data_nef_c15677_2kb1 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 PDB 2KB1 PDB 2K1E stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly 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 SER start . . 2 A 2 ALA middle . . 3 A 3 ASP middle . . 4 A 4 HIS middle . . 5 A 5 GLU middle . . 6 A 6 ARG middle . . 7 A 7 GLU middle . . 8 A 8 ALA middle . . 9 A 9 GLN middle . . 10 A 10 LYS middle . . 11 A 11 ALA middle . . 12 A 12 GLU middle . . 13 A 13 GLU middle . . 14 A 14 GLU middle . . 15 A 15 LEU middle . . 16 A 16 GLN middle . . 17 A 17 LYS middle . . 18 A 18 VAL middle . . 19 A 19 LEU middle . . 20 A 20 GLU middle . . 21 A 21 GLU middle . . 22 A 22 ALA middle . . 23 A 23 SER middle . . 24 A 24 LYS middle . . 25 A 25 LYS middle . . 26 A 26 ALA middle . . 27 A 27 VAL middle . . 28 A 28 GLU middle . . 29 A 29 ALA middle . . 30 A 30 GLU middle . . 31 A 31 ARG middle . . 32 A 32 GLY middle . false 33 A 33 ALA middle . . 34 A 34 PRO middle . false 35 A 35 GLY middle . false 36 A 36 ALA middle . . 37 A 37 ALA middle . . 38 A 38 LEU middle . . 39 A 39 ILE middle . . 40 A 40 SER middle . . 41 A 41 TYR middle . . 42 A 42 PRO middle . false 43 A 43 ASP middle . . 44 A 44 ALA middle . . 45 A 45 ILE middle . . 46 A 46 TRP middle . . 47 A 47 TRP middle . . 48 A 48 SER middle . . 49 A 49 VAL middle . . 50 A 50 GLU middle . . 51 A 51 THR middle . . 52 A 52 ALA middle . . 53 A 53 THR middle . . 54 A 54 THR middle . . 55 A 55 VAL middle . . 56 A 56 GLY middle . false 57 A 57 TYR middle . . 58 A 58 GLY middle . false 59 A 59 ASP middle . . 60 A 60 ARG middle . . 61 A 61 TYR middle . . 62 A 62 PRO middle . false 63 A 63 VAL middle . . 64 A 64 THR middle . . 65 A 65 GLU middle . . 66 A 66 GLU middle . . 67 A 67 GLY middle . false 68 A 68 ARG middle . . 69 A 69 LYS middle . . 70 A 70 VAL middle . . 71 A 71 ALA middle . . 72 A 72 GLU middle . . 73 A 73 GLN middle . . 74 A 74 VAL middle . . 75 A 75 MET middle . . 76 A 76 LYS middle . . 77 A 77 ALA middle . . 78 A 78 GLY middle . false 79 A 79 ILE middle . . 80 A 80 GLU middle . . 81 A 81 VAL middle . . 82 A 82 PHE middle . . 83 A 83 ALA middle . . 84 A 84 LEU middle . . 85 A 85 VAL middle . . 86 A 86 THR middle . . 87 A 87 ALA middle . . 88 A 88 ALA middle . . 89 A 89 LEU middle . . 90 A 90 ALA middle . . 91 A 91 THR middle . . 92 A 92 ASP middle . . 93 A 93 PHE middle . . 94 A 94 VAL middle . . 95 A 95 ARG middle . . 96 A 96 ARG middle . . 97 A 97 GLU middle . . 98 A 98 GLU middle . . 99 A 99 GLU middle . . 100 A 100 ARG middle . . 101 A 101 ARG middle . . 102 A 102 GLY middle . false 103 A 103 HIS end . . 104 B 1 SER start . . 105 B 2 ALA middle . . 106 B 3 ASP middle . . 107 B 4 HIS middle . . 108 B 5 GLU middle . . 109 B 6 ARG middle . . 110 B 7 GLU middle . . 111 B 8 ALA middle . . 112 B 9 GLN middle . . 113 B 10 LYS middle . . 114 B 11 ALA middle . . 115 B 12 GLU middle . . 116 B 13 GLU middle . . 117 B 14 GLU middle . . 118 B 15 LEU middle . . 119 B 16 GLN middle . . 120 B 17 LYS middle . . 121 B 18 VAL middle . . 122 B 19 LEU middle . . 123 B 20 GLU middle . . 124 B 21 GLU middle . . 125 B 22 ALA middle . . 126 B 23 SER middle . . 127 B 24 LYS middle . . 128 B 25 LYS middle . . 129 B 26 ALA middle . . 130 B 27 VAL middle . . 131 B 28 GLU middle . . 132 B 29 ALA middle . . 133 B 30 GLU middle . . 134 B 31 ARG middle . . 135 B 32 GLY middle . false 136 B 33 ALA middle . . 137 B 34 PRO middle . false 138 B 35 GLY middle . false 139 B 36 ALA middle . . 140 B 37 ALA middle . . 141 B 38 LEU middle . . 142 B 39 ILE middle . . 143 B 40 SER middle . . 144 B 41 TYR middle . . 145 B 42 PRO middle . false 146 B 43 ASP middle . . 147 B 44 ALA middle . . 148 B 45 ILE middle . . 149 B 46 TRP middle . . 150 B 47 TRP middle . . 151 B 48 SER middle . . 152 B 49 VAL middle . . 153 B 50 GLU middle . . 154 B 51 THR middle . . 155 B 52 ALA middle . . 156 B 53 THR middle . . 157 B 54 THR middle . . 158 B 55 VAL middle . . 159 B 56 GLY middle . false 160 B 57 TYR middle . . 161 B 58 GLY middle . false 162 B 59 ASP middle . . 163 B 60 ARG middle . . 164 B 61 TYR middle . . 165 B 62 PRO middle . false 166 B 63 VAL middle . . 167 B 64 THR middle . . 168 B 65 GLU middle . . 169 B 66 GLU middle . . 170 B 67 GLY middle . false 171 B 68 ARG middle . . 172 B 69 LYS middle . . 