A 170 ASP H H 1 8.150 0.04 A 170 ASP HA H 1 4.250 0.04 A 170 ASP HBx H 1 2.93 0.04 A 170 ASP HBy H 1 3.07 0.04 A 170 ASP C C 13 176.300 0.30 A 170 ASP CA C 13 54.690 0.30 A 170 ASP CB C 13 42.800 0.30 A 170 ASP N N 15 120.950 0.40 A 171 PHE H H 1 8.220 0.04 A 171 PHE HA H 1 4.170 0.04 A 171 PHE HBy H 1 2.940 0.04 A 171 PHE HBx H 1 2.810 0.04 A 171 PHE HD2 H 1 7.030 0.04 A 171 PHE HE2 H 1 7.300 0.04 A 171 PHE HZ H 1 7.260 0.04 A 171 PHE C C 13 176.300 0.30 A 171 PHE CA C 13 54.730 0.30 A 171 PHE CB C 13 36.230 0.30 A 171 PHE CD2 C 13 130.100 0.30 A 171 PHE CE2 C 13 129.500 0.30 A 171 PHE CZ C 13 128.000 0.30 A 171 PHE N N 15 122.630 0.40 A 172 HIS H H 1 8.220 0.04 A 172 HIS HA H 1 4.634 0.04 A 172 HIS HBx H 1 3.060 0.04 A 172 HIS HBy H 1 3.470 0.04 A 172 HIS HD2 H 1 7.550 0.04 A 172 HIS HE1 H 1 8.410 0.04 A 172 HIS C C 13 174.700 0.30 A 172 HIS CA C 13 53.950 0.30 A 172 HIS CB C 13 26.900 0.30 A 172 HIS CD2 C 13 118.900 0.30 A 172 HIS CE1 C 13 135.000 0.30 A 172 HIS N N 15 122.000 0.40 A 173 ALA H H 1 8.300 0.04 A 173 ALA HA H 1 3.934 0.04 A 173 ALA HB% H 1 1.372 0.04 A 173 ALA CA C 13 58.066 0.30 A 173 ALA CB C 13 18.600 0.30 A 173 ALA N N 15 123.300 0.40 A 174 PHE H H 1 8.270 0.04 A 174 PHE HA H 1 4.222 0.04 A 174 PHE HBy H 1 3.05 0.04 A 174 PHE HBx H 1 2.92 0.04 A 174 PHE HD2 H 1 7.310 0.04 A 174 PHE HE2 H 1 7.220 0.04 A 174 PHE HZ H 1 7.020 0.04 A 174 PHE C C 13 176.200 0.30 A 174 PHE CA C 13 57.430 0.30 A 174 PHE CB C 13 38.660 0.30 A 174 PHE CD2 C 13 129.500 0.30 A 174 PHE CE2 C 13 129.500 0.30 A 174 PHE CZ C 13 127.700 0.30 A 174 PHE N N 15 121.320 0.40 A 175 ASP H H 1 8.250 0.04 A 175 ASP HA H 1 4.880 0.04 A 175 ASP HBy H 1 3.150 0.04 A 175 ASP HBx H 1 3.04 0.04 A 175 ASP C C 13 177.300 0.30 A 175 ASP CA C 13 54.040 0.30 A 175 ASP CB C 13 41.700 0.30 A 175 ASP N N 15 116.500 0.40 A 176 GLY H H 1 8.800 0.04 A 176 GLY HAy H 1 4.450 0.04 A 176 GLY HAx H 1 4.290 0.04 A 176 GLY CA C 13 43.670 0.30 A 176 GLY N N 15 110.060 0.40 A 177 LYS H H 1 8.750 0.04 A 177 LYS HA H 1 3.460 0.04 A 177 LYS HBx H 1 1.630 0.04 A 177 LYS HDy H 1 1.730 0.04 A 177 LYS HEx H 1 2.540 0.04 A 177 LYS HGy H 1 1.330 0.04 A 177 LYS C C 13 177.900 0.30 A 177 LYS CA C 13 58.530 0.30 A 177 LYS CB C 13 32.280 0.30 A 177 LYS CD C 13 29.300 0.30 A 177 LYS CE C 13 42.300 0.30 A 177 LYS CG C 13 24.800 0.30 A 177 LYS N N 15 124.290 0.40 A 178 GLY H H 1 10.980 0.04 A 178 GLY HAy H 1 4.210 0.04 A 178 GLY HAx H 1 3.560 0.04 A 178 GLY C C 13 174.400 0.30 A 178 GLY CA C 13 43.010 0.30 A 178 GLY N N 15 121.280 0.40 A 179 GLY H H 1 8.540 0.04 A 179 GLY HAx H 1 3.470 0.04 A 179 GLY HAy H 1 4.080 0.04 A 179 GLY CA C 13 46.750 0.30 A 179 GLY N N 15 110.400 0.40 A 180 ILE H H 1 10.790 0.04 A 180 ILE HA H 1 3.934 0.04 A 180 ILE HB H 1 2.070 0.04 A 180 ILE HD1% H 1 0.970 0.04 A 180 ILE HG1x H 1 1.320 0.04 A 180 ILE HG1y H 1 1.720 0.04 A 180 ILE HG2% H 1 1.200 0.04 A 180 ILE CA C 13 62.350 0.30 A 180 ILE CB C 13 33.400 0.30 A 180 ILE CD1 C 13 17.500 0.30 A 180 ILE CG1 C 13 25.000 0.30 A 180 ILE CG2 C 13 20.800 0.30 A 180 ILE N N 15 132.140 0.40 A 181 LEU H H 1 8.310 0.04 A 181 LEU HA H 1 5.030 0.04 A 181 LEU C C 13 176.600 0.30 A 181 LEU CA C 13 52.400 0.30 A 181 LEU CB C 13 43.000 0.30 A 181 LEU CD1 C 13 19.300 0.30 A 181 LEU CD2 C 13 22.000 0.30 A 181 