data_nef_c16249_2khm 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 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 1 92 CYS SG 2 92 CYS SG 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 1 MET start . . 2 A 2 ALA middle . . 3 A 3 SER middle . . 4 A 4 MET middle . . 5 A 5 THR middle . . 6 A 6 GLY middle . false 7 A 7 GLY middle . false 8 A 8 GLN middle . . 9 A 9 GLN middle . . 10 A 10 MET middle . . 11 A 11 GLY middle . false 12 A 12 ARG middle . . 13 A 13 GLY middle . false 14 A 14 SER middle . . 15 A 15 MET middle . . 16 A 16 GLY middle . false 17 A 17 ALA middle . . 18 A 18 ALA middle . . 19 A 19 SER middle . . 20 A 20 ALA middle . . 21 A 21 ALA middle . . 22 A 22 VAL middle . . 23 A 23 SER middle . . 24 A 24 VAL middle . . 25 A 25 GLY middle . false 26 A 26 GLY middle . false 27 A 27 TYR middle . . 28 A 28 GLY middle . false 29 A 29 PRO middle . false 30 A 30 GLN middle . . 31 A 31 SER middle . . 32 A 32 SER middle . . 33 A 33 SER middle . . 34 A 34 ALA middle . . 35 A 35 PRO middle . false 36 A 36 VAL middle . . 37 A 37 ALA middle . . 38 A 38 SER middle . . 39 A 39 ALA middle . . 40 A 40 ALA middle . . 41 A 41 ALA middle . . 42 A 42 SER middle . . 43 A 43 ARG middle . . 44 A 44 LEU middle . . 45 A 45 SER middle . . 46 A 46 SER middle . . 47 A 47 PRO middle . false 48 A 48 ALA middle . . 49 A 49 ALA middle . . 50 A 50 SER middle . . 51 A 51 SER middle . . 52 A 52 ARG middle . . 53 A 53 VAL middle . . 54 A 54 SER middle . . 55 A 55 SER middle . . 56 A 56 ALA middle . . 57 A 57 VAL middle . . 58 A 58 SER middle . . 59 A 59 SER middle . . 60 A 60 LEU middle . . 61 A 61 VAL middle . . 62 A 62 SER middle . . 63 A 63 SER middle . . 64 A 64 GLY middle . false 65 A 65 PRO middle . false 66 A 66 THR middle . . 67 A 67 ASN middle . . 68 A 68 GLN middle . . 69 A 69 ALA middle . . 70 A 70 ALA middle . . 71 A 71 LEU middle . . 72 A 72 SER middle . . 73 A 73 ASN middle . . 74 A 74 THR middle . . 75 A 75 ILE middle . . 76 A 76 SER middle . . 77 A 77 SER middle . . 78 A 78 VAL middle . . 79 A 79 VAL middle . . 80 A 80 SER middle . . 81 A 81 GLN middle . . 82 A 82 VAL middle . . 83 A 83 SER middle . . 84 A 84 ALA middle . . 85 A 85 SER middle . . 86 A 86 ASN middle . . 87 A 87 PRO middle . false 88 A 88 GLY middle . false 89 A 89 LEU middle . . 90 A 90 SER middle . . 91 A 91 GLY middle . false 92 A 92 CYS middle -HG . 93 A 93 ASP middle . . 94 A 94 VAL middle . . 95 A 95 LEU middle . . 96 A 96 VAL middle . . 97 A 97 GLN middle . . 98 A 98 ALA middle . . 99 A 99 LEU middle . . 100 A 100 LEU middle . . 101 A 101 GLU middle . . 102 A 102 VAL middle . . 103 A 103 VAL middle . . 104 A 104 SER middle . . 105 A 105 ALA middle . . 106 A 106 LEU middle . . 107 A 107 VAL middle . . 108 A 108 SER middle . . 109 A 109 ILE middle . . 110 A 110 LEU middle . . 111 A 111 GLY middle . false 112 A 112 SER middle . . 113 A 113 SER middle . . 114 A 114 SER middle . . 115 A 115 ILE middle . . 116 A 116 GLY middle . false 117 A 117 GLN middle . . 118 A 118 ILE middle . . 119 A 119 ASN middle . . 120 A 120 TYR middle . . 121 A 121 GLY middle . false 122 A 122 ALA middle . . 123 A 123 SER middle . . 124 A 124 ALA middle . . 125 A 125 GLN middle . . 126 A 126 TYR middle . . 127 A 127 THR middle . . 128 A 128 GLN middle . . 129 A 129 MET middle . . 130 A 130 VAL middle . . 131 A 131 GLY middle . false 132 A 132 GLN middle . . 133 A 133 SER middle . . 134 A 134 VAL middle . . 135 A 135 ALA middle . . 136 A 136 GLN middle . . 137 A 137 ALA middle . . 138 A 138 LEU middle . . 139 A 139 ALA middle . . 140 A 140 GLY end . false 141 B 1 MET start . . 142 B 2 ALA middle . . 143 B 3 SER middle . . 144 B 4 MET middle . . 145 B 5 THR middle . . 146 B 6 GLY middle . false 147 B 7 GLY middle . false 148 B 8 GLN middle . . 149 B 9 GLN middle . . 150 B 10 MET middle . . 151 B 11 GLY middle . false 152 B 12 ARG middle . . 153 B 13 GLY middle . false 154 B 14 SER middle . . 155 B 15 MET middle . . 156 B 16 GLY middle . false 157 B 17 ALA middle . . 158 B 18 ALA middle . . 159 B 19 SER middle . . 160 B 20 ALA middle . . 161 B 21 ALA middle . . 162 B 22 VAL middle . . 163 B 23 SER middle . . 164 B 24 VAL middle . . 165 B 25 GLY middle . false 166 B 26 GLY middle . false 167 B 27 TYR middle . . 168 B 28 GLY middle . false 169 B 29 PRO middle . false 170 B 30 GLN middle . . 171 B 31 SER middle . . 172 B 32 SER middle . . 173 B 33 SER middle . . 174 B 34 ALA middle . . 175 B 35 PRO middle . false 176 B 36 VAL middle . . 177 B 37 ALA middle . . 178 B 38 SER middle . . 179 B 39 ALA middle . . 180 B 40 ALA middle . . 181 B 41 ALA middle . . 182 B 42 SER middle . . 183 B 43 ARG middle . . 184 B 44 LEU middle . . 185 B 45 SER middle . . 186 B 46 SER middle . . 187 B 47 PRO middle . false 188 B 48 ALA middle . . 189 B 49 ALA middle . . 190 B 50 SER middle . . 191 B 51 SER middle . . 192 B 52 ARG middle . . 193 B 53 VAL middle . . 194 B 54 SER middle . . 195 B 55 SER middle . . 196 B 56 ALA middle . . 197 B 57 VAL middle . . 198 B 58 SER middle . . 199 B 59 SER middle . . 200 B 60 LEU middle . . 201 B 61 VAL middle . . 202 B 62 SER middle . . 203 B 63 SER middle . . 204 B 64 GLY middle . false 205 B 65 PRO middle . false 206 B 66 THR middle . . 207 B 67 ASN middle . . 208 B 68 GLN middle . . 209 B 69 ALA middle . . 210 B 70 ALA middle . . 211 B 71 LEU middle . . 212 B 72 SER middle . . 213 B 73 ASN middle . . 214 B 74 THR middle . . 215 B 75 ILE middle . . 216 B 76 SER middle . . 217 B 77 SER middle . . 218 B 78 VAL middle . . 219 B 79 VAL middle . . 220 B 80 SER middle . . 221 B 81 GLN middle . . 222 B 82 VAL middle . . 223 B 83 SER middle . . 224 B 84 ALA middle . . 225 B 85 SER middle . . 226 B 86 ASN middle . . 227 B 87 PRO middle . false 228 B 88 GLY middle . false 229 B 89 LEU middle . . 230 B 90 SER middle . . 231 B 91 GLY middle . false 232 B 92 CYS middle -HG . 233 B 93 ASP middle . . 234 B 94 VAL middle . . 235 B 95 LEU middle . . 236 B 96 VAL middle . . 237 B 97 GLN middle . . 238 B 98 ALA middle . . 239 B 99 LEU middle . . 240 B 100 LEU middle . . 241 B 101 GLU middle . . 242 B 102 VAL middle . . 243 B 103 VAL middle . . 244 B 104 SER middle . . 245 B 105 ALA middle . . 246 B 106 LEU middle . . 247 B 107 VAL middle . . 248 B 108 SER middle . . 249 B 109 ILE middle . . 250 B 110 LEU middle . . 251 B 111 GLY middle . false 252 B 112 SER middle . . 253 B 113 SER middle . . 254 B 114 SER middle . . 255 B 115 ILE middle . . 256 B 116 GLY middle . false 257 B 117 GLN middle . . 258 B 118 ILE middle . . 259 B 119 ASN middle . . 260 B 120 TYR middle . . 261 B 121 GLY middle . false 262 B 122 ALA middle . . 263 B 123 SER middle . . 264 B 124 ALA middle . . 265 B 125 GLN middle . . 266 B 126 TYR middle . . 267 B 127 THR middle . . 268 B 128 GLN middle . . 269 B 129 MET middle . . 270 B 130 VAL middle . . 271 B 131 GLY middle . false 272 B 132 GLN middle . . 273 B 133 SER middle . . 274 B 134 VAL middle . . 275 B 135 ALA middle . . 276 B 136 GLN middle . . 277 B 137 ALA middle . . 278 B 138 LEU middle . . 279 B 139 ALA middle . . 280 B 140 GLY end . false stop_ save_ save_assigned_chem_shift_list_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_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 2 ALA HA H 1 4.56 0.02 A 2 ALA HB% H 1 1.33 0.02 A 2 ALA CA C 13 50.47 0.05 A 2 ALA CB C 13 18.16 0.05 A 3 SER H H 1 8.20 0.02 A 3 SER N N 15 115.11 0.05 A 4 MET H H 1 8.39 0.02 A 4 MET HA H 1 4.57 0.02 A 4 MET HBy H 1 2.10 0.02 A 4 MET HBx H 1 1.99 0.02 A 4 MET HE% H 1 2.05 0.02 A 4 MET HGy H 1 2.59 0.02 A 4 MET HGx H 1 2.52 0.02 A 4 MET CA C 13 55.66 0.05 A 4 MET CB C 13 33.02 0.05 A 4 MET CE C 13 16.98 0.05 A 4 MET CG C 13 32.30 0.05 A 4 MET N N 15 121.85 0.05 A 5 THR H H 1 8.15 0.02 A 5 THR HA H 1 4.35 0.02 A 5 THR HB H 1 4.21 0.02 A 5 THR C C 13 174.30 0.05 A 5 THR CA C 13 61.92 0.05 A 5 THR CB C 13 69.90 0.05 A 5 THR CG2 C 13 21.52 0.05 A 5 THR N N 15 114.76 0.05 A 6 GLY H H 1 8.37 0.02 A 6 GLY HA2 H 1 3.97 0.02 A 6 GLY HA3 H 1 3.97 0.02 A 6 GLY C C 13 174.81 0.05 A 6 GLY CA C 13 45.46 0.05 A 6 GLY N N 15 111.19 0.05 A 7 GLY H H 1 8.25 0.02 A 7 GLY HA2 H 1 3.92 0.02 A 7 GLY HA3 H 1 3.92 0.02 A 7 GLY C C 13 174.39 0.05 A 7 GLY CA C 13 45.28 0.05 A 7 GLY N N 15 108.51 0.05 A 8 GLN H H 1 8.25 0.02 A 8 GLN HA H 1 4.28 0.02 A 8 GLN HBy H 1 2.06 0.02 A 8 GLN HBx H 1 1.94 0.02 A 8 GLN HG2 H 1 2.29 0.02 A 8 GLN HG3 H 1 2.29 0.02 A 8 GLN C C 13 176.20 0.05 A 8 GLN CA C 13 56.05 0.05 A 8 GLN CB C 13 29.32 0.05 A 8 GLN CG C 13 33.74 0.05 A 8 GLN N N 15 119.71 0.05 A 9 GLN H H 1 8.44 0.02 A 9 GLN HA H 1 4.28 0.02 A 9 GLN HBy H 1 2.05 0.02 A 9 GLN HBx H 1 1.94 0.02 A 9 GLN HG2 H 1 2.30 0.02 A 9 GLN HG3 H 1 2.30 0.02 A 9 GLN C C 13 176.07 0.05 A 9 GLN CA C 13 55.92 0.05 A 9 GLN CB C 13 29.14 0.05 A 9 GLN CG C 13 33.59 0.05 A 9 GLN N N 15 121.20 0.05 A 10 MET H H 1 8.37 0.02 A 10 MET HA H 1 4.45 0.02 A 10 MET HBy H 1 2.07 0.02 A 10 MET HBx H 1 1.98 0.02 A 10 MET HE% H 1 2.05 0.02 A 10 MET HGy H 1 2.58 0.02 A 10 MET HGx H 1 2.50 0.02 A 10 MET C C 13 176.77 0.05 A 10 MET CA C 13 55.57 0.05 A 10 MET CB C 13 32.76 0.05 A 10 MET CE C 13 16.98 0.05 A 10 MET CG C 13 32.08 0.05 A 10 MET N N 15 121.40 0.05 A 11 GLY H H 1 8.39 0.02 A 11 GLY HA2 H 1 3.93 0.02 A 11 GLY HA3 H 1 3.93 0.02 A 11 GLY C C 13 174.30 0.05 A 11 GLY CA C 13 45.37 0.05 A 11 GLY N N 15 109.96 0.05 A 12 ARG H H 1 8.22 0.02 A 12 ARG HA H 1 4.31 0.02 A 12 ARG HBy H 1 1.86 0.02 A 12 ARG HBx H 1 1.72 0.02 A 12 ARG HD2 H 1 3.16 0.02 A 12 ARG HD3 H 1 3.16 0.02 A 12 ARG HGy H 1 1.62 0.02 A 12 ARG HGx H 1 1.57 0.02 A 12 ARG C C 13 177.10 0.05 A 12 ARG CA C 13 56.33 0.05 A 12 ARG CB C 13 30.74 0.05 A 12 ARG CD C 13 43.60 0.05 A 12 ARG CG C 13 27.07 0.05 A 12 ARG N N 15 120.54 0.05 A 13 GLY H H 1 8.44 0.02 A 13 GLY HA2 H 1 3.96 0.02 A 13 GLY HA3 H 1 3.96 0.02 A 13 GLY C C 13 174.30 0.05 A 13 GLY CA C 13 45.35 0.05 A 13 GLY N N 15 109.78 0.05 A 14 SER H H 1 8.19 0.02 A 14 SER HA H 1 4.37 0.02 A 14 SER HB2 H 1 3.81 0.02 A 14 SER HB3 H 1 3.81 0.02 A 14 SER C C 13 174.88 0.05 A 14 SER CA C 13 58.47 0.05 A 14 SER CB C 13 63.91 0.05 A 14 SER N N 15 115.65 0.05 A 15 MET H H 1 8.37 0.02 A 15 MET HA H 1 4.46 0.02 A 15 MET HBy H 1 2.09 0.02 A 15 MET HBx H 1 2.00 0.02 A 15 MET HE% H 1 2.05 0.02 A 15 MET HGy H 1 2.59 0.02 A 15 MET HGx H 1 2.52 0.02 A 15 MET C C 13 176.78 0.05 A 15 MET CA C 13 55.77 0.05 A 15 MET CB C 13 32.72 0.05 A 15 MET CE C 13 16.98 0.05 A 15 MET CG C 13 32.08 0.05 A 15 MET N N 15 121.58 0.05 A 16 GLY H H 1 8.30 0.02 A 16 GLY HA2 H 1 3.88 0.02 A 16 GLY HA3 H 1 3.88 0.02 A 16 GLY C C 13 173.91 0.05 A 16 GLY CA C 13 45.28 0.05 A 16 GLY N N 15 109.73 0.05 A 17 ALA H H 1 8.10 0.02 A 17 ALA HA H 1 4.28 0.02 A 17 ALA HB% H 1 1.35 0.02 A 17 ALA C C 13 177.80 0.05 A 17 ALA CA C 13 52.48 0.05 A 17 ALA CB C 13 19.33 0.05 A 17 ALA N N 15 123.88 0.05 A 18 ALA H H 1 8.25 0.02 A 18 ALA HA H 1 4.28 0.02 A 18 ALA HB% H 1 1.38 0.02 A 18 ALA C C 13 177.96 0.05 A 18 ALA CA C 13 52.63 0.05 A 18 ALA CB C 13 19.08 0.05 A 18 ALA N N 15 123.08 0.05 A 19 SER H H 1 8.10 0.02 A 19 SER HA H 1 4.35 0.02 A 19 SER HB2 H 1 3.84 0.02 A 19 SER HB3 H 1 3.84 0.02 A 19 SER C C 13 174.35 0.05 A 19 SER CA C 13 58.35 0.05 A 19 SER CB C 13 63.81 0.05 A 19 SER N N 15 114.61 0.05 A 20 ALA H H 1 8.17 0.02 A 20 ALA HA H 1 4.26 0.02 A 20 ALA HB% H 1 1.34 0.02 A 20 ALA C C 13 177.34 0.05 A 20 ALA CA C 13 52.44 0.05 A 20 ALA CB C 13 19.31 0.05 A 20 ALA N N 15 125.65 0.05 A 21 ALA H H 1 8.11 0.02 A 21 ALA HA H 1 4.29 0.02 A 21 ALA HB% H 1 1.33 0.02 A 21 ALA C C 13 177.74 0.05 A 21 ALA CA C 13 52.65 0.05 A 21 ALA CB C 13 19.14 0.05 A 21 ALA N N 15 122.95 0.05 A 22 VAL H H 1 7.94 0.02 A 22 VAL HA H 1 4.10 0.02 A 22 VAL HB H 1 2.02 0.02 A 22 VAL HG1% H 1 0.90 0.02 A 22 VAL HG2% H 1 0.90 0.02 A 22 VAL C C 13 176.17 0.05 A 22 VAL CA C 13 62.25 0.05 A 22 VAL CB C 13 32.88 0.05 A 22 VAL CG1 C 13 21.31 0.05 A 22 VAL CG2 C 13 20.41 0.05 A 22 VAL N N 15 118.60 0.05 A 23 SER H H 1 8.27 0.02 A 23 SER HA H 1 4.47 0.02 A 23 SER HB2 H 1 3.81 0.02 A 23 SER HB3 H 1 3.81 0.02 A 23 SER C C 13 174.59 0.05 A 23 SER CA C 13 58.06 0.05 A 23 SER CB C 13 63.80 0.05 A 23 SER N N 15 119.26 0.05 A 24 VAL H H 1 8.16 0.02 A 24 VAL HA H 1 4.13 0.02 A 24 VAL HB H 1 2.06 0.02 A 24 VAL HG1% H 1 0.90 0.02 A 24 VAL HG2% H 1 0.90 0.02 A 24 VAL C C 13 176.68 0.05 A 24 VAL CA C 13 62.47 0.05 A 24 VAL CB C 13 32.86 0.05 A 24 VAL CG1 C 13 21.06 0.05 A 24 VAL CG2 C 13 20.42 0.05 A 24 VAL N N 15 121.72 0.05 A 25 GLY H H 1 8.37 0.02 A 25 GLY HA2 H 1 3.91 0.02 A 25 GLY HA3 H 1 3.91 0.02 A 25 GLY C C 13 174.45 0.05 A 25 GLY CA C 13 45.26 0.05 A 25 GLY N N 15 111.95 0.05 A 26 GLY H H 1 8.10 0.02 A 26 GLY HA2 H 1 3.84 0.02 A 26 GLY HA3 H 1 3.84 0.02 A 26 GLY C C 13 173.78 0.05 A 26 GLY CA C 13 45.12 0.05 A 26 GLY N N 15 108.32 0.05 A 27 TYR H H 1 8.04 0.02 A 27 TYR HA H 1 4.60 0.02 A 27 TYR HB2 H 1 2.88 0.02 A 27 TYR HB3 H 1 3.08 0.02 A 27 TYR HD1 H 1 7.05 0.02 A 27 TYR HD2 H 1 7.05 0.02 A 27 TYR HE1 H 1 6.75 0.02 A 27 TYR HE2 H 1 6.75 0.02 A 27 TYR HH H 1 10.87 0.02 A 27 TYR C C 13 176.04 0.05 A 27 TYR CA C 13 57.72 0.05 A 27 TYR CB C 13 39.15 0.05 A 27 TYR CD1 C 13 133.30 0.05 A 27 TYR CD2 C 13 133.30 0.05 A 27 TYR CE1 C 13 118.30 0.05 A 27 TYR CE2 C 13 118.30 0.05 A 27 TYR N N 15 119.49 0.05 A 28 GLY H H 1 8.21 0.02 A 28 GLY HA2 H 1 4.06 0.02 A 28 GLY HA3 H 1 4.06 0.02 A 28 GLY CA C 13 44.75 0.05 A 28 GLY N N 15 110.51 0.05 A 29 PRO HA H 1 4.39 0.02 A 29 PRO HB2 H 1 1.94 0.02 A 29 PRO HB3 H 1 2.28 0.02 A 29 PRO