173 B 70 VAL middle . . 174 B 71 ALA middle . . 175 B 72 GLU middle . . 176 B 73 GLN middle . . 177 B 74 VAL middle . . 178 B 75 MET middle . . 179 B 76 LYS middle . . 180 B 77 ALA middle . . 181 B 78 GLY middle . false 182 B 79 ILE middle . . 183 B 80 GLU middle . . 184 B 81 VAL middle . . 185 B 82 PHE middle . . 186 B 83 ALA middle . . 187 B 84 LEU middle . . 188 B 85 VAL middle . . 189 B 86 THR middle . . 190 B 87 ALA middle . . 191 B 88 ALA middle . . 192 B 89 LEU middle . . 193 B 90 ALA middle . . 194 B 91 THR middle . . 195 B 92 ASP middle . . 196 B 93 PHE middle . . 197 B 94 VAL middle . . 198 B 95 ARG middle . . 199 B 96 ARG middle . . 200 B 97 GLU middle . . 201 B 98 GLU middle . . 202 B 99 GLU middle . . 203 B 100 ARG middle . . 204 B 101 ARG middle . . 205 B 102 GLY middle . false 206 B 103 HIS end . . 207 C 1 SER start . . 208 C 2 ALA middle . . 209 C 3 ASP middle . . 210 C 4 HIS middle . . 211 C 5 GLU middle . . 212 C 6 ARG middle . . 213 C 7 GLU middle . . 214 C 8 ALA middle . . 215 C 9 GLN middle . . 216 C 10 LYS middle . . 217 C 11 ALA middle . . 218 C 12 GLU middle . . 219 C 13 GLU middle . . 220 C 14 GLU middle . . 221 C 15 LEU middle . . 222 C 16 GLN middle . . 223 C 17 LYS middle . . 224 C 18 VAL middle . . 225 C 19 LEU middle . . 226 C 20 GLU middle . . 227 C 21 GLU middle . . 228 C 22 ALA middle . . 229 C 23 SER middle . . 230 C 24 LYS middle . . 231 C 25 LYS middle . . 232 C 26 ALA middle . . 233 C 27 VAL middle . . 234 C 28 GLU middle . . 235 C 29 ALA middle . . 236 C 30 GLU middle . . 237 C 31 ARG middle . . 238 C 32 GLY middle . false 239 C 33 ALA middle . . 240 C 34 PRO middle . false 241 C 35 GLY middle . false 242 C 36 ALA middle . . 243 C 37 ALA middle . . 244 C 38 LEU middle . . 245 C 39 ILE middle . . 246 C 40 SER middle . . 247 C 41 TYR middle . . 248 C 42 PRO middle . false 249 C 43 ASP middle . . 250 C 44 ALA middle . . 251 C 45 ILE middle . . 252 C 46 TRP middle . . 253 C 47 TRP middle . . 254 C 48 SER middle . . 255 C 49 VAL middle . . 256 C 50 GLU middle . . 257 C 51 THR middle . . 258 C 52 ALA middle . . 259 C 53 THR middle . . 260 C 54 THR middle . . 261 C 55 VAL middle . . 262 C 56 GLY middle . false 263 C 57 TYR middle . . 264 C 58 GLY middle . false 265 C 59 ASP middle . . 266 C 60 ARG middle . . 267 C 61 TYR middle . . 268 C 62 PRO middle . false 269 C 63 VAL middle . . 270 C 64 THR middle . . 271 C 65 GLU middle . . 272 C 66 GLU middle . . 273 C 67 GLY middle . false 274 C 68 ARG middle . . 275 C 69 LYS middle . . 276 C 70 VAL middle . . 277 C 71 ALA middle . . 278 C 72 GLU middle . . 279 C 73 GLN middle . . 280 C 74 VAL middle . . 281 C 75 MET middle . . 282 C 76 LYS middle . . 283 C 77 ALA middle . . 284 C 78 GLY middle . false 285 C 79 ILE middle . . 286 C 80 GLU middle . . 287 C 81 VAL middle . . 288 C 82 PHE middle . . 289 C 83 ALA middle . . 290 C 84 LEU middle . . 291 C 85 VAL middle . . 292 C 86 THR middle . . 293 C 87 ALA middle . . 294 C 88 ALA middle . . 295 C 89 LEU middle . . 296 C 90 ALA middle . . 297 C 91 THR middle . . 298 C 92 ASP middle . . 299 C 93 PHE middle . . 300 C 94 VAL middle . . 301 C 95 ARG middle . . 302 C 96 ARG middle . . 303 C 97 GLU middle . . 304 C 98 GLU middle . . 305 C 99 GLU middle . . 306 C 100 ARG middle . . 307 C 101 ARG middle . . 308 C 102 GLY middle . false 309 C 103 HIS end . . 310 D 1 SER start . . 311 D 2 ALA middle . . 312 D 3 ASP middle . . 313 D 4 HIS middle . . 314 D 5 GLU middle . . 315 D 6 ARG middle . . 316 D 7 GLU middle . . 317 D 8 ALA middle . . 318 D 9 GLN middle . . 319 D 10 LYS middle . . 320 D 11 ALA middle . . 321 D 12 GLU middle . . 322 D 13 GLU middle . . 323 D 14 GLU middle . . 324 D 15 LEU middle . . 325 D 16 GLN middle . . 326 D 17 LYS middle . . 327 D 18 VAL middle . . 328 D 19 LEU middle . . 329 D 20 GLU middle . . 330 D 21 GLU middle . . 331 D 22 ALA middle . . 332 D 23 SER middle . . 333 D 24 LYS middle . . 334 D 25 LYS middle . . 335 D 26 ALA middle . . 336 D 27 VAL middle . . 337 D 28 GLU middle . . 338 D 29 ALA middle . . 339 D 30 GLU middle . . 340 D 31 ARG middle . . 341 D 32 GLY middle . false 342 D 33 ALA middle . . 343 D 34 PRO middle . false 344 D 35 GLY middle . false 345 D 36 ALA middle . . 346 D 37 ALA middle . . 347 D 38 LEU middle . . 348 D 39 ILE middle . . 