data_nef_c15637_2k05 save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code BMRB 15633 BMRB 15635 BMRB 15636 stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 11 CYS SG 1 36 CYS SG 1 13 CYS SG 1 52 CYS SG 1 38 CYS SG 2 67 CYS SG 1 67 CYS SG 2 38 CYS SG 2 11 CYS SG 2 36 CYS SG 2 13 CYS SG 2 52 CYS SG 3 8 ILE C 3 9 TYS N 3 9 TYS C 3 10 THR N 3 13 ASN C 3 14 TYS N 3 14 TYS C 3 15 THR N 3 22 ASP C 3 23 TYS N 3 23 TYS C 3 24 ASP N 4 8 ILE C 4 9 TYS N 4 9 TYS C 4 10 THR N 4 13 ASN C 4 14 TYS N 4 14 TYS C 4 15 THR N 4 22 ASP C 4 23 TYS N 4 23 TYS C 4 24 ASP N 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 GLY start . false 2 A 0 MET middle . . 3 A 1 LYS middle . . 4 A 2 PRO middle . false 5 A 3 VAL middle . . 6 A 4 SER middle . . 7 A 5 LEU middle . . 8 A 6 SER middle . . 9 A 7 TYR middle . . 10 A 8 ARG middle . . 11 A 9 CYS middle -HG . 12 A 10 PRO middle . false 13 A 11 CYS middle -HG . 14 A 12 ARG middle . . 15 A 13 PHE middle . . 16 A 14 PHE middle . . 17 A 15 GLU middle . . 18 A 16 SER middle . . 19 A 17 HIS middle . . 20 A 18 VAL middle . . 21 A 19 ALA middle . . 22 A 20 ARG middle . . 23 A 21 ALA middle . . 24 A 22 ASN middle . . 25 A 23 VAL middle . . 26 A 24 LYS middle . . 27 A 25 HIS middle . . 28 A 26 LEU middle . . 29 A 27 LYS middle . . 30 A 28 ILE middle . . 31 A 29 LEU middle . . 32 A 30 ASN middle . . 33 A 31 THR middle . . 34 A 32 PRO middle . false 35 A 33 ASN middle . . 36 A 34 CYS middle -HG . 37 A 35 ALA middle . . 38 A 36 CYS middle -HG . 39 A 37 GLN middle . . 40 A 38 ILE middle . . 41 A 39 VAL middle . . 42 A 40 ALA middle . . 43 A 41 ARG middle . . 44 A 42 LEU middle . . 45 A 43 LYS middle . . 46 A 44 ASN middle . . 47 A 45 ASN middle . . 48 A 46 ASN middle . . 49 A 47 ARG middle . . 50 A 48 GLN middle . . 51 A 49 VAL middle . . 52 A 50 CYS middle -HG . 53 A 51 ILE middle . . 54 A 52 ASP middle . . 55 A 53 PRO middle . false 56 A 54 LYS middle . . 57 A 55 LEU middle . . 58 A 56 LYS middle . . 59 A 57 TRP middle . . 60 A 58 ILE middle . . 61 A 59 GLN middle . . 62 A 60 GLU middle . . 63 A 61 TYR middle . . 64 A 62 LEU middle . . 65 A 63 GLU middle . . 66 A 64 LYS middle . . 67 A 65 CYS middle -HG . 68 A 66 LEU middle . . 69 A 67 ASN middle . . 70 A 68 LYS end . . 71 C 199 GLY start . false 72 C 200 MET middle . . 73 C 201 LYS middle . . 74 C 202 PRO middle . false 75 C 203 VAL middle . . 76 C 204 SER middle . . 77 C 205 LEU middle . . 78 C 206 SER middle . . 79 C 207 TYR middle . . 80 C 208 ARG middle . . 81 C 209 CYS middle -HG . 82 C 210 PRO middle . false 83 C 211 CYS middle -HG . 84 C 212 ARG middle . . 85 C 213 PHE middle . . 86 C 214 PHE middle . . 87 C 215 GLU middle . . 88 C 216 SER middle . . 89 C 217 HIS middle . . 90 C 218 VAL middle . . 91 C 219 ALA middle . . 92 C 220 ARG middle . . 93 C 221 ALA middle . . 94 C 222 ASN middle . . 95 C 223 VAL middle . . 96 C 224 LYS middle . . 97 C 225 HIS middle . . 98 C 226 LEU middle . . 99 C 227 LYS middle . . 100 C 228 ILE middle . . 101 C 229 LEU middle . . 102 C 230 ASN middle . . 103 C 231 THR middle . . 104 C 232 PRO middle . false 105 C 233 ASN middle . . 106 C 234 CYS middle -HG . 107 C 235 ALA middle . . 108 C 236 CYS middle -HG . 109 C 237 GLN middle . . 110 C 238 ILE middle . . 111 C 239 VAL middle . . 112 C 240 ALA middle . . 113 C 241 ARG middle . . 114 C 242 LEU middle . . 115 C 243 LYS middle . . 116 C 244 ASN middle . . 117 C 245 ASN middle . . 118 C 246 ASN middle . . 119 C 247 ARG middle . . 120 C 248 GLN middle . . 121 C 249 VAL middle . . 122 C 250 CYS middle -HG . 123 C 251 ILE middle . . 124 C 252 ASP middle . . 125 C 253 PRO middle . false 126 C 254 LYS middle . . 127 C 255 LEU middle . . 128 C 256 LYS middle . . 129 C 257 TRP middle . . 130 C 258 ILE middle . . 131 C 259 GLN middle . . 132 C 260 GLU middle . . 133 C 261 TYR middle . . 134 C 262 LEU middle . . 135 C 263 GLU middle . . 136 C 264 LYS middle . . 137 C 265 CYS middle -HG . 138 C 266 LEU middle . . 139 C 267 ASN middle . . 140 C 268 LYS end . . 141 B 99 GLY start . false 142 B 100 SER middle . . 143 B 101 MET middle . . 144 B 102 GLU middle . . 145 B 103 GLY middle . false 146 B 104 ILE middle . . 147 B 105 SER middle . . 148 B 106 ILE middle -OXT . 149 B 107 TYS middle -HN2,-OXT . 150 B 108 THR middle -H2 . 151 B 109 SER middle . . 152 B 110 ASP middle . . 153 B 111 ASN middle -OXT . 154 B 112 TYS middle -HN2,-OXT . 155 B 113 THR middle -H2 . 156 B 114 GLU middle . . 157 B 115 GLU middle . . 158 B 116 MET middle . . 159 B 117 GLY middle . false 160 B 118 SER middle . . 161 B 119 GLY middle . false 162 B 120 ASP middle -OXT . 163 B 121 TYS middle -HN2,-OXT . 164 B 122 ASP middle -H2 . 165 B 123 SER middle . . 166 B 124 MET middle . . 167 B 125 LYS middle . . 168 B 126 GLU middle . . 169 B 127 PRO middle . false 170 B 128 ALA middle . . 171 B 129 PHE middle . . 172 B 130 ARG middle . . 173 B 131 GLU middle . . 174 B 132 GLU middle . . 175 B 133 ASN middle . . 176 B 134 ALA middle . . 177 B 135 ASN middle . . 178 B 136 PHE middle . . 179 B 137 ASN middle . . 180 B 138 LYS end . . 181 D 299 GLY start . false 182 D 300 SER middle . . 183 D 301 MET middle . . 184 D 302 GLU middle . . 185 D 303 GLY middle . false 186 D 304 ILE middle . . 187 D 305 SER middle . . 188 D 306 ILE middle -OXT . 189 D 307 TYS middle -HN2,-OXT . 190 D 308 THR middle -H2 . 191 D 309 SER middle . . 192 D 310 ASP middle . . 193 D 311 ASN middle -OXT . 194 D 312 TYS middle -HN2,-OXT . 195 D 313 THR middle -H2 . 196 D 314 GLU middle . . 197 D 315 GLU middle . . 198 D 316 MET middle . . 199 D 317 GLY middle . false 200 D 318 SER middle . . 201 D 319 GLY middle . false 202 D 320 ASP middle -OXT . 203 D 321 TYS middle -HN2,-OXT . 204 D 322 ASP middle -H2 . 205 D 323 SER middle . . 206 D 324 MET middle . . 207 D 325 LYS middle . . 208 D 326 GLU middle . . 209 D 327 PRO middle . false 210 D 328 ALA middle . . 211 D 329 PHE middle . . 212 D 330 ARG middle . . 213 D 331 GLU middle . . 214 D 332 GLU middle . . 215 D 333 ASN middle . . 216 D 334 ALA middle . . 217 D 335 ASN middle . . 218 D 336 PHE middle . . 219 D 337 ASN middle . . 220 D 338 LYS end . . 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 1 LYS H H 1 8.402 0.020 A 1 LYS HGy H 1 1.376 0.020 A 1 LYS CA C 13 58.046 0.1 A 1 LYS CB C 13 34.102 0.1 A 1 LYS CD C 13 29.896 0.1 A 1 LYS CE C 13 42.838 0.1 A 1 LYS CG C 13 25.042 0.1 A 1 LYS N N 15 124.577 0.1 A 2 PRO HA H 1 4.510 0.004 A 2 PRO HBy H 1 2.309 0.020 A 2 PRO HBx H 1 1.916 0.020 A 2 PRO HDy H 1 3.885 0.020 A 2 PRO HDx H 1 3.659 0.020 A 2 PRO HGx H 1 2.045 0.020 A 2 PRO HGy H 1 2.045 0.020 A 2 PRO C C 13 177.132 0.1 A 2 PRO CA C 13 63.529 0.1 A 2 PRO CB C 13 32.476 0.1 A 2 PRO CD C 13 51.064 0.1 A 2 PRO CG C 13 27.775 0.1 A 3 VAL H H 1 8.201 0.020 A 3 VAL HA H 1 4.140 0.020 A 3 VAL HB H 1 2.108 0.020 A 3 VAL HGx% H 1 0.988 0.020 A 3 VAL HGy% H 1 0.988 0.020 A 3 VAL C C 13 176.423 0.1 A 3 VAL CA C 13 62.873 0.1 A 3 VAL CB C 13 33.455 0.1 A 3 VAL CG1 C 13 21.324 0.1 A 3 VAL N N 15 120.488 0.1 A 4 SER H H 1 8.276 0.020 A 4 SER HA H 1 4.487 0.020 A 4 SER HBx H 1 3.857 0.020 A 4 SER HBy H 1 3.857 0.020 A 4 SER C C 13 174.687 0.1 A 4 SER CA C 13 58.375 0.1 A 4 SER CB C 13 64.295 0.1 A 4 SER N N 15 119.000 0.1 A 5 LEU H H 1 8.238 0.020 A 5 LEU HA H 1 4.397 0.020 A 5 LEU HBx H 1 1.605 0.020 A 5 LEU HBy H 1 1.605 0.020 A 5 LEU HDx% H 1 0.926 0.020 A 5 LEU C C 13 177.406 0.1 A 5 LEU CA C 13 55.766 0.1 A 5 LEU CB C 13 43.132 0.1 A 5 LEU CD1 C 13 25.588 0.1 A 5 LEU N N 15 124.704 0.1 A 6 SER H H 1 8.148 0.020 A 6 SER HA H 1 4.438 0.020 A 6 SER HBx H 1 3.816 0.020 A 6 SER HBy H 1 3.816 0.020 A 6 SER C C 13 174.321 0.1 A 6 SER CA C 13 58.718 0.1 A 6 SER CB C 13 64.295 0.1 A 6 SER N N 15 115.960 0.1 A 7 TYR H H 1 7.915 0.020 A 7 TYR HA H 1 4.585 0.020 A 7 TYR HBy H 1 3.085 0.020 A 7 TYR HBx H 1 2.945 0.020 A 7 TYR HD1 H 1 7.112 0.020 A 7 TYR HD2 H 1 7.112 0.020 A 7 TYR HE1 H 1 6.835 0.020 A 7 TYR HE2 H 1 6.835 0.020 A 7 TYR C C 13 175.532 0.1 A 7 TYR CA C 13 58.335 0.1 A 7 TYR CB C 13 39.474 0.1 A 7 TYR CD1 C 13 133.600 0.1 A 7 TYR CE1 C 13 118.588 0.1 A 7 TYR N N 15 121.884 0.1 A 8 ARG H H 1 8.117 0.020 A 8 ARG HA H 1 4.337 0.020 A 8 ARG HBy H 1 1.837 0.020 A 8 ARG HBx H 1 1.737 0.002 A 8 ARG HDx H 1 3.167 0.020 A 8 ARG HDy H 1 3.167 0.020 A 8 ARG HGx H 1 1.539 0.020 A 8 ARG HGy H 1 1.539 0.020 A 8 ARG C C 13 175.898 0.1 A 8 ARG CA C 13 56.048 0.1 A 8 ARG CB C 13 31.492 0.1 A 8 ARG CD C 13 43.957 0.1 A 8 ARG CG C 13 27.307 0.1 A 8 ARG N N 15 121.977 0.1 A 9 CYS H H 1 8.127 0.020 A 9 CYS HA H 1 4.984 0.020 A 9 CYS HBy H 1 3.164 0.020 A 9 CYS HBx H 1 2.737 0.020 A 9 CYS C C 13 177.771 0.1 A 9 CYS CA C 13 53.192 0.1 A 9 CYS CB C 13 40.897 0.1 A 9 CYS N N 15 121.209 0.1 A 10 PRO HA H 1 4.321 0.020 A 10 PRO HBy H 1 2.318 0.020 A 10 PRO HBx H 1 1.883 0.020 A 10 PRO HDx H 1 3.865 0.020 A 10 PRO HDy H 1 3.865 0.020 A 10 PRO HGx H 1 2.031 0.020 A 10 PRO HGy H 1 2.031 0.020 A 10 PRO CA C 13 65.478 0.1 A 10 PRO CB C 13 32.904 0.1 A 10 PRO CD C 13 51.251 0.1 A 10 PRO CG C 13 27.900 0.1 A 11 CYS H H 1 8.633 0.001 A 11 CYS C C 13 174.618 0.1 A 11 CYS N N 15 114.595 0.1 A 12 ARG H H 1 8.236 0.020 A 12 ARG HA H 1 4.067 0.020 A 12 ARG HBx H 1 1.572 0.020 A 12 ARG HBy H 1 1.572 0.020 A 12 ARG HDx H 1 3.062 0.020 A 12 ARG HDy H 1 3.062 0.020 A 12 ARG HGy H 1 1.331 0.020 A 12 ARG HGx H 1 1.295 0.020 A 12 ARG C C 13 175.098 0.1 A 12 ARG CA C 13 57.370 0.1 A 12 ARG CB C 13 31.631 0.1 A 12 ARG CD C 13 43.865 0.1 A 12 ARG CG C 13 27.227 0.1 A 12 ARG N N 15 122.779 0.1 A 13 PHE H H 1 7.571 0.020 A 13 PHE HA H 1 4.510 0.020 A 13 PHE HBy H 1 3.084 0.020 A 13 PHE HBx H 1 2.807 0.020 A 13 PHE HD1 H 1 7.224 0.005 A 13 PHE HD2 H 1 7.224 0.005 A 13 PHE HE1 H 1 7.326 0.020 A 13 PHE HE2 H 1 7.326 0.020 A 13 PHE C C 13 174.162 0.1 A 13 PHE CA C 13 56.289 0.1 A 13 PHE CB C 13 41.320 0.1 A 13 PHE CD1 C 13 132.565 0.1 A 13 PHE CE1 C 13 132.047 0.1 A 13 PHE N N 15 116.797 0.1 A 14 PHE H H 1 8.084 0.020 A 14 PHE HA H 1 4.767 0.020 A 14 PHE HBy H 1 2.898 0.020 A 14 PHE HBx H 1 2.775 0.020 A 14 PHE HD1 H 1 7.022 0.020 A 14 PHE HD2 H 1 7.022 0.020 A 14 PHE HE1 H 1 7.324 0.020 A 14 PHE HE2 H 1 7.324 0.020 A 14 PHE C C 13 175.441 0.1 A 14 PHE CA C 13 55.767 0.1 A 14 PHE CB C 13 41.320 0.1 A 14 PHE CD1 C 13 132.047 0.1 A 14 PHE CE1 C 13 131.789 0.1 A 14 PHE N N 15 118.930 0.1 A 15 GLU H H 1 8.815 0.020 A 15 GLU HA H 1 4.579 0.020 A 15 GLU HBx H 1 2.000 0.020 A 15 GLU HBy H 1 2.155 0.020 A 15 GLU HGy H 1 2.392 0.020 A 15 GLU HGx H 1 2.320 0.020 A 15 GLU C C 13 176.857 0.1 A 15 GLU CA C 13 56.289 0.1 A 15 GLU CB C 13 31.173 0.1 A 15 GLU CG C 13 36.818 0.1 A 15 GLU N N 15 122.929 0.1 A 16 SER H H 1 8.751 0.005 A 16 SER HA H 1 4.762 0.006 A 16 SER HBy H 1 3.911 0.020 A 16 SER HBx H 1 3.782 0.020 A 16 SER C C 13 177.497 0.1 A 16 SER CA C 13 59.328 0.1 A 16 SER CB C 13 64.515 0.1 A 16 SER N N 15 118.860 0.1 A 17 HIS H H 1 8.761 0.020 A 17 HIS HA H 1 4.832 0.020 A 17 HIS HBx H 1 3.203 0.020 A 17 HIS HBy H 1 3.203 0.020 A 17 HIS HD2 H 1 7.090 0.002 A 17 HIS HE1 H 1 7.836 0.020 A 17 HIS C C 13 174.618 0.1 A 17 HIS CA C 13 56.449 0.1 A 17 HIS CB C 13 30.214 0.1 A 17 HIS CD2 C 13 120.400 0.1 A 17 HIS CE1 C 13 138.518 0.1 A 17 HIS N N 15 120.535 0.1 A 18 VAL H H 1 7.085 0.020 A 18 VAL HA H 1 4.160 0.020 A 18 VAL HB H 1 1.936 0.020 A 18 VAL HGx% H 1 0.899 0.020 A 18 VAL HGy% H 1 0.899 0.020 A 18 VAL C C 13 174.436 0.1 A 18 VAL CA C 13 62.167 0.1 A 18 VAL CB C 13 34.426 0.1 A 18 VAL CG1 C 13 22.445 0.1 A 18 VAL N N 15 120.872 0.1 A 19 ALA H H 1 8.521 0.001 A 19 ALA HA H 1 4.367 0.020 A 19 ALA HB% H 1 1.358 0.020 A 19 ALA C C 13 177.657 0.1 A 19 ALA CA C 13 51.193 0.1 A 19 ALA CB C 13 19.790 0.1 A 19 ALA N N 15 131.339 0.1 A 20 ARG H H 1 7.790 0.001 A 20 ARG HA H 1 2.451 0.020 A 20 ARG HBy H 1 1.043 0.020 A 20 ARG HBx H 1 0.410 0.020 A 20 ARG HDx H 1 2.897 0.002 A 20 ARG HDy H 1 2.897 0.002 A 20 ARG HGy H 1 1.162 0.020 A 20 ARG HGx H 1 0.828 0.020 A 20 ARG C C 13 178.365 0.1 A 20 ARG CA C 13 59.379 0.1 A 20 ARG CB C 13 29.572 0.1 A 20 ARG CD C 13 44.132 0.1 A 20 ARG CG C 13 26.984 0.1 A 20 ARG N N 15 124.365 0.1 A 21 ALA H H 1 8.120 0.020 A 21 ALA HA H 1 4.060 0.020 A 21 ALA HB% H 1 1.293 0.020 A 21 ALA C C 13 178.000 0.1 A 21 ALA CA C 13 54.100 0.1 A 21 ALA CB C 13 18.713 0.1 A 21 ALA N N 15 117.156 0.1 A 22 ASN H H 1 7.707 0.008 A 22 ASN HA H 1 5.010 0.003 A 22 ASN HBy H 1 3.087 0.020 A 22 ASN HBx H 1 2.663 0.020 A 22 ASN HD2y H 1 7.590 0.020 A 22 ASN HD2x H 1 7.089 0.020 A 22 ASN C C 13 174.938 0.1 A 22 ASN CA C 13 52.869 0.1 A 22 ASN CB C 13 40.573 0.1 A 22 ASN N N 15 112.819 0.1 A 22 ASN ND2 N 15 111.993 0.019 A 23 VAL H H 1 7.489 0.020 A 23 VAL HA H 1 4.888 0.020 A 23 VAL HB H 1 1.743 0.020 A 23 VAL HGx% H 1 0.899 0.020 A 23 VAL HGy% H 1 0.744 0.020 A 23 VAL C C 13 175.829 0.1 A 23 VAL CA C 13 59.870 0.1 A 23 VAL CB C 13 35.396 0.1 A 23 VAL CG1 C 13 22.432 0.1 A 23 VAL CG2 C 13 21.807 0.1 A 23 VAL N N 15 119.721 0.1 A 24 LYS H H 1 9.480 0.008 A 24 LYS HA H 1 4.353 0.004 A 24 LYS HBy H 1 1.690 0.020 A 24 LYS HBx H 1 1.307 0.020 A 24 LYS HDx H 1 1.659 0.020 A 24 LYS HDy H 1 1.659 0.020 A 24 LYS HEx H 1 3.031 0.020 A 24 LYS HEy H 1 3.031 0.020 A 24 LYS HGy H 1 1.398 0.020 A 24 LYS HGx H 1 1.343 0.020 A 24 LYS C C 13 176.606 0.1 A 24 LYS CA C 13 58.977 0.1 A 24 LYS CB C 13 34.567 0.1 A 24 LYS CD C 13 30.359 0.1 A 24 LYS CE C 13 42.191 0.1 A 24 LYS CG C 13 25.759 0.1 A 24 LYS N N 15 127.843 0.1 A 25 HIS H H 1 7.237 0.003 A 25 HIS HA H 1 4.979 0.020 A 25 HIS HBy H 1 3.633 0.020 A 25 HIS HBx H 1 3.093 0.020 A 25 HIS HD2 H 1 6.608 0.020 A 25 HIS HE1 H 1 7.804 0.020 A 25 HIS C C 13 178.434 0.1 A 25 HIS CA C 13 55.406 0.1 A 25 HIS CB C 13 32.480 0.1 A 25 HIS CD2 C 13 123.763 0.1 A 25 HIS CE1 C 13 138.518 0.1 A 25 HIS N N 15 109.556 0.1 A 26 LEU H H 1 8.189 0.002 A 26 LEU HA H 1 5.190 0.020 A 26 LEU HBy H 1 1.708 0.020 A 26 LEU HBx H 1 1.259 0.020 A 26 LEU HDx% H 1 0.565 0.020 A 26 LEU HDy% H 1 0.785 0.020 A 26 LEU HG H 1 1.491 0.020 A 26 LEU C C 13 175.510 0.1 A 26 LEU CA C 13 53.480 0.1 A 26 LEU CB C 13 45.235 0.1 A 26 LEU CD1 C 13 26.013 0.1 A 26 LEU CD2 C 13 24.187 0.1 A 26 LEU CG C 13 26.653 0.1 A 26 LEU N N 15 117.260 0.1 A 27 LYS H H 1 9.572 0.005 A 27 LYS HA H 1 5.372 0.020 A 27 LYS HBx H 1 1.553 0.020 A 27 LYS HBy H 1 1.553 0.020 A 27 LYS HDy H 1 1.032 0.020 A 27 LYS HDx H 1 0.991 0.020 A 27 LYS HEy H 1 2.555 0.020 A 27 LYS HEx H 1 2.421 0.020 A 27 LYS HGx H 1 1.010 0.020 A 27 LYS HGy H 1 1.255 0.020 A 27 LYS C C 13 174.801 0.1 A 27 LYS CA C 13 55.165 0.1 A 27 LYS CB C 13 35.253 0.1 A 27 LYS CD C 13 29.925 0.1 A 27 LYS CE C 13 41.867 0.1 A 27 LYS CG C 13 25.559 0.1 A 27 LYS N N 15 123.488 0.1 A 28 ILE H H 1 9.136 0.005 A 28 ILE HA H 1 4.924 0.003 A 28 ILE HB H 1 1.847 0.020 A 28 ILE HD1% H 1 0.784 0.020 A 28 ILE HG1x H 1 1.509 0.020 A 28 ILE HG1y H 1 1.509 0.020 A 28 ILE HG2% H 1 0.948 0.020 A 28 ILE C C 13 176.949 0.1 A 28 ILE CA C 13 60.542 0.1 A 28 ILE CB C 13 39.600 0.1 A 28 ILE CD1 C 13 14.041 0.1 A 28 ILE CG1 C 13 27.631 0.1 A 28 ILE CG2 C 13 18.698 0.1 A 28 ILE N N 15 123.846 0.1 A 29 LEU H H 1 8.805 0.020 A 29 LEU HA H 1 4.535 0.020 A 29 LEU HBy H 1 2.338 0.020 A 29 LEU HBx H 1 1.958 0.003 A 29 LEU HDx% H 1 0.877 0.020 A 29 LEU HDy% H 1 0.835 0.016 A 29 LEU C C 13 176.012 0.1 A 29 LEU CA C 13 55.366 0.1 A 29 LEU CB C 13 43.180 0.1 A 29 LEU CD1 C 13 25.808 0.1 A 29 LEU CD2 C 13 23.425 0.1 A 29 LEU N N 15 128.649 0.1 A 30 ASN H H 1 8.216 0.006 A 30 ASN HA H 1 5.005 0.020 A 30 ASN HBy H 1 2.907 0.020 A 30 ASN HBx H 1 2.368 0.020 A 30 ASN HD2y H 1 7.640 0.020 A 30 ASN HD2x H 1 6.235 0.020 A 30 ASN C C 13 174.664 0.1 A 30 ASN CA C 13 52.517 0.1 A 30 ASN CB C 13 38.776 0.1 A 30 ASN N N 15 120.791 0.1 A 30 ASN ND2 N 15 111.738 0.1 A 31 THR H H 1 7.883 0.020 A 31 THR HA H 1 4.842 0.002 A 31 THR HB H 1 4.219 0.020 A 31 THR HG2% H 1 1.148 0.020 A 31 THR CA C 13 58.369 0.1 A 31 THR CB C 13 70.018 0.1 A 31 THR CG2 C 13 22.130 0.1 A 31 THR N N 15 115.811 0.1 A 32 PRO HA H 1 4.317 0.020 A 32 PRO HBx H 1 1.866 0.020 A 32 PRO HBy H 1 2.322 0.020 A 32 PRO HDx H 1 3.777 0.004 A 32 PRO HDy H 1 3.777 0.004 A 32 PRO HGx H 1 2.020 0.020 A 32 PRO HGy H 1 2.020 0.020 A 32 PRO CA C 13 65.164 0.1 A 32 PRO CB C 13 32.484 0.1 A 32 PRO CD C 13 51.251 0.1 A 32 PRO CG C 13 27.631 0.1 A 33 ASN H H 1 8.259 0.020 A 33 ASN HA H 1 4.651 0.020 A 33 ASN HBx H 1 2.770 0.020 A 33 ASN HBy H 1 2.770 0.020 A 33 ASN HD2y H 1 7.538 0.020 A 33 ASN HD2x H 1 6.813 0.020 A 33 ASN C C 13 174.710 0.1 A 33 ASN CA C 13 54.532 0.1 A 33 ASN CB C 13 39.167 0.1 A 33 ASN N N 15 120.081 0.1 A 33 ASN ND2 N 15 112.472 0.1 A 34 CYS H H 1 7.569 0.005 A 34 CYS HA H 1 4.675 0.020 A 34 CYS HBy H 1 3.119 0.020 A 34 CYS HBx H 1 3.017 0.020 A 34 CYS C C 13 173.865 0.1 A 34 CYS CA C 13 55.447 0.1 A 34 CYS CB C 13 45.228 0.1 A 34 CYS N N 15 117.076 0.1 A 35 ALA H H 1 8.472 0.020 A 35 ALA HA H 1 4.223 0.020 A 35 ALA HB% H 1 1.442 0.020 A 35 ALA C C 13 176.423 0.1 A 35 ALA CA C 13 53.537 0.1 A 35 ALA CB C 13 19.202 0.1 A 35 ALA N N 15 125.153 0.1 A 36 CYS H H 1 8.316 0.002 A 36 CYS HA H 1 4.196 0.020 A 36 CYS HBy H 1 3.462 0.020 A 36 CYS HBx H 1 2.636 0.020 A 36 CYS C C 13 173.705 0.1 A 36 CYS CA C 13 58.616 0.1 A 36 CYS CB C 13 45.705 0.1 A 36 CYS N N 15 118.837 0.1 A 37 GLN H H 1 8.928 0.001 A 37 GLN HA H 1 4.596 0.020 A 37 GLN HBx H 1 2.304 0.020 A 37 GLN HBy H 1 2.304 0.020 A 37 GLN HE2y H 1 7.236 0.007 A 37 GLN HE2x H 1 6.863 0.007 A 37 GLN HGx H 1 2.557 0.020 A 37 GLN HGy H 1 2.557 0.020 A 37 GLN C C 13 173.636 0.1 A 37 GLN CA C 13 54.603 0.1 A 37 GLN CB C 13 31.761 0.1 A 37 GLN CG C 13 34.722 0.1 A 37 GLN N N 15 128.567 0.1 A 37 GLN NE2 N 15 112.756 0.006 A 38 ILE H H 1 8.851 0.020 A 38 ILE HA H 1 5.087 0.020 A 38 ILE HB H 1 1.781 0.020 A 38 ILE HD1% H 1 0.709 0.020 A 38 ILE HG1x H 1 1.808 0.020 A 38 ILE HG1y H 1 1.808 0.020 A 38 ILE HG2% H 1 0.741 0.020 A 38 ILE C C 13 174.390 0.1 A 38 ILE CA C 13 60.582 0.1 A 38 ILE CB C 13 40.048 0.1 A 38 ILE CD1 C 13 14.029 0.1 A 38 ILE CG1 C 13 28.278 0.1 A 38 ILE CG2 C 13 19.218 0.1 A 38 ILE N N 15 123.962 0.1 A 39 VAL H H 1 9.090 0.020 A 39 VAL HA H 1 4.822 0.020 A 39 VAL HB H 1 2.161 0.020 A 39 VAL HGx% H 1 0.744 0.020 A 39 VAL HGy% H 1 0.938 0.020 A 39 VAL C C 13 175.487 0.1 A 39 VAL CA C 13 59.980 0.1 A 39 VAL CB C 13 35.868 0.1 A 39 VAL CG1 C 13 21.783 0.1 A 39 VAL CG2 C 13 21.797 0.1 A 39 VAL N N 15 126.354 0.1 A 40 ALA H H 1 9.513 0.020 A 40 ALA HA H 1 5.137 0.020 A 40 ALA HB% H 1 1.322 0.020 A 40 ALA C C 13 175.944 0.1 A 40 ALA CA C 13 50.591 0.1 A 40 ALA CB C 13 22.432 0.1 A 40 ALA N N 15 128.406 0.1 A 41 ARG H H 1 7.720 0.004 A 41 ARG HA H 1 4.959 0.020 A 41 ARG HBx H 1 1.454 0.020 A 41 ARG HBy H 1 1.454 0.020 A 41 ARG HDx H 1 3.110 0.020 A 41 ARG HDy H 1 3.110 0.020 A 41 ARG HGx H 1 1.379 0.020 A 41 ARG HGy H 1 1.379 0.020 A 41 ARG C C 13 175.510 0.1 A 41 ARG CA C 13 54.162 0.1 A 41 ARG CB C 13 31.200 0.1 A 41 ARG CD C 13 42.838 0.1 A 41 ARG CG C 13 27.631 0.1 A 41 ARG N N 15 121.795 0.1 A 42 LEU H H 1 9.164 0.020 A 42 LEU HA H 1 5.021 0.020 A 42 LEU HBx H 1 1.765 0.020 A 42 LEU HBy H 1 2.207 0.020 A 42 LEU HDx% H 1 1.018 0.020 A 42 LEU HDy% H 1 0.802 0.020 A 42 LEU HG H 1 1.814 0.001 A 42 LEU C C 13 177.840 0.1 A 42 LEU CA C 13 54.724 0.1 A 42 LEU CB C 13 41.712 0.1 A 42 LEU CD1 C 13 26.006 0.1 A 42 LEU CD2 C 13 23.452 0.1 A 42 LEU CG C 13 27.815 0.1 A 42 LEU N N 15 129.087 0.1 A 43 LYS H H 1 8.396 0.020 A 43 LYS HA H 1 3.950 0.020 A 43 LYS HBy H 1 1.890 0.020 A 43 LYS HBx H 1 1.708 0.002 A 43 LYS HDx H 1 1.656 0.020 A 43 LYS HDy H 1 1.784 0.020 A 43 LYS HEx H 1 3.054 0.005 A 43 LYS HEy H 1 3.054 0.005 A 43 LYS HGy H 1 1.320 0.020 A 43 LYS HGx H 1 1.222 0.020 A 43 LYS CA C 13 59.016 0.1 A 43 LYS CB C 13 34.102 0.1 A 43 LYS CD C 13 29.896 0.1 A 43 LYS CG C 13 26.660 0.1 A 43 LYS N N 15 119.674 0.1 A 46 ASN HA H 1 4.709 0.020 A 46 ASN HBy H 1 3.093 0.020 A 46 ASN HBx H 1 2.773 0.020 A 46 ASN HD2y H 1 7.573 0.020 A 46 ASN HD2x H 1 6.911 0.020 A 46 ASN C C 13 175.098 0.1 A 46 ASN CA C 13 54.764 0.1 A 46 ASN CB C 13 39.265 0.1 A 46 ASN ND2 N 15 113.190 0.1 A 47 ARG H H 1 7.923 0.004 A 47 ARG HA H 1 4.368 0.020 A 47 ARG HBx H 1 1.798 0.003 A 47 ARG HBy H 1 1.798 0.003 A 47 ARG HDy H 1 3.205 0.020 A 47 ARG HDx H 1 3.149 0.020 A 47 ARG HGy H 1 1.648 0.020 A 47 ARG HGx H 1 1.576 0.020 A 47 ARG C C 13 175.601 0.1 A 47 ARG CA C 13 57.051 0.1 A 47 ARG CB C 13 32.121 0.1 A 47 ARG CD C 13 43.788 0.021 A 47 ARG CG C 13 28.500 0.1 A 47 ARG N N 15 119.826 0.1 A 48 GLN H H 1 8.547 0.006 A 48 GLN HA H 1 5.441 0.020 A 48 GLN HBy H 1 1.988 0.020 A 48 GLN HBx H 1 1.848 0.020 A 48 GLN HE2y H 1 7.615 0.020 A 48 GLN HE2x H 1 7.082 0.020 A 48 GLN HGy H 1 2.435 0.020 A 48 GLN HGx H 1 1.972 0.020 A 48 GLN C C 13 175.578 0.1 A 48 GLN CA C 13 55.125 0.1 A 48 GLN CB C 13 32.121 0.1 A 48 GLN CG C 13 36.035 0.1 A 48 GLN N N 15 120.767 0.1 A 48 GLN NE2 N 15 111.045 0.1 A 49 VAL H H 1 8.630 0.003 A 49 VAL HA H 1 4.826 0.020 A 49 VAL HB H 1 2.159 0.020 A 49 VAL HGx% H 1 0.730 0.020 A 49 VAL HGy% H 1 0.911 0.004 A 49 VAL C C 13 175.258 0.1 A 49 VAL CA C 13 59.338 0.1 A 49 VAL CB C 13 36.155 0.1 A 49 VAL CG1 C 13 22.121 0.1 A 49 VAL CG2 C 13 19.918 0.1 A 49 VAL N N 15 116.678 0.1 A 50 CYS H H 1 9.095 0.009 A 50 CYS HA H 1 5.278 0.020 A 50 CYS HBy H 1 3.675 0.020 A 50 CYS HBx H 1 2.932 0.020 A 50 CYS C C 13 174.527 0.1 A 50 CYS CA C 13 58.054 0.1 A 50 CYS CB C 13 43.162 0.1 A 50 CYS N N 15 124.549 0.1 A 51 ILE H H 1 8.485 0.009 A 51 ILE HA H 1 4.973 0.020 A 51 ILE HB H 1 1.547 0.020 A 51 ILE HD1% H 1 0.732 0.020 A 51 ILE HG1y H 1 1.364 0.020 A 51 ILE HG1x H 1 1.150 0.020 A 51 ILE HG2% H 1 0.740 0.020 A 51 ILE C C 13 173.019 0.1 A 51 ILE CA C 13 58.897 0.1 A 51 ILE CB C 13 42.201 0.1 A 51 ILE CD1 C 13 14.665 0.1 A 51 ILE CG1 C 13 27.986 0.028 A 51 ILE CG2 C 13 18.126 0.1 A 51 ILE N N 15 122.581 0.1 A 52 ASP H H 1 7.661 0.006 A 52 ASP HA H 1 3.611 0.020 A 52 ASP HBy H 1 2.702 0.020 A 52 ASP HBx H 1 2.266 0.020 A 52 ASP CA C 13 51.574 0.1 A 52 ASP CB C 13 42.515 0.1 A 52 ASP N N 15 125.772 0.1 A 53 PRO HA H 1 4.010 0.020 A 53 PRO HBx H 1 1.881 0.020 A 53 PRO HBy H 1 2.171 0.020 A 53 PRO HDx H 1 3.420 0.020 A 53 PRO HDy H 1 3.420 0.020 A 53 PRO HGy H 1 1.872 0.020 A 53 PRO HGx H 1 1.811 0.020 A 53 PRO C C 13 176.126 0.1 A 53 PRO CA C 13 63.993 0.1 A 53 PRO CB C 13 33.002 0.1 A 53 PRO CD C 13 51.251 0.1 A 53 PRO CG C 13 27.631 0.1 A 54 LYS H H 1 7.930 0.004 A 54 LYS HA H 1 3.988 0.020 A 54 LYS HBy H 1 1.787 0.003 A 54 LYS HBx H 1 1.747 0.020 A 54 LYS HDx H 1 1.691 0.020 A 54 LYS HDy H 1 1.691 0.020 A 54 LYS HEx H 1 3.026 0.020 A 54 LYS HEy H 1 3.026 0.020 A 54 LYS HGy H 1 1.398 0.020 A 54 LYS HGx H 1 1.361 0.020 A 54 LYS C C 13 177.931 0.1 A 54 LYS CA C 13 56.770 0.1 A 54 LYS CB C 13 32.023 0.1 A 54 LYS CD C 13 28.925 0.1 A 54 LYS CE C 13 41.868 0.1 A 54 LYS CG C 13 25.270 0.1 A 54 LYS N N 15 112.924 0.1 A 55 LEU H H 1 7.161 0.002 A 55 LEU HA H 1 4.059 0.020 A 55 LEU HBy H 1 1.257 0.020 A 55 LEU HBx H 1 1.050 0.020 A 55 LEU HDx% H 1 1.079 0.020 A 55 LEU HDy% H 1 1.076 0.020 A 55 LEU HG H 1 1.900 0.020 A 55 LEU C C 13 179.416 0.1 A 55 LEU CA C 13 56.088 0.1 A 55 LEU CB C 13 42.191 0.1 A 55 LEU CD1 C 13 26.013 0.1 A 55 LEU CD2 C 13 23.425 0.1 A 55 LEU CG C 13 27.631 0.1 A 55 LEU N N 15 120.593 0.1 A 56 LYS H H 1 8.720 0.001 A 56 LYS HA H 1 3.911 0.020 A 56 LYS HBx H 1 2.030 0.020 A 56 LYS HBy H 1 2.030 0.020 A 56 LYS HDy H 1 1.833 0.020 A 56 LYS HDx H 1 1.799 0.006 A 56 LYS HEx H 1 3.060 0.020 A 56 LYS HEy H 1 