LEU CG C 13 26.900 0.30 A 181 LEU N N 15 126.600 0.40 A 182 ALA H H 1 8.370 0.04 A 182 ALA HA H 1 3.730 0.04 A 182 ALA HB% H 1 1.500 0.04 A 182 ALA CA C 13 54.000 0.30 A 182 ALA CB C 13 17.900 0.30 A 182 ALA N N 15 120.930 0.40 A 183 HIS H H 1 8.860 0.04 A 183 HIS HA H 1 3.970 0.04 A 183 HIS HBx H 1 3.220 0.04 A 183 HIS HBy H 1 3.460 0.04 A 183 HIS HD2 H 1 7.130 0.04 A 183 HIS HE1 H 1 7.830 0.04 A 183 HIS C C 13 174.800 0.30 A 183 HIS CA C 13 55.300 0.30 A 183 HIS CB C 13 30.000 0.30 A 183 HIS CD2 C 13 120.000 0.30 A 183 HIS CE1 C 13 136.000 0.30 A 183 HIS N N 15 115.900 0.40 A 184 ALA H H 1 9.080 0.04 A 184 ALA HA H 1 4.140 0.04 A 184 ALA HB% H 1 1.400 0.04 A 184 ALA CA C 13 52.150 0.30 A 184 ALA CB C 13 21.800 0.30 A 184 ALA N N 15 121.080 0.40 A 185 PHE H H 1 11.780 0.04 A 185 PHE HA H 1 4.690 0.04 A 185 PHE HBx H 1 3.300 0.04 A 185 PHE HBy H 1 3.570 0.04 A 185 PHE C C 13 180.500 0.30 A 185 PHE CA C 13 59.400 0.30 A 185 PHE CB C 13 37.000 0.30 A 185 PHE N N 15 135.900 0.40 A 186 GLY H H 1 8.320 0.04 A 186 GLY HAx H 1 4.110 0.04 A 186 GLY HAy H 1 4.210 0.04 A 186 GLY CA C 13 48.000 0.30 A 186 GLY N N 15 108.200 0.40 A 187 PRO CA C 13 63.870 0.30 A 187 PRO CB C 13 27.000 0.30 A 187 PRO CG C 13 29.100 0.30 A 188 GLY H H 1 5.750 0.04 A 188 GLY HAy H 1 3.920 0.04 A 188 GLY HAx H 1 3.520 0.04 A 188 GLY C C 13 179.400 0.30 A 188 GLY CA C 13 44.200 0.30 A 188 GLY N N 15 109.990 0.40 A 189 SER H H 1 8.090 0.04 A 189 SER HA H 1 4.360 0.04 A 189 SER HBy H 1 4.190 0.04 A 189 SER HBx H 1 3.990 0.04 A 189 SER CA C 13 58.850 0.30 A 189 SER CB C 13 64.600 0.30 A 189 SER N N 15 114.650 0.40 A 190 GLY H H 1 9.240 0.04 A 190 GLY HAy H 1 3.800 0.04 A 190 GLY CA C 13 47.350 0.30 A 190 GLY N N 15 111.350 0.40 A 191 ILE H H 1 9.040 0.04 A 191 ILE HA H 1 4.020 0.04 A 191 ILE HB H 1 2.120 0.04 A 191 ILE HD1% H 1 0.460 0.04 A 191 ILE HG1y H 1 1.460 0.04 A 191 ILE HG2% H 1 0.510 0.04 A 191 ILE CA C 13 62.340 0.30 A 191 ILE CB C 13 38.000 0.30 A 191 ILE CD1 C 13 16.500 0.30 A 191 ILE CG1 C 13 27.500 0.30 A 191 ILE CG2 C 13 22.600 0.30 A 191 ILE N N 15 133.470 0.40 A 192 GLY H H 1 7.810 0.04 A 192 GLY HAy H 1 3.800 0.04 A 192 GLY CA C 13 46.100 0.30 A 192 GLY N N 15 105.280 0.40 A 193 GLY H H 1 8.130 0.04 A 193 GLY HAx H 1 3.900 0.04 A 193 GLY HAy H 1 4.290 0.04 A 193 GLY CA C 13 46.400 0.30 A 193 GLY N N 15 115.850 0.40 A 194 ASP H H 1 8.280 0.04 A 194 ASP HA H 1 4.312 0.04 A 194 ASP HBx H 1 2.990 0.04 A 194 ASP C C 13 175.000 0.30 A 194 ASP CA C 13 56.580 0.30 A 194 ASP CB C 13 39.500 0.30 A 194 ASP N N 15 122.470 0.40 A 195 ALA H H 1 8.630 0.04 A 195 ALA HA H 1 4.770 0.04 A 195 ALA HB% H 1 1.040 0.04 A 195 ALA CA C 13 51.100 0.30 A 195 ALA N N 15 119.890 0.40 A 196 HIS H H 1 9.000 0.04 A 196 HIS HA H 1 4.810 0.04 A 196 HIS HBx H 1 2.530 0.04 A 196 HIS HBy H 1 3.360 0.04 A 196 HIS HD2 H 1 6.520 0.04 A 196 HIS HE1 H 1 8.460 0.04 A 196 HIS C C 13 172.900 0.30 A 196 HIS CA C 13 50.500 0.30 A 196 HIS CB C 13 34.100 0.30 A 196 HIS CD2 C 13 122.100 0.30 A 196 HIS CE1 C 13 140.300 0.30 A 196 HIS N N 15 120.880 0.40 A 197 PHE H H 1 9.140 0.04 A 197 PHE HA H 1 4.320 0.04 A 197 PHE HBx H 1 1.720 0.04 A 197 PHE HBy H 1 2.250 0.04 A 197 PHE HD2 H 1 6.250 0.04 A 197 PHE HE2 H 1 6.510 0.04 A 197 PHE HZ H 1 6.380 0.04 A 197 PHE C C 13 174.200 0.30 