349 D 40 SER middle . . 350 D 41 TYR middle . . 351 D 42 PRO middle . false 352 D 43 ASP middle . . 353 D 44 ALA middle . . 354 D 45 ILE middle . . 355 D 46 TRP middle . . 356 D 47 TRP middle . . 357 D 48 SER middle . . 358 D 49 VAL middle . . 359 D 50 GLU middle . . 360 D 51 THR middle . . 361 D 52 ALA middle . . 362 D 53 THR middle . . 363 D 54 THR middle . . 364 D 55 VAL middle . . 365 D 56 GLY middle . false 366 D 57 TYR middle . . 367 D 58 GLY middle . false 368 D 59 ASP middle . . 369 D 60 ARG middle . . 370 D 61 TYR middle . . 371 D 62 PRO middle . false 372 D 63 VAL middle . . 373 D 64 THR middle . . 374 D 65 GLU middle . . 375 D 66 GLU middle . . 376 D 67 GLY middle . false 377 D 68 ARG middle . . 378 D 69 LYS middle . . 379 D 70 VAL middle . . 380 D 71 ALA middle . . 381 D 72 GLU middle . . 382 D 73 GLN middle . . 383 D 74 VAL middle . . 384 D 75 MET middle . . 385 D 76 LYS middle . . 386 D 77 ALA middle . . 387 D 78 GLY middle . false 388 D 79 ILE middle . . 389 D 80 GLU middle . . 390 D 81 VAL middle . . 391 D 82 PHE middle . . 392 D 83 ALA middle . . 393 D 84 LEU middle . . 394 D 85 VAL middle . . 395 D 86 THR middle . . 396 D 87 ALA middle . . 397 D 88 ALA middle . . 398 D 89 LEU middle . . 399 D 90 ALA middle . . 400 D 91 THR middle . . 401 D 92 ASP middle . . 402 D 93 PHE middle . . 403 D 94 VAL middle . . 404 D 95 ARG middle . . 405 D 96 ARG middle . . 406 D 97 GLU middle . . 407 D 98 GLU middle . . 408 D 99 GLU middle . . 409 D 100 ARG middle . . 410 D 101 ARG middle . . 411 D 102 GLY middle . false 412 D 103 HIS 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 SER H1 H 1 8.399 0.010 A 1 SER HA H 1 4.094 0.010 A 1 SER HBx H 1 3.953 0.003 A 1 SER HBy H 1 3.953 0.003 A 1 SER C C 13 170.732 0.100 A 1 SER CA C 13 59.193 0.100 A 1 SER CB C 13 62.908 0.100 A 1 SER N N 15 117.162 0.100 A 2 ALA H H 1 8.742 0.009 A 2 ALA HA H 1 4.302 0.004 A 2 ALA HB% H 1 1.297 0.001 A 2 ALA C C 13 177.216 0.100 A 2 ALA CA C 13 52.876 0.058 A 2 ALA CB C 13 19.182 0.100 A 2 ALA N N 15 124.657 0.023 A 3 ASP H H 1 8.432 0.002 A 3 ASP HA H 1 4.530 0.010 A 3 ASP HBx H 1 2.713 0.001 A 3 ASP HBy H 1 2.713 0.001 A 3 ASP C C 13 176.023 0.100 A 3 ASP CA C 13 53.721 0.148 A 3 ASP CB C 13 38.752 0.100 A 3 ASP N N 15 118.729 0.069 A 4 HIS H H 1 8.549 0.012 A 4 HIS HA H 1 4.568 0.019 A 4 HIS HB2 H 1 3.239 0.002 A 4 HIS HB3 H 1 3.144 0.012 A 4 HIS HD2 H 1 7.219 0.010 A 4 HIS HE1 H 1 8.530 0.010 A 4 HIS C C 13 175.101 0.100 A 4 HIS CA C 13 56.640 0.100 A 4 HIS CB C 13 28.961 0.100 A 4 HIS CD2 C 13 119.713 0.100 A 4 HIS CE1 C 13 136.016 0.100 A 4 HIS N N 15 119.650 0.096 A 5 GLU H H 1 8.330 0.005 A 5 GLU HA H 1 4.207 0.001 A 5 GLU HBx H 1 2.021 0.011 A 5 GLU HBy H 1 2.021 0.011 A 5 GLU HGx H 1 2.411 0.010 A 5 GLU HGy H 1 2.411 0.010 A 5 GLU C C 13 175.749 0.100 A 5 GLU CA C 13 56.594 0.100 A 5 GLU CB C 13 29.285 0.100 A 5 GLU CG C 13 33.330 0.100 A 5 GLU N N 15 120.937 0.063 A 6 ARG H H 1 8.325 0.003 A 6 ARG HA H 1 4.571 0.010 A 6 ARG HBx H 1 1.803 0.010 A 6 ARG HBy H 1 1.803 0.010 A 6 ARG HDx H 1 3.263 0.010 A 6 ARG HDy H 1 3.263 0.010 A 6 ARG HE H 1 7.000 0.010 A 6 ARG HGx H 1 1.636 0.010 A 6 ARG HGy H 1 1.636 0.010 A 6 ARG HH1x H 1 6.373 0.010 A 6 ARG HH1y H 1 6.373 0.010 A 6 ARG HH2x H 1 6.726 0.010 A 6 ARG HH2y H 1 6.726 0.010 A 6 ARG C C 13 177.578 0.100 A 6 ARG CA C 13 56.716 0.100 A 6 ARG CB C 13 30.744 0.100 A 6 ARG CD C 13 43.200 0.100 A 6 ARG CG C 13 27.165 0.100 A 6 ARG N N 15 120.267 0.002 A 6 ARG NE N 15 108.520 0.100 A 7 GLU H H 1 8.136 0.003 A 7 GLU HA H 1 4.165 0.009 A 7 GLU HBx H 1 2.007 0.006 A 7 GLU HBy H 1 2.007 0.006 A 7 GLU HGx H 1 2.448 0.010 A 7 GLU HGy H 1 2.448 0.010 A 7 GLU C C 13 177.156 0.100 A 7 GLU CA C 13 57.125 0.100 A 7 GLU CB C 13 30.149 0.100 A 7 GLU CG C 13 33.260 0.100 A 7 GLU N N 15 121.008 0.007 A 8 ALA H H 1 8.325 0.001 A 8 ALA HA H 1 4.212 0.010 A 8 ALA HB% H 1 1.353 0.010 A 8 ALA C C 13 178.913 0.100 A 8 ALA CA C 13 52.832 0.100 A 8 ALA CB C 13 18.909 0.100 A 8 ALA N N 15 124.538 0.048 A 9 GLN H H 1 8.159 0.010 A 9 GLN HA H 1 4.140 0.010 A 9 GLN HBx H 1 2.050 0.005 A 9 GLN HBy H 1 2.050 0.005 A 9 GLN HE21 H 1 6.816 0.001 A 9 GLN HE22 H 1 7.456 0.017 A 9 GLN HGx H 1 2.376 0.018 A 9 GLN HGy H 1 2.376 0.018 A 9 GLN C C 13 175.771 0.100 A 9 GLN CA C 13 57.655 0.100 A 9 GLN CB C 13 28.606 