HDy H 1 3.61 0.02 A 29 PRO HDx H 1 3.58 0.02 A 29 PRO HGy H 1 2.01 0.02 A 29 PRO HGx H 1 1.97 0.02 A 29 PRO CA C 13 63.71 0.05 A 29 PRO CB C 13 32.08 0.05 A 29 PRO CD C 13 49.95 0.05 A 29 PRO CG C 13 27.40 0.05 A 30 GLN H H 1 8.54 0.02 A 30 GLN HA H 1 4.30 0.02 A 30 GLN HB2 H 1 1.94 0.02 A 30 GLN HB3 H 1 2.11 0.02 A 30 GLN HE21 H 1 7.40 0.02 A 30 GLN HE22 H 1 6.73 0.02 A 30 GLN HG2 H 1 2.36 0.02 A 30 GLN HG3 H 1 2.36 0.02 A 30 GLN C C 13 176.36 0.05 A 30 GLN CA C 13 56.16 0.05 A 30 GLN CB C 13 29.14 0.05 A 30 GLN CD C 13 180.80 0.05 A 30 GLN CG C 13 33.70 0.05 A 30 GLN N N 15 119.55 0.05 A 30 GLN NE2 N 15 112.22 0.05 A 31 SER H H 1 8.24 0.02 A 31 SER HA H 1 4.41 0.02 A 31 SER HB2 H 1 3.84 0.02 A 31 SER HB3 H 1 3.95 0.02 A 31 SER CA C 13 58.27 0.05 A 31 SER CB C 13 63.94 0.05 A 31 SER N N 15 116.27 0.05 A 32 SER H H 1 8.48 0.02 A 32 SER HA H 1 4.46 0.02 A 32 SER HBy H 1 3.96 0.02 A 32 SER HBx H 1 3.86 0.02 A 32 SER CA C 13 59.02 0.05 A 32 SER CB C 13 63.85 0.05 A 32 SER N N 15 118.10 0.05 A 33 SER H H 1 8.45 0.02 A 33 SER HA H 1 4.18 0.02 A 33 SER HB2 H 1 3.81 0.02 A 33 SER HB3 H 1 3.73 0.02 A 33 SER C C 13 174.56 0.05 A 33 SER CA C 13 60.04 0.05 A 33 SER CB C 13 64.04 0.05 A 33 SER N N 15 117.67 0.05 A 34 ALA H H 1 8.11 0.02 A 34 ALA HA H 1 4.19 0.02 A 34 ALA HB% H 1 1.45 0.02 A 34 ALA CA C 13 56.06 0.05 A 34 ALA CB C 13 16.75 0.05 A 34 ALA N N 15 125.18 0.05 A 35 PRO HA H 1 4.37 0.02 A 35 PRO HB2 H 1 1.86 0.02 A 35 PRO HB3 H 1 2.31 0.02 A 35 PRO HDy H 1 3.67 0.02 A 35 PRO HDx H 1 3.64 0.02 A 35 PRO HGy H 1 2.06 0.02 A 35 PRO HGx H 1 2.01 0.02 A 35 PRO CA C 13 65.46 0.05 A 35 PRO CB C 13 31.27 0.05 A 35 PRO CD C 13 50.33 0.05 A 35 PRO CG C 13 28.13 0.05 A 36 VAL H H 1 7.06 0.02 A 36 VAL HA H 1 3.77 0.02 A 36 VAL HB H 1 2.02 0.02 A 36 VAL HGx% H 1 0.92 0.02 A 36 VAL HGy% H 1 0.92 0.02 A 36 VAL C C 13 178.41 0.05 A 36 VAL CA C 13 64.70 0.05 A 36 VAL CB C 13 31.78 0.05 A 36 VAL CG1 C 13 21.72 0.05 A 36 VAL CG2 C 13 21.72 0.05 A 36 VAL N N 15 118.06 0.05 A 37 ALA H H 1 8.03 0.02 A 37 ALA HA H 1 3.76 0.02 A 37 ALA HB% H 1 1.32 0.02 A 37 ALA C C 13 178.70 0.05 A 37 ALA CA C 13 55.24 0.05 A 37 ALA CB C 13 19.47 0.05 A 37 ALA N N 15 122.62 0.05 A 38 SER H H 1 8.51 0.02 A 38 SER HA H 1 3.94 0.02 A 38 SER HBy H 1 3.90 0.02 A 38 SER HBx H 1 3.86 0.02 A 38 SER C C 13 177.32 0.05 A 38 SER CA C 13 61.58 0.05 A 38 SER CB C 13 62.67 0.05 A 38 SER N N 15 112.42 0.05 A 39 ALA H H 1 7.66 0.02 A 39 ALA HA H 1 4.14 0.02 A 39 ALA HB% H 1 1.45 0.02 A 39 ALA C C 13 180.15 0.05 A 39 ALA CA C 13 54.84 0.05 A 39 ALA CB C 13 18.13 0.05 A 39 ALA N N 15 123.90 0.05 A 40 ALA H H 1 7.72 0.02 A 40 ALA HA H 1 4.04 0.02 A 40 ALA HB% H 1 1.25 0.02 A 40 ALA C C 13 179.19 0.05 A 40 ALA CA C 13 54.83 0.05 A 40 ALA CB C 13 18.51 0.05 A 40 ALA N N 15 120.51 0.05 A 41 ALA H H 1 8.37 0.02 A 41 ALA HA H 1 3.83 0.02 A 41 ALA HB% H 1 1.43 0.02 A 41 ALA C C 13 180.67 0.05 A 41 ALA CA C 13 55.33 0.05 A 41 ALA CB C 13 18.10 0.05 A 41 ALA N N 15 118.65 0.05 A 42 SER H H 1 7.64 0.02 A 42 SER HA H 1 4.23 0.02 A 42 SER HB2 H 1 3.97 0.02 A 42 SER HB3 H 1 3.97 0.02 A 42 SER C C 13 177.44 0.05 A 42 SER CA C 13 61.42 0.05 A 42 SER CB C 13 62.83 0.05 A 42 SER N N 15 112.81 0.05 A 43 ARG H H 1 7.60 0.02 A 43 ARG HA H 1 4.18 0.02 A 43 ARG HB2 H 1 1.76 0.02 A 43 ARG HB3 H 1 1.97 0.02 A 43 ARG HD2 H 1 3.34 0.02 A 43 ARG HD3 H 1 2.95 0.02 A 43 ARG HE H 1 7.60 0.02 A 43 ARG HG2 H 1 1.91 0.02 A 43 ARG HG3 H 1 1.47 0.02 A 43 ARG C C 13 178.79 0.05 A 43 ARG CA C 13 59.47 0.05 A 43 ARG CB C 13 30.30 0.05 A 43 ARG CD C 13 43.40 0.05 A 43 ARG CG C 13 29.50 0.05 A 43 ARG N N 15 121.57 0.05 A 43 ARG NE N 15 67.00 0.05 A 44 LEU H H 1 7.85 0.02 A 44 LEU HA H 1 3.89 0.02 A 44 LEU HB2 H 1 1.68 0.02 A 44 LEU HB3 H 1 1.73 0.02 A 44 LEU HD1% H 1 0.84 0.02 A 44 LEU HD2% H 1 0.78 0.02 A 44 LEU HG H 1 1.79 0.02 A 44 LEU C C 13 175.96 0.05 A 44 LEU CA C 13 56.58 0.05 A 44 LEU CB C 13 42.04 0.05 A 44 LEU CD1 C 13 25.64 0.05 A 44 LEU CD2 C 13 24.70 0.05 A 44 LEU CG C 13 27.60 0.05 A 44 LEU N N 15 119.73 0.05 A 45 SER H H 1 7.22 0.02 A 45 SER HA H 1 4.37 0.02 A 45 SER HBy H 1 3.99 0.02 A 45 SER HBx H 1 3.95 0.02 A 45 SER C C 13 174.60 0.05 A 45 SER CA C 13 58.67 0.05 A 45 SER CB C 13 63.49 0.05 A 45 SER N N 15 110.35 0.05 A 46 SER H H 1 7.45 0.02 A 46 SER HA H 1 4.76 0.02 A 46 SER HB2 H 1 4.27 0.02 A 46 SER HB3 H 1 4.01 0.02 A 46 SER CA C 13 56.53 0.05 A 46 SER CB C 13 64.30 0.05 A 46 SER N N 15 117.89 0.05 A 47 PRO HA H 1 4.43 0.02 A 47 PRO HB2 H 1 1.97 0.02 A 47 PRO HB3 H 1 2.41 0.02 A 47 PRO HDy H 1 3.97 0.02 A 47 PRO HDx H 1 3.93 0.02 A 47 PRO HGy H 1 2.16 0.02 A 47 PRO HGx H 1 2.08 0.02 A 47 PRO CA C 13 65.24 0.05 A 47 PRO CB C 13 31.87 0.05 A 47 PRO CD C 13 50.94 0.05 A 47 PRO CG C 13 27.87 0.05 A 48 ALA H H 1 8.11 0.02 A 48 ALA HA H 1 4.06 0.02 A 48 ALA HB% H 1 1.41 0.02 A 48 ALA C C 13 180.19 0.05 A 48 ALA CA C 13 54.72 0.05 A 48 ALA CB C 13 18.80 0.05 A 48 ALA N N 15 122.95 0.05 A 49 ALA H H 1 7.54 0.02 A 49 ALA HA H 1 4.07 0.02 A 49 ALA HB% H 1 1.44 0.02 A 49 ALA C C 13 179.45 0.05 A 49 ALA CA C 13 55.30 0.05 A 49 ALA CB C 13 19.10 0.05 A 49 ALA N N 15 120.65 0.05 A 50 SER H H 1 7.53 0.02 A 50 SER HA H 1 4.12 0.02 A 50 SER HB2 H 1 3.96 0.02 A 50 SER HB3 H 1 3.96 0.02 A 50 SER C C 13 177.69 0.05 A 50 SER CA C 13 62.34 0.05 A 50 SER CB C 13 62.30 0.05 A 50 SER N N 15 111.55 0.05 A 51 SER H H 1 7.87 0.02 A 51 SER HA H 1 4.29 0.02 A 51 SER HB2 H 1 3.96 0.02 A 51 SER HB3 H 1 3.96 0.02 A 51 SER C C 13 177.29 0.05 A 51 SER CA C 13 61.88 0.05 A 51 SER CB C 13 62.95 0.05 A 51 SER N N 15 117.20 0.05 A 52 ARG H H 1 7.82 0.02 A 52 ARG HA H 1 4.07 0.02 A 52 ARG HB2 H 1 2.34 0.02 A 52 ARG HB3 H 1 1.63 0.02 A 52 ARG HD2 H 1 2.86 0.02 A 52 ARG HD3 H 1 3.18 0.02 A 52 ARG HG2 H 1 1.42 0.02 A 52 ARG HG3 H 1 1.81 0.02 A 52 ARG HH11 H 1 6.39 0.02 A 52 ARG HH12 H 1 6.39 0.02 A 52 ARG C C 13 180.30 0.05 A 52 ARG CA C 13 60.74 0.05 A 52 ARG CB C 13 31.80 0.05 A 52 ARG CD C 13 44.36 0.05 A 52 ARG CG C 13 29.63 0.05 A 52 ARG N N 15 123.72 0.05 A 52 ARG NH1 N 15 84.85 0.05 A 53 VAL H H 1 8.59 0.02 A 53 VAL HA H 1 3.45 0.02 A 53 VAL HB H 1 2.16 0.02 A 53 VAL HG1% H 1 0.74 0.02 A 53 VAL HG2% H 1 1.27 0.02 A 53 VAL C C 13 178.14 0.05 A 53 VAL CA C 13 67.82 0.05 A 53 VAL CB C 13 31.94 0.05 A 53 VAL CG1 C 13 19.97 0.05 A 53 VAL CG2 C 13 22.52 0.05 A 53 VAL N N 15 121.26 0.05 A 54 SER H H 1 8.28 0.02 A 54 SER HA H 1 4.16 0.02 A 54 SER HB2 H 1 4.04 0.02 A 54 SER HB3 H 1 4.04 0.02 A 54 SER C C 13 177.27 0.05 A 54 SER CA C 13 62.89 0.05 A 54 SER CB C 13 62.90 0.05 A 54 SER N N 15 114.99 0.05 A 55 SER H H 1 7.95 0.02 A 55 SER HA H 1 4.27 0.02 A 55 SER HB2 H 1 4.03 0.02 A 55 SER HB3 H 1 4.03 0.02 A 55 SER C C 13 176.62 0.05 A 55 SER CA C 13 61.74 0.05 A 55 SER CB C 13 62.94 0.05 A 55 SER N N 15 116.55 0.05 A 56 ALA H H 1 8.32 0.02 A 56 ALA HA H 1 4.19 0.02 A 56 ALA HB% H 1 1.32 0.02 A 56 ALA C C 13 179.26 0.05 A 56 ALA CA C 13 54.87 0.05 A 56 ALA CB C 13 17.31 0.05 A 56 ALA N N 15 126.46 0.05 A 57 VAL H H 1 8.78 0.02 A 57 VAL HA H 1 3.39 0.02 A 57 VAL HB H 1 2.49 0.02 A 57 VAL HG1% H 1 0.79 0.02 A 57 VAL HG2% H 1 1.20 0.02 A 57 VAL C C 13 177.54 0.05 A 57 VAL CA C 13 67.78 0.05 A 57 VAL CB C 13 31.69 0.05 A 57 VAL CG1 C 13 22.29 0.05 A 57 VAL CG2 C 13 24.30 0.05 A 57 VAL N N 15 118.65 0.05 A 58 SER H H 1 7.82 0.02 A 58 SER HA H 1 4.24 0.02 A 58 SER HB2 H 1 3.97 0.02 A 58 SER HB3 H 1 3.97 0.02 A 58 SER C C 13 178.60 0.05 A 58 SER CA C 13 61.91 0.05 A 58 SER CB C 13 62.94 0.05 A 58 SER N N 15 111.73 0.05 A 59 SER H H 1 8.18 0.02 A 59 SER HA H 1 4.20 0.02 A 59 SER HB2 H 1 3.98 0.02 A 59 SER HB3 H 1 3.98 0.02 A 59 SER C C 13 177.05 0.05 A 59 SER CA C 13 61.65 0.05 A 59 SER CB C 13 63.25 0.05 A 59 SER N N 15 116.82 0.05 A 60 LEU H H 1 8.48 0.02 A 60 LEU HA H 1 3.89 0.02 A 60 LEU HB2 H 1 2.00 0.02 A 60 LEU HB3 H 1 0.94 0.02 A 60 LEU HD1% H 1 0.64 0.02 A 60 LEU HD2% H 1 0.68 0.02 A 60 LEU HG H 1 1.99 0.02 A 60 LEU C C 13 179.05 0.05 A 60 LEU CA C 13 57.96 0.05 A 60 LEU CB C 13 42.60 0.05 A 60 LEU CD1 C 13 25.48 0.05 A 60 LEU CD2 C 13 23.10 0.05 A 60 LEU CG C 13 26.75 0.05 A 60 LEU N N 15 122.01 0.05 A 61 VAL H H 1 8.59 0.02 A 61 VAL HA H 1 3.68 0.02 A 61 VAL HB H 1 2.18 0.02 A 61 VAL HGx% H 1 0.93 0.02 A 61 VAL HGy% H 1 1.00 0.02 A 61 VAL C C 13 178.63 0.05 A 61 VAL CA C 13 66.08 0.05 A 61 VAL CB C 13 31.69 0.05 A 61 VAL CG1 C 13 21.70 0.05 A 61 VAL CG2 C 13 23.15 0.05 A 61 VAL N N 15 116.11 0.05 A 62 SER H H 1 7.82 0.02 A 62 SER HA H 1 4.22 0.02 A 62 SER HB2 H 1 3.99 0.02 A 62 SER HB3 H 1 3.99 0.02 A 62 SER C C 13 176.43 0.05 A 62 SER CA C 13 61.62 0.05 A 62 SER CB C 13 63.11 0.05 A 62 SER N N 15 114.20 0.05 A 63 SER H H 1 7.55 0.02 A 63 SER HA H 1 4.60 0.02 A 63 SER HB2 H 1 3.70 0.02 A 63 SER HB3 H 1 3.88 0.02 A 63 SER C C 13 173.81 0.05 A 63 SER CA C 13 59.82 0.05 A 63 SER CB C 13 64.65 0.05 A 63 SER N N 15 113.35 0.05 A 64 GLY H H 1 7.63 0.02 A 64 GLY HA2 H 1 3.86 0.02 A 64 GLY HA3 H 1 4.35 0.02 A 64 GLY CA C 13 43.41 0.05 A 64 GLY N N 15 112.82 0.05 A 65 PRO HA H 1 4.19 0.02 A 65 PRO HB2 H 1 1.78 0.02 A 65 PRO HB3 H 1 1.87 0.02 A 65 PRO HD2 H 1 3.82 0.02 A 65 PRO HD3 H 1 3.75 0.02 A 65 PRO HGy H 1 1.83 0.02 A 65 PRO HGx H 1 1.67 0.02 A 65 PRO CA C 13 64.34 0.05 A 65 PRO CB C 13 32.66 0.05 A 65 PRO CD C 13 50.75 0.05 A 65 PRO CG C 13 27.85 0.05 A 66 THR H H 1 7.19 0.02 A 66 THR HA H 1 4.19 0.02 A 66 THR HB H 1 4.53 0.02 A 66 THR HG2% H 1 0.87 0.02 A 66 THR CA C 13 59.97 0.05 A 66 THR CB C 13 68.39 0.05 A 66 THR CG2 C 13 21.90 0.05 A 66 THR N N 15 120.40 0.05 A 67 ASN H H 1 7.45 0.02 A 67 ASN HA H 1 4.75 0.02 A 67 ASN HB2 H 1 2.96 0.02 A 67 ASN HB3 H 1 2.79 0.02 A 67 ASN HD21 H 1 7.80 0.02 A 67 ASN HD22 H 1 7.04 0.02 A 67 ASN C C 13 174.99 0.05 A 67 ASN CA C 13 52.68 0.05 A 67 ASN CB C 13 40.52 0.05 A 67 ASN CG C 13 176.90 0.05 A 67 ASN N N 15 120.30 0.05 A 67 ASN ND2 N 15 114.60 0.05 A 68 GLN H H 1 8.90 0.02 A 68 GLN HA H 1 3.89 0.02 A 68 GLN HB2 H 1 2.17 0.02 A 68 GLN HB3 H 1 1.93 0.02 A 68 GLN HE21 H 1 7.36 0.02 A 68 GLN HE22 H 1 6.88 0.02 A 68 GLN HG2 H 1 2.19 0.02 A 68 GLN HG3 H 1 2.37 0.02 A 68 GLN C C 13 177.69 0.05 A 68 GLN CA C 13 59.76 0.05 A 68 GLN CB C 13 29.10 0.05 A 68 GLN CD C 13 179.60 0.05 A 68 GLN CG C 13 33.34 0.05 A 68 GLN N N 15 126.83 0.05 A 68 GLN NE2 N 15 111.20 0.05 A 69 ALA H H 1 8.27 0.02 A 69 ALA HA H 1 4.06 0.02 A 69 ALA HB% H 1 1.41 0.02 A 69 ALA C C 13 179.95 0.05 A 69 ALA CA C 13 55.17 0.05 A 69 ALA CB C 13 17.82 0.05 A 69 ALA N N 15 121.45 0.05 A 70 ALA H H 1 7.72 0.02 A 70 ALA HA H 1 4.11 0.02 A 70 ALA HB% H 1 1.47 0.02 A 70 ALA C C 13 181.70 0.05 A 70 ALA CA C 13 54.80 0.05 A 70 ALA CB C 13 19.94 0.05 A 70 ALA N N 15 120.51 0.05 A 71 LEU H H 1 8.29 0.02 A 71 LEU HA H 1 3.86 0.02 A 71 LEU HB2 H 1 1.71 0.02 A 71 LEU HB3 H 1 1.54 0.02 A 71 LEU HDx% H 1 0.72 0.02 A 71 LEU HDy% H 1 0.74 0.02 A 71 LEU HG H 1 1.55 0.02 A 71 LEU C C 13 178.87 0.05 A 71 LEU CA C 13 58.69 0.05 A 71 LEU CB C 13 41.38 0.05 A 71 LEU CDx C 13 23.85 0.05 A 71 LEU CDy C 13 24.13 0.05 A 71 LEU CG C 13 27.35 0.05 A 71 LEU N N 15 121.45 0.05 A 72 SER H H 1 8.68 0.02 A 72 SER HA H 1 3.88 0.02 A 72 SER HB2 H 1 3.92 0.02 A 72 SER HB3 H 1 3.92 0.02 A 72 SER HG H 1 5.21 0.02 A 72 SER C C 13 176.52 0.05 A 72 SER CA C 13 62.75 0.05 A 72 SER CB C 13 63.20 0.05 A 72 SER N N 15 114.26 0.05 A 73 ASN H H 1 8.35 0.02 A 73 ASN HA H 1 4.39 0.02 A 73 ASN HB2 H 1 2.89 0.02 A 73 ASN HB3 H 1 2.77 0.02 A 73 ASN HD21 H 1 7.58 0.02 A 73 ASN HD22 H 1 6.91 0.02 A 73 ASN C C 13 178.23 0.05 A 73 ASN CA C 13 56.34 0.05 A 73 ASN CB C 13 38.45 0.05 A 73 ASN CG C 13 176.30 0.05 A 73 ASN N N 15 118.60 0.05 A 73 ASN ND2 N 15 112.38 0.05 A 74 THR H H 1 8.16 0.02 A 74 THR HA H 1 3.98 0.02 A 74 THR HB H 1 4.19 0.02 A 74 THR HG1 H 1 5.04 0.02 A 74 THR HG2% H 1 1.14 0.02 A 74 THR C C 13 175.60 0.05 A 74 THR CA C 13 67.70 0.05 A 74 THR CB C 13 68.40 0.05 A 74 THR CG2 C 13 21.46 0.05 A 74 THR N N 15 117.75 0.05 A 75 ILE H H 1 8.50 0.02 A 75 ILE HA H 1 3.35 0.02 A 75 ILE HB H 1 1.78 0.02 A 75 ILE HD1% H 1 0.62 0.02 A 75 ILE HG12 H 1 1.82 0.02 A 75 ILE HG13 H 1 0.75 0.02 A 75 ILE HG2% H 1 0.66 0.02 A 75 ILE C C 13 176.93 0.05 A 75 ILE CA C 13 66.63 0.05 A 75 ILE CB C 13 37.77 0.05 A 75 ILE CD1 C 13 13.00 0.05 A 75 ILE CG1 C 13 30.36 0.05 A 75 ILE CG2 C 13 17.04 0.05 A 75 ILE N N 15 120.64 0.05 A 76 SER H H 1 8.27 0.02 A 76 SER HA H 1 3.88 0.02 A 76 SER HB2 H 1 3.88 0.02 A 76 SER HB3 H 1 3.88 0.02 A 76 SER C C 13 177.35 0.05 A 76 SER CA C 13 62.01 0.05 A 76 SER CB C 13 62.92 0.05 A 76 SER N N 15 112.36 0.05 A 77 SER H H 1 7.99 0.02 A 77 SER HA H 1 4.22 0.02 A 77 SER HB2 H 1 3.97 0.02 A 77 SER HB3 H 1 3.97 0.02 A 77 SER C C 13 177.28 0.05 A 77 SER CA C 13 61.38 0.05 A 77 SER CB C 13 63.11 0.05 A 77 SER N N 15 115.62 0.05 A 78 VAL H H 1 8.48 0.02 A 78 VAL HA H 1 3.59 0.02 A 78 VAL HB H 1 1.92 0.02 A 78 VAL HG1% H 1 1.05 0.02 A 78 VAL HG2% H 1 0.95 0.02 A 78 VAL C C 13 178.18 0.05 A 78 VAL CA C 13 67.92 0.05 A 78 VAL CB C 13 31.91 0.05 A 78 VAL CG1 C 13 23.64 0.05 A 78 VAL CG2 C 13 23.43 0.05 A 78 VAL N N 15 121.29 0.05 A 79 VAL H H 1 8.52 0.02 A 79 VAL HA H 1 3.26 0.02 A 79 VAL HB H 1 2.09 0.02 A 79 VAL HG1% H 1 0.76 0.02 A 79 VAL HG2% H 1 0.82 0.02 A 79 VAL CA C 13 67.80 0.05 A 79 VAL CB C 13 31.33 0.05 A 79 VAL CG1 C 13 21.00 0.05 A 79 VAL CG2 C 13 24.41 0.05 A 79 VAL N N 15 118.80 0.05 A 80 SER H H 1 8.05 0.02 A 80 SER HA H 1 4.11 0.02 A 80 SER HB2 H 1 4.04 0.02 A 80 SER HB3 H 1 4.04 0.02 A 80 SER C C 13 177.39 0.05 A 80 SER CA C 13 62.11 0.05 A 80 SER CB C 13 62.81 0.05 A 80 SER