A 197 PHE CA C 13 57.040 0.30 A 197 PHE CB C 13 41.480 0.30 A 197 PHE CD2 C 13 129.800 0.30 A 197 PHE CE2 C 13 126.600 0.30 A 197 PHE CZ C 13 123.700 0.30 A 197 PHE N N 15 122.750 0.40 A 198 ASP H H 1 8.040 0.04 A 198 ASP HA H 1 4.340 0.04 A 198 ASP HBx H 1 3.120 0.04 A 198 ASP HBy H 1 3.470 0.04 A 198 ASP C C 13 179.400 0.30 A 198 ASP CA C 13 54.260 0.30 A 198 ASP CB C 13 40.500 0.30 A 198 ASP N N 15 122.570 0.40 A 199 GLU H H 1 9.560 0.04 A 199 GLU HA H 1 4.490 0.04 A 199 GLU HBy H 1 1.740 0.04 A 199 GLU HGx H 1 2.050 0.04 A 199 GLU C C 13 176.600 0.30 A 199 GLU CA C 13 56.380 0.30 A 199 GLU CB C 13 31.800 0.30 A 199 GLU CG C 13 36.400 0.30 A 199 GLU N N 15 130.440 0.40 A 200 ASP H H 1 9.080 0.04 A 200 ASP HA H 1 4.810 0.04 A 200 ASP HBy H 1 2.690 0.04 A 200 ASP HBx H 1 2.560 0.04 A 200 ASP C C 13 177.300 0.30 A 200 ASP CA C 13 56.910 0.30 A 200 ASP CB C 13 39.600 0.30 A 200 ASP N N 15 119.500 0.40 A 201 GLU H H 1 7.390 0.04 A 201 GLU HA H 1 4.470 0.04 A 201 GLU HBx H 1 1.650 0.04 A 201 GLU HBy H 1 1.770 0.04 A 201 GLU HGy H 1 1.940 0.04 A 201 GLU C C 13 175.100 0.30 A 201 GLU CA C 13 54.020 0.30 A 201 GLU CB C 13 27.100 0.30 A 201 GLU CG C 13 35.700 0.30 A 201 GLU N N 15 116.700 0.40 A 202 PHE H H 1 8.440 0.04 A 202 PHE HA H 1 4.930 0.04 A 202 PHE HBx H 1 2.700 0.04 A 202 PHE HBy H 1 2.860 0.04 A 202 PHE HD1 H 1 7.080 0.04 A 202 PHE HE1 H 1 7.310 0.04 A 202 PHE HZ H 1 6.900 0.04 A 202 PHE C C 13 172.800 0.30 A 202 PHE CA C 13 55.620 0.30 A 202 PHE CB C 13 38.900 0.30 A 202 PHE CD1 C 13 129.300 0.30 A 202 PHE CE1 C 13 128.000 0.30 A 202 PHE CZ C 13 127.500 0.30 A 202 PHE N N 15 126.330 0.40 A 203 TRP H H 1 9.240 0.04 A 203 TRP HA H 1 5.000 0.04 A 203 TRP HBx H 1 2.570 0.04 A 203 TRP HBy H 1 3.220 0.04 A 203 TRP HD1 H 1 7.380 0.04 A 203 TRP HE1 H 1 10.200 0.04 A 203 TRP HE3 H 1 7.350 0.04 A 203 TRP HH2 H 1 7.500 0.04 A 203 TRP HZ2 H 1 7.130 0.04 A 203 TRP HZ3 H 1 7.230 0.04 A 203 TRP C C 13 176.800 0.30 A 203 TRP CA C 13 56.690 0.30 A 203 TRP CB C 13 31.000 0.30 A 203 TRP CD1 C 13 126.100 0.30 A 203 TRP CE3 C 13 116.000 0.30 A 203 TRP CH2 C 13 122.500 0.30 A 203 TRP CZ2 C 13 112.000 0.30 A 203 TRP CZ3 C 13 125.000 0.30 A 203 TRP N N 15 131.500 0.40 A 203 TRP NE1 N 15 127.200 0.40 A 204 THR H H 1 8.300 0.04 A 204 THR HA H 1 4.400 0.04 A 204 THR HB H 1 4.150 0.04 A 204 THR HG2% H 1 1.110 0.04 A 204 THR C C 13 176.100 0.30 A 204 THR CA C 13 59.990 0.30 A 204 THR CB C 13 70.680 0.30 A 204 THR CG2 C 13 20.800 0.30 A 204 THR N N 15 109.610 0.40 A 205 THR H H 1 8.330 0.04 A 205 THR HA H 1 4.600 0.04 A 205 THR HB H 1 4.380 0.04 A 205 THR HG2% H 1 1.340 0.04 A 205 THR C C 13 175.600 0.30 A 205 THR CA C 13 62.400 0.30 A 205 THR CB C 13 69.400 0.30 A 205 THR CG2 C 13 22.500 0.30 A 205 THR N N 15 109.830 0.40 A 206 HIS H H 1 8.000 0.04 A 206 HIS HA H 1 4.320 0.04 A 206 HIS HBx H 1 3.110 0.04 A 206 HIS HBy H 1 3.470 0.04 A 206 HIS HD2 H 1 7.170 0.04 A 206 HIS HE1 H 1 7.820 0.04 A 206 HIS C C 13 174.200 0.30 A 206 HIS CA C 13 55.530 0.30 A 206 HIS CB C 13 31.600 0.30 A 206 HIS CD2 C 13 117.800 0.30 A 206 HIS CE1 C 13 137.300 0.30 A 206 HIS N N 15 122.640 0.40 A 207 SER H H 1 7.990 0.04 A 207 SER HA H 1 4.170 0.04 A 207 SER HBx H 1 3.42 0.04 A 207 SER HBy H 1 3.50 0.04 A 207 SER C C 13 176.000 0.30 A 207 SER CA C 13 