0.100 A 9 GLN CG C 13 33.120 0.100 A 9 GLN N N 15 124.103 0.100 A 9 GLN NE2 N 15 112.089 0.039 A 10 LYS H H 1 8.148 0.010 A 10 LYS HA H 1 4.204 0.010 A 10 LYS HBx H 1 1.831 0.010 A 10 LYS HBy H 1 1.831 0.010 A 10 LYS HDx H 1 1.683 0.010 A 10 LYS HDy H 1 1.683 0.010 A 10 LYS HEx H 1 2.986 0.010 A 10 LYS HEy H 1 2.986 0.010 A 10 LYS HGx H 1 1.585 0.010 A 10 LYS HGy H 1 1.585 0.010 A 10 LYS C C 13 177.798 0.100 A 10 LYS CA C 13 57.139 0.100 A 10 LYS CB C 13 33.040 0.100 A 10 LYS CD C 13 30.600 0.100 A 10 LYS CE C 13 42.000 0.100 A 10 LYS CG C 13 24.850 0.100 A 10 LYS N N 15 120.635 0.100 A 11 ALA H H 1 8.148 0.010 A 11 ALA HA H 1 4.140 0.010 A 11 ALA HB% H 1 1.386 0.010 A 11 ALA C C 13 178.173 0.100 A 11 ALA CA C 13 53.351 0.100 A 11 ALA CB C 13 19.128 0.100 A 11 ALA N N 15 123.171 0.022 A 12 GLU H H 1 8.248 0.001 A 12 GLU HA H 1 4.222 0.010 A 12 GLU HBx H 1 1.936 0.010 A 12 GLU HBy H 1 1.936 0.010 A 12 GLU HGx H 1 2.391 0.010 A 12 GLU HGy H 1 2.391 0.010 A 12 GLU C C 13 176.385 0.100 A 12 GLU CA C 13 57.442 0.100 A 12 GLU CB C 13 30.001 0.100 A 12 GLU CG C 13 33.350 0.100 A 12 GLU N N 15 119.451 0.021 A 13 GLU H H 1 8.372 0.002 A 13 GLU HA H 1 4.265 0.010 A 13 GLU HBx H 1 2.008 0.010 A 13 GLU HBy H 1 2.008 0.010 A 13 GLU HGx H 1 2.397 0.010 A 13 GLU HGy H 1 2.397 0.010 A 13 GLU C C 13 178.060 0.100 A 13 GLU CA C 13 56.828 0.100 A 13 GLU CB C 13 30.082 0.100 A 13 GLU CG C 13 33.350 0.100 A 13 GLU N N 15 121.080 0.049 A 14 GLU H H 1 8.152 0.001 A 14 GLU HA H 1 4.142 0.010 A 14 GLU HBx H 1 2.069 0.010 A 14 GLU HBy H 1 2.069 0.010 A 14 GLU HGx H 1 2.473 0.010 A 14 GLU HGy H 1 2.473 0.010 A 14 GLU C C 13 176.274 0.100 A 14 GLU CA C 13 56.892 0.100 A 14 GLU CB C 13 28.169 0.100 A 14 GLU CG C 13 33.530 0.100 A 14 GLU N N 15 120.236 0.011 A 15 LEU H H 1 8.301 0.002 A 15 LEU HA H 1 4.224 0.010 A 15 LEU HB2 H 1 1.490 0.010 A 15 LEU HB3 H 1 1.688 0.010 A 15 LEU HDx% H 1 0.814 0.010 A 15 LEU HDy% H 1 0.787 0.010 A 15 LEU HG H 1 1.506 0.010 A 15 LEU C C 13 177.983 0.100 A 15 LEU CA C 13 56.344 0.100 A 15 LEU CB C 13 42.250 0.100 A 15 LEU CD1 C 13 24.475 0.100 A 15 LEU CD2 C 13 24.475 0.100 A 15 LEU CG C 13 26.872 0.100 A 15 LEU N N 15 123.072 0.010 A 16 GLN H H 1 8.132 0.001 A 16 GLN HA H 1 4.145 0.020 A 16 GLN HBx H 1 2.066 0.002 A 16 GLN HBy H 1 2.066 0.002 A 16 GLN HE21 H 1 6.820 0.010 A 16 GLN HE22 H 1 7.384 0.003 A 16 GLN HGx H 1 2.426 0.017 A 16 GLN HGy H 1 2.426 0.017 A 16 GLN C C 13 177.674 0.100 A 16 GLN CA C 13 57.971 0.100 A 16 GLN CB C 13 29.889 0.100 A 16 GLN CG C 13 33.120 0.100 A 16 GLN N N 15 119.160 0.033 A 16 GLN NE2 N 15 112.010 0.016 A 17 LYS H H 1 8.214 0.003 A 17 LYS HA H 1 4.140 0.010 A 17 LYS HBx H 1 1.768 0.010 A 17 LYS HBy H 1 1.768 0.010 A 17 LYS HDx H 1 1.502 0.010 A 17 LYS HDy H 1 1.502 0.010 A 17 LYS HEx H 1 2.954 0.010 A 17 LYS HEy H 1 2.954 0.010 A 17 LYS HGx H 1 1.382 0.010 A 17 LYS HGy H 1 1.382 0.010 A 17 LYS C C 13 177.646 0.100 A 17 LYS CA C 13 57.115 0.100 A 17 LYS CB C 13 32.833 0.100 A 17 LYS CD C 13 30.600 0.100 A 17 LYS CE C 13 42.000 0.100 A 17 LYS CG C 13 24.850 0.100 A 17 LYS N N 15 120.310 0.030 A 18 VAL H H 1 7.871 0.002 A 18 VAL HA H 1 4.108 0.010 A 18 VAL HB H 1 2.111 0.010 A 18 VAL HGx% H 1 0.972 0.010 A 18 VAL HGy% H 1 0.972 0.010 A 18 VAL C C 13 177.476 0.100 A 18 VAL CA C 13 63.634 0.100 A 18 VAL CB C 13 31.886 0.100 A 18 VAL CG1 C 13 21.720 0.100 A 18 VAL CG2 C 13 21.720 0.100 A 18 VAL N N 15 120.571 0.021 A 19 LEU H H 1 8.180 0.005 A 19 LEU HA H 1 4.042 0.010 A 19 LEU HBx H 1 1.720 0.010 A 19 LEU HBy H 1 1.720 0.010 A 19 LEU HDx% H 1 0.847 0.010 A 19 LEU HDy% H 1 0.874 0.010 A 19 LEU HG H 1 1.499 0.010 A 19 LEU C C 13 179.462 0.100 A 19 LEU CA C 13 57.653 0.100 A 19 LEU CB C 13 41.800 0.100 A 19 LEU CD1 C 13 23.876 0.100 A 19 LEU CD2 C 13 23.876 0.100 A 19 LEU CG C 13 26.878 0.100 A 19 LEU N N 15 122.936 0.023 A 20 GLU H H 1 8.122 0.001 A 20 GLU HA H 1 4.156 0.010 A 20 GLU HBx H 1 2.069 0.010 A 20 GLU HBy H 1 2.069 0.010 A 20 GLU HGx H 1 2.406 0.010 A 20 GLU HGy H 1 2.406 0.010 A 20 GLU C C 13 178.001 0.100 A 20 GLU CA C 13 58.045 0.100 A 20 GLU CB C 13 30.092 0.100 A 20 GLU CG C 13 33.530 0.100 A 20 GLU N N 15 118.745 0.030 A 21 GLU H H 1 8.190 0.005 A 21 GLU HA H 1 4.144 0.010 A 21 GLU HBx H 1 2.071 0.010 A 21 GLU HBy H 1 2.071 0.010 A 21 GLU HGx H 1 2.485 