3.060 0.020 A 56 LYS HGy H 1 1.608 0.020 A 56 LYS HGx H 1 1.571 0.003 A 56 LYS C C 13 178.937 0.1 A 56 LYS CA C 13 60.301 0.1 A 56 LYS CB C 13 32.121 0.1 A 56 LYS CD C 13 29.576 0.1 A 56 LYS CE C 13 42.495 0.1 A 56 LYS CG C 13 25.074 0.1 A 56 LYS N N 15 125.479 0.1 A 57 TRP H H 1 7.811 0.020 A 57 TRP HA H 1 4.664 0.003 A 57 TRP HBy H 1 3.615 0.020 A 57 TRP HBx H 1 3.306 0.020 A 57 TRP HD1 H 1 7.743 0.009 A 57 TRP HE1 H 1 10.309 0.003 A 57 TRP HE3 H 1 7.363 0.006 A 57 TRP HH2 H 1 6.722 0.005 A 57 TRP HZ2 H 1 7.032 0.008 A 57 TRP HZ3 H 1 6.631 0.020 A 57 TRP C C 13 178.868 0.1 A 57 TRP CA C 13 58.897 0.1 A 57 TRP CB C 13 28.036 0.1 A 57 TRP CD1 C 13 128.682 0.1 A 57 TRP CE3 C 13 121.176 0.1 A 57 TRP CH2 C 13 124.023 0.1 A 57 TRP CZ2 C 13 114.182 0.1 A 57 TRP CZ3 C 13 121.176 0.1 A 57 TRP N N 15 113.433 0.1 A 57 TRP NE1 N 15 130.751 0.1 A 58 ILE H H 1 6.461 0.006 A 58 ILE HA H 1 3.304 0.020 A 58 ILE HB H 1 1.749 0.020 A 58 ILE HD1% H 1 0.533 0.020 A 58 ILE HG1x H 1 -0.395 0.020 A 58 ILE HG1y H 1 0.126 0.020 A 58 ILE HG2% H 1 0.527 0.020 A 58 ILE C C 13 177.726 0.1 A 58 ILE CA C 13 64.314 0.1 A 58 ILE CB C 13 35.897 0.1 A 58 ILE CD1 C 13 16.953 0.1 A 58 ILE CG1 C 13 26.986 0.1 A 58 ILE CG2 C 13 17.277 0.1 A 58 ILE N N 15 124.379 0.1 A 59 GLN H H 1 7.624 0.004 A 59 GLN HA H 1 3.748 0.020 A 59 GLN HBy H 1 2.264 0.020 A 59 GLN HBx H 1 2.190 0.020 A 59 GLN HE2x H 1 7.078 0.020 A 59 GLN HE2y H 1 7.925 0.004 A 59 GLN HGx H 1 2.381 0.020 A 59 GLN HGy H 1 2.381 0.020 A 59 GLN C C 13 178.434 0.1 A 59 GLN CA C 13 59.379 0.1 A 59 GLN CB C 13 28.272 0.1 A 59 GLN CG C 13 34.102 0.1 A 59 GLN N N 15 119.070 0.1 A 59 GLN NE2 N 15 115.396 0.005 A 60 GLU H H 1 8.064 0.001 A 60 GLU HA H 1 4.083 0.020 A 60 GLU HBx H 1 2.110 0.020 A 60 GLU HBy H 1 2.251 0.020 A 60 GLU HGy H 1 2.530 0.020 A 60 GLU HGx H 1 2.284 0.020 A 60 GLU C C 13 179.051 0.1 A 60 GLU CA C 13 59.659 0.1 A 60 GLU CB C 13 30.457 0.1 A 60 GLU CG C 13 37.308 0.1 A 60 GLU N N 15 117.166 0.1 A 61 TYR H H 1 7.924 0.006 A 61 TYR HA H 1 4.254 0.020 A 61 TYR HBx H 1 3.292 0.020 A 61 TYR HBy H 1 3.445 0.001 A 61 TYR HD1 H 1 7.173 0.006 A 61 TYR HD2 H 1 7.173 0.006 A 61 TYR HE1 H 1 6.831 0.020 A 61 TYR HE2 H 1 6.831 0.020 A 61 TYR C C 13 178.617 0.1 A 61 TYR CA C 13 61.184 0.1 A 61 TYR CB C 13 39.461 0.1 A 61 TYR CD1 C 13 133.083 0.1 A 61 TYR CE1 C 13 118.325 0.1 A 61 TYR N N 15 121.271 0.1 A 62 LEU H H 1 8.260 0.005 A 62 LEU HA H 1 3.954 0.020 A 62 LEU HBy H 1 1.952 0.020 A 62 LEU HBx H 1 1.214 0.020 A 62 LEU HDx% H 1 0.698 0.020 A 62 LEU HDy% H 1 0.754 0.020 A 62 LEU HG H 1 1.925 0.020 A 62 LEU C C 13 179.553 0.1 A 62 LEU CA C 13 58.014 0.1 A 62 LEU CB C 13 42.191 0.1 A 62 LEU CD1 C 13 26.604 0.1 A 62 LEU CD2 C 13 23.313 0.1 A 62 LEU CG C 13 26.984 0.1 A 62 LEU N N 15 116.299 0.1 A 63 GLU H H 1 8.454 0.002 A 63 GLU HA H 1 3.840 0.020 A 63 GLU HBy H 1 2.242 0.020 A 63 GLU HBx H 1 2.085 0.020 A 63 GLU HGy H 1 2.476 0.020 A 63 GLU HGx H 1 2.253 0.020 A 63 GLU C C 13 179.279 0.1 A 63 GLU CA C 13 60.301 0.1 A 63 GLU CB C 13 29.870 0.1 A 63 GLU CG C 13 37.406 0.1 A 63 GLU N N 15 118.616 0.1 A 64 LYS H H 1 7.575 0.020 A 64 LYS HA H 1 4.212 0.020 A 64 LYS HBx H 1 1.944 0.020 A 64 LYS HBy H 1 2.017 0.001 A 64 LYS HDx H 1 1.715 0.020 A 64 LYS HDy H 1 1.715 0.020 A 64 LYS HEx H 1 3.006 0.004 A 64 LYS HEy H 1 3.006 0.004 A 64 LYS HGy H 1 1.641 0.020 A 64 LYS HGx H 1 1.592 0.020 A 64 LYS C C 13 178.457 0.1 A 64 LYS CA C 13 58.496 0.1 A 64 LYS CB C 13 32.400 0.1 A 64 LYS CD C 13 29.249 0.1 A 64 LYS CE C 13 42.838 0.1 A 64 LYS CG C 13 25.336 0.1 A 64 LYS N N 15 117.166 0.1 A 65 CYS H H 1 7.918 0.004 A 65 CYS HA H 1 4.526 0.020 A 65 CYS HBy H 1 3.074 0.020 A 65 CYS HBx H 1 2.980 0.020 A 65 CYS C C 13 174.893 0.1 A 65 CYS CA C 13 56.329 0.1 A 65 CYS CB C 13 45.235 0.1 A 65 CYS N N 15 115.330 0.1 A 66 LEU H H 1 7.559 0.002 A 66 LEU HA H 1 4.490 0.001 A 66 LEU HBy H 1 1.738 0.020 A 66 LEU HBx H 1 1.595 0.020 A 66 LEU HDx% H 1 0.873 0.020 A 66 LEU HDy% H 1 0.867 0.020 A 66 LEU HG H 1 1.700 0.020 A 66 LEU C C 13 176.812 0.1 A 66 LEU CA C 13 55.366 0.1 A 66 LEU CB C 13 43.278 0.1 A 66 LEU CD1 C 13 26.013 0.1 A 66 LEU CD2 C 13 23.998 0.1 A 66 LEU CG C 13 27.307 0.1 A 66 LEU N N 15 120.930 0.1 A 67 ASN H H 1 8.265 0.001 A 67 ASN HA H 1 4.669 0.020 A 67 ASN HBy H 1 2.853 0.020 A 67 ASN HBx H 1 2.607 0.020 A 67 ASN HD2y H 1 7.554 0.020 A 67 ASN HD2x H 1 6.813 0.020 A 67 ASN CA C 13 53.761 0.1 A 67 ASN CB C 13 39.069 0.1 A 67 ASN N N 15 120.279 0.1 A 67 ASN ND2 N 15 111.986 0.1 A 68 LYS H H 1 7.840 0.004 A 68 LYS HA H 1 4.175 0.020 A 68 LYS HBy H 1 1.849 0.020 A 68 LYS HBx H 1 1.704 0.020 A 68 LYS HDx H 1 1.681 0.020 A 68 LYS HDy H 1 1.681 0.020 A 68 LYS HEx H 1 3.035 0.003 A 68 LYS HEy H 1 3.035 0.003 A 68 LYS HGx H 1 1.400 0.020 A 68 LYS HGy H 1 1.400 0.020 A 68 LYS CA C 13 57.722 0.1 A 68 LYS CB C 13 34.102 0.1 A 68 LYS CD C 13 29.572 0.1 A 68 LYS CG C 13 25.042 0.1 A 68 LYS N N 15 127.034 0.1 B 101 MET HA H 1 4.472 0.020 B 101 MET HBy H 1 2.124 0.020 B 101 MET HBx H 1 2.047 0.020 B 101 MET HGy H 1 2.656 0.002 B 101 MET HGx H 1 2.575 0.020 B 101 MET C C 13 176.332 0.1 B 101 MET CA C 13 55.902 0.1 B 101 MET CB C 13 33.026 0.1 B 102 GLU H H 1 8.329 0.020 B 102 GLU HA H 1 4.282 0.002 B 102 GLU HBy H 1 2.088 0.020 B 102 GLU HBx H 1 1.986 0.003 B 102 GLU HGx H 1 2.275 0.020 B 102 GLU HGy H 1 2.275 0.020 B 102 GLU C C 13 177.132 0.1 B 102 GLU CA C 13 57.410 0.1 B 102 GLU CG C 13 36.797 0.1 B 102 GLU N N 15 121.884 0.1 B 103 GLY H H 1 8.335 0.020 B 103 GLY HAx H 1 3.941 0.020 B 103 GLY HAy H 1 3.941 0.020 B 103 GLY C C 13 174.207 0.1 B 103 GLY CA C 13 45.731 0.1 B 103 GLY N N 15 110.055 0.1 B 104 ILE H H 1 7.831 0.002 B 104 ILE HA H 1 4.269 0.020 B 104 ILE HB H 1 1.887 0.020 B 104 ILE HD1% H 1 0.848 0.020 B 104 ILE HG1y H 1 1.439 0.020 B 104 ILE HG1x H 1 1.170 0.020 B 104 ILE HG2% H 1 0.902 0.020 B 104 ILE C C 13 176.401 0.1 B 104 ILE CA C 13 61.558 0.1 B 104 ILE CB C 13 39.436 0.1 B 104 ILE CD1 C 13 13.418 0.1 B 104 ILE CG1 C 13 27.496 0.1 B 104 ILE CG2 C 13 18.069 0.1 B 104 ILE N N 15 119.606 0.1 B 105 SER H H 1 8.324 0.020 B 105 SER HA H 1 4.535 0.020 B 105 SER HBy H 1 3.913 0.020 B 105 SER HBx H 1 3.815 0.020 B 105 SER C C 13 174.550 0.1 B 105 SER CA C 13 58.667 0.1 B 105 SER CB C 13 64.072 0.1 B 105 SER N N 15 119.717 0.1 B 106 ILE H H 1 7.921 0.002 B 106 ILE HA H 1 4.205 0.020 B 106 ILE HB H 1 1.786 0.020 B 106 ILE HD1% H 1 0.777 0.020 B 106 ILE HG1y H 1 1.256 0.020 B 106 ILE HG1x H 1 1.065 0.020 B 106 ILE HG2% H 1 0.774 0.020 B 106 ILE C C 13 175.921 0.1 B 106 ILE CA C 13 61.935 0.1 B 106 ILE CB C 13 39.436 0.1 B 106 ILE CD1 C 13 13.418 0.1 B 106 ILE CG1 C 13 27.370 0.1 B 106 ILE CG2 C 13 18.069 0.1 B 106 ILE N N 15 121.730 0.1 B 107 TYS H H 1 8.213 0.020 B 107 TYS HA H 1 4.791 0.020 B 107 TYS HBx H 1 2.978 0.020 B 107 TYS HBy H 1 3.169 0.020 B 107 TYS HD1 H 1 7.271 0.003 B 107 TYS HD2 H 1 7.271 0.003 B 107 TYS HE1 H 1 7.261 0.003 B 107 TYS HE2 H 1 7.261 0.003 B 107 TYS C C 13 176.058 0.1 B 107 TYS CA C 13 58.165 0.1 B 107 TYS CB C 13 39.601 0.1 B 107 TYS CD1 C 13 133.603 0.1 B 107 TYS CE1 C 13 124.799 0.1 B 107 TYS N N 15 123.118 0.1 B 108 THR H H 1 8.007 0.020 B 108 THR HA H 1 4.419 0.020 B 108 THR HB H 1 4.252 0.020 B 108 THR HG2% H 1 1.187 0.020 B 108 THR C C 13 174.459 0.1 B 108 THR CA C 13 62.061 0.1 B 108 THR CB C 13 70.608 0.1 B 108 THR CG2 C 13 21.965 0.1 B 108 THR N N 15 115.642 0.1 B 109 SER H H 1 8.211 0.020 B 109 SER HA H 1 4.507 0.020 B 109 SER HBy H 1 3.939 0.020 B 109 SER HBx H 1 3.900 0.020 B 109 SER C C 13 174.504 0.1 B 109 SER CA C 13 58.919 0.1 B 109 SER CB C 13 64.198 0.1 B 109 SER N N 15 117.260 0.1 B 110 ASP H H 1 8.323 0.020 B 110 ASP HA H 1 4.620 0.020 B 110 ASP HBy H 1 2.704 0.020 B 110 ASP HBx H 1 2.657 0.020 B 110 ASP C C 13 176.058 0.1 B 110 ASP CA C 13 55.022 0.1 B 110 ASP CB C 13 41.825 0.1 B 110 ASP N N 15 122.020 0.1 B 111 ASN H H 1 8.230 0.020 B 111 ASN HA H 1 4.707 0.020 B 111 ASN HBy H 1 2.834 0.020 B 111 ASN HBx H 1 2.687 0.020 B 111 ASN C C 13 175.030 0.1 B 111 ASN CA C 13 53.765 0.1 B 111 ASN CB C 13 39.562 0.1 B 111 ASN N N 15 118.317 0.1 B 112 TYS H H 1 8.135 0.020 B 112 TYS HA H 1 4.641 0.020 B 112 TYS HBx H 1 3.047 0.020 B 112 TYS HBy H 1 3.128 0.020 B 112 TYS HD1 H 1 7.275 0.020 B 112 TYS HD2 H 1 7.275 0.020 B 112 TYS HE1 H 1 7.263 0.020 B 112 TYS HE2 H 1 7.263 0.020 B 112 TYS C C 13 176.081 0.1 B 112 TYS CA C 13 58.793 0.1 B 112 TYS CB C 13 39.925 0.1 B 112 TYS CD1 C 13 133.085 0.1 B 112 TYS CE1 C 13 124.281 0.1 B 112 TYS N N 15 120.283 0.1 B 113 THR H H 1 7.993 0.020 B 113 THR HA H 1 4.301 0.020 B 113 THR HB H 1 4.211 0.020 B 113 THR HG2% H 1 1.189 0.020 B 113 THR C C 13 174.413 0.1 B 113 THR CA C 13 62.187 0.1 B 113 THR CB C 13 70.341 0.1 B 113 THR CG2 C 13 21.965 0.1 B 113 THR N N 15 115.937 0.1 B 114 GLU H H 1 8.378 0.020 B 114 GLU HA H 1 4.268 0.001 B 114 GLU HBy H 1 2.069 0.020 B 114 GLU HBx H 1 1.960 0.020 B 114 GLU HGx H 1 2.278 0.020 B 114 GLU HGy H 1 2.278 0.020 B 114 GLU C C 13 176.766 0.1 B 114 GLU CA C 13 57.410 0.1 B 114 GLU CB C 13 30.620 0.1 B 114 GLU CG C 13 36.923 0.1 B 114 GLU N N 15 123.052 0.1 B 115 GLU H H 1 8.326 0.020 B 115 GLU HA H 1 4.274 0.020 B 115 GLU HBy H 1 2.066 0.020 B 115 GLU HBx H 1 1.959 0.020 B 115 GLU HGx H 1 2.278 0.020 B 115 GLU HGy H 1 2.278 0.020 B 115 GLU C C 13 176.880 0.1 B 115 GLU CA C 13 57.410 0.1 B 115 GLU CB C 13 30.525 0.1 B 115 GLU CG C 13 36.923 0.1 B 115 GLU N N 15 121.688 0.1 B 116 MET H H 1 8.309 0.020 B 116 MET HA H 1 4.473 0.020 B 116 MET HBy H 1 2.116 0.020 B 116 MET HBx H 1 2.030 0.020 B 116 MET HGy H 1 2.633 0.001 B 116 MET HGx H 1 2.546 0.020 B 116 MET C C 13 177.086 0.1 B 116 MET CA C 13 56.279 0.1 B 116 MET CB C 13 33.026 0.1 B 116 MET N N 15 121.270 0.1 B 117 GLY H H 1 8.335 0.020 B 117 GLY HAx H 1 4.054 0.020 B 117 GLY HAy H 1 4.054 0.020 B 117 GLY C C 13 174.481 0.1 B 117 GLY CA C 13 45.847 0.1 B 117 GLY N N 15 110.055 0.1 B 118 SER H H 1 8.230 0.020 B 118 SER HA H 1 4.476 0.020 B 118 SER HBy H 1 3.940 0.020 B 118 SER HBx H 1 3.880 0.020 B 118 SER C C 13 175.327 0.1 B 118 SER CA C 13 58.919 0.1 B 118 SER CB C 13 64.575 0.1 B 118 SER N N 15 115.664 0.1 B 119 GLY H H 1 8.354 0.020 B 119 GLY HAx H 1 3.941 0.020 B 119 GLY HAy H 1 3.941 0.020 B 119 GLY C C 13 174.002 0.1 B 119 GLY CA C 13 45.721 0.1 B 119 GLY N N 15 110.872 0.1 B 120 ASP H H 1 8.065 0.020 B 120 ASP HA H 1 4.621 0.020 B 120 ASP HBy H 1 2.650 0.020 B 120 ASP HBx H 1 2.528 0.020 B 120 ASP C C 13 176.355 0.1 B 120 ASP CA C 13 54.771 0.1 B 120 ASP CB C 13 41.699 0.1 B 120 ASP N N 15 120.530 0.1 B 121 TYS H H 1 8.187 0.020 B 121 TYS HA H 1 4.647 0.020 B 121 TYS HBx H 1 3.032 0.020 B 121 TYS HBy H 1 3.204 0.020 B 121 TYS HD1 H 1 7.273 0.002 B 121 TYS HD2 H 1 7.273 0.002 B 121 TYS HE1 H 1 7.255 0.020 B 121 TYS HE2 H 1 7.255 0.020 B 121 TYS C C 13 176.058 0.1 B 121 TYS CA C 13 58.667 0.1 B 121 TYS CB C 13 39.311 0.1 B 121 TYS CD1 C 13 133.344 0.1 B 121 TYS CE1 C 13 124.540 0.1 B 121 TYS N N 15 120.283 0.1 B 122 ASP H H 1 8.322 0.020 B 122 ASP HA H 1 4.626 0.020 B 122 ASP HBy H 1 2.715 0.020 B 122 ASP HBx H 1 2.658 0.001 B 122 ASP C C 13 176.835 0.1 B 122 ASP CA C 13 55.022 0.1 B 122 ASP CB C 13 41.825 0.1 B 122 ASP N N 15 121.417 0.1 B 123 SER H H 1 8.155 0.020 B 123 SER HA H 1 4.391 0.020 B 123 SER HBy H 1 3.940 0.020 B 123 SER HBx H 1 3.902 0.020 B 123 SER C C 13 175.075 0.1 B 123 SER CA C 13 59.347 0.1 B 123 SER CB C 13 63.879 0.1 B 123 SER N N 15 116.126 0.1 B 124 MET H H 1 8.221 0.020 B 124 MET HA H 1 4.476 0.020 B 124 MET HBy H 1 2.129 0.020 B 124 MET HBx H 1 2.032 0.020 B 124 MET HGy H 1 2.617 0.020 B 124 MET HGx H 1 2.535 0.020 B 124 MET C C 13 176.355 0.1 B 124 MET CA C 13 56.279 0.1 B 124 MET CB C 13 32.900 0.1 B 124 MET CG C 13 32.900 0.1 B 124 MET N N 15 121.210 0.1 B 125 LYS H H 1 8.025 0.020 B 125 LYS HA H 1 4.312 0.020 B 125 LYS HBy H 1 1.832 0.020 B 125 LYS HBx H 1 1.753 0.020 B 125 LYS HDx H 1 1.664 0.020 B 125 LYS HDy H 1 1.664 0.020 B 125 LYS HEx H 1 2.997 0.020 B 125 LYS HEy H 1 2.997 0.020 B 125 LYS HGx H 1 1.420 0.020 B 125 LYS HGy H 1 1.420 0.020 B 125 LYS C C 13 176.355 0.1 B 125 LYS CA C 13 56.656 0.1 B 125 LYS CB C 13 33.529 0.1 B 125 LYS CD C 13 29.632 0.1 B 125 LYS CE C 13 42.579 0.1 B 125 LYS CG C 13 25.107 0.1 B 125 LYS N N 15 121.457 0.1 B 126 GLU H H 1 8.222 0.020 B 126 GLU N N 15 122.740 0.1 B 127 PRO HA H 1 4.355 0.020 B 127 PRO HBy H 1 2.217 0.020 B 127 PRO HBx H 1 1.805 0.020 B 127 PRO HDy H 1 3.787 0.020 B 127 PRO HDx H 1 3.683 0.020 B 127 PRO HGx H 1 1.992 0.020 B 127 PRO HGy H 1 1.992 0.020 B 127 PRO C C 13 176.812 0.1 B 127 PRO CA C 13 63.821 0.1 B 127 PRO CB C 13 32.272 0.1 B 127 PRO CD C 13 51.000 0.1 B 127 PRO CG C 13 27.873 0.1 B 128 ALA H H 1 8.267 0.020 B 128 ALA HA H 1 4.269 0.020 B 128 ALA HB% H 1 1.322 0.020 B 128 ALA C C 13 177.589 0.1 B 128 ALA CA C 13 52.873 0.1 B 128 ALA CB C 13 19.703 0.1 B 128 ALA N N 15 123.577 0.1 B 129 PHE H H 1 8.019 0.020 B 129 PHE HA H 1 4.621 0.020 B 129 PHE HBy H 1 3.127 0.020 B 129 PHE HBx H 1 3.049 0.020 B 129 PHE HD1 H 1 7.261 0.020 B 129 PHE HD2 H 1 7.261 0.020 B 129 PHE HE1 H 1 7.368 0.020 B 129 PHE HE2 H 1 7.368 0.020 B 129 PHE HZ H 1 7.320 0.020 B 129 PHE C C 13 175.624 0.1 B 129 PHE CA C 13 58.039 0.1 B 129 PHE CB C 13 40.055 0.1 B 129 PHE CD1 C 13 132.047 0.1 B 129 PHE CE1 C 13 132.047 0.1 B 129 PHE CZ C 13 129.978 0.1 B 129 PHE N N 15 118.994 0.1 B 130 ARG H H 1 8.029 0.020 B 130 ARG HA H 1 4.309 0.020 B 130 ARG HBy H 1 1.817 0.020 B 130 ARG HBx H 1 1.710 0.020 B 130 ARG HDx H 1 3.168 0.020 B 130 ARG HDy H 1 3.168 0.020 B 130 ARG HGx H 1 1.550 0.020 B 130 ARG HGy H 1 1.550 0.020 B 130 ARG C C 13 175.875 0.1 B 130 ARG CA C 13 56.154 0.1 B 130 ARG CB C 13 31.643 0.1 B 130 ARG CD C 13 43.961 0.1 B 130 ARG CG C 13 27.300 0.1 B 130 ARG N N 15 122.929 0.1 B 131 GLU H H 1 8.374 0.020 B 131 GLU HA H 1 4.276 0.020 B 131 GLU HBy H 1 2.063 0.020 B 131 GLU HBx H 1 1.960 0.020 B 131 GLU HGx H 1 2.279 0.020 B 131 GLU HGy H 1 2.279 0.020 B 131 GLU C C 13 176.766 0.1 B 131 GLU CA C 13 57.285 0.1 B 131 GLU CB C 13 30.512 0.1 B 131 GLU CG C 13 36.797 0.1 B 131 GLU N N 15 122.719 0.1 B 132 GLU H H 1 8.509 0.020 B 132 GLU HA H 1 4.271 0.020 B 132 GLU HBy H 1 2.063 0.020 B 132 GLU HBx H 1 1.957 0.020 B 132 GLU HGx H 1 2.273 0.020 B 132 GLU HGy H 1 2.273 0.020 B 132 GLU C C 13 176.560 0.1 B 132 GLU CA C 13 57.400 0.1 B 132 GLU CB C 13 30.530 0.044 B 132 GLU CG C 13 36.797 0.1 B 132 GLU N N 15 122.122 0.1 B 133 ASN H H 1 8.362 0.020 B 133 ASN HA H 1 4.693 0.020 B 133 ASN HBy H 1 2.831 0.020 B 133 ASN HBx H 1 2.751 0.020 B 133 ASN C C 13 175.258 0.1 B 133 ASN CA C 13 53.765 0.1 B 133 ASN CB C 13 39.562 0.1 B 133 ASN N N 15 119.552 0.1 B 134 ALA H H 1 8.155 0.020 B 134 ALA HA H 1 4.265 0.020 B 134 ALA HB% H 1 1.326 0.020 B 134 ALA C C 13 177.520 0.1 B 134 ALA CA C 13 52.873 0.1 B 134 ALA CB C 13 19.703 0.1 B 134 ALA N N 15 124.376 0.1 B 135 ASN H H 1 8.210 0.020 B 135 ASN HA H 1 4.688 0.020 B 135 ASN HBy H 1 2.749 0.020 B 135 ASN HBx H 1 2.689 0.020 B 135 ASN C C 13 175.144 0.1 B 135 ASN CA C 13 53.640 0.1 B 135 ASN CB C 13 39.311 0.1 B 135 ASN N N 15 117.103 0.1 B 136 PHE H H 1 7.997 0.020 B 136 PHE HA H 1 4.623 0.020 B 136 PHE HBy H 1 3.208 0.020 B 136 PHE HBx H 1 3.044 0.020 B 136 PHE HD1 H 1 7.267 0.020 B 136 PHE HD2 H 1 7.267 0.020 B 136 PHE HE1 H 1 7.383 0.020 B 136 PHE HE2 H 1 7.383 0.020 B 136 PHE C C 13 175.601 0.1 B 136 PHE CA C 13 58.165 0.1 B 136 PHE CB C 13 39.939 0.1 B 136 PHE CD1 C 13 132.309 0.1 B 136 PHE CE1 C 13 131.791 0.1 B 136 PHE N N 15 120.229 0.1 B 137 ASN H H 1 8.272 0.020 B 137 ASN HA H 1 4.702 0.020 B 137 ASN HBy H 1 2.834 0.020 B 137 ASN HBx H 1 2.696 0.020 B 137 ASN C C 13 174.047 0.1 B 137 ASN CA C 13 53.891 0.1 B 137 ASN CB C 13 39.688 0.1 B 137 ASN N N 15 120.594 0.1 B 138 LYS H H 1 7.697 0.020 B 138 LYS HA H 1 4.164 0.020 B 138 LYS HBy H 1 1.833 0.020 B 138 LYS HBx H 1 1.710 0.020 B 138 LYS HDx H 1 1.674 0.020 B 138 LYS HDy H 1 1.674 0.020 B 138 LYS HEx H 1 2.998 0.020 B 138 LYS HEy H 1 2.998 0.020 B 138 LYS HGx H 1 1.376 0.020 B 138 LYS HGy H 1 1.376 0.020 B 138 LYS CA C 13 58.046 0.1 B 138 LYS CB C 13 34.102 0.1 B 138 LYS CD C 13 29.896 0.1 B 138 LYS CE C 13 42.838 0.1 B 138 LYS CG C 13 25.042 0.1 B 138 LYS N N 15 126.523 0.1 stop_ save_ save_DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode DYANA/DIANA_distance_constraints_3 _nef_distance_restraint_list.restraint_origin undefined _nef_distance_restraint_list.potential_type upper-bound-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 3 VAL HA A 3 VAL HGx% 1.0 . 3.57 2 1 A 3 VAL HA A 3 VAL HGy% 1.0 . 3.57 3 2 A 5 LEU HA A 5 LEU HDx% 1.0 . 3.45 4 2 A 5 LEU HA A 5 LEU HD21 1.0 . 3.45 5 3 A 6 SER HA A 7 TYR HD% 1.0 . 4.35 6 4 A 7 TYR HD% A 6 SER HBx 1.0 . 4.41 7 4 A 7 TYR HD% A 6 SER HBy 1.0 . 4.41 8 5 A 7 TYR HD% A 7 TYR HA 1.0 . 3.86 9 6 A 8 ARG HA A 8 ARG HDx 1.0 . 4.43 10 6 A 8 ARG HA A 8 ARG HDy 1.0 . 4.43 11 7 A 8 ARG HA A 8 ARG HGx 1.0 . 3.94 12 7 A 8 ARG HA A 8 ARG HGy 1.0 . 3.94 13 8 A 8 ARG HDy A 8 ARG HBy 1.0 . 4.08 14 8 A 8 ARG HBy A 8 ARG HDx 1.0 . 4.08 15 9 A 8 ARG HDy A 8 ARG HBx 1.0 . 4.08 16 9 A 8 ARG HBx A 8 ARG HDx 1.0 . 4.08 17 10 A 8 ARG HBx A 8 ARG HDx 1.0 . 3.52 18 10 A 8 ARG HBy A 8 ARG HDx 1.0 . 3.52 19 10 A 8 ARG HDy A 8 ARG HBx 1.0 . 3.52 20 10 A 8 ARG HDy A 8 ARG HBy 1.0 . 3.52 21 11 A 9 CYS CB A 34 CYS CB 1.0 . 3.99 22 12 A 9 CYS CB A 34 CYS SG 1.0 . 3.10 23 13 A 10 PRO HDy A 9 CYS HBy 1.0 . 5.44 24 13 A 9 CYS HBy A 10 PRO HDx 1.0 . 5.44 25 14 A 10 PRO HDy A 9 CYS HBx 1.0 . 5.44 26 14 A 9 CYS HBx A 10 PRO HDx 1.0 . 5.44 27 15 A 9 CYS HBx A 10 PRO HDx 1.0 . 4.69 28 15 A 10 PRO HDy A 9 CYS HBy 1.0 . 4.69 29 15 A 10 PRO HDy A 9 CYS HBx 1.0 . 4.69 30 15 A 9 CYS HBy A 10 PRO HDx 1.0 . 4.69 31 16 A 34 CYS CB A 9 CYS SG 1.0 . 3.10 32 17 A 34 CYS SG A 9 CYS SG 1.0 . 2.10 33 18 A 10 PRO HBy A 29 LEU HDx% 1.0 . 5.50 34 19 A 10 PRO HBy A 29 LEU HDy% 1.0 . 5.50 35 20 A 10 PRO HBy A 29 LEU HDy% 1.0 . 4.48 36 20 A 10 PRO HBy A 29 LEU HDx% 1.0 . 4.48 37 21 A 10 PRO HBy A 31 THR HG2% 1.0 . 5.31 38 22 A 10 PRO HBx A 11 CYS H 1.0 . 4.48 39 23 A 10 PRO HBx A 29 LEU HDy% 1.0 . 4.54 40 23 A 29 LEU HDx% A 10 PRO HBx 1.0 . 4.54 41 24 A 31 THR HG2% A 10 PRO HBx 1.0 . 5.02 42 25 A 11 CYS H A 10 PRO HDx 1.0 . 4.54 43 25 A 10 PRO HDy A 11 CYS H 1.0 . 4.54 44 26 A 10 PRO HDy A 29 LEU HDy% 1.0 . 4.51 45 26 A 10 PRO HDx A 29 LEU HDy% 1.0 . 4.51 46 26 A 29 LEU HDx% A 10 PRO HDx 1.0 . 4.51 47 26 A 10 PRO HDy A 29 LEU HDx% 1.0 . 4.51 48 27 A 31 THR HG2% A 10 PRO HDx 1.0 . 4.49 49 27 A 10 PRO HDy A 31 THR HG2% 1.0 . 4.49 50 28 A 10 PRO HGx A 29 LEU HDy% 1.0 . 4.00 51 28 A 10 PRO HGy A 29 LEU HDy% 1.0 . 4.00 52 28 A 29 LEU HDx% A 10 PRO HGx 1.0 . 4.00 53 28 A 29 LEU HDx% A 10 PRO HGy 1.0 . 4.00 54 29 A 31 THR HG2% A 10 PRO HGx 1.0 . 4.34 55 29 A 31 THR HG2% A 10 PRO HGy 1.0 . 4.34 56 30 A 11 CYS CB A 50 CYS CB 1.0 . 3.99 57 31 A 11 CYS CB A 50 CYS SG 1.0 . 3.10 58 32 A 50 CYS CB A 11 CYS SG 1.0 . 3.10 59 33 A 50 CYS SG A 11 CYS SG 1.0 . 2.10 60 34 A 12 ARG HA A 12 ARG HGy 1.0 . 4.12 61 35 A 12 ARG HA A 12 ARG HGx 1.0 . 4.12 62 36 A 12 ARG HA A 12 ARG HDx 1.0 . 4.53 63 36 A 12 ARG HA A 12 ARG HDy 1.0 . 4.53 64 37 A 12 ARG HBx A 12 ARG HDx 1.0 . 3.55 65 37 A 12 ARG HBy A 12 ARG HDx 1.0 . 3.55 66 37 A 12 ARG HDy A 12 ARG HBx 1.0 . 3.55 67 37 A 12 ARG HDy A 12 ARG HBy 1.0 . 3.55 68 38 A 13 PHE HD% A 12 ARG HBx 1.0 . 4.20 69 38 A 12 ARG HBy A 13 PHE HD% 1.0 . 4.20 70 39 A 13 PHE HE% A 12 ARG HBx 1.0 . 4.82 71 39 A 12 ARG HBy A 13 PHE HE% 1.0 . 4.82 72 40 A 13 PHE HE% A 12 ARG HDx 1.0 . 4.25 73 40 A 12 ARG HDy A 13 PHE HE% 1.0 . 4.25 74 41 A 13 PHE HD% A 12 ARG HGx 1.0 . 4.43 75 41 A 13 PHE HD% A 12 ARG HGy 1.0 . 4.43 76 42 A 13 PHE HE% A 12 ARG HGx 1.0 . 4.91 77 42 A 13 PHE HE% A 12 ARG HGy 1.0 . 4.91 78 43 A 13 PHE HD% A 13 PHE H 1.0 . 5.50 79 44 A 13 PHE HE% A 13 PHE H 1.0 . 5.50 80 45 A 13 PHE H A 14 PHE H 1.0 . 5.50 81 46 A 13 PHE HD% A 13 PHE HA 1.0 . 3.84 82 47 A 13 PHE HE% A 13 PHE HA 1.0 . 4.67 83 48 A 13 PHE HA A 14 PHE HD% 1.0 . 4.62 84 49 A 14 PHE H A 13 PHE HBy 1.0 . 4.24 85 49 A 14 PHE H A 13 PHE HBx 1.0 . 4.24 86 50 A 13 PHE HD% A 14 PHE H 1.0 . 5.08 87 51 A 14 PHE H B 119 GLY HAx 1.0 . 5.07 88 51 A 14 PHE H B 119 GLY HAy 1.0 . 5.07 89 52 A 14 PHE H A 14 PHE HD% 1.0 . 4.93 90 53 A 14 PHE HD% A 14 PHE HA 1.0 . 4.56 91 54 A 14 PHE HBy A 15 GLU H 1.0 . 5.35 92 55 A 14 PHE HBy A 50 CYS HBy 1.0 . 5.50 93 56 A 14 PHE HBy A 52 ASP H 1.0 . 4.78 94 57 A 14 PHE HBy A 52 ASP HA 1.0 . 5.50 95 58 A 15 GLU H A 14 PHE HBx 1.0 . 5.28 96 59 A 52 ASP HA A 14 PHE HBx 1.0 . 5.50 97 60 A 14 PHE HD% A 15 GLU H 1.0 . 5.50 98 61 A 14 PHE HD% A 52 ASP H 1.0 . 4.61 99 62 A 14 PHE HD% A 52 ASP HBx 1.0 . 4.52 100 62 A 14 PHE HD% A 52 ASP HBy 1.0 . 4.52 101 63 A 14 PHE HD% A 53 PRO HDx 1.0 . 5.03 102 63 A 14 PHE HD% A 53 PRO HDy 1.0 . 5.03 103 64 A 15 GLU H A 15 GLU HGy 1.0 . 5.09 104 65 A 15 GLU H A 15 GLU HGx 1.0 . 5.09 105 66 A 15 GLU H A 15 GLU HGx 1.0 . 4.43 106 66 A 15 GLU H A 15 GLU HGy 1.0 . 4.43 107 67 A 15 GLU H A 18 VAL HGx% 1.0 . 4.96 108 67 A 15 GLU H A 18 VAL HGy% 1.0 . 4.96 109 68 A 15 GLU H A 51 ILE HA 1.0 . 5.23 110 69 A 15 GLU H A 51 ILE HD1% 1.0 . 5.50 111 70 A 15 GLU H A 52 ASP H 1.0 . 5.07 112 71 A 15 GLU HBx A 18 VAL HGx% 1.0 . 4.21 113 71 A 18 VAL HGy% A 15 GLU HBx 1.0 . 4.21 114 72 A 15 GLU HBy A 18 VAL HGx% 1.0 . 3.69 115 72 A 18 VAL HGy% A 15 GLU HBy 1.0 . 3.69 116 73 A 15 GLU HBy A 51 ILE HG2% 1.0 . 5.16 117 74 A 15 GLU HGy A 18 VAL HGy% 1.0 . 3.85 118 74 A 15 GLU HGy A 18 VAL HGx% 1.0 . 3.85 119 75 A 18 VAL HGy% A 15 GLU HGx 1.0 . 3.85 120 75 A 15 GLU HGx A 18 VAL HGx% 1.0 . 3.85 121 76 B 123 SER HA A 15 GLU HGx 1.0 . 4.56 122 76 A 15 GLU HGy B 123 SER HA 1.0 . 4.56 123 77 A 52 ASP H A 16 SER HA 1.0 . 4.85 124 78 A 52 ASP HBy A 16 SER HA 1.0 . 5.50 125 79 A 16 SER HA A 52 ASP HBx 1.0 . 5.50 126 80 A 16 SER HA A 55 LEU HDx% 1.0 . 4.99 127 81 A 16 SER HA A 55 LEU HDy% 1.0 . 5.02 128 82 A 17 HIS HD2 A 16 SER HBy 1.0 . 4.60 129 83 A 17 HIS HD2 A 16 SER HBx 1.0 . 4.60 130 84 A 52 ASP H A 16 SER HBx 1.0 . 4.59 131 84 A 52 ASP H A 16 SER HBy 1.0 . 4.59 132 85 A 16 SER HBy A 52 ASP HBx 1.0 . 4.76 133 85 A 16 SER HBx A 52 ASP HBx 1.0 . 4.76 134 85 A 52 ASP HBy A 16 SER HBx 1.0 . 4.76 135 85 A 52 ASP HBy A 16 SER HBy 1.0 . 4.76 136 86 A 55 LEU HDy% A 16 SER HBx 1.0 . 4.50 137 86 A 55 LEU HDy% A 16 SER HBy 1.0 . 4.50 138 87 A 17 HIS HD2 A 17 HIS HA 1.0 . 4.68 139 88 A 55 LEU HDy% A 17 HIS HD2 1.0 . 4.70 140 89 A 17 HIS HD2 A 17 HIS HBx 1.0 . 3.76 141 89 A 17 HIS HD2 A 17 HIS HBy 1.0 . 3.76 142 90 A 17 HIS HE1 A 17 HIS HBx 1.0 . 4.84 143 90 A 17 HIS HBy A 17 HIS HE1 1.0 . 4.84 144 91 A 18 VAL H A 17 HIS HBx 1.0 . 4.50 145 91 A 17 HIS HBy A 18 VAL H 1.0 . 4.50 146 92 A 18 VAL H A 18 VAL HGx% 1.0 . 3.50 147 92 A 18 VAL HGy% A 18 VAL H 1.0 . 3.50 148 93 A 18 VAL HA A 18 VAL HGx% 1.0 . 3.80 149 93 A 18 VAL HGy% A 18 VAL HA 1.0 . 3.80 150 94 A 18 VAL HA A 19 ALA HB% 1.0 . 5.37 151 95 A 51 ILE HG2% A 18 VAL HB 1.0 . 3.85 152 96 A 55 LEU HDx% A 18 VAL HB 1.0 . 4.50 153 97 A 18 VAL HB A 57 TRP HZ2 1.0 . 5.13 154 98 B 121 TYS HBx A 18 VAL HGx% 1.0 . 5.10 155 98 A 18 VAL HGy% B 121 TYS HBx 1.0 . 5.10 156 99 B 121 TYS HBy A 18 VAL HGx% 1.0 . 4.91 157 99 A 18 VAL HGy% B 121 TYS HBy 1.0 . 4.91 158 100 A 19 ALA H A 18 VAL HGx% 1.0 . 4.97 159 100 A 18 VAL HGy% A 19 ALA H 1.0 . 4.97 160 101 A 22 ASN H A 18 VAL HGx% 1.0 . 4.45 161 101 A 18 VAL HGy% A 22 ASN H 1.0 . 4.45 162 102 A 22 ASN HBy A 18 VAL HGx% 1.0 . 