58.800 0.30 A 207 SER CB C 13 64.600 0.30 A 207 SER N N 15 114.390 0.40 A 208 GLY H H 1 9.020 0.04 A 208 GLY HAx H 1 3.740 0.04 A 208 GLY HAy H 1 3.960 0.04 A 208 GLY CA C 13 45.300 0.30 A 208 GLY N N 15 112.330 0.40 A 209 GLY H H 1 8.000 0.04 A 209 GLY HAy H 1 4.150 0.04 A 209 GLY HAx H 1 3.840 0.04 A 209 GLY C C 13 174.000 0.30 A 209 GLY CA C 13 46.400 0.30 A 209 GLY N N 15 108.040 0.40 A 210 THR H H 1 9.170 0.04 A 210 THR HA H 1 4.000 0.04 A 210 THR HB H 1 3.790 0.04 A 210 THR HG2% H 1 0.560 0.04 A 210 THR C C 13 172.700 0.30 A 210 THR CA C 13 62.690 0.30 A 210 THR CB C 13 69.420 0.30 A 210 THR CG2 C 13 21.000 0.30 A 210 THR N N 15 124.630 0.40 A 211 ASN H H 1 8.410 0.04 A 211 ASN HA H 1 4.774 0.04 A 211 ASN HBy H 1 3.170 0.04 A 211 ASN HBx H 1 3.100 0.04 A 211 ASN HD2y H 1 7.990 0.04 A 211 ASN HD2x H 1 6.370 0.04 A 211 ASN C C 13 176.700 0.30 A 211 ASN CA C 13 55.880 0.30 A 211 ASN CB C 13 41.860 0.30 A 211 ASN N N 15 125.650 0.40 A 211 ASN ND2 N 15 110.800 0.40 A 212 LEU H H 1 8.700 0.04 A 212 LEU HA H 1 4.400 0.04 A 212 LEU HBx H 1 1.590 0.04 A 212 LEU HBy H 1 1.860 0.04 A 212 LEU HDx% H 1 0.800 0.04 A 212 LEU HDy% H 1 1.070 0.04 A 212 LEU HG H 1 1.490 0.04 A 212 LEU C C 13 176.500 0.30 A 212 LEU CA C 13 58.840 0.30 A 212 LEU CB C 13 41.120 0.30 A 212 LEU CD1 C 13 17.600 0.30 A 212 LEU CD2 C 13 18.100 0.30 A 212 LEU CG C 13 27.900 0.30 A 212 LEU N N 15 132.060 0.40 A 213 PHE H H 1 9.370 0.04 A 213 PHE HA H 1 3.940 0.04 A 213 PHE HBy H 1 3.430 0.04 A 213 PHE HBx H 1 3.180 0.04 A 213 PHE HD2 H 1 7.200 0.04 A 213 PHE HE2 H 1 6.870 0.04 A 213 PHE HZ H 1 6.500 0.04 A 213 PHE C C 13 175.900 0.30 A 213 PHE CA C 13 61.710 0.30 A 213 PHE CB C 13 37.900 0.30 A 213 PHE CD2 C 13 130.200 0.30 A 213 PHE CE2 C 13 129.300 0.30 A 213 PHE CZ C 13 128.900 0.30 A 213 PHE N N 15 120.810 0.40 A 214 LEU H H 1 9.090 0.04 A 214 LEU HA H 1 4.360 0.04 A 214 LEU HBx H 1 1.520 0.04 A 214 LEU HBy H 1 1.820 0.04 A 214 LEU HDx% H 1 0.450 0.04 A 214 LEU HDy% H 1 0.810 0.04 A 214 LEU HG H 1 1.080 0.04 A 214 LEU C C 13 180.400 0.30 A 214 LEU CA C 13 57.900 0.30 A 214 LEU CB C 13 43.010 0.30 A 214 LEU CD1 C 13 26.500 0.30 A 214 LEU CD2 C 13 19.600 0.30 A 214 LEU CG C 13 33.000 0.30 A 214 LEU N N 15 118.040 0.40 A 215 THR H H 1 7.660 0.04 A 215 THR HA H 1 4.400 0.04 A 215 THR HB H 1 4.080 0.04 A 215 THR HG2% H 1 1.490 0.04 A 215 THR C C 13 176.600 0.30 A 215 THR CA C 13 67.030 0.30 A 215 THR CB C 13 68.200 0.30 A 215 THR CG2 C 13 21.500 0.30 A 215 THR N N 15 115.530 0.40 A 216 ALA H H 1 9.440 0.04 A 216 ALA HA H 1 4.040 0.04 A 216 ALA HB% H 1 1.080 0.04 A 216 ALA C C 13 178.400 0.30 A 216 ALA CA C 13 55.580 0.30 A 216 ALA CB C 13 17.300 0.30 A 216 ALA N N 15 125.450 0.40 A 217 VAL H H 1 8.560 0.04 A 217 VAL HA H 1 4.580 0.04 A 217 VAL HB H 1 1.560 0.04 A 217 VAL HGx% H 1 0.980 0.04 A 217 VAL HGy% H 1 1.110 0.04 A 217 VAL CA C 13 68.030 0.30 A 217 VAL CB C 13 31.200 0.30 A 217 VAL CG1 C 13 23.100 0.30 A 217 VAL CG2 C 13 23.600 0.30 A 217 VAL N N 15 118.600 0.40 A 218 HIS H H 1 6.880 0.04 A 218 HIS HA H 1 4.280 0.04 A 218 HIS HBy H 1 3.390 0.04 A 218 HIS HBx H 1 3.070 0.04 A 218 HIS HD2 H 1 7.060 0.04 A 218 HIS HE1 H 1 7.770 0.04 A 218 HIS C C 13 175.900 0.30 A 218 HIS CA C 13 58.560 0.30 A 218 HIS CB C 13 31.000 0.30 A 218 HIS CD2 C 13 