0.010 A 21 GLU HGy H 1 2.485 0.010 A 21 GLU C C 13 177.290 0.100 A 21 GLU CA C 13 58.109 0.100 A 21 GLU CB C 13 29.868 0.100 A 21 GLU CG C 13 33.530 0.100 A 21 GLU N N 15 119.542 0.200 A 22 ALA H H 1 8.092 0.007 A 22 ALA HA H 1 4.173 0.007 A 22 ALA HB% H 1 1.406 0.002 A 22 ALA C C 13 179.020 0.100 A 22 ALA CA C 13 53.944 0.100 A 22 ALA CB C 13 18.578 0.100 A 22 ALA N N 15 123.378 0.175 A 23 SER H H 1 8.079 0.001 A 23 SER HA H 1 4.300 0.018 A 23 SER HBx H 1 3.884 0.002 A 23 SER HBy H 1 3.884 0.002 A 23 SER C C 13 173.125 0.100 A 23 SER CA C 13 59.414 0.100 A 23 SER CB C 13 63.520 0.100 A 23 SER N N 15 114.637 0.023 A 24 LYS H H 1 8.032 0.003 A 24 LYS HA H 1 4.325 0.010 A 24 LYS HBx H 1 1.772 0.010 A 24 LYS HBy H 1 1.772 0.010 A 24 LYS HDx H 1 1.776 0.010 A 24 LYS HDy H 1 1.776 0.010 A 24 LYS HEx H 1 2.914 0.010 A 24 LYS HEy H 1 2.914 0.010 A 24 LYS HGx H 1 1.399 0.010 A 24 LYS HGy H 1 1.399 0.010 A 24 LYS C C 13 175.423 0.100 A 24 LYS CA C 13 57.273 0.100 A 24 LYS CB C 13 31.200 0.100 A 24 LYS CD C 13 30.600 0.100 A 24 LYS CE C 13 42.000 0.100 A 24 LYS CG C 13 24.850 0.100 A 24 LYS N N 15 122.635 0.030 A 25 LYS H H 1 8.042 0.003 A 25 LYS HA H 1 4.169 0.010 A 25 LYS HBx H 1 1.747 0.010 A 25 LYS HBy H 1 1.747 0.010 A 25 LYS HDx H 1 1.776 0.010 A 25 LYS HDy H 1 1.776 0.010 A 25 LYS HEx H 1 2.983 0.010 A 25 LYS HEy H 1 2.983 0.010 A 25 LYS HGx H 1 1.399 0.010 A 25 LYS HGy H 1 1.399 0.010 A 25 LYS C C 13 177.025 0.100 A 25 LYS CA C 13 56.876 0.100 A 25 LYS CB C 13 31.200 0.100 A 25 LYS CD C 13 30.600 0.100 A 25 LYS CE C 13 42.000 0.100 A 25 LYS CG C 13 24.850 0.100 A 25 LYS N N 15 121.079 0.070 A 26 ALA H H 1 8.103 0.009 A 26 ALA HA H 1 4.196 0.020 A 26 ALA HB% H 1 1.349 0.009 A 26 ALA C C 13 178.418 0.100 A 26 ALA CA C 13 53.049 0.100 A 26 ALA CB C 13 19.055 0.100 A 26 ALA N N 15 124.589 0.069 A 27 VAL H H 1 8.030 0.002 A 27 VAL HA H 1 3.945 0.001 A 27 VAL HB H 1 2.025 0.010 A 27 VAL HGx% H 1 0.906 0.010 A 27 VAL HGy% H 1 0.906 0.010 A 27 VAL C C 13 179.177 0.100 A 27 VAL CA C 13 63.001 0.100 A 27 VAL CB C 13 32.449 0.100 A 27 VAL CG1 C 13 20.980 0.100 A 27 VAL CG2 C 13 20.980 0.100 A 27 VAL N N 15 119.340 0.028 A 28 GLU H H 1 8.187 0.002 A 28 GLU HA H 1 4.166 0.010 A 28 GLU HBx H 1 2.008 0.008 A 28 GLU HBy H 1 2.008 0.008 A 28 GLU HGx H 1 2.429 0.010 A 28 GLU HGy H 1 2.429 0.010 A 28 GLU C C 13 176.411 0.100 A 28 GLU CA C 13 57.290 0.100 A 28 GLU CB C 13 30.025 0.100 A 28 GLU CG C 13 33.000 0.100 A 28 GLU N N 15 120.351 0.057 A 29 ALA H H 1 8.173 0.003 A 29 ALA HA H 1 4.230 0.010 A 29 ALA HB% H 1 1.356 0.010 A 29 ALA C C 13 176.924 0.100 A 29 ALA CA C 13 53.338 0.100 A 29 ALA CB C 13 18.964 0.100 A 29 ALA N N 15 124.463 0.014 A 30 GLU H H 1 8.239 0.001 A 30 GLU HA H 1 4.251 0.010 A 30 GLU HBx H 1 2.008 0.011 A 30 GLU HBy H 1 2.008 0.011 A 30 GLU HGx H 1 2.449 0.014 A 30 GLU HGy H 1 2.449 0.014 A 30 GLU C C 13 175.016 0.100 A 30 GLU CA C 13 58.033 0.100 A 30 GLU CB C 13 29.996 0.100 A 30 GLU CG C 13 33.000 0.100 A 30 GLU N N 15 122.971 0.022 A 31 ARG H H 1 8.261 0.005 A 31 ARG HA H 1 4.255 0.010 A 31 ARG HBx H 1 1.761 0.020 A 31 ARG HBy H 1 1.761 0.020 A 31 ARG HDx H 1 3.124 0.003 A 31 ARG HDy H 1 3.124 0.003 A 31 ARG HE H 1 7.147 0.010 A 31 ARG HGx H 1 1.605 0.002 A 31 ARG HGy H 1 1.605 0.002 A 31 ARG HH1x H 1 6.420 0.010 A 31 ARG HH1y H 1 6.420 0.010 A 31 ARG HH2x H 1 6.726 0.010 A 31 ARG HH2y H 1 6.726 0.010 A 31 ARG C C 13 176.727 0.100 A 31 ARG CA C 13 56.565 0.100 A 31 ARG CB C 13 30.783 0.100 A 31 ARG CD C 13 43.200 0.100 A 31 ARG CG C 13 27.165 0.100 A 31 ARG N N 15 121.894 0.101 A 31 ARG NE N 15 108.585 0.100 A 32 GLY H H 1 8.302 0.001 A 32 GLY HAx H 1 3.852 0.010 A 32 GLY HAy H 1 3.852 0.010 A 32 GLY C C 13 173.994 0.100 A 32 GLY CA C 13 45.077 0.100 A 32 GLY N N 15 109.773 0.058 A 33 ALA H H 1 8.011 0.012 A 33 ALA HA H 1 4.212 0.010 A 33 ALA HB% H 1 1.311 0.004 A 33 ALA CA C 13 50.522 0.100 A 33 ALA CB C 13 18.962 0.100 A 33 ALA N N 15 123.601 0.020 A 34 PRO HA H 1 4.352 0.010 A 34 PRO HBx H 1 2.228 0.010 A 34 PRO HBy H 1 2.228 0.010 A 34 PRO HD2 H 1 3.576 0.010 A 34 PRO HD3 H 1 3.680 0.010 A 34 PRO HGx H 1 1.887 0.010 A 34 PRO HGy H 1 1.887 0.010 A 34 PRO C C 13 177.746 0.100 A 34 PRO CA C 13 63.520 0.100 A 34 PRO CB C 13 31.938 0.100 A 34 PRO CD C 13 50.176 0.100 A 34 PRO CG C 13 27.510 