N N 15 114.10 0.05 A 81 GLN H H 1 8.08 0.02 A 81 GLN HA H 1 4.15 0.02 A 81 GLN HB2 H 1 2.04 0.02 A 81 GLN HB3 H 1 2.16 0.02 A 81 GLN HE21 H 1 6.99 0.02 A 81 GLN HE22 H 1 6.75 0.02 A 81 GLN HG2 H 1 2.72 0.02 A 81 GLN HG3 H 1 2.31 0.02 A 81 GLN C C 13 179.85 0.05 A 81 GLN CA C 13 59.05 0.05 A 81 GLN CB C 13 30.70 0.05 A 81 GLN CD C 13 180.30 0.05 A 81 GLN CG C 13 35.14 0.05 A 81 GLN N N 15 120.47 0.05 A 81 GLN NE2 N 15 110.53 0.05 A 82 VAL H H 1 9.11 0.02 A 82 VAL HA H 1 3.23 0.02 A 82 VAL HB H 1 2.07 0.02 A 82 VAL HG1% H 1 0.83 0.02 A 82 VAL HG2% H 1 0.90 0.02 A 82 VAL C C 13 178.88 0.05 A 82 VAL CA C 13 67.40 0.05 A 82 VAL CB C 13 31.27 0.05 A 82 VAL CG1 C 13 22.55 0.05 A 82 VAL CG2 C 13 23.47 0.05 A 82 VAL N N 15 122.55 0.05 A 83 SER H H 1 8.35 0.02 A 83 SER HA H 1 4.00 0.02 A 83 SER HB2 H 1 3.98 0.02 A 83 SER HB3 H 1 3.98 0.02 A 83 SER C C 13 177.02 0.05 A 83 SER CA C 13 61.50 0.05 A 83 SER CB C 13 62.94 0.05 A 83 SER N N 15 113.73 0.05 A 84 ALA H H 1 7.87 0.02 A 84 ALA HA H 1 4.09 0.02 A 84 ALA HB% H 1 1.47 0.02 A 84 ALA C C 13 179.61 0.05 A 84 ALA CA C 13 54.54 0.05 A 84 ALA CB C 13 18.56 0.05 A 84 ALA N N 15 120.63 0.05 A 85 SER H H 1 7.49 0.02 A 85 SER HA H 1 4.41 0.02 A 85 SER HB2 H 1 3.99 0.02 A 85 SER HB3 H 1 3.90 0.02 A 85 SER HG H 1 4.71 0.02 A 85 SER C C 13 173.95 0.05 A 85 SER CA C 13 59.21 0.05 A 85 SER CB C 13 64.40 0.05 A 85 SER N N 15 108.57 0.05 A 86 ASN H H 1 7.42 0.02 A 86 ASN HA H 1 5.13 0.02 A 86 ASN HB2 H 1 2.69 0.02 A 86 ASN HB3 H 1 2.45 0.02 A 86 ASN HD21 H 1 7.85 0.02 A 86 ASN HD22 H 1 6.88 0.02 A 86 ASN C C 13 174.00 0.05 A 86 ASN CA C 13 51.84 0.05 A 86 ASN CB C 13 40.43 0.05 A 86 ASN CG C 13 178.80 0.05 A 86 ASN N N 15 118.65 0.05 A 86 ASN ND2 N 15 114.17 0.05 A 87 PRO HA H 1 4.51 0.02 A 87 PRO HB2 H 1 1.93 0.02 A 87 PRO HB3 H 1 2.28 0.02 A 87 PRO HD2 H 1 3.62 0.02 A 87 PRO HD3 H 1 3.39 0.02 A 87 PRO HG2 H 1 1.98 0.02 A 87 PRO HG3 H 1 1.98 0.02 A 87 PRO CA C 13 64.30 0.05 A 87 PRO CB C 13 31.84 0.05 A 87 PRO CD C 13 50.34 0.05 A 87 PRO CG C 13 27.35 0.05 A 88 GLY H H 1 8.58 0.02 A 88 GLY HAy H 1 3.90 0.02 A 88 GLY HAx H 1 3.82 0.02 A 88 GLY C C 13 174.74 0.05 A 88 GLY CA C 13 45.17 0.05 A 88 GLY N N 15 108.21 0.05 A 89 LEU H H 1 7.19 0.02 A 89 LEU HA H 1 4.43 0.02 A 89 LEU HB2 H 1 1.67 0.02 A 89 LEU HB3 H 1 1.54 0.02 A 89 LEU HG H 1 1.68 0.02 A 89 LEU C C 13 177.52 0.05 A 89 LEU CA C 13 54.48 0.05 A 89 LEU CB C 13 43.16 0.05 A 89 LEU CD1 C 13 22.40 0.05 A 89 LEU CD2 C 13 25.00 0.05 A 89 LEU CG C 13 26.57 0.05 A 89 LEU N N 15 120.38 0.05 A 90 SER H H 1 8.98 0.02 A 90 SER HA H 1 4.39 0.02 A 90 SER HB2 H 1 4.09 0.02 A 90 SER HB3 H 1 4.24 0.02 A 90 SER HG H 1 4.70 0.02 A 90 SER C C 13 174.48 0.05 A 90 SER CA C 13 58.17 0.05 A 90 SER CB C 13 65.10 0.05 A 90 SER N N 15 119.13 0.05 A 91 GLY H H 1 8.75 0.02 A 91 GLY HAy H 1 3.66 0.02 A 91 GLY HAx H 1 3.64 0.02 A 91 GLY CA C 13 47.52 0.05 A 91 GLY N N 15 107.55 0.05 A 92 CYS H H 1 8.62 0.02 A 92 CYS HA H 1 4.01 0.02 A 92 CYS HB2 H 1 3.29 0.02 A 92 CYS HB3 H 1 3.06 0.02 A 92 CYS CA C 13 61.44 0.05 A 92 CYS CB C 13 44.53 0.05 A 92 CYS N N 15 120.69 0.05 A 93 ASP H H 1 7.72 0.02 A 93 ASP HA H 1 4.13 0.02 A 93 ASP HB2 H 1 2.83 0.02 A 93 ASP HB3 H 1 2.43 0.02 A 93 ASP C C 13 179.07 0.05 A 93 ASP CA C 13 58.26 0.05 A 93 ASP CB C 13 41.96 0.05 A 93 ASP N N 15 120.10 0.05 A 94 VAL H H 1 8.26 0.02 A 94 VAL HA H 1 3.33 0.02 A 94 VAL HB H 1 2.02 0.02 A 94 VAL HG1% H 1 0.85 0.02 A 94 VAL HG2% H 1 0.91 0.02 A 94 VAL C C 13 177.02 0.05 A 94 VAL CA C 13 66.41 0.05 A 94 VAL CB C 13 31.70 0.05 A 94 VAL CG1 C 13 22.49 0.05 A 94 VAL CG2 C 13 24.13 0.05 A 94 VAL N N 15 118.47 0.05 A 95 LEU H H 1 7.58 0.02 A 95 LEU HA H 1 3.98 0.02 A 95 LEU HB2 H 1 1.54 0.02 A 95 LEU HB3 H 1 1.80 0.02 A 95 LEU HD1% H 1 0.81 0.02 A 95 LEU HD2% H 1 0.79 0.02 A 95 LEU HG H 1 1.83 0.02 A 95 LEU C C 13 178.37 0.05 A 95 LEU CA C 13 57.66 0.05 A 95 LEU CB C 13 42.16 0.05 A 95 LEU CD1 C 13 23.39 0.05 A 95 LEU CD2 C 13 26.64 0.05 A 95 LEU CG C 13 26.80 0.05 A 95 LEU N N 15 119.38 0.05 A 96 VAL H H 1 8.52 0.02 A 96 VAL HA H 1 3.21 0.02 A 96 VAL HB H 1 2.04 0.02 A 96 VAL HG1% H 1 0.66 0.02 A 96 VAL HG2% H 1 0.98 0.02 A 96 VAL C C 13 177.10 0.05 A 96 VAL CA C 13 67.73 0.05 A 96 VAL CB C 13 31.65 0.05 A 96 VAL CG1 C 13 21.40 0.05 A 96 VAL CG2 C 13 25.47 0.05 A 96 VAL N N 15 118.35 0.05 A 97 GLN H H 1 7.78 0.02 A 97 GLN HA H 1 3.59 0.02 A 97 GLN HB2 H 1 1.99 0.02 A 97 GLN HB3 H 1 2.07 0.02 A 97 GLN HE21 H 1 8.92 0.02 A 97 GLN HE22 H 1 5.94 0.02 A 97 GLN HGy H 1 2.28 0.02 A 97 GLN HGx H 1 2.08 0.02 A 97 GLN C C 13 177.50 0.05 A 97 GLN CA C 13 59.62 0.05 A 97 GLN CB C 13 27.68 0.05 A 97 GLN CD C 13 179.88 0.05 A 97 GLN CG C 13 32.70 0.05 A 97 GLN N N 15 117.66 0.05 A 97 GLN NE2 N 15 110.47 0.05 A 98 ALA H H 1 8.78 0.02 A 98 ALA HA H 1 3.88 0.02 A 98 ALA HB% H 1 1.29 0.02 A 98 ALA C C 13 179.88 0.05 A 98 ALA CA C 13 54.78 0.05 A 98 ALA CB C 13 20.10 0.05 A 98 ALA N N 15 118.47 0.05 A 99 LEU H H 1 8.66 0.02 A 99 LEU HA H 1 3.95 0.02 A 99 LEU HB2 H 1 2.02 0.02 A 99 LEU HB3 H 1 1.05 0.02 A 99 LEU HD1% H 1 0.79 0.02 A 99 LEU HD2% H 1 0.63 0.02 A 99 LEU HG H 1 1.94 0.02 A 99 LEU C C 13 179.24 0.05 A 99 LEU CA C 13 57.76 0.05 A 99 LEU CB C 13 42.03 0.05 A 99 LEU CD1 C 13 27.66 0.05 A 99 LEU CD2 C 13 21.70 0.05 A 99 LEU CG C 13 27.05 0.05 A 99 LEU N N 15 115.42 0.05 A 100 LEU H H 1 8.32 0.02 A 100 LEU HA H 1 3.92 0.02 A 100 LEU HB2 H 1 1.33 0.02 A 100 LEU HB3 H 1 2.11 0.65 A 100 LEU HD1% H 1 0.65 0.65 A 100 LEU HD2% H 1 0.68 0.68 A 100 LEU HG H 1 1.90 0.68 A 100 LEU C C 13 180.28 0.05 A 100 LEU CA C 13 58.18 0.05 A 100 LEU CB C 13 41.98 0.05 A 100 LEU CD1 C 13 24.10 0.05 A 100 LEU CD2 C 13 26.73 0.05 A 100 LEU CG C 13 26.62 0.05 A 100 LEU N N 15 119.94 0.05 A 101 GLU H H 1 8.27 0.02 A 101 GLU HA H 1 3.75 0.02 A 101 GLU HB2 H 1 2.09 0.02 A 101 GLU HB3 H 1 1.89 0.02 A 101 GLU HG2 H 1 2.45 0.02 A 101 GLU HG3 H 1 2.45 0.02 A 101 GLU C C 13 178.81 0.05 A 101 GLU CA C 13 61.07 0.05 A 101 GLU CB C 13 28.52 0.05 A 101 GLU CG C 13 38.37 0.05 A 101 GLU N N 15 124.79 0.05 A 102 VAL H H 1 8.41 0.02 A 102 VAL HA H 1 3.46 0.02 A 102 VAL HB H 1 2.21 0.02 A 102 VAL HG1% H 1 0.77 0.02 A 102 VAL HG2% H 1 0.92 0.02 A 102 VAL C C 13 178.22 0.05 A 102 VAL CA C 13 67.80 0.05 A 102 VAL CB C 13 31.06 0.05 A 102 VAL CG1 C 13 20.95 0.05 A 102 VAL CG2 C 13 23.44 0.05 A 102 VAL N N 15 120.91 0.05 A 103 VAL H H 1 9.01 0.02 A 103 VAL HA H 1 3.29 0.02 A 103 VAL HB H 1 2.29 0.02 A 103 VAL HG1% H 1 0.72 0.02 A 103 VAL HG2% H 1 0.93 0.02 A 103 VAL C C 13 177.29 0.05 A 103 VAL CA C 13 67.95 0.05 A 103 VAL CB C 13 31.31 0.05 A 103 VAL CG1 C 13 21.47 0.05 A 103 VAL CG2 C 13 25.13 0.05 A 103 VAL N N 15 120.77 0.05 A 104 SER H H 1 8.10 0.02 A 104 SER HA H 1 4.32 0.02 A 104 SER HB2 H 1 3.74 0.02 A 104 SER HB3 H 1 3.91 0.02 A 104 SER C C 13 175.88 0.05 A 104 SER CA C 13 63.29 0.05 A 104 SER CB C 13 63.39 0.05 A 104 SER N N 15 114.72 0.05 A 105 ALA H H 1 8.11 0.02 A 105 ALA HA H 1 3.77 0.02 A 105 ALA HB% H 1 1.38 0.02 A 105 ALA C C 13 178.71 0.05 A 105 ALA CA C 13 54.93 0.05 A 105 ALA CB C 13 18.55 0.05 A 105 ALA N N 15 125.07 0.05 A 106 LEU H H 1 8.33 0.02 A 106 LEU HA H 1 3.77 0.02 A 106 LEU HB2 H 1 2.05 0.02 A 106 LEU HB3 H 1 1.01 0.02 A 106 LEU HD1% H 1 0.78 0.02 A 106 LEU HD2% H 1 0.59 0.02 A 106 LEU HG H 1 1.84 0.02 A 106 LEU C C 13 179.30 0.05 A 106 LEU CA C 13 58.30 0.05 A 106 LEU CB C 13 42.20 0.05 A 106 LEU CD1 C 13 28.53 0.05 A 106 LEU CD2 C 13 23.02 0.05 A 106 LEU CG C 13 26.89 0.05 A 106 LEU N N 15 117.73 0.05 A 107 VAL H H 1 8.78 0.02 A 107 VAL HA H 1 3.25 0.02 A 107 VAL HB H 1 1.86 0.02 A 107 VAL HG1% H 1 0.58 0.02 A 107 VAL HG2% H 1 0.85 0.02 A 107 VAL C C 13 176.87 0.05 A 107 VAL CA C 13 67.05 0.05 A 107 VAL CB C 13 31.59 0.05 A 107 VAL CG1 C 13 22.18 0.05 A 107 VAL CG2 C 13 23.90 0.05 A 107 VAL N N 15 118.99 0.05 A 108 SER H H 1 7.55 0.02 A 108 SER HA H 1 3.37 0.02 A 108 SER HB2 H 1 3.92 0.02 A 108 SER HB3 H 1 3.63 0.02 A 108 SER HG H 1 4.43 0.02 A 108 SER C C 13 177.10 0.05 A 108 SER CA C 13 61.70 0.05 A 108 SER CB C 13 62.88 0.05 A 108 SER N N 15 114.80 0.05 A 109 ILE H H 1 7.68 0.02 A 109 ILE HA H 1 3.35 0.02 A 109 ILE HB H 1 1.72 0.02 A 109 ILE HD1% H 1 0.77 0.02 A 109 ILE HG12 H 1 0.55 0.02 A 109 ILE HG13 H 1 2.00 0.02 A 109 ILE HG2% H 1 0.67 0.02 A 109 ILE C C 13 180.44 0.05 A 109 ILE CA C 13 65.66 0.05 A 109 ILE CB C 13 38.32 0.05 A 109 ILE CD1 C 13 14.99 0.05 A 109 ILE CG1 C 13 29.70 0.05 A 109 ILE CG2 C 13 19.07 0.05 A 109 ILE N N 15 120.30 0.05 A 110 LEU H H 1 8.40 0.02 A 110 LEU HA H 1 3.75 0.02 A 110 LEU HB2 H 1 1.73 0.02 A 110 LEU HB3 H 1 1.16 0.02 A 110 LEU HD1% H 1 0.65 0.02 A 110 LEU HD2% H 1 0.60 0.02 A 110 LEU HG H 1 1.42 0.02 A 110 LEU C C 13 179.59 0.05 A 110 LEU CA C 13 58.26 0.05 A 110 LEU CB C 13 41.65 0.05 A 110 LEU CD1 C 13 26.26 0.05 A 110 LEU CD2 C 13 25.00 0.05 A 110 LEU CG C 13 27.56 0.05 A 110 LEU N N 15 123.94 0.05 A 111 GLY H H 1 8.34 0.02 A 111 GLY HA2 H 1 3.91 0.02 A 111 GLY HA3 H 1 3.76 0.02 A 111 GLY C C 13 174.70 0.05 A 111 GLY CA C 13 46.69 0.05 A 111 GLY N N 15 107.63 0.05 A 112 SER H H 1 7.36 0.02 A 112 SER HA H 1 4.82 0.02 A 112 SER HB2 H 1 4.13 0.02 A 112 SER HB3 H 1 3.58 0.02 A 112 SER HG H 1 4.19 0.02 A 112 SER C C 13 173.65 0.05 A 112 SER CA C 13 57.96 0.05 A 112 SER CB C 13 64.99 0.05 A 112 SER N N 15 115.63 0.05 A 113 SER H H 1 7.43 0.02 A 113 SER HA H 1 5.08 0.02 A 113 SER HB2 H 1 3.45 0.02 A 113 SER HB3 H 1 3.62 0.02 A 113 SER HG H 1 4.20 0.02 A 113 SER C C 13 172.36 0.05 A 113 SER CA C 13 58.78 0.05 A 113 SER CB C 13 65.23 0.05 A 113 SER N N 15 115.93 0.05 A 114 SER H H 1 8.49 0.02 A 114 SER HA H 1 4.75 0.02 A 114 SER HB2 H 1 3.70 0.02 A 114 SER HB3 H 1 3.79 0.02 A 114 SER C C 13 174.57 0.05 A 114 SER CA C 13 56.42 0.05 A 114 SER CB C 13 63.81 0.05 A 114 SER N N 15 116.72 0.05 A 115 ILE H H 1 8.80 0.02 A 115 ILE HA H 1 4.04 0.02 A 115 ILE HB H 1 1.70 0.02 A 115 ILE HD1% H 1 0.73 0.02 A 115 ILE HG12 H 1 0.99 0.02 A 115 ILE HG13 H 1 1.44 0.02 A 115 ILE HG2% H 1 0.85 0.02 A 115 ILE C C 13 176.90 0.05 A 115 ILE CA C 13 62.51 0.05 A 115 ILE CB C 13 38.32 0.05 A 115 ILE CD1 C 13 13.74 0.05 A 115 ILE CG1 C 13 27.04 0.05 A 115 ILE CG2 C 13 17.36 0.05 A 115 ILE N N 15 129.77 0.05 A 116 GLY H H 1 7.79 0.02 A 116 GLY HA2 H 1 4.42 0.02 A 116 GLY HA3 H 1 3.62 0.02 A 116 GLY C C 13 172.84 0.05 A 116 GLY CA C 13 44.19 0.05 A 116 GLY N N 15 117.70 0.05 A 117 GLN H H 1 8.16 0.02 A 117 GLN HA H 1 4.17 0.02 A 117 GLN HBy H 1 2.05 0.02 A 117 GLN HBx H 1 1.92 0.02 A 117 GLN HE21 H 1 7.52 0.02 A 117 GLN HE22 H 1 6.79 0.02 A 117 GLN HG2 H 1 2.30 0.02 A 117 GLN HG3 H 1 2.30 0.02 A 117 GLN C C 13 176.45 0.05 A 117 GLN CA C 13 55.98 0.05 A 117 GLN CB C 13 28.85 0.05 A 117 GLN CG C 13 33.76 0.05 A 117 GLN N N 15 120.21 0.05 A 117 GLN NE2 N 15 111.90 0.05 A 118 ILE H H 1 8.30 0.02 A 118 ILE HA H 1 3.78 0.02 A 118 ILE HB H 1 1.55 0.02 A 118 ILE HD1% H 1 0.57 0.02 A 118 ILE HG12 H 1 1.21 0.02 A 118 ILE HG13 H 1 1.36 0.02 A 118 ILE HG2% H 1 0.04 0.02 A 118 ILE C C 13 175.72 0.05 A 118 ILE CA C 13 59.54 0.05 A 118 ILE CB C 13 37.29 0.05 A 118 ILE CD1 C 13 11.31 0.05 A 118 ILE CG1 C 13 27.25 0.05 A 118 ILE CG2 C 13 16.39 0.05 A 118 ILE N N 15 126.47 0.05 A 119 ASN H H 1 8.09 0.02 A 119 ASN HA H 1 4.88 0.02 A 119 ASN HB2 H 1 2.98 0.02 A 119 ASN HB3 H 1 2.69 0.02 A 119 ASN HD21 H 1 7.64 0.02 A 119 ASN HD22 H 1 6.87 0.02 A 119 ASN C C 13 176.52 0.05 A 119 ASN CA C 13 51.05 0.05 A 119 ASN CB C 13 37.38 0.05 A 119 ASN N N 15 124.20 0.05 A 119 ASN ND2 N 15 111.30 0.05 A 120 TYR H H 1 8.58 0.02 A 120 TYR HA H 1 4.00 0.02 A 120 TYR HB2 H 1 3.12 0.02 A 120 TYR HB3 H 1 2.86 0.02 A 120 TYR HD1 H 1 7.15 0.02 A 120 TYR HD2 H 1 7.15 0.02 A 120 TYR HE1 H 1 6.78 0.02 A 120 TYR HE2 H 1 6.78 0.02 A 120 TYR HH H 1 10.92 0.02 A 120 TYR C C 13 178.49 0.05 A 120 TYR CA C 13 62.41 0.05 A 120 TYR CB C 13 37.59 0.05 A 120 TYR CD1 C 13 133.60 0.05 A 120 TYR CD2 C 13 133.60 0.05 A 120 TYR CE1 C 13 119.10 0.05 A 120 TYR CE2 C 13 119.10 0.05 A 120 TYR N N 15 125.60 0.05 A 121 GLY H H 1 8.57 0.02 A 121 GLY HA2 H 1 4.03 0.02 A 121 GLY HA3 H 1 3.93 0.02 A 121 GLY C C 13 175.22 0.05 A 121 GLY CA C 13 46.31 0.05 A 121 GLY N N 15 108.43 0.05 A 122 ALA H H 1 7.32 0.02 A 122 ALA HA H 1 4.46 0.02 A 122 ALA HB% H 1 1.45 0.02 A 122 ALA C C 13 178.10 0.05 A 122 ALA CA C 13 52.66 0.05 A 122 ALA CB C 13 19.17 0.05 A 122 ALA N N 15 121.82 0.05 A 123 SER H H 1 7.73 0.02 A 123 SER HA H 1 4.38 0.02 A 123 SER HB2 H 1 3.87 0.02 A 123 SER HB3 H 1 3.99 0.02 A 123 SER HG H 1 5.43 0.02 A 123 SER C C 13 176.87 0.05 A 123 SER CA C 13 62.44 0.05 A 123 SER CB C 13 63.29 0.05 A 123 SER N N 15 114.41 0.05 A 124 ALA H H 1 8.31 0.02 A 124 ALA HA H 1 4.28 0.02 A 124 ALA HB% H 1 1.44 0.02 A 124 ALA C C 13 179.70 0.05 A 124 ALA CA C 13 55.33 0.05 A 124 ALA CB C 13 17.89 0.05 A 124 ALA N N 15 125.47 0.05 A 125 GLN H H 1 7.68 0.02 A 125 GLN HA H 1 4.01 0.02 A 125 GLN HB2 H 1 1.99 0.02 A 125 GLN HB3 H 1 1.89 0.02 A 125 GLN HE21 H 1 7.12 0.02 A 125 GLN HE22 H 1 6.58 0.02 A 125 GLN HG2 H 1 2.07 0.02 A 125 GLN HG3 H 1 2.07 0.02 A 125 GLN C C 13 179.44 0.05 A 125 GLN CA C 13 58.70 0.05 A 125 GLN CB C 13 27.95 0.05 A 125 GLN CD C 13 180.00 0.05 A 125 GLN CG C 13 33.63 0.05 A 125 GLN N N 15 118.63 0.05 A 125 GLN NE2 N 15 110.97 0.05 A 126 TYR H H 1 8.01 0.02 A 126 TYR HA H 1 4.38 0.02 A 126 TYR HBy H 1 2.92 0.02 A 126 TYR HBx H 1 2.88 0.02 A 126 TYR HD1 H 1 7.04 0.02 A 126 TYR HD2 H 1 7.04 0.02 A 126 TYR HE1 H 1 6.80 0.02 A 126 TYR HE2 H 1 6.80 0.02 A 126 TYR HH H 1 10.62 0.02 A 126 TYR C C 13 177.49 0.05 A 126 TYR CA C 13 62.35 0.05 A 126 TYR CB C 13 37.71 0.05 A 126 TYR CD1 C 13 133.70 0.05 A 126 TYR CD2 C 13 133.70 0.05 A 126 TYR CE1 C 13 118.70 0.05 A 126 TYR CE2 C 13 118.70 0.05 A 126 TYR N N 15 118.96 0.05 A 127 THR H H 1 8.19 0.02 A 127 THR HA H 1 4.19 0.02 A 127 THR HB H 1 4.23 0.02 A 127 THR HG1 H 1 4.69 0.02 A 127 THR HG2% H 1 1.22 0.02 A 127 THR C C 13 176.55 0.05 A 127 THR CA C 13 66.74 0.05 A 127 THR CB C 13 68.60 0.05 A 127 THR CG2 C 13 22.35 0.05 A 127 THR N N 15 116.82 0.05 A 128 GLN H H 1 7.59 0.02 A 128 GLN HA H 1 3.96 0.02 A 128 GLN HBy H 1 2.03 0.02 A 128 GLN HBx H 1 2.01 0.02 A 128 GLN HE21 H 1 7.37 0.02 A 128 GLN HE22 H 1 6.66 0.02 A 128 GLN HGy H 1 2.43 0.02 A 128 GLN HGx H 1 2.28 0.02 A 128 GLN C C 13 178.62 0.05 A 128 GLN CA C 13 58.83 0.05 A 128 GLN CB C 13 28.13 0.05 A 128 GLN CD C 13 180.30 0.05 A 128 GLN CG C 13 33.97 0.05 A 128 GLN N N 15 119.44 0.05 A 128 GLN NE2 N 15 110.80 0.05 A 129 MET H H 1 7.92 0.02 A 129 MET HA H 1 4.01 0.02 A 129 MET HB2 H 1 2.27 0.02 A 129 MET HB3 H 1 2.27 0.02 A 129 MET HE% H 1 2.03 0.02 A 129 MET HGy H 1 2.76 0.02 A 129 MET HGx H 1 2.32 0.02 A 129 MET C C 13 179.41 0.05 A 129 MET CA C 13 59.44 0.05 A 129 MET CB C 13 32.62 0.05 A 129 MET CE C 13 17.61 0.05 A 129 MET CG C 13 31.98 0.05 A 129 MET N N 15 120.41 0.05 A 130 VAL H H 1 8.66 0.02 A 130 VAL HA H 1 3.38 0.02 A 130 VAL HB H 1 2.37 0.02 A 130 VAL HG1% H 1 0.75 0.02 A 130 VAL HG2% H 1 0.95 0.02 A 130 VAL C C 13 178.67 0.05 A 130 VAL CA C 13 67.54 0.05 A 130 VAL CB C 13 30.81 0.05 A 130 VAL CG1 C 13 21.55 0.05 A 130 VAL CG2 C 13 24.12 0.05 A 130 VAL N N 15 123.31 0.05 A 131 GLY H H 1 8.33 0.02 A 131 GLY HA2 H 1 3.49 0.02 A 131 GLY HA3 H 1 3.96 0.02 A 131 GLY C C 13 175.44 0.05 A 131 GLY CA C 13 48.39 0.05 A 131 GLY N N 15 106.93 0.05 A 132 GLN H H 1 8.19 0.02 A 132 GLN HA H 1 3.98 0.02 A 132 GLN HB2 H 1 2.10 0.02 A 132 GLN HB3 H 1 2.00 0.02 A 132 GLN HE21 H 1 7.16 0.02 A 132 GLN HE22 H 1 6.83 0.02 A 132 GLN HG2 H 1 2.35 0.02 A 132 GLN HG3 H 1 2.42 0.02 A 132 GLN C C 13 179.07 0.05 A 132 GLN CA C 13 58.69 0.05 A 132 GLN CB C 13 28.30 0.05 A 132 GLN CD C 13 180.10 0.05 A 132 GLN CG C 13 34.30 0.05 A 132 GLN N N 15 119.59 0.05 A 132 GLN NE2 N 15 111.20 0.05 A 133 SER H H 1 8.66 0.02 A 133 SER HA H 1 4.16 0.02 A 133 SER HB2 H 1 3.63 0.02 A 133 SER HB3 H 1 4.01 0.02 A 133 SER C C 13 176.60 0.05 A 133 SER CA C 13 62.87 0.05 A 133 SER CB C 13 63.00 0.05 A 133 SER N N 15 116.80 0.05 A 134 VAL H H 1 8.08 0.02 A 134 VAL HA H 1 3.61 0.02 A 134 VAL HB H 1 2.03 0.02 A 134 VAL HG1% H 1 0.92 0.02 A 134 VAL HG2% H 1 0.99 0.02 A 134 VAL C C 13 176.10 0.05 A 134 VAL CA C 13 66.19 0.05 A 134 VAL CB C 13 31.41 0.05 A 134 VAL CG1 C 13 21.42 0.05 A 134 VAL CG2 C 13 23.44 0.05 A 134 VAL N N 15 121.63 0.05 A 135 ALA H H 1 7.72 0.02 A 135 ALA HA H 1 3.88 0.02 A 135 ALA HB% H 1 1.36 0.02 A 135 ALA C C 13 180.25 0.05 A 135 ALA CA C 13 55.15 0.05 A 135 ALA CB C 13 18.05 0.05 A 135 ALA N N 15 122.03 0.05 A 136 GLN H H 1 8.14 0.02 A 136 GLN HA H 1 4.00 0.02 A 136 GLN HBy H 1 2.06 0.02 A 136 GLN HBx H 1 2.02 0.02 A 136 GLN HE21 H 1 7.42 0.02 A 136 GLN HE22 H 1 6.77 0.02 A 136 GLN HGy H 1 2.43 0.02 A 136 GLN HGx H 1 2.35 0.02 A 136 GLN C C 13 178.17 0.05 A 136 GLN CA C 13 58.21 0.05 A 136 GLN CB C 13 28.62 0.05 A 136 GLN CD C 13 180.20 0.05 A 136 GLN CG C 13 34.10 0.05 A 136 GLN N N 15 115.56 0.05 A 136 GLN NE2 N 15 111.60 0.05 A 137 ALA H H 1 7.77 0.02 A 137 ALA HA H 1 4.08 0.02 A 137 ALA HB% H 1 1.48 0.02 A 137 ALA C C 13 178.62 0.05 A 137 ALA CA C 13 54.47 0.05 A 137 ALA CB C 13 19.87 0.05 A 137 ALA N N 15 119.97 0.05 A 138 LEU H H 1 7.39 0.02 A 138 LEU HA H 1 4.48 0.02 A 138 LEU HB2 H 1 1.60 0.02 A 138 LEU HB3 H 1 1.51 0.02 A 138 LEU HD1% H 1 0.76 0.02 A 138 LEU HD2% H 1 0.74 0.02 A 138 LEU HG H 1 1.65 0.02 A 138 LEU C C 13 176.43 0.05 A 138 LEU CA C 13 53.78 0.05 A 138 LEU CB C 13 42.29 0.05 A 138 LEU CD1 C 13 22.88 0.05 A 138 LEU CD2 C 13 26.11 0.05 A 138 LEU CG C 13 27.13 0.05 A 138 LEU N N 15 114.25 0.05 A 139 ALA H H 1 7.57 0.02 A 139 ALA HA H 1 4.30 0.02 A 139 ALA HB% H 1 1.39 0.02 A 139 ALA C C 13 177.11 0.05 A 139 ALA CA C 13 52.90 0.05 A 139 ALA CB C 13 19.53 0.05 A 139 ALA N N 15 122.49 0.05 A 140 GLY H H 1 7.78 0.02 A 140 GLY HA2 H 1 3.70 0.02 A 140 GLY HA3 H 1 3.70 0.02 A 140 GLY CA C 13 46.24 0.05 A 140 GLY N N 15 113.49 0.05 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 _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 113 SER H A 113 SER HB3 1.0 0.0 3.2 2 2 A 80 SER H A 80 SER HA 1.0 2.7 7.7 3 3 A 57 VAL H A 57 VAL HG1% 1.0 0.0 4.8 4 4 A 26 GLY H A 26 GLY HA2 1.0 0.0 3.4 5 4 A 26 GLY H A 26 GLY HA3 1.0 0.0 3.4 6 5 A 51 SER H A 51 SER HA 1.0 2.7 7.7 7 6 A 137 ALA H A 137 ALA HA 1.0 2.7 7.7 8 7 A 113 SER H A 113 SER HA 1.0 2.7 7.7 9 8 A 133 SER H A 133 SER HB2 1.0 0.0 3.5 10 9 A 89 LEU HA A 89 LEU HD21 1.0 0.0 4.0 11 10 A 103 VAL H A 103 VAL HB 1.0 0.0 2.7 12 11 A 76 SER H A 76 SER HB2 1.0 0.0 3.4 13 11 A 76 SER H A 76 SER HB3 1.0 0.0 3.4 14 12 A 52 ARG HH1% A 52 ARG HD3 1.0 0.0 3.4 15 13 A 61 VAL H A 61 VAL HGx% 1.0 0.0 4.8 16 14 A 53 VAL H A 53 VAL HG2% 1.0 0.0 3.5 17 15 A 138 LEU H A 138 LEU HB3 1.0 0.0 4.0 18 16 A 89 LEU H A 89 LEU HB3 1.0 0.0 4.0 19 17 A 73 ASN H A 73 ASN HB3 1.0 0.0 3.5 20 18 A 61 VAL H A 61 VAL HB 1.0 0.0 2.7 21 19 A 103 VAL H A 103 VAL HG2% 1.0 0.0 3.5 22 20 A 52 ARG HH1% A 52 ARG HG2 1.0 0.0 5.7 23 21 A 39 ALA H A 39 ALA HB% 1.0 0.0 3.5 24 22 A 60 LEU H A 60 LEU HB3 1.0 0.0 4.0 25 23 A 64 GLY H A 64 GLY HA3 1.0 0.0 3.2 26 24 A 90 SER H A 90 SER HB3 1.0 0.0 4.0 27 25 A 86 ASN H A 86 ASN HA 1.0 0.0 3.2 28 26 A 98 ALA H A 98 ALA HA 1.0 2.7 7.7 29 27 A 78 VAL HA A 78 VAL HG2% 1.0 0.0 4.0 30 28 A 71 LEU H A 71 LEU HB2 1.0 0.0 2.7 31 29 A 100 LEU H A 100 LEU HA 1.0 2.7 7.7 32 30 A 57 VAL H A 57 VAL HB 1.0 0.0 2.7 33 31 A 106 LEU H A 106 LEU HB3 1.0 0.0 4.0 34 32 A 75 ILE H A 75 ILE HA 1.0 2.7 7.7 35 33 A 94 VAL H A 94 VAL HA 1.0 2.7 7.7 36 34 A 115 ILE H A 115 ILE HD1% 1.0 0.0 0.0 37 35 A 110 LEU H A 110 LEU HA 1.0 2.7 7.7 38 36 A 99 LEU H A 99 LEU HA 1.0 2.7 7.7 39 37 A 88 GLY H A 88 GLY HAx 1.0 0.0 3.4 40 37 A 88 GLY H A 88 GLY HAy 1.0 0.0 3.4 41 38 A 106 LEU H A 106 LEU HG 1.0 0.0 2.7 42 39 A 66 THR H A 66 THR HG2% 1.0 0.0 4.0 43 40 A 46 SER H A 46 SER HB2 1.0 2.7 6.7 44 41 A 123 SER H A 123 SER HB2 1.0 0.0 4.0 45 42 A 130 VAL H A 130 VAL HB 1.0 0.0 2.7 46 43 A 37 ALA H A 37 ALA HB% 1.0 0.0 3.5 47 44 A 22 VAL H A 22 VAL HA 1.0 0.0 3.2 48 45 A 123 SER H A 123 SER HA 1.0 2.7 7.7 49 46 A 139 ALA H A 139 ALA HA 1.0 0.0 3.2 50 47 A 110 LEU H A 110 LEU HG 1.0 0.0 3.2 51 48 A 73 ASN H A 73 ASN HA 1.0 2.7 7.7 52 49 A 34 ALA H A 34 ALA HB% 1.0 0.0 3.5 53 50 A 68 GLN H A 68 GLN HA 1.0 0.0 3.2 54 51 A 72 SER H A 72 SER HB2 1.0 0.0 3.5 55 51 A 72 SER H A 72 SER HB3 1.0 0.0 3.5 56 52 A 21 ALA H A 21 ALA HB% 1.0 0.0 4.0 57 53 A 103 VAL H A 103 VAL HA 1.0 2.7 7.7 58 54 A 27 TYR H A 27 TYR HB2 1.0 0.0 3.2 59 55 A 106 LEU H A 106 LEU HB2 1.0 0.0 2.7 60 56 A 77 SER H A 77 SER HA 1.0 2.7 7.7 61 57 A 52 ARG HH1% A 52 ARG HG3 1.0 0.0 5.7 62 58 A 78 VAL H A 78 VAL HB 1.0 0.0 2.7 63 59 A 82 VAL H A 82 VAL HG1% 1.0 0.0 4.8 64 60 A 61 VAL H A 61 VAL HA 1.0 0.0 3.2 65 61 A 44 LEU H A 44 LEU HA 1.0 0.0 3.2 66 62 A 81 GLN HE21 A 81 GLN HG3 1.0 0.0 4.0 67 63 A 128 GLN H A 128 GLN HGy 1.0 0.0 3.9 68 63 A 128 GLN H A 128 GLN HGx 1.0 0.0 3.9 69 64 A 107 VAL H A 107 VAL HG2% 1.0 0.0 3.5 70 65 A 67 ASN H A 67 ASN HB3 1.0 0.0 2.7 71 66 A 125 GLN H A 125 GLN HA 1.0 2.7 7.7 72 67 A 43 ARG H A 43 ARG HB2 1.0 0.0 4.0 73 68 A 33 SER H A 33 SER HB2 1.0 0.0 3.2 74 69 A 102 VAL H A 102 VAL HG2% 1.0 0.0 3.5 75 70 A 40 ALA H A 40 ALA HA 1.0 2.7 7.7 76 71 A 90 SER H A 90 SER HB2 1.0 0.0 3.2 77 72 A 66 THR H A 66 THR HA 1.0 2.7 7.7 78 73 A 43 ARG H A 43 ARG HB3 1.0 0.0 2.7 79 74 A 73 ASN H A 73 ASN HD21 1.0 0.0 4.0 80 75 A 44 LEU H A 44 LEU HB3 1.0 0.0 3.4 81 75 A 44 LEU H A 44 LEU HB2 1.0 0.0 3.4 82 76 A 71 LEU H A 71 LEU HG 1.0 0.0 3.2 83 77 A 43 ARG HE A 43 ARG HD2 1.0 0.0 4.0 84 78 A 67 ASN H A 67 ASN HB2 1.0 0.0 2.7 85 79 A 74 THR H A 74 THR HG1 1.0 0.0 2.7 86 80 A 104 SER H A 104 SER HB2 1.0 0.0 4.0 87 81 A 63 SER HA A 63 SER HB2 1.0 0.0 3.2 88 82 A 138 LEU H A 138 LEU HA 1.0 2.7 7.7 89 83 A 109 ILE H A 109 ILE HB 1.0 0.0 2.7 90 84 A 110 LEU H A 110 LEU HB2 1.0 0.0 2.7 91 85 A 81 GLN H A 81 GLN HA 1.0 2.7 7.7 92 86 A 118 ILE HA A 118 ILE HD1% 1.0 0.0 4.0 93 87 A 84 ALA H A 84 ALA HA 1.0 2.7 7.7 94 88 A 63 SER HB2 A 63 SER H 1.0 0.0 2.7 95 89 A 80 SER H A 80 SER HB2 1.0 0.0 3.4 96 89 A 80 SER H A 80 SER HB3 1.0 0.0 3.4 97 90 A 86 ASN H A 86 ASN HD22 1.0 0.0 4.0 98 91 A 111 GLY H A 111 GLY HA2 1.0 2.7 7.7 99 92 A 68 GLN H A 68 GLN HB3 1.0 0.0 3.2 100 93 A 70 ALA H A 70 ALA HB% 1.0 0.0 3.5 101 94 A 132 GLN H A 132 GLN HB2 1.0 0.0 2.7 102 95 A 94 VAL H A 94 VAL HG1% 1.0 0.0 4.8 103 96 A 41 ALA H A 41 ALA HB% 1.0 0.0 3.5 104 97 A 42 SER H A 42 SER HB2 1.0 0.0 3.4 105 97 A 42 SER H A 42 SER HB3 1.0 0.0 3.4 106 98 A 115 ILE H A 115 ILE HB 1.0 0.0 2.7 107 99 A 109 ILE H A 109 ILE HG12 1.0 0.0 4.0 108 100 A 101 GLU H A 101 GLU HB3 1.0 0.0 3.5 109 101 A 95 LEU H A 95 LEU HB3 1.0 0.0 2.7 110 102 A 39 ALA H A 39 ALA HA 1.0 2.7 7.7 111 103 A 45 SER H A 45 SER HA 1.0 0.0 3.2 112 104 A 127 THR H A 127 THR HB 1.0 0.0 3.2 113 105 A 125 GLN H A 125 GLN HB2 1.0 0.0 3.2 114 106 A 31 SER H A 31 SER HB3 1.0 0.0 4.0 115 107 A 54 SER H A 54 SER HB2 1.0 0.0 3.4 116 107 A 54 SER H A 54 SER HB3 1.0 0.0 3.4 117 108 A 63 SER HA A 63 SER HB3 1.0 0.0 2.7 118 109 A 105 ALA H A 105 ALA HA 1.0 2.7 7.7 119 110 A 134 VAL H A 134 VAL HB 1.0 0.0 2.7 120 111 A 116 GLY H A 116 GLY HA2 1.0 2.7 4.0 121 112 A 102 VAL H A 102 VAL HG1% 1.0 0.0 4.8 122 113 A 37 ALA H A 37 ALA HA 1.0 0.0 3.2 123 114 A 36 VAL H A 36 VAL HB 1.0 0.0 2.7 124 115 A 129 MET H A 129 MET HA 1.0 2.7 7.7 125 116 A 101 GLU H A 101 GLU HB2 1.0 0.0 2.7 126 117 A 79 VAL H A 79 VAL HB 1.0 0.0 2.7 127 118 A 43 ARG HH2% A 43 ARG HD3 1.0 0.0 6.5 128 118 A 43 ARG HD3 A 43 ARG HH1% 1.0 0.0 6.5 129 119 A 106 LEU H A 106 LEU HA 1.0 2.7 7.7 130 120 A 57 VAL H A 57 VAL HG2% 1.0 0.0 4.0 131 121 A 118 ILE H A 118 ILE HB 1.0 0.0 2.7 132 122 A 30 GLN H A 30 GLN HB2 1.0 0.0 4.0 133 123 A 42 SER H A 42 SER HA 1.0 0.0 3.2 134 124 A 131 GLY H A 131 GLY HA3 1.0 0.0 2.7 135 125 A 120 TYR H A 120 TYR HB3 1.0 0.0 3.2 136 126 A 83 SER H A 83 SER HA 1.0 2.7 7.7 137 127 A 59 SER H A 59 SER HA 1.0 0.0 3.2 138 128 A 24 VAL H A 24 VAL HB 1.0 0.0 3.2 139 129 A 27 TYR H A 27 TYR HE% 1.0 3.2 8.9 140 130 A 60 LEU H A 60 LEU HA 1.0 0.0 3.2 141 131 A 67 ASN H A 67 ASN HA 1.0 0.0 3.2 142 132 A 53 VAL H A 53 VAL HG1% 1.0 2.7 6.7 143 133 A 60 LEU H A 60 LEU HB2 1.0 0.0 2.7 144 134 A 89 LEU HA A 89 LEU H 1.0 0.0 4.0 145 135 A 20 ALA H A 20 ALA HB% 1.0 2.7 6.7 146 136 A 50 SER H A 50 SER HB2 1.0 0.0 3.4 147 136 A 50 SER H A 50 SER HB3 1.0 0.0 3.4 148 137 A 111 GLY H A 111 GLY HA3 1.0 0.0 2.7 149 138 A 20 ALA H A 20 ALA HA 1.0 0.0 3.2 150 139 A 134 VAL H A 134 VAL HG1% 1.0 0.0 4.8 151 140 A 104 SER H A 104 SER HB3 1.0 0.0 3.2 152 141 A 134 VAL H A 134 VAL HA 1.0 2.7 7.7 153 142 A 133 SER H A 133 SER HB3 1.0 0.0 2.7 154 143 A 121 GLY H A 121 GLY HA2 1.0 0.0 4.0 155 144 A 48 ALA H A 48 ALA HA 1.0 0.0 3.2 156 145 A 115 ILE H A 115 ILE HA 1.0 0.0 4.0 157 146 A 72 SER H A 72 SER HG 1.0 3.2 8.2 158 147 A 116 GLY H A 116 GLY HA3 1.0 0.0 2.7 159 148 A 107 VAL H A 107 VAL HA 1.0 2.7 7.7 160 149 A 97 GLN H A 97 GLN HB2 1.0 0.0 3.4 161 149 A 97 GLN H A 97 GLN HB3 1.0 0.0 3.4 162 150 A 118 ILE HA A 118 ILE HG2% 1.0 0.0 3.5 163 151 A 108 SER H A 108 SER HB3 1.0 0.0 4.0 164 152 A 108 SER H A 108 SER HA 1.0 2.7 7.7 165 153 A 78 VAL HA A 78 VAL HG1% 1.0 0.0 4.0 166 154 A 34 ALA H A 34 ALA HA 1.0 0.0 3.2 167 155 A 125 GLN H A 125 GLN HB3 1.0 0.0 3.2 168 156 A 54 SER H A 54 SER HA 1.0 0.0 3.2 169 157 A 38 SER H A 38 SER HA 1.0 0.0 3.2 170 158 A 45 SER H A 45 SER HBy 1.0 0.0 3.4 171 158 A 45 SER H A 45 SER HBx 1.0 0.0 3.4 172 159 A 64 GLY H A 64 GLY HA2 1.0 0.0 2.7 173 160 A 33 SER H A 33 SER HB3 1.0 0.0 3.2 174 161 A 43 ARG H A 43 ARG HG3 1.0 0.0 4.7 175 161 A 43 ARG H A 43 ARG HG2 1.0 0.0 4.7 176 162 A 30 GLN H A 30 GLN HA 1.0 0.0 3.2 177 163 A 36 VAL H A 36 VAL HA 1.0 0.0 4.0 178 164 A 58 SER H A 58 SER HB2 1.0 0.0 3.4 179 164 A 58 SER H A 58 SER HB3 1.0 0.0 3.4 180 165 A 122 ALA H A 122 ALA HA 1.0 2.7 7.7 181 166 A 135 ALA H A 135 ALA HB% 1.0 0.0 3.5 182 167 A 85 SER H A 85 SER HG 1.0 3.2 8.2 183 168 A 132 GLN H A 132 GLN HB3 1.0 0.0 4.0 184 169 A 120 TYR H A 120 TYR HB2 1.0 0.0 3.2 185 170 A 130 VAL H A 130 VAL HG2% 1.0 0.0 3.5 186 171 A 104 SER H A 104 SER HA 1.0 2.7 7.7 187 172 A 63 SER H A 63 SER HB3 1.0 0.0 4.0 188 173 A 68 GLN H A 68 GLN HB2 1.0 0.0 2.7 189 174 A 89 LEU HA A 89 LEU HD11 1.0 2.7 7.7 190 175 A 97 GLN HA A 97 GLN HE21 1.0 3.2 8.2 191 176 A 81 GLN HE22 A 81 GLN HG2 1.0 0.0 5.0 192 177 A 94 VAL H A 94 VAL HB 1.0 0.0 2.7 193 178 A 53 VAL H A 53 VAL HB 1.0 0.0 2.7 194 179 A 132 GLN H A 132 GLN HG2 1.0 0.0 3.9 195 179 A 132 GLN H A 132 GLN HG3 1.0 0.0 3.9 196 180 A 77 SER H A 77 SER HB2 1.0 0.0 3.4 197 180 A 77 SER H A 77 SER HB3 1.0 0.0 3.4 198 181 A 117 GLN H A 117 GLN HBy 1.0 0.0 3.4 199 181 A 117 GLN H A 117 GLN HBx 1.0 0.0 3.4 200 182 A 95 LEU H A 95 LEU HA 1.0 2.7 7.7 201 183 A 114 SER H A 114 SER HB2 1.0 0.0 3.2 202 184 A 120 TYR H A 120 TYR HA 1.0 0.0 3.2 203 185 A 21 ALA H A 21 ALA HA 1.0 0.0 3.2 204 186 A 62 SER H A 62 SER HA 1.0 0.0 3.2 205 187 A 71 LEU H A 71 LEU HA 1.0 2.7 7.7 206 188 A 96 VAL H A 96 VAL HA 1.0 2.7 7.7 207 189 A 55 SER H A 55 SER HB2 1.0 0.0 3.4 208 189 A 55 SER H A 55 SER HB3 1.0 0.0 3.4 209 190 A 38 SER H A 38 SER HBy 1.0 0.0 3.4 210 190 A 38 SER H A 38 SER HBx 1.0 0.0 3.4 211 191 A 97 GLN H A 97 GLN HA 1.0 2.7 7.7 212 192 A 51 SER H A 51 SER HB2 1.0 0.0 3.4 213 192 A 51 SER H A 51 SER HB3 1.0 0.0 3.4 214 193 A 82 VAL H A 82 VAL HA 1.0 2.7 7.7 215 194 A 115 ILE H A 115 ILE HG12 1.0 0.0 4.0 216 195 A 27 TYR H A 27 TYR HD% 1.0 0.0 3.9 217 196 A 52 ARG H A 52 ARG HB3 1.0 0.0 3.5 218 197 A 33 SER H A 33 SER HA 1.0 0.0 3.2 219 198 A 49 ALA H A 49 ALA HB% 1.0 0.0 3.4 220 199 A 57 VAL H A 57 VAL HA 1.0 0.0 3.2 221 200 A 129 MET H A 129 MET HB2 1.0 0.0 3.4 222 200 A 129 MET H A 129 MET HB3 1.0 0.0 3.4 223 201 A 81 GLN H A 81 GLN HB2 1.0 0.0 4.0 224 202 A 101 GLU H A 101 GLU HA 1.0 2.7 7.7 225 203 A 102 VAL H A 102 VAL HA 1.0 2.7 7.7 226 204 A 83 SER H A 83 SER HB2 1.0 0.0 3.4 227 204 A 83 SER H A 83 SER HB3 1.0 0.0 3.4 228 205 A 74 THR H A 74 THR HG2% 1.0 0.0 4.8 229 206 A 91 GLY H A 91 GLY HAy 1.0 0.0 3.4 230 206 A 91 GLY H A 91 GLY HAx 1.0 0.0 3.4 231 207 A 133 SER H A 133 SER HG 1.0 0.0 3.2 232 208 A 43 ARG HA A 43 ARG HG3 1.0 2.7 5.0 233 209 A 43 ARG H A 43 ARG HA 1.0 0.0 3.2 234 210 A 40 ALA H A 40 ALA HB% 1.0 0.0 3.5 235 211 A 92 CYS H A 92 CYS HB3 1.0 0.0 3.2 236 212 A 72 SER H A 72 SER HA 1.0 2.7 7.7 237 213 A 50 SER H A 50 SER HA 1.0 0.0 3.2 238 214 A 114 SER H A 114 SER HB3 1.0 0.0 4.0 239 215 A 23 SER H A 23 SER HB2 1.0 2.7 6.7 240 215 A 23 SER H A 23 SER HB3 1.0 2.7 6.7 241 216 A 132 GLN H A 132 GLN HA 1.0 2.7 7.7 242 217 A 112 SER H A 112 SER HB2 1.0 0.0 4.0 243 218 A 52 ARG H A 52 ARG HD3 1.0 2.7 7.7 244 218 A 52 ARG H A 52 ARG HD2 1.0 2.7 7.7 245 219 A 131 GLY H A 131 GLY HA2 1.0 2.7 7.7 246 220 A 43 ARG HB2 A 43 ARG HG3 1.0 0.0 3.2 247 221 A 115 ILE H A 115 ILE HG13 1.0 0.0 2.7 248 222 A 122 ALA H A 122 ALA HB% 1.0 0.0 3.4 249 223 A 73 ASN H A 73 ASN HD22 1.0 3.2 8.2 250 224 A 109 ILE H A 109 ILE HG13 1.0 0.0 2.7 251 225 A 119 ASN H A 119 ASN HD21 1.0 2.7 5.0 252 226 A 119 ASN H A 119 ASN HA 1.0 2.7 7.7 253 227 A 24 VAL H A 24 VAL HA 1.0 0.0 3.2 254 228 A 52 ARG HH1% A 52 ARG H 1.0 0.0 5.7 255 229 A 96 VAL H A 96 VAL HB 1.0 0.0 2.7 256 230 A 108 SER H A 108 SER HG 1.0 0.0 2.7 257 231 A 70 ALA H A 70 ALA HA 1.0 2.7 7.7 258 232 A 138 LEU H A 138 LEU HB2 1.0 0.0 2.7 259 233 A 86 ASN H A 86 ASN HB3 1.0 0.0 4.0 260 234 A 55 SER H A 55 SER HA 1.0 0.0 3.2 261 235 A 135 ALA H A 135 ALA HA 1.0 2.7 7.7 262 236 A 113 SER H A 113 SER HB2 1.0 0.0 4.0 263 237 A 79 VAL H A 79 VAL HA 1.0 2.7 7.7 264 238 A 52 ARG H A 52 ARG HB2 1.0 0.0 2.7 265 239 A 121 GLY H A 121 GLY HA3 1.0 0.0 2.7 266 240 A 74 THR H A 74 THR HA 1.0 2.7 7.7 267 241 A 61 VAL H A 61 VAL HGy% 1.0 0.0 4.0 268 242 A 52 ARG HH1% A 52 ARG HD2 1.0 0.0 4.0 269 243 A 94 VAL H A 94 VAL HG2% 1.0 0.0 4.0 270 244 A 93 ASP H A 93 ASP HB3 1.0 0.0 3.5 271 245 A 32 SER H A 32 SER HA 1.0 0.0 3.2 272 246 A 92 CYS H A 92 CYS HB2 1.0 0.0 3.2 273 247 A 126 TYR H A 126 TYR HBy 1.0 0.0 3.4 274 247 A 126 TYR H A 126 TYR HBx 1.0 0.0 3.4 275 248 A 100 LEU H A 100 LEU HB2 1.0 0.0 4.0 276 249 A 126 TYR H A 126 TYR HE% 1.0 0.0 5.0 277 250 A 102 VAL H A 102 VAL HB 1.0 0.0 2.7 278 251 A 78 VAL HA A 78 VAL H 1.0 2.7 7.7 279 252 A 105 ALA H A 105 ALA HB% 1.0 0.0 3.5 280 253 A 124 ALA H A 124 ALA HB% 1.0 0.0 3.5 281 254 A 63 SER HA A 63 SER H 1.0 0.0 3.2 282 255 A 127 THR H A 127 THR HA 1.0 2.7 7.7 283 256 A 107 VAL H A 107 VAL HB 1.0 0.0 2.7 284 257 A 46 SER H A 46 SER HB3 1.0 0.0 2.7 285 258 A 99 LEU H A 99 LEU HB3 1.0 0.0 3.5 286 259 A 114 SER H A 114 SER HA 1.0 2.7 7.7 287 260 A 56 ALA H A 56 ALA HA 1.0 0.0 3.2 288 261 A 43 ARG HD2 A 43 ARG HB3 1.0 0.0 5.7 289 261 A 43 ARG HB3 A 43 ARG HD3 1.0 0.0 5.7 290 262 A 69 ALA H A 69 ALA HB% 1.0 0.0 3.5 291 263 A 113 SER H A 113 SER HG 1.0 0.0 3.2 292 264 A 136 GLN H A 136 GLN HBy 1.0 0.0 3.4 293 264 A 136 GLN H A 136 GLN HBx 1.0 0.0 3.4 294 265 A 74 THR H A 74 THR HB 1.0 0.0 2.7 295 266 A 117 GLN H A 117 GLN HA 1.0 0.0 3.2 296 267 A 139 ALA H A 139 ALA HB% 1.0 0.0 4.0 297 268 A 136 GLN H A 136 GLN HA 1.0 2.7 7.7 298 269 A 52 ARG H A 52 ARG HA 1.0 0.0 3.2 299 270 A 28 GLY H A 28 GLY HA2 1.0 0.0 3.4 300 270 A 28 GLY H A 28 GLY HA3 1.0 0.0 3.4 301 271 A 115 ILE H A 115 ILE HG2% 1.0 0.0 4.8 302 272 A 59 SER H A 59 SER HB2 1.0 0.0 3.4 303 272 A 59 SER H A 59 SER HB3 1.0 0.0 3.4 304 273 A 99 LEU H A 99 LEU HB2 1.0 0.0 2.7 305 274 A 85 SER H A 85 SER HA 1.0 2.7 7.7 306 275 A 23 SER H A 23 SER HA 1.0 2.7 7.7 307 276 A 43 ARG HD2 A 43 ARG HB2 1.0 0.0 4.7 308 276 A 43 ARG HB2 A 43 ARG HD3 1.0 0.0 4.7 309 277 A 140 GLY H A 140 GLY HA2 1.0 0.0 3.4 310 277 A 140 GLY H A 140 GLY HA3 1.0 0.0 3.4 311 278 A 98 ALA H A 98 ALA HB% 1.0 0.0 3.5 312 279 A 43 ARG HE A 43 ARG HG3 1.0 0.0 4.0 313 280 A 43 ARG H A 43 ARG HD3 1.0 0.0 4.7 314 280 A 43 ARG H A 43 ARG HD2 1.0 0.0 4.7 315 281 A 31 SER H A 31 SER HB2 1.0 0.0 3.2 316 282 A 29 PRO HA A 29 PRO HDy 1.0 0.0 4.0 317 282 A 29 PRO HA A 29 PRO HDx 1.0 0.0 4.0 318 283 A 27 TYR H A 27 TYR HA 1.0 0.0 3.2 319 284 A 93 ASP H A 93 ASP HB2 1.0 0.0 2.7 320 285 A 58 SER H A 58 SER HA 1.0 0.0 3.2 321 286 A 76 SER H A 76 SER HA 1.0 2.7 7.7 322 287 A 43 ARG HH2% A 43 ARG HD2 1.0 0.0 5.5 323 287 A 43 ARG HD2 A 43 ARG HH1% 1.0 0.0 5.5 324 288 A 43 ARG HA A 43 ARG HD3 1.0 3.2 8.2 325 288 A 43 ARG HA A 43 ARG HD2 1.0 3.2 8.2 326 289 A 108 SER H A 108 SER HB2 1.0 0.0 2.7 327 290 A 66 THR H A 66 THR HB 1.0 3.2 8.2 328 291 A 84 ALA H A 84 ALA HB% 1.0 0.0 3.5 329 292 A 73 ASN H A 73 ASN HB2 1.0 0.0 2.7 330 293 A 71 LEU H A 71 LEU HB3 1.0 0.0 4.0 331 294 A 43 ARG HE A 43 ARG HG2 1.0 0.0 5.0 332 295 A 85 SER H A 85 SER HB3 1.0 0.0 3.4 333 295 A 85 SER H A 85 SER HB2 1.0 0.0 3.4 334 296 A 52 ARG HG3 A 52 ARG H 1.0 0.0 3.2 335 297 A 95 LEU HB3 A 95 LEU HD2% 1.0 0.0 3.5 336 298 A 86 ASN H A 86 ASN HB2 1.0 0.0 2.7 337 299 A 126 TYR H A 126 TYR HA 1.0 2.7 7.7 338 300 A 30 GLN H A 30 GLN HB3 1.0 0.0 4.0 339 301 A 128 GLN H A 128 GLN HA 1.0 2.7 7.7 340 302 A 119 ASN H A 119 ASN HB2 1.0 0.0 3.2 341 303 A 62 SER H A 62 SER HB2 1.0 0.0 3.4 342 303 A 62 SER H A 62 SER HB3 1.0 0.0 3.4 343 304 A 90 SER H A 90 SER HA 1.0 2.7 7.7 344 305 A 124 ALA H A 124 ALA HA 1.0 2.7 7.7 345 306 A 100 LEU H A 100 LEU HB3 1.0 0.0 3.2 346 307 A 75 ILE H A 75 ILE HB 1.0 0.0 2.7 347 308 A 43 ARG HE A 43 ARG HD3 1.0 0.0 3.2 348 309 A 118 ILE HA A 118 ILE H 1.0 2.7 7.7 349 310 A 49 ALA H A 49 ALA HA 1.0 0.0 3.2 350 311 A 56 ALA H A 56 ALA HB% 1.0 0.0 3.5 351 312 A 109 ILE H A 109 ILE HA 1.0 2.7 7.7 352 313 A 119 ASN H A 119 ASN HB3 1.0 0.0 3.2 353 314 A 110 LEU H A 110 LEU HB3 1.0 0.0 3.5 354 315 A 134 VAL H A 134 VAL HG2% 1.0 0.0 3.5 355 316 A 48 ALA H A 48 ALA HB% 1.0 0.0 3.4 356 317 A 81 GLN HE21 A 81 GLN HG2 1.0 0.0 4.0 357 318 A 89 LEU H A 89 LEU HB2 1.0 0.0 3.2 358 319 A 127 THR H A 127 THR HG2% 1.0 0.0 4.8 359 320 A 82 VAL H A 82 VAL HG2% 1.0 0.0 3.5 360 321 A 128 GLN H A 128 GLN HBy 1.0 0.0 3.4 361 321 A 128 GLN H A 128 GLN HBx 1.0 0.0 3.4 362 322 A 112 SER H A 112 SER HA 1.0 2.7 7.7 363 323 A 123 SER H A 123 SER HG 1.0 2.7 7.7 364 324 A 82 VAL H A 82 VAL HB 1.0 0.0 2.7 365 325 A 93 ASP H A 93 ASP HA 1.0 2.7 7.7 366 326 A 103 VAL H A 103 VAL HG1% 1.0 0.0 4.8 367 327 A 43 ARG HG2 A 43 ARG HA 1.0 0.0 4.0 368 328 A 112 SER H A 112 SER HB3 1.0 0.0 2.7 369 329 A 107 VAL H A 107 VAL HG1% 1.0 0.0 4.8 370 330 A 52 ARG HG2 A 52 ARG H 1.0 0.0 4.0 371 331 A 137 ALA H A 137 ALA HB% 1.0 0.0 3.5 372 332 A 95 LEU H A 95 LEU HB2 1.0 0.0 2.7 373 333 A 97 GLN HA A 97 GLN HE22 1.0 3.2 8.2 374 334 A 46 SER H A 46 SER HA 1.0 0.0 3.2 375 335 A 81 GLN H A 81 GLN HB3 1.0 0.0 3.2 376 336 A 130 VAL H A 130 VAL HG1% 1.0 0.0 4.8 377 337 A 130 VAL H A 130 VAL HA 1.0 2.7 7.7 378 338 A 123 SER H A 123 SER HB3 1.0 0.0 2.7 379 339 A 53 VAL H A 53 VAL HA 1.0 0.0 3.2 380 340 A 31 SER H A 31 SER HA 1.0 0.0 3.2 381 341 A 41 ALA H A 41 ALA HA 1.0 0.0 3.2 382 342 A 81 GLN HE22 A 81 GLN HG3 1.0 0.0 5.0 383 343 A 133 SER H A 133 SER HA 1.0 2.7 7.7 384 344 A 25 GLY H A 25 GLY HA2 1.0 0.0 3.4 385 344 A 25 GLY H A 25 GLY HA3 1.0 0.0 3.4 386 345 A 69 ALA H A 69 ALA HA 1.0 0.0 3.2 387 346 A 27 TYR H A 27 TYR HB3 1.0 2.7 6.7 388 347 A 126 TYR H A 126 TYR HD% 1.0 0.0 3.4 389 348 A 92 CYS H A 92 CYS HA 1.0 2.7 7.7 390 349 A 76 SER H A 77 SER H 1.0 0.0 2.7 391 350 A 41 ALA HB% A 42 SER H 1.0 2.7 6.7 392 351 A 116 GLY HA2 A 117 GLN H 1.0 0.0 4.0 393 352 A 106 LEU H A 107 VAL H 1.0 0.0 2.7 394 353 A 53 VAL H A 52 ARG HB2 1.0 0.0 3.2 395 354 A 51 SER H A 52 ARG H 1.0 0.0 2.7 396 355 A 89 LEU HA A 90 SER H 1.0 0.0 3.2 397 356 A 36 VAL H A 35 PRO HDy 1.0 3.2 7.9 398 356 A 36 VAL H A 35 PRO HDx 1.0 3.2 7.9 399 357 A 88 GLY H A 87 PRO HD3 1.0 3.2 8.2 400 358 A 135 ALA H A 136 GLN H 1.0 0.0 2.7 401 359 A 116 GLY H A 117 GLN HA 1.0 3.2 8.2 402 360 A 140 GLY H A 139 ALA HB% 1.0 2.7 5.0 403 361 A 89 LEU H A 88 GLY HAy 1.0 2.7 7.7 404 362 A 37 ALA H A 38 SER H 1.0 0.0 2.7 405 363 A 30 GLN H A 29 PRO HB3 1.0 2.7 6.7 406 364 A 134 VAL H A 133 SER HA 1.0 3.2 8.2 407 365 A 106 LEU H A 105 ALA H 1.0 0.0 2.7 408 366 A 37 ALA HA A 38 SER H 1.0 2.7 6.7 409 367 A 118 ILE HG2% A 119 ASN H 1.0 0.0 4.0 410 368 A 55 SER HA A 56 ALA H 1.0 2.7 6.7 411 369 A 84 ALA HA A 85 SER H 1.0 3.2 8.2 412 370 A 44 LEU HB2 A 45 SER H 1.0 3.2 8.2 413 371 A 41 ALA H A 40 ALA HA 1.0 2.8 6.8 414 372 A 102 VAL H A 101 GLU H 1.0 0.0 2.7 415 373 A 22 VAL H A 21 ALA HB% 1.0 2.7 6.7 416 374 A 70 ALA H A 69 ALA HA 1.0 3.2 8.2 417 375 A 53 VAL H A 52 ARG H 1.0 0.0 2.7 418 376 A 98 ALA H A 99 LEU H 1.0 0.0 2.7 419 377 A 31 SER H A 30 GLN HB2 1.0 3.2 8.2 420 378 A 61 VAL H A 62 SER H 1.0 0.0 2.7 421 379 A 78 VAL H A 79 VAL H 1.0 0.0 2.7 422 380 A 116 GLY H A 115 ILE HA 1.0 0.0 4.0 423 381 A 123 SER H A 122 ALA HA 1.0 3.2 8.2 424 382 A 115 ILE H A 116 GLY H 1.0 3.2 5.0 425 383 A 74 THR H A 73 ASN HB2 1.0 0.0 4.0 426 384 A 31 SER H A 30 GLN HA 1.0 0.0 2.7 427 385 A 100 LEU H A 99 LEU HB3 1.0 0.0 3.5 428 386 A 57 VAL HG2% A 58 SER H 1.0 2.7 7.5 429 387 A 128 GLN H A 127 THR HA 1.0 3.2 8.2 430 388 A 134 VAL H A 133 SER HG 1.0 0.0 4.0 431 389 A 103 VAL HA A 104 SER H 1.0 3.2 8.2 432 390 A 111 GLY HA2 A 112 SER H 1.0 3.2 8.2 433 391 A 36 VAL H A 35 PRO HB2 1.0 2.7 6.7 434 392 A 77 SER HA A 78 VAL H 1.0 3.2 8.2 435 393 A 71 LEU H A 70 ALA HA 1.0 3.2 8.2 436 394 A 68 GLN H A 67 ASN HA 1.0 0.0 2.7 437 395 A 57 VAL H A 56 ALA HB% 1.0 0.0 4.0 438 396 A 106 LEU H A 105 ALA HA 1.0 3.2 8.2 439 397 A 137 ALA H A 136 GLN HA 1.0 3.2 8.2 440 398 A 103 VAL HB A 104 SER H 1.0 0.0 3.2 441 399 A 110 LEU HB2 A 111 GLY H 1.0 0.0 4.0 442 400 A 104 SER H A 105 ALA H 1.0 0.0 2.7 443 401 A 66 THR H A 65 PRO HA 1.0 3.2 8.2 444 402 A 88 GLY H A 89 LEU HD11 1.0 3.2 8.2 445 403 A 133 SER HB2 A 134 VAL H 1.0 0.0 4.0 446 404 A 36 VAL H A 35 PRO HB3 1.0 3.2 8.2 447 405 A 26 GLY H A 27 TYR H 1.0 0.0 3.2 448 406 A 93 ASP H A 92 CYS HB2 1.0 0.0 4.0 449 407 A 64 GLY H A 63 SER HA 1.0 2.7 6.7 450 408 A 95 LEU HA A 96 VAL H 1.0 3.2 8.2 451 409 A 103 VAL H A 102 VAL HB 1.0 0.0 3.2 452 410 A 115 ILE H A 114 SER HB2 1.0 0.0 4.0 453 411 A 44 LEU H A 43 ARG HB3 1.0 0.0 4.0 454 411 A 44 LEU H A 43 ARG HB2 1.0 0.0 4.0 455 412 A 95 LEU H A 96 VAL H 1.0 0.0 2.7 456 413 A 109 ILE H A 108 SER HG 1.0 3.2 8.2 457 414 A 125 GLN H A 124 ALA HB% 1.0 0.0 3.5 458 415 A 93 ASP H A 92 CYS HA 1.0 3.2 8.2 459 416 A 34 ALA H A 33 SER HB3 1.0 0.0 3.2 460 417 A 22 VAL H A 23 SER H 1.0 3.2 8.2 461 418 A 68 GLN H A 67 ASN HB3 1.0 2.7 6.7 462 419 A 88 GLY H A 87 PRO HB3 1.0 2.7 6.7 463 420 A 31 SER H A 30 GLN H 1.0 0.0 3.2 464 421 A 116 GLY HA2 A 115 ILE HG2% 1.0 0.0 5.8 465 422 A 135 ALA HB% A 136 GLN H 1.0 0.0 4.0 466 423 A 73 ASN H A 72 SER HB2 1.0 0.0 3.9 467 423 A 73 ASN H A 72 SER HB3 1.0 0.0 3.9 468 424 A 134 VAL HG1% A 135 ALA H 1.0 0.0 4.0 469 425 A 113 SER H A 112 SER HA 1.0 0.0 4.0 470 426 A 48 ALA H A 47 PRO HB2 1.0 2.7 6.7 471 427 A 48 ALA H A 47 PRO HB3 1.0 3.2 8.2 472 428 A 73 ASN HA A 74 THR H 1.0 3.2 8.2 473 429 A 37 ALA H A 36 VAL H 1.0 0.0 2.7 474 430 A 132 GLN H A 131 GLY H 1.0 0.0 2.7 475 431 A 123 SER H A 122 ALA H 1.0 0.0 2.7 476 432 A 110 LEU HA A 111 GLY H 1.0 3.2 8.2 477 433 A 80 SER HA A 81 GLN H 1.0 3.2 8.2 478 434 A 54 SER H A 53 VAL HA 1.0 2.7 6.7 479 435 A 31 SER H A 30 GLN HB3 1.0 3.2 8.2 480 436 A 86 ASN H A 87 PRO HG2 1.0 3.2 8.2 481 436 A 86 ASN H A 87 PRO HG3 1.0 3.2 8.2 482 437 A 39 ALA H A 38 SER H 1.0 0.0 2.7 483 438 A 54 SER H A 53 VAL HB 1.0 0.0 3.2 484 439 A 123 SER H A 124 ALA H 1.0 0.0 2.7 485 440 A 22 VAL HA A 23 SER H 1.0 0.0 2.7 486 441 A 90 SER H A 89 LEU HB2 1.0 0.0 4.0 487 442 A 80 SER H A 79 VAL HG1% 1.0 0.0 4.0 488 443 A 138 LEU H A 139 ALA H 1.0 0.0 2.7 489 444 A 53 VAL H A 52 ARG HB3 1.0 2.7 6.7 490 445 A 89 LEU H A 90 SER H 1.0 3.2 5.0 491 446 A 114 SER H A 113 SER HB2 1.0 0.0 3.5 492 447 A 98 ALA H A 97 GLN HB2 1.0 0.0 3.9 493 447 A 98 ALA H A 97 GLN HB3 1.0 0.0 3.9 494 448 A 22 VAL H A 21 ALA H 1.0 2.7 6.7 495 449 A 84 ALA H A 85 SER H 1.0 0.0 2.7 496 450 A 94 VAL H A 93 ASP HB3 1.0 0.0 4.0 497 451 A 53 VAL H A 54 SER H 1.0 0.0 2.7 498 452 A 137 ALA HA A 138 LEU H 1.0 3.2 8.2 499 453 A 75 ILE H A 74 THR HB 1.0 0.0 3.2 500 454 A 30 GLN H A 29 PRO HB2 1.0 0.0 3.2 501 455 A 130 VAL H A 131 GLY H 1.0 0.0 2.7 502 456 A 111 GLY H A 112 SER H 1.0 0.0 2.7 503 457 A 109 ILE H A 108 SER HA 1.0 3.2 8.2 504 458 A 97 GLN H A 96 VAL H 1.0 0.0 2.7 505 459 A 40 ALA H A 39 ALA HA 1.0 3.2 8.2 506 460 A 77 SER H A 76 SER HB2 1.0 0.0 3.9 507 460 A 76 SER HB3 A 77 SER H 1.0 0.0 3.9 508 461 A 51 SER