118.100 0.30 A 218 HIS CE1 C 13 135.700 0.30 A 218 HIS N N 15 116.930 0.40 A 220 ILE H H 1 8.920 0.04 A 220 ILE HA H 1 3.550 0.04 A 220 ILE HB H 1 2.350 0.04 A 220 ILE HD1% H 1 1.040 0.04 A 220 ILE HG1y H 1 1.450 0.04 A 220 ILE HG1x H 1 1.120 0.04 A 220 ILE C C 13 177.200 0.30 A 220 ILE CA C 13 63.440 0.30 A 220 ILE CB C 13 37.800 0.30 A 220 ILE CD1 C 13 13.900 0.30 A 220 ILE CG1 C 13 27.100 0.30 A 220 ILE CG2 C 13 17.600 0.30 A 220 ILE N N 15 115.890 0.40 A 221 GLY H H 1 7.490 0.04 A 221 GLY HAy H 1 3.690 0.04 A 221 GLY HAx H 1 3.600 0.04 A 221 GLY CA C 13 47.950 0.30 A 221 GLY N N 15 108.560 0.40 A 222 HIS H H 1 6.990 0.04 A 222 HIS HA H 1 4.280 0.04 A 222 HIS HB2 H 1 3.880 0.04 A 222 HIS HB3 H 1 3.880 0.04 A 222 HIS HD2 H 1 7.400 0.04 A 222 HIS HE1 H 1 7.770 0.04 A 222 HIS CA C 13 56.410 0.30 A 222 HIS CB C 13 30.400 0.30 A 222 HIS CD2 C 13 125.000 0.30 A 222 HIS CE1 C 13 134.700 0.30 A 222 HIS N N 15 118.500 0.40 A 223 SER H H 1 8.460 0.04 A 223 SER HA H 1 4.310 0.04 A 223 SER HBy H 1 4.050 0.04 A 223 SER C C 13 175.800 0.30 A 223 SER CA C 13 56.330 0.30 A 223 SER CB C 13 62.360 0.30 A 223 SER N N 15 122.000 0.40 A 224 LEU H H 1 7.800 0.04 A 224 LEU HA H 1 4.530 0.04 A 224 LEU HBy H 1 2.800 0.04 A 224 LEU HDy% H 1 1.390 0.04 A 224 LEU HG H 1 2.660 0.04 A 224 LEU CA C 13 52.900 0.30 A 224 LEU CB C 13 41.000 0.30 A 224 LEU CD1 C 13 23.000 0.30 A 224 LEU CD2 C 13 19.000 0.30 A 224 LEU CG C 13 32.300 0.30 A 224 LEU N N 15 114.580 0.40 A 225 GLY H H 1 7.890 0.04 A 225 GLY HAy H 1 4.240 0.04 A 225 GLY HAx H 1 3.960 0.04 A 225 GLY C C 13 176.600 0.30 A 225 GLY CA C 13 46.300 0.30 A 225 GLY N N 15 119.510 0.40 A 226 LEU H H 1 8.130 0.04 A 226 LEU HA H 1 3.960 0.04 A 226 LEU HBx H 1 2.660 0.04 A 226 LEU HDx% H 1 1.500 0.04 A 226 LEU HG H 1 1.800 0.04 A 226 LEU CA C 13 54.000 0.30 A 226 LEU CB C 13 41.800 0.30 A 226 LEU CD1 C 13 31.000 0.30 A 226 LEU CG C 13 33.000 0.30 A 226 LEU N N 15 120.940 0.40 A 227 GLY H H 1 8.830 0.04 A 227 GLY HAy H 1 3.600 0.04 A 227 GLY HAx H 1 3.500 0.04 A 227 GLY CA C 13 43.700 0.30 A 227 GLY N N 15 110.080 0.40 A 228 HIS H H 1 8.540 0.04 A 228 HIS HA H 1 5.220 0.04 A 228 HIS HBy H 1 3.210 0.04 A 228 HIS HBx H 1 3.050 0.04 A 228 HIS HD2 H 1 6.650 0.04 A 228 HIS HE1 H 1 8.290 0.04 A 228 HIS CA C 13 56.340 0.30 A 228 HIS CB C 13 30.000 0.30 A 228 HIS CD2 C 13 122.500 0.30 A 228 HIS CE1 C 13 139.000 0.30 A 228 HIS N N 15 115.580 0.40 A 229 SER H H 1 7.120 0.04 A 229 SER HA H 1 4.750 0.04 A 229 SER HBy H 1 4.220 0.04 A 229 SER C C 13 175.600 0.30 A 229 SER CA C 13 55.580 0.30 A 229 SER CB C 13 65.100 0.30 A 229 SER N N 15 114.530 0.40 A 230 SER H H 1 8.870 0.04 A 230 SER HA H 1 4.760 0.04 A 230 SER HBy H 1 4.090 0.04 A 230 SER HBx H 1 3.980 0.04 A 230 SER C C 13 173.500 0.30 A 230 SER CA C 13 58.740 0.30 A 230 SER CB C 13 64.220 0.30 A 230 SER N N 15 120.140 0.40 A 231 ASP H H 1 8.940 0.04 A 231 ASP HA H 1 4.840 0.04 A 231 ASP HBx H 1 3.040 0.04 A 231 ASP HBy H 1 3.220 0.04 A 231 ASP C C 13 174.900 0.30 A 231 ASP CA C 13 51.430 0.30 A 231 ASP CB C 13 42.500 0.30 A 231 ASP N N 15 126.560 0.40 A 232 PRO HA H 1 4.850 0.04 A 232 PRO HBy H 1 2.140 0.04 A 232 PRO HDx H 1 3.800 0.04 A 232 PRO HDy H 1 3.93 0.04 A 232 PRO C C 13 177.800 0.30 A 232 PRO CA C 13 63.200 0.30 A 232 PRO CB C 13 32.000 0.30 