0.100 A 35 GLY H H 1 8.433 0.001 A 35 GLY HAx H 1 3.848 0.010 A 35 GLY HAy H 1 3.848 0.010 A 35 GLY C C 13 173.266 0.100 A 35 GLY CA C 13 45.405 0.100 A 35 GLY N N 15 109.298 0.093 A 36 ALA H H 1 8.095 0.007 A 36 ALA HA H 1 4.196 0.010 A 36 ALA HB% H 1 1.363 0.010 A 36 ALA C C 13 177.944 0.100 A 36 ALA CA C 13 52.551 0.100 A 36 ALA CB C 13 19.485 0.100 A 36 ALA N N 15 124.605 0.160 A 37 ALA H H 1 8.199 0.010 A 37 ALA HA H 1 4.491 0.010 A 37 ALA HB% H 1 1.353 0.010 A 37 ALA C C 13 177.456 0.100 A 37 ALA CA C 13 52.453 0.100 A 37 ALA CB C 13 19.060 0.100 A 37 ALA N N 15 123.695 0.039 A 38 LEU H H 1 8.099 0.005 A 38 LEU HA H 1 4.243 0.010 A 38 LEU HBx H 1 1.537 0.010 A 38 LEU HBy H 1 1.537 0.010 A 38 LEU HDx% H 1 0.840 0.010 A 38 LEU HDy% H 1 0.840 0.010 A 38 LEU HG H 1 1.533 0.010 A 38 LEU C C 13 177.358 0.100 A 38 LEU CA C 13 55.218 0.100 A 38 LEU CB C 13 42.228 0.100 A 38 LEU CD1 C 13 24.475 0.100 A 38 LEU CD2 C 13 24.475 0.100 A 38 LEU CG C 13 26.872 0.100 A 38 LEU N N 15 121.531 0.076 A 39 ILE H H 1 7.966 0.001 A 39 ILE HA H 1 4.136 0.010 A 39 ILE HB H 1 1.691 0.010 A 39 ILE HD1% H 1 0.839 0.010 A 39 ILE HG1x H 1 0.673 0.010 A 39 ILE HG1y H 1 0.673 0.010 A 39 ILE HG2% H 1 0.649 0.010 A 39 ILE C C 13 175.586 0.100 A 39 ILE CA C 13 60.873 0.100 A 39 ILE CB C 13 38.727 0.100 A 39 ILE CD1 C 13 12.898 0.100 A 39 ILE CG1 C 13 27.261 0.100 A 39 ILE CG2 C 13 17.349 0.100 A 39 ILE N N 15 121.669 0.013 A 40 SER H H 1 8.101 0.001 A 40 SER HA H 1 4.347 0.010 A 40 SER HBx H 1 3.636 0.010 A 40 SER HBy H 1 3.636 0.010 A 40 SER C C 13 173.336 0.100 A 40 SER CA C 13 57.331 0.100 A 40 SER CB C 13 63.983 0.100 A 40 SER N N 15 119.591 0.008 A 41 TYR H H 1 8.100 0.010 A 41 TYR HA H 1 4.436 0.010 A 41 TYR HB2 H 1 3.035 0.010 A 41 TYR HB3 H 1 2.727 0.010 A 41 TYR HDx H 1 7.000 0.010 A 41 TYR HDy H 1 7.000 0.010 A 41 TYR HEx H 1 7.000 0.010 A 41 TYR HEy H 1 7.000 0.010 A 41 TYR CA C 13 56.067 0.100 A 41 TYR CB C 13 38.244 0.100 A 41 TYR N N 15 122.744 0.100 A 42 PRO HA H 1 4.281 0.010 A 42 PRO HBx H 1 2.155 0.010 A 42 PRO HBy H 1 2.155 0.010 A 42 PRO HD2 H 1 3.650 0.010 A 42 PRO HD3 H 1 3.508 0.010 A 42 PRO HGx H 1 1.876 0.010 A 42 PRO HGy H 1 1.876 0.010 A 42 PRO C C 13 176.765 0.100 A 42 PRO CA C 13 63.650 0.100 A 42 PRO CB C 13 30.513 0.100 A 42 PRO CD C 13 50.520 0.100 A 42 PRO CG C 13 27.384 0.100 A 43 ASP H H 1 8.305 0.001 A 43 ASP HA H 1 4.548 0.001 A 43 ASP HB2 H 1 2.904 0.010 A 43 ASP HB3 H 1 2.752 0.014 A 43 ASP C C 13 175.135 0.100 A 43 ASP CA C 13 53.570 0.100 A 43 ASP CB C 13 38.450 0.100 A 43 ASP N N 15 118.052 0.055 A 44 ALA H H 1 8.013 0.002 A 44 ALA HA H 1 4.106 0.004 A 44 ALA HB% H 1 1.206 0.002 A 44 ALA C C 13 177.969 0.100 A 44 ALA CA C 13 52.867 0.100 A 44 ALA CB C 13 19.023 0.100 A 44 ALA N N 15 123.344 0.004 A 45 ILE H H 1 7.860 0.002 A 45 ILE HA H 1 3.855 0.010 A 45 ILE HB H 1 1.593 0.010 A 45 ILE HD1% H 1 0.464 0.010 A 45 ILE HG1x H 1 0.955 0.010 A 45 ILE HG1y H 1 0.955 0.010 A 45 ILE HG2% H 1 0.688 0.010 A 45 ILE C C 13 176.287 0.100 A 45 ILE CA C 13 61.465 0.100 A 45 ILE CB C 13 38.294 0.100 A 45 ILE CD1 C 13 12.870 0.100 A 45 ILE CG1 C 13 27.244 0.100 A 45 ILE CG2 C 13 17.061 0.100 A 45 ILE N N 15 118.636 0.058 A 46 TRP H H 1 7.646 0.007 A 46 TRP HA H 1 4.504 0.010 A 46 TRP HBx H 1 3.130 0.010 A 46 TRP HBy H 1 3.130 0.010 A 46 TRP HD1 H 1 7.075 0.010 A 46 TRP HE1 H 1 10.076 0.002 A 46 TRP HE3 H 1 7.384 0.010 A 46 TRP HH2 H 1 7.046 0.010 A 46 TRP HZ2 H 1 7.367 0.010 A 46 TRP HZ3 H 1 7.075 0.010 A 46 TRP C C 13 176.136 0.100 A 46 TRP CA C 13 57.139 0.100 A 46 TRP CB C 13 28.880 0.100 A 46 TRP CZ2 C 13 114.596 0.100 A 46 TRP N N 15 122.947 0.025 A 46 TRP NE1 N 15 129.459 0.013 A 47 TRP H H 1 7.502 0.002 A 47 TRP HA H 1 4.482 0.014 A 47 TRP HB2 H 1 2.987 0.002 A 47 TRP HB3 H 1 3.128 0.010 A 47 TRP HD1 H 1 6.946 0.010 A 47 TRP HE1 H 1 9.987 0.002 A 47 TRP HE3 H 1 7.143 0.010 A 47 TRP HH2 H 1 7.320 0.010 A 47 TRP HZ2 H 1 7.347 0.010 A 47 TRP HZ3 H 1 6.826 0.010 A 47 TRP C C 13 176.149 0.100 A 47 TRP CA C 13 57.197 0.100 A 47 TRP CB C 13 29.703 0.100 A 47 TRP N N 15 120.943 0.023 A 47 TRP NE1 N 15 129.409 0.021 A 48 SER H H 1 7.861 0.001 A 48 SER HA H 1 4.258 0.010 A 48 SER HBx H 1 3.694 0.020 A 48 SER HBy H 1 3.694 0.020 A 48 SER C C 13 174.600 0.100 A 48 SER CA C 13 57.844 0.100 A 48 SER CB C 