H A 50 SER HA 1.0 3.2 8.2 509 462 A 90 SER HB2 A 91 GLY H 1.0 0.0 4.0 510 463 A 71 LEU H A 72 SER H 1.0 0.0 2.7 511 464 A 24 VAL H A 23 SER HB2 1.0 2.7 7.4 512 464 A 24 VAL H A 23 SER HB3 1.0 2.7 7.4 513 465 A 64 GLY H A 63 SER HB3 1.0 2.7 6.7 514 466 A 60 LEU H A 59 SER HB2 1.0 2.7 6.6 515 466 A 60 LEU H A 59 SER HB3 1.0 2.7 6.6 516 467 A 80 SER HB3 A 81 GLN HG3 1.0 0.0 5.7 517 467 A 81 GLN HG3 A 80 SER HB2 1.0 0.0 5.7 518 468 A 95 LEU HB3 A 96 VAL H 1.0 0.0 3.2 519 469 A 57 VAL H A 58 SER H 1.0 0.0 2.7 520 470 A 118 ILE H A 119 ASN H 1.0 3.2 8.2 521 471 A 86 ASN H A 85 SER HA 1.0 0.0 4.0 522 472 A 80 SER H A 79 VAL H 1.0 0.0 2.7 523 473 A 61 VAL H A 60 LEU HB2 1.0 0.0 3.2 524 474 A 130 VAL H A 129 MET HA 1.0 3.2 8.2 525 475 A 98 ALA H A 97 GLN H 1.0 0.0 2.7 526 476 A 102 VAL H A 101 GLU HB3 1.0 0.0 4.0 527 477 A 113 SER H A 114 SER H 1.0 3.2 5.0 528 478 A 133 SER H A 132 GLN HB2 1.0 0.0 4.0 529 479 A 123 SER HA A 124 ALA H 1.0 3.2 8.2 530 480 A 100 LEU H A 101 GLU H 1.0 0.0 2.7 531 481 A 129 MET H A 128 GLN HBy 1.0 0.0 3.9 532 481 A 129 MET H A 128 GLN HBx 1.0 0.0 3.9 533 482 A 72 SER H A 71 LEU HB2 1.0 0.0 4.0 534 483 A 50 SER H A 49 ALA H 1.0 0.0 2.7 535 484 A 34 ALA H A 33 SER HB2 1.0 0.0 4.0 536 485 A 30 GLN H A 29 PRO HA 1.0 0.0 2.7 537 486 A 107 VAL H A 108 SER H 1.0 0.0 2.7 538 487 A 55 SER H A 56 ALA H 1.0 0.0 2.7 539 488 A 98 ALA H A 97 GLN HA 1.0 3.2 8.2 540 489 A 131 GLY H A 130 VAL HG2% 1.0 0.0 4.8 541 490 A 123 SER H A 122 ALA HB% 1.0 0.0 4.0 542 491 A 120 TYR H A 121 GLY H 1.0 2.7 7.7 543 492 A 76 SER H A 75 ILE HB 1.0 0.0 2.7 544 493 A 77 SER H A 76 SER HA 1.0 3.2 8.2 545 494 A 135 ALA H A 134 VAL HG2% 1.0 0.0 4.8 546 495 A 66 THR H A 65 PRO HD2 1.0 0.0 4.0 547 496 A 118 ILE HB A 119 ASN H 1.0 2.7 5.0 548 497 A 26 GLY H A 25 GLY HA2 1.0 0.0 3.4 549 497 A 26 GLY H A 25 GLY HA3 1.0 0.0 3.4 550 498 A 121 GLY H A 122 ALA H 1.0 0.0 3.2 551 499 A 60 LEU H A 59 SER H 1.0 0.0 2.7 552 500 A 135 ALA HA A 136 GLN H 1.0 3.2 8.2 553 501 A 33 SER H A 32 SER H 1.0 0.0 3.2 554 502 A 89 LEU HD21 A 88 GLY H 1.0 5.0 10.0 555 503 A 28 GLY H A 27 TYR HB3 1.0 2.7 6.7 556 504 A 80 SER H A 79 VAL HG2% 1.0 0.0 4.8 557 505 A 127 THR H A 126 TYR HBy 1.0 0.0 4.7 558 505 A 127 THR H A 126 TYR HBx 1.0 0.0 4.7 559 506 A 48 ALA HA A 49 ALA H 1.0 2.7 6.7 560 507 A 94 VAL H A 93 ASP HA 1.0 3.2 8.2 561 508 A 118 ILE H A 117 GLN HA 1.0 0.0 2.7 562 509 A 90 SER HB3 A 91 GLY H 1.0 0.0 3.2 563 510 A 78 VAL HA A 79 VAL H 1.0 3.2 8.2 564 511 A 43 ARG H A 42 SER HA 1.0 2.7 6.7 565 512 A 82 VAL H A 81 GLN HA 1.0 3.2 8.2 566 513 A 130 VAL H A 129 MET HB2 1.0 0.0 3.9 567 513 A 130 VAL H A 129 MET HB3 1.0 0.0 3.9 568 514 A 82 VAL H A 81 GLN H 1.0 0.0 2.7 569 515 A 57 VAL H A 56 ALA H 1.0 0.0 2.7 570 516 A 133 SER H A 132 GLN H 1.0 0.0 2.7 571 517 A 102 VAL H A 101 GLU HB2 1.0 0.0 3.2 572 518 A 113 SER HA A 114 SER H 1.0 0.0 2.7 573 519 A 94 VAL H A 93 ASP HB2 1.0 0.0 3.3 574 520 A 75 ILE H A 74 THR HA 1.0 3.2 8.2 575 521 A 68 GLN HA A 69 ALA H 1.0 2.7 6.7 576 522 A 39 ALA H A 40 ALA H 1.0 0.0 2.7 577 523 A 113 SER H A 112 SER H 1.0 0.0 3.2 578 524 A 49 ALA H A 48 ALA HB% 1.0 0.0 4.0 579 525 A 60 LEU H A 59 SER HA 1.0 2.7 6.7 580 526 A 34 ALA H A 33 SER H 1.0 0.0 3.2 581 527 A 80 SER H A 79 VAL HA 1.0 3.2 8.2 582 528 A 133 SER H A 132 GLN HB3 1.0 0.0 4.0 583 529 A 128 GLN H A 127 THR HB 1.0 0.0 3.2 584 530 A 128 GLN H A 127 THR H 1.0 0.0 2.7 585 531 A 89 LEU HB3 A 90 SER H 1.0 0.0 4.0 586 532 A 66 THR H A 65 PRO HD3 1.0 0.0 5.0 587 533 A 57 VAL HB A 58 SER H 1.0 0.0 2.7 588 534 A 113 SER HB3 A 114 SER H 1.0 0.0 5.0 589 535 A 75 ILE H A 74 THR H 1.0 0.0 2.7 590 536 A 116 GLY HA3 A 115 ILE HG2% 1.0 0.0 5.8 591 537 A 92 CYS HB3 A 93 ASP H 1.0 0.0 4.0 592 538 A 57 VAL H A 56 ALA HA 1.0 2.7 6.7 593 539 A 100 LEU H A 99 LEU HB2 1.0 0.0 4.0 594 540 A 80 SER H A 81 GLN H 1.0 0.0 2.7 595 541 A 116 GLY HA3 A 117 GLN H 1.0 0.0 2.7 596 542 A 91 GLY H A 90 SER HA 1.0 0.0 2.7 597 543 A 133 SER H A 134 VAL H 1.0 0.0 2.7 598 544 A 103 VAL H A 102 VAL HA 1.0 3.2 8.2 599 545 A 129 MET H A 128 GLN HA 1.0 3.2 8.2 600 546 A 50 SER H A 49 ALA HB% 1.0 0.0 3.5 601 547 A 61 VAL HA A 62 SER H 1.0 2.7 6.7 602 548 A 137 ALA H A 138 LEU H 1.0 0.0 2.7 603 549 A 58 SER H A 57 VAL HA 1.0 2.7 6.7 604 550 A 86 ASN HD22 A 85 SER H 1.0 3.2 8.2 605 551 A 44 LEU H A 45 SER H 1.0 0.0 2.7 606 552 A 84 ALA H A 83 SER H 1.0 0.0 2.7 607 553 A 89 LEU HA A 88 GLY H 1.0 4.0 9.0 608 554 A 131 GLY H A 130 VAL HA 1.0 3.2 8.2 609 555 A 105 ALA H A 104 SER HA 1.0 3.2 8.2 610 556 A 83 SER H A 82 VAL HB 1.0 0.0 2.7 611 557 A 115 ILE HB A 116 GLY H 1.0 3.2 5.0 612 558 A 86 ASN H A 87 PRO HD3 1.0 0.0 3.2 613 559 A 75 ILE H A 74 THR HG1 1.0 0.0 4.0 614 560 A 134 VAL H A 133 SER HB3 1.0 0.0 4.0 615 561 A 76 SER H A 75 ILE HA 1.0 3.2 8.2 616 562 A 131 GLY H A 130 VAL HG1% 1.0 0.0 4.0 617 563 A 113 SER H A 112 SER HB2 1.0 0.0 4.0 618 564 A 73 ASN HB3 A 74 THR H 1.0 0.0 4.0 619 565 A 120 TYR H A 119 ASN HA 1.0 0.0 2.7 620 566 A 64 GLY H A 63 SER HB2 1.0 0.0 3.2 621 567 A 139 ALA H A 140 GLY H 1.0 0.0 2.7 622 568 A 59 SER H A 58 SER H 1.0 0.0 2.7 623 569 A 73 ASN H A 72 SER H 1.0 0.0 2.7 624 570 A 68 GLN H A 69 ALA H 1.0 0.0 3.2 625 571 A 30 GLN H A 29 PRO HDy 1.0 3.2 8.9 626 571 A 30 GLN H A 29 PRO HDx 1.0 3.2 8.9 627 572 A 107 VAL HA A 108 SER H 1.0 3.2 8.2 628 573 A 103 VAL H A 102 VAL H 1.0 0.0 2.7 629 574 A 115 ILE H A 114 SER HA 1.0 0.0 2.7 630 575 A 115 ILE H A 114 SER H 1.0 3.2 5.0 631 576 A 116 GLY H A 117 GLN HG2 1.0 3.2 8.2 632 576 A 116 GLY H A 117 GLN HG3 1.0 3.2 8.2 633 577 A 78 VAL HB A 79 VAL H 1.0 0.0 3.2 634 578 A 75 ILE H A 74 THR HG2% 1.0 0.0 4.8 635 579 A 61 VAL HGx% A 62 SER H 1.0 0.0 4.0 636 580 A 44 LEU H A 43 ARG H 1.0 0.0 2.7 637 581 A 116 GLY H A 117 GLN H 1.0 2.7 6.7 638 582 A 109 ILE H A 108 SER HB3 1.0 0.0 4.0 639 583 A 73 ASN H A 72 SER HA 1.0 3.2 8.2 640 584 A 108 SER H A 107 VAL HG1% 1.0 0.0 4.0 641 585 A 110 LEU H A 109 ILE HA 1.0 3.2 8.2 642 586 A 61 VAL HB A 62 SER H 1.0 0.0 3.2 643 587 A 76 SER H A 75 ILE H 1.0 0.0 2.7 644 588 A 67 ASN H A 66 THR HA 1.0 0.0 3.2 645 589 A 72 SER H A 71 LEU HB3 1.0 0.0 4.0 646 590 A 139 ALA HA A 140 GLY H 1.0 2.7 7.7 647 591 A 86 ASN H A 85 SER H 1.0 0.0 2.7 648 592 A 113 SER H A 112 SER HB3 1.0 0.0 5.0 649 593 A 122 ALA H A 121 GLY HA3 1.0 0.0 4.0 650 594 A 94 VAL HA A 95 LEU H 1.0 3.2 8.2 651 595 A 23 SER H A 22 VAL HB 1.0 2.7 6.7 652 596 A 31 SER H A 32 SER H 1.0 3.2 8.2 653 597 A 84 ALA H A 83 SER HB2 1.0 0.0 3.4 654 597 A 84 ALA H A 83 SER HB3 1.0 0.0 3.4 655 598 A 48 ALA H A 49 ALA H 1.0 0.0 3.2 656 599 A 85 SER H A 84 ALA HB% 1.0 0.0 3.5 657 600 A 125 GLN H A 126 TYR H 1.0 0.0 2.7 658 601 A 83 SER H A 82 VAL HA 1.0 3.2 8.2 659 602 A 134 VAL HB A 135 ALA H 1.0 0.0 3.2 660 603 A 94 VAL H A 93 ASP H 1.0 0.0 2.7 661 604 A 125 GLN H A 124 ALA HA 1.0 3.2 8.2 662 605 A 34 ALA H A 33 SER HA 1.0 3.2 8.2 663 606 A 120 TYR H A 119 ASN HB3 1.0 0.0 4.5 664 607 A 110 LEU H A 109 ILE H 1.0 0.0 2.7 665 608 A 51 SER HA A 52 ARG H 1.0 2.7 6.7 666 609 A 133 SER H A 132 GLN HA 1.0 3.2 8.2 667 610 A 63 SER H A 62 SER HB2 1.0 0.0 3.9 668 610 A 63 SER H A 62 SER HB3 1.0 0.0 3.9 669 611 A 111 GLY H A 110 LEU HB3 1.0 0.0 4.0 670 612 A 48 ALA H A 47 PRO HA 1.0 2.7 6.7 671 613 A 91 GLY H A 92 CYS H 1.0 2.7 7.7 672 614 A 37 ALA HB% A 38 SER H 1.0 0.0 3.5 673 615 A 90 SER H A 91 GLY H 1.0 3.2 5.0 674 616 A 51 SER H A 50 SER H 1.0 0.0 2.7 675 617 A 61 VAL H A 60 LEU H 1.0 0.0 2.7 676 618 A 52 ARG H A 51 SER HB2 1.0 0.0 3.9 677 618 A 51 SER HB3 A 52 ARG H 1.0 0.0 3.9 678 619 A 86 ASN H A 87 PRO HD2 1.0 0.0 4.0 679 620 A 118 ILE HA A 119 ASN H 1.0 0.0 2.7 680 621 A 107 VAL HG2% A 108 SER H 1.0 0.0 4.8 681 622 A 137 ALA H A 136 GLN H 1.0 0.0 2.7 682 623 A 125 GLN HA A 126 TYR H 1.0 3.2 8.2 683 624 A 96 VAL H A 95 LEU HB2 1.0 2.7 6.7 684 625 A 139 ALA H A 138 LEU HA 1.0 2.7 6.7 685 626 A 68 GLN H A 67 ASN H 1.0 2.7 6.7 686 627 A 138 LEU H A 137 ALA HB% 1.0 0.0 4.0 687 628 A 86 ASN H A 85 SER HB3 1.0 0.0 4.7 688 628 A 86 ASN H A 85 SER HB2 1.0 0.0 4.7 689 629 A 88 GLY H A 87 PRO HB2 1.0 0.0 4.0 690 630 A 120 TYR H A 119 ASN H 1.0 3.2 8.2 691 631 A 80 SER HB3 A 81 GLN HG2 1.0 0.0 4.7 692 631 A 80 SER HB2 A 81 GLN HG2 1.0 0.0 4.7 693 632 A 39 ALA H A 38 SER HA 1.0 3.2 8.2 694 633 A 72 SER H A 71 LEU HA 1.0 3.2 8.2 695 634 A 118 ILE H A 117 GLN H 1.0 3.2 8.2 696 635 A 24 VAL H A 23 SER HA 1.0 0.0 2.7 697 636 A 102 VAL H A 101 GLU HA 1.0 3.2 8.2 698 637 A 115 ILE HD1% A 116 GLY H 1.0 3.2 8.2 699 638 A 115 ILE H A 114 SER HB3 1.0 0.0 4.0 700 639 A 81 GLN H A 80 SER HB3 1.0 0.0 3.4 701 639 A 81 GLN H A 80 SER HB2 1.0 0.0 3.4 702 640 A 66 THR H A 65 PRO HB2 1.0 0.0 3.9 703 640 A 66 THR H A 65 PRO HB3 1.0 0.0 3.9 704 641 A 130 VAL HB A 131 GLY H 1.0 0.0 2.7 705 642 A 54 SER H A 55 SER H 1.0 0.0 2.7 706 643 A 43 ARG H A 42 SER H 1.0 0.0 2.7 707 644 A 56 ALA H A 55 SER HB2 1.0 0.0 3.4 708 644 A 55 SER HB3 A 56 ALA H 1.0 0.0 3.4 709 645 A 48 ALA H A 47 PRO HDy 1.0 2.7 7.4 710 645 A 48 ALA H A 47 PRO HDx 1.0 2.7 7.4 711 646 A 127 THR H A 126 TYR H 1.0 0.0 2.7 712 647 A 26 GLY H A 25 GLY H 1.0 3.2 8.2 713 648 A 41 ALA H A 40 ALA HB% 1.0 2.7 6.7 714 649 A 39 ALA H A 38 SER HBy 1.0 0.0 3.9 715 649 A 39 ALA H A 38 SER HBx 1.0 0.0 3.9 716 650 A 88 GLY H A 87 PRO HG2 1.0 0.0 4.0 717 650 A 88 GLY H A 87 PRO HG3 1.0 0.0 4.0 718 651 A 89 LEU H A 88 GLY HAx 1.0 2.7 7.7 719 652 A 41 ALA H A 40 ALA H 1.0 0.0 2.8 720 653 A 20 ALA H A 19 SER HA 1.0 0.0 3.2 721 654 A 70 ALA H A 69 ALA HB% 1.0 0.0 4.0 722 655 A 27 TYR H A 28 GLY H 1.0 0.0 3.2 723 656 A 67 ASN H A 66 THR HB 1.0 3.2 8.2 724 657 A 34 ALA H A 35 PRO HDy 1.0 0.0 3.4 725 657 A 34 ALA H A 35 PRO HDx 1.0 0.0 3.4 726 658 A 94 VAL H A 95 LEU H 1.0 0.0 2.7 727 659 A 80 SER H A 79 VAL HB 1.0 0.0 2.7 728 660 A 66 THR H A 67 ASN H 1.0 0.0 2.7 729 661 A 70 ALA H A 69 ALA H 1.0 0.0 2.7 730 662 A 53 VAL H A 52 ARG HA 1.0 2.7 6.7 731 663 A 128 GLN H A 129 MET H 1.0 0.0 2.7 732 664 A 63 SER H A 62 SER H 1.0 0.0 2.7 733 665 A 61 VAL H A 60 LEU HA 1.0 2.7 6.7 734 666 A 36 VAL H A 35 PRO HA 1.0 2.7 6.7 735 667 A 88 GLY H A 87 PRO HD2 1.0 0.0 4.0 736 668 A 68 GLN HB3 A 69 ALA H 1.0 0.0 3.2 737 669 A 44 LEU H A 43 ARG HA 1.0 2.7 6.7 738 670 A 103 VAL H A 102 VAL HG2% 1.0 0.0 4.8 739 671 A 125 GLN HB2 A 126 TYR H 1.0 0.0 4.0 740 672 A 22 VAL H A 21 ALA HA 1.0 0.0 3.2 741 673 A 92 CYS H A 93 ASP H 1.0 0.0 4.0 742 674 A 37 ALA H A 36 VAL HB 1.0 0.0 3.2 743 675 A 63 SER H A 62 SER HA 1.0 2.7 6.7 744 676 A 78 VAL H A 77 SER HB2 1.0 0.0 4.0 745 676 A 78 VAL H A 77 SER HB3 1.0 0.0 4.0 746 677 A 106 LEU HB2 A 107 VAL H 1.0 0.0 3.2 747 678 A 97 GLN H A 96 VAL HA 1.0 3.2 8.2 748 679 A 24 VAL H A 25 GLY H 1.0 3.2 8.2 749 680 A 134 VAL H A 135 ALA H 1.0 0.0 2.7 750 681 A 120 TYR H A 119 ASN HB2 1.0 0.0 5.0 751 682 A 61 VAL H A 60 LEU HB3 1.0 0.0 4.0 752 683 A 46 SER H A 45 SER H 1.0 0.0 2.7 753 684 A 46 SER H A 45 SER HA 1.0 2.7 6.7 754 685 A 27 TYR H A 26 GLY HA2 1.0 0.0 3.4 755 685 A 26 GLY HA3 A 27 TYR H 1.0 0.0 3.4 756 686 A 127 THR H A 126 TYR HA 1.0 3.2 8.2 757 687 A 122 ALA H A 121 GLY HA2 1.0 0.0 4.0 758 688 A 64 GLY H A 63 SER H 1.0 0.0 2.7 759 689 A 71 LEU H A 70 ALA H 1.0 0.0 2.7 760 690 A 24 VAL HB A 25 GLY H 1.0 3.2 8.2 761 691 A 100 LEU H A 99 LEU HA 1.0 3.2 8.2 762 692 A 57 VAL HG1% A 58 SER H 1.0 0.0 4.0 763 693 A 103 VAL H A 104 SER H 1.0 0.0 2.7 764 694 A 46 SER H A 45 SER HBy 1.0 2.7 6.6 765 694 A 46 SER H A 45 SER HBx 1.0 2.7 6.6 766 695 A 98 ALA HA A 99 LEU H 1.0 3.2 8.2 767 696 A 100 LEU HA A 101 GLU H 1.0 2.7 7.7 768 697 A 118 ILE H A 117 GLN HBy 1.0 0.0 4.7 769 697 A 118 ILE H A 117 GLN HBx 1.0 0.0 4.7 770 698 A 137 ALA H A 136 GLN HBy 1.0 0.0 3.9 771 698 A 137 ALA H A 136 GLN HBx 1.0 0.0 3.9 772 699 A 134 VAL HA A 135 ALA H 1.0 3.2 8.2 773 700 A 46 SER H A 47 PRO HDy 1.0 2.7 6.7 774 700 A 46 SER H A 47 PRO HDx 1.0 2.7 6.7 775 701 A 77 SER H A 78 VAL H 1.0 0.0 2.7 776 702 A 32 SER H A 31 SER HA 1.0 0.0 4.0 777 703 A 82 VAL H A 83 SER H 1.0 0.0 2.7 778 704 A 92 CYS H A 91 GLY HAy 1.0 0.0 5.0 779 704 A 91 GLY HAx A 92 CYS H 1.0 0.0 5.0 780 705 A 121 GLY H A 120 TYR HA 1.0 2.7 7.7 781 706 A 118 ILE HD1% A 119 ASN H 1.0 0.0 4.8 782 707 A 88 GLY H A 89 LEU HB2 1.0 2.7 5.0 783 708 A 45 SER H A 44 LEU HB3 1.0 2.7 6.7 784 709 A 27 TYR HB2 A 28 GLY H 1.0 2.7 6.7 785 710 A 37 ALA H A 36 VAL HA 1.0 2.7 6.7 786 711 A 116 GLY H A 115 ILE HG2% 1.0 0.0 4.2 787 712 A 109 ILE H A 108 SER HB2 1.0 0.0 4.0 788 713 A 24 VAL HA A 25 GLY H 1.0 0.0 2.7 789 714 A 127 THR H A 126 TYR HD% 1.0 0.0 5.7 790 715 A 106 LEU HB3 A 107 VAL H 1.0 0.0 4.0 791 716 A 123 SER HB2 A 124 ALA H 1.0 0.0 5.0 792 717 A 125 GLN HB3 A 126 TYR H 1.0 0.0 4.0 793 718 A 97 GLN H A 96 VAL HB 1.0 0.0 3.2 794 719 A 130 VAL H A 129 MET H 1.0 0.0 2.7 795 720 A 33 SER H A 32 SER HA 1.0 0.0 2.7 796 721 A 109 ILE H A 108 SER H 1.0 0.0 2.7 797 722 A 33 SER H A 32 SER HBy 1.0 2.7 7.5 798 722 A 33 SER H A 32 SER HBx 1.0 2.7 7.5 799 723 A 42 SER H A 41 ALA HA 1.0 2.7 6.7 800 724 A 108 SER H A 107 VAL HB 1.0 0.0 3.2 801 725 A 50 SER H A 49 ALA HA 1.0 2.7 6.7 802 726 A 43 ARG H A 42 SER HB2 1.0 2.7 6.6 803 726 A 43 ARG H A 42 SER HB3 1.0 2.7 6.6 804 727 A 84 ALA H A 83 SER HA 1.0 3.2 8.2 805 728 A 89 LEU H A 88 GLY H 1.0 0.0 2.7 806 729 A 88 GLY H A 87 PRO HA 1.0 0.0 4.0 807 730 A 124 ALA H A 123 SER HB3 1.0 0.0 4.0 808 731 A 137 ALA HB% A 138 LEU HD1% 1.0 0.0 4.7 809 732 A 28 GLY H A 27 TYR HA 1.0 0.0 3.2 810 733 A 111 GLY HA3 A 112 SER H 1.0 2.7 7.7 811 734 A 107 VAL H A 106 LEU HA 1.0 3.2 8.2 812 735 A 114 SER H A 113 SER HG 1.0 3.2 8.2 813 736 A 68 GLN H A 67 ASN HB2 1.0 3.2 8.2 814 737 A 110 LEU H A 111 GLY H 1.0 0.0 2.7 815 738 A 125 GLN H A 124 ALA H 1.0 0.0 2.7 816 739 A 39 ALA HB% A 40 ALA H 1.0 0.0 4.0 817 740 A 44 LEU HA A 45 SER H 1.0 2.7 6.7 818 741 A 41 ALA H A 42 SER H 1.0 0.0 2.7 819 742 A 62 SER H A 61 VAL HGy% 1.0 0.0 4.8 820 743 A 68 GLN HB2 A 69 ALA H 1.0 2.7 6.7 821 744 A 73 ASN H A 74 THR H 1.0 0.0 2.7 822 745 A 100 LEU H A 99 LEU H 1.0 0.0 2.7 823 746 A 82 VAL HA A 85 SER HB3 1.0 0.0 5.0 824 747 A 133 SER H A 135 ALA H 1.0 3.2 5.0 825 748 A 129 MET H A 126 TYR HA 1.0 0.0 4.0 826 749 A 95 LEU H A 97 GLN H 1.0 3.2 5.0 827 750 A 99 LEU H A 101 GLU H 1.0 3.2 5.0 828 751 A 106 LEU HB3 A 109 ILE H 1.0 0.0 5.5 829 752 A 85 SER H A 82 VAL HB 1.0 3.2 8.2 830 753 A 105 ALA H A 102 VAL HA 1.0 0.0 4.0 831 754 A 131 GLY H A 128 GLN HA 1.0 0.0 4.0 832 755 A 138 LEU H A 135 ALA H 1.0 0.0 6.0 833 756 A 103 VAL H A 105 ALA H 1.0 3.2 5.0 834 757 A 98 ALA H A 100 LEU H 1.0 3.2 5.0 835 758 A 76 SER H A 78 VAL H 1.0 3.2 5.0 836 759 A 86 ASN H A 83 SER HA 1.0 2.7 5.0 837 760 A 97 GLN HE21 A 101 GLU HG2 1.0 2.7 7.7 838 760 A 97 GLN HE21 A 101 GLU HG3 1.0 2.7 7.7 839 761 A 113 SER H A 110 LEU H 1.0 0.0 5.0 840 762 A 135 ALA H A 132 GLN HA 1.0 0.0 4.0 841 763 A 82 VAL HG1% A 85 SER H 1.0 2.7 7.5 842 764 A 89 LEU HD11 A 93 ASP HB3 1.0 0.0 5.8 843 765 A 78 VAL HA A 81 GLN HG2 1.0 0.0 4.7 844 765 A 78 VAL HA A 81 GLN HG3 1.0 0.0 4.7 845 766 A 67 ASN HB3 A 70 ALA HB% 1.0 0.0 5.0 846 767 A 106 LEU H A 103 VAL HA 1.0 0.0 4.0 847 768 A 99 LEU H A 96 VAL HA 1.0 3.2 8.2 848 769 A 89 LEU H A 87 PRO HA 1.0 0.0 4.0 849 770 A 98 ALA H A 95 LEU HA 1.0 2.7 6.7 850 771 A 128 GLN H A 125 GLN HA 1.0 0.0 4.0 851 772 A 133 SER H A 130 VAL HG1% 1.0 0.0 5.8 852 773 A 89 LEU H A 93 ASP HB2 1.0 2.7 7.7 853 774 A 130 VAL H A 128 GLN H 1.0 3.2 5.0 854 775 A 74 THR H A 70 ALA HB% 1.0 2.7 7.7 855 776 A 103 VAL H A 100 LEU HA 1.0 0.0 3.5 856 777 A 99 LEU H A 102 VAL H 1.0 0.0 5.0 857 778 A 81 GLN H A 79 VAL H 1.0 3.2 5.0 858 779 A 86 ASN H A 84 ALA H 1.0 3.2 5.0 859 780 A 99 LEU H A 97 GLN H 1.0 3.2 5.0 860 781 A 102 VAL H A 104 SER H 1.0 3.2 5.0 861 782 A 80 SER H A 82 VAL H 1.0 3.2 5.0 862 783 A 89 LEU H A 87 PRO HD2 1.0 3.2 8.2 863 784 A 116 GLY H A 114 SER H 1.0 3.2 8.2 864 785 A 86 ASN H A 83 SER H 1.0 3.2 5.0 865 786 A 93 ASP H A 90 SER HA 1.0 3.2 8.2 866 787 A 139 ALA H A 136 GLN HA 1.0 0.0 4.0 867 788 A 134 VAL H A 131 GLY HA2 1.0 0.0 5.0 868 789 A 40 ALA HA A 43 ARG HD2 1.0 0.0 5.0 869 790 A 107 VAL H A 105 ALA H 1.0 3.2 5.0 870 791 A 110 LEU H A 107 VAL H 1.0 3.2 5.0 871 792 A 67 ASN HB2 A 69 ALA H 1.0 0.0 5.0 872 793 A 46 SER HB3 A 43 ARG HB3 1.0 0.0 5.0 873 794 A 100 LEU H A 96 VAL HA 1.0 0.0 5.0 874 795 A 126 TYR H A 124 ALA H 1.0 3.2 5.0 875 796 A 111 GLY H A 108 SER HA 1.0 0.0 4.0 876 797 A 89 LEU H A 86 ASN HB2 1.0 0.0 5.0 877 798 A 132 GLN H A 129 MET HA 1.0 0.0 5.0 878 799 A 122 ALA H A 119 ASN HB3 1.0 0.0 5.0 879 800 A 133 SER H A 130 VAL HA 1.0 0.0 4.0 880 801 A 89 LEU H A 86 ASN HB3 1.0 0.0 4.0 881 802 A 128 GLN H A 126 TYR H 1.0 3.2 5.0 882 803 A 110 LEU H A 112 SER H 1.0 3.2 5.0 883 804 A 136 GLN H A 133 SER HA 1.0 0.0 5.0 884 805 A 110 LEU H A 107 VAL HA 1.0 0.0 4.0 885 806 A 106 LEU H A 102 VAL HA 1.0 0.0 5.0 886 807 A 101 GLU H A 97 GLN HA 1.0 0.0 5.0 887 808 A 72 SER H A 70 ALA H 1.0 3.2 5.0 888 809 A 75 ILE HA A 78 VAL H 1.0 0.0 4.0 889 810 A 51 SER H A 53 VAL H 1.0 3.2 5.0 890 811 A 86 ASN H A 84 ALA HA 1.0 2.7 5.0 891 812 A 98 ALA HA A 102 VAL H 1.0 0.0 5.0 892 813 A 110 LEU H A 108 SER H 1.0 3.2 5.0 893 814 A 86 ASN HA A 88 GLY H 1.0 2.7 5.0 894 815 A 139 ALA H A 135 ALA HA 1.0 0.0 5.0 895 816 A 89 LEU HD21 A 93 ASP HB2 1.0 0.0 4.0 896 817 A 53 VAL H A 49 ALA HA 1.0 3.2 8.2 897 818 A 51 SER H A 47 PRO HA 1.0 3.2 8.2 898 819 A 90 SER H A 93 ASP H 1.0 3.2 5.0 899 820 A 80 SER H A 78 VAL H 1.0 3.2 5.0 900 821 A 99 LEU H A 97 GLN HA 1.0 4.0 6.0 901 822 A 130 VAL H A 126 TYR HA 1.0 0.0 5.0 902 823 A 124 ALA H A 121 GLY HA3 1.0 0.0 5.7 903 823 A 124 ALA H A 121 GLY HA2 1.0 0.0 5.7 904 824 A 46 SER HB2 A 49 ALA H 1.0 0.0 4.0 905 825 A 112 SER H A 109 ILE HA 1.0 0.0 4.0 906 826 A 128 GLN H A 124 ALA HA 1.0 0.0 5.0 907 827 A 122 ALA H A 119 ASN HD21 1.0 0.0 5.0 908 828 A 123 SER H A 121 GLY HA3 1.0 0.0 5.7 909 828 A 123 SER H A 121 GLY HA2 1.0 0.0 5.7 910 829 A 89 LEU HD11 A 93 ASP HB2 1.0 0.0 5.8 911 830 A 86 ASN H A 82 VAL HA 1.0 2.7 7.7 912 831 A 130 VAL H A 132 GLN H 1.0 3.2 5.0 913 832 A 134 VAL H A 136 GLN H 1.0 3.2 5.0 914 833 A 122 ALA HA A 126 TYR H 1.0 0.0 5.0 915 834 A 27 TYR HB2 A 29 PRO HA 1.0 2.7 6.7 916 835 A 61 VAL HGx% A 64 GLY HA2 1.0 0.0 5.8 917 836 A 104 SER H A 102 VAL HA 1.0 0.0 5.0 918 837 A 73 ASN H A 75 ILE H 1.0 3.2 5.0 919 838 A 56 ALA H A 53 VAL HA 1.0 0.0 3.5 920 839 A 138 LEU H A 135 ALA HA 1.0 0.0 4.0 921 840 A 137 ALA H A 134 VAL HA 1.0 0.0 4.0 922 841 A 113 SER H A 111 GLY H 1.0 3.2 5.0 923 842 A 98 ALA H A 96 VAL H 1.0 3.2 5.0 924 843 A 86 ASN H A 84 ALA HB% 1.0 2.7 7.7 925 844 A 97 GLN HA A 100 LEU HB2 1.0 0.0 6.0 926 845 A 90 SER H A 93 ASP HB3 1.0 0.0 4.0 927 846 A 97 GLN HE22 A 101 GLU HG2 1.0 3.2 8.2 928 846 A 97 GLN HE22 A 101 GLU HG3 1.0 3.2 8.2 929 847 A 105 ALA HA A 108 SER H 1.0 0.0 4.0 930 848 A 129 MET H A 131 GLY H 1.0 3.2 5.0 931 849 A 125 GLN H A 127 THR H 1.0 3.2 5.0 932 850 A 82 VAL H A 84 ALA H 1.0 3.2 5.0 933 851 A 89 LEU H A 86 ASN HA 1.0 0.0 5.0 934 852 A 85 SER H A 81 GLN HG2 1.0 4.0 9.0 935 852 A 85 SER H A 81 GLN HG3 1.0 4.0 9.0 936 853 A 106 LEU H A 108 SER H 1.0 3.2 5.0 937 854 A 137 ALA H A 133 SER HA 1.0 0.0 5.0 938 855 A 38 SER H A 35 PRO HA 1.0 0.0 3.2 939 856 A 100 LEU H A 97 GLN HA 1.0 0.0 4.0 940 857 A 52 ARG HH1% A 49 ALA HA 1.0 0.0 5.7 941 857 A 49 ALA HA A 52 ARG HH2% 1.0 0.0 5.7 942 858 A 89 LEU H A 91 GLY HAy 1.0 2.7 7.7 943 858 A 89 LEU H A 91 GLY HAx 1.0 2.7 7.7 944 859 A 67 ASN HB3 A 69 ALA H 1.0 0.0 5.0 945 860 A 120 TYR H A 118 ILE HG2% 1.0 0.0 4.8 946 861 A 75 ILE H A 77 SER H 1.0 3.2 5.0 947 862 A 61 VAL HGx% A 64 GLY HA3 1.0 0.0 5.8 948 863 A 88 GLY H A 86 ASN HB3 1.0 3.2 8.2 949 864 A 60 LEU H A 56 ALA HB% 1.0 0.0 5.8 950 865 A 106 LEU H A 104 SER H 1.0 3.2 5.0 951 866 A 76 SER H A 74 THR H 1.0 3.2 5.0 952 867 A 89 LEU HD21 A 93 ASP HB3 1.0 0.0 4.0 953 868 A 122 ALA HA A 124 ALA H 1.0 3.2 8.2 954 869 A 46 SER HB3 A 43 ARG HB2 1.0 0.0 5.0 955 870 A 103 VAL H A 101 GLU H 1.0 3.2 5.0 956 871 A 130 VAL H A 127 THR HA 1.0 0.0 4.0 957 872 A 67 ASN HB2 A 70 ALA HB% 1.0 0.0 4.0 958 873 A 123 SER H A 121 GLY H 1.0 3.2 5.0 959 874 A 72 SER H A 74 THR H 1.0 3.2 5.0 960 875 A 127 THR H A 129 MET H 1.0 3.2 5.0 961 876 A 96 VAL H A 92 CYS HA 1.0 3.2 8.2 962 877 A 83 SER H A 85 SER H 1.0 3.2 5.0 963 878 A 64 GLY H A 67 ASN HB2 1.0 0.0 5.0 964 879 A 131 GLY H A 127 THR HA 1.0 0.0 5.0 965 880 A 52 ARG HH1% A 48 ALA HB% 1.0 0.0 3.9 966 880 A 48 ALA HB% A 52 ARG HH2% 1.0 0.0 3.9 967 881 A 77 SER H A 74 THR H 1.0 3.2 5.0 968 882 A 73 ASN HA A 77 SER H 1.0 0.0 4.0 969 883 A 120 TYR H A 122 ALA H 1.0 3.2 5.0 970 884 A 69 ALA H A 67 ASN HD22 1.0 2.7 5.0 971 885 A 90 SER H A 94 VAL H 1.0 3.2 5.0 972 886 A 107 VAL H A 109 ILE H 1.0 3.2 5.0 973 887 A 99 LEU HA A 102 VAL H 1.0 0.0 4.0 974 888 A 86 ASN H A 83 SER HB2 1.0 3.2 8.2 975 888 A 86 ASN H A 83 SER HB3 1.0 3.2 8.2 976 889 A 134 VAL H A 131 GLY HA3 1.0 0.0 6.0 977 890 A 40 ALA HA A 43 ARG HD3 1.0 2.7 7.7 978 891 A 43 ARG H A 40 ALA HB% 1.0 0.0 5.8 979 892 A 138 LEU H A 136 GLN H 1.0 3.2 5.0 980 893 A 76 SER H A 73 ASN HA 1.0 0.0 4.0 981 894 A 132 GLN H A 134 VAL H 1.0 3.2 5.0 982 895 A 89 LEU H A 86 ASN HD22 1.0 2.7 7.7 983 896 A 109 ILE H A 111 GLY H 1.0 3.2 5.0 984 897 A 129 MET H A 126 TYR HBy 1.0 0.0 5.7 985 897 A 129 MET H A 126 TYR HBx 1.0 0.0 5.7 986 898 A 139 ALA H A 136 GLN H 1.0 0.0 5.0 987 899 A 129 MET H A 126 TYR HD% 1.0 0.0 6.7 988 900 A 134 VAL H A 130 VAL HA 1.0 0.0 5.0 989 901 A 137 ALA HA A 140 GLY H 1.0 0.0 5.0 990 902 A 122 ALA H A 124 ALA H 1.0 3.2 5.0 991 903 A 63 SER H A 60 LEU HA 1.0 3.2 8.2 992 904 A 73 ASN H A 70 ALA HA 1.0 0.0 3.5 993 905 A 106 LEU HA A 108 SER H 1.0 0.0 5.0 994 906 A 111 GLY H A 114 SER H 1.0 3.2 8.2 995 907 A 50 SER H A 47 PRO HA 1.0 2.7 6.7 996 908 A 64 GLY H A 67 ASN HB3 1.0 0.0 6.0 997 909 A 73 ASN H A 71 LEU H 1.0 3.2 5.0 998 910 A 125 GLN H A 122 ALA HA 1.0 0.0 4.0 999 911 A 90 SER H A 93 ASP HB2 1.0 0.0 3.2 1000 912 A 63 SER HB2 A 70 ALA HB% 1.0 0.0 4.0 1001 913 A 105 ALA H A 53 VAL HG1% 1.0 0.0 4.8 1002 914 A 104 SER H A 53 VAL HG1% 1.0 0.0 5.8 1003 915 A 52 ARG HD2 A 78 VAL HG2% 1.0 0.0 5.8 1004 916 A 89 LEU HD11 A 43 ARG HD3 1.0 0.0 5.5 1005 916 A 89 LEU HD11 A 43 ARG HD2 1.0 0.0 5.5 1006 917 A 79 VAL HA A 98 ALA HB% 1.0 0.0 3.5 1007 918 A 52 ARG HG3 A 78 VAL HG2% 1.0 0.0 6.5 1008 918 A 52 ARG HG3 A 78 VAL HG1% 1.0 0.0 6.5 1009 919 A 86 ASN HD22 A 48 ALA HB% 1.0 0.0 5.8 1010 920 A 43 ARG HE A 89 LEU HD11 1.0 2.7 7.7 1011 921 A 68 GLN H A 129 MET HE% 1.0 0.0 5.8 1012 922 A 81 GLN HG3 A 52 ARG HD3 1.0 0.0 4.7 1013 922 A 52 ARG HD3 A 81 GLN HG2 1.0 0.0 4.7 1014 923 A 43 ARG H A 97 GLN HE22 1.0 0.0 6.0 1015 924 A 134 VAL HA A 75 ILE HD1% 1.0 0.0 5.8 1016 925 A 78 VAL HG1% A 52 ARG HD3 1.0 0.0 5.5 1017 925 A 52 ARG HD3 A 78 VAL HG2% 1.0 0.0 5.5 1018 926 A 69 ALA H A 129 MET HE% 1.0 0.0 5.8 1019 927 A 78 VAL H A 98 ALA HB% 1.0 0.0 6.8 1020 928 A 60 LEU H A 74 THR HG2% 1.0 0.0 4.8 1021 929 A 53 VAL HG2% A 104 SER H 1.0 0.0 5.8 1022 930 A 133 SER H A 71 LEU HB2 1.0 0.0 6.0 1023 931 A 133 SER HB3 A 75 ILE HD1% 1.0 0.0 5.8 1024 932 A 98 ALA H A 82 VAL HG2% 1.0 0.0 5.0 1025 933 A 82 VAL HG2% A 52 ARG HD3 1.0 0.0 4.8 1026 934 A 134 VAL H A 75 ILE HD1% 1.0 0.0 5.8 1027 935 A 61 VAL H A 109 ILE HG2% 1.0 0.0 6.8 1028 936 A 81 GLN HB2 A 52 ARG HD3 1.0 0.0 5.0 1029 937 A 67 ASN H A 129 MET HE% 1.0 0.0 4.8 1030 938 A 48 ALA HB% A 85 SER HB3 1.0 0.0 5.5 1031 938 A 85 SER HB2 A 48 ALA HB% 1.0 0.0 5.5 1032 939 A 70 ALA HB% A 63 SER HB3 1.0 0.0 4.0 1033 940 A 85 SER HG A 48 ALA HB% 1.0 0.0 4.8 1034 941 A 78 VAL HA A 52 ARG HD2 1.0 0.0 5.0 1035 942 A 40 ALA HB% A 100 LEU HD2% 1.0 0.0 4.7 1036 943 A 67 ASN HA A 129 MET HE% 1.0 0.0 4.8 1037 944 A 52 ARG HH1% A 81 GLN HB2 1.0 0.0 4.7 1038 945 A 129 MET HE% A 71 LEU HDx% 1.0 0.0 4.7 1039 946 A 96 VAL H A 40 ALA HB% 1.0 0.0 6.8 1040 947 A 81 GLN HB3 A 52 ARG HD3 1.0 2.7 4.0 1041 948 A 44 LEU HB2 A 101 GLU HG2 1.0 0.0 4.2 1042 948 A 44 LEU HB3 A 101 GLU HG2 1.0 0.0 4.2 1043 948 A 101 GLU HG3 A 44 LEU HB3 1.0 0.0 4.2 1044 948 A 44 LEU HB2 A 101 GLU HG3 1.0 0.0 4.2 1045 949 A 98 ALA HB% A 79 VAL HG2% 1.0 0.0 4.2 1046 950 A 61 VAL H A 109 ILE HD1% 1.0 0.0 4.8 1047 951 A 68 GLN HG2 A 132 GLN HE22 1.0 0.0 4.0 1048 952 A 63 SER H A 70 ALA HB% 1.0 0.0 4.8 1049 953 A 53 VAL HG2% A 105 ALA H 1.0 0.0 5.8 1050 954 A 52 ARG HD2 A 78 VAL HG1% 1.0 0.0 4.0 1051 955 A 40 ALA HB% A 96 VAL HG2% 1.0 0.0 5.5 1052 956 A 52 ARG HH1% A 81 GLN HG2 1.0 2.7 7.7 1053 956 A 52 ARG HH1% A 81 GLN HG3 1.0 2.7 7.7 1054 957 A 60 LEU H A 109 ILE HD1% 1.0 0.0 4.8 1055 958 A 101 GLU H A 44 LEU HD1% 1.0 0.0 4.8 1056 959 A 134 VAL HG2% A 75 ILE HD1% 1.0 0.0 4.7 1057 960 A 81 GLN HB3 A 52 ARG HD2 1.0 0.0 5.0 1058 961 A 68 GLN HG2 A 132 GLN HE21 1.0 0.0 3.2 1059 962 A 97 GLN H A 40 ALA HB% 1.0 0.0 5.8 1060 963 A 52 ARG HD2 A 82 VAL HG2% 1.0 0.0 4.8 1061 964 A 79 VAL H A 98 ALA HB% 1.0 0.0 4.8 1062 965 A 44 LEU HA A 101 GLU HG2 1.0 0.0 5.0 1063 965 A 44 LEU HA A 101 GLU HG3 1.0 0.0 5.0 1064 966 A 52 ARG HH1% A 85 SER HB3 1.0 0.0 4.7 1065 967 A 43 ARG HD3 A 97 GLN HGy 1.0 3.2 8.2 1066 967 A 43 ARG HD2 A 97 GLN HGy 1.0 3.2 8.2 1067 967 A 97 GLN HGx A 43 ARG HD3 1.0 3.2 8.2 1068 967 A 43 ARG HD2 A 97 GLN HGx 1.0 3.2 8.2 1069 968 A 81 GLN HB2 A 52 ARG HD2 1.0 0.0 5.0 1070 969 A 137 ALA HB% A 75 ILE HG2% 1.0 0.0 4.2 1071 970 A 43 ARG HE A 97 GLN HB2 1.0 0.0 3.9 1072 970 A 43 ARG HE A 97 GLN HB3 1.0 0.0 3.9 1073 971 A 52 ARG HG2 A 78 VAL HG2% 1.0 0.0 6.5 1074 971 A 52 ARG HG2 A 78 VAL HG1% 1.0 0.0 6.5 1075 972 A 126 TYR HE% A 66 THR HB 1.0 0.0 5.7 1076 973 A 129 MET HE% A 71 LEU HB3 1.0 0.0 5.5 1077 973 A 129 MET HE% A 71 LEU HB2 1.0 0.0 5.5 1078 974 A 81 GLN HE21 A 52 ARG HD2 1.0 3.2 8.2 1079 974 A 81 GLN HE22 A 52 ARG HD2 1.0 3.2 8.2 1080 975 A 79 VAL HB A 98 ALA HB% 1.0 0.0 4.8 1081 976 A 66 THR HA A 126 TYR HD% 1.0 0.0 5.7 1082 977 A 93 ASP HB3 A 43 ARG HD2 1.0 0.0 5.0 1083 978 A 82 VAL H A 98 ALA HB% 1.0 0.0 5.8 1084 979 A 133 SER H A 75 ILE HD1% 1.0 0.0 5.8 1085 980 A 65 PRO HA A 60 LEU HD2% 1.0 0.0 4.0 1086 981 A 52 ARG HH1% A 82 VAL HA 1.0 0.0 5.7 1087 982 A 44 LEU H A 97 GLN HE22 1.0 0.0 4.0 1088 983 A 97 GLN HA A 40 ALA HB% 1.0 0.0 4.8 1089 984 A 98 ALA HB% A 78 VAL HG1% 1.0 0.0 4.2 1090 985 A 137 ALA HB% A 79 VAL HG2% 1.0 2.7 8.2 1091 986 A 116 GLY H B 113 SER HBy 1.0 0.0 4.0 1092 987 A 109 ILE HG2% B 110 LEU HD21 1.0 0.0 4.7 1093 988 A 103 VAL HG2% B 103 VAL H 1.0 0.0 4.8 1094 989 A 138 LEU HB3 B 34 ALA HB1 1.0 0.0 5.5 1095 990 A 50 SER HA B 127 THR HG21 1.0 0.0 5.8 1096 991 A 34 ALA HB% B 139 ALA H 1.0 0.0 5.8 1097 992 B 57 VAL HG11 A 120 TYR HE% 1.0 0.0 4.7 1098 993 A 108 SER HA B 126 TYR HD% 1.0 0.0 4.7 1099 994 A 134 VAL HG1% B 41 ALA HB1 1.0 0.0 4.7 1100 995 A 37 ALA HB% B 138 LEU HD21 1.0 0.0 4.2 1101 996 A 120 TYR HE% B 57 VAL HB 1.0 0.0 3.9 1102 997 A 118 ILE HD1% B 109 ILE HG21 1.0 0.0 4.7 1103 998 A 130 VAL HG2% B 107 VAL H 1.0 0.0 4.8 1104 999 A 57 VAL HG1% B 120 TYR HD% 1.0 0.0 4.7 1105 1000 A 57 VAL HG1% B 120 TYR HE% 1.0 0.0 4.7 1106 1001 A 37 ALA HB% B 138 LEU HBy 1.0 