A 232 PRO CD C 13 50.70 0.30 A 232 PRO CG C 13 27.400 0.30 A 233 LYS H H 1 8.310 0.04 A 233 LYS HA H 1 4.130 0.04 A 233 LYS HBx H 1 1.66 0.04 A 233 LYS HBy H 1 1.77 0.04 A 233 LYS HDy H 1 1.500 0.04 A 233 LYS HEx H 1 3.030 0.04 A 233 LYS HGy H 1 1.360 0.04 A 233 LYS C C 13 176.800 0.30 A 233 LYS CA C 13 56.440 0.30 A 233 LYS CB C 13 28.700 0.30 A 233 LYS CD C 13 31.900 0.30 A 233 LYS CE C 13 41.100 0.30 A 233 LYS CG C 13 24.200 0.30 A 233 LYS N N 15 116.890 0.40 A 234 ALA H H 1 8.190 0.04 A 234 ALA HA H 1 4.560 0.04 A 234 ALA HB% H 1 1.800 0.04 A 234 ALA C C 13 179.500 0.30 A 234 ALA CA C 13 52.080 0.30 A 234 ALA CB C 13 20.000 0.30 A 234 ALA N N 15 123.950 0.40 A 235 VAL H H 1 11.380 0.04 A 235 VAL HA H 1 4.250 0.04 A 235 VAL HB H 1 2.330 0.04 A 235 VAL HGx% H 1 1.140 0.04 A 235 VAL HGy% H 1 0.960 0.04 A 235 VAL CA C 13 64.950 0.30 A 235 VAL CB C 13 31.370 0.30 A 235 VAL CG1 C 13 20.400 0.30 A 235 VAL CG2 C 13 23.900 0.30 A 235 VAL N N 15 131.320 0.40 A 236 MET H H 1 7.910 0.04 A 236 MET HA H 1 4.220 0.04 A 236 MET HBx H 1 2.040 0.04 A 236 MET HBy H 1 2.180 0.04 A 236 MET HE% H 1 1.790 0.04 A 236 MET HGy H 1 2.960 0.04 A 236 MET C C 13 177.700 0.30 A 236 MET CA C 13 53.760 0.30 A 236 MET CB C 13 27.340 0.30 A 236 MET CE C 13 20.500 0.30 A 236 MET CG C 13 30.500 0.30 A 236 MET N N 15 115.150 0.40 A 237 PHE H H 1 8.010 0.04 A 237 PHE HA H 1 3.860 0.04 A 237 PHE HBy H 1 3.210 0.04 A 237 PHE HBx H 1 3.030 0.04 A 237 PHE HD1 H 1 7.300 0.04 A 237 PHE HE1 H 1 7.360 0.04 A 237 PHE HZ H 1 7.070 0.04 A 237 PHE C C 13 176.800 0.30 A 237 PHE CA C 13 57.840 0.30 A 237 PHE CB C 13 40.250 0.30 A 237 PHE CD1 C 13 129.900 0.30 A 237 PHE CE1 C 13 128.900 0.30 A 237 PHE CZ C 13 129.400 0.30 A 237 PHE N N 15 128.350 0.40 A 238 PRO HA H 1 4.330 0.04 A 238 PRO HBy H 1 2.050 0.04 A 238 PRO HDy H 1 3.510 0.04 A 238 PRO HDx H 1 3.500 0.04 A 238 PRO HGy H 1 1.560 0.04 A 238 PRO HGx H 1 1.410 0.04 A 238 PRO C C 13 176.300 0.30 A 238 PRO CA C 13 65.610 0.30 A 238 PRO CB C 13 29.300 0.30 A 238 PRO CD C 13 50.400 0.30 A 238 PRO CG C 13 25.660 0.30 A 239 THR H H 1 6.390 0.04 A 239 THR HA H 1 4.120 0.04 A 239 THR HB H 1 4.060 0.04 A 239 THR HG2% H 1 1.240 0.04 A 239 THR C C 13 173.500 0.30 A 239 THR CA C 13 61.420 0.30 A 239 THR CB C 13 69.700 0.30 A 239 THR CG2 C 13 21.800 0.30 A 239 THR N N 15 111.880 0.40 A 240 TYR H H 1 8.410 0.04 A 240 TYR HA H 1 4.280 0.04 A 240 TYR HBy H 1 3.020 0.04 A 240 TYR HBx H 1 2.760 0.04 A 240 TYR HD2 H 1 7.200 0.04 A 240 TYR HE2 H 1 6.980 0.04 A 240 TYR C C 13 174.600 0.30 A 240 TYR CA C 13 59.060 0.30 A 240 TYR CB C 13 39.420 0.30 A 240 TYR CD2 C 13 129.700 0.30 A 240 TYR CE2 C 13 115.900 0.30 A 240 TYR N N 15 127.950 0.40 A 241 LYS H H 1 7.420 0.04 A 241 LYS HA H 1 4.030 0.04 A 241 LYS HBx H 1 1.630 0.04 A 241 LYS HEx H 1 3.000 0.04 A 241 LYS C C 13 173.700 0.30 A 241 LYS CA C 13 55.360 0.30 A 241 LYS CB C 13 35.010 0.30 A 241 LYS CD C 13 29.300 0.30 A 241 LYS CE C 13 42.400 0.30 A 241 LYS CG C 13 23.900 0.30 A 241 LYS N N 15 127.450 0.40 A 242 TYR H H 1 8.540 0.04 A 242 TYR HA H 1 3.860 0.04 A 242 TYR HBx H 1 2.740 0.04 A 242 TYR HBy H 1 3.050 0.04 A 242 TYR HD1 H 1 6.990 0.04 A 242 TYR HE1 H 1 6.740 0.04 A 242 TYR C C 13 175.200 0.30 A 242 TYR CA C 13 60.900 0.30 A 242 TYR CB C 13 38.500 0.30 A 242 TYR CD1 C 13 131.000 0.30 A 242 TYR CE1 C 13 116.100 0.30 A 242 TYR N N 15 123.250 0.40 A 243 VAL H H 1 5.870 0.04 A 243 VAL HA H 1 3.880 0.04 A 243 VAL HB H 1 1.900 0.04 A 243 VAL HGx% H 1 0.820 0.04 A 243 VAL HGy% H 1 1.080 0.04 A 243 VAL C C 13 172.200 0.30 A 243 VAL CA C 13 59.530 0.30 A 243 VAL CB C 13 35.400 0.30 A 243 VAL CG1 C 13 19.500 0.30 A 243 VAL CG2 C 13 21.400 0.30 A 243 VAL N N 15 124.130 0.40 A 244 ASP H H 1 7.850 0.04 A 244 ASP HA H 1 4.280 0.04 A 244 ASP HBy H 1 2.740 0.04 A 244 ASP HBx H 1 2.720 0.04 A 244 ASP C C 13 179.100 0.30 A 244 ASP CA C 13 55.260 0.30 A 244 ASP CB C 13 42.100 0.30 A 244 ASP N N 15 118.510 0.40 A 245 ILE H H 1 7.770 0.04 A 245 ILE HA H 1 3.840 0.04 A 245 ILE HB H 1 1.960 0.04 A 245 ILE HD1% H 1 0.800 0.04 A 245 ILE HG2% H 1 1.280 0.04 A 245 ILE C C 13 177.400 0.30 A 245 ILE CA C 13 64.650 0.30 A 245 ILE CB C 13 37.900 0.30 A 245 ILE CD1 C 13 14.000 0.30 A 245 ILE CG1 C 13 27.000 0.30 A 245 ILE CG2 C 13 18.200 0.30 A 245 ILE N N 15 124.230 0.40 A 246 ASN H H 1 8.590 0.04 A 246 ASN HA H 1 4.580 0.04 A 246 ASN HBx H 1 2.840 0.04 A 246 ASN HBy H 1 2.980 0.04 A 246 ASN HD2x H 1 7.050 0.04 A 246 ASN HD2y H 1 7.950 0.04 A 246 ASN C C 13 176.500 0.30 A 246 ASN CA C 13 55.600 0.30 A 246 ASN CB C 13 38.420 0.30 A 246 ASN N N 15 118.560 0.40 A 246 ASN ND2 N 15 115.000 0.40 A 247 THR H H 1 7.540 0.04 A 247 THR HA H 1 4.400 0.04 A 247 THR HB H 1 3.830 0.04 A 247 THR HG2% H 1 1.140 0.04 A 247 THR C C 13 173.900 0.30 A 247 THR CA C 13 60.950 0.30 A 247 THR CB C 13 69.270 0.30 A 247 THR CG2 C 13 21.500 0.30 A 247 THR N N 15 108.860 0.40 A 248 PHE H H 1 7.190 0.04 A 248 PHE HA H 1 4.154 0.04 A 248 PHE HBx H 1 2.850 0.04 A 248 PHE HBy H 1 3.110 0.04 A 248 PHE HD1 H 1 7.320 0.04 A 248 PHE HE1 H 1 7.040 0.04 A 248 PHE HZ H 1 6.970 0.04 A 248 PHE C C 13 174.600 0.30 A 248 PHE CA C 13 60.000 0.30 A 248 PHE CB C 13 40.030 0.30 A 248 PHE CD1 C 13 132.000 0.30 A 248 PHE CE1 C 13 131.500 0.30 A 248 PHE CZ C 13 131.100 0.30 A 248 PHE N N 15 123.200 0.40 A 249 ARG H H 1 7.180 0.04 A 249 ARG HA H 1 4.130 0.04 A 249 ARG HBx H 1 1.660 0.04 A 249 ARG HDx H 1 3.090 0.04 A 249 ARG HGx H 1 1.460 0.04 A 249 ARG C C 13 174.600 0.30 A 249 ARG CA C 13 54.340 0.30 A 249 ARG CB C 13 33.510 0.30 A 249 ARG CD C 13 43.500 0.30 A 249 ARG CG C 13 26.200 0.30 A 249 ARG N N 15 126.250 0.40 A 250 LEU H H 1 8.180 0.04 A 250 LEU HA H 1 3.920 0.04 A 250 LEU HBy H 1 1.460 0.04 A 250 LEU HBx H 1 1.300 0.04 A 250 LEU HDx% H 1 0.330 0.04 A 250 LEU HDy% H 1 0.110 0.04 A 250 LEU HG H 1 1.670 0.04 A 250 LEU C C 13 177.000 0.30 A 250 LEU CA C 13 54.970 0.30 A 250 LEU CB C 13 43.100 0.30 A 250 LEU CD1 C 13 22.500 0.30 A 250 LEU CG C 13 26.900 0.30 A 250 LEU N N 15 120.940 0.40 A 251 SER H H 1 9.000 0.04 A 251 SER HA H 1 4.200 0.04 A 251 SER HBx H 1 3.880 0.04 A 251 SER C C 13 175.100 0.30 A 251 SER CA C 13 57.830 0.30 A 251 SER CB C 13 65.800 0.30 A 251 SER N N 15 118.210 0.40 A 252 ALA H H 1 8.860 0.04 A 252 ALA HA H 1 4.540 0.04 A 252 ALA HB% H 1 1.500 0.04 A 252 ALA C C 13 180.300 0.30 A 252 ALA CA C 13 55.710 0.30 A 252 ALA CB C 13 18.200 0.30 A 252 ALA N N 15 123.680 0.40 A 253 ASP H H 1 8.300 0.04 A 253 ASP HA H 1 4.380 0.04 A 253 ASP HBx H 1 2.510 0.04 A 253 ASP HBy H 1 2.860 0.04 A 253 ASP C C 13 178.600 0.30 A 253 