13 64.102 0.100 A 48 SER N N 15 116.339 0.029 A 49 VAL H H 1 7.921 0.002 A 49 VAL HA H 1 3.990 0.010 A 49 VAL HB H 1 2.015 0.010 A 49 VAL HGx% H 1 0.849 0.004 A 49 VAL HGy% H 1 0.837 0.001 A 49 VAL C C 13 176.402 0.100 A 49 VAL CA C 13 62.909 0.100 A 49 VAL CB C 13 32.467 0.100 A 49 VAL CG1 C 13 20.946 0.100 A 49 VAL CG2 C 13 20.946 0.100 A 49 VAL N N 15 121.079 0.028 A 50 GLU H H 1 8.229 0.002 A 50 GLU HA H 1 4.307 0.010 A 50 GLU HBx H 1 1.824 0.010 A 50 GLU HBy H 1 1.824 0.010 A 50 GLU HGx H 1 2.298 0.004 A 50 GLU HGy H 1 2.298 0.004 A 50 GLU C C 13 176.506 0.100 A 50 GLU CA C 13 57.040 0.100 A 50 GLU CB C 13 30.123 0.100 A 50 GLU CG C 13 33.000 0.100 A 50 GLU N N 15 122.433 0.013 A 51 THR H H 1 7.993 0.002 A 51 THR HA H 1 4.248 0.010 A 51 THR HB H 1 4.180 0.010 A 51 THR HG2% H 1 1.072 0.010 A 51 THR C C 13 174.430 0.100 A 51 THR CA C 13 62.227 0.100 A 51 THR CB C 13 69.712 0.100 A 51 THR CG2 C 13 21.500 0.100 A 51 THR N N 15 114.413 0.021 A 52 ALA H H 1 8.160 0.009 A 52 ALA HA H 1 4.212 0.010 A 52 ALA HB% H 1 1.334 0.005 A 52 ALA C C 13 177.976 0.100 A 52 ALA CA C 13 53.069 0.100 A 52 ALA CB C 13 19.178 0.100 A 52 ALA N N 15 125.641 0.040 A 53 THR H H 1 8.022 0.002 A 53 THR HA H 1 4.231 0.010 A 53 THR HB H 1 4.154 0.010 A 53 THR HG2% H 1 1.122 0.010 A 53 THR C C 13 174.750 0.100 A 53 THR CA C 13 62.231 0.100 A 53 THR CB C 13 69.726 0.100 A 53 THR CG2 C 13 21.500 0.100 A 53 THR N N 15 112.100 0.014 A 54 THR H H 1 7.999 0.001 A 54 THR HA H 1 4.303 0.010 A 54 THR HB H 1 4.176 0.002 A 54 THR HG2% H 1 1.113 0.010 A 54 THR C C 13 174.592 0.100 A 54 THR CA C 13 62.002 0.100 A 54 THR CB C 13 69.793 0.100 A 54 THR CG2 C 13 21.500 0.100 A 54 THR N N 15 116.238 0.030 A 55 VAL H H 1 8.098 0.001 A 55 VAL HA H 1 4.017 0.008 A 55 VAL HB H 1 1.963 0.001 A 55 VAL HGx% H 1 0.839 0.001 A 55 VAL HGy% H 1 0.839 0.001 A 55 VAL C C 13 176.453 0.100 A 55 VAL CA C 13 62.650 0.100 A 55 VAL CB C 13 32.524 0.100 A 55 VAL CG1 C 13 20.950 0.100 A 55 VAL CG2 C 13 20.950 0.100 A 55 VAL N N 15 122.445 0.046 A 56 GLY H H 1 8.308 0.002 A 56 GLY HA2 H 1 3.839 0.010 A 56 GLY HA3 H 1 4.019 0.010 A 56 GLY C C 13 173.958 0.100 A 56 GLY CA C 13 45.216 0.100 A 56 GLY N N 15 112.118 0.059 A 57 TYR H H 1 8.051 0.009 A 57 TYR HA H 1 4.402 0.009 A 57 TYR HB2 H 1 2.878 0.004 A 57 TYR HB3 H 1 3.047 0.010 A 57 TYR HDx H 1 7.008 0.008 A 57 TYR HDy H 1 7.008 0.008 A 57 TYR HEx H 1 6.724 0.010 A 57 TYR HEy H 1 6.724 0.010 A 57 TYR C C 13 176.557 0.100 A 57 TYR CA C 13 58.251 0.100 A 57 TYR CB C 13 38.935 0.100 A 57 TYR N N 15 120.259 0.077 A 58 GLY H H 1 8.335 0.002 A 58 GLY HAx H 1 3.801 0.010 A 58 GLY HAy H 1 3.801 0.010 A 58 GLY C C 13 173.911 0.100 A 58 GLY CA C 13 45.311 0.100 A 58 GLY N N 15 110.220 0.053 A 59 ASP H H 1 8.161 0.010 A 59 ASP HA H 1 4.581 0.010 A 59 ASP HBx H 1 2.736 0.003 A 59 ASP HBy H 1 2.736 0.003 A 59 ASP C C 13 175.189 0.100 A 59 ASP CA C 13 53.570 0.100 A 59 ASP CB C 13 38.750 0.100 A 59 ASP N N 15 118.765 0.018 A 60 ARG H H 1 8.086 0.001 A 60 ARG HA H 1 4.152 0.010 A 60 ARG HBx H 1 1.940 0.010 A 60 ARG HBy H 1 1.940 0.010 A 60 ARG HDx H 1 3.216 0.010 A 60 ARG HDy H 1 3.216 0.010 A 60 ARG HE H 1 6.993 0.010 A 60 ARG HGx H 1 1.558 0.010 A 60 ARG HGy H 1 1.558 0.010 A 60 ARG HH1x H 1 6.373 0.010 A 60 ARG HH1y H 1 6.373 0.010 A 60 ARG HH2x H 1 6.652 0.010 A 60 ARG HH2y H 1 6.652 0.010 A 60 ARG C C 13 176.603 0.100 A 60 ARG CA C 13 56.825 0.100 A 60 ARG CB C 13 30.935 0.100 A 60 ARG CD C 13 43.200 0.100 A 60 ARG CG C 13 27.165 0.100 A 60 ARG N N 15 120.762 0.016 A 60 ARG NE N 15 108.550 0.100 A 61 TYR H H 1 8.117 0.010 A 61 TYR HA H 1 4.488 0.010 A 61 TYR HBx H 1 3.052 0.010 A 61 TYR HBy H 1 3.052 0.010 A 61 TYR HDx H 1 7.000 0.010 A 61 TYR HDy H 1 7.000 0.010 A 61 TYR HEx H 1 7.000 0.010 A 61 TYR HEy H 1 7.000 0.010 A 61 TYR CA C 13 56.688 0.100 A 61 TYR CB C 13 39.582 0.100 A 61 TYR N N 15 121.714 0.100 A 62 PRO HA H 1 4.383 0.010 A 62 PRO HBx H 1 2.280 0.010 A 62 PRO HBy H 1 2.280 0.010 A 62 PRO HDx H 1 3.758 0.010 A 62 PRO HDy H 1 3.758 0.010 A 62 PRO HGx H 1 2.158 0.010 A 62 PRO HGy H 1 2.158 0.010 A 62 PRO C C 13 177.441 0.100 A 62 PRO CA C 13 63.212 0.100 A 62 PRO CB C 13 31.939 0.100 A 62 PRO CD C 13 50.471 0.100 A 62 PRO CG C 13 27.600 0.100 A 63 VAL H H 1 8.217 0.001 A 63 VAL HA H 1 4.164 0.010 A 63 VAL HB H 1 