5.50 163 102 A 18 VAL HGy% A 22 ASN HBy 1.0 . 5.50 164 103 A 22 ASN HBx A 18 VAL HGx% 1.0 . 4.69 165 103 A 18 VAL HGy% A 22 ASN HBx 1.0 . 4.69 166 104 A 18 VAL HGy% A 22 ASN HD2x 1.0 . 5.22 167 104 A 18 VAL HGx% A 22 ASN HD2x 1.0 . 5.22 168 104 A 22 ASN HD2y A 18 VAL HGx% 1.0 . 5.22 169 104 A 18 VAL HGy% A 22 ASN HD2y 1.0 . 5.22 170 105 A 23 VAL H A 18 VAL HGx% 1.0 . 4.32 171 105 A 18 VAL HGy% A 23 VAL H 1.0 . 4.32 172 106 A 52 ASP H A 18 VAL HGx% 1.0 . 4.79 173 106 A 52 ASP H A 18 VAL HGy% 1.0 . 4.79 174 107 A 57 TRP HE1 A 18 VAL HGx% 1.0 . 5.11 175 107 A 18 VAL HGy% A 57 TRP HE1 1.0 . 5.11 176 108 A 57 TRP HH2 A 18 VAL HGx% 1.0 . 3.58 177 108 A 18 VAL HGy% A 57 TRP HH2 1.0 . 3.58 178 109 A 57 TRP HZ2 A 18 VAL HGx% 1.0 . 3.55 179 109 A 18 VAL HGy% A 57 TRP HZ2 1.0 . 3.55 180 110 A 19 ALA H A 22 ASN HBy 1.0 . 5.50 181 111 A 19 ALA H A 22 ASN HBx 1.0 . 5.50 182 112 A 19 ALA H A 22 ASN HD2x 1.0 . 5.34 183 112 A 19 ALA H A 22 ASN HD2y 1.0 . 5.34 184 113 A 19 ALA H A 23 VAL HGx% 1.0 . 5.30 185 114 A 19 ALA H A 23 VAL HGy% 1.0 . 5.30 186 115 A 57 TRP HE1 A 19 ALA HA 1.0 . 5.06 187 116 A 19 ALA HB% A 20 ARG H 1.0 . 4.91 188 117 A 19 ALA HB% A 21 ALA H 1.0 . 5.14 189 118 A 19 ALA HB% A 22 ASN HBy 1.0 . 4.88 190 119 A 19 ALA HB% A 22 ASN HBx 1.0 . 4.74 191 120 A 19 ALA HB% A 23 VAL HGy% 1.0 . 5.44 192 120 A 19 ALA HB% A 23 VAL HGx% 1.0 . 5.44 193 121 A 20 ARG H A 20 ARG HGy 1.0 . 5.50 194 122 A 20 ARG H A 20 ARG HGx 1.0 . 5.50 195 123 A 20 ARG HA A 20 ARG HDx 1.0 . 5.50 196 123 A 20 ARG HA A 20 ARG HDy 1.0 . 5.50 197 124 A 23 VAL H A 20 ARG HA 1.0 . 4.91 198 125 A 23 VAL HGx% A 20 ARG HA 1.0 . 5.50 199 126 A 20 ARG HA A 23 VAL HGy% 1.0 . 5.50 200 127 A 57 TRP HH2 A 20 ARG HA 1.0 . 5.36 201 128 A 57 TRP HZ2 A 20 ARG HA 1.0 . 5.17 202 129 A 21 ALA H A 20 ARG HBy 1.0 . 5.50 203 130 A 21 ALA H A 20 ARG HBx 1.0 . 5.50 204 131 A 57 TRP HH2 A 20 ARG HBx 1.0 . 4.88 205 131 A 57 TRP HH2 A 20 ARG HBy 1.0 . 4.88 206 132 A 23 VAL H A 20 ARG HDx 1.0 . 5.04 207 132 A 23 VAL H A 20 ARG HDy 1.0 . 5.04 208 133 A 57 TRP HBy A 20 ARG HDx 1.0 . 5.50 209 133 A 20 ARG HDy A 57 TRP HBy 1.0 . 5.50 210 134 A 57 TRP HBx A 20 ARG HDx 1.0 . 5.50 211 134 A 20 ARG HDy A 57 TRP HBx 1.0 . 5.50 212 135 A 61 TYR HE% A 20 ARG HDx 1.0 . 4.32 213 135 A 20 ARG HDy A 61 TYR HE% 1.0 . 4.32 214 136 A 21 ALA H A 21 ALA HB% 1.0 . 4.18 215 137 A 22 ASN H A 21 ALA H 1.0 . 4.85 216 138 A 23 VAL H A 21 ALA HA 1.0 . 4.69 217 139 A 22 ASN H A 21 ALA HB% 1.0 . 3.77 218 140 A 21 ALA HB% A 22 ASN HA 1.0 . 5.50 219 141 A 23 VAL H A 21 ALA HB% 1.0 . 5.50 220 142 A 22 ASN H A 22 ASN HBy 1.0 . 4.07 221 143 A 22 ASN H A 22 ASN HBx 1.0 . 3.97 222 144 A 22 ASN H A 23 VAL H 1.0 . 3.65 223 145 A 22 ASN HA A 43 LYS HBy 1.0 . 5.28 224 146 A 22 ASN HA A 43 LYS HBx 1.0 . 5.28 225 147 A 22 ASN HA A 43 LYS HDy 1.0 . 4.73 226 148 A 22 ASN HA A 43 LYS HGy 1.0 . 5.47 227 149 A 22 ASN HA A 43 LYS HGx 1.0 . 5.31 228 150 A 22 ASN HBy A 23 VAL H 1.0 . 4.95 229 151 A 22 ASN HBy A 23 VAL HGy% 1.0 . 5.44 230 151 A 22 ASN HBy A 23 VAL HGx% 1.0 . 5.44 231 152 A 22 ASN HBy A 42 LEU HDy% 1.0 . 4.95 232 152 A 22 ASN HBy A 42 LEU HDx% 1.0 . 4.95 233 153 A 22 ASN HBy A 43 LYS HDy 1.0 . 5.50 234 154 A 22 ASN HBx A 23 VAL H 1.0 . 4.82 235 155 A 22 ASN HBx A 42 LEU HDy% 1.0 . 5.28 236 155 A 22 ASN HBx A 42 LEU HDx% 1.0 . 5.28 237 156 A 42 LEU HBx A 22 ASN HD2x 1.0 . 5.34 238 156 A 22 ASN HD2y A 42 LEU HBx 1.0 . 5.34 239 157 A 22 ASN HD2y A 42 LEU HDy% 1.0 . 5.27 240 157 A 22 ASN HD2x A 42 LEU HDy% 1.0 . 5.27 241 157 A 42 LEU HDx% A 22 ASN HD2x 1.0 . 5.27 242 157 A 22 ASN HD2y A 42 LEU HDx% 1.0 . 5.27 243 158 A 23 VAL H A 23 VAL HGx% 1.0 . 4.42 244 159 A 23 VAL H A 23 VAL HGy% 1.0 . 4.42 245 160 A 23 VAL H A 23 VAL HGy% 1.0 . 3.29 246 160 A 23 VAL H A 23 VAL HGx% 1.0 . 3.29 247 161 A 23 VAL HB A 42 LEU H 1.0 . 5.50 248 162 A 24 LYS H A 23 VAL HGy% 1.0 . 4.35 249 162 A 23 VAL HGx% A 24 LYS H 1.0 . 4.35 250 163 D 307 TYS HBx A 23 VAL HGy% 1.0 . 4.16 251 163 A 23 VAL HGx% D 307 TYS HBx 1.0 . 4.16 252 164 D 307 TYS HBy A 23 VAL HGy% 1.0 . 3.75 253 164 A 23 VAL HGx% D 307 TYS HBy 1.0 . 3.75 254 165 A 40 ALA HA A 23 VAL HGy% 1.0 . 4.96 255 165 A 23 VAL HGx% A 40 ALA HA 1.0 . 4.96 256 166 A 42 LEU H A 23 VAL HGy% 1.0 . 5.44 257 166 A 23 VAL HGx% A 42 LEU H 1.0 . 5.44 258 167 A 57 TRP HH2 A 23 VAL HGy% 1.0 . 3.86 259 167 A 57 TRP HH2 A 23 VAL HGx% 1.0 . 3.86 260 168 A 57 TRP HZ2 A 23 VAL HGy% 1.0 . 3.74 261 168 A 57 TRP HZ2 A 23 VAL HGx% 1.0 . 3.74 262 169 A 24 LYS H A 24 LYS HGy 1.0 . 4.72 263 170 A 24 LYS H A 24 LYS HGx 1.0 . 4.72 264 171 A 24 LYS H A 24 LYS HDx 1.0 . 4.46 265 171 A 24 LYS H A 24 LYS HDy 1.0 . 4.46 266 172 A 24 LYS H A 24 LYS HGx 1.0 . 4.02 267 172 A 24 LYS H A 24 LYS HGy 1.0 . 4.02 268 173 A 24 LYS H A 25 HIS H 1.0 . 3.98 269 174 A 24 LYS H A 41 ARG H 1.0 . 4.79 270 175 A 24 LYS H A 41 ARG O 1.0 . 2.00 271 176 A 43 LYS HGx A 24 LYS H 1.0 . 5.50 272 177 A 24 LYS HA A 24 LYS HDx 1.0 . 4.68 273 177 A 24 LYS HDy A 24 LYS HA 1.0 . 4.68 274 178 A 24 LYS HA A 43 LYS HDx 1.0 . 5.05 275 179 A 43 LYS HDy A 24 LYS HA 1.0 . 5.50 276 180 A 43 LYS HGy A 24 LYS HA 1.0 . 5.36 277 181 A 43 LYS HGx A 24 LYS HA 1.0 . 5.30 278 182 A 24 LYS HEy A 24 LYS HBy 1.0 . 3.57 279 182 A 24 LYS HBy A 24 LYS HEx 1.0 . 3.57 280 183 A 25 HIS H A 24 LYS HBy 1.0 . 4.03 281 184 A 24 LYS HEy A 24 LYS HBx 1.0 . 3.57 282 184 A 24 LYS HBx A 24 LYS HEx 1.0 . 3.57 283 185 A 25 HIS H A 24 LYS HBx 1.0 . 4.03 284 186 A 24 LYS HGy A 43 LYS HA 1.0 . 4.57 285 187 A 43 LYS HA A 24 LYS HGx 1.0 . 4.57 286 188 A 41 ARG O A 24 LYS N 1.0 . 3.00 287 189 A 24 LYS HBy A 24 LYS HDx 1.0 . 2.65 288 189 A 24 LYS HBx A 24 LYS HDx 1.0 . 2.65 289 189 A 24 LYS HDy A 24 LYS HBx 1.0 . 2.65 290 189 A 24 LYS HDy A 24 LYS HBy 1.0 . 2.65 291 190 A 24 LYS HBy A 24 LYS HEx 1.0 . 2.91 292 190 A 24 LYS HBx A 24 LYS HEx 1.0 . 2.91 293 190 A 24 LYS HEy A 24 LYS HBx 1.0 . 2.91 294 190 A 24 LYS HEy A 24 LYS HBy 1.0 . 2.91 295 191 A 41 ARG H A 24 LYS HBx 1.0 . 4.63 296 191 A 41 ARG H A 24 LYS HBy 1.0 . 4.63 297 192 A 43 LYS HA A 24 LYS HBx 1.0 . 5.34 298 192 A 43 LYS HA A 24 LYS HBy 1.0 . 5.34 299 193 A 25 HIS H A 24 LYS HDx 1.0 . 5.50 300 193 A 24 LYS HDy A 25 HIS H 1.0 . 5.50 301 194 A 41 ARG H A 24 LYS HEx 1.0 . 5.12 302 194 A 41 ARG H A 24 LYS HEy 1.0 . 5.12 303 195 A 43 LYS H A 24 LYS HEx 1.0 . 5.50 304 195 A 24 LYS HEy A 43 LYS H 1.0 . 5.50 305 196 A 43 LYS HA A 24 LYS HEx 1.0 . 4.80 306 196 A 24 LYS HEy A 43 LYS HA 1.0 . 4.80 307 197 A 25 HIS H A 24 LYS HGx 1.0 . 3.88 308 197 A 24 LYS HGy A 25 HIS H 1.0 . 3.88 309 198 A 43 LYS H A 24 LYS HGx 1.0 . 4.12 310 198 A 24 LYS HGy A 43 LYS H 1.0 . 4.12 311 199 A 43 LYS HA A 24 LYS HGx 1.0 . 3.80 312 199 A 24 LYS HGy A 43 LYS HA 1.0 . 3.80 313 200 A 40 ALA HA A 25 HIS H 1.0 . 5.45 314 201 A 25 HIS H A 40 ALA HB% 1.0 . 5.50 315 202 A 25 HIS H A 41 ARG H 1.0 . 4.32 316 203 A 25 HIS HA C 229 LEU HA 1.0 . 5.50 317 204 A 25 HIS HA C 229 LEU HD21 1.0 . 5.06 318 204 A 25 HIS HA C 229 LEU HD11 1.0 . 5.06 319 205 A 25 HIS HBy C 229 LEU HD21 1.0 . 5.38 320 205 C 229 LEU HD11 A 25 HIS HBy 1.0 . 5.38 321 206 A 25 HIS HBy A 26 LEU H 1.0 . 4.88 322 207 A 25 HIS HBx C 229 LEU HD21 1.0 . 4.70 323 207 C 229 LEU HD11 A 25 HIS HBx 1.0 . 4.70 324 208 A 26 LEU H A 25 HIS HBx 1.0 . 4.96 325 209 A 25 HIS HD2 C 227 LYS HDx 1.0 . 5.50 326 210 A 25 HIS HD2 C 227 LYS HDy 1.0 . 5.50 327 211 A 25 HIS HD2 C 227 LYS HGx 1.0 . 5.50 328 212 A 25 HIS HD2 C 227 LYS HGy 1.0 . 5.50 329 213 A 25 HIS HD2 C 227 LYS HBx 1.0 . 5.50 330 213 A 25 HIS HD2 C 227 LYS HBy 1.0 . 5.50 331 214 A 25 HIS HD2 C 227 LYS HEy 1.0 . 5.34 332 214 A 25 HIS HD2 C 227 LYS HEx 1.0 . 5.34 333 215 A 25 HIS HD2 C 229 LEU HD21 1.0 . 4.95 334 215 C 229 LEU HD11 A 25 HIS HD2 1.0 . 4.95 335 216 C 227 LYS HDx A 25 HIS HE1 1.0 . 4.30 336 217 C 227 LYS HDy A 25 HIS HE1 1.0 . 4.30 337 218 A 25 HIS HE1 C 227 LYS HEy 1.0 . 4.56 338 218 C 227 LYS HEx A 25 HIS HE1 1.0 . 4.56 339 219 C 229 LEU HD11 A 25 HIS HE1 1.0 . 4.51 340 220 A 25 HIS HE1 C 229 LEU HD21 1.0 . 4.51 341 221 A 25 HIS HE1 A 27 LYS HEx 1.0 . 4.62 342 221 A 25 HIS HE1 A 27 LYS HEy 1.0 . 4.62 343 222 A 25 HIS HE1 A 41 ARG HBx 1.0 . 3.96 344 222 A 25 HIS HE1 A 41 ARG HBy 1.0 . 3.96 345 223 A 25 HIS HE1 A 41 ARG HDx 1.0 . 4.22 346 223 A 25 HIS HE1 A 41 ARG HDy 1.0 . 4.22 347 224 A 25 HIS HE1 A 41 ARG HGx 1.0 . 3.98 348 224 A 25 HIS HE1 A 41 ARG HGy 1.0 . 3.98 349 225 A 26 LEU H C 228 ILE H 1.0 . 4.87 350 226 A 26 LEU H C 228 ILE HB 1.0 . 5.36 351 227 A 26 LEU H C 228 ILE O 1.0 . 2.00 352 228 A 26 LEU H A 26 LEU HG 1.0 . 4.72 353 229 A 26 LEU H A 26 LEU HDx% 1.0 . 4.94 354 230 A 26 LEU H A 26 LEU HDy% 1.0 . 4.94 355 231 A 26 LEU H A 26 LEU HDy% 1.0 . 4.25 356 231 A 26 LEU H A 26 LEU HDx% 1.0 . 4.25 357 232 A 26 LEU HDx% A 26 LEU HA 1.0 . 5.20 358 233 A 26 LEU HA A 26 LEU HDy% 1.0 . 5.20 359 234 A 26 LEU HA A 26 LEU HDy% 1.0 . 3.69 360 234 A 26 LEU HDx% A 26 LEU HA 1.0 . 3.69 361 235 A 41 ARG H A 26 LEU HA 1.0 . 5.50 362 236 C 228 ILE H A 26 LEU HBy 1.0 . 5.04 363 237 C 228 ILE HB A 26 LEU HBy 1.0 . 5.50 364 238 A 26 LEU HDx% A 26 LEU HBy 1.0 . 4.20 365 239 A 26 LEU HBy A 26 LEU HDy% 1.0 . 4.20 366 240 A 61 TYR HE% A 26 LEU HBy 1.0 . 4.31 367 241 C 228 ILE H A 26 LEU HBx 1.0 . 4.82 368 242 C 228 ILE HB A 26 LEU HBx 1.0 . 5.04 369 243 A 26 LEU HBx A 27 LYS H 1.0 . 5.50 370 244 C 228 ILE O A 26 LEU N 1.0 . 3.00 371 245 C 228 ILE H A 26 LEU O 1.0 . 2.00 372 246 A 26 LEU O C 228 ILE N 1.0 . 3.00 373 247 C 228 ILE H A 26 LEU HDx% 1.0 . 5.50 374 248 A 26 LEU HDx% A 27 LYS H 1.0 . 5.50 375 249 A 57 TRP HH2 A 26 LEU HDx% 1.0 . 4.95 376 250 A 26 LEU HDx% A 57 TRP HZ3 1.0 . 5.19 377 251 C 228 ILE H A 26 LEU HDy% 1.0 . 5.50 378 252 A 27 LYS H A 26 LEU HDy% 1.0 . 5.50 379 253 A 57 TRP HH2 A 26 LEU HDy% 1.0 . 4.95 380 254 A 57 TRP HZ3 A 26 LEU HDy% 1.0 . 5.19 381 255 C 228 ILE HB A 26 LEU HDy% 1.0 . 4.80 382 255 C 228 ILE HB A 26 LEU HDx% 1.0 . 4.80 383 256 C 228 ILE HD11 A 26 LEU HDy% 1.0 . 3.35 384 256 A 26 LEU HDx% C 228 ILE HD11 1.0 . 3.35 385 257 A 26 LEU HDx% C 228 ILE HG1x 1.0 . 4.92 386 257 A 26 LEU HDy% C 228 ILE HG1x 1.0 . 4.92 387 257 C 228 ILE HG1y A 26 LEU HDy% 1.0 . 4.92 388 257 A 26 LEU HDx% C 228 ILE HG1y 1.0 . 4.92 389 258 C 228 ILE HG21 A 26 LEU HDy% 1.0 . 4.19 390 258 A 26 LEU HDx% C 228 ILE HG21 1.0 . 4.19 391 259 A 27 LYS H A 26 LEU HDy% 1.0 . 4.20 392 259 A 26 LEU HDx% A 27 LYS H 1.0 . 4.20 393 260 A 40 ALA HA A 26 LEU HDy% 1.0 . 4.51 394 260 A 40 ALA HA A 26 LEU HDx% 1.0 . 4.51 395 261 A 40 ALA HB% A 26 LEU HDy% 1.0 . 3.31 396 261 A 40 ALA HB% A 26 LEU HDx% 1.0 . 3.31 397 262 A 57 TRP HH2 A 26 LEU HDy% 1.0 . 4.10 398 262 A 57 TRP HH2 A 26 LEU HDx% 1.0 . 4.10 399 263 A 57 TRP HZ2 A 26 LEU HDy% 1.0 . 5.23 400 263 A 57 TRP HZ2 A 26 LEU HDx% 1.0 . 5.23 401 264 A 57 TRP HZ3 A 26 LEU HDy% 1.0 . 4.52 402 264 A 26 LEU HDx% A 57 TRP HZ3 1.0 . 4.52 403 265 A 26 LEU HDy% A 58 ILE HG1y 1.0 . 3.74 404 265 A 26 LEU HDx% A 58 ILE HG1y 1.0 . 3.74 405 265 A 58 ILE HG1x A 26 LEU HDy% 1.0 . 3.74 406 265 A 26 LEU HDx% A 58 ILE HG1x 1.0 . 3.74 407 266 A 61 TYR HBx A 26 LEU HDy% 1.0 . 4.96 408 266 A 26 LEU HDx% A 61 TYR HBx 1.0 . 4.96 409 267 A 61 TYR HBy A 26 LEU HDy% 1.0 . 5.44 410 267 A 26 LEU HDx% A 61 TYR HBy 1.0 . 5.44 411 268 A 61 TYR HD% A 26 LEU HDy% 1.0 . 3.94 412 268 A 26 LEU HDx% A 61 TYR HD% 1.0 . 3.94 413 269 A 61 TYR HE% A 26 LEU HDy% 1.0 . 4.30 414 269 A 61 TYR HE% A 26 LEU HDx% 1.0 . 4.30 415 270 A 62 LEU H A 26 LEU HDy% 1.0 . 4.88 416 270 A 26 LEU HDx% A 62 LEU H 1.0 . 4.88 417 271 A 27 LYS H A 27 LYS HGx 1.0 . 5.00 418 272 A 27 LYS H A 27 LYS HGy 1.0 . 4.95 419 273 A 27 LYS H A 28 ILE H 1.0 . 5.14 420 274 A 27 LYS H A 38 ILE HD1% 1.0 . 5.50 421 275 A 27 LYS H A 38 ILE HG2% 1.0 . 4.77 422 276 A 27 LYS H A 39 VAL H 1.0 . 4.43 423 277 A 27 LYS H A 39 VAL O 1.0 . 2.00 424 278 A 27 LYS H A 39 VAL HGx% 1.0 . 5.50 425 279 A 27 LYS H A 39 VAL HGy% 1.0 . 5.50 426 280 A 27 LYS H A 39 VAL HGy% 1.0 . 4.26 427 280 A 27 LYS H A 39 VAL HGx% 1.0 . 4.26 428 281 A 40 ALA HA A 27 LYS H 1.0 . 4.99 429 282 A 27 LYS HA A 27 LYS HDy 1.0 . 5.39 430 283 A 27 LYS HA A 27 LYS HDx 1.0 . 5.39 431 284 A 27 LYS HEy A 27 LYS HA 1.0 . 5.50 432 285 A 27 LYS HA A 27 LYS HEx 1.0 . 5.50 433 286 A 27 LYS HDy C 225 HIS HD2 1.0 . 5.50 434 287 A 27 LYS HDy C 225 HIS HE1 1.0 . 4.30 435 288 A 27 LYS HDx C 225 HIS HD2 1.0 . 5.50 436 289 A 27 LYS HDx C 225 HIS HE1 1.0 . 4.30 437 290 A 27 LYS HGx C 225 HIS HD2 1.0 . 5.50 438 291 A 27 LYS HGx A 27 LYS HDy 1.0 . 2.40 439 292 A 27 LYS HEy A 27 LYS HGx 1.0 . 4.09 440 293 A 27 LYS HGx A 27 LYS HEx 1.0 . 4.09 441 294 A 27 LYS HGx A 28 ILE H 1.0 . 4.82 442 295 A 27 LYS HGy C 225 HIS HD2 1.0 . 5.50 443 296 A 39 VAL O A 27 LYS N 1.0 . 3.00 444 297 A 39 VAL H A 27 LYS O 1.0 . 2.00 445 298 A 27 LYS O A 39 VAL N 1.0 . 3.00 446 299 C 225 HIS HD2 A 27 LYS HBx 1.0 . 5.50 447 299 C 225 HIS HD2 A 27 LYS HBy 1.0 . 5.50 448 300 A 27 LYS HEy A 27 LYS HBy 1.0 . 4.67 449 300 A 27 LYS HEy A 27 LYS HBx 1.0 . 4.67 450 301 A 27 LYS HBx A 27 LYS HEx 1.0 . 4.67 451 301 A 27 LYS HBy A 27 LYS HEx 1.0 . 4.67 452 302 A 27 LYS HBx A 27 LYS HEx 1.0 . 4.10 453 302 A 27 LYS HBy A 27 LYS HEx 1.0 . 4.10 454 302 A 27 LYS HEy A 27 LYS HBx 1.0 . 4.10 455 302 A 27 LYS HEy A 27 LYS HBy 1.0 . 4.10 456 303 A 28 ILE H A 27 LYS HBx 1.0 . 5.17 457 303 A 28 ILE H A 27 LYS HBy 1.0 . 5.17 458 304 A 39 VAL H A 27 LYS HBx 1.0 . 4.79 459 304 A 39 VAL H A 27 LYS HBy 1.0 . 4.79 460 305 C 225 HIS HD2 A 27 LYS HEx 1.0 . 5.34 461 305 A 27 LYS HEy C 225 HIS HD2 1.0 . 5.34 462 306 C 225 HIS HE1 A 27 LYS HEx 1.0 . 4.56 463 306 A 27 LYS HEy C 225 HIS HE1 1.0 . 4.56 464 307 A 27 LYS HEy A 29 LEU HDy% 1.0 . 4.17 465 307 A 27 LYS HEx A 29 LEU HDy% 1.0 . 4.17 466 307 A 29 LEU HDx% A 27 LYS HEx 1.0 . 4.17 467 307 A 29 LEU HDx% A 27 LYS HEy 1.0 . 4.17 468 308 A 28 ILE H C 226 LEU H 1.0 . 4.87 469 309 A 28 ILE H C 226 LEU HBx 1.0 . 5.04 470 310 A 28 ILE H C 226 LEU HBy 1.0 . 4.82 471 311 A 28 ILE H C 226 LEU O 1.0 . 2.00 472 312 A 28 ILE H C 226 LEU HD11 1.0 . 5.50 473 313 A 28 ILE H C 226 LEU HD21 1.0 . 5.50 474 314 A 28 ILE H A 28 ILE HD1% 1.0 . 4.36 475 315 A 28 ILE H A 28 ILE HG1x 1.0 . 4.43 476 315 A 28 ILE H A 28 ILE HG1y 1.0 . 4.43 477 316 A 28 ILE H A 28 ILE HG2% 1.0 . 4.67 478 317 A 28 ILE HD1% A 28 ILE HA 1.0 . 4.47 479 318 A 38 ILE HD1% A 28 ILE HA 1.0 . 5.50 480 319 A 38 ILE HG2% A 28 ILE HA 1.0 . 4.86 481 320 C 226 LEU H A 28 ILE HB 1.0 . 5.36 482 321 C 226 LEU HBx A 28 ILE HB 1.0 . 5.50 483 322 C 226 LEU HBy A 28 ILE HB 1.0 . 5.04 484 323 A 28 ILE HB C 226 LEU HD21 1.0 . 4.80 485 323 A 28 ILE HB C 226 LEU HD11 1.0 . 4.80 486 324 A 28 ILE HB C 261 TYR HE% 1.0 . 3.98 487 325 A 28 ILE HD1% A 28 ILE HB 1.0 . 3.70 488 326 A 28 ILE HB A 29 LEU H 1.0 . 4.32 489 327 C 226 LEU O A 28 ILE N 1.0 . 3.00 490 328 C 226 LEU H A 28 ILE O 1.0 . 2.00 491 329 A 28 ILE O C 226 LEU N 1.0 . 3.00 492 330 A 28 ILE HD1% C 226 LEU HD21 1.0 . 3.35 493 330 A 28 ILE HD1% C 226 LEU HD11 1.0 . 3.35 494 331 A 28 ILE HD1% C 261 TYR HD% 1.0 . 3.71 495 332 A 28 ILE HD1% C 261 TYR HE% 1.0 . 3.83 496 333 A 28 ILE HD1% C 262 LEU HA 1.0 . 4.78 497 334 A 28 ILE HD1% A 29 LEU H 1.0 . 5.30 498 335 A 28 ILE HG1x C 226 LEU HD21 1.0 . 4.92 499 335 A 28 ILE HG1y C 226 LEU HD21 1.0 . 4.92 500 335 C 226 LEU HD11 A 28 ILE HG1x 1.0 . 4.92 501 335 A 28 ILE HG1y C 226 LEU HD11 1.0 . 4.92 502 336 C 261 TYR HE% A 28 ILE HG1x 1.0 . 4.43 503 336 A 28 ILE HG1y C 261 TYR HE% 1.0 . 4.43 504 337 A 29 LEU H A 28 ILE HG1x 1.0 . 5.17 505 337 A 28 ILE HG1y A 29 LEU H 1.0 . 5.17 506 338 A 28 ILE HG2% C 226 LEU HD21 1.0 . 4.19 507 338 A 28 ILE HG2% C 226 LEU HD11 1.0 . 4.19 508 339 A 28 ILE HG2% C 261 TYR HD% 1.0 . 3.85 509 340 A 28 ILE HG2% C 261 TYR HE% 1.0 . 3.52 510 341 A 28 ILE HD1% A 28 ILE HG2% 1.0 . 3.20 511 342 A 28 ILE HG2% A 28 ILE HG1x 1.0 . 3.93 512 342 A 28 ILE HG1y A 28 ILE HG2% 1.0 . 3.93 513 343 A 28 ILE HG2% A 29 LEU H 1.0 . 4.41 514 344 A 28 ILE HG2% A 36 CYS HA 1.0 . 5.50 515 345 A 38 ILE HD1% A 28 ILE HG2% 1.0 . 3.59 516 346 A 28 ILE HG2% A 38 ILE HG1x 1.0 . 4.08 517 346 A 28 ILE HG2% A 38 ILE HG1y 1.0 . 4.08 518 347 A 29 LEU HDx% A 29 LEU H 1.0 . 4.75 519 348 A 29 LEU H A 29 LEU HDy% 1.0 . 4.75 520 349 A 29 LEU H A 29 LEU HDy% 1.0 . 3.92 521 349 A 29 LEU HDx% A 29 LEU H 1.0 . 3.92 522 350 A 29 LEU H A 37 GLN H 1.0 . 4.69 523 351 A 29 LEU H A 37 GLN HBx 1.0 . 5.50 524 351 A 29 LEU H A 37 GLN HBy 1.0 . 5.50 525 352 A 29 LEU HA C 225 HIS HA 1.0 . 5.50 526 353 A 29 LEU HA A 37 GLN HBx 1.0 . 5.50 527 353 A 37 GLN HBy A 29 LEU HA 1.0 . 5.50 528 354 A 29 LEU HDx% C 225 HIS HE1 1.0 . 4.51 529 355 A 29 LEU HDx% A 30 ASN H 1.0 . 5.50 530 356 C 225 HIS HE1 A 29 LEU HDy% 1.0 . 4.51 531 357 A 30 ASN H A 29 LEU HDy% 1.0 . 5.50 532 358 B 112 TYS HBx A 29 LEU HDy% 1.0 . 4.36 533 358 A 29 LEU HDx% B 112 TYS HBx 1.0 . 4.36 534 359 B 112 TYS HBy A 29 LEU HDy% 1.0 . 4.36 535 359 A 29 LEU HDx% B 112 TYS HBy 1.0 . 4.36 536 360 C 225 HIS HA A 29 LEU HDy% 1.0 . 5.06 537 360 A 29 LEU HDx% C 225 HIS HA 1.0 . 5.06 538 361 C 225 HIS HBx A 29 LEU HDy% 1.0 . 5.38 539 361 A 29 LEU HDx% C 225 HIS HBx 1.0 . 5.38 540 362 C 225 HIS HBy A 29 LEU HDy% 1.0 . 4.70 541 362 A 29 LEU HDx% C 225 HIS HBy 1.0 . 4.70 542 363 C 225 HIS HD2 A 29 LEU HDy% 1.0 . 4.95 543 363 A 29 LEU HDx% C 225 HIS HD2 1.0 . 4.95 544 364 A 31 THR HG2% A 31 THR H 1.0 . 5.50 545 365 A 31 THR HB A 32 PRO HDx 1.0 . 4.89 546 365 A 31 THR HB A 32 PRO HDy 1.0 . 4.89 547 366 A 31 THR HG2% A 32 PRO HDx 1.0 . 4.34 548 366 A 31 THR HG2% A 32 PRO HDy 1.0 . 4.34 549 367 A 31 THR HG2% A 34 CYS HBy 1.0 . 5.38 550 368 A 31 THR HG2% A 34 CYS HBx 1.0 . 5.35 551 369 A 31 THR HG2% A 37 GLN HE2y 1.0 . 5.34 552 369 A 31 THR HG2% A 37 GLN HE2x 1.0 . 5.34 553 370 A 34 CYS HBy A 37 GLN HE2y 1.0 . 5.14 554 371 A 34 CYS HBy A 37 GLN HE2x 1.0 . 5.14 555 372 A 34 CYS HBy A 37 GLN HE2y 1.0 . 4.51 556 372 A 34 CYS HBy A 37 GLN HE2x 1.0 . 4.51 557 373 A 35 ALA HB% A 36 CYS H 1.0 . 5.50 558 374 A 37 GLN HE2y A 35 ALA HB% 1.0 . 5.50 559 375 A 37 GLN HE2x A 35 ALA HB% 1.0 . 5.50 560 376 A 35 ALA HB% A 54 LYS HDx 1.0 . 5.27 561 376 A 35 ALA HB% A 54 LYS HDy 1.0 . 5.27 562 377 A 36 CYS CB C 265 CYS CB 1.0 . 3.99 563 378 A 36 CYS CB C 265 CYS SG 1.0 . 3.10 564 379 A 37 GLN H A 36 CYS HBy 1.0 . 5.50 565 380 A 37 GLN H A 36 CYS HBx 1.0 . 5.50 566 381 C 265 CYS CB A 36 CYS SG 1.0 . 3.10 567 382 C 265 CYS SG A 36 CYS SG 1.0 . 2.10 568 383 A 37 GLN H A 37 GLN HE2y 1.0 . 4.95 569 383 A 37 GLN H A 37 GLN HE2x 1.0 . 4.95 570 384 A 37 GLN H A 37 GLN HGx 1.0 . 4.76 571 384 A 37 GLN H A 37 GLN HGy 1.0 . 4.76 572 385 A 37 GLN H A 53 PRO HGx 1.0 . 4.54 573 386 A 37 GLN HE2y A 37 GLN HBx 1.0 . 5.09 574 386 A 37 GLN HBy A 37 GLN HE2y 1.0 . 5.09 575 387 A 37 GLN HE2x A 37 GLN HBx 1.0 . 5.09 576 387 A 37 GLN HBy A 37 GLN HE2x 1.0 . 5.09 577 388 A 37 GLN HE2x A 37 GLN HBx 1.0 . 4.26 578 388 A 37 GLN HE2y A 37 GLN HBx 1.0 . 4.26 579 388 A 37 GLN HBy A 37 GLN HE2y 1.0 . 4.26 580 388 A 37 GLN HBy A 37 GLN HE2x 1.0 . 4.26 581 389 A 38 ILE H A 37 GLN HBx 1.0 . 4.93 582 389 A 37 GLN HBy A 38 ILE H 1.0 . 4.93 583 390 A 37 GLN HE2x A 39 VAL HGy% 1.0 . 4.93 584 390 A 39 VAL HGx% A 37 GLN HE2y 1.0 . 4.93 585 390 A 39 VAL HGx% A 37 GLN HE2x 1.0 . 4.93 586 390 A 37 GLN HE2y A 39 VAL HGy% 1.0 . 4.93 587 391 A 37 GLN HE2y A 53 PRO HGx 1.0 . 4.94 588 391 A 37 GLN HE2x A 53 PRO HGx 1.0 . 4.94 589 392 A 38 ILE H A 38 ILE HB 1.0 . 3.95 590 393 A 38 ILE HD1% A 38 ILE H 1.0 . 4.16 591 394 A 38 ILE H A 38 ILE HG1x 1.0 . 5.26 592 394 A 38 ILE HG1y A 38 ILE H 1.0 . 5.26 593 395 A 38 ILE HG2% A 38 ILE H 1.0 . 4.15 594 396 A 38 ILE H A 51 ILE H 1.0 . 5.50 595 397 A 38 ILE HD1% A 38 ILE HA 1.0 . 5.26 596 398 A 38 ILE HG2% A 38 ILE HA 1.0 . 4.16 597 399 A 38 ILE HD1% A 38 ILE HB 1.0 . 3.64 598 400 A 39 VAL H A 38 ILE HB 1.0 . 4.16 599 401 A 38 ILE HB A 51 ILE H 1.0 . 5.35 600 402 A 38 ILE HB A 51 ILE HB 1.0 . 5.27 601 403 A 51 ILE HG2% A 38 ILE HB 1.0 . 4.13 602 404 A 38 ILE HB A 58 ILE HG1y 1.0 . 5.34 603 404 A 58 ILE HG1x A 38 ILE HB 1.0 . 5.34 604 405 A 51 ILE H A 38 ILE O 1.0 . 2.00 605 406 A 38 ILE O A 51 ILE N 1.0 . 3.00 606 407 A 38 ILE HD1% A 51 ILE HB 1.0 . 4.61 607 408 A 38 ILE HD1% A 58 ILE HD1% 1.0 . 3.27 608 409 A 38 ILE HD1% A 58 ILE HG1y 1.0 . 4.19 609 409 A 58 ILE HG1x A 38 ILE HD1% 1.0 . 4.19 610 410 A 38 ILE HD1% A 58 ILE HG2% 1.0 . 3.35 611 411 A 39 VAL H A 38 ILE HG1x 1.0 . 5.50 612 411 A 39 VAL H A 38 ILE HG1y 1.0 . 5.50 613 412 A 38 ILE HG1x A 58 ILE HG1y 1.0 . 5.34 614 412 A 38 ILE HG1y A 58 ILE HG1y 1.0 . 5.34 615 412 A 58 ILE HG1x A 38 ILE HG1x 1.0 . 5.34 616 412 A 58 ILE HG1x A 38 ILE HG1y 1.0 . 5.34 617 413 A 38 ILE HG2% A 38 ILE HG1x 1.0 . 3.96 618 413 A 38 ILE HG2% A 38 ILE HG1y 1.0 . 3.96 619 414 A 38 ILE HG2% A 39 VAL H 1.0 . 4.17 620 415 A 38 ILE HG2% A 51 ILE H 1.0 . 5.50 621 416 A 38 ILE HG2% A 51 ILE HB 1.0 . 4.39 622 417 A 38 ILE HG2% A 51 ILE HG1x 1.0 . 4.41 623 417 A 38 ILE HG2% A 51 ILE HG1y 1.0 . 4.41 624 418 A 38 ILE HG2% A 53 PRO HDx 1.0 . 5.50 625 418 A 53 PRO HDy A 38 ILE HG2% 1.0 . 5.50 626 419 A 39 VAL H A 39 VAL HGx% 1.0 . 4.44 627 420 A 39 VAL H A 39 VAL HGy% 1.0 . 4.44 628 421 A 39 VAL H A 39 VAL HGy% 1.0 . 3.42 629 421 A 39 VAL H A 39 VAL HGx% 1.0 . 3.42 630 422 A 39 VAL HA A 50 CYS HA 1.0 . 5.48 631 423 A 51 ILE H A 39 VAL HA 1.0 . 4.43 632 424 A 39 VAL HGx% A 40 ALA H 1.0 . 4.76 633 425 A 40 ALA H A 39 VAL HGy% 1.0 . 4.76 634 426 A 40 ALA H A 39 VAL HGy% 1.0 . 3.80 635 426 A 39 VAL HGx% A 40 ALA H 1.0 . 3.80 636 427 A 49 VAL H A 39 VAL HGy% 1.0 . 4.22 637 427 A 39 VAL HGx% A 49 VAL H 1.0 . 4.22 638 428 A 40 ALA HB% A 40 ALA H 1.0 . 4.13 639 429 A 40 ALA H A 49 VAL H 1.0 . 4.69 640 430 A 40 ALA H A 49 VAL O 1.0 . 2.00 641 431 A 51 ILE H A 40 ALA H 1.0 . 5.12 642 432 A 49 VAL O A 40 ALA N 1.0 . 3.00 643 433 A 49 VAL H A 40 ALA O 1.0 . 2.00 644 434 A 40 ALA O A 49 VAL N 1.0 . 3.00 645 435 A 41 ARG H A 40 ALA HB% 1.0 . 3.78 646 436 A 40 ALA HB% A 49 VAL H 1.0 . 4.89 647 437 A 40 ALA HB% A 49 VAL HB 1.0 . 5.43 648 438 A 40 ALA HB% A 49 VAL HGy% 1.0 . 3.15 649 439 A 40 ALA HB% A 51 ILE H 1.0 . 4.59 650 440 A 57 TRP HH2 A 40 ALA HB% 1.0 . 4.76 651 441 A 57 TRP HZ2 A 40 ALA HB% 1.0 . 4.94 652 442 A 41 ARG H A 41 ARG HBx 1.0 . 4.04 653 442 A 41 ARG H A 41 ARG HBy 1.0 . 4.04 654 443 A 41 ARG H A 41 ARG HDx 1.0 . 5.50 655 443 A 41 ARG H A 41 ARG HDy 1.0 . 5.50 656 444 A 41 ARG H A 41 ARG HGx 1.0 . 5.50 657 444 A 41 ARG H A 41 ARG HGy 1.0 . 5.50 658 445 A 41 ARG H A 49 VAL H 1.0 . 5.50 659 446 A 41 ARG HA A 41 ARG HDx 1.0 . 5.50 660 446 A 41 ARG HDy A 41 ARG HA 1.0 . 5.50 661 447 A 41 ARG HA A 48 GLN HA 1.0 . 5.50 662 448 A 41 ARG HA A 48 GLN HGy 1.0 . 5.50 663 449 A 41 ARG HA A 48 GLN HGx 1.0 . 5.50 664 450 A 49 VAL H A 41 ARG HA 1.0 . 5.50 665 451 A 41 ARG HBx A 41 ARG HDx 1.0 . 4.08 666 451 A 41 ARG HBy A 41 ARG HDx 1.0 . 4.08 667 451 A 41 ARG HDy A 41 ARG HBx 1.0 . 4.08 668 451 A 41 ARG HBy A 41 ARG HDy 1.0 . 4.08 669 452 A 42 LEU H A 41 ARG HBx 1.0 . 4.60 670 452 A 42 LEU H A 41 ARG HBy 1.0 . 4.60 671 453 A 41 ARG HBy A 48 GLN HGx 1.0 . 5.34 672 453 A 41 ARG HBx A 48 GLN HGx 1.0 . 5.34 673 453 A 48 GLN HGy A 41 ARG HBx 1.0 . 5.34 674 453 A 41 ARG HBy A 48 GLN HGy 1.0 . 5.34 675 454 A 42 LEU H A 41 ARG HDx 1.0 . 5.12 676 454 A 42 LEU H A 41 ARG HDy 1.0 . 5.12 677 455 A 41 ARG HDx A 48 GLN HBy 1.0 . 5.50 678 455 A 41 ARG HDy A 48 GLN HBy 1.0 . 5.50 679 456 A 41 ARG HDy A 48 GLN HBx 1.0 . 5.50 680 456 A 48 GLN HBx A 41 ARG HDx 1.0 . 5.50 681 457 A 41 ARG HDx A 48 GLN HGx 1.0 . 5.34 682 457 A 41 ARG HDy A 48 GLN HGx 1.0 . 5.34 683 457 A 48 GLN HGy A 41 ARG HDx 1.0 . 5.34 684 457 A 41 ARG HDy A 48 GLN HGy 1.0 . 5.34 685 458 A 42 LEU HBx A 42 LEU H 1.0 . 4.14 686 459 A 42 LEU H A 42 LEU HG 1.0 . 5.01 687 460 A 42 LEU HDx% A 42 LEU H 1.0 . 4.41 688 461 A 42 LEU H A 42 LEU HDy% 1.0 . 4.41 689 462 A 42 LEU H A 48 GLN HA 1.0 . 4.89 690 463 A 42 LEU H A 49 VAL H 1.0 . 5.47 691 464 A 42 LEU HDx% A 42 LEU HA 1.0 . 4.73 692 465 A 42 LEU HA A 42 LEU HDy% 1.0 . 4.73 693 466 A 42 LEU HA A 42 LEU HDy% 1.0 . 3.58 694 466 A 42 LEU HDx% A 42 LEU HA 1.0 . 3.58 695 467 A 42 LEU HBx A 43 LYS H 1.0 . 5.50 696 468 A 42 LEU HBx A 47 ARG H 1.0 . 3.45 697 469 A 42 LEU HDx% A 42 LEU HBy 1.0 . 4.24 698 470 A 42 LEU HBy A 42 LEU HDy% 1.0 . 4.24 699 471 A 43 LYS H A 42 LEU HBy 1.0 . 4.79 700 472 A 47 ARG H A 42 LEU HBy 1.0 . 4.67 701 473 A 42 LEU HG A 47 ARG H 1.0 . 5.22 702 474 A 42 LEU HG A 49 VAL HGx% 1.0 . 4.07 703 475 A 49 VAL HGy% A 42 LEU HG 1.0 . 4.17 704 476 A 42 LEU HDx% A 43 LYS H 1.0 . 4.61 705 477 A 43 LYS H A 42 LEU HDy% 1.0 . 4.61 706 478 A 43 LYS H A 42 LEU HDy% 1.0 . 3.81 707 478 A 42 LEU HDx% A 43 LYS H 1.0 . 3.81 708 479 A 42 LEU HDx% A 46 ASN HBx 1.0 . 4.88 709 479 A 42 LEU HDy% A 46 ASN HBx 1.0 . 4.88 710 479 A 46 ASN HBy A 42 LEU HDy% 1.0 . 4.88 711 479 A 42 LEU HDx% A 46 ASN HBy 1.0 . 4.88 712 480 A 47 ARG H A 42 LEU HDy% 1.0 . 4.54 713 480 A 42 LEU HDx% A 47 ARG H 1.0 . 4.54 714 481 A 47 ARG HA A 42 LEU HDy% 1.0 . 5.44 715 481 A 42 LEU HDx% A 47 ARG HA 1.0 . 5.44 716 482 A 42 LEU HDx% A 47 ARG HBx 1.0 . 4.60 717 482 A 42 LEU HDy% A 47 ARG HBx 1.0 . 4.60 718 482 A 47 ARG HBy A 42 LEU HDy% 1.0 . 4.60 719 482 A 42 LEU HDx% A 47 ARG HBy 1.0 . 4.60 720 483 A 42 LEU HDx% A 47 ARG HDx 1.0 . 4.17 721 483 A 42 LEU HDy% A 47 ARG HDx 1.0 . 4.17 722 483 A 47 ARG HDy A 42 LEU HDy% 1.0 . 4.17 723 483 A 42 LEU HDx% A 47 ARG HDy 1.0 . 4.17 724 484 A 48 GLN HA A 42 LEU HDy% 1.0 . 5.38 725 484 A 42 LEU HDx% A 48 GLN HA 1.0 . 5.38 726 485 A 49 VAL H A 42 LEU HDy% 1.0 . 5.44 727 485 A 42 LEU HDx% A 49 VAL H 1.0 . 5.44 728 486 A 49 VAL HB A 42 LEU HDy% 1.0 . 4.51 729 486 A 42 LEU HDx% A 49 VAL HB 1.0 . 4.51 730 487 A 43 LYS HDx A 43 LYS H 1.0 . 4.01 731 488 A 43 LYS HDy A 43 LYS H 1.0 . 4.03 732 489 A 43 LYS HGy A 43 LYS H 1.0 . 5.50 733 490 A 43 LYS HGx A 43 LYS H 1.0 . 4.13 734 491 A 43 LYS H A 43 LYS HEx 1.0 . 5.50 735 491 A 43 LYS H A 43 LYS HEy 1.0 . 5.50 736 492 A 43 LYS HDx A 43 LYS HA 1.0 . 4.98 737 493 A 43 LYS HDy A 43 LYS HA 1.0 . 5.40 738 494 A 43 LYS HA A 43 LYS HEx 1.0 . 4.74 739 494 A 43 LYS HA A 43 LYS HEy 1.0 . 4.74 740 495 A 43 LYS HBy A 43 LYS HEx 1.0 . 5.50 741 495 A 43 LYS HBy A 43 LYS HEy 1.0 . 5.50 742 496 A 43 LYS HBx A 43 LYS HEx 1.0 . 5.50 743 496 A 43 LYS HBx A 43 LYS HEy 1.0 . 5.50 744 497 A 46 ASN HA A 46 ASN HD2y 1.0 . 4.57 745 498 A 46 ASN HA A 46 ASN HD2x 1.0 . 4.57 746 499 A 46 ASN HA A 46 ASN HD2y 1.0 . 3.96 747 499 A 46 ASN HA A 46 ASN HD2x 1.0 . 3.96 748 500 A 47 ARG H A 46 ASN HBy 1.0 . 4.82 749 501 A 47 ARG H A 46 ASN HBx 1.0 . 4.82 750 502 A 47 ARG H A 46 ASN HBx 1.0 . 4.11 751 502 A 47 ARG H A 46 ASN HBy 1.0 . 4.11 752 503 A 47 ARG H A 47 ARG HDy 1.0 . 4.58 753 504 A 47 ARG H A 47 ARG HDx 1.0 . 4.58 754 505 A 47 ARG H A 47 ARG HDx 1.0 . 4.00 755 505 A 47 ARG H A 47 ARG HDy 1.0 . 4.00 756 506 A 47 ARG H A 47 ARG HGx 1.0 . 3.73 757 506 A 47 ARG H A 47 ARG HGy 1.0 . 3.73 758 507 A 47 ARG H A 48 GLN H 1.0 . 4.79 759 508 A 47 ARG HA A 47 ARG HDx 1.0 . 4.23 760 508 A 47 ARG HA A 47 ARG HDy 1.0 . 4.23 761 509 A 47 ARG HA A 48 GLN H 1.0 . 3.53 762 510 A 47 ARG HDy A 48 GLN H 1.0 . 5.50 763 511 A 48 GLN H A 47 ARG HDx 1.0 . 5.50 764 512 A 47 ARG HGy A 48 GLN H 1.0 . 4.92 765 513 A 48 GLN H A 47 ARG HGx 1.0 . 4.92 766 514 A 47 ARG HBx A 47 ARG HDx 1.0 . 3.35 767 514 A 47 ARG HBy A 47 ARG HDx 1.0 . 3.35 768 514 A 47 ARG HDy A 47 ARG HBx 1.0 . 3.35 769 514 A 47 ARG HBy A 47 ARG HDy 1.0 . 3.35 770 515 A 48 GLN H A 47 ARG HBx 1.0 . 4.03 771 515 A 47 ARG HBy A 48 GLN H 1.0 . 4.03 772 516 A 48 GLN H A 47 ARG HDx 1.0 . 4.78 773 516 A 47 ARG HDy A 48 GLN H 1.0 . 4.78 774 517 A 48 GLN H A 47 ARG HGx 1.0 . 4.05 775 517 A 47 ARG HGy A 48 GLN H 1.0 . 4.05 776 518 A 48 GLN HGy A 48 GLN H 1.0 . 5.27 777 519 A 48 GLN H A 48 GLN HGx 1.0 . 5.27 778 520 A 49 VAL H A 48 GLN HBy 1.0 . 4.98 779 521 A 49 VAL H A 48 GLN HBx 1.0 . 4.98 780 522 A 49 VAL H A 48 GLN HBy 1.0 . 4.25 781 522 A 49 VAL H A 48 GLN HBx 1.0 . 4.25 782 523 A 49 VAL H A 48 GLN HGx 1.0 . 5.34 783 523 A 49 VAL H A 48 GLN HGy 1.0 . 5.34 784 524 A 49 VAL H A 49 VAL HGx% 1.0 . 4.22 785 525 A 49 VAL H A 49 VAL HGy% 1.0 . 3.77 786 526 A 49 VAL HB A 50 CYS H 1.0 . 4.37 787 527 A 49 VAL HGx% A 50 CYS H 1.0 . 4.46 788 528 B 121 TYS HBx A 49 VAL HGy% 1.0 . 5.10 789 529 B 121 TYS HBy A 49 VAL HGy% 1.0 . 4.91 790 530 A 49 VAL HGy% A 50 CYS H 1.0 . 4.53 791 531 A 50 CYS HBy A 51 ILE H 1.0 . 5.33 792 532 A 51 ILE H A 50 CYS HBx 1.0 . 4.65 793 533 A 51 ILE HD1% A 51 ILE H 1.0 . 3.77 794 534 A 51 ILE H A 51 ILE HG1x 1.0 . 4.48 795 534 A 51 ILE H A 51 ILE HG1y 1.0 . 4.48 796 535 A 51 ILE HG2% A 51 ILE H 1.0 . 4.13 797 536 A 51 ILE HA A 51 ILE HD1% 1.0 . 4.60 798 537 A 51 ILE HA A 55 LEU HDx% 1.0 . 5.50 799 538 A 51 ILE HD1% A 51 ILE HB 1.0 . 3.86 800 539 A 52 ASP H A 51 ILE HB 1.0 . 4.60 801 540 A 51 ILE HB A 58 ILE HG1y 1.0 . 5.34 802 540 A 58 ILE HG1x A 51 ILE HB 1.0 . 5.34 803 541 A 52 ASP H A 51 ILE HG1y 1.0 . 5.17 804 542 A 52 ASP H A 51 ILE HG1x 1.0 . 5.17 805 543 A 52 ASP H A 51 ILE HD1% 1.0 . 5.04 806 544 A 51 ILE HD1% A 57 TRP HH2 1.0 . 4.77 807 545 A 51 ILE HD1% A 57 TRP HZ2 1.0 . 4.34 808 546 A 51 ILE HD1% A 58 ILE HG1y 1.0 . 5.06 809 546 A 51 ILE HD1% A 58 ILE HG1x 1.0 . 5.06 810 547 A 51 ILE HG1x A 58 ILE HG1y 1.0 . 4.82 811 547 A 51 ILE HG1y A 58 ILE HG1y 1.0 . 4.82 812 547 A 58 ILE HG1x A 51 ILE HG1x 1.0 . 4.82 813 547 A 58 ILE HG1x A 51 ILE HG1y 1.0 . 4.82 814 548 A 51 ILE HG2% A 51 ILE HG1y 1.0 . 3.50 815 549 A 51 ILE HG2% A 51 ILE HG1x 1.0 . 3.50 816 550 A 51 ILE HD1% A 51 ILE HG2% 1.0 . 2.40 817 551 A 51 ILE HG2% A 51 ILE HG1x 1.0 . 3.00 818 551 A 51 ILE HG2% A 51 ILE HG1y 1.0 . 3.00 819 552 A 52 ASP H A 51 ILE HG2% 1.0 . 3.99 820 553 A 51 ILE HG2% A 57 TRP HZ2 1.0 . 5.21 821 554 A 51 ILE HG2% A 58 ILE HG1y 1.0 . 3.53 822 554 A 51 ILE HG2% A 58 ILE HG1x 1.0 . 3.53 823 555 A 52 ASP H A 52 ASP HBy 1.0 . 4.13 824 556 A 52 ASP H A 52 ASP HBx 1.0 . 4.13 825 557 A 52 ASP H A 52 ASP HBx 1.0 . 3.60 826 557 A 52 ASP H A 52 ASP HBy 1.0 . 3.60 827 558 A 52 ASP H A 55 LEU H 1.0 . 5.09 828 559 A 52 ASP H A 55 LEU HG 1.0 . 4.82 829 560 A 52 ASP H A 55 LEU HDx% 1.0 . 4.27 830 561 A 52 ASP HA A 54 LYS H 1.0 . 5.50 831 562 A 52 ASP HBy A 55 LEU H 1.0 . 5.05 832 563 A 52 ASP HBy A 55 LEU HG 1.0 . 5.50 833 564 A 52 ASP HBy A 55 LEU HDx% 1.0 . 5.30 834 565 A 52 ASP HBy A 55 LEU HDy% 1.0 . 5.50 835 566 A 55 LEU H A 52 ASP HBx 1.0 . 5.05 836 567 A 55 LEU HG A 52 ASP HBx 1.0 . 5.50 837 568 A 55 LEU HDx% A 52 ASP HBx 1.0 . 5.30 838 569 A 55 LEU HDy% A 52 ASP HBx 1.0 . 5.50 839 570 A 55 LEU HG A 52 ASP HBx 1.0 . 4.65 840 570 A 52 ASP HBy A 55 LEU HG 1.0 . 4.65 841 571 A 55 LEU HDx% A 52 ASP HBx 1.0 . 4.62 842 571 A 52 ASP HBy A 55 LEU HDx% 1.0 . 4.62 843 572 A 55 LEU HDy% A 52 ASP HBx 1.0 . 4.85 844 572 A 52 ASP HBy A 55 LEU HDy% 1.0 . 4.85 845 573 A 55 LEU H A 53 PRO HA 1.0 . 5.50 846 574 A 53 PRO HA A 58 ILE HB 1.0 . 5.50 847 575 A 58 ILE HD1% A 53 PRO HA 1.0 . 4.06 848 576 A 53 PRO HA A 58 ILE HG1y 1.0 . 5.09 849 576 A 58 ILE HG1x A 53 PRO HA 1.0 . 5.09 850 577 A 58 ILE HG2% A 53 PRO HA 1.0 . 4.13 851 578 A 58 ILE HG2% A 53 PRO HBx 1.0 . 5.50 852 579 A 58 ILE HG2% A 53 PRO HBy 1.0 . 5.28 853 580 A 54 LYS H A 53 PRO HGy 1.0 . 3.76 854 581 A 53 PRO HGx A 54 LYS H 1.0 . 4.96 855 582 A 54 LYS H A 53 PRO HDx 1.0 . 4.74 856 582 A 53 PRO HDy A 54 LYS H 1.0 . 4.74 857 583 A 54 LYS H A 54 LYS HBy 1.0 . 4.11 858 584 A 54 LYS H A 54 LYS HBx 1.0 . 4.11 859 585 A 54 LYS H A 54 LYS HGy 1.0 . 3.85 860 586 A 54 LYS H A 54 LYS HGx 1.0 . 3.85 861 587 A 54 LYS H A 54 LYS HBx 1.0 . 3.34 862 587 A 54 LYS H A 54 LYS HBy 1.0 . 3.34 863 588 A 54 LYS H A 54 LYS HDx 1.0 . 4.59 864 588 A 54 LYS HDy A 54 LYS H 1.0 . 4.59 865 589 A 54 LYS H A 54 LYS HEx 1.0 . 4.60 866 589 A 54 LYS H A 54 LYS HEy 1.0 . 4.60 867 590 A 55 LEU H A 54 LYS H 1.0 . 3.64 868 591 A 54 LYS H A 58 ILE HB 1.0 . 5.50 869 592 A 58 ILE HG2% A 54 LYS H 1.0 . 4.76 870 593 A 54 LYS HA A 54 LYS HEx 1.0 . 5.50 871 593 A 54 LYS HEy A 54 LYS HA 1.0 . 5.50 872 594 A 54 LYS HA A 59 GLN HE2x 1.0 . 4.77 873 595 A 54 LYS HA A 59 GLN HE2y 1.0 . 4.26 874 596 A 54 LYS HA A 59 GLN HGx 1.0 . 4.81 875 596 A 54 LYS HA A 59 GLN HGy 1.0 . 4.81 876 597 A 54 LYS HDy A 54 LYS HBy 1.0 . 3.32 877 597 A 54 LYS HBy A 54 LYS HDx 1.0 . 3.32 878 598 A 54 LYS HBy A 54 LYS HEy 1.0 . 3.56 879 598 A 54 LYS HBy A 54 LYS HEx 1.0 . 3.56 880 599 A 54 LYS HDy A 54 LYS HBx 1.0 . 3.32 881 599 A 54 LYS HBx A 54 LYS HDx 1.0 . 3.32 882 600 A 54 LYS HEy A 54 LYS HBx 1.0 . 3.56 883 600 A 54 LYS HBx A 54 LYS HEx 1.0 . 3.56 884 601 A 54 LYS HGy A 54 LYS HEx 1.0 . 3.90 885 601 A 54 LYS HEy A 54 LYS HGy 1.0 . 3.90 886 602 A 54 LYS HEy A 54 LYS HGx 1.0 . 3.90 887 602 A 54 LYS HEx A 54 LYS HGx 1.0 . 3.90 888 603 A 54 LYS HBy A 54 LYS HDx 1.0 . 2.88 889 603 A 54 LYS HBx A 54 LYS HDx 1.0 . 2.88 890 603 A 54 LYS HDy A 54 LYS HBx 1.0 . 2.88 891 603 A 54 LYS HDy A 54 LYS HBy 1.0 . 2.88 892 604 A 54 LYS HBy A 54 LYS HEx 1.0 . 2.97 893 604 A 54 LYS HEy A 54 LYS HBx 1.0 . 2.97 894 604 A 54 LYS HBy A 54 LYS HEy 1.0 . 2.97 895 604 A 54 LYS HBx A 54 LYS HEx 1.0 . 2.97 896 605 A 54 LYS HDy A 54 LYS HEx 1.0 . 2.80 897 605 A 54 LYS HDx A 54 LYS HEx 1.0 . 2.80 898 605 A 54 LYS HEy A 54 LYS HDx 1.0 . 2.80 899 605 A 54 LYS HDy A 54 LYS HEy 1.0 . 2.80 900 606 A 54 LYS HEy A 54 LYS HGx 1.0 . 3.28 901 606 A 54 LYS HEx A 54 LYS HGx 1.0 . 3.28 902 606 A 54 LYS HGy A 54 LYS HEx 1.0 . 3.28 903 606 A 54 LYS HEy A 54 LYS HGy 1.0 . 3.28 904 607 A 55 LEU H A 55 LEU HBy 1.0 . 3.90 905 608 A 55 LEU H A 55 LEU HBx 1.0 . 3.40 906 609 A 55 LEU H A 55 LEU HG 1.0 . 3.82 907 610 A 55 LEU HDx% A 55 LEU H 1.0 . 4.86 908 611 A 55 LEU H A 58 ILE HB 1.0 . 3.94 909 612 A 58 ILE HD1% A 55 LEU H 1.0 . 5.24 910 613 A 55 LEU H A 58 ILE HG1y 1.0 . 4.25 911 613 A 58 ILE HG1x A 55 LEU H 1.0 . 4.25 912 614 A 58 ILE HG2% A 55 LEU H 1.0 . 5.05 913 615 A 55 LEU HDx% A 55 LEU HA 1.0 . 5.37 914 616 A 55 LEU HDy% A 55 LEU HA 1.0 . 3.97 915 617 A 55 LEU HA A 58 ILE H 1.0 . 5.50 916 618 A 55 LEU HA A 58 ILE HG1y 1.0 . 5.34 917 618 A 58 ILE HG1x A 55 LEU HA 1.0 . 5.34 918 619 A 55 LEU HDx% A 55 LEU HBy 1.0 . 4.19 919 620 A 55 LEU HBy A 58 ILE H 1.0 . 4.95 920 621 A 58 ILE HB A 55 LEU HBy 1.0 . 5.50 921 622 A 55 LEU HBy A 58 ILE HG1y 1.0 . 4.62 922 622 A 58 ILE HG1x A 55 LEU HBy 1.0 . 4.62 923 623 A 55 LEU HBx A 56 LYS H 1.0 . 5.50 924 624 A 55 LEU HBx A 58 ILE H 1.0 . 4.60 925 625 A 58 ILE HB A 55 LEU HBx 1.0 . 5.50 926 626 A 58 ILE HD1% A 55 LEU HBx 1.0 . 5.49 927 627 A 55 LEU HBx A 58 ILE HG1y 1.0 . 4.44 928 627 A 58 ILE HG1x A 55 LEU HBx 1.0 . 4.44 929 628 A 55 LEU HG A 58 ILE HB 1.0 . 5.50 930 629 A 55 LEU HG A 58 ILE HG1y 1.0 . 5.34 931 629 A 58 ILE HG1x A 55 LEU HG 1.0 . 5.34 932 630 A 55 LEU HDx% A 57 TRP HD1 1.0 . 5.32 933 631 A 55 LEU HDx% A 57 TRP HE1 1.0 . 3.98 934 632 A 55 LEU HDx% A 57 TRP HZ2 1.0 . 4.31 935 633 A 55 LEU HDx% A 58 ILE H 1.0 . 5.50 936 634 A 55 LEU HDx% A 58 ILE HG1y 1.0 . 4.10 937 634 A 55 LEU HDx% A 58 ILE HG1x 1.0 . 4.10 938 635 A 55 LEU HDy% A 56 LYS H 1.0 . 5.50 939 636 A 55 LEU HDy% A 57 TRP HD1 1.0 . 3.66 940 637 A 55 LEU HDy% A 57 TRP HE1 1.0 . 3.98 941 638 A 55 LEU HDy% A 57 TRP HZ2 1.0 . 5.17 942 639 A 55 LEU HDy% A 58 ILE H 1.0 . 5.50 943 640 A 55 LEU HDy% A 58 ILE HG1y 1.0 . 4.39 944 640 A 55 LEU HDy% A 58 ILE HG1x 1.0 . 4.39 945 641 A 56 LYS HA A 56 LYS HDy 1.0 . 4.51 946 642 A 56 LYS HA A 56 LYS HDx 1.0 . 4.51 947 643 A 56 LYS HA A 56 LYS HEx 1.0 . 5.50 948 643 A 56 LYS HA A 56 LYS HEy 1.0 . 5.50 949 644 A 56 LYS HA A 59 GLN H 1.0 . 4.50 950 645 A 56 LYS HA A 59 GLN HGx 1.0 . 4.78 951 645 A 59 GLN HGy A 56 LYS HA 1.0 . 4.78 952 646 A 56 LYS HA A 60 GLU H 1.0 . 5.13 953 647 A 60 GLU HGx A 56 LYS HGy 1.0 . 5.06 954 648 A 60 GLU HGx A 56 LYS HGx 1.0 . 5.06 955 649 A 56 LYS HDy A 56 LYS HBx 1.0 . 3.66 956 649 A 56 LYS HBy A 56 LYS HDy 1.0 . 3.66 957 650 A 56 LYS HBx A 56 LYS HDx 1.0 . 3.66 958 650 A 56 LYS HBy A 56 LYS HDx 1.0 . 3.66 959 651 A 56 LYS HBx A 56 LYS HEx 1.0 . 4.72 960 651 A 56 LYS HBy A 56 LYS HEx 1.0 . 4.72 961 651 A 56 LYS HEy A 56 LYS HBx 1.0 . 4.72 962 651 A 56 LYS HEy A 56 LYS HBy 1.0 . 4.72 963 652 A 57 TRP H A 56 LYS HBx 1.0 . 5.00 964 652 A 56 LYS HBy A 57 TRP H 1.0 . 5.00 965 653 A 57 TRP H A 56 LYS HDx 1.0 . 5.34 966 653 A 57 TRP H A 56 LYS HDy 1.0 . 5.34 967 654 A 60 GLU HGy A 56 LYS HDx 1.0 . 4.92 968 654 A 56 LYS HDy A 60 GLU HGy 1.0 . 4.92 969 655 A 57 TRP H A 56 LYS HGx 1.0 . 5.34 970 655 A 57 TRP H A 56 LYS HGy 1.0 . 5.34 971 656 A 60 GLU HGy A 56 LYS HGx 1.0 . 4.67 972 656 A 60 GLU HGy A 56 LYS HGy 1.0 . 4.67 973 657 A 57 TRP HE1 A 57 TRP H 1.0 . 4.63 974 658 A 58 ILE H A 57 TRP H 1.0 . 4.84 975 659 A 60 GLU H A 57 TRP HA 1.0 . 4.62 976 660 A 57 TRP HA A 60 GLU HBx 1.0 . 5.06 977 661 A 57 TRP HA A 60 GLU HBy 1.0 . 5.50 978 662 A 60 GLU HGy A 57 TRP HA 1.0 . 5.50 979 663 A 60 GLU HGx A 57 TRP HA 1.0 . 5.50 980 664 A 57 TRP HA A 61 TYR H 1.0 . 5.50 981 665 A 57 TRP HBx A 57 TRP HD1 1.0 . 3.86 982 666 A 58 ILE HD1% A 57 TRP HE3 1.0 . 5.46 983 667 A 57 TRP HZ2 A 58 ILE HG1y 1.0 . 4.77 984 667 A 57 TRP HZ2 A 58 ILE HG1x 1.0 . 4.77 985 668 A 58 ILE HB A 58 ILE H 1.0 . 3.96 986 669 A 58 ILE HG1x A 58 ILE H 1.0 . 4.39 987 670 A 58 ILE H A 58 ILE HG1y 1.0 . 4.39 988 671 A 58 ILE HD1% A 58 ILE H 1.0 . 4.72 989 672 A 58 ILE H A 58 ILE HG1y 1.0 . 3.70 990 672 A 58 ILE HG1x A 58 ILE H 1.0 . 3.70 991 673 A 58 ILE HG2% A 58 ILE H 1.0 . 4.17 992 674 A 58 ILE H A 59 GLN H 1.0 . 3.94 993 675 A 58 ILE H A 60 GLU H 1.0 . 5.26 994 676 A 58 ILE HD1% A 58 ILE HA 1.0 . 4.01 995 677 A 58 ILE HG2% A 58 ILE HA 1.0 . 4.06 996 678 A 61 TYR HD% A 58 ILE HA 1.0 . 5.50 997 679 A 58 ILE HD1% A 58 ILE HB 1.0 . 3.78 998 680 A 58 ILE HB A 59 GLN H 1.0 . 4.13 999 681 A 58 ILE HB A 62 LEU HDx% 1.0 . 4.63 1000 682 A 62 LEU H A 58 ILE HD1% 1.0 . 5.47 1001 683 A 59 GLN H A 58 ILE HG1y 1.0 . 4.57 1002 683 A 58 ILE HG1x A 59 GLN H 1.0 . 4.57 1003 684 A 58 ILE HG2% A 59 GLN H 1.0 . 4.33 1004 685 A 58 ILE HG2% A 59 GLN HGx 1.0 . 5.50 1005 685 A 58 ILE HG2% A 59 GLN HGy 1.0 . 5.50 1006 686 A 58 ILE HG2% A 61 TYR H 1.0 . 5.03 1007 687 A 62 LEU H A 58 ILE HG2% 1.0 . 5.40 1008 688 A 59 GLN HE2x A 59 GLN H 1.0 . 5.50 1009 689 A 59 GLN HE2y A 59 GLN H 1.0 . 4.56 1010 690 A 59 GLN H A 59 GLN HBy 1.0 . 3.50 1011 690 A 59 GLN H A 59 GLN HBx 1.0 . 3.50 1012 691 A 59 GLN H A 59 GLN HGx 1.0 . 3.67 1013 691 A 59 GLN HGy A 59 GLN H 1.0 . 3.67 1014 692 A 59 GLN H A 60 GLU H 1.0 . 4.03 1015 693 A 59 GLN HA C 266 LEU HD21 1.0 . 4.06 1016 693 A 59 GLN HA C 266 LEU HD11 1.0 . 4.06 1017 694 A 59 GLN HE2y A 59 GLN HA 1.0 . 5.46 1018 695 A 62 LEU H A 59 GLN HA 1.0 . 4.68 1019 696 A 62 LEU HDx% A 59 GLN HA 1.0 . 4.47 1020 697 A 59 GLN HA A 63 GLU H 1.0 . 4.68 1021 698 A 60 GLU H A 59 GLN HBy 1.0 . 5.28 1022 699 A 60 GLU H A 59 GLN HBx 1.0 . 5.28 1023 700 A 59 GLN HE2x C 266 LEU HA 1.0 . 4.40 1024 701 A 59 GLN HE2x C 266 LEU HD21 1.0 . 4.63 1025 701 A 59 GLN HE2x C 266 LEU HD11 1.0 . 4.63 1026 702 A 59 GLN HE2x A 62 LEU HDx% 1.0 . 4.75 1027 703 A 59 GLN HE2y C 266 LEU HBx 1.0 . 5.50 1028 704 A 59 GLN HE2y C 266 LEU HBy 1.0 . 5.50 1029 705 A 59 GLN HE2y C 266 LEU HG 1.0 . 5.50 1030 706 A 59 GLN HE2y C 266 LEU HD11 1.0 . 5.50 1031 707 A 59 GLN HE2y C 266 LEU HD21 1.0 . 5.50 1032 708 A 59 GLN HE2y C 266 LEU HD21 1.0 . 4.31 1033 708 A 59 GLN HE2y C 266 LEU HD11 1.0 . 4.31 1034 709 A 59 GLN HE2y A 62 LEU HDx% 1.0 . 4.18 1035 710 A 59 GLN HBx C 266 LEU HD21 1.0 . 3.90 1036 710 A 59 GLN HBy C 266 LEU HD21 1.0 . 3.90 1037 710 C 266 LEU HD11 A 59 GLN HBy 1.0 . 3.90 1038 710 A 59 GLN HBx C 266 LEU HD11 1.0 . 3.90 1039 711 A 59 GLN HE2x A 59 GLN HBy 1.0 . 4.93 1040 711 A 59 GLN HE2x A 59 GLN HBx 1.0 . 4.93 1041 712 A 59 GLN HE2y A 59 GLN HBy 1.0 . 4.16 1042 712 A 59 GLN HE2y A 59 GLN HBx 1.0 . 4.16 1043 713 A 59 GLN HGy C 266 LEU HD21 1.0 . 4.92 1044 713 A 59 GLN HGx C 266 LEU HD21 1.0 . 4.92 1045 713 C 266 LEU HD11 A 59 GLN HGx 1.0 . 4.92 1046 713 A 59 GLN HGy C 266 LEU HD11 1.0 . 4.92 1047 714 A 59 GLN HE2y A 59 GLN HGx 1.0 . 3.87 1048 714 A 59 GLN HE2y A 59 GLN HGy 1.0 . 3.87 1049 715 A 60 GLU H A 59 GLN HGx 1.0 . 5.14 1050 715 A 59 GLN HGy A 60 GLU H 1.0 . 5.14 1051 716 A 60 GLU H A 60 GLU HBx 1.0 . 3.84 1052 717 A 60 GLU H A 60 GLU HBy 1.0 . 3.48 1053 718 A 60 GLU H A 60 GLU HGy 1.0 . 3.91 1054 719 A 60 GLU H A 60 GLU HGx 1.0 . 4.37 1055 720 A 60 GLU H A 61 TYR H 1.0 . 4.07 1056 721 A 63 GLU H A 60 GLU HA 1.0 . 4.94 1057 722 A 60 GLU HA A 63 GLU HBy 1.0 . 4.46 1058 723 A 60 GLU HA A 63 GLU HBx 1.0 . 4.40 1059 724 A 60 GLU HBx A 61 TYR H 1.0 . 4.44 1060 725 A 60 GLU HGx A 60 GLU HBy 1.0 . 2.61 1061 726 A 60 GLU HBy A 61 TYR H 1.0 . 4.26 1062 727 A 60 GLU HGy A 61 TYR H 1.0 . 5.13 1063 728 A 60 GLU HGx A 61 TYR H 1.0 . 4.90 1064 729 A 61 TYR HBx A 61 TYR H 1.0 . 3.87 1065 730 A 61 TYR HBy A 61 TYR H 1.0 . 3.97 1066 731 A 61 TYR HD% A 61 TYR H 1.0 . 4.71 1067 732 A 62 LEU H A 61 TYR H 1.0 . 4.08 1068 733 A 61 TYR H A 64 LYS HGy 1.0 . 5.50 1069 734 A 61 TYR HD% A 61 TYR HA 1.0 . 3.94 1070 735 A 61 TYR HBx A 62 LEU H 1.0 . 4.39 1071 736 A 61 TYR HBy A 62 LEU H 1.0 . 4.69 1072 737 C 228 ILE HD11 A 61 TYR HD% 1.0 . 3.71 1073 738 C 228 ILE HG21 A 61 TYR HD% 1.0 . 3.85 1074 739 A 61 TYR HD% A 62 LEU HG 1.0 . 4.43 1075 740 A 61 TYR HE% C 228 ILE HB 1.0 . 3.98 1076 741 A 61 TYR HE% C 228 ILE HD11 1.0 . 3.83 1077 742 A 61 TYR HE% C 228 ILE HG1x 1.0 . 4.43 1078 742 A 61 TYR HE% C 228 ILE HG1y 1.0 . 4.43 1079 743 A 61 TYR HE% C 228 ILE HG21 1.0 . 3.52 1080 744 A 61 TYR HE% A 65 CYS HBy 1.0 . 4.65 1081 745 A 62 LEU H C 266 LEU HD21 1.0 . 4.55 1082 745 A 62 LEU H C 266 LEU HD11 1.0 . 4.55 1083 746 A 62 LEU H A 62 LEU HG 1.0 . 3.72 1084 747 A 62 LEU H A 62 LEU HDx% 1.0 . 3.96 1085 748 A 62 LEU H A 62 LEU HDy% 1.0 . 3.98 1086 749 A 62 LEU H A 63 GLU H 1.0 . 4.07 1087 750 C 228 ILE HD11 A 62 LEU HA 1.0 . 4.78 1088 751 A 62 LEU HA C 266 LEU HD21 1.0 . 4.99 1089 751 C 266 LEU HD11 A 62 LEU HA 1.0 . 4.99 1090 752 A 62 LEU HDx% A 62 LEU HA 1.0 . 4.08 1091 753 A 62 LEU HDy% A 62 LEU HA 1.0 . 3.68 1092 754 A 62 LEU HA A 65 CYS H 1.0 . 4.20 1093 755 A 62 LEU HA A 66 LEU H 1.0 . 5.50 1094 756 A 62 LEU HBy C 266 LEU HD21 1.0 . 4.31 1095 756 C 266 LEU HD11 A 62 LEU HBy 1.0 . 4.31 1096 757 A 62 LEU HDy% A 62 LEU HBy 1.0 . 3.62 1097 758 A 63 GLU H A 62 LEU HBy 1.0 . 5.32 1098 759 A 62 LEU HDx% A 62 LEU HBx 1.0 . 4.18 1099 760 A 62 LEU HDy% A 62 LEU HBx 1.0 . 4.12 1100 761 A 63 GLU H A 62 LEU HBx 1.0 . 4.82 1101 762 A 63 GLU H A 62 LEU HG 1.0 . 4.03 1102 763 A 62 LEU HDx% C 266 LEU H 1.0 . 4.52 1103 764 A 62 LEU HDx% C 266 LEU HA 1.0 . 4.94 1104 765 A 62 LEU HDx% A 63 GLU H 1.0 . 4.33 1105 766 A 62 LEU HDy% C 266 LEU H 1.0 . 5.50 1106 767 C 266 LEU HD11 A 63 GLU H 1.0 . 4.84 1107 768 A 63 GLU H C 266 LEU HD21 1.0 . 4.84 1108 769 A 63 GLU H C 266 LEU HD21 1.0 . 4.14 1109 769 C 266 LEU HD11 A 63 GLU H 1.0 . 4.14 1110 770 A 63 GLU H A 63 GLU HBy 1.0 . 3.59 1111 771 A 63 GLU H A 63 GLU HBx 1.0 . 3.96 1112 772 A 63 GLU H A 63 GLU HGy 1.0 . 4.13 1113 773 A 63 GLU H A 63 GLU HGx 1.0 . 4.22 1114 774 A 63 GLU H A 64 LYS H 1.0 . 4.03 1115 775 A 63 GLU HGx A 63 GLU HA 1.0 . 4.20 1116 776 A 66 LEU H A 63 GLU HA 1.0 . 4.47 1117 777 A 63 GLU HBy A 64 LYS H 1.0 . 4.14 1118 778 A 63 GLU HBx A 64 LYS H 1.0 . 4.11 1119 779 C 266 LEU HG A 63 GLU HGy 1.0 . 4.64 1120 780 A 63 GLU HGy C 266 LEU HD21 1.0 . 4.46 1121 780 C 266 LEU HD11 A 63 GLU HGy 1.0 . 4.46 1122 781 A 63 GLU HGy A 64 LYS H 1.0 . 5.20 1123 782 C 266 LEU HG A 63 GLU HGx 1.0 . 4.41 1124 783 A 63 GLU HGx A 64 LYS H 1.0 . 5.18 1125 784 A 64 LYS H A 64 LYS HBx 1.0 . 3.65 1126 785 A 64 LYS H A 64 LYS HBy 1.0 . 3.63 1127 786 A 64 LYS HGy A 64 LYS H 1.0 . 3.81 1128 787 A 64 LYS H A 64 LYS HGx 1.0 . 3.96 1129 788 A 64 LYS H A 64 LYS HDx 1.0 . 4.75 1130 788 A 64 LYS H A 64 LYS HDy 1.0 . 4.75 1131 789 A 64 LYS H A 64 LYS HEx 1.0 . 5.10 1132 789 A 64 LYS H A 64 LYS HEy 1.0 . 5.10 1133 790 A 65 CYS H A 64 LYS H 1.0 . 3.29 1134 791 A 64 LYS HA A 64 LYS HDx 1.0 . 3.91 1135 791 A 64 LYS HDy A 64 LYS HA 1.0 . 3.91 1136 792 A 64 LYS HA A 64 LYS HEx 1.0 . 5.50 1137 792 A 64 LYS HEy A 64 LYS HA 1.0 . 5.50 1138 793 A 64 LYS HA A 67 ASN H 1.0 . 5.50 1139 794 A 64 LYS HBx A 64 LYS HDx 1.0 . 3.71 1140 794 A 64 LYS HBx A 64 LYS HDy 1.0 . 3.71 1141 795 A 64 LYS HBx A 64 LYS HEx 1.0 . 5.35 1142 795 A 64 LYS HBx A 64 LYS HEy 1.0 . 5.35 1143 796 A 65 CYS H A 64 LYS HBx 1.0 . 4.06 1144 797 A 64 LYS HBy A 64 LYS HDx 1.0 . 3.74 1145 797 A 64 LYS HBy A 64 LYS HDy 1.0 . 3.74 1146 798 A 64 LYS HBy A 64 LYS HEx 1.0 . 3.96 1147 798 A 64 LYS HBy A 64 LYS HEy 1.0 . 3.96 1148 799 A 65 CYS H A 64 LYS HBy 1.0 . 4.07 1149 800 A 64 LYS HGy A 64 LYS HDx 1.0 . 2.40 1150 800 A 64 LYS HGy A 64 LYS HDy 1.0 . 2.40 1151 801 A 64 LYS HGy A 64 LYS HEx 1.0 . 3.18 1152 801 A 64 LYS HGy A 64 LYS HEy 1.0 . 3.18 1153 802 A 64 LYS HGy A 65 CYS H 1.0 . 4.32 1154 803 A 64 LYS HGx A 64 LYS HDx 1.0 . 2.57 1155 803 A 64 LYS HGx A 64 LYS HDy 1.0 . 2.57 1156 804 A 64 LYS HGx A 64 LYS HEx 1.0 . 3.41 1157 804 A 64 LYS HGx A 64 LYS HEy 1.0 . 3.41 1158 805 A 65 CYS H A 64 LYS HGx 1.0 . 4.39 1159 806 A 64 LYS HDx A 64 LYS HEx 1.0 . 2.95 1160 806 A 64 LYS HDy A 64 LYS HEx 1.0 . 2.95 1161 806 A 64 LYS HEy A 64 LYS HDx 1.0 . 2.95 1162 806 A 64 LYS HDy A 64 LYS HEy 1.0 . 2.95 1163 807 A 65 CYS CB C 236 CYS CB 1.0 . 3.99 1164 808 A 65 CYS CB C 236 CYS SG 1.0 . 3.10 1165 809 A 65 CYS HBy A 65 CYS H 1.0 . 3.85 1166 810 A 65 CYS H A 65 CYS HBx 1.0 . 3.82 1167 811 A 65 CYS H A 66 LEU H 1.0 . 3.69 1168 812 A 65 CYS H A 68 LYS HDx 1.0 . 5.20 1169 812 A 65 CYS H A 68 LYS HDy 1.0 . 5.20 1170 813 A 65 CYS H A 68 LYS HGx 1.0 . 4.61 1171 813 A 65 CYS H A 68 LYS HGy 1.0 . 4.61 1172 814 A 65 CYS HBy A 66 LEU H 1.0 . 4.46 1173 815 A 66 LEU H A 65 CYS HBx 1.0 . 4.67 1174 816 C 236 CYS CB A 65 CYS SG 1.0 . 3.10 1175 817 C 236 CYS SG A 65 CYS SG 1.0 . 2.10 1176 818 A 66 LEU H C 262 LEU HD11 1.0 . 4.52 1177 819 A 66 LEU H C 262 LEU HD21 1.0 . 5.50 1178 820 A 66 LEU H A 66 LEU HBy 1.0 . 3.84 1179 821 A 66 LEU H A 66 LEU HBx 1.0 . 3.84 1180 822 A 66 LEU H A 66 LEU HG 1.0 . 4.60 1181 823 A 66 LEU H A 66 LEU HBy 1.0 . 3.25 1182 823 A 66 LEU H A 66 LEU HBx 1.0 . 3.25 1183 824 A 66 LEU H A 66 LEU HDx% 1.0 . 4.16 1184 825 A 66 LEU H A 66 LEU HDy% 1.0 . 4.16 1185 826 A 66 LEU H A 66 LEU HDy% 1.0 . 3.52 1186 826 A 66 LEU H A 66 LEU HDx% 1.0 . 3.52 1187 827 A 66 LEU H A 67 ASN H 1.0 . 4.18 1188 828 A 66 LEU HA C 259 GLN HE2x 1.0 . 4.40 1189 829 C 262 LEU HD11 A 66 LEU HA 1.0 . 4.94 1190 830 A 66 LEU HDx% A 66 LEU HA 1.0 . 4.62 1191 831 A 66 LEU HA A 66 LEU HDy% 1.0 . 4.62 1192 832 A 66 LEU HA A 66 LEU HDy% 1.0 . 3.75 1193 832 A 66 LEU HDx% A 66 LEU HA 1.0 . 3.75 1194 833 C 259 GLN HE2y A 66 LEU HBy 1.0 . 5.50 1195 834 A 67 ASN H A 66 LEU HBy 1.0 . 4.27 1196 835 A 66 LEU HBx C 259 GLN HE2y 1.0 . 5.50 1197 836 A 67 ASN H A 66 LEU HBx 1.0 . 4.27 1198 837 A 66 LEU HG C 259 GLN HE2y 1.0 . 5.50 1199 838 A 66 LEU HG C 263 GLU HGx 1.0 . 4.64 1200 839 A 66 LEU HG C 263 GLU HGy 1.0 . 4.41 1201 840 A 66 LEU HBx A 66 LEU HDy% 1.0 . 2.81 1202 840 A 66 LEU HBy A 66 LEU HDy% 1.0 . 2.81 1203 840 A 66 LEU HDx% A 66 LEU HBy 1.0 . 2.81 1204 840 A 66 LEU HBx A 66 LEU HDx% 1.0 . 2.81 1205 841 A 66 LEU HDx% C 259 GLN HE2y 1.0 . 5.50 1206 842 A 66 LEU HDx% C 263 GLU H 1.0 . 4.84 1207 843 C 259 GLN HE2y A 66 LEU HDy% 1.0 . 5.50 1208 844 C 263 GLU H A 66 LEU HDy% 1.0 . 4.84 1209 845 C 259 GLN HA A 66 LEU HDy% 1.0 . 4.06 1210 845 A 66 LEU HDx% C 259 GLN HA 1.0 . 4.06 1211 846 C 259 GLN HE2x A 66 LEU HDy% 1.0 . 4.63 1212 846 A 66 LEU HDx% C 259 GLN HE2x 1.0 . 4.63 1213 847 C 259 GLN HE2y A 66 LEU HDy% 1.0 . 4.31 1214 847 A 66 LEU HDx% C 259 GLN HE2y 1.0 . 4.31 1215 848 A 66 LEU HDy% C 259 GLN HBx 1.0 . 3.90 1216 848 C 259 GLN HBy A 66 LEU HDy% 1.0 . 3.90 1217 848 A 66 LEU HDx% C 259 GLN HBy 1.0 . 3.90 1218 848 A 66 LEU HDx% C 259 GLN HBx 1.0 . 3.90 1219 849 A 66 LEU HDx% C 259 GLN HGx 1.0 . 4.92 1220 849 A 66 LEU HDy% C 259 GLN HGx 1.0 . 4.92 1221 849 C 259 GLN HGy A 66 LEU HDy% 1.0 . 4.92 1222 849 A 66 LEU HDx% C 259 GLN HGy 1.0 . 4.92 1223 850 C 262 LEU H A 66 LEU HDy% 1.0 . 4.55 1224 850 A 66 LEU HDx% C 262 LEU H 1.0 . 4.55 1225 851 C 262 LEU HA A 66 LEU HDy% 1.0 . 4.99 1226 851 C 262 LEU HA A 66 LEU HDx% 1.0 . 4.99 1227 852 C 262 LEU HBx A 66 LEU HDy% 1.0 . 4.31 1228 852 A 66 LEU HDx% C 262 LEU HBx 1.0 . 4.31 1229 853 C 263 GLU H A 66 LEU HDy% 1.0 . 4.14 1230 853 A 66 LEU HDx% C 263 GLU H 1.0 . 4.14 1231 854 C 263 GLU HGx A 66 LEU HDy% 1.0 . 4.46 1232 854 A 66 LEU HDx% C 263 GLU HGx 1.0 . 4.46 1233 855 A 66 LEU HDy% D 327 PRO HBx 1.0 . 3.93 1234 855 A 66 LEU HDx% D 327 PRO HBx 1.0 . 3.93 1235 855 D 327 PRO HBy A 66 LEU HDy% 1.0 . 3.93 1236 855 A 66 LEU HDx% D 327 PRO HBy 1.0 . 3.93 1237 856 A 66 LEU HDy% D 327 PRO HDx 1.0 . 5.28 1238 856 A 66 LEU HDx% D 327 PRO HDx 1.0 . 5.28 1239 856 D 327 PRO HDy A 66 LEU HDy% 1.0 . 5.28 1240 856 A 66 LEU HDx% D 327 PRO HDy 1.0 . 5.28 1241 857 A 66 LEU HDx% D 327 PRO HGx 1.0 . 4.60 1242 857 A 66 LEU HDy% D 327 PRO HGx 1.0 . 4.60 1243 857 D 327 PRO HGy A 66 LEU HDy% 1.0 . 4.60 1244 857 A 66 LEU HDx% D 327 PRO HGy 1.0 . 4.60 1245 858 D 329 PHE HD% A 66 LEU HDy% 1.0 . 3.35 1246 858 A 66 LEU HDx% D 329 PHE HD% 1.0 . 3.35 1247 859 A 67 ASN H A 66 LEU HDy% 1.0 . 4.03 1248 859 A 67 ASN H A 66 LEU HDx% 1.0 . 4.03 1249 860 A 67 ASN H A 67 ASN HBy 1.0 . 4.12 1250 861 A 67 ASN H A 67 ASN HBx 1.0 . 4.12 1251 862 A 67 ASN H A 68 LYS H 1.0 . 4.39 1252 863 A 67 ASN HA A 67 ASN HD2y 1.0 . 4.06 1253 864 A 67 ASN HA A 67 ASN HD2x 1.0 . 4.06 1254 865 A 67 ASN HA A 67 ASN HD2y 1.0 . 3.54 1255 865 A 67 ASN HA A 67 ASN HD2x 1.0 . 3.54 1256 866 A 68 LYS H A 67 ASN HA 1.0 . 3.32 1257 867 A 68 LYS H A 67 ASN HBy 1.0 . 4.49 1258 868 A 68 LYS H A 67 ASN HBx 1.0 . 4.49 1259 869 A 68 LYS H A 67 ASN HBx 1.0 . 3.79 1260 869 A 68 LYS H A 67 ASN HBy 1.0 . 3.79 1261 870 A 67 ASN HBx A 68 LYS HBx 1.0 . 4.91 1262 870 A 67 ASN HBy A 68 LYS HBx 1.0 . 4.91 1263 870 A 68 LYS HBy A 67 ASN HBx 1.0 . 4.91 1264 870 A 67 ASN HBy A 68 LYS HBy 1.0 . 4.91 1265 871 A 68 LYS H A 68 LYS HBy 1.0 . 3.99 1266 872 A 68 LYS H A 68 LYS HBx 1.0 . 3.99 1267 873 A 68 LYS H A 68 LYS HBx 1.0 . 3.24 1268 873 A 68 LYS H A 68 LYS HBy 1.0 . 3.24 1269 874 A 68 LYS H A 68 LYS HDx 1.0 . 5.23 1270 874 A 68 LYS HDy A 68 LYS H 1.0 . 5.23 1271 875 A 68 LYS H A 68 LYS HGx 1.0 . 3.69 1272 875 A 68 LYS HGy A 68 LYS H 1.0 . 3.69 1273 876 A 68 LYS HA A 68 LYS HDx 1.0 . 4.01 1274 876 A 68 LYS HDy A 68 LYS HA 1.0 . 4.01 1275 877 A 68 LYS HA A 68 LYS HEx 1.0 . 5.50 1276 877 A 68 LYS HA A 68 LYS HEy 1.0 . 5.50 1277 878 A 68 LYS HA A 68 LYS HGx 1.0 . 3.95 1278 878 A 68 LYS HGy A 68 LYS HA 1.0 . 3.95 1279 879 A 68 LYS HBy A 68 LYS HEy 1.0 . 5.07 1280 879 A 68 LYS HBy A 68 LYS HEx 1.0 . 5.07 1281 880 A 68 LYS HEy A 68 LYS HBx 1.0 . 5.07 1282 880 A 68 LYS HBx A 68 LYS HEx 1.0 . 5.07 1283 881 A 68 LYS HBx A 68 LYS HEx 1.0 . 4.42 1284 881 A 68 LYS HBy A 68 LYS HEx 1.0 . 4.42 1285 881 A 68 LYS HEy A 68 LYS HBx 1.0 . 4.42 1286 881 A 68 LYS HBy A 68 LYS HEy 1.0 . 4.42 1287 882 A 68 LYS HDx A 68 LYS HGx 1.0 . 2.84 1288 882 A 68 LYS HDy A 68 LYS HGx 1.0 . 2.84 1289 882 A 68 LYS HGy A 68 LYS HDx 1.0 . 2.84 1290 882 A 68 LYS HDy A 68 LYS HGy 1.0 . 2.84 1291 883 A 68 LYS HEy A 68 LYS HGx 1.0 . 3.74 1292 883 A 68 LYS HEx A 68 LYS HGx 1.0 . 3.74 1293 883 A 68 LYS HGy A 68 LYS HEx 1.0 . 3.74 1294 883 A 68 LYS HGy A 68 LYS HEy 1.0 . 3.74 1295 884 B 102 GLU H B 102 GLU HBy 1.0 . 4.08 1296 885 B 102 GLU H B 102 GLU HBx 1.0 . 4.08 1297 886 B 102 GLU H B 102 GLU HBy 1.0 . 3.55 1298 886 B 102 GLU H B 102 GLU HBx 1.0 . 3.55 1299 887 B 102 GLU H B 102 GLU HGx 1.0 . 4.29 1300 887 B 102 GLU H B 102 GLU HGy 1.0 . 4.29 1301 888 B 102 GLU HA B 102 GLU HGx 1.0 . 3.13 1302 888 B 102 GLU HGy B 102 GLU HA 1.0 . 3.13 1303 889 B 102 GLU HGy B 102 GLU HBy 1.0 . 2.42 1304 889 B 102 GLU HBy B 102 GLU HGx 1.0 . 2.42 1305 890 B 102 GLU HBx B 102 GLU HGy 1.0 . 2.42 1306 890 B 102 GLU HBx B 102 GLU HGx 1.0 . 2.42 1307 891 B 103 GLY H B 104 ILE H 1.0 . 4.46 1308 892 B 104 ILE H B 103 GLY HAx 1.0 . 3.04 1309 892 B 104 ILE H B 103 GLY HAy 1.0 . 3.04 1310 893 B 104 ILE H B 104 ILE HB 1.0 . 3.36 1311 894 B 104 ILE H B 104 ILE HG1y 1.0 . 3.87 1312 895 B 104 ILE H B 104 ILE HG1x 1.0 . 3.87 1313 896 B 104 ILE H B 104 ILE HD1% 1.0 . 3.86 1314 897 B 104 ILE H B 104 ILE HG1x 1.0 . 3.31 1315 897 B 104 ILE H B 104 ILE HG1y 1.0 . 3.31 1316 898 B 104 ILE H B 104 ILE HG2% 1.0 . 3.79 1317 899 B 104 ILE HD1% B 104 ILE HA 1.0 . 4.44 1318 900 B 104 ILE HG2% B 104 ILE HA 1.0 . 3.77 1319 901 B 104 ILE HB B 104 ILE HD1% 1.0 . 3.88 1320 902 B 104 ILE HG1y B 104 ILE HG2% 1.0 . 3.40 1321 903 B 104 ILE HG2% B 104 ILE HG1x 1.0 . 3.40 1322 904 B 104 ILE HD1% B 104 ILE HG2% 1.0 . 2.40 1323 905 B 104 ILE HG2% B 104 ILE HG1x 1.0 . 2.97 1324 905 B 104 ILE HG1y B 104 ILE HG2% 1.0 . 2.97 1325 906 B 105 SER HBy B 106 ILE H 1.0 . 4.62 1326 907 B 106 ILE H B 105 SER HBx 1.0 . 4.62 1327 908 B 106 ILE H B 106 ILE HB 1.0 . 4.04 1328 909 B 106 ILE H B 106 ILE HG1y 1.0 . 4.62 1329 910 B 106 ILE H B 106 ILE HG1x 1.0 . 4.62 1330 911 B 106 ILE H B 106 ILE HD1% 1.0 . 4.21 1331 912 B 106 ILE H B 106 ILE HG1x 1.0 . 3.97 1332 912 B 106 ILE H B 106 ILE HG1y 1.0 . 3.97 1333 913 B 106 ILE H B 106 ILE HG2% 1.0 . 4.21 1334 914 B 106 ILE HD1% B 106 ILE HA 1.0 . 3.64 1335 915 B 106 ILE HG2% B 106 ILE HA 1.0 . 3.62 1336 916 B 106 ILE HA B 107 TYS H 1.0 . 3.24 1337 917 B 106 ILE HB B 106 ILE HD1% 1.0 . 3.30 1338 918 B 106 ILE HB B 107 TYS H 1.0 . 4.09 1339 919 B 106 ILE HG1y B 107 TYS H 1.0 . 5.28 1340 920 B 107 TYS H B 106 ILE HG1x 1.0 . 5.28 1341 921 B 106 ILE HD1% B 107 TYS H 1.0 . 3.80 1342 922 B 107 TYS H B 106 ILE HG1x 1.0 . 4.42 1343 922 B 106 ILE HG1y B 107 TYS H 1.0 . 4.42 1344 923 B 106 ILE HD1% B 106 ILE HG2% 1.0 . 2.40 1345 924 B 106 ILE HG2% B 106 ILE HG1x 1.0 . 3.00 1346 924 B 106 ILE HG1y B 106 ILE HG2% 1.0 . 3.00 1347 925 B 106 ILE HG2% B 107 TYS H 1.0 . 3.80 1348 926 B 107 TYS H B 107 TYS HBx 1.0 . 3.64 1349 927 B 107 TYS H B 107 TYS HBy 1.0 . 3.71 1350 928 B 107 TYS HBx C 223 VAL HG21 1.0 . 4.16 1351 928 B 107 TYS HBx C 223 VAL HG11 1.0 . 4.16 1352 929 B 107 TYS HBy C 223 VAL HG21 1.0 . 3.75 1353 929 B 107 TYS HBy C 223 VAL HG11 1.0 . 3.75 1354 930 B 108 THR H B 108 THR HG2% 1.0 . 4.66 1355 931 B 108 THR HG2% B 108 THR HA 1.0 . 3.69 1356 932 B 108 THR HB B 109 SER H 1.0 . 5.04 1357 933 B 110 ASP HBy B 111 ASN H 1.0 . 5.05 1358 934 B 111 ASN H B 110 ASP HBx 1.0 . 5.05 1359 935 B 112 TYS H B 111 ASN HBy 1.0 . 4.53 1360 935 B 111 ASN HBx B 112 TYS H 1.0 . 4.53 1361 936 B 112 TYS HBx B 112 TYS H 1.0 . 3.97 1362 937 B 112 TYS HBy B 112 TYS H 1.0 . 3.97 1363 938 B 112 TYS HBx B 113 THR H 1.0 . 4.25 1364 939 B 112 TYS HBy B 113 THR H 1.0 . 4.25 1365 940 B 113 THR H B 113 THR HB 1.0 . 3.85 1366 941 B 113 THR H B 113 THR HG2% 1.0 . 3.95 1367 942 B 113 THR HB B 113 THR HA 1.0 . 2.40 1368 943 B 113 THR HG2% B 113 THR HA 1.0 . 3.08 1369 944 B 113 THR HA B 114 GLU H 1.0 . 3.26 1370 945 B 113 THR HB B 114 GLU H 1.0 . 5.50 1371 946 B 113 THR HG2% B 114 GLU H 1.0 . 4.54 1372 947 B 114 GLU H B 114 GLU HBy 1.0 . 4.09 1373 948 B 114 GLU H B 114 GLU HBx 1.0 . 3.76 1374 949 B 114 GLU H B 114 GLU HGx 1.0 . 4.04 1375 949 B 114 GLU H B 114 GLU HGy 1.0 . 4.04 1376 950 B 114 GLU HA B 114 GLU HGx 1.0 . 3.30 1377 950 B 114 GLU HGy B 114 GLU HA 1.0 . 3.30 1378 951 B 114 GLU HA B 115 GLU H 1.0 . 3.29 1379 952 B 114 GLU HBy B 114 GLU HGx 1.0 . 2.40 1380 952 B 114 GLU HBy B 114 GLU HGy 1.0 . 2.40 1381 953 B 114 GLU HBx B 114 GLU HGx 1.0 . 2.40 1382 953 B 114 GLU HBx B 114 GLU HGy 1.0 . 2.40 1383 954 B 115 GLU H B 115 GLU HBy 1.0 . 3.75 1384 955 B 115 GLU H B 115 GLU HBx 1.0 . 3.75 1385 956 B 115 GLU H B 115 GLU HBy 1.0 . 3.26 1386 956 B 115 GLU H B 115 GLU HBx 1.0 . 3.26 1387 957 B 115 GLU H B 115 GLU HGx 1.0 . 3.82 1388 957 B 115 GLU H B 115 GLU HGy 1.0 . 3.82 1389 958 B 115 GLU HA B 115 GLU HGx 1.0 . 3.19 1390 958 B 115 GLU HGy B 115 GLU HA 1.0 . 3.19 1391 959 B 115 GLU HA B 116 MET H 1.0 . 3.34 1392 960 B 115 GLU HGy B 115 GLU HBy 1.0 . 2.40 1393 960 B 115 GLU HBy B 115 GLU HGx 1.0 . 2.40 1394 961 B 115 GLU HBx B 115 GLU HGy 1.0 . 2.40 1395 961 B 115 GLU HBx B 115 GLU HGx 1.0 . 2.40 1396 962 B 116 MET H B 116 MET HBy 1.0 . 3.41 1397 962 B 116 MET H B 116 MET HBx 1.0 . 3.41 1398 963 B 116 MET H B 116 MET HGy 1.0 . 4.25 1399 963 B 116 MET H B 116 MET HGx 1.0 . 4.25 1400 964 B 116 MET HA B 116 MET HGy 1.0 . 3.66 1401 964 B 116 MET HGx B 116 MET HA 1.0 . 3.66 1402 965 B 121 TYS H B 120 ASP HBy 1.0 . 5.14 1403 966 B 120 ASP HBy B 123 SER HBy 1.0 . 5.50 1404 967 B 120 ASP HBy B 123 SER HBx 1.0 . 5.50 1405 968 B 121 TYS H B 120 ASP HBx 1.0 . 5.14 1406 969 B 123 SER HBy B 120 ASP HBx 1.0 . 5.50 1407 970 B 120 ASP HBx B 123 SER HBx 1.0 . 5.50 1408 971 B 121 TYS H B 120 ASP HBx 1.0 . 4.27 1409 971 B 121 TYS H B 120 ASP HBy 1.0 . 4.27 1410 972 B 120 ASP HBy B 123 SER HBx 1.0 . 4.28 1411 972 B 123 SER HBy B 120 ASP HBx 1.0 . 4.28 1412 972 B 120 ASP HBy B 123 SER HBy 1.0 . 4.28 1413 972 B 120 ASP HBx B 123 SER HBx 1.0 . 4.28 1414 973 B 121 TYS H B 122 ASP H 1.0 . 4.81 1415 974 B 121 TYS HBx B 122 ASP H 1.0 . 4.52 1416 975 B 121 TYS HBy B 122 ASP H 1.0 . 4.72 1417 976 B 122 ASP H B 122 ASP HBy 1.0 . 4.03 1418 977 B 122 ASP H B 122 ASP HBx 1.0 . 4.03 1419 978 B 123 SER HBy B 122 ASP HBy 1.0 . 5.50 1420 979 B 122 ASP HBy B 123 SER HBx 1.0 . 5.50 1421 980 B 123 SER HBy B 122 ASP HBx 1.0 . 5.50 1422 981 B 122 ASP HBx B 123 SER HBx 1.0 . 5.50 1423 982 B 122 ASP HBy B 123 SER HBx 1.0 . 4.29 1424 982 B 123 SER HBy B 122 ASP HBx 1.0 . 4.29 1425 982 B 123 SER HBy B 122 ASP HBy 1.0 . 4.29 1426 982 B 122 ASP HBx B 123 SER HBx 1.0 . 4.29 1427 983 B 124 MET HA B 124 MET HGy 1.0 . 4.24 1428 984 B 124 MET HA B 124 MET HGx 1.0 . 4.24 1429 985 B 124 MET HA B 124 MET HGx 1.0 . 3.67 1430 985 B 124 MET HA B 124 MET HGy 1.0 . 3.67 1431 986 B 124 MET HA B 125 LYS H 1.0 . 3.43 1432 987 B 124 MET HGy B 124 MET HBy 1.0 . 2.98 1433 988 B 124 MET HBy B 124 MET HGx 1.0 . 2.98 1434 989 B 124 MET HGy B 124 MET HBx 1.0 . 2.98 1435 990 B 124 MET HBx B 124 MET HGx 1.0 . 2.98 1436 991 B 124 MET HBy B 124 MET HGx 1.0 . 2.31 1437 991 B 124 MET HBx B 124 MET HGx 1.0 . 2.31 1438 991 B 124 MET HGy B 124 MET HBx 1.0 . 2.31 1439 991 B 124 MET HGy B 124 MET HBy 1.0 . 2.31 1440 992 B 125 LYS H B 125 LYS HBy 1.0 . 3.72 1441 993 B 125 LYS H B 125 LYS HBx 1.0 . 3.72 1442 994 B 125 LYS H B 125 LYS HDx 1.0 . 4.46 1443 994 B 125 LYS H B 125 LYS HDy 1.0 . 4.46 1444 995 B 125 LYS H B 125 LYS HGx 1.0 . 4.02 1445 995 B 125 LYS H B 125 LYS HGy 1.0 . 4.02 1446 996 B 125 LYS HA B 125 LYS HDx 1.0 . 4.26 1447 996 B 125 LYS HDy B 125 LYS HA 1.0 . 4.26 1448 997 B 125 LYS HA B 125 LYS HEx 1.0 . 4.66 1449 997 B 125 LYS HA B 125 LYS HEy 1.0 . 4.66 1450 998 B 125 LYS HA B 125 LYS HGx 1.0 . 3.86 1451 998 B 125 LYS HGy B 125 LYS HA 1.0 . 3.86 1452 999 B 125 LYS HA B 126 GLU H 1.0 . 3.13 1453 1000 B 125 LYS HEy B 125 LYS HBy 1.0 . 4.05 1454 1000 B 125 LYS HBy B 125 LYS HEx 1.0 . 4.05 1455 1001 B 126 GLU H B 125 LYS HBy 1.0 . 4.16 1456 1002 B 125 LYS HEy B 125 LYS HBx 1.0 . 4.05 1457 1002 B 125 LYS HBx B 125 LYS HEx 1.0 . 4.05 1458 1003 B 126 GLU H B 125 LYS HBx 1.0 . 4.16 1459 1004 B 125 LYS HBx B 125 LYS HDx 1.0 . 2.37 1460 1004 B 125 LYS HBy B 125 LYS HDx 1.0 . 2.37 1461 1004 B 125 LYS HDy B 125 LYS HBx 1.0 . 2.37 1462 1004 B 125 LYS HDy B 125 LYS HBy 1.0 . 2.37 1463 1005 B 125 LYS HBx B 125 LYS HEx 1.0 . 3.38 1464 1005 B 125 LYS HEy B 125 LYS HBx 1.0 . 3.38 1465 1005 B 125 LYS HEy B 125 LYS HBy 1.0 . 3.38 1466 1005 B 125 LYS HBy B 125 LYS HEx 1.0 . 3.38 1467 1006 B 126 GLU H B 125 LYS HBx 1.0 . 3.53 1468 1006 B 126 GLU H B 125 LYS HBy 1.0 . 3.53 1469 1007 B 125 LYS HDx B 125 LYS HGx 1.0 . 2.57 1470 1007 B 125 LYS HDy B 125 LYS HGx 1.0 . 2.57 1471 1007 B 125 LYS HGy B 125 LYS HDx 1.0 . 2.57 1472 1007 B 125 LYS HDy B 125 LYS HGy 1.0 . 2.57 1473 1008 B 125 LYS HEy B 125 LYS HGx 1.0 . 3.29 1474 1008 B 125 LYS HEx B 125 LYS HGx 1.0 . 3.29 1475 1008 B 125 LYS HGy B 125 LYS HEx 1.0 . 3.29 1476 1008 B 125 LYS HGy B 125 LYS HEy 1.0 . 3.29 1477 1009 B 126 GLU H B 125 LYS HGx 1.0 . 4.44 1478 1009 B 125 LYS HGy B 126 GLU H 1.0 . 4.44 1479 1010 B 126 GLU H B 127 PRO HDy 1.0 . 4.42 1480 1010 B 126 GLU H B 127 PRO HDx 1.0 . 4.42 1481 1011 B 127 PRO HA B 128 ALA H 1.0 . 3.18 1482 1012 B 128 ALA H B 127 PRO HBy 1.0 . 4.19 1483 1013 B 128 ALA H B 127 PRO HBx 1.0 . 4.19 1484 1014 B 127 PRO HBx C 266 LEU HD21 1.0 . 3.93 1485 1014 B 127 PRO HBy C 266 LEU HD21 1.0 . 3.93 1486 1014 C 266 LEU HD11 B 127 PRO HBy 1.0 . 3.93 1487 1014 C 266 LEU HD11 B 127 PRO HBx 1.0 . 3.93 1488 1015 B 128 ALA H B 127 PRO HDy 1.0 . 4.73 1489 1015 B 127 PRO HDx B 128 ALA H 1.0 . 4.73 1490 1016 B 127 PRO HDx C 266 LEU HD21 1.0 . 5.28 1491 1016 B 127 PRO HDy C 266 LEU HD21 1.0 . 5.28 1492 1016 C 266 LEU HD11 B 127 PRO HDy 1.0 . 5.28 1493 1016 C 266 LEU HD11 B 127 PRO HDx 1.0 . 5.28 1494 1017 B 128 ALA H B 127 PRO HGx 1.0 . 4.44 1495 1017 B 128 ALA H B 127 PRO HGy 1.0 . 4.44 1496 1018 B 127 PRO HGx C 266 LEU HD21 1.0 . 4.60 1497 1018 B 127 PRO HGy C 266 LEU HD21 1.0 . 4.60 1498 1018 C 266 LEU HD11 B 127 PRO HGx 1.0 . 4.60 1499 1018 C 266 LEU HD11 B 127 PRO HGy 1.0 . 4.60 1500 1019 B 128 ALA H B 128 ALA HB% 1.0 . 3.09 1501 1020 B 128 ALA HA B 129 PHE H 1.0 . 3.14 1502 1021 B 128 ALA HB% B 129 PHE H 1.0 . 3.64 1503 1022 B 129 PHE H B 129 PHE HBy 1.0 . 3.61 1504 1023 B 129 PHE H B 129 PHE HBx 1.0 . 3.61 1505 1024 B 129 PHE H B 129 PHE HBx 1.0 . 3.14 1506 1024 B 129 PHE H B 129 PHE HBy 1.0 . 3.14 1507 1025 B 129 PHE H B 129 PHE HD% 1.0 . 4.35 1508 1026 B 129 PHE HD% B 129 PHE HA 1.0 . 3.46 1509 1027 B 129 PHE HA B 129 PHE HE% 1.0 . 4.06 1510 1028 B 129 PHE HA B 130 ARG H 1.0 . 3.47 1511 1029 B 129 PHE HBy B 130 ARG H 1.0 . 4.39 1512 1030 B 130 ARG H B 129 PHE HBx 1.0 . 4.39 1513 1031 B 129 PHE HD% C 266 LEU HD21 1.0 . 3.35 1514 1031 C 266 LEU HD11 B 129 PHE HD% 1.0 . 3.35 1515 1032 B 130 ARG H B 130 ARG HBy 1.0 . 4.12 1516 1033 B 130 ARG H B 130 ARG HBx 1.0 . 4.12 1517 1034 B 130 ARG H B 130 ARG HBx 1.0 . 3.49 1518 1034 B 130 ARG H B 130 ARG HBy 1.0 . 3.49 1519 1035 B 130 ARG H B 130 ARG HGx 1.0 . 3.94 1520 1035 B 130 ARG H B 130 ARG HGy 1.0 . 3.94 1521 1036 B 130 ARG HA B 130 ARG HDx 1.0 . 4.48 1522 1036 B 130 ARG HA B 130 ARG HDy 1.0 . 4.48 1523 1037 B 130 ARG HA B 130 ARG HGx 1.0 . 3.72 1524 1037 B 130 ARG HGy B 130 ARG HA 1.0 . 3.72 1525 1038 B 130 ARG HA B 131 GLU H 1.0 . 3.22 1526 1039 B 130 ARG HBy B 130 ARG HDy 1.0 . 3.80 1527 1039 B 130 ARG HBy B 130 ARG HDx 1.0 . 3.80 1528 1040 B 130 ARG HBy B 130 ARG HGy 1.0 . 2.88 1529 1040 B 130 ARG HBy B 130 ARG HGx 1.0 . 2.88 1530 1041 B 130 ARG HDy B 130 ARG HBx 1.0 . 3.80 1531 1041 B 130 ARG HBx B 130 ARG HDx 1.0 . 3.80 1532 1042 B 130 ARG HGy B 130 ARG HBx 1.0 . 2.88 1533 1042 B 130 ARG HBx B 130 ARG HGx 1.0 . 2.88 1534 1043 B 131 GLU H B 130 ARG HGx 1.0 . 4.74 1535 1043 B 130 ARG HGy B 131 GLU H 1.0 . 4.74 1536 1044 B 131 GLU H B 131 GLU HBy 1.0 . 4.19 1537 1045 B 131 GLU H B 131 GLU HBx 1.0 . 4.19 1538 1046 B 131 GLU H B 131 GLU HBy 1.0 . 3.53 1539 1046 B 131 GLU H B 131 GLU HBx 1.0 . 3.53 1540 1047 B 131 GLU H B 131 GLU HGx 1.0 . 4.59 1541 1047 B 131 GLU H B 131 GLU HGy 1.0 . 4.59 1542 1048 B 131 GLU HA B 131 GLU HGx 1.0 . 3.13 1543 1048 B 131 GLU HGy B 131 GLU HA 1.0 . 3.13 1544 1049 B 131 GLU HA B 132 GLU H 1.0 . 3.16 1545 1050 B 131 GLU HGy B 131 GLU HBy 1.0 . 2.40 1546 1050 B 131 GLU HBy B 131 GLU HGx 1.0 . 2.40 1547 1051 B 132 GLU H B 131 GLU HBy 1.0 . 4.05 1548 1052 B 131 GLU HBx B 131 GLU HGy 1.0 . 2.40 1549 1052 B 131 GLU HBx B 131 GLU HGx 1.0 . 2.40 1550 1053 B 131 GLU HBx B 132 GLU H 1.0 . 4.05 1551 1054 B 132 GLU H B 131 GLU HBy 1.0 . 3.34 1552 1054 B 131 GLU HBx B 132 GLU H 1.0 . 3.34 1553 1055 B 132 GLU H B 131 GLU HGx 1.0 . 4.38 1554 1055 B 131 GLU HGy B 132 GLU H 1.0 . 4.38 1555 1056 B 132 GLU H B 132 GLU HBy 1.0 . 3.79 1556 1057 B 132 GLU H B 132 GLU HBx 1.0 . 3.79 1557 1058 B 132 GLU H B 132 GLU HBy 1.0 . 3.26 1558 1058 B 132 GLU H B 132 GLU HBx 1.0 . 3.26 1559 1059 B 132 GLU H B 132 GLU HGx 1.0 . 3.91 1560 1059 B 132 GLU H B 132 GLU HGy 1.0 . 3.91 1561 1060 B 132 GLU HA B 132 GLU HGx 1.0 . 3.20 1562 1060 B 132 GLU HGy B 132 GLU HA 1.0 . 3.20 1563 1061 B 132 GLU HGy B 132 GLU HBy 1.0 . 2.40 1564 1061 B 132 GLU HBy B 132 GLU HGx 1.0 . 2.40 1565 1062 B 132 GLU HBx B 132 GLU HGy 1.0 . 2.40 1566 1062 B 132 GLU HBx B 132 GLU HGx 1.0 . 2.40 1567 1063 B 136 PHE HA B 136 PHE HD% 1.0 . 3.51 1568 1064 B 136 PHE HA B 136 PHE HE% 1.0 . 4.26 1569 1065 B 138 LYS HA B 138 LYS HDx 1.0 . 5.50 1570 1065 B 138 LYS HA B 138 LYS HDy 1.0 . 5.50 1571 1066 B 138 LYS HA B 138 LYS HEx 1.0 . 4.76 1572 1066 B 138 LYS HA B 138 LYS HEy 1.0 . 4.76 1573 1067 B 138 LYS HDy B 138 LYS HBy 1.0 . 2.40 1574 1067 B 138 LYS HBy B 138 LYS HDx 1.0 . 2.40 1575 1068 B 138 LYS HDy B 138 LYS HBx 1.0 . 2.40 1576 1068 B 138 LYS HBx B 138 LYS HDx 1.0 . 2.40 1577 1069 B 138 LYS HBx B 138 LYS HEx 1.0 . 3.26 1578 1069 B 138 LYS HBy B 138 LYS HEx 1.0 . 3.26 1579 1069 B 138 LYS HEy B 138 LYS HBx 1.0 . 3.26 1580 1069 B 138 LYS HEy B 138 LYS HBy 1.0 . 3.26 1581 1070 B 138 LYS HEy B 138 LYS HGx 1.0 . 3.60 1582 1070 B 138 LYS HEx B 138 LYS HGx 1.0 . 3.60 1583 1070 B 138 LYS HGy B 138 LYS HEx 1.0 . 3.60 1584 1070 B 138 LYS HEy B 138 LYS HGy 1.0 . 3.60 1585 1071 C 203 VAL HA C 203 VAL HG11 1.0 . 3.57 1586 1071 C 203 VAL HA C 203 VAL HG21 1.0 . 3.57 1587 1072 C 205 LEU HA C 205 LEU HD11 1.0 . 3.45 1588 1072 C 205 LEU HA C 205 LEU HD21 1.0 . 3.45 1589 1073 C 206 SER HA C 207 TYR HD% 1.0 . 4.35 1590 1074 C 207 TYR HD% C 206 SER HBx 1.0 . 4.41 1591 1074 C 207 TYR HD% C 206 SER HBy 1.0 . 4.41 1592 1075 C 207 TYR HD% C 207 TYR HA 1.0 . 3.86 1593 1076 C 208 ARG HA C 208 ARG HDx 1.0 . 4.43 1594 1076 C 208 ARG HA C 208 ARG HDy 1.0 . 4.43 1595 1077 C 208 ARG HA C 208 ARG HGx 1.0 . 3.94 1596 1077 C 208 ARG HA C 208 ARG HGy 1.0 . 3.94 1597 1078 C 208 ARG HDy C 208 ARG HBx 1.0 . 4.08 1598 1078 C 208 ARG HBx C 208 ARG HDx 1.0 . 4.08 1599 1079 C 208 ARG HDy C 208 ARG HBy 1.0 . 4.08 1600 1079 C 208 ARG HBy C 208 ARG HDx 1.0 . 4.08 1601 1080 C 208 ARG HBy C 208 ARG HDx 1.0 . 3.52 1602 1080 C 208 ARG HBx C 208 ARG HDx 1.0 . 3.52 1603 1080 C 208 ARG HDy C 208 ARG HBy 1.0 . 3.52 1604 1080 C 208 ARG HDy C 208 ARG HBx 1.0 . 3.52 1605 1081 C 209 CYS CB C 234 CYS CB 1.0 . 3.99 1606 1082 C 209 CYS CB C 234 CYS SG 1.0 . 3.10 1607 1083 C 210 PRO HDy C 209 CYS HBx 1.0 . 5.44 1608 1083 C 209 CYS HBx C 210 PRO HDx 1.0 . 5.44 1609 1084 C 210 PRO HDy C 209 CYS HBy 1.0 . 5.44 1610 1084 C 209 CYS HBy C 210 PRO HDx 1.0 . 5.44 1611 1085 C 209 CYS HBx C 210 PRO HDx 1.0 . 4.69 1612 1085 C 210 PRO HDy C 209 CYS HBx 1.0 . 4.69 1613 1085 C 210 PRO HDy C 209 CYS HBy 1.0 . 4.69 1614 1085 C 209 CYS HBy C 210 PRO HDx 1.0 . 4.69 1615 1086 C 234 CYS CB C 209 CYS SG 1.0 . 3.10 1616 1087 C 234 CYS SG C 209 CYS SG 1.0 . 2.10 1617 1088 C 229 LEU HD11 C 210 PRO HBx 1.0 . 5.50 1618 1089 C 210 PRO HBx C 229 LEU HD21 1.0 . 5.50 1619 1090 C 210 PRO HBx C 229 LEU HD21 1.0 . 4.48 1620 1090 C 229 LEU HD11 C 210 PRO HBx 1.0 . 4.48 1621 1091 C 210 PRO HBx C 231 THR HG21 1.0 . 5.31 1622 1092 C 210 PRO HBy C 211 CYS H 1.0 . 4.48 1623 1093 C 210 PRO HBy C 229 LEU HD21 1.0 . 4.54 1624 1093 C 229 LEU HD11 C 210 PRO HBy 1.0 . 4.54 1625 1094 C 231 THR HG21 C 210 PRO HBy 1.0 . 5.02 1626 1095 C 211 CYS H C 210 PRO HDx 1.0 . 4.54 1627 1095 C 210 PRO HDy C 211 CYS H 1.0 . 4.54 1628 1096 C 210 PRO HDx C 229 LEU HD21 1.0 . 4.51 1629 1096 C 210 PRO HDy C 229 LEU HD21 1.0 . 4.51 1630 1096 C 229 LEU HD11 C 210 PRO HDx 1.0 . 4.51 1631 1096 C 229 LEU HD11 C 210 PRO HDy 1.0 . 4.51 1632 1097 C 231 THR HG21 C 210 PRO HDx 1.0 . 4.49 1633 1097 C 210 PRO HDy C 231 THR HG21 1.0 . 4.49 1634 1098 C 210 PRO HGx C 229 LEU HD21 1.0 . 4.00 1635 1098 C 210 PRO HGy C 229 LEU HD21 1.0 . 4.00 1636 1098 C 229 LEU HD11 C 210 PRO HGx 1.0 . 4.00 1637 1098 C 229 LEU HD11 C 210 PRO HGy 1.0 . 4.00 1638 1099 C 231 THR HG21 C 210 PRO HGx 1.0 . 4.34 1639 1099 C 231 THR HG21 C 210 PRO HGy 1.0 . 4.34 1640 1100 C 211 CYS CB C 250 CYS CB 1.0 . 3.99 1641 1101 C 211 CYS CB C 250 CYS SG 1.0 . 3.10 1642 1102 C 250 CYS CB C 211 CYS SG 1.0 . 3.10 1643 1103 C 250 CYS SG C 211 CYS SG 1.0 . 2.10 1644 1104 C 212 ARG HA C 212 ARG HGx 1.0 . 4.12 1645 1105 C 212 ARG HA C 212 ARG HGy 1.0 . 4.12 1646 1106 C 212 ARG HA C 212 ARG HDx 1.0 . 4.53 1647 1106 C 212 ARG HA C 212 ARG HDy 1.0 . 4.53 1648 1107 C 212 ARG HBx C 212 ARG HDx 1.0 . 3.55 1649 1107 C 212 ARG HBy C 212 ARG HDx 1.0 . 3.55 1650 1107 C 212 ARG HDy C 212 ARG HBx 1.0 . 3.55 1651 1107 C 212 ARG HDy C 212 ARG HBy 1.0 . 3.55 1652 1108 C 213 PHE HD% C 212 ARG HBx 1.0 . 4.20 1653 1108 C 212 ARG HBy C 213 PHE HD% 1.0 . 4.20 1654 1109 C 213 PHE HE% C 212 ARG HBx 1.0 . 4.82 1655 1109 C 212 ARG HBy C 213 PHE HE% 1.0 . 4.82 1656 1110 C 213 PHE HE% C 212 ARG HDx 1.0 . 4.25 1657 1110 C 212 ARG HDy C 213 PHE HE% 1.0 . 4.25 1658 1111 C 213 PHE HD% C 212 ARG HGy 1.0 . 4.43 1659 1111 C 213 PHE HD% C 212 ARG HGx 1.0 . 4.43 1660 1112 C 213 PHE HE% C 212 ARG HGy 1.0 . 4.91 1661 1112 C 213 PHE HE% C 212 ARG HGx 1.0 . 4.91 1662 1113 C 213 PHE HD% C 213 PHE H 1.0 . 5.50 1663 1114 C 213 PHE HE% C 213 PHE H 1.0 . 5.50 1664 1115 C 213 PHE H C 214 PHE H 1.0 . 5.50 1665 1116 C 213 PHE HD% C 213 PHE HA 1.0 . 3.84 1666 1117 C 213 PHE HE% C 213 PHE HA 1.0 . 4.67 1667 1118 C 213 PHE HA C 214 PHE HD% 1.0 . 4.62 1668 1119 C 214 PHE H C 213 PHE HBx 1.0 . 4.24 1669 1119 C 214 PHE H C 213 PHE HBy 1.0 . 4.24 1670 1120 C 213 PHE HD% C 214 PHE H 1.0 . 5.08 1671 1121 C 214 PHE H C 214 PHE HD% 1.0 . 4.93 1672 1122 C 214 PHE H D 319 GLY HAx 1.0 . 5.07 1673 1122 C 214 PHE H D 319 GLY HAy 1.0 . 5.07 1674 1123 C 214 PHE HD% C 214 PHE HA 1.0 . 4.56 1675 1124 C 214 PHE HBx C 215 GLU H 1.0 . 5.35 1676 1125 C 214 PHE HBx C 250 CYS HBx 1.0 . 5.50 1677 1126 C 214 PHE HBx C 252 ASP H 1.0 . 4.78 1678 1127 C 214 PHE HBx C 252 ASP HA 1.0 . 5.50 1679 1128 C 215 GLU H C 214 PHE HBy 1.0 . 5.28 1680 1129 C 252 ASP HA C 214 PHE HBy 1.0 . 5.50 1681 1130 C 214 PHE HD% C 215 GLU H 1.0 . 5.50 1682 1131 C 214 PHE HD% C 252 ASP H 1.0 . 4.61 1683 1132 C 214 PHE HD% C 252 ASP HBy 1.0 . 4.52 1684 1132 C 214 PHE HD% C 252 ASP HBx 1.0 . 4.52 1685 1133 C 214 PHE HD% C 253 PRO HDx 1.0 . 5.03 1686 1133 C 214 PHE HD% C 253 PRO HDy 1.0 . 5.03 1687 1134 C 215 GLU H C 215 GLU HGx 1.0 . 5.09 1688 1135 C 215 GLU H C 215 GLU HGy 1.0 . 5.09 1689 1136 C 215 GLU H C 215 GLU HGy 1.0 . 4.43 1690 1136 C 215 GLU H C 215 GLU HGx 1.0 . 4.43 1691 1137 C 215 GLU H C 218 VAL HG11 1.0 . 4.96 1692 1137 C 215 GLU H C 218 VAL HG21 1.0 . 4.96 1693 1138 C 215 GLU H C 251 ILE HA 1.0 . 5.23 1694 1139 C 215 GLU H C 251 ILE HD11 1.0 . 5.50 1695 1140 C 215 GLU H C 252 ASP H 1.0 . 5.07 1696 1141 C 215 GLU HBx C 218 VAL HG11 1.0 . 4.21 1697 1141 C 218 VAL HG21 C 215 GLU HBx 1.0 . 4.21 1698 1142 C 215 GLU HBy C 218 VAL HG11 1.0 . 3.69 1699 1142 C 218 VAL HG21 C 215 GLU HBy 1.0 . 3.69 1700 1143 C 215 GLU HBy C 251 ILE HG21 1.0 . 5.16 1701 1144 C 215 GLU HGx C 218 VAL HG21 1.0 . 3.85 1702 1144 C 215 GLU HGx C 218 VAL HG11 1.0 . 3.85 1703 1145 C 218 VAL HG21 C 215 GLU HGy 1.0 . 3.85 1704 1145 C 215 GLU HGy C 218 VAL HG11 1.0 . 3.85 1705 1146 D 323 SER HA C 215 GLU HGy 1.0 . 4.56 1706 1146 C 215 GLU HGx D 323 SER HA 1.0 . 4.56 1707 1147 C 252 ASP H C 216 SER HA 1.0 . 4.85 1708 1148 C 252 ASP HBx C 216 SER HA 1.0 . 5.50 1709 1149 C 216 SER HA C 252 ASP HBy 1.0 . 5.50 1710 1150 C 216 SER HA C 255 LEU HD11 1.0 . 4.99 1711 1151 C 216 SER HA C 255 LEU HD21 1.0 . 5.02 1712 1152 C 217 HIS HD2 C 216 SER HBx 1.0 . 4.60 1713 1153 C 217 HIS HD2 C 216 SER HBy 1.0 . 4.60 1714 1154 C 252 ASP H C 216 SER HBy 1.0 . 4.59 1715 1154 C 252 ASP H C 216 SER HBx 1.0 . 4.59 1716 1155 C 216 SER HBy C 252 ASP HBy 1.0 . 4.76 1717 1155 C 216 SER HBx C 252 ASP HBy 1.0 . 4.76 1718 1155 C 252 ASP HBx C 216 SER HBy 1.0 . 4.76 1719 1155 C 252 ASP HBx C 216 SER HBx 1.0 . 4.76 1720 1156 C 255 LEU HD21 C 216 SER HBy 1.0 . 4.50 1721 1156 C 255 LEU HD21 C 216 SER HBx 1.0 . 4.50 1722 1157 C 217 HIS HD2 C 217 HIS HA 1.0 . 4.68 1723 1158 C 255 LEU HD21 C 217 HIS HD2 1.0 . 4.70 1724 1159 C 217 HIS HD2 C 217 HIS HBx 1.0 . 3.76 1725 1159 C 217 HIS HD2 C 217 HIS HBy 1.0 . 3.76 1726 1160 C 217 HIS HE1 C 217 HIS HBx 1.0 . 4.84 1727 1160 C 217 HIS HBy C 217 HIS HE1 1.0 . 4.84 1728 1161 C 218 VAL H C 217 HIS HBx 1.0 . 4.50 1729 1161 C 217 HIS HBy C 218 VAL H 1.0 . 4.50 1730 1162 C 218 VAL H C 218 VAL HG11 1.0 . 3.50 1731 1162 C 218 VAL HG21 C 218 VAL H 1.0 . 3.50 1732 1163 C 218 VAL HA C 218 VAL HG11 1.0 . 3.80 1733 1163 C 218 VAL HG21 C 218 VAL HA 1.0 . 3.80 1734 1164 C 218 VAL HA C 219 ALA HB1 1.0 . 5.37 1735 1165 C 251 ILE HG21 C 218 VAL HB 1.0 . 3.85 1736 1166 C 255 LEU HD11 C 218 VAL HB 1.0 . 4.50 1737 1167 C 218 VAL HB C 257 TRP HZ2 1.0 . 5.13 1738 1168 C 219 ALA H C 218 VAL HG11 1.0 . 4.97 1739 1168 C 218 VAL HG21 C 219 ALA H 1.0 . 4.97 1740 1169 C 222 ASN H C 218 VAL HG11 1.0 . 4.45 1741 1169 C 218 VAL HG21 C 222 ASN H 1.0 . 4.45 1742 1170 C 222 ASN HBx C 218 VAL HG11 1.0 . 5.50 1743 1170 C 218 VAL HG21 C 222 ASN HBx 1.0 . 5.50 1744 1171 C 222 ASN HBy C 218 VAL HG11 1.0 . 4.69 1745 1171 C 218 VAL HG21 C 222 ASN HBy 1.0 . 4.69 1746 1172 C 218 VAL HG11 C 222 ASN HD2y 1.0 . 5.22 1747 1172 C 218 VAL HG21 C 222 ASN HD2y 1.0 . 5.22 1748 1172 C 222 ASN HD2x C 218 VAL HG11 1.0 . 5.22 1749 1172 C 218 VAL HG21 C 222 ASN HD2x 1.0 . 5.22 1750 1173 C 223 VAL H C 218 VAL HG11 1.0 . 4.32 1751 1173 C 218 VAL HG21 C 223 VAL H 1.0 . 4.32 1752 1174 C 252 ASP H C 218 VAL HG11 1.0 . 4.79 1753 1174 C 252 ASP H C 218 VAL HG21 1.0 . 4.79 1754 1175 C 257 TRP HE1 C 218 VAL HG11 1.0 . 5.11 1755 1175 C 218 VAL HG21 C 257 TRP HE1 1.0 . 5.11 1756 1176 C 257 TRP HH2 C 218 VAL HG11 1.0 . 3.58 1757 1176 C 218 VAL HG21 C 257 TRP HH2 1.0 . 3.58 1758 1177 C 257 TRP HZ2 C 218 VAL HG11 1.0 . 3.55 1759 1177 C 218 VAL HG21 C 257 TRP HZ2 1.0 . 3.55 1760 1178 D 321 TYS HBx C 218 VAL HG11 1.0 . 5.10 1761 1178 C 218 VAL HG21 D 321 TYS HBx 1.0 . 5.10 1762 1179 D 321 TYS HBy C 218 VAL HG11 1.0 . 4.91 1763 1179 C 218 VAL HG21 D 321 TYS HBy 1.0 . 4.91 1764 1180 C 219 ALA H C 222 ASN HBx 1.0 . 5.50 1765 1181 C 219 ALA H C 222 ASN HBy 1.0 . 5.50 1766 1182 C 219 ALA H C 222 ASN HD2y 1.0 . 5.34 1767 1182 C 219 ALA H C 222 ASN HD2x 1.0 . 5.34 1768 1183 C 223 VAL HG11 C 219 ALA H 1.0 . 5.30 1769 1184 C 219 ALA H C 223 VAL HG21 1.0 . 5.30 1770 1185 C 257 TRP HE1 C 219 ALA HA 1.0 . 5.06 1771 1186 C 219 ALA HB1 C 220 ARG H 1.0 . 4.91 1772 1187 C 219 ALA HB1 C 221 ALA H 1.0 . 5.14 1773 1188 C 219 ALA HB1 C 222 ASN HBx 1.0 . 4.88 1774 1189 C 219 ALA HB1 C 222 ASN HBy 1.0 . 4.74 1775 1190 C 219 ALA HB1 C 223 VAL HG21 1.0 . 5.44 1776 1190 C 223 VAL HG11 C 219 ALA HB1 1.0 . 5.44 1777 1191 C 220 ARG H C 220 ARG HGx 1.0 . 5.50 1778 1192 C 220 ARG H C 220 ARG HGy 1.0 . 5.50 1779 1193 C 220 ARG HA C 220 ARG HDx 1.0 . 5.50 1780 1193 C 220 ARG HA C 220 ARG HDy 1.0 . 5.50 1781 1194 C 223 VAL H C 220 ARG HA 1.0 . 4.91 1782 1195 C 223 VAL HG11 C 220 ARG HA 1.0 . 5.50 1783 1196 C 220 ARG HA C 223 VAL HG21 1.0 . 5.50 1784 1197 C 257 TRP HH2 C 220 ARG HA 1.0 . 5.36 1785 1198 C 257 TRP HZ2 C 220 ARG HA 1.0 . 5.17 1786 1199 C 221 ALA H C 220 ARG HBx 1.0 . 5.50 1787 1200 C 221 ALA H C 220 ARG HBy 1.0 . 5.50 1788 1201 C 257 TRP HH2 C 220 ARG HBy 1.0 . 4.88 1789 1201 C 257 TRP HH2 C 220 ARG HBx 1.0 . 4.88 1790 1202 C 223 VAL H C 220 ARG HDx 1.0 . 5.04 1791 1202 C 223 VAL H C 220 ARG HDy 1.0 . 5.04 1792 1203 C 257 TRP HBx C 220 ARG HDx 1.0 . 5.50 1793 1203 C 220 ARG HDy C 257 TRP HBx 1.0 . 5.50 1794 1204 C 257 TRP HBy C 220 ARG HDx 1.0 . 5.50 1795 1204 C 220 ARG HDy C 257 TRP HBy 1.0 . 5.50 1796 1205 C 261 TYR HE% C 220 ARG HDx 1.0 . 4.32 1797 1205 C 261 TYR HE% C 220 ARG HDy 1.0 . 4.32 1798 1206 C 221 ALA H C 221 ALA HB1 1.0 . 4.18 1799 1207 C 222 ASN H C 221 ALA H 1.0 . 4.85 1800 1208 C 223 VAL H C 221 ALA HA 1.0 . 4.69 1801 1209 C 222 ASN H C 221 ALA HB1 1.0 . 3.77 1802 1210 C 221 ALA HB1 C 222 ASN HA 1.0 . 5.50 1803 1211 C 223 VAL H C 221 ALA HB1 1.0 . 5.50 1804 1212 C 222 ASN H C 222 ASN HBx 1.0 . 4.07 1805 1213 C 222 ASN H C 222 ASN HBy 1.0 . 3.97 1806 1214 C 222 ASN H C 223 VAL H 1.0 . 3.65 1807 1215 C 222 ASN HA C 243 LYS HBx 1.0 . 5.28 1808 1216 C 222 ASN HA C 243 LYS HBy 1.0 . 5.28 1809 1217 C 222 ASN HA C 243 LYS HDy 1.0 . 4.73 1810 1218 C 222 ASN HA C 243 LYS HGx 1.0 . 5.47 1811 1219 C 222 ASN HA C 243 LYS HGy 1.0 . 5.31 1812 1220 C 222 ASN HBx C 223 VAL H 1.0 . 4.95 1813 1221 C 222 ASN HBx C 223 VAL HG21 1.0 . 5.44 1814 1221 C 223 VAL HG11 C 222 ASN HBx 1.0 . 5.44 1815 1222 C 222 ASN HBx C 242 LEU HD21 1.0 . 4.95 1816 1222 C 222 ASN HBx C 242 LEU HD11 1.0 . 4.95 1817 1223 C 222 ASN HBx C 243 LYS HDy 1.0 . 5.50 1818 1224 C 222 ASN HBy C 223 VAL H 1.0 . 4.82 1819 1225 C 222 ASN HBy C 242 LEU HD21 1.0 . 5.28 1820 1225 C 222 ASN HBy C 242 LEU HD11 1.0 . 5.28 1821 1226 C 242 LEU HBx C 222 ASN HD2y 1.0 . 5.34 1822 1226 C 222 ASN HD2x C 242 LEU HBx 1.0 . 5.34 1823 1227 C 222 ASN HD2x C 242 LEU HD21 1.0 . 5.27 1824 1227 C 222 ASN HD2y C 242 LEU HD21 1.0 . 5.27 1825 1227 C 242 LEU HD11 C 222 ASN HD2y 1.0 . 5.27 1826 1227 C 222 ASN HD2x C 242 LEU HD11 1.0 . 5.27 1827 1228 C 223 VAL HG11 C 223 VAL H 1.0 . 4.42 1828 1229 C 223 VAL H C 223 VAL HG21 1.0 . 4.42 1829 1230 C 223 VAL H C 223 VAL HG21 1.0 . 3.29 1830 1230 C 223 VAL HG11 C 223 VAL H 1.0 . 3.29 1831 1231 C 223 VAL HB C 242 LEU H 1.0 . 5.50 1832 1232 C 224 LYS H C 223 VAL HG21 1.0 . 4.35 1833 1232 C 223 VAL HG11 C 224 LYS H 1.0 . 4.35 1834 1233 C 240 ALA HA C 223 VAL HG21 1.0 . 4.96 1835 1233 C 223 VAL HG11 C 240 ALA HA 1.0 . 4.96 1836 1234 C 242 LEU H C 223 VAL HG21 1.0 . 5.44 1837 1234 C 223 VAL HG11 C 242 LEU H 1.0 . 5.44 1838 1235 C 257 TRP HH2 C 223 VAL HG21 1.0 . 3.86 1839 1235 C 223 VAL HG11 C 257 TRP HH2 1.0 . 3.86 1840 1236 C 257 TRP HZ2 C 223 VAL HG21 1.0 . 3.74 1841 1236 C 223 VAL HG11 C 257 TRP HZ2 1.0 . 3.74 1842 1237 C 224 LYS H C 224 LYS HGx 1.0 . 4.72 1843 1238 C 224 LYS H C 224 LYS HGy 1.0 . 4.72 1844 1239 C 224 LYS H C 224 LYS HDx 1.0 . 4.46 1845 1239 C 224 LYS H C 224 LYS HDy 1.0 . 4.46 1846 1240 C 224 LYS H C 224 LYS HGy 1.0 . 4.02 1847 1240 C 224 LYS H C 224 LYS HGx 1.0 . 4.02 1848 1241 C 224 LYS H C 225 HIS H 1.0 . 3.98 1849 1242 C 224 LYS H C 241 ARG H 1.0 . 4.79 1850 1243 C 224 LYS H C 241 ARG O 1.0 . 2.00 1851 1244 C 243 LYS HGy C 224 LYS H 1.0 . 5.50 1852 1245 C 224 LYS HA C 224 LYS HDx 1.0 . 4.68 1853 1245 C 224 LYS HDy C 224 LYS HA 1.0 . 4.68 1854 1246 C 224 LYS HA C 243 LYS HDx 1.0 . 5.05 1855 1247 C 243 LYS HDy C 224 LYS HA 1.0 . 5.50 1856 1248 C 243 LYS HGx C 224 LYS HA 1.0 . 5.36 1857 1249 C 243 LYS HGy C 224 LYS HA 1.0 . 5.30 1858 1250 C 224 LYS HEy C 224 LYS HBx 1.0 . 3.57 1859 1250 C 224 LYS HBx C 224 LYS HEx 1.0 . 3.57 1860 1251 C 225 HIS H C 224 LYS HBx 1.0 . 4.03 1861 1252 C 224 LYS HEy C 224 LYS HBy 1.0 . 3.57 1862 1252 C 224 LYS HBy C 224 LYS HEx 1.0 . 3.57 1863 1253 C 225 HIS H C 224 LYS HBy 1.0 . 4.03 1864 1254 C 224 LYS HGx C 243 LYS HA 1.0 . 4.57 1865 1255 C 243 LYS HA C 224 LYS HGy 1.0 . 4.57 1866 1256 C 241 ARG O C 224 LYS N 1.0 . 3.00 1867 1257 C 224 LYS HBy C 224 LYS HDx 1.0 . 2.65 1868 1257 C 224 LYS HBx C 224 LYS HDx 1.0 . 2.65 1869 1257 C 224 LYS HDy C 224 LYS HBy 1.0 . 2.65 1870 1257 C 224 LYS HDy C 224 LYS HBx 1.0 . 2.65 1871 1258 C 224 LYS HBy C 224 LYS HEx 1.0 . 2.91 1872 1258 C 224 LYS HBx C 224 LYS HEx 1.0 . 2.91 1873 1258 C 224 LYS HEy C 224 LYS HBy 1.0 . 2.91 1874 1258 C 224 LYS HEy C 224 LYS HBx 1.0 . 2.91 1875 1259 C 241 ARG H C 224 LYS HBy 1.0 . 4.63 1876 1259 C 241 ARG H C 224 LYS HBx 1.0 . 4.63 1877 1260 C 243 LYS HA C 224 LYS HBy 1.0 . 5.34 1878 1260 C 243 LYS HA C 224 LYS HBx 1.0 . 5.34 1879 1261 C 225 HIS H C 224 LYS HDx 1.0 . 5.50 1880 1261 C 224 LYS HDy C 225 HIS H 1.0 . 5.50 1881 1262 C 241 ARG H C 224 LYS HEx 1.0 . 5.12 1882 1262 C 241 ARG H C 224 LYS HEy 1.0 . 5.12 1883 1263 C 243 LYS H C 224 LYS HEx 1.0 . 5.50 1884 1263 C 224 LYS HEy C 243 LYS H 1.0 . 5.50 1885 1264 C 243 LYS HA C 224 LYS HEx 1.0 . 4.80 1886 1264 C 224 LYS HEy C 243 LYS HA 1.0 . 4.80 1887 1265 C 225 HIS H C 224 LYS HGy 1.0 . 3.88 1888 1265 C 224 LYS HGx C 225 HIS H 1.0 . 3.88 1889 1266 C 243 LYS H C 224 LYS HGy 1.0 . 4.12 1890 1266 C 224 LYS HGx C 243 LYS H 1.0 . 4.12 1891 1267 C 243 LYS HA C 224 LYS HGy 1.0 . 3.80 1892 1267 C 224 LYS HGx C 243 LYS HA 1.0 . 3.80 1893 1268 C 240 ALA HA C 225 HIS H 1.0 . 5.45 1894 1269 C 225 HIS H C 240 ALA HB1 1.0 . 5.50 1895 1270 C 225 HIS H C 241 ARG H 1.0 . 4.32 1896 1271 C 226 LEU H C 225 HIS HBx 1.0 . 4.88 1897 1272 C 226 LEU H C 225 HIS HBy 1.0 . 4.96 1898 1273 C 225 HIS HE1 C 227 LYS HEy 1.0 . 4.62 1899 1273 C 227 LYS HEx C 225 HIS HE1 1.0 . 4.62 1900 1274 C 225 HIS HE1 C 241 ARG HBx 1.0 . 3.96 1901 1274 C 225 HIS HE1 C 241 ARG HBy 1.0 . 3.96 1902 1275 C 225 HIS HE1 C 241 ARG HDx 1.0 . 4.22 1903 1275 C 225 HIS HE1 C 241 ARG HDy 1.0 . 4.22 1904 1276 C 225 HIS HE1 C 241 ARG HGx 1.0 . 3.98 1905 1276 C 225 HIS HE1 C 241 ARG HGy 1.0 . 3.98 1906 1277 C 226 LEU H C 226 LEU HG 1.0 . 4.72 1907 1278 C 226 LEU H C 226 LEU HD11 1.0 . 4.94 1908 1279 C 226 LEU H C 226 LEU HD21 1.0 . 4.94 1909 1280 C 226 LEU H C 226 LEU HD21 1.0 . 4.25 1910 1280 C 226 LEU H C 226 LEU HD11 1.0 . 4.25 1911 1281 C 226 LEU HD11 C 226 LEU HA 1.0 . 5.20 1912 1282 C 226 LEU HA C 226 LEU HD21 1.0 . 5.20 1913 1283 C 226 LEU HA C 226 LEU HD21 1.0 . 3.69 1914 1283 C 226 LEU HD11 C 226 LEU HA 1.0 . 3.69 1915 1284 C 241 ARG H C 226 LEU HA 1.0 . 5.50 1916 1285 C 226 LEU HBx C 226 LEU HD11 1.0 . 4.20 1917 1286 C 226 LEU HBx C 226 LEU HD21 1.0 . 4.20 1918 1287 C 226 LEU HBx C 261 TYR HE% 1.0 . 4.31 1919 1288 C 226 LEU HBy C 227 LYS H 1.0 . 5.50 1920 1289 C 226 LEU HD11 C 227 LYS H 1.0 . 5.50 1921 1290 C 226 LEU HD11 C 257 TRP HH2 1.0 . 4.95 1922 1291 C 226 LEU HD11 C 257 TRP HZ3 1.0 . 5.19 1923 1292 C 227 LYS H C 226 LEU HD21 1.0 . 5.50 1924 1293 C 257 TRP HH2 C 226 LEU HD21 1.0 . 4.95 1925 1294 C 257 TRP HZ3 C 226 LEU HD21 1.0 . 5.19 1926 1295 C 227 LYS H C 226 LEU HD21 1.0 . 4.20 1927 1295 C 226 LEU HD11 C 227 LYS H 1.0 . 4.20 1928 1296 C 240 ALA HA C 226 LEU HD21 1.0 . 4.51 1929 1296 C 226 LEU HD11 C 240 ALA HA 1.0 . 4.51 1930 1297 C 240 ALA HB1 C 226 LEU HD21 1.0 . 3.31 1931 1297 C 226 LEU HD11 C 240 ALA HB1 1.0 . 3.31 1932 1298 C 257 TRP HH2 C 226 LEU HD21 1.0 . 4.10 1933 1298 C 226 LEU HD11 C 257 TRP HH2 1.0 . 4.10 1934 1299 C 257 TRP HZ2 C 226 LEU HD21 1.0 . 5.23 1935 1299 C 226 LEU HD11 C 257 TRP HZ2 1.0 . 5.23 1936 1300 C 257 TRP HZ3 C 226 LEU HD21 1.0 . 4.52 1937 1300 C 226 LEU HD11 C 257 TRP HZ3 1.0 . 4.52 1938 1301 C 226 LEU HD21 C 258 ILE HG1y 1.0 . 3.74 1939 1301 C 226 LEU HD11 C 258 ILE HG1y 1.0 . 3.74 1940 1301 C 258 ILE HG1x C 226 LEU HD21 1.0 . 3.74 1941 1301 C 226 LEU HD11 C 258 ILE HG1x 1.0 . 3.74 1942 1302 C 261 TYR HBx C 226 LEU HD21 1.0 . 4.96 1943 1302 C 226 LEU HD11 C 261 TYR HBx 1.0 . 4.96 1944 1303 C 261 TYR HBy C 226 LEU HD21 1.0 . 5.44 1945 1303 C 226 LEU HD11 C 261 TYR HBy 1.0 . 5.44 1946 1304 C 261 TYR HD% C 226 LEU HD21 1.0 . 3.94 1947 1304 C 226 LEU HD11 C 261 TYR HD% 1.0 . 3.94 1948 1305 C 261 TYR HE% C 226 LEU HD21 1.0 . 4.30 1949 1305 C 226 LEU HD11 C 261 TYR HE% 1.0 . 4.30 1950 1306 C 262 LEU H C 226 LEU HD21 1.0 . 4.88 1951 1306 C 226 LEU HD11 C 262 LEU H 1.0 . 4.88 1952 1307 C 227 LYS HGx C 227 LYS H 1.0 . 5.00 1953 1308 C 227 LYS HGy C 227 LYS H 1.0 . 4.95 1954 1309 C 228 ILE H C 227 LYS H 1.0 . 5.14 1955 1310 C 227 LYS H C 238 ILE HD11 1.0 . 5.50 1956 1311 C 227 LYS H C 238 ILE HG21 1.0 . 4.77 1957 1312 C 227 LYS H C 239 VAL H 1.0 . 4.43 1958 1313 C 227 LYS H C 239 VAL O 1.0 . 2.00 1959 1314 C 227 LYS H C 239 VAL HG11 1.0 . 5.50 1960 1315 C 227 LYS H C 239 VAL HG21 1.0 . 5.50 1961 1316 C 227 LYS H C 239 VAL HG21 1.0 . 4.26 1962 1316 C 227 LYS H C 239 VAL HG11 1.0 . 4.26 1963 1317 C 240 ALA HA C 227 LYS H 1.0 . 4.99 1964 1318 C 227 LYS HDx C 227 LYS HA 1.0 . 5.39 1965 1319 C 227 LYS HDy C 227 LYS HA 1.0 . 5.39 1966 1320 C 227 LYS HEx C 227 LYS HA 1.0 . 5.50 1967 1321 C 227 LYS HA C 227 LYS HEy 1.0 . 5.50 1968 1322 C 227 LYS HDx C 227 LYS HGx 1.0 . 2.40 1969 1323 C 227 LYS HGx C 227 LYS HEx 1.0 . 4.09 1970 1324 C 227 LYS HGx C 227 LYS HEy 1.0 . 4.09 1971 1325 C 227 LYS HGx C 228 ILE H 1.0 . 4.82 1972 1326 C 239 VAL O C 227 LYS N 1.0 . 3.00 1973 1327 C 239 VAL H C 227 LYS O 1.0 . 2.00 1974 1328 C 227 LYS O C 239 VAL N 1.0 . 3.00 1975 1329 C 227 LYS HEx C 227 LYS HBx 1.0 . 4.67 1976 1329 C 227 LYS HBy C 227 LYS HEx 1.0 . 4.67 1977 1330 C 227 LYS HBx C 227 LYS HEy 1.0 . 4.67 1978 1330 C 227 LYS HBy C 227 LYS HEy 1.0 . 4.67 1979 1331 C 227 LYS HBx C 227 LYS HEy 1.0 . 4.10 1980 1331 C 227 LYS HBy C 227 LYS HEy 1.0 . 4.10 1981 1331 C 227 LYS HEx C 227 LYS HBx 1.0 . 4.10 1982 1331 C 227 LYS HBy C 227 LYS HEx 1.0 . 4.10 1983 1332 C 228 ILE H C 227 LYS HBx 1.0 . 5.17 1984 1332 C 227 LYS HBy C 228 ILE H 1.0 . 5.17 1985 1333 C 239 VAL H C 227 LYS HBx 1.0 . 4.79 1986 1333 C 227 LYS HBy C 239 VAL H 1.0 . 4.79 1987 1334 C 227 LYS HEx C 229 LEU HD21 1.0 . 4.17 1988 1334 C 227 LYS HEy C 229 LEU HD21 1.0 . 4.17 1989 1334 C 229 LEU HD11 C 227 LYS HEy 1.0 . 4.17 1990 1334 C 229 LEU HD11 C 227 LYS HEx 1.0 . 4.17 1991 1335 C 228 ILE H C 228 ILE HD11 1.0 . 4.36 1992 1336 C 228 ILE H C 228 ILE HG1x 1.0 . 4.43 1993 1336 C 228 ILE H C 228 ILE HG1y 1.0 . 4.43 1994 1337 C 228 ILE H C 228 ILE HG21 1.0 . 4.67 1995 1338 C 228 ILE HD11 C 228 ILE HA 1.0 . 4.47 1996 1339 C 238 ILE HD11 C 228 ILE HA 1.0 . 5.50 1997 1340 C 238 ILE HG21 C 228 ILE HA 1.0 . 4.86 1998 1341 C 228 ILE HB C 228 ILE HD11 1.0 . 3.70 1999 1342 C 228 ILE HB C 229 LEU H 1.0 . 4.32 2000 1343 C 228 ILE HD11 C 229 LEU H 1.0 . 5.30 2001 1344 C 229 LEU H C 228 ILE HG1x 1.0 . 5.17 2002 1344 C 228 ILE HG1y C 229 LEU H 1.0 . 5.17 2003 1345 C 228 ILE HD11 C 228 ILE HG21 1.0 . 3.20 2004 1346 C 228 ILE HG21 C 228 ILE HG1x 1.0 . 3.93 2005 1346 C 228 ILE HG1y C 228 ILE HG21 1.0 . 3.93 2006 1347 C 228 ILE HG21 C 229 LEU H 1.0 . 4.41 2007 1348 C 228 ILE HG21 C 236 CYS HA 1.0 . 5.50 2008 1349 C 228 ILE HG21 C 238 ILE HD11 1.0 . 3.59 2009 1350 C 228 ILE HG21 C 238 ILE HG1x 1.0 . 4.08 2010 1350 C 228 ILE HG21 C 238 ILE HG1y 1.0 . 4.08 2011 1351 C 229 LEU HD11 C 229 LEU H 1.0 . 4.75 2012 1352 C 229 LEU H C 229 LEU HD21 1.0 . 4.75 2013 1353 C 229 LEU H C 229 LEU HD21 1.0 . 3.92 2014 1353 C 229 LEU HD11 C 229 LEU H 1.0 . 3.92 2015 1354 C 229 LEU H C 237 GLN H 1.0 . 4.69 2016 1355 C 229 LEU H C 237 GLN HBx 1.0 . 5.50 2017 1355 C 229 LEU H C 237 GLN HBy 1.0 . 5.50 2018 1356 C 229 LEU HA C 237 GLN HBx 1.0 . 5.50 2019 1356 C 229 LEU HA C 237 GLN HBy 1.0 . 5.50 2020 1357 C 229 LEU HD11 C 230 ASN H 1.0 . 5.50 2021 1358 C 230 ASN H C 229 LEU HD21 1.0 . 5.50 2022 1359 D 312 TYS HBx C 229 LEU HD21 1.0 . 4.36 2023 1359 C 229 LEU HD11 D 312 TYS HBx 1.0 . 4.36 2024 1360 D 312 TYS HBy C 229 LEU HD21 1.0 . 4.36 2025 1360 C 229 LEU HD11 D 312 TYS HBy 1.0 . 4.36 2026 1361 C 231 THR HG21 C 231 THR H 1.0 . 5.50 2027 1362 C 231 THR HB C 232 PRO HDx 1.0 . 4.89 2028 1362 C 231 THR HB C 232 PRO HDy 1.0 . 4.89 2029 1363 C 231 THR HG21 C 232 PRO HDx 1.0 . 4.34 2030 1363 C 231 THR HG21 C 232 PRO HDy 1.0 . 4.34 2031 1364 C 231 THR HG21 C 234 CYS HBx 1.0 . 5.38 2032 1365 C 231 THR HG21 C 234 CYS HBy 1.0 . 5.35 2033 1366 C 231 THR HG21 C 237 GLN HE2x 1.0 . 5.34 2034 1366 C 231 THR HG21 C 237 GLN HE2y 1.0 . 5.34 2035 1367 C 234 CYS HBx C 237 GLN HE2x 1.0 . 5.14 2036 1368 C 234 CYS HBx C 237 GLN HE2y 1.0 . 5.14 2037 1369 C 234 CYS HBx C 237 GLN HE2x 1.0 . 4.51 2038 1369 C 234 CYS HBx C 237 GLN HE2y 1.0 . 4.51 2039 1370 C 235 ALA HB1 C 236 CYS H 1.0 . 5.50 2040 1371 C 237 GLN HE2x C 235 ALA HB1 1.0 . 5.50 2041 1372 C 237 GLN HE2y C 235 ALA HB1 1.0 . 5.50 2042 1373 C 235 ALA HB1 C 254 LYS HDx 1.0 . 5.27 2043 1373 C 235 ALA HB1 C 254 LYS HDy 1.0 . 5.27 2044 1374 C 237 GLN H C 236 CYS HBx 1.0 . 5.50 2045 1375 C 237 GLN H C 236 CYS HBy 1.0 . 5.50 2046 1376 C 237 GLN H C 237 GLN HE2x 1.0 . 4.95 2047 1376 C 237 GLN H C 237 GLN HE2y 1.0 . 4.95 2048 1377 C 237 GLN H C 237 GLN HGx 1.0 . 4.76 2049 1377 C 237 GLN H C 237 GLN HGy 1.0 . 4.76 2050 1378 C 237 GLN H C 253 PRO HGy 1.0 . 4.54 2051 1379 C 237 GLN HE2x C 237 GLN HBx 1.0 . 5.09 2052 1379 C 237 GLN HBy C 237 GLN HE2x 1.0 . 5.09 2053 1380 C 237 GLN HE2y C 237 GLN HBx 1.0 . 5.09 2054 1380 C 237 GLN HBy C 237 GLN HE2y 1.0 . 5.09 2055 1381 C 237 GLN HE2y C 237 GLN HBx 1.0 . 4.26 2056 1381 C 237 GLN HBy C 237 GLN HE2x 1.0 . 4.26 2057 1381 C 237 GLN HE2x C 237 GLN HBx 1.0 . 4.26 2058 1381 C 237 GLN HBy C 237 GLN HE2y 1.0 . 4.26 2059 1382 C 238 ILE H C 237 GLN HBx 1.0 . 4.93 2060 1382 C 237 GLN HBy C 238 ILE H 1.0 . 4.93 2061 1383 C 237 GLN HE2x C 239 VAL HG21 1.0 . 4.93 2062 1383 C 239 VAL HG11 C 237 GLN HE2x 1.0 . 4.93 2063 1383 C 239 VAL HG11 C 237 GLN HE2y 1.0 . 4.93 2064 1383 C 237 GLN HE2y C 239 VAL HG21 1.0 . 4.93 2065 1384 C 237 GLN HE2x C 253 PRO HGy 1.0 . 4.94 2066 1384 C 237 GLN HE2y C 253 PRO HGy 1.0 . 4.94 2067 1385 C 238 ILE H C 238 ILE HB 1.0 . 3.95 2068 1386 C 238 ILE HD11 C 238 ILE H 1.0 . 4.16 2069 1387 C 238 ILE H C 238 ILE HG1x 1.0 . 5.26 2070 1387 C 238 ILE HG1y C 238 ILE H 1.0 . 5.26 2071 1388 C 238 ILE HG21 C 238 ILE H 1.0 . 4.15 2072 1389 C 238 ILE H C 251 ILE H 1.0 . 5.50 2073 1390 C 238 ILE HD11 C 238 ILE HA 1.0 . 5.26 2074 1391 C 238 ILE HG21 C 238 ILE HA 1.0 . 4.16 2075 1392 C 238 ILE HD11 C 238 ILE HB 1.0 . 3.64 2076 1393 C 239 VAL H C 238 ILE HB 1.0 . 4.16 2077 1394 C 238 ILE HB C 251 ILE H 1.0 . 5.35 2078 1395 C 238 ILE HB C 251 ILE HB 1.0 . 5.27 2079 1396 C 251 ILE HG21 C 238 ILE HB 1.0 . 4.13 2080 1397 C 238 ILE HB C 258 ILE HG1y 1.0 . 5.34 2081 1397 C 258 ILE HG1x C 238 ILE HB 1.0 . 5.34 2082 1398 C 251 ILE H C 238 ILE O 1.0 . 2.00 2083 1399 C 238 ILE O C 251 ILE N 1.0 . 3.00 2084 1400 C 238 ILE HD11 C 251 ILE HB 1.0 . 4.61 2085 1401 C 238 ILE HD11 C 258 ILE HD11 1.0 . 3.27 2086 1402 C 238 ILE HD11 C 258 ILE HG1y 1.0 . 4.19 2087 1402 C 258 ILE HG1x C 238 ILE HD11 1.0 . 4.19 2088 1403 C 238 ILE HD11 C 258 ILE HG21 1.0 . 3.35 2089 1404 C 239 VAL H C 238 ILE HG1x 1.0 . 5.50 2090 1404 C 239 VAL H C 238 ILE HG1y 1.0 . 5.50 2091 1405 C 238 ILE HG1x C 258 ILE HG1y 1.0 . 5.34 2092 1405 C 238 ILE HG1y C 258 ILE HG1y 1.0 . 5.34 2093 1405 C 258 ILE HG1x C 238 ILE HG1x 1.0 . 5.34 2094 1405 C 258 ILE HG1x C 238 ILE HG1y 1.0 . 5.34 2095 1406 C 238 ILE HG21 C 238 ILE HG1x 1.0 . 3.96 2096 1406 C 238 ILE HG21 C 238 ILE HG1y 1.0 . 3.96 2097 1407 C 238 ILE HG21 C 239 VAL H 1.0 . 4.17 2098 1408 C 238 ILE HG21 C 251 ILE H 1.0 . 5.50 2099 1409 C 238 ILE HG21 C 251 ILE HB 1.0 . 4.39 2100 1410 C 238 ILE HG21 C 251 ILE HG1y 1.0 . 4.41 2101 1410 C 238 ILE HG21 C 251 ILE HG1x 1.0 . 4.41 2102 1411 C 238 ILE HG21 C 253 PRO HDx 1.0 . 5.50 2103 1411 C 253 PRO HDy C 238 ILE HG21 1.0 . 5.50 2104 1412 C 239 VAL H C 239 VAL HG11 1.0 . 4.44 2105 1413 C 239 VAL H C 239 VAL HG21 1.0 . 4.44 2106 1414 C 239 VAL H C 239 VAL HG21 1.0 . 3.42 2107 1414 C 239 VAL H C 239 VAL HG11 1.0 . 3.42 2108 1415 C 239 VAL HA C 250 CYS HA 1.0 . 5.48 2109 1416 C 251 ILE H C 239 VAL HA 1.0 . 4.43 2110 1417 C 239 VAL HG11 C 240 ALA H 1.0 . 4.76 2111 1418 C 240 ALA H C 239 VAL HG21 1.0 . 4.76 2112 1419 C 240 ALA H C 239 VAL HG21 1.0 . 3.80 2113 1419 C 239 VAL HG11 C 240 ALA H 1.0 . 3.80 2114 1420 C 249 VAL H C 239 VAL HG21 1.0 . 4.22 2115 1420 C 239 VAL HG11 C 249 VAL H 1.0 . 4.22 2116 1421 C 240 ALA HB1 C 240 ALA H 1.0 . 4.13 2117 1422 C 240 ALA H C 249 VAL H 1.0 . 4.69 2118 1423 C 240 ALA H C 249 VAL O 1.0 . 2.00 2119 1424 C 251 ILE H C 240 ALA H 1.0 . 5.12 2120 1425 C 249 VAL O C 240 ALA N 1.0 . 3.00 2121 1426 C 249 VAL H C 240 ALA O 1.0 . 2.00 2122 1427 C 240 ALA O C 249 VAL N 1.0 . 3.00 2123 1428 C 241 ARG H C 240 ALA HB1 1.0 . 3.78 2124 1429 C 240 ALA HB1 C 249 VAL H 1.0 . 4.89 2125 1430 C 240 ALA HB1 C 249 VAL HB 1.0 . 5.43 2126 1431 C 240 ALA HB1 C 249 VAL HG21 1.0 . 3.15 2127 1432 C 240 ALA HB1 C 251 ILE H 1.0 . 4.59 2128 1433 C 257 TRP HH2 C 240 ALA HB1 1.0 . 4.76 2129 1434 C 257 TRP HZ2 C 240 ALA HB1 1.0 . 4.94 2130 1435 C 241 ARG H C 241 ARG HBx 1.0 . 4.04 2131 1435 C 241 ARG H C 241 ARG HBy 1.0 . 4.04 2132 1436 C 241 ARG H C 241 ARG HDx 1.0 . 5.50 2133 1436 C 241 ARG H C 241 ARG HDy 1.0 . 5.50 2134 1437 C 241 ARG H C 241 ARG HGx 1.0 . 5.50 2135 1437 C 241 ARG H C 241 ARG HGy 1.0 . 5.50 2136 1438 C 241 ARG H C 249 VAL H 1.0 . 5.50 2137 1439 C 241 ARG HA C 241 ARG HDx 1.0 . 5.50 2138 1439 C 241 ARG HDy C 241 ARG HA 1.0 . 5.50 2139 1440 C 241 ARG HA C 248 GLN HA 1.0 . 5.50 2140 1441 C 241 ARG HA C 248 GLN HGx 1.0 . 5.50 2141 1442 C 241 ARG HA C 248 GLN HGy 1.0 . 5.50 2142 1443 C 249 VAL H C 241 ARG HA 1.0 . 5.50 2143 1444 C 241 ARG HBx C 241 ARG HDx 1.0 . 4.08 2144 1444 C 241 ARG HBy C 241 ARG HDx 1.0 . 4.08 2145 1444 C 241 ARG HDy C 241 ARG HBx 1.0 . 4.08 2146 1444 C 241 ARG HBy C 241 ARG HDy 1.0 . 4.08 2147 1445 C 242 LEU H C 241 ARG HBx 1.0 . 4.60 2148 1445 C 242 LEU H C 241 ARG HBy 1.0 . 4.60 2149 1446 C 241 ARG HBy C 248 GLN HGy 1.0 . 5.34 2150 1446 C 241 ARG HBx C 248 GLN HGy 1.0 . 5.34 2151 1446 C 248 GLN HGx C 241 ARG HBx 1.0 . 5.34 2152 1446 C 241 ARG HBy C 248 GLN HGx 1.0 . 5.34 2153 1447 C 242 LEU H C 241 ARG HDx 1.0 . 5.12 2154 1447 C 242 LEU H C 241 ARG HDy 1.0 . 5.12 2155 1448 C 241 ARG HDy C 248 GLN HBx 1.0 . 5.50 2156 1448 C 241 ARG HDx C 248 GLN HBx 1.0 . 5.50 2157 1449 C 248 GLN HBy C 241 ARG HDx 1.0 . 5.50 2158 1449 C 241 ARG HDy C 248 GLN HBy 1.0 . 5.50 2159 1450 C 241 ARG HDy C 248 GLN HGy 1.0 . 5.34 2160 1450 C 241 ARG HDx C 248 GLN HGy 1.0 . 5.34 2161 1450 C 248 GLN HGx C 241 ARG HDx 1.0 . 5.34 2162 1450 C 241 ARG HDy C 248 GLN HGx 1.0 . 5.34 2163 1451 C 242 LEU HBx C 242 LEU H 1.0 . 4.14 2164 1452 C 242 LEU H C 242 LEU HG 1.0 . 5.01 2165 1453 C 242 LEU HD11 C 242 LEU H 1.0 . 4.41 2166 1454 C 242 LEU H C 242 LEU HD21 1.0 . 4.41 2167 1455 C 242 LEU H C 248 GLN HA 1.0 . 4.89 2168 1456 C 242 LEU H C 249 VAL H 1.0 . 5.47 2169 1457 C 242 LEU HD11 C 242 LEU HA 1.0 . 4.73 2170 1458 C 242 LEU HA C 242 LEU HD21 1.0 . 4.73 2171 1459 C 242 LEU HA C 242 LEU HD21 1.0 . 3.58 2172 1459 C 242 LEU HD11 C 242 LEU HA 1.0 . 3.58 2173 1460 C 242 LEU HBx C 243 LYS H 1.0 . 5.50 2174 1461 C 242 LEU HBx C 247 ARG H 1.0 . 3.45 2175 1462 C 242 LEU HD11 C 242 LEU HBy 1.0 . 4.24 2176 1463 C 242 LEU HBy C 242 LEU HD21 1.0 . 4.24 2177 1464 C 243 LYS H C 242 LEU HBy 1.0 . 4.79 2178 1465 C 247 ARG H C 242 LEU HBy 1.0 . 4.67 2179 1466 C 242 LEU HG C 247 ARG H 1.0 . 5.22 2180 1467 C 242 LEU HG C 249 VAL HG11 1.0 . 4.07 2181 1468 C 249 VAL HG21 C 242 LEU HG 1.0 . 4.17 2182 1469 C 242 LEU HD11 C 243 LYS H 1.0 . 4.61 2183 1470 C 243 LYS H C 242 LEU HD21 1.0 . 4.61 2184 1471 C 243 LYS H C 242 LEU HD21 1.0 . 3.81 2185 1471 C 242 LEU HD11 C 243 LYS H 1.0 . 3.81 2186 1472 C 242 LEU HD21 C 246 ASN HBy 1.0 . 4.88 2187 1472 C 242 LEU HD11 C 246 ASN HBy 1.0 . 4.88 2188 1472 C 246 ASN HBx C 242 LEU HD21 1.0 . 4.88 2189 1472 C 242 LEU HD11 C 246 ASN HBx 1.0 . 4.88 2190 1473 C 247 ARG H C 242 LEU HD21 1.0 . 4.54 2191 1473 C 242 LEU HD11 C 247 ARG H 1.0 . 4.54 2192 1474 C 247 ARG HA C 242 LEU HD21 1.0 . 5.44 2193 1474 C 242 LEU HD11 C 247 ARG HA 1.0 . 5.44 2194 1475 C 242 LEU HD11 C 247 ARG HBx 1.0 . 4.60 2195 1475 C 242 LEU HD21 C 247 ARG HBx 1.0 . 4.60 2196 1475 C 247 ARG HBy C 242 LEU HD21 1.0 . 4.60 2197 1475 C 242 LEU HD11 C 247 ARG HBy 1.0 . 4.60 2198 1476 C 242 LEU HD11 C 247 ARG HDy 1.0 . 4.17 2199 1476 C 242 LEU HD21 C 247 ARG HDy 1.0 . 4.17 2200 1476 C 247 ARG HDx C 242 LEU HD21 1.0 . 4.17 2201 1476 C 242 LEU HD11 C 247 ARG HDx 1.0 . 4.17 2202 1477 C 248 GLN HA C 242 LEU HD21 1.0 . 5.38 2203 1477 C 242 LEU HD11 C 248 GLN HA 1.0 . 5.38 2204 1478 C 249 VAL H C 242 LEU HD21 1.0 . 5.44 2205 1478 C 242 LEU HD11 C 249 VAL H 1.0 . 5.44 2206 1479 C 249 VAL HB C 242 LEU HD21 1.0 . 4.51 2207 1479 C 242 LEU HD11 C 249 VAL HB 1.0 . 4.51 2208 1480 C 243 LYS HDx C 243 LYS H 1.0 . 4.01 2209 1481 C 243 LYS HDy C 243 LYS H 1.0 . 4.03 2210 1482 C 243 LYS HGx C 243 LYS H 1.0 . 5.50 2211 1483 C 243 LYS HGy C 243 LYS H 1.0 . 4.13 2212 1484 C 243 LYS H C 243 LYS HEx 1.0 . 5.50 2213 1484 C 243 LYS H C 243 LYS HEy 1.0 . 5.50 2214 1485 C 243 LYS HDx C 243 LYS HA 1.0 . 4.98 2215 1486 C 243 LYS HDy C 243 LYS HA 1.0 . 5.40 2216 1487 C 243 LYS HA C 243 LYS HEx 1.0 . 4.74 2217 1487 C 243 LYS HA C 243 LYS HEy 1.0 . 4.74 2218 1488 C 243 LYS HBx C 243 LYS HEx 1.0 . 5.50 2219 1488 C 243 LYS HBx C 243 LYS HEy 1.0 . 5.50 2220 1489 C 243 LYS HBy C 243 LYS HEx 1.0 . 5.50 2221 1489 C 243 LYS HBy C 243 LYS HEy 1.0 . 5.50 2222 1490 C 246 ASN HA C 246 ASN HD2x 1.0 . 4.57 2223 1491 C 246 ASN HA C 246 ASN HD2y 1.0 . 4.57 2224 1492 C 246 ASN HA C 246 ASN HD2x 1.0 . 3.96 2225 1492 C 246 ASN HA C 246 ASN HD2y 1.0 . 3.96 2226 1493 C 247 ARG H C 246 ASN HBx 1.0 . 4.82 2227 1494 C 247 ARG H C 246 ASN HBy 1.0 . 4.82 2228 1495 C 247 ARG H C 246 ASN HBy 1.0 . 4.11 2229 1495 C 247 ARG H C 246 ASN HBx 1.0 . 4.11 2230 1496 C 247 ARG H C 247 ARG HDx 1.0 . 4.58 2231 1497 C 247 ARG H C 247 ARG HDy 1.0 . 4.58 2232 1498 C 247 ARG H C 247 ARG HDy 1.0 . 4.00 2233 1498 C 247 ARG H C 247 ARG HDx 1.0 . 4.00 2234 1499 C 247 ARG H C 247 ARG HGy 1.0 . 3.73 2235 1499 C 247 ARG H C 247 ARG HGx 1.0 . 3.73 2236 1500 C 247 ARG H C 248 GLN H 1.0 . 4.79 2237 1501 C 247 ARG HA C 247 ARG HDy 1.0 . 4.23 2238 1501 C 247 ARG HA C 247 ARG HDx 1.0 . 4.23 2239 1502 C 247 ARG HA C 248 GLN H 1.0 . 3.53 2240 1503 C 247 ARG HDx C 248 GLN H 1.0 . 5.50 2241 1504 C 248 GLN H C 247 ARG HDy 1.0 . 5.50 2242 1505 C 247 ARG HGx C 248 GLN H 1.0 . 4.92 2243 1506 C 248 GLN H C 247 ARG HGy 1.0 . 4.92 2244 1507 C 247 ARG HBx C 247 ARG HDy 1.0 . 3.35 2245 1507 C 247 ARG HBy C 247 ARG HDy 1.0 . 3.35 2246 1507 C 247 ARG HDx C 247 ARG HBx 1.0 . 3.35 2247 1507 C 247 ARG HBy C 247 ARG HDx 1.0 . 3.35 2248 1508 C 248 GLN H C 247 ARG HBx 1.0 . 4.03 2249 1508 C 247 ARG HBy C 248 GLN H 1.0 . 4.03 2250 1509 C 248 GLN H C 247 ARG HDy 1.0 . 4.78 2251 1509 C 247 ARG HDx C 248 GLN H 1.0 . 4.78 2252 1510 C 248 GLN H C 247 ARG HGy 1.0 . 4.05 2253 1510 C 247 ARG HGx C 248 GLN H 1.0 . 4.05 2254 1511 C 248 GLN HGx C 248 GLN H 1.0 . 5.27 2255 1512 C 248 GLN H C 248 GLN HGy 1.0 . 5.27 2256 1513 C 249 VAL H C 248 GLN HBx 1.0 . 4.98 2257 1514 C 249 VAL H C 248 GLN HBy 1.0 . 4.98 2258 1515 C 249 VAL H C 248 GLN HBx 1.0 . 4.25 2259 1515 C 249 VAL H C 248 GLN HBy 1.0 . 4.25 2260 1516 C 249 VAL H C 248 GLN HGy 1.0 . 5.34 2261 1516 C 249 VAL H C 248 GLN HGx 1.0 . 5.34 2262 1517 C 249 VAL H C 249 VAL HG11 1.0 . 4.22 2263 1518 C 249 VAL H C 249 VAL HG21 1.0 . 3.77 2264 1519 C 249 VAL HB C 250 CYS H 1.0 . 4.37 2265 1520 C 249 VAL HG11 C 250 CYS H 1.0 . 4.46 2266 1521 C 249 VAL HG21 C 250 CYS H 1.0 . 4.53 2267 1522 D 321 TYS HBx C 249 VAL HG21 1.0 . 5.10 2268 1523 D 321 TYS HBy C 249 VAL HG21 1.0 . 4.91 2269 1524 C 250 CYS HBx C 251 ILE H 1.0 . 5.33 2270 1525 C 251 ILE H C 250 CYS HBy 1.0 . 4.65 2271 1526 C 251 ILE HD11 C 251 ILE H 1.0 . 3.77 2272 1527 C 251 ILE H C 251 ILE HG1y 1.0 . 4.48 2273 1527 C 251 ILE H C 251 ILE HG1x 1.0 . 4.48 2274 1528 C 251 ILE HG21 C 251 ILE H 1.0 . 4.13 2275 1529 C 251 ILE HA C 251 ILE HD11 1.0 . 4.60 2276 1530 C 251 ILE HA C 255 LEU HD11 1.0 . 5.50 2277 1531 C 251 ILE HD11 C 251 ILE HB 1.0 . 3.86 2278 1532 C 252 ASP H C 251 ILE HB 1.0 . 4.60 2279 1533 C 251 ILE HB C 258 ILE HG1y 1.0 . 5.34 2280 1533 C 258 ILE HG1x C 251 ILE HB 1.0 . 5.34 2281 1534 C 252 ASP H C 251 ILE HG1x 1.0 . 5.17 2282 1535 C 252 ASP H C 251 ILE HG1y 1.0 . 5.17 2283 1536 C 252 ASP H C 251 ILE HD11 1.0 . 5.04 2284 1537 C 251 ILE HD11 C 257 TRP HH2 1.0 . 4.77 2285 1538 C 251 ILE HD11 C 257 TRP HZ2 1.0 . 4.34 2286 1539 C 251 ILE HD11 C 258 ILE HG1y 1.0 . 5.06 2287 1539 C 251 ILE HD11 C 258 ILE HG1x 1.0 . 5.06 2288 1540 C 251 ILE HG1y C 258 ILE HG1y 1.0 . 4.82 2289 1540 C 251 ILE HG1x C 258 ILE HG1y 1.0 . 4.82 2290 1540 C 258 ILE HG1x C 251 ILE HG1y 1.0 . 4.82 2291 1540 C 258 ILE HG1x C 251 ILE HG1x 1.0 . 4.82 2292 1541 C 251 ILE HG21 C 251 ILE HG1x 1.0 . 3.50 2293 1542 C 251 ILE HG21 C 251 ILE HG1y 1.0 . 3.50 2294 1543 C 251 ILE HD11 C 251 ILE HG21 1.0 . 2.40 2295 1544 C 251 ILE HG21 C 251 ILE HG1y 1.0 . 3.00 2296 1544 C 251 ILE HG21 C 251 ILE HG1x 1.0 . 3.00 2297 1545 C 252 ASP H C 251 ILE HG21 1.0 . 3.99 2298 1546 C 251 ILE HG21 C 257 TRP HZ2 1.0 . 5.21 2299 1547 C 251 ILE HG21 C 258 ILE HG1y 1.0 . 3.53 2300 1547 C 251 ILE HG21 C 258 ILE HG1x 1.0 . 3.53 2301 1548 C 252 ASP H C 252 ASP HBx 1.0 . 4.13 2302 1549 C 252 ASP H C 252 ASP HBy 1.0 . 4.13 2303 1550 C 252 ASP H C 252 ASP HBy 1.0 . 3.60 2304 1550 C 252 ASP H C 252 ASP HBx 1.0 . 3.60 2305 1551 C 252 ASP H C 255 LEU H 1.0 . 5.09 2306 1552 C 252 ASP H C 255 LEU HG 1.0 . 4.82 2307 1553 C 252 ASP H C 255 LEU HD11 1.0 . 4.27 2308 1554 C 252 ASP HA C 254 LYS H 1.0 . 5.50 2309 1555 C 252 ASP HBx C 255 LEU H 1.0 . 5.05 2310 1556 C 252 ASP HBx C 255 LEU HG 1.0 . 5.50 2311 1557 C 252 ASP HBx C 255 LEU HD11 1.0 . 5.30 2312 1558 C 252 ASP HBx C 255 LEU HD21 1.0 . 5.50 2313 1559 C 255 LEU H C 252 ASP HBy 1.0 . 5.05 2314 1560 C 255 LEU HG C 252 ASP HBy 1.0 . 5.50 2315 1561 C 255 LEU HD11 C 252 ASP HBy 1.0 . 5.30 2316 1562 C 255 LEU HD21 C 252 ASP HBy 1.0 . 5.50 2317 1563 C 255 LEU HG C 252 ASP HBy 1.0 . 4.65 2318 1563 C 252 ASP HBx C 255 LEU HG 1.0 . 4.65 2319 1564 C 255 LEU HD11 C 252 ASP HBy 1.0 . 4.62 2320 1564 C 252 ASP HBx C 255 LEU HD11 1.0 . 4.62 2321 1565 C 255 LEU HD21 C 252 ASP HBy 1.0 . 4.85 2322 1565 C 252 ASP HBx C 255 LEU HD21 1.0 . 4.85 2323 1566 C 255 LEU H C 253 PRO HA 1.0 . 5.50 2324 1567 C 253 PRO HA C 258 ILE HB 1.0 . 5.50 2325 1568 C 258 ILE HD11 C 253 PRO HA 1.0 . 4.06 2326 1569 C 253 PRO HA C 258 ILE HG1y 1.0 . 5.09 2327 1569 C 258 ILE HG1x C 253 PRO HA 1.0 . 5.09 2328 1570 C 258 ILE HG21 C 253 PRO HA 1.0 . 4.13 2329 1571 C 258 ILE HG21 C 253 PRO HBx 1.0 . 5.50 2330 1572 C 258 ILE HG21 C 253 PRO HBy 1.0 . 5.28 2331 1573 C 254 LYS H C 253 PRO HGx 1.0 . 3.76 2332 1574 C 253 PRO HGy C 254 LYS H 1.0 . 4.96 2333 1575 C 254 LYS H C 253 PRO HDx 1.0 . 4.74 2334 1575 C 253 PRO HDy C 254 LYS H 1.0 . 4.74 2335 1576 C 254 LYS H C 254 LYS HBx 1.0 . 4.11 2336 1577 C 254 LYS H C 254 LYS HBy 1.0 . 4.11 2337 1578 C 254 LYS H C 254 LYS HGx 1.0 . 3.85 2338 1579 C 254 LYS H C 254 LYS HGy 1.0 . 3.85 2339 1580 C 254 LYS H C 254 LYS HBy 1.0 . 3.34 2340 1580 C 254 LYS H C 254 LYS HBx 1.0 . 3.34 2341 1581 C 254 LYS H C 254 LYS HDx 1.0 . 4.59 2342 1581 C 254 LYS HDy C 254 LYS H 1.0 . 4.59 2343 1582 C 254 LYS H C 254 LYS HEx 1.0 . 4.60 2344 1582 C 254 LYS H C 254 LYS HEy 1.0 . 4.60 2345 1583 C 255 LEU H C 254 LYS H 1.0 . 3.64 2346 1584 C 254 LYS H C 258 ILE HB 1.0 . 5.50 2347 1585 C 258 ILE HG21 C 254 LYS H 1.0 . 4.76 2348 1586 C 254 LYS HA C 254 LYS HEx 1.0 . 5.50 2349 1586 C 254 LYS HEy C 254 LYS HA 1.0 . 5.50 2350 1587 C 259 GLN HE2x C 254 LYS HA 1.0 . 4.77 2351 1588 C 259 GLN HE2y C 254 LYS HA 1.0 . 4.26 2352 1589 C 254 LYS HA C 259 GLN HGx 1.0 . 4.81 2353 1589 C 259 GLN HGy C 254 LYS HA 1.0 . 4.81 2354 1590 C 254 LYS HDy C 254 LYS HBx 1.0 . 3.32 2355 1590 C 254 LYS HBx C 254 LYS HDx 1.0 . 3.32 2356 1591 C 254 LYS HBx C 254 LYS HEy 1.0 . 3.56 2357 1591 C 254 LYS HBx C 254 LYS HEx 1.0 . 3.56 2358 1592 C 254 LYS HDy C 254 LYS HBy 1.0 . 3.32 2359 1592 C 254 LYS HBy C 254 LYS HDx 1.0 . 3.32 2360 1593 C 254 LYS HEy C 254 LYS HBy 1.0 . 3.56 2361 1593 C 254 LYS HBy C 254 LYS HEx 1.0 . 3.56 2362 1594 C 254 LYS HEy C 254 LYS HGx 1.0 . 3.90 2363 1594 C 254 LYS HGx C 254 LYS HEx 1.0 . 3.90 2364 1595 C 254 LYS HEx C 254 LYS HGy 1.0 . 3.90 2365 1595 C 254 LYS HEy C 254 LYS HGy 1.0 . 3.90 2366 1596 C 254 LYS HBy C 254 LYS HDx 1.0 . 2.88 2367 1596 C 254 LYS HBx C 254 LYS HDx 1.0 . 2.88 2368 1596 C 254 LYS HDy C 254 LYS HBy 1.0 . 2.88 2369 1596 C 254 LYS HDy C 254 LYS HBx 1.0 . 2.88 2370 1597 C 254 LYS HBx C 254 LYS HEx 1.0 . 2.97 2371 1597 C 254 LYS HBy C 254 LYS HEx 1.0 . 2.97 2372 1597 C 254 LYS HEy C 254 LYS HBy 1.0 . 2.97 2373 1597 C 254 LYS HBx C 254 LYS HEy 1.0 . 2.97 2374 1598 C 254 LYS HDy C 254 LYS HEx 1.0 . 2.80 2375 1598 C 254 LYS HDx C 254 LYS HEx 1.0 . 2.80 2376 1598 C 254 LYS HEy C 254 LYS HDx 1.0 . 2.80 2377 1598 C 254 LYS HDy C 254 LYS HEy 1.0 . 2.80 2378 1599 C 254 LYS HEx C 254 LYS HGy 1.0 . 3.28 2379 1599 C 254 LYS HEy C 254 LYS HGy 1.0 . 3.28 2380 1599 C 254 LYS HGx C 254 LYS HEx 1.0 . 3.28 2381 1599 C 254 LYS HEy C 254 LYS HGx 1.0 . 3.28 2382 1600 C 255 LEU H C 255 LEU HBx 1.0 . 3.90 2383 1601 C 255 LEU H C 255 LEU HBy 1.0 . 3.40 2384 1602 C 255 LEU H C 255 LEU HG 1.0 . 3.82 2385 1603 C 255 LEU HD11 C 255 LEU H 1.0 . 4.86 2386 1604 C 255 LEU H C 258 ILE HB 1.0 . 3.94 2387 1605 C 258 ILE HD11 C 255 LEU H 1.0 . 5.24 2388 1606 C 255 LEU H C 258 ILE HG1y 1.0 . 4.25 2389 1606 C 258 ILE HG1x C 255 LEU H 1.0 . 4.25 2390 1607 C 258 ILE HG21 C 255 LEU H 1.0 . 5.05 2391 1608 C 255 LEU HD11 C 255 LEU HA 1.0 . 5.37 2392 1609 C 255 LEU HD21 C 255 LEU HA 1.0 . 3.97 2393 1610 C 255 LEU HA C 258 ILE H 1.0 . 5.50 2394 1611 C 255 LEU HA C 258 ILE HG1y 1.0 . 5.34 2395 1611 C 258 ILE HG1x C 255 LEU HA 1.0 . 5.34 2396 1612 C 255 LEU HD11 C 255 LEU HBx 1.0 . 4.19 2397 1613 C 255 LEU HBx C 258 ILE H 1.0 . 4.95 2398 1614 C 258 ILE HB C 255 LEU HBx 1.0 . 5.50 2399 1615 C 255 LEU HBx C 258 ILE HG1y 1.0 . 4.62 2400 1615 C 258 ILE HG1x C 255 LEU HBx 1.0 . 4.62 2401 1616 C 255 LEU HBy C 256 LYS H 1.0 . 5.50 2402 1617 C 255 LEU HBy C 258 ILE H 1.0 . 4.60 2403 1618 C 258 ILE HB C 255 LEU HBy 1.0 . 5.50 2404 1619 C 258 ILE HD11 C 255 LEU HBy 1.0 . 5.49 2405 1620 C 255 LEU HBy C 258 ILE HG1y 1.0 . 4.44 2406 1620 C 258 ILE HG1x C 255 LEU HBy 1.0 . 4.44 2407 1621 C 255 LEU HG C 258 ILE HB 1.0 . 5.50 2408 1622 C 255 LEU HG C 258 ILE HG1y 1.0 . 5.34 2409 1622 C 258 ILE HG1x C 255 LEU HG 1.0 . 5.34 2410 1623 C 255 LEU HD11 C 257 TRP HD1 1.0 . 5.32 2411 1624 C 255 LEU HD11 C 257 TRP HE1 1.0 . 3.98 2412 1625 C 255 LEU HD11 C 257 TRP HZ2 1.0 . 4.31 2413 1626 C 255 LEU HD11 C 258 ILE H 1.0 . 5.50 2414 1627 C 255 LEU HD11 C 258 ILE HG1y 1.0 . 4.10 2415 1627 C 255 LEU HD11 C 258 ILE HG1x 1.0 . 4.10 2416 1628 C 255 LEU HD21 C 256 LYS H 1.0 . 5.50 2417 1629 C 255 LEU HD21 C 257 TRP HD1 1.0 . 3.66 2418 1630 C 255 LEU HD21 C 257 TRP HE1 1.0 . 3.98 2419 1631 C 255 LEU HD21 C 257 TRP HZ2 1.0 . 5.17 2420 1632 C 255 LEU HD21 C 258 ILE H 1.0 . 5.50 2421 1633 C 255 LEU HD21 C 258 ILE HG1y 1.0 . 4.39 2422 1633 C 255 LEU HD21 C 258 ILE HG1x 1.0 . 4.39 2423 1634 C 256 LYS HA C 256 LYS HDx 1.0 . 4.51 2424 1635 C 256 LYS HA C 256 LYS HDy 1.0 . 4.51 2425 1636 C 256 LYS HA C 256 LYS HEx 1.0 . 5.50 2426 1636 C 256 LYS HA C 256 LYS HEy 1.0 . 5.50 2427 1637 C 256 LYS HA C 259 GLN H 1.0 . 4.50 2428 1638 C 256 LYS HA C 259 GLN HGx 1.0 . 4.78 2429 1638 C 259 GLN HGy C 256 LYS HA 1.0 . 4.78 2430 1639 C 256 LYS HA C 260 GLU H 1.0 . 5.13 2431 1640 C 260 GLU HGy C 256 LYS HGx 1.0 . 5.06 2432 1641 C 260 GLU HGy C 256 LYS HGy 1.0 . 5.06 2433 1642 C 256 LYS HDx C 256 LYS HBx 1.0 . 3.66 2434 1642 C 256 LYS HBy C 256 LYS HDx 1.0 . 3.66 2435 1643 C 256 LYS HBx C 256 LYS HDy 1.0 . 3.66 2436 1643 C 256 LYS HBy C 256 LYS HDy 1.0 . 3.66 2437 1644 C 256 LYS HBy C 256 LYS HEx 1.0 . 4.72 2438 1644 C 256 LYS HBx C 256 LYS HEx 1.0 . 4.72 2439 1644 C 256 LYS HEy C 256 LYS HBx 1.0 . 4.72 2440 1644 C 256 LYS HEy C 256 LYS HBy 1.0 . 4.72 2441 1645 C 257 TRP H C 256 LYS HBx 1.0 . 5.00 2442 1645 C 256 LYS HBy C 257 TRP H 1.0 . 5.00 2443 1646 C 257 TRP H C 256 LYS HDy 1.0 . 5.34 2444 1646 C 257 TRP H C 256 LYS HDx 1.0 . 5.34 2445 1647 C 260 GLU HGx C 256 LYS HDy 1.0 . 4.92 2446 1647 C 256 LYS HDx C 260 GLU HGx 1.0 . 4.92 2447 1648 C 257 TRP H C 256 LYS HGy 1.0 . 5.34 2448 1648 C 257 TRP H C 256 LYS HGx 1.0 . 5.34 2449 1649 C 260 GLU HGx C 256 LYS HGy 1.0 . 4.67 2450 1649 C 260 GLU HGx C 256 LYS HGx 1.0 . 4.67 2451 1650 C 257 TRP HE1 C 257 TRP H 1.0 . 4.63 2452 1651 C 258 ILE H C 257 TRP H 1.0 . 4.84 2453 1652 C 260 GLU H C 257 TRP HA 1.0 . 4.62 2454 1653 C 257 TRP HA C 260 GLU HBx 1.0 . 5.06 2455 1654 C 257 TRP HA C 260 GLU HBy 1.0 . 5.50 2456 1655 C 260 GLU HGx C 257 TRP HA 1.0 . 5.50 2457 1656 C 260 GLU HGy C 257 TRP HA 1.0 . 5.50 2458 1657 C 257 TRP HA C 261 TYR H 1.0 . 5.50 2459 1658 C 257 TRP HBy C 257 TRP HD1 1.0 . 3.86 2460 1659 C 258 ILE HD11 C 257 TRP HE3 1.0 . 5.46 2461 1660 C 257 TRP HZ2 C 258 ILE HG1y 1.0 . 4.77 2462 1660 C 257 TRP HZ2 C 258 ILE HG1x 1.0 . 4.77 2463 1661 C 258 ILE HB C 258 ILE H 1.0 . 3.96 2464 1662 C 258 ILE HG1x C 258 ILE H 1.0 . 4.39 2465 1663 C 258 ILE H C 258 ILE HG1y 1.0 . 4.39 2466 1664 C 258 ILE HD11 C 258 ILE H 1.0 . 4.72 2467 1665 C 258 ILE H C 258 ILE HG1y 1.0 . 3.70 2468 1665 C 258 ILE HG1x C 258 ILE H 1.0 . 3.70 2469 1666 C 258 ILE HG21 C 258 ILE H 1.0 . 4.17 2470 1667 C 258 ILE H C 259 GLN H 1.0 . 3.94 2471 1668 C 258 ILE H C 260 GLU H 1.0 . 5.26 2472 1669 C 258 ILE HD11 C 258 ILE HA 1.0 . 4.01 2473 1670 C 258 ILE HG21 C 258 ILE HA 1.0 . 4.06 2474 1671 C 261 TYR HD% C 258 ILE HA 1.0 . 5.50 2475 1672 C 258 ILE HD11 C 258 ILE HB 1.0 . 3.78 2476 1673 C 258 ILE HB C 259 GLN H 1.0 . 4.13 2477 1674 C 262 LEU HD11 C 258 ILE HB 1.0 . 4.63 2478 1675 C 262 LEU H C 258 ILE HD11 1.0 . 5.47 2479 1676 C 259 GLN H C 258 ILE HG1y 1.0 . 4.57 2480 1676 C 258 ILE HG1x C 259 GLN H 1.0 . 4.57 2481 1677 C 258 ILE HG21 C 259 GLN H 1.0 . 4.33 2482 1678 C 258 ILE HG21 C 259 GLN HGx 1.0 . 5.50 2483 1678 C 259 GLN HGy C 258 ILE HG21 1.0 . 5.50 2484 1679 C 258 ILE HG21 C 261 TYR H 1.0 . 5.03 2485 1680 C 262 LEU H C 258 ILE HG21 1.0 . 5.40 2486 1681 C 259 GLN HE2x C 259 GLN H 1.0 . 5.50 2487 1682 C 259 GLN HE2y C 259 GLN H 1.0 . 4.56 2488 1683 C 259 GLN H C 259 GLN HBx 1.0 . 3.50 2489 1683 C 259 GLN HBy C 259 GLN H 1.0 . 3.50 2490 1684 C 259 GLN H C 259 GLN HGx 1.0 . 3.67 2491 1684 C 259 GLN HGy C 259 GLN H 1.0 . 3.67 2492 1685 C 259 GLN H C 260 GLU H 1.0 . 4.03 2493 1686 C 259 GLN HE2y C 259 GLN HA 1.0 . 5.46 2494 1687 C 259 GLN HA C 262 LEU H 1.0 . 4.68 2495 1688 C 262 LEU HD11 C 259 GLN HA 1.0 . 4.47 2496 1689 C 263 GLU H C 259 GLN HA 1.0 . 4.68 2497 1690 C 260 GLU H C 259 GLN HBx 1.0 . 5.28 2498 1691 C 259 GLN HBy C 260 GLU H 1.0 . 5.28 2499 1692 C 262 LEU HD11 C 259 GLN HE2x 1.0 . 4.75 2500 1693 C 262 LEU HD11 C 259 GLN HE2y 1.0 . 4.18 2501 1694 C 259 GLN HE2x C 259 GLN HBx 1.0 . 4.93 2502 1694 C 259 GLN HE2x C 259 GLN HBy 1.0 . 4.93 2503 1695 C 259 GLN HE2y C 259 GLN HBx 1.0 . 4.16 2504 1695 C 259 GLN HE2y C 259 GLN HBy 1.0 . 4.16 2505 1696 C 259 GLN HE2y C 259 GLN HGx 1.0 . 3.87 2506 1696 C 259 GLN HE2y C 259 GLN HGy 1.0 . 3.87 2507 1697 C 260 GLU H C 259 GLN HGx 1.0 . 5.14 2508 1697 C 259 GLN HGy C 260 GLU H 1.0 . 5.14 2509 1698 C 260 GLU H C 260 GLU HBx 1.0 . 3.84 2510 1699 C 260 GLU H C 260 GLU HBy 1.0 . 3.48 2511 1700 C 260 GLU H C 260 GLU HGx 1.0 . 3.91 2512 1701 C 260 GLU H C 260 GLU HGy 1.0 . 4.37 2513 1702 C 260 GLU H C 261 TYR H 1.0 . 4.07 2514 1703 C 263 GLU H C 260 GLU HA 1.0 . 4.94 2515 1704 C 260 GLU HA C 263 GLU HBx 1.0 . 4.46 2516 1705 C 260 GLU HA C 263 GLU HBy 1.0 . 4.40 2517 1706 C 260 GLU HBx C 261 TYR H 1.0 . 4.44 2518 1707 C 260 GLU HGy C 260 GLU HBy 1.0 . 2.61 2519 1708 C 260 GLU HBy C 261 TYR H 1.0 . 4.26 2520 1709 C 260 GLU HGx C 261 TYR H 1.0 . 5.13 2521 1710 C 260 GLU HGy C 261 TYR H 1.0 . 4.90 2522 1711 C 261 TYR HBx C 261 TYR H 1.0 . 3.87 2523 1712 C 261 TYR HBy C 261 TYR H 1.0 . 3.97 2524 1713 C 261 TYR HD% C 261 TYR H 1.0 . 4.71 2525 1714 C 262 LEU H C 261 TYR H 1.0 . 4.08 2526 1715 C 261 TYR H C 264 LYS HGx 1.0 . 5.50 2527 1716 C 261 TYR HD% C 261 TYR HA 1.0 . 3.94 2528 1717 C 262 LEU H C 261 TYR HBx 1.0 . 4.39 2529 1718 C 262 LEU H C 261 TYR HBy 1.0 . 4.69 2530 1719 C 261 TYR HD% C 262 LEU HG 1.0 . 4.43 2531 1720 C 261 TYR HE% C 265 CYS HBx 1.0 . 4.65 2532 1721 C 262 LEU H C 262 LEU HG 1.0 . 3.72 2533 1722 C 262 LEU HD11 C 262 LEU H 1.0 . 3.96 2534 1723 C 262 LEU HD21 C 262 LEU H 1.0 . 3.98 2535 1724 C 263 GLU H C 262 LEU H 1.0 . 4.07 2536 1725 C 262 LEU HA C 262 LEU HD11 1.0 . 4.08 2537 1726 C 262 LEU HA C 262 LEU HD21 1.0 . 3.68 2538 1727 C 262 LEU HA C 265 CYS H 1.0 . 4.20 2539 1728 C 262 LEU HA C 266 LEU H 1.0 . 5.50 2540 1729 C 262 LEU HD21 C 262 LEU HBx 1.0 . 3.62 2541 1730 C 263 GLU H C 262 LEU HBx 1.0 . 5.32 2542 1731 C 262 LEU HD11 C 262 LEU HBy 1.0 . 4.18 2543 1732 C 262 LEU HD21 C 262 LEU HBy 1.0 . 4.12 2544 1733 C 263 GLU H C 262 LEU HBy 1.0 . 4.82 2545 1734 C 263 GLU H C 262 LEU HG 1.0 . 4.03 2546 1735 C 262 LEU HD11 C 263 GLU H 1.0 . 4.33 2547 1736 C 263 GLU H C 263 GLU HBx 1.0 . 3.59 2548 1737 C 263 GLU H C 263 GLU HBy 1.0 . 3.96 2549 1738 C 263 GLU HGx C 263 GLU H 1.0 . 4.13 2550 1739 C 263 GLU HGy C 263 GLU H 1.0 . 4.22 2551 1740 C 263 GLU H C 264 LYS H 1.0 . 4.03 2552 1741 C 263 GLU HGy C 263 GLU HA 1.0 . 4.20 2553 1742 C 266 LEU H C 263 GLU HA 1.0 . 4.47 2554 1743 C 263 GLU HBx C 264 LYS H 1.0 . 4.14 2555 1744 C 263 GLU HBy C 264 LYS H 1.0 . 4.11 2556 1745 C 263 GLU HGx C 264 LYS H 1.0 . 5.20 2557 1746 C 263 GLU HGy C 264 LYS H 1.0 . 5.18 2558 1747 C 264 LYS H C 264 LYS HBx 1.0 . 3.65 2559 1748 C 264 LYS H C 264 LYS HBy 1.0 . 3.63 2560 1749 C 264 LYS HGx C 264 LYS H 1.0 . 3.81 2561 1750 C 264 LYS H C 264 LYS HGy 1.0 . 3.96 2562 1751 C 264 LYS H C 264 LYS HDx 1.0 . 4.75 2563 1751 C 264 LYS H C 264 LYS HDy 1.0 . 4.75 2564 1752 C 264 LYS H C 264 LYS HEx 1.0 . 5.10 2565 1752 C 264 LYS H C 264 LYS HEy 1.0 . 5.10 2566 1753 C 265 CYS H C 264 LYS H 1.0 . 3.29 2567 1754 C 264 LYS HA C 264 LYS HDx 1.0 . 3.91 2568 1754 C 264 LYS HDy C 264 LYS HA 1.0 . 3.91 2569 1755 C 264 LYS HA C 264 LYS HEx 1.0 . 5.50 2570 1755 C 264 LYS HEy C 264 LYS HA 1.0 . 5.50 2571 1756 C 264 LYS HA C 267 ASN H 1.0 . 5.50 2572 1757 C 264 LYS HBx C 264 LYS HDx 1.0 . 3.71 2573 1757 C 264 LYS HBx C 264 LYS HDy 1.0 . 3.71 2574 1758 C 264 LYS HBx C 264 LYS HEx 1.0 . 5.35 2575 1758 C 264 LYS HBx C 264 LYS HEy 1.0 . 5.35 2576 1759 C 265 CYS H C 264 LYS HBx 1.0 . 4.06 2577 1760 C 264 LYS HBy C 264 LYS HDx 1.0 . 3.74 2578 1760 C 264 LYS HBy C 264 LYS HDy 1.0 . 3.74 2579 1761 C 264 LYS HBy C 264 LYS HEx 1.0 . 3.96 2580 1761 C 264 LYS HBy C 264 LYS HEy 1.0 . 3.96 2581 1762 C 265 CYS H C 264 LYS HBy 1.0 . 4.07 2582 1763 C 264 LYS HGx C 264 LYS HDx 1.0 . 2.40 2583 1763 C 264 LYS HGx C 264 LYS HDy 1.0 . 2.40 2584 1764 C 264 LYS HGx C 264 LYS HEx 1.0 . 3.18 2585 1764 C 264 LYS HGx C 264 LYS HEy 1.0 . 3.18 2586 1765 C 264 LYS HGx C 265 CYS H 1.0 . 4.32 2587 1766 C 264 LYS HGy C 264 LYS HDx 1.0 . 2.57 2588 1766 C 264 LYS HGy C 264 LYS HDy 1.0 . 2.57 2589 1767 C 264 LYS HGy C 264 LYS HEx 1.0 . 3.41 2590 1767 C 264 LYS HGy C 264 LYS HEy 1.0 . 3.41 2591 1768 C 265 CYS H C 264 LYS HGy 1.0 . 4.39 2592 1769 C 264 LYS HDx C 264 LYS HEx 1.0 . 2.95 2593 1769 C 264 LYS HDy C 264 LYS HEx 1.0 . 2.95 2594 1769 C 264 LYS HEy C 264 LYS HDx 1.0 . 2.95 2595 1769 C 264 LYS HDy C 264 LYS HEy 1.0 . 2.95 2596 1770 C 265 CYS HBx C 265 CYS H 1.0 . 3.85 2597 1771 C 265 CYS H C 265 CYS HBy 1.0 . 3.82 2598 1772 C 266 LEU H C 265 CYS H 1.0 . 3.69 2599 1773 C 265 CYS H C 268 LYS HDx 1.0 . 5.20 2600 1773 C 265 CYS H C 268 LYS HDy 1.0 . 5.20 2601 1774 C 265 CYS H C 268 LYS HGx 1.0 . 4.61 2602 1774 C 265 CYS H C 268 LYS HGy 1.0 . 4.61 2603 1775 C 266 LEU H C 265 CYS HBx 1.0 . 4.46 2604 1776 C 266 LEU H C 265 CYS HBy 1.0 . 4.67 2605 1777 C 266 LEU H C 266 LEU HBx 1.0 . 3.84 2606 1778 C 266 LEU H C 266 LEU HBy 1.0 . 3.84 2607 1779 C 266 LEU HG C 266 LEU H 1.0 . 4.60 2608 1780 C 266 LEU H C 266 LEU HBx 1.0 . 3.25 2609 1780 C 266 LEU H C 266 LEU HBy 1.0 . 3.25 2610 1781 C 266 LEU HD11 C 266 LEU H 1.0 . 4.16 2611 1782 C 266 LEU H C 266 LEU HD21 1.0 . 4.16 2612 1783 C 266 LEU H C 266 LEU HD21 1.0 . 3.52 2613 1783 C 266 LEU HD11 C 266 LEU H 1.0 . 3.52 2614 1784 C 266 LEU H C 267 ASN H 1.0 . 4.18 2615 1785 C 266 LEU HD11 C 266 LEU HA 1.0 . 4.62 2616 1786 C 266 LEU HA C 266 LEU HD21 1.0 . 4.62 2617 1787 C 266 LEU HA C 266 LEU HD21 1.0 . 3.75 2618 1787 C 266 LEU HD11 C 266 LEU HA 1.0 . 3.75 2619 1788 C 267 ASN H C 266 LEU HBx 1.0 . 4.27 2620 1789 C 267 ASN H C 266 LEU HBy 1.0 . 4.27 2621 1790 C 266 LEU HBx C 266 LEU HD21 1.0 . 2.81 2622 1790 C 266 LEU HD11 C 266 LEU HBx 1.0 . 2.81 2623 1790 C 266 LEU HD11 C 266 LEU HBy 1.0 . 2.81 2624 1790 C 266 LEU HBy C 266 LEU HD21 1.0 . 2.81 2625 1791 C 267 ASN H C 266 LEU HD21 1.0 . 4.03 2626 1791 C 266 LEU HD11 C 267 ASN H 1.0 . 4.03 2627 1792 C 267 ASN H C 267 ASN HBx 1.0 . 4.12 2628 1793 C 267 ASN H C 267 ASN HBy 1.0 . 4.12 2629 1794 C 267 ASN H C 268 LYS H 1.0 . 4.39 2630 1795 C 267 ASN HA C 267 ASN HD2x 1.0 . 4.06 2631 1796 C 267 ASN HA C 267 ASN HD2y 1.0 . 4.06 2632 1797 C 267 ASN HA C 267 ASN HD2y 1.0 . 3.54 2633 1797 C 267 ASN HA C 267 ASN HD2x 1.0 . 3.54 2634 1798 C 268 LYS H C 267 ASN HA 1.0 . 3.32 2635 1799 C 268 LYS H C 267 ASN HBx 1.0 . 4.49 2636 1800 C 268 LYS H C 267 ASN HBy 1.0 . 4.49 2637 1801 C 268 LYS H C 267 ASN HBy 1.0 . 3.79 2638 1801 C 268 LYS H C 267 ASN HBx 1.0 . 3.79 2639 1802 C 267 ASN HBx C 268 LYS HBy 1.0 . 4.91 2640 1802 C 267 ASN HBy C 268 LYS HBy 1.0 . 4.91 2641 1802 C 268 LYS HBx C 267 ASN HBy 1.0 . 4.91 2642 1802 C 267 ASN HBx C 268 LYS HBx 1.0 . 4.91 2643 1803 C 268 LYS H C 268 LYS HBx 1.0 . 3.99 2644 1804 C 268 LYS H C 268 LYS HBy 1.0 . 3.99 2645 1805 C 268 LYS H C 268 LYS HBy 1.0 . 3.24 2646 1805 C 268 LYS H C 268 LYS HBx 1.0 . 3.24 2647 1806 C 268 LYS H C 268 LYS HDx 1.0 . 5.23 2648 1806 C 268 LYS HDy C 268 LYS H 1.0 . 5.23 2649 1807 C 268 LYS H C 268 LYS HGx 1.0 . 3.69 2650 1807 C 268 LYS HGy C 268 LYS H 1.0 . 3.69 2651 1808 C 268 LYS HA C 268 LYS HDx 1.0 . 4.01 2652 1808 C 268 LYS HDy C 268 LYS HA 1.0 . 4.01 2653 1809 C 268 LYS HA C 268 LYS HEx 1.0 . 5.50 2654 1809 C 268 LYS HA C 268 LYS HEy 1.0 . 5.50 2655 1810 C 268 LYS HA C 268 LYS HGx 1.0 . 3.95 2656 1810 C 268 LYS HGy C 268 LYS HA 1.0 . 3.95 2657 1811 C 268 LYS HBx C 268 LYS HEy 1.0 . 5.07 2658 1811 C 268 LYS HBx C 268 LYS HEx 1.0 . 5.07 2659 1812 C 268 LYS HEy C 268 LYS HBy 1.0 . 