ASP CA C 13 58.360 0.30 A 253 ASP CB C 13 43.800 0.30 A 253 ASP N N 15 117.490 0.40 A 254 ASP H H 1 7.430 0.04 A 254 ASP HA H 1 4.760 0.04 A 254 ASP HBx H 1 2.790 0.04 A 254 ASP HBy H 1 3.090 0.04 A 254 ASP C C 13 177.700 0.30 A 254 ASP CA C 13 57.810 0.30 A 254 ASP CB C 13 44.300 0.30 A 254 ASP N N 15 118.830 0.40 A 255 ILE H H 1 7.920 0.04 A 255 ILE HA H 1 3.690 0.04 A 255 ILE HB H 1 1.770 0.04 A 255 ILE HD1% H 1 0.780 0.04 A 255 ILE HG1y H 1 1.610 0.04 A 255 ILE HG1x H 1 1.430 0.04 A 255 ILE HG2% H 1 0.890 0.04 A 255 ILE C C 13 177.600 0.30 A 255 ILE CA C 13 65.520 0.30 A 255 ILE CB C 13 38.490 0.30 A 255 ILE CD1 C 13 17.000 0.30 A 255 ILE CG1 C 13 27.200 0.30 A 255 ILE N N 15 118.800 0.40 A 256 ARG H H 1 8.480 0.04 A 256 ARG HA H 1 4.130 0.04 A 256 ARG HBy H 1 1.960 0.04 A 256 ARG HDy H 1 3.260 0.04 A 256 ARG HGy H 1 1.760 0.04 A 256 ARG C C 13 180.500 0.30 A 256 ARG CA C 13 59.400 0.30 A 256 ARG CB C 13 29.850 0.30 A 256 ARG CD C 13 43.500 0.30 A 256 ARG CG C 13 27.300 0.30 A 256 ARG N N 15 119.230 0.40 A 257 GLY H H 1 8.310 0.04 A 257 GLY HAy H 1 3.970 0.04 A 257 GLY HAx H 1 3.820 0.04 A 257 GLY C C 13 177.000 0.30 A 257 GLY CA C 13 47.400 0.30 A 257 GLY N N 15 108.170 0.40 A 258 ILE H H 1 8.580 0.04 A 258 ILE HA H 1 4.530 0.04 A 258 ILE HB H 1 2.170 0.04 A 258 ILE HD1% H 1 0.720 0.04 A 258 ILE HG1x H 1 1.590 0.04 A 258 ILE HG2% H 1 0.890 0.04 A 258 ILE C C 13 177.800 0.30 A 258 ILE CA C 13 61.110 0.30 A 258 ILE CB C 13 31.900 0.30 A 258 ILE CG1 C 13 24.200 0.30 A 258 ILE CG2 C 13 20.600 0.30 A 258 ILE N N 15 123.360 0.40 A 259 GLN H H 1 8.680 0.04 A 259 GLN HA H 1 4.510 0.04 A 259 GLN HBx H 1 2.040 0.04 A 259 GLN HBy H 1 2.270 0.04 A 259 GLN HE2y H 1 7.750 0.04 A 259 GLN HE2x H 1 6.970 0.04 A 259 GLN HGx H 1 2.760 0.04 A 259 GLN HGy H 1 2.960 0.04 A 259 GLN C C 13 179.300 0.30 A 259 GLN CA C 13 58.780 0.30 A 259 GLN CB C 13 27.000 0.30 A 259 GLN CG C 13 35.000 0.30 A 259 GLN N N 15 123.720 0.40 A 259 GLN NE2 N 15 113.800 0.40 A 260 SER H H 1 7.980 0.04 A 260 SER HA H 1 4.290 0.04 A 260 SER HBx H 1 4.020 0.04 A 260 SER HBy H 1 4.120 0.04 A 260 SER C C 13 175.100 0.30 A 260 SER CA C 13 61.420 0.30 A 260 SER CB C 13 62.850 0.30 A 260 SER N N 15 115.850 0.40 A 261 LEU H H 1 6.980 0.04 A 261 LEU HA H 1 4.490 0.04 A 261 LEU HBx H 1 1.730 0.04 A 261 LEU HBy H 1 1.880 0.04 A 261 LEU HDx% H 1 0.650 0.04 A 261 LEU HDy% H 1 0.800 0.04 A 261 LEU HG H 1 1.58 0.04 A 261 LEU C C 13 177.600 0.30 A 261 LEU CA C 13 56.690 0.30 A 261 LEU CB C 13 43.460 0.30 A 261 LEU CD1 C 13 19.700 0.30 A 261 LEU CD2 C 13 23.000 0.30 A 261 LEU CG C 13 26.00 0.30 A 261 LEU N N 15 119.000 0.40 A 262 TYR H H 1 7.750 0.04 A 262 TYR HA H 1 4.710 0.04 A 262 TYR HBy H 1 3.110 0.04 A 262 TYR HBx H 1 2.790 0.04 A 262 TYR HD1 H 1 7.310 0.04 A 262 TYR HE1 H 1 6.860 0.04 A 262 TYR C C 13 174.500 0.30 A 262 TYR CA C 13 59.000 0.30 A 262 TYR CB C 13 40.780 0.30 A 262 TYR CD1 C 13 131.600 0.30 A 262 TYR CE1 C 13 116.000 0.30 A 262 TYR N N 15 114.630 0.40 A 263 GLY H H 1 8.150 0.04 A 263 GLY HAy H 1 4.490 0.04 A 263 GLY HAx H 1 3.870 0.04 A 263 GLY C C 13 174.600 0.30 A 263 GLY CA C 13 47.400 0.30 A 263 GLY N N 15 115.840 0.40 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin pre save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond save_