0.0 4.8 1107 1002 A 114 SER H B 115 ILE HA 1.0 0.0 3.2 1108 1003 A 44 LEU HD2% B 131 GLY H 1.0 0.0 4.0 1109 1004 A 61 VAL HGy% B 118 ILE HD11 1.0 2.7 8.2 1110 1005 A 138 LEU HB3 B 37 ALA HB1 1.0 0.0 4.8 1111 1006 A 115 ILE H B 113 SER HBy 1.0 0.0 6.0 1112 1007 A 44 LEU HD1% B 127 THR HG21 1.0 0.0 4.7 1113 1008 A 37 ALA HB% B 95 LEU HD21 1.0 0.0 4.7 1114 1009 A 109 ILE HG2% B 118 ILE HD11 1.0 0.0 4.7 1115 1010 A 120 TYR HE% B 57 VAL HG21 1.0 0.0 5.5 1116 1011 B 44 LEU HD11 A 131 GLY HA3 1.0 0.0 5.5 1117 1011 B 44 LEU HD11 A 131 GLY HA2 1.0 0.0 5.5 1118 1012 A 103 VAL H B 103 VAL HG11 1.0 0.0 4.8 1119 1013 A 120 TYR HE% B 54 SER HBx 1.0 0.0 6.5 1120 1013 A 120 TYR HE% B 54 SER HBy 1.0 0.0 6.5 1121 1014 A 134 VAL HG1% B 37 ALA HB1 1.0 0.0 4.2 1122 1015 B 127 THR HG21 A 101 GLU HG2 1.0 0.0 5.5 1123 1015 A 101 GLU HG3 B 127 THR HG21 1.0 0.0 5.5 1124 1016 A 120 TYR HE% B 61 VAL HG21 1.0 0.0 6.5 1125 1017 A 114 SER H B 114 SER HBx 1.0 0.0 4.7 1126 1017 A 114 SER H B 114 SER HBy 1.0 0.0 4.7 1127 1018 B 109 ILE HD11 A 110 LEU HD2% 1.0 0.0 4.0 1128 1019 A 117 GLN H B 113 SER HA 1.0 0.0 5.0 1129 1020 B 120 TYR HD% A 58 SER HB2 1.0 0.0 5.5 1130 1020 A 58 SER HB3 B 120 TYR HD% 1.0 0.0 5.5 1131 1021 A 127 THR HG2% B 101 GLU HGx 1.0 0.0 5.5 1132 1021 A 127 THR HG2% B 101 GLU HGy 1.0 0.0 5.5 1133 1022 A 116 GLY HA2 B 114 SER H 1.0 0.0 5.0 1134 1023 A 114 SER H B 115 ILE HG21 1.0 0.0 5.8 1135 1024 B 127 THR HG21 A 50 SER HB2 1.0 0.0 5.5 1136 1024 A 50 SER HB3 B 127 THR HG21 1.0 0.0 5.5 1137 1025 A 124 ALA HB% B 53 VAL HG11 1.0 0.0 6.5 1138 1026 A 130 VAL HG2% B 103 VAL H 1.0 0.0 6.8 1139 1027 A 57 VAL HG1% B 118 ILE HD11 1.0 0.0 4.7 1140 1028 A 129 MET HE% B 107 VAL HG21 1.0 0.0 5.5 1141 1029 A 115 ILE HD1% B 65 PRO HGy 1.0 0.0 6.5 1142 1029 A 115 ILE HD1% B 65 PRO HGx 1.0 0.0 6.5 1143 1030 A 37 ALA HB% B 134 VAL HG11 1.0 0.0 4.2 1144 1031 A 115 ILE HB B 114 SER H 1.0 0.0 6.0 1145 1032 B 107 VAL HG21 A 126 TYR HBy 1.0 0.0 6.5 1146 1032 A 126 TYR HBx B 107 VAL HG21 1.0 0.0 6.5 1147 1033 A 106 LEU HD1% B 106 LEU HBy 1.0 0.0 5.5 1148 1034 A 118 ILE HG2% B 57 VAL HG11 1.0 0.0 4.2 1149 1035 A 126 TYR HE% B 108 SER HA 1.0 0.0 5.7 1150 1036 A 118 ILE H B 61 VAL HG21 1.0 0.0 5.8 1151 1037 B 107 VAL HG11 A 126 TYR HBy 1.0 0.0 5.5 1152 1037 A 126 TYR HBx B 107 VAL HG11 1.0 0.0 5.5 1153 1038 A 109 ILE HD1% B 110 LEU HD21 1.0 0.0 4.0 1154 1039 A 58 SER H B 120 TYR HE% 1.0 0.0 4.7 1155 1040 A 92 CYS HB2 B 36 VAL HG11 1.0 0.0 4.7 1156 1040 A 92 CYS HB2 B 36 VAL HG21 1.0 0.0 4.7 1157 1041 A 41 ALA HB% B 135 ALA H 1.0 0.0 3.9 1158 1042 A 103 VAL HG2% B 102 VAL H 1.0 0.0 4.8 1159 1043 A 139 ALA H B 34 ALA HB1 1.0 0.0 5.8 1160 1044 A 95 LEU HD2% B 36 VAL HG11 1.0 0.0 5.5 1161 1044 A 95 LEU HD2% B 36 VAL HG21 1.0 0.0 5.5 1162 1045 A 113 SER HB2 B 115 ILE H 1.0 0.0 5.0 1163 1046 B 115 ILE H A 65 PRO HB2 1.0 0.0 6.7 1164 1046 A 65 PRO HB3 B 115 ILE H 1.0 0.0 6.7 1165 1047 A 109 ILE HD1% B 110 LEU HD11 1.0 0.0 4.0 1166 1048 A 103 VAL HG2% B 103 VAL HG21 1.0 0.0 4.2 1167 1049 A 106 LEU HD1% B 103 VAL HA 1.0 0.0 4.0 1168 1050 A 41 ALA HB% B 134 VAL HG11 1.0 0.0 4.7 1169 1051 A 34 ALA HB% B 138 LEU H 1.0 0.0 5.8 1170 1052 A 115 ILE H B 113 SER HBx 1.0 0.0 5.0 1171 1053 A 53 VAL HG1% B 124 ALA HB1 1.0 0.0 6.5 1172 1054 A 114 SER H B 116 GLY H 1.0 0.0 4.0 1173 1055 A 34 ALA HB% B 138 LEU HD21 1.0 0.0 5.5 1174 1056 A 115 ILE H B 114 SER H 1.0 0.0 5.0 1175 1057 A 127 THR HG2% B 53 VAL HG21 1.0 0.0 4.2 1176 1058 A 103 VAL HG1% B 103 VAL H 1.0 0.0 4.8 1177 1059 B 124 ALA HB1 A 50 SER HB2 1.0 0.0 4.2 1178 1059 A 50 SER HB3 B 124 ALA HB1 1.0 0.0 4.2 1179 1060 A 103 VAL HG1% B 102 VAL H 1.0 0.0 5.8 1180 1061 A 115 ILE H B 65 PRO HBx 1.0 0.0 6.7 1181 1061 A 115 ILE H B 65 PRO HBy 1.0 0.0 6.7 1182 1062 A 118 ILE H B 61 VAL HG11 1.0 0.0 5.8 1183 1063 A 114 SER HA B 116 GLY H 1.0 0.0 6.0 1184 1064 B 115 ILE H A 114 SER HB3 1.0 0.0 5.8 1185 1064 B 115 ILE H A 114 SER HB2 1.0 0.0 5.8 1186 1065 A 126 TYR HE% B 111 GLY H 1.0 0.0 5.7 1187 1066 A 113 SER HA B 116 GLY H 1.0 0.0 3.2 1188 1067 B 110 LEU HD11 A 106 LEU HD2% 1.0 0.0 4.7 1189 1068 A 66 THR HB B 107 VAL HG11 1.0 0.0 5.5 1190 1069 A 57 VAL HG2% B 120 TYR HD% 1.0 0.0 6.5 1191 1070 A 41 ALA HB% B 134 VAL HG21 1.0 0.0 5.5 1192 1071 A 127 THR HG2% B 50 SER HA 1.0 0.0 5.8 1193 1072 A 115 ILE HD1% B 114 SER H 1.0 0.0 6.8 1194 1073 A 44 LEU HD2% B 131 GLY HAx 1.0 0.0 4.7 1195 1073 A 44 LEU HD2% B 131 GLY HAy 1.0 0.0 4.7 1196 1074 A 61 VAL HGy% B 120 TYR HE% 1.0 0.0 6.5 1197 1075 B 106 LEU HD21 A 110 LEU HD1% 1.0 0.0 4.7 1198 1076 B 103 VAL HG11 A 106 LEU HD1% 1.0 0.0 4.2 1199 1077 A 120 TYR HE% B 58 SER H 1.0 0.0 4.7 1200 1078 A 115 ILE HD1% B 65 PRO HDy 1.0 0.0 6.5 1201 1078 A 115 ILE HD1% B 65 PRO HDx 1.0 0.0 6.5 1202 1079 A 57 VAL HG1% B 118 ILE HG21 1.0 0.0 4.2 1203 1080 A 119 ASN H B 112 SER H 1.0 3.2 8.2 1204 1081 A 114 SER H B 116 GLY HAx 1.0 0.0 5.0 1205 1082 A 107 VAL HG1% B 66 THR HB 1.0 0.0 5.5 1206 1083 A 119 ASN H B 112 SER HBy 1.0 0.0 5.0 1207 1084 A 113 SER HB3 B 116 GLY H 1.0 0.0 4.0 1208 1085 B 57 VAL HG11 A 120 TYR HD% 1.0 0.0 4.7 1209 1086 B 41 ALA HB1 A 131 GLY HA3 1.0 0.0 6.5 1210 1086 B 41 ALA HB1 A 131 GLY HA2 1.0 0.0 6.5 1211 1087 B 44 LEU HD21 A 131 GLY HA3 1.0 0.0 4.7 1212 1087 A 131 GLY HA2 B 44 LEU HD21 1.0 0.0 4.7 1213 1088 A 127 THR HG2% B 50 SER HBx 1.0 0.0 5.5 1214 1088 A 127 THR HG2% B 50 SER HBy 1.0 0.0 5.5 1215 1089 A 130 VAL HG2% B 104 SER HBx 1.0 0.0 4.2 1216 1089 A 130 VAL HG2% B 104 SER HBy 1.0 0.0 4.2 1217 1090 B 115 ILE H A 65 PRO HGy 1.0 0.0 5.7 1218 1090 B 115 ILE H A 65 PRO HGx 1.0 0.0 5.7 1219 1091 B 107 VAL H A 106 LEU HD1% 1.0 0.0 4.8 1220 1092 A 115 ILE HG2% B 114 SER H 1.0 0.0 5.8 1221 1093 A 66 THR HG2% B 111 GLY H 1.0 0.0 4.0 1222 1094 A 106 LEU HD1% B 106 LEU HD11 1.0 0.0 4.2 1223 1095 A 41 ALA HB% B 131 GLY HAx 1.0 0.0 6.5 1224 1095 A 41 ALA HB% B 131 GLY HAy 1.0 0.0 6.5 1225 1096 A 116 GLY H B 114 SER H 1.0 0.0 4.0 1226 1097 B 118 ILE H A 112 SER HB2 1.0 0.0 5.0 1227 1098 A 92 CYS HA B 36 VAL HG11 1.0 0.0 5.5 1228 1098 A 92 CYS HA B 36 VAL HG21 1.0 0.0 5.5 1229 1099 A 103 VAL HG1% B 102 VAL HG11 1.0 0.0 4.2 1230 1100 A 118 ILE HG2% B 58 SER H 1.0 0.0 6.8 1231 1101 A 53 VAL HG2% B 127 THR HG21 1.0 0.0 4.2 1232 1102 A 57 VAL HG2% B 120 TYR HE% 1.0 0.0 5.5 1233 1103 B 37 ALA HB1 A 138 LEU HD2% 1.0 0.0 4.2 1234 1104 B 127 THR HG21 A 44 LEU HD2% 1.0 0.0 4.7 1235 1105 A 102 VAL HG1% B 103 VAL HG11 1.0 0.0 4.2 1236 1106 A 57 VAL HB B 120 TYR HD% 1.0 0.0 4.7 1237 1107 A 118 ILE HD1% B 61 VAL HG21 1.0 2.7 8.2 1238 1108 A 95 LEU HD2% B 36 VAL HB 1.0 0.0 4.8 1239 1109 A 138 LEU H B 34 ALA HB1 1.0 0.0 5.8 1240 1110 A 111 GLY HA2 B 66 THR HG21 1.0 0.0 5.5 1241 1111 A 111 GLY H B 66 THR HG21 1.0 0.0 4.0 1242 1112 A 109 ILE HG13 B 118 ILE HD11 1.0 0.0 5.8 1243 1113 A 120 TYR HD% B 58 SER HBx 1.0 0.0 5.5 1244 1113 A 120 TYR HD% B 58 SER HBy 1.0 0.0 5.5 1245 1114 A 124 ALA HB% B 50 SER HBx 1.0 0.0 4.2 1246 1114 A 124 ALA HB% B 50 SER HBy 1.0 0.0 4.2 1247 1115 A 38 SER H B 134 VAL HG11 1.0 0.0 4.8 1248 1116 A 138 LEU HD2% B 38 SER H 1.0 0.0 4.8 1249 1117 B 130 VAL HG21 A 104 SER HB3 1.0 0.0 4.2 1250 1117 A 104 SER HB2 B 130 VAL HG21 1.0 0.0 4.2 1251 1118 A 34 ALA HB% B 138 LEU HD11 1.0 0.0 6.5 1252 1119 A 111 GLY H B 126 TYR HE% 1.0 0.0 5.7 1253 1120 B 119 ASN H A 112 SER HB2 1.0 0.0 4.0 1254 1121 A 107 VAL H B 130 VAL HG21 1.0 0.0 4.8 1255 1122 A 107 VAL HG1% B 126 TYR HD% 1.0 0.0 4.7 1256 1123 A 114 SER H B 115 ILE HG1y 1.0 0.0 5.0 1257 1124 A 135 ALA H B 41 ALA HB1 1.0 0.0 3.9 1258 1125 A 115 ILE H B 114 SER HBx 1.0 0.0 5.8 1259 1125 A 115 ILE H B 114 SER HBy 1.0 0.0 5.8 1260 1126 A 61 VAL HGy% B 118 ILE H 1.0 0.0 5.8 1261 1127 A 61 VAL HGx% B 118 ILE H 1.0 0.0 5.8 1262 1128 A 110 LEU HD2% B 65 PRO HBx 1.0 0.0 4.7 1263 1128 A 110 LEU HD2% B 65 PRO HBy 1.0 0.0 4.7 1264 1129 A 118 ILE HD1% B 112 SER HBy 1.0 0.0 4.7 1265 1129 A 118 ILE HD1% B 112 SER HBx 1.0 0.0 4.7 1266 1130 A 118 ILE H B 112 SER HBx 1.0 0.0 5.0 1267 1131 A 37 ALA HB% B 138 LEU HBx 1.0 0.0 5.8 1268 1132 A 109 ILE HB B 110 LEU HD21 1.0 0.0 4.8 1269 1133 B 57 VAL HG21 A 120 TYR HD% 1.0 0.0 6.5 1270 1134 A 107 VAL H B 106 LEU HD11 1.0 0.0 4.8 1271 1135 A 107 VAL HG2% B 129 MET HE1 1.0 0.0 5.5 1272 1136 A 36 VAL HB B 95 LEU HD21 1.0 0.0 4.8 1273 1137 B 95 LEU HD21 A 36 VAL HGx% 1.0 0.0 5.5 1274 1137 B 95 LEU HD21 A 36 VAL HGy% 1.0 0.0 5.5 1275 1138 A 127 THR HG2% B 104 SER HA 1.0 0.0 5.8 1276 1139 A 127 THR HG2% B 44 LEU HD11 1.0 0.0 4.7 1277 1140 B 120 TYR HE% A 54 SER HB2 1.0 0.0 6.5 1278 1140 A 54 SER HB3 B 120 TYR HE% 1.0 0.0 6.5 1279 1141 A 58 SER HA B 120 TYR HE% 1.0 0.0 5.5 1280 1142 A 116 GLY H B 113 SER HBx 1.0 0.0 3.2 1281 1143 A 115 ILE HG2% B 109 ILE HG21 1.0 0.0 5.5 1282 1144 A 106 LEU HB3 B 106 LEU HD11 1.0 0.0 5.5 1283 1145 A 127 THR HG2% B 44 LEU HD21 1.0 0.0 4.7 1284 1146 B 119 ASN H A 112 SER HB3 1.0 0.0 5.0 1285 1147 A 103 VAL H B 130 VAL HG21 1.0 0.0 6.8 1286 1148 A 118 ILE HD1% B 109 ILE HA 1.0 0.0 4.8 1287 1149 B 109 ILE HD11 A 110 LEU HD1% 1.0 0.0 4.0 1288 1150 A 120 TYR HE% B 58 SER HA 1.0 0.0 5.5 1289 1151 A 115 ILE H B 65 PRO HGx 1.0 0.0 5.7 1290 1151 A 115 ILE H B 65 PRO HGy 1.0 0.0 5.7 1291 1152 A 134 VAL HG2% B 37 ALA HB1 1.0 0.0 4.7 1292 1153 B 114 SER H A 114 SER HB3 1.0 0.0 4.7 1293 1153 B 114 SER H A 114 SER HB2 1.0 0.0 4.7 1294 1154 A 95 LEU HD2% B 37 ALA HB1 1.0 0.0 4.7 1295 1155 A 103 VAL HA B 106 LEU HD11 1.0 0.0 4.0 1296 1156 A 116 GLY H B 114 SER HA 1.0 0.0 6.0 1297 1157 A 38 SER H B 138 LEU HD21 1.0 0.0 4.8 1298 1158 A 118 ILE HD1% B 57 VAL HG11 1.0 0.0 4.7 1299 1159 A 66 THR HA B 107 VAL HG11 1.0 0.0 4.7 1300 1160 A 107 VAL HG1% B 126 TYR HBx 1.0 0.0 5.5 1301 1160 A 107 VAL HG1% B 126 TYR HBy 1.0 0.0 5.5 1302 1161 A 107 VAL HG1% B 129 MET HE1 1.0 0.0 4.7 1303 1162 A 107 VAL HG2% B 126 TYR HD% 1.0 0.0 6.5 1304 1163 B 34 ALA HB1 A 138 LEU HD2% 1.0 0.0 5.5 1305 1164 A 34 ALA HB% B 138 LEU HBy 1.0 0.0 5.5 1306 1165 A 102 VAL H B 103 VAL HG21 1.0 0.0 4.8 1307 1166 A 120 TYR HE% B 58 SER HBx 1.0 0.0 4.7 1308 1166 A 120 TYR HE% B 58 SER HBy 1.0 0.0 4.7 1309 1167 A 41 ALA HB% B 135 ALA HB1 1.0 0.0 4.7 1310 1168 B 118 ILE HD11 A 112 SER HB3 1.0 0.0 4.7 1311 1168 B 118 ILE HD11 A 112 SER HB2 1.0 0.0 4.7 1312 1169 A 118 ILE HD1% B 109 ILE HG1y 1.0 0.0 5.8 1313 1170 A 131 GLY H B 44 LEU HD21 1.0 0.0 4.0 1314 1171 A 131 GLY H B 44 LEU HD11 1.0 0.0 5.0 1315 1172 A 114 SER H B 115 ILE H 1.0 0.0 5.0 1316 1173 B 120 TYR HE% A 58 SER HB2 1.0 0.0 4.7 1317 1173 A 58 SER HB3 B 120 TYR HE% 1.0 0.0 4.7 1318 1174 A 118 ILE HG2% B 61 VAL HG21 1.0 2.7 8.2 1319 1175 B 109 ILE HG21 A 110 LEU HD2% 1.0 0.0 4.7 1320 1176 A 113 SER HA B 117 GLN H 1.0 0.0 5.0 1321 1177 A 112 SER H B 119 ASN H 1.0 3.2 8.2 1322 1178 A 138 LEU HD1% B 37 ALA HB1 1.0 0.0 5.5 1323 1179 A 107 VAL HG1% B 66 THR HA 1.0 0.0 4.7 1324 1180 B 92 CYS HBx A 36 VAL HGx% 1.0 0.0 4.7 1325 1180 A 36 VAL HGy% B 92 CYS HBx 1.0 0.0 4.7 1326 1181 A 126 TYR HD% B 107 VAL HG11 1.0 0.0 4.7 1327 1182 A 126 TYR HD% B 107 VAL HG21 1.0 0.0 6.5 1328 1183 A 109 ILE HA B 118 ILE HD11 1.0 0.0 4.8 1329 1184 A 120 TYR HE% B 61 VAL HG11 1.0 0.0 6.5 1330 1185 A 115 ILE HG13 B 114 SER H 1.0 0.0 5.0 1331 1186 A 104 SER HA B 127 THR HG21 1.0 0.0 5.8 1332 1187 A 108 SER HA B 126 TYR HE% 1.0 0.0 5.7 1333 1188 A 107 VAL HG2% B 126 TYR HBx 1.0 0.0 6.5 1334 1188 A 107 VAL HG2% B 126 TYR HBy 1.0 0.0 6.5 1335 1189 A 37 ALA HB% B 134 VAL HG21 1.0 0.0 4.7 1336 1190 A 102 VAL H B 103 VAL HG11 1.0 0.0 5.8 1337 1191 A 110 LEU HD2% B 109 ILE HB 1.0 0.0 4.8 1338 1192 A 114 SER H B 115 ILE HD11 1.0 0.0 6.8 1339 1193 A 135 ALA HB% B 41 ALA HB1 1.0 0.0 4.7 1340 1194 A 37 ALA H B 95 LEU HD21 1.0 0.0 4.8 1341 1195 A 58 SER H B 118 ILE HG21 1.0 0.0 6.8 1342 1196 A 109 ILE HG2% B 115 ILE HG21 1.0 0.0 5.5 1343 1197 A 66 THR HG2% B 111 GLY HAx 1.0 0.0 5.5 1344 1198 A 134 VAL HG2% B 41 ALA HB1 1.0 0.0 5.5 1345 1199 A 113 SER HB3 B 115 ILE H 1.0 0.0 6.0 1346 1200 A 138 LEU HB2 B 37 ALA HB1 1.0 0.0 5.8 1347 1201 A 61 VAL HGy% B 118 ILE HG21 1.0 2.7 8.2 1348 1202 A 119 ASN H B 112 SER HBx 1.0 0.0 4.0 1349 1203 A 113 SER HB2 B 116 GLY H 1.0 0.0 3.2 1350 1204 A 103 VAL H B 103 VAL HG21 1.0 0.0 4.8 1351 1205 B 115 ILE HD11 A 65 PRO HGy 1.0 0.0 6.5 1352 1205 A 65 PRO HGx B 115 ILE HD11 1.0 0.0 6.5 1353 1206 A 114 SER H B 115 ILE HB 1.0 0.0 6.0 1354 1207 B 92 CYS HA A 36 VAL HGx% 1.0 0.0 5.5 1355 1207 A 36 VAL HGy% B 92 CYS HA 1.0 0.0 5.5 1356 1208 A 103 VAL HG1% B 106 LEU HD11 1.0 0.0 4.2 1357 1209 A 61 VAL HGx% B 120 TYR HE% 1.0 0.0 6.5 1358 1210 A 96 VAL HG2% B 96 VAL HG21 1.0 0.0 4.2 1359 1211 B 110 LEU HD21 A 65 PRO HB2 1.0 0.0 4.7 1360 1211 A 65 PRO HB3 B 110 LEU HD21 1.0 0.0 4.7 1361 1212 A 95 LEU HD2% B 96 VAL HA 1.0 0.0 4.8 1362 1213 A 126 TYR HD% B 108 SER HA 1.0 0.0 4.7 1363 1214 A 129 MET HE% B 107 VAL HG11 1.0 0.0 4.7 1364 1215 A 138 LEU HD1% B 34 ALA HB1 1.0 0.0 6.5 1365 1216 A 115 ILE HA B 114 SER H 1.0 0.0 3.2 1366 1217 A 37 ALA HB% B 138 LEU HD11 1.0 0.0 5.5 1367 1218 A 57 VAL HB B 120 TYR HE% 1.0 0.0 3.9 1368 1219 A 95 LEU HD2% B 37 ALA H 1.0 0.0 4.8 1369 1220 B 115 ILE HD11 A 65 PRO HD3 1.0 0.0 6.5 1370 1220 B 115 ILE HD11 A 65 PRO HD2 1.0 0.0 6.5 1371 1221 A 96 VAL HA B 95 LEU HD21 1.0 0.0 4.8 1372 1222 A 44 LEU HD1% B 131 GLY HAx 1.0 0.0 5.5 1373 1222 A 44 LEU HD1% B 131 GLY HAy 1.0 0.0 5.5 1374 1223 A 44 LEU HD1% B 131 GLY H 1.0 0.0 5.0 1375 1224 B 57 VAL HB A 120 TYR HD% 1.0 0.0 4.7 1376 1225 A 116 GLY H B 113 SER HA 1.0 0.0 3.2 1377 1226 A 134 VAL HG1% B 38 SER H 1.0 0.0 4.8 stop_ save_