5.07 2660 1812 C 268 LYS HBy C 268 LYS HEx 1.0 . 5.07 2661 1813 C 268 LYS HBy C 268 LYS HEx 1.0 . 4.42 2662 1813 C 268 LYS HBx C 268 LYS HEx 1.0 . 4.42 2663 1813 C 268 LYS HEy C 268 LYS HBy 1.0 . 4.42 2664 1813 C 268 LYS HBx C 268 LYS HEy 1.0 . 4.42 2665 1814 C 268 LYS HDy C 268 LYS HGx 1.0 . 2.84 2666 1814 C 268 LYS HDx C 268 LYS HGx 1.0 . 2.84 2667 1814 C 268 LYS HGy C 268 LYS HDx 1.0 . 2.84 2668 1814 C 268 LYS HDy C 268 LYS HGy 1.0 . 2.84 2669 1815 C 268 LYS HEy C 268 LYS HGx 1.0 . 3.74 2670 1815 C 268 LYS HEx C 268 LYS HGx 1.0 . 3.74 2671 1815 C 268 LYS HGy C 268 LYS HEx 1.0 . 3.74 2672 1815 C 268 LYS HGy C 268 LYS HEy 1.0 . 3.74 2673 1816 D 302 GLU H D 302 GLU HBx 1.0 . 4.08 2674 1817 D 302 GLU H D 302 GLU HBy 1.0 . 4.08 2675 1818 D 302 GLU H D 302 GLU HBx 1.0 . 3.55 2676 1818 D 302 GLU H D 302 GLU HBy 1.0 . 3.55 2677 1819 D 302 GLU H D 302 GLU HGx 1.0 . 4.29 2678 1819 D 302 GLU H D 302 GLU HGy 1.0 . 4.29 2679 1820 D 302 GLU HA D 302 GLU HGx 1.0 . 3.13 2680 1820 D 302 GLU HGy D 302 GLU HA 1.0 . 3.13 2681 1821 D 302 GLU HGy D 302 GLU HBx 1.0 . 2.42 2682 1821 D 302 GLU HBx D 302 GLU HGx 1.0 . 2.42 2683 1822 D 302 GLU HBy D 302 GLU HGy 1.0 . 2.42 2684 1822 D 302 GLU HBy D 302 GLU HGx 1.0 . 2.42 2685 1823 D 303 GLY H D 304 ILE H 1.0 . 4.46 2686 1824 D 304 ILE H D 303 GLY HAx 1.0 . 3.04 2687 1824 D 304 ILE H D 303 GLY HAy 1.0 . 3.04 2688 1825 D 304 ILE H D 304 ILE HB 1.0 . 3.36 2689 1826 D 304 ILE H D 304 ILE HG1x 1.0 . 3.87 2690 1827 D 304 ILE H D 304 ILE HG1y 1.0 . 3.87 2691 1828 D 304 ILE H D 304 ILE HD11 1.0 . 3.86 2692 1829 D 304 ILE H D 304 ILE HG1y 1.0 . 3.31 2693 1829 D 304 ILE H D 304 ILE HG1x 1.0 . 3.31 2694 1830 D 304 ILE H D 304 ILE HG21 1.0 . 3.79 2695 1831 D 304 ILE HD11 D 304 ILE HA 1.0 . 4.44 2696 1832 D 304 ILE HG21 D 304 ILE HA 1.0 . 3.77 2697 1833 D 304 ILE HB D 304 ILE HD11 1.0 . 3.88 2698 1834 D 304 ILE HG1x D 304 ILE HG21 1.0 . 3.40 2699 1835 D 304 ILE HG21 D 304 ILE HG1y 1.0 . 3.40 2700 1836 D 304 ILE HD11 D 304 ILE HG21 1.0 . 2.40 2701 1837 D 304 ILE HG21 D 304 ILE HG1y 1.0 . 2.97 2702 1837 D 304 ILE HG1x D 304 ILE HG21 1.0 . 2.97 2703 1838 D 305 SER HBx D 306 ILE H 1.0 . 4.62 2704 1839 D 306 ILE H D 305 SER HBy 1.0 . 4.62 2705 1840 D 306 ILE H D 306 ILE HB 1.0 . 4.04 2706 1841 D 306 ILE H D 306 ILE HG1x 1.0 . 4.62 2707 1842 D 306 ILE H D 306 ILE HG1y 1.0 . 4.62 2708 1843 D 306 ILE H D 306 ILE HD11 1.0 . 4.21 2709 1844 D 306 ILE H D 306 ILE HG1y 1.0 . 3.97 2710 1844 D 306 ILE H D 306 ILE HG1x 1.0 . 3.97 2711 1845 D 306 ILE H D 306 ILE HG21 1.0 . 4.21 2712 1846 D 306 ILE HD11 D 306 ILE HA 1.0 . 3.64 2713 1847 D 306 ILE HG21 D 306 ILE HA 1.0 . 3.62 2714 1848 D 306 ILE HA D 307 TYS H 1.0 . 3.24 2715 1849 D 306 ILE HB D 306 ILE HD11 1.0 . 3.30 2716 1850 D 306 ILE HB D 307 TYS H 1.0 . 4.09 2717 1851 D 306 ILE HG1x D 307 TYS H 1.0 . 5.28 2718 1852 D 307 TYS H D 306 ILE HG1y 1.0 . 5.28 2719 1853 D 306 ILE HD11 D 307 TYS H 1.0 . 3.80 2720 1854 D 307 TYS H D 306 ILE HG1y 1.0 . 4.42 2721 1854 D 306 ILE HG1x D 307 TYS H 1.0 . 4.42 2722 1855 D 306 ILE HD11 D 306 ILE HG21 1.0 . 2.40 2723 1856 D 306 ILE HG21 D 306 ILE HG1y 1.0 . 3.00 2724 1856 D 306 ILE HG1x D 306 ILE HG21 1.0 . 3.00 2725 1857 D 306 ILE HG21 D 307 TYS H 1.0 . 3.80 2726 1858 D 307 TYS HBx D 307 TYS H 1.0 . 3.64 2727 1859 D 307 TYS HBy D 307 TYS H 1.0 . 3.71 2728 1860 D 308 THR H D 308 THR HG21 1.0 . 4.66 2729 1861 D 308 THR HG21 D 308 THR HA 1.0 . 3.69 2730 1862 D 308 THR HB D 309 SER H 1.0 . 5.04 2731 1863 D 310 ASP HBx D 311 ASN H 1.0 . 5.05 2732 1864 D 311 ASN H D 310 ASP HBy 1.0 . 5.05 2733 1865 D 312 TYS H D 311 ASN HBx 1.0 . 4.53 2734 1865 D 311 ASN HBy D 312 TYS H 1.0 . 4.53 2735 1866 D 312 TYS HBx D 312 TYS H 1.0 . 3.97 2736 1867 D 312 TYS HBy D 312 TYS H 1.0 . 3.97 2737 1868 D 312 TYS HBx D 313 THR H 1.0 . 4.25 2738 1869 D 312 TYS HBy D 313 THR H 1.0 . 4.25 2739 1870 D 313 THR H D 313 THR HB 1.0 . 3.85 2740 1871 D 313 THR H D 313 THR HG21 1.0 . 3.95 2741 1872 D 313 THR HB D 313 THR HA 1.0 . 2.40 2742 1873 D 313 THR HG21 D 313 THR HA 1.0 . 3.08 2743 1874 D 313 THR HA D 314 GLU H 1.0 . 3.26 2744 1875 D 313 THR HB D 314 GLU H 1.0 . 5.50 2745 1876 D 313 THR HG21 D 314 GLU H 1.0 . 4.54 2746 1877 D 314 GLU H D 314 GLU HBx 1.0 . 4.09 2747 1878 D 314 GLU H D 314 GLU HBy 1.0 . 3.76 2748 1879 D 314 GLU H D 314 GLU HGx 1.0 . 4.04 2749 1879 D 314 GLU H D 314 GLU HGy 1.0 . 4.04 2750 1880 D 314 GLU HA D 314 GLU HGx 1.0 . 3.30 2751 1880 D 314 GLU HGy D 314 GLU HA 1.0 . 3.30 2752 1881 D 314 GLU HA D 315 GLU H 1.0 . 3.29 2753 1882 D 314 GLU HBx D 314 GLU HGx 1.0 . 2.40 2754 1882 D 314 GLU HBx D 314 GLU HGy 1.0 . 2.40 2755 1883 D 314 GLU HBy D 314 GLU HGx 1.0 . 2.40 2756 1883 D 314 GLU HBy D 314 GLU HGy 1.0 . 2.40 2757 1884 D 315 GLU H D 315 GLU HBx 1.0 . 3.75 2758 1885 D 315 GLU H D 315 GLU HBy 1.0 . 3.75 2759 1886 D 315 GLU H D 315 GLU HBx 1.0 . 3.26 2760 1886 D 315 GLU H D 315 GLU HBy 1.0 . 3.26 2761 1887 D 315 GLU H D 315 GLU HGx 1.0 . 3.82 2762 1887 D 315 GLU H D 315 GLU HGy 1.0 . 3.82 2763 1888 D 315 GLU HA D 315 GLU HGx 1.0 . 3.19 2764 1888 D 315 GLU HGy D 315 GLU HA 1.0 . 3.19 2765 1889 D 315 GLU HA D 316 MET H 1.0 . 3.34 2766 1890 D 315 GLU HGy D 315 GLU HBx 1.0 . 2.40 2767 1890 D 315 GLU HBx D 315 GLU HGx 1.0 . 2.40 2768 1891 D 315 GLU HBy D 315 GLU HGy 1.0 . 2.40 2769 1891 D 315 GLU HBy D 315 GLU HGx 1.0 . 2.40 2770 1892 D 316 MET H D 316 MET HBx 1.0 . 3.41 2771 1892 D 316 MET H D 316 MET HBy 1.0 . 3.41 2772 1893 D 316 MET H D 316 MET HGx 1.0 . 4.25 2773 1893 D 316 MET H D 316 MET HGy 1.0 . 4.25 2774 1894 D 316 MET HA D 316 MET HGx 1.0 . 3.66 2775 1894 D 316 MET HGy D 316 MET HA 1.0 . 3.66 2776 1895 D 321 TYS H D 320 ASP HBx 1.0 . 5.14 2777 1896 D 320 ASP HBx D 323 SER HBx 1.0 . 5.50 2778 1897 D 320 ASP HBx D 323 SER HBy 1.0 . 5.50 2779 1898 D 321 TYS H D 320 ASP HBy 1.0 . 5.14 2780 1899 D 323 SER HBx D 320 ASP HBy 1.0 . 5.50 2781 1900 D 320 ASP HBy D 323 SER HBy 1.0 . 5.50 2782 1901 D 321 TYS H D 320 ASP HBy 1.0 . 4.27 2783 1901 D 321 TYS H D 320 ASP HBx 1.0 . 4.27 2784 1902 D 320 ASP HBx D 323 SER HBy 1.0 . 4.28 2785 1902 D 320 ASP HBy D 323 SER HBy 1.0 . 4.28 2786 1902 D 323 SER HBx D 320 ASP HBy 1.0 . 4.28 2787 1902 D 320 ASP HBx D 323 SER HBx 1.0 . 4.28 2788 1903 D 321 TYS H D 322 ASP H 1.0 . 4.81 2789 1904 D 321 TYS HBx D 322 ASP H 1.0 . 4.52 2790 1905 D 321 TYS HBy D 322 ASP H 1.0 . 4.72 2791 1906 D 322 ASP H D 322 ASP HBx 1.0 . 4.03 2792 1907 D 322 ASP H D 322 ASP HBy 1.0 . 4.03 2793 1908 D 323 SER HBx D 322 ASP HBx 1.0 . 5.50 2794 1909 D 322 ASP HBx D 323 SER HBy 1.0 . 5.50 2795 1910 D 323 SER HBx D 322 ASP HBy 1.0 . 5.50 2796 1911 D 322 ASP HBy D 323 SER HBy 1.0 . 5.50 2797 1912 D 322 ASP HBx D 323 SER HBy 1.0 . 4.29 2798 1912 D 323 SER HBx D 322 ASP HBy 1.0 . 4.29 2799 1912 D 323 SER HBx D 322 ASP HBx 1.0 . 4.29 2800 1912 D 322 ASP HBy D 323 SER HBy 1.0 . 4.29 2801 1913 D 324 MET HA D 324 MET HGx 1.0 . 4.24 2802 1914 D 324 MET HA D 324 MET HGy 1.0 . 4.24 2803 1915 D 324 MET HA D 324 MET HGy 1.0 . 3.67 2804 1915 D 324 MET HA D 324 MET HGx 1.0 . 3.67 2805 1916 D 324 MET HA D 325 LYS H 1.0 . 3.43 2806 1917 D 324 MET HGx D 324 MET HBx 1.0 . 2.98 2807 1918 D 324 MET HBx D 324 MET HGy 1.0 . 2.98 2808 1919 D 324 MET HGx D 324 MET HBy 1.0 . 2.98 2809 1920 D 324 MET HBy D 324 MET HGy 1.0 . 2.98 2810 1921 D 324 MET HBx D 324 MET HGy 1.0 . 2.31 2811 1921 D 324 MET HGx D 324 MET HBy 1.0 . 2.31 2812 1921 D 324 MET HGx D 324 MET HBx 1.0 . 2.31 2813 1921 D 324 MET HBy D 324 MET HGy 1.0 . 2.31 2814 1922 D 325 LYS H D 325 LYS HBx 1.0 . 3.72 2815 1923 D 325 LYS H D 325 LYS HBy 1.0 . 3.72 2816 1924 D 325 LYS H D 325 LYS HDx 1.0 . 4.46 2817 1924 D 325 LYS H D 325 LYS HDy 1.0 . 4.46 2818 1925 D 325 LYS H D 325 LYS HGx 1.0 . 4.02 2819 1925 D 325 LYS H D 325 LYS HGy 1.0 . 4.02 2820 1926 D 325 LYS HA D 325 LYS HDx 1.0 . 4.26 2821 1926 D 325 LYS HDy D 325 LYS HA 1.0 . 4.26 2822 1927 D 325 LYS HA D 325 LYS HEx 1.0 . 4.66 2823 1927 D 325 LYS HA D 325 LYS HEy 1.0 . 4.66 2824 1928 D 325 LYS HA D 325 LYS HGx 1.0 . 3.86 2825 1928 D 325 LYS HGy D 325 LYS HA 1.0 . 3.86 2826 1929 D 325 LYS HA D 326 GLU H 1.0 . 3.13 2827 1930 D 325 LYS HEy D 325 LYS HBx 1.0 . 4.05 2828 1930 D 325 LYS HBx D 325 LYS HEx 1.0 . 4.05 2829 1931 D 326 GLU H D 325 LYS HBx 1.0 . 4.16 2830 1932 D 325 LYS HEy D 325 LYS HBy 1.0 . 4.05 2831 1932 D 325 LYS HBy D 325 LYS HEx 1.0 . 4.05 2832 1933 D 326 GLU H D 325 LYS HBy 1.0 . 4.16 2833 1934 D 325 LYS HBy D 325 LYS HDx 1.0 . 2.37 2834 1934 D 325 LYS HBx D 325 LYS HDx 1.0 . 2.37 2835 1934 D 325 LYS HDy D 325 LYS HBy 1.0 . 2.37 2836 1934 D 325 LYS HDy D 325 LYS HBx 1.0 . 2.37 2837 1935 D 325 LYS HBx D 325 LYS HEx 1.0 . 3.38 2838 1935 D 325 LYS HBy D 325 LYS HEx 1.0 . 3.38 2839 1935 D 325 LYS HEy D 325 LYS HBy 1.0 . 3.38 2840 1935 D 325 LYS HEy D 325 LYS HBx 1.0 . 3.38 2841 1936 D 326 GLU H D 325 LYS HBy 1.0 . 3.53 2842 1936 D 326 GLU H D 325 LYS HBx 1.0 . 3.53 2843 1937 D 325 LYS HDy D 325 LYS HGx 1.0 . 2.57 2844 1937 D 325 LYS HDx D 325 LYS HGx 1.0 . 2.57 2845 1937 D 325 LYS HGy D 325 LYS HDx 1.0 . 2.57 2846 1937 D 325 LYS HDy D 325 LYS HGy 1.0 . 2.57 2847 1938 D 325 LYS HEx D 325 LYS HGx 1.0 . 3.29 2848 1938 D 325 LYS HEy D 325 LYS HGx 1.0 . 3.29 2849 1938 D 325 LYS HGy D 325 LYS HEx 1.0 . 3.29 2850 1938 D 325 LYS HGy D 325 LYS HEy 1.0 . 3.29 2851 1939 D 326 GLU H D 325 LYS HGx 1.0 . 4.44 2852 1939 D 325 LYS HGy D 326 GLU H 1.0 . 4.44 2853 1940 D 326 GLU H D 327 PRO HDx 1.0 . 4.42 2854 1940 D 327 PRO HDy D 326 GLU H 1.0 . 4.42 2855 1941 D 327 PRO HA D 328 ALA H 1.0 . 3.18 2856 1942 D 328 ALA H D 327 PRO HBx 1.0 . 4.19 2857 1943 D 327 PRO HBy D 328 ALA H 1.0 . 4.19 2858 1944 D 328 ALA H D 327 PRO HDx 1.0 . 4.73 2859 1944 D 327 PRO HDy D 328 ALA H 1.0 . 4.73 2860 1945 D 328 ALA H D 327 PRO HGx 1.0 . 4.44 2861 1945 D 327 PRO HGy D 328 ALA H 1.0 . 4.44 2862 1946 D 328 ALA H D 328 ALA HB1 1.0 . 3.09 2863 1947 D 328 ALA HA D 329 PHE H 1.0 . 3.14 2864 1948 D 328 ALA HB1 D 329 PHE H 1.0 . 3.64 2865 1949 D 329 PHE H D 329 PHE HBx 1.0 . 3.61 2866 1950 D 329 PHE H D 329 PHE HBy 1.0 . 3.61 2867 1951 D 329 PHE H D 329 PHE HBy 1.0 . 3.14 2868 1951 D 329 PHE H D 329 PHE HBx 1.0 . 3.14 2869 1952 D 329 PHE HD% D 329 PHE H 1.0 . 4.35 2870 1953 D 329 PHE HD% D 329 PHE HA 1.0 . 3.46 2871 1954 D 329 PHE HA D 329 PHE HE% 1.0 . 4.06 2872 1955 D 329 PHE HA D 330 ARG H 1.0 . 3.47 2873 1956 D 329 PHE HBx D 330 ARG H 1.0 . 4.39 2874 1957 D 330 ARG H D 329 PHE HBy 1.0 . 4.39 2875 1958 D 330 ARG H D 330 ARG HBx 1.0 . 4.12 2876 1959 D 330 ARG H D 330 ARG HBy 1.0 . 4.12 2877 1960 D 330 ARG H D 330 ARG HBy 1.0 . 3.49 2878 1960 D 330 ARG H D 330 ARG HBx 1.0 . 3.49 2879 1961 D 330 ARG H D 330 ARG HGx 1.0 . 3.94 2880 1961 D 330 ARG H D 330 ARG HGy 1.0 . 3.94 2881 1962 D 330 ARG HA D 330 ARG HDx 1.0 . 4.48 2882 1962 D 330 ARG HA D 330 ARG HDy 1.0 . 4.48 2883 1963 D 330 ARG HA D 330 ARG HGx 1.0 . 3.72 2884 1963 D 330 ARG HGy D 330 ARG HA 1.0 . 3.72 2885 1964 D 330 ARG HA D 331 GLU H 1.0 . 3.22 2886 1965 D 330 ARG HBx D 330 ARG HDy 1.0 . 3.80 2887 1965 D 330 ARG HBx D 330 ARG HDx 1.0 . 3.80 2888 1966 D 330 ARG HBx D 330 ARG HGy 1.0 . 2.88 2889 1966 D 330 ARG HBx D 330 ARG HGx 1.0 . 2.88 2890 1967 D 330 ARG HDy D 330 ARG HBy 1.0 . 3.80 2891 1967 D 330 ARG HBy D 330 ARG HDx 1.0 . 3.80 2892 1968 D 330 ARG HGy D 330 ARG HBy 1.0 . 2.88 2893 1968 D 330 ARG HBy D 330 ARG HGx 1.0 . 2.88 2894 1969 D 331 GLU H D 330 ARG HGx 1.0 . 4.74 2895 1969 D 330 ARG HGy D 331 GLU H 1.0 . 4.74 2896 1970 D 331 GLU H D 331 GLU HBx 1.0 . 4.19 2897 1971 D 331 GLU H D 331 GLU HBy 1.0 . 4.19 2898 1972 D 331 GLU H D 331 GLU HBx 1.0 . 3.53 2899 1972 D 331 GLU H D 331 GLU HBy 1.0 . 3.53 2900 1973 D 331 GLU H D 331 GLU HGx 1.0 . 4.59 2901 1973 D 331 GLU H D 331 GLU HGy 1.0 . 4.59 2902 1974 D 331 GLU HA D 331 GLU HGx 1.0 . 3.13 2903 1974 D 331 GLU HGy D 331 GLU HA 1.0 . 3.13 2904 1975 D 331 GLU HA D 332 GLU H 1.0 . 3.16 2905 1976 D 331 GLU HGy D 331 GLU HBx 1.0 . 2.40 2906 1976 D 331 GLU HBx D 331 GLU HGx 1.0 . 2.40 2907 1977 D 332 GLU H D 331 GLU HBx 1.0 . 4.05 2908 1978 D 331 GLU HBy D 331 GLU HGy 1.0 . 2.40 2909 1978 D 331 GLU HBy D 331 GLU HGx 1.0 . 2.40 2910 1979 D 331 GLU HBy D 332 GLU H 1.0 . 4.05 2911 1980 D 332 GLU H D 331 GLU HBx 1.0 . 3.34 2912 1980 D 331 GLU HBy D 332 GLU H 1.0 . 3.34 2913 1981 D 332 GLU H D 331 GLU HGx 1.0 . 4.38 2914 1981 D 331 GLU HGy D 332 GLU H 1.0 . 4.38 2915 1982 D 332 GLU H D 332 GLU HBx 1.0 . 3.79 2916 1983 D 332 GLU H D 332 GLU HBy 1.0 . 3.79 2917 1984 D 332 GLU H D 332 GLU HBx 1.0 . 3.26 2918 1984 D 332 GLU H D 332 GLU HBy 1.0 . 3.26 2919 1985 D 332 GLU H D 332 GLU HGx 1.0 . 3.91 2920 1985 D 332 GLU H D 332 GLU HGy 1.0 . 3.91 2921 1986 D 332 GLU HA D 332 GLU HGx 1.0 . 3.20 2922 1986 D 332 GLU HGy D 332 GLU HA 1.0 . 3.20 2923 1987 D 332 GLU HGy D 332 GLU HBx 1.0 . 2.40 2924 1987 D 332 GLU HBx D 332 GLU HGx 1.0 . 2.40 2925 1988 D 332 GLU HBy D 332 GLU HGy 1.0 . 2.40 2926 1988 D 332 GLU HBy D 332 GLU HGx 1.0 . 2.40 2927 1989 D 336 PHE HA D 336 PHE HD% 1.0 . 3.51 2928 1990 D 336 PHE HA D 336 PHE HE% 1.0 . 4.26 2929 1991 D 338 LYS HA D 338 LYS HDx 1.0 . 5.50 2930 1991 D 338 LYS HA D 338 LYS HDy 1.0 . 5.50 2931 1992 D 338 LYS HA D 338 LYS HEx 1.0 . 4.76 2932 1992 D 338 LYS HA D 338 LYS HEy 1.0 . 4.76 2933 1993 D 338 LYS HDy D 338 LYS HBx 1.0 . 2.40 2934 1993 D 338 LYS HBx D 338 LYS HDx 1.0 . 2.40 2935 1994 D 338 LYS HDy D 338 LYS HBy 1.0 . 2.40 2936 1994 D 338 LYS HBy D 338 LYS HDx 1.0 . 2.40 2937 1995 D 338 LYS HBy D 338 LYS HEx 1.0 . 3.26 2938 1995 D 338 LYS HBx D 338 LYS HEx 1.0 . 3.26 2939 1995 D 338 LYS HEy D 338 LYS HBy 1.0 . 3.26 2940 1995 D 338 LYS HEy D 338 LYS HBx 1.0 . 3.26 2941 1996 D 338 LYS HEx D 338 LYS HGx 1.0 . 3.60 2942 1996 D 338 LYS HEy D 338 LYS HGx 1.0 . 3.60 2943 1996 D 338 LYS HGy D 338 LYS HEx 1.0 . 3.60 2944 1996 D 338 LYS HEy D 338 LYS HGy 1.0 . 3.60 stop_ save_ save_DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode DYANA/DIANA_dihedral_2 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 7 TYR C A 8 ARG N A 8 ARG CA A 8 ARG C 1.0 -136.9 -60.7 PHI 2 2 A 8 ARG N A 8 ARG CA A 8 ARG C A 9 CYS N 1.0 113.3 160.8 PSI 3 3 A 8 ARG C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -140.0 -98.0 PHI 4 4 A 9 CYS N A 9 CYS CA A 9 CYS C A 10 PRO N 1.0 134.0 176.0 PSI 5 5 A 10 PRO C A 11 CYS N A 11 CYS CA A 11 CYS C 1.0 -97.8 -71.3 PHI 6 6 A 11 CYS C A 12 ARG N A 12 ARG CA A 12 ARG C 1.0 -112.0 -78.0 PHI 7 7 A 12 ARG C A 13 PHE N A 13 PHE CA A 13 PHE C 1.0 -135.7 -98.5 PHI 8 8 A 13 PHE N A 13 PHE CA A 13 PHE C A 14 PHE N 1.0 130.6 160.2 PSI 9 9 A 13 PHE C A 14 PHE N A 14 PHE CA A 14 PHE C 1.0 -133.9 -89.0 PHI 10 10 A 14 PHE N A 14 PHE CA A 14 PHE C A 15 GLU N 1.0 128.1 149.7 PSI 11 11 A 14 PHE C A 15 GLU N A 15 GLU CA A 15 GLU C 1.0 -112.8 -64.2 PHI 12 12 A 15 GLU N A 15 GLU CA A 15 GLU C A 16 SER N 1.0 109.9 152.8 PSI 13 13 A 18 VAL C A 19 ALA N A 19 ALA CA A 19 ALA C 1.0 -103.0 -65.0 PHI 14 14 A 19 ALA N A 19 ALA CA A 19 ALA C A 20 ARG N 1.0 93.0 135.0 PSI 15 15 A 19 ALA C A 20 ARG N A 20 ARG CA A 20 ARG C 1.0 -68.5 -48.5 PHI 16 16 A 20 ARG N A 20 ARG CA A 20 ARG C A 21 ALA N 1.0 -45.8 -17.1 PSI 17 17 A 20 ARG C A 21 ALA N A 21 ALA CA A 21 ALA C 1.0 -81.7 -52.8 PHI 18 18 A 21 ALA N A 21 ALA CA A 21 ALA C A 22 ASN N 1.0 -44.4 -11.7 PSI 19 19 A 22 ASN C A 23 VAL N A 23 VAL CA A 23 VAL C 1.0 -137.3 -95.4 PHI 20 20 A 23 VAL N A 23 VAL CA A 23 VAL C A 24 LYS N 1.0 123.7 154.2 PSI 21 21 A 25 HIS C A 26 LEU N A 26 LEU CA A 26 LEU C 1.0 -146.5 -117.7 PHI 22 22 A 26 LEU N A 26 LEU CA A 26 LEU C A 27 LYS N 1.0 130.2 162.2 PSI 23 23 A 26 LEU C A 27 LYS N A 27 LYS CA A 27 LYS C 1.0 -145.2 -114.2 PHI 24 24 A 27 LYS N A 27 LYS CA A 27 LYS C A 28 ILE N 1.0 119.2 141.2 PSI 25 25 A 27 LYS C A 28 ILE N A 28 ILE CA A 28 ILE C 1.0 -134.4 -104.1 PHI 26 26 A 28 ILE N A 28 ILE CA A 28 ILE C A 29 LEU N 1.0 115.4 136.0 PSI 27 27 A 29 LEU C A 30 ASN N A 30 ASN CA A 30 ASN C 1.0 -122.5 -84.0 PHI 28 28 A 30 ASN N A 30 ASN CA A 30 ASN C A 31 THR N 1.0 105.0 143.3 PSI 29 29 A 30 ASN C A 31 THR N A 31 THR CA A 31 THR C 1.0 -114.4 -70.4 PHI 30 30 A 31 THR N A 31 THR CA A 31 THR C A 32 PRO N 1.0 129.8 161.7 PSI 31 31 A 33 ASN C A 34 CYS N A 34 CYS CA A 34 CYS C 1.0 -146.0 -126.0 PHI 32 32 A 34 CYS N A 34 CYS CA A 34 CYS C A 35 ALA N 1.0 138.0 160.0 PSI 33 33 A 37 GLN C A 38 ILE N A 38 ILE CA A 38 ILE C 1.0 -124.7 -104.7 PHI 34 34 A 38 ILE N A 38 ILE CA A 38 ILE C A 39 VAL N 1.0 117.5 137.5 PSI 35 35 A 38 ILE C A 39 VAL N A 39 VAL CA A 39 VAL C 1.0 -131.4 -110.8 PHI 36 36 A 39 VAL N A 39 VAL CA A 39 VAL C A 40 ALA N 1.0 127.5 147.5 PSI 37 37 A 39 VAL C A 40 ALA N A 40 ALA CA A 40 ALA C 1.0 -137.9 -110.4 PHI 38 38 A 40 ALA N A 40 ALA CA A 40 ALA C A 41 ARG N 1.0 125.3 145.3 PSI 39 39 A 40 ALA C A 41 ARG N A 41 ARG CA A 41 ARG C 1.0 -117.9 -97.9 PHI 40 40 A 41 ARG N A 41 ARG CA A 41 ARG C A 42 LEU N 1.0 110.1 130.1 PSI 41 41 A 47 ARG C A 48 GLN N A 48 GLN CA A 48 GLN C 1.0 -136.0 -99.4 PHI 42 42 A 48 GLN N A 48 GLN CA A 48 GLN C A 49 VAL N 1.0 132.4 161.7 PSI 43 43 A 48 GLN C A 49 VAL N A 49 VAL CA A 49 VAL C 1.0 -146.1 -111.4 PHI 44 44 A 49 VAL N A 49 VAL CA A 49 VAL C A 50 CYS N 1.0 133.8 155.5 PSI 45 45 A 49 VAL C A 50 CYS N A 50 CYS CA A 50 CYS C 1.0 -140.0 -104.9 PHI 46 46 A 50 CYS N A 50 CYS CA A 50 CYS C A 51 ILE N 1.0 128.1 151.7 PSI 47 47 A 50 CYS C A 51 ILE N A 51 ILE CA A 51 ILE C 1.0 -154.2 -107.1 PHI 48 48 A 51 ILE N A 51 ILE CA A 51 ILE C A 52 ASP N 1.0 136.2 162.5 PSI 49 49 A 56 LYS C A 57 TRP N A 57 TRP CA A 57 TRP C 1.0 -74.8 -54.8 PHI 50 50 A 57 TRP N A 57 TRP CA A 57 TRP C A 58 ILE N 1.0 -47.9 -27.9 PSI 51 51 A 57 TRP C A 58 ILE N A 58 ILE CA A 58 ILE C 1.0 -74.5 -54.5 PHI 52 52 A 58 ILE N A 58 ILE CA A 58 ILE C A 59 GLN N 1.0 -50.7 -30.7 PSI 53 53 A 58 ILE C A 59 GLN N A 59 GLN CA A 59 GLN C 1.0 -69.6 -49.6 PHI 54 54 A 59 GLN N A 59 GLN CA A 59 GLN C A 60 GLU N 1.0 -50.3 -30.3 PSI 55 55 A 59 GLN C A 60 GLU N A 60 GLU CA A 60 GLU C 1.0 -75.0 -55.0 PHI 56 56 A 60 GLU N A 60 GLU CA A 60 GLU C A 61 TYR N 1.0 -51.1 -31.1 PSI 57 57 A 60 GLU C A 61 TYR N A 61 TYR CA A 61 TYR C 1.0 -74.4 -54.4 PHI 58 58 A 61 TYR N A 61 TYR CA A 61 TYR C A 62 LEU N 1.0 -53.6 -33.6 PSI 59 59 A 61 TYR C A 62 LEU N A 62 LEU CA A 62 LEU C 1.0 -72.5 -52.5 PHI 60 60 A 62 LEU N A 62 LEU CA A 62 LEU C A 63 GLU N 1.0 -50.4 -30.4 PSI 61 61 A 62 LEU C A 63 GLU N A 63 GLU CA A 63 GLU C 1.0 -73.8 -53.8 PHI 62 62 A 63 GLU N A 63 GLU CA A 63 GLU C A 64 LYS N 1.0 -49.7 -29.7 PSI 63 63 A 63 GLU C A 64 LYS N A 64 LYS CA A 64 LYS C 1.0 -90.9 -63.1 PHI 64 64 A 64 LYS N A 64 LYS CA A 64 LYS C A 65 CYS N 1.0 -43.0 -4.5 PSI 65 65 C 207 TYR C C 208 ARG N C 208 ARG CA C 208 ARG C 1.0 -136.9 -60.7 PHI 66 66 C 208 ARG N C 208 ARG CA C 208 ARG C C 209 CYS N 1.0 113.3 160.8 PSI 67 67 C 208 ARG C C 209 CYS N C 209 CYS CA C 209 CYS C 1.0 -140.0 -98.0 PHI 68 68 C 209 CYS N C 209 CYS CA C 209 CYS C C 210 PRO N 1.0 134.0 176.0 PSI 69 69 C 210 PRO C C 211 CYS N C 211 CYS CA C 211 CYS C 1.0 -97.8 -71.3 PHI 70 70 C 211 CYS C C 212 ARG N C 212 ARG CA C 212 ARG C 1.0 -112.0 -78.0 PHI 71 71 C 212 ARG C C 213 PHE N C 213 PHE CA C 213 PHE C 1.0 -135.7 -98.5 PHI 72 72 C 213 PHE N C 213 PHE CA C 213 PHE C C 214 PHE N 1.0 130.6 160.2 PSI 73 73 C 213 PHE C C 214 PHE N C 214 PHE CA C 214 PHE C 1.0 -133.9 -89.0 PHI 74 74 C 214 PHE N C 214 PHE CA C 214 PHE C C 215 GLU N 1.0 128.1 149.7 PSI 75 75 C 214 PHE C C 215 GLU N C 215 GLU CA C 215 GLU C 1.0 -112.8 -64.2 PHI 76 76 C 215 GLU N C 215 GLU CA C 215 GLU C C 216 SER N 1.0 109.9 152.8 PSI 77 77 C 218 VAL C C 219 ALA N C 219 ALA CA C 219 ALA C 1.0 -103.0 -65.0 PHI 78 78 C 219 ALA N C 219 ALA CA C 219 ALA C C 220 ARG N 1.0 93.0 135.0 PSI 79 79 C 219 ALA C C 220 ARG N C 220 ARG CA C 220 ARG C 1.0 -68.5 -48.5 PHI 80 80 C 220 ARG N C 220 ARG CA C 220 ARG C C 221 ALA N 1.0 -45.8 -17.1 PSI 81 81 C 220 ARG C C 221 ALA N C 221 ALA CA C 221 ALA C 1.0 -81.7 -52.8 PHI 82 82 C 221 ALA N C 221 ALA CA C 221 ALA C C 222 ASN N 1.0 -44.4 -11.7 PSI 83 83 C 222 ASN C C 223 VAL N C 223 VAL CA C 223 VAL C 1.0 -137.3 -95.4 PHI 84 84 C 223 VAL N C 223 VAL CA C 223 VAL C C 224 LYS N 1.0 123.7 154.2 PSI 85 85 C 225 HIS C C 226 LEU N C 226 LEU CA C 226 LEU C 1.0 -146.5 -117.7 PHI 86 86 C 226 LEU N C 226 LEU CA C 226 LEU C C 227 LYS N 1.0 130.2 162.2 PSI 87 87 C 226 LEU C C 227 LYS N C 227 LYS CA C 227 LYS C 1.0 -145.2 -114.2 PHI 88 88 C 227 LYS N C 227 LYS CA C 227 LYS C C 228 ILE N 1.0 119.2 141.2 PSI 89 89 C 227 LYS C C 228 ILE N C 228 ILE CA C 228 ILE C 1.0 -134.4 -104.1 PHI 90 90 C 228 ILE N C 228 ILE CA C 228 ILE C C 229 LEU N 1.0 115.4 136.0 PSI 91 91 C 229 LEU C C 230 ASN N C 230 ASN CA C 230 ASN C 1.0 -122.5 -84.0 PHI 92 92 C 230 ASN N C 230 ASN CA C 230 ASN C C 231 THR N 1.0 105.0 143.3 PSI 93 93 C 230 ASN C C 231 THR N C 231 THR CA C 231 THR C 1.0 -114.4 -70.4 PHI 94 94 C 231 THR N C 231 THR CA C 231 THR C C 232 PRO N 1.0 129.8 161.7 PSI 95 95 C 233 ASN C C 234 CYS N C 234 CYS CA C 234 CYS C 1.0 -146.0 -126.0 PHI 96 96 C 234 CYS N C 234 CYS CA C 234 CYS C C 235 ALA N 1.0 138.0 160.0 PSI 97 97 C 237 GLN C C 238 ILE N C 238 ILE CA C 238 ILE C 1.0 -124.7 -104.7 PHI 98 98 C 238 ILE N C 238 ILE CA C 238 ILE C C 239 VAL N 1.0 117.5 137.5 PSI 99 99 C 238 ILE C C 239 VAL N C 239 VAL CA C 239 VAL C 1.0 -131.4 -110.8 PHI 100 100 C 239 VAL N C 239 VAL CA C 239 VAL C C 240 ALA N 1.0 127.5 147.5 PSI 101 101 C 239 VAL C C 240 ALA N C 240 ALA CA C 240 ALA C 1.0 -137.9 -110.4 PHI 102 102 C 240 ALA N C 240 ALA CA C 240 ALA C C 241 ARG N 1.0 125.3 145.3 PSI 103 103 C 240 ALA C C 241 ARG N C 241 ARG CA C 241 ARG C 1.0 -117.9 -97.9 PHI 104 104 C 241 ARG N C 241 ARG CA C 241 ARG C C 242 LEU N 1.0 110.1 130.1 PSI 105 105 C 247 ARG C C 248 GLN N C 248 GLN CA C 248 GLN C 1.0 -136.0 -99.4 PHI 106 106 C 248 GLN N C 248 GLN CA C 248 GLN C C 249 VAL N 1.0 132.4 161.7 PSI 107 107 C 248 GLN C C 249 VAL N C 249 VAL CA C 249 VAL C 1.0 -146.1 -111.4 PHI 108 108 C 249 VAL N C 249 VAL CA C 249 VAL C C 250 CYS N 1.0 133.8 155.5 PSI 109 109 C 249 VAL C C 250 CYS N C 250 CYS CA C 250 CYS C 1.0 -140.0 -104.9 PHI 110 110 C 250 CYS N C 250 CYS CA C 250 CYS C C 251 ILE N 1.0 128.1 151.7 PSI 111 111 C 250 CYS C C 251 ILE N C 251 ILE CA C 251 ILE C 1.0 -154.2 -107.1 PHI 112 112 C 251 ILE N C 251 ILE CA C 251 ILE C C 252 ASP N 1.0 136.2 162.5 PSI 113 113 C 256 LYS C C 257 TRP N C 257 TRP CA C 257 TRP C 1.0 -74.8 -54.8 PHI 114 114 C 257 TRP N C 257 TRP CA C 257 TRP C C 258 ILE N 1.0 -47.9 -27.9 PSI 115 115 C 257 TRP C C 258 ILE N C 258 ILE CA C 258 ILE C 1.0 -74.5 -54.5 PHI 116 116 C 258 ILE N C 258 ILE CA C 258 ILE C C 259 GLN N 1.0 -50.7 -30.7 PSI 117 117 C 258 ILE C C 259 GLN N C 259 GLN CA C 259 GLN C 1.0 -69.6 -49.6 PHI 118 118 C 259 GLN N C 259 GLN CA C 259 GLN C C 260 GLU N 1.0 -50.3 -30.3 PSI 119 119 C 259 GLN C C 260 GLU N C 260 GLU CA C 260 GLU C 1.0 -75.0 -55.0 PHI 120 120 C 260 GLU N C 260 GLU CA C 260 GLU C C 261 TYR N 1.0 -51.1 -31.1 PSI 121 121 C 260 GLU C C 261 TYR N C 261 TYR CA C 261 TYR C 1.0 -74.4 -54.4 PHI 122 122 C 261 TYR N C 261 TYR CA C 261 TYR C C 262 LEU N 1.0 -53.6 -33.6 PSI 123 123 C 261 TYR C C 262 LEU N C 262 LEU CA C 262 LEU C 1.0 -72.5 -52.5 PHI 124 124 C 262 LEU N C 262 LEU CA C 262 LEU C C 263 GLU N 1.0 -50.4 -30.4 PSI 125 125 C 262 LEU C C 263 GLU N C 263 GLU CA C 263 GLU C 1.0 -73.8 -53.8 PHI 126 126 C 263 GLU N C 263 GLU CA C 263 GLU C C 264 LYS N 1.0 -49.7 -29.7 PSI 127 127 C 263 GLU C C 264 LYS N C 264 LYS CA C 264 LYS C 1.0 -90.9 -63.1 PHI 128 128 C 264 LYS N C 264 LYS CA C 264 LYS C C 265 CYS N 1.0 -43.0 -4.5 PSI stop_ save_