2.047 0.020 A 63 VAL HGx% H 1 0.887 0.010 A 63 VAL HGy% H 1 0.763 0.010 A 63 VAL C C 13 176.576 0.100 A 63 VAL CA C 13 62.382 0.100 A 63 VAL CB C 13 32.862 0.100 A 63 VAL CG1 C 13 21.030 0.100 A 63 VAL CG2 C 13 21.030 0.100 A 63 VAL N N 15 120.316 0.021 A 64 THR H H 1 8.084 0.001 A 64 THR HA H 1 4.313 0.010 A 64 THR HB H 1 4.110 0.010 A 64 THR HG2% H 1 1.136 0.002 A 64 THR C C 13 174.558 0.100 A 64 THR CA C 13 62.606 0.100 A 64 THR CB C 13 70.496 0.100 A 64 THR CG2 C 13 21.500 0.100 A 64 THR N N 15 116.779 0.018 A 65 GLU H H 1 8.404 0.011 A 65 GLU HA H 1 4.314 0.010 A 65 GLU HB2 H 1 2.029 0.010 A 65 GLU HB3 H 1 1.890 0.010 A 65 GLU HGx H 1 2.369 0.010 A 65 GLU HGy H 1 2.369 0.010 A 65 GLU C C 13 175.016 0.100 A 65 GLU CA C 13 57.750 0.100 A 65 GLU CB C 13 30.083 0.100 A 65 GLU CG C 13 33.000 0.100 A 65 GLU N N 15 122.323 0.063 A 66 GLU H H 1 8.397 0.010 A 66 GLU HA H 1 4.224 0.010 A 66 GLU HBx H 1 2.013 0.010 A 66 GLU HBy H 1 2.013 0.010 A 66 GLU HGx H 1 2.392 0.010 A 66 GLU HGy H 1 2.392 0.010 A 66 GLU C C 13 176.855 0.100 A 66 GLU CA C 13 58.023 0.100 A 66 GLU CB C 13 29.857 0.100 A 66 GLU CG C 13 33.000 0.100 A 66 GLU N N 15 122.201 0.100 A 67 GLY H H 1 8.376 0.003 A 67 GLY HAx H 1 3.834 0.010 A 67 GLY HAy H 1 3.834 0.010 A 67 GLY C C 13 173.071 0.100 A 67 GLY CA C 13 45.871 0.100 A 67 GLY N N 15 109.499 0.056 A 68 ARG H H 1 8.011 0.006 A 68 ARG HA H 1 4.482 0.010 A 68 ARG HBx H 1 1.733 0.010 A 68 ARG HBy H 1 1.733 0.010 A 68 ARG HDx H 1 3.132 0.010 A 68 ARG HDy H 1 3.132 0.010 A 68 ARG HE H 1 7.160 0.010 A 68 ARG HGx H 1 1.576 0.010 A 68 ARG HGy H 1 1.576 0.010 A 68 ARG HH1x H 1 6.424 0.010 A 68 ARG HH1y H 1 6.424 0.010 A 68 ARG HH2x H 1 6.743 0.010 A 68 ARG HH2y H 1 6.743 0.010 A 68 ARG C C 13 177.494 0.100 A 68 ARG CA C 13 57.574 0.100 A 68 ARG CB C 13 30.325 0.100 A 68 ARG CD C 13 43.200 0.100 A 68 ARG CG C 13 27.165 0.100 A 68 ARG N N 15 122.501 0.022 A 68 ARG NE N 15 108.423 0.100 A 69 LYS H H 1 7.986 0.003 A 69 LYS HA H 1 4.150 0.010 A 69 LYS HBx H 1 1.874 0.010 A 69 LYS HBy H 1 1.874 0.010 A 69 LYS HDx H 1 1.593 0.010 A 69 LYS HDy H 1 1.593 0.010 A 69 LYS HEx H 1 3.028 0.010 A 69 LYS HEy H 1 3.028 0.010 A 69 LYS HGx H 1 1.429 0.010 A 69 LYS HGy H 1 1.429 0.010 A 69 LYS C C 13 178.168 0.100 A 69 LYS CA C 13 57.781 0.100 A 69 LYS CB C 13 32.705 0.100 A 69 LYS CD C 13 30.600 0.100 A 69 LYS CE C 13 42.000 0.100 A 69 LYS CG C 13 24.850 0.100 A 69 LYS N N 15 120.934 0.100 A 70 VAL H H 1 7.848 0.002 A 70 VAL HA H 1 4.088 0.010 A 70 VAL HB H 1 2.125 0.010 A 70 VAL HGx% H 1 0.818 0.010 A 70 VAL HGy% H 1 0.926 0.010 A 70 VAL C C 13 175.998 0.100 A 70 VAL CA C 13 64.206 0.100 A 70 VAL CB C 13 31.873 0.100 A 70 VAL CG1 C 13 20.980 0.100 A 70 VAL CG2 C 13 20.980 0.100 A 70 VAL N N 15 120.324 0.100 A 71 ALA H H 1 8.300 0.002 A 71 ALA HA H 1 4.221 0.010 A 71 ALA HB% H 1 1.305 0.010 A 71 ALA C C 13 178.225 0.100 A 71 ALA CA C 13 53.106 0.100 A 71 ALA CB C 13 19.128 0.100 A 71 ALA N N 15 127.025 0.028 A 72 GLU H H 1 8.181 0.006 A 72 GLU HA H 1 4.219 0.010 A 72 GLU HBx H 1 2.113 0.010 A 72 GLU HBy H 1 2.113 0.010 A 72 GLU HGx H 1 2.329 0.010 A 72 GLU HGy H 1 2.329 0.010 A 72 GLU C C 13 176.779 0.100 A 72 GLU CA C 13 56.776 0.100 A 72 GLU CB C 13 28.610 0.100 A 72 GLU CG C 13 33.000 0.100 A 72 GLU N N 15 123.008 0.034 A 73 GLN H H 1 8.132 0.001 A 73 GLN HA H 1 4.141 0.010 A 73 GLN HBx H 1 2.064 0.010 A 73 GLN HBy H 1 2.064 0.010 A 73 GLN HE21 H 1 7.461 0.010 A 73 GLN HE22 H 1 6.815 0.010 A 73 GLN HGx H 1 2.376 0.010 A 73 GLN HGy H 1 2.376 0.010 A 73 GLN C C 13 175.803 0.200 A 73 GLN CA C 13 56.456 0.100 A 73 GLN CB C 13 28.290 0.100 A 73 GLN CG C 13 33.040 0.100 A 73 GLN N N 15 120.564 0.100 A 73 GLN NE2 N 15 112.169 0.012 A 74 VAL H H 1 8.088 0.004 A 74 VAL HA H 1 3.986 0.010 A 74 VAL HB H 1 1.885 0.010 A 74 VAL HGx% H 1 0.803 0.010 A 74 VAL HGy% H 1 0.941 0.010 A 74 VAL C C 13 176.167 0.100 A 74 VAL CA C 13 63.123 0.100 A 74 VAL CB C 13 30.082 0.100 A 74 VAL CG1 C 13 21.264 0.100 A 74 VAL CG2 C 13 21.264 0.100 A 74 VAL N N 15 121.828 0.035 A 75 MET H H 1 8.167 0.010 A 75 MET HA H 1 4.093 0.010 A 75 MET HBx H 1 2.018 0.010 A 75 MET HBy H 1 2.018 0.010 A 75 MET HE% H 1 2.078 0.010 A 75 MET C C 13 176.455 0.100 A 75 MET N N 15 123.990 0.100 A 76 LYS H H 1 8.287 0.003 A 76 LYS HA H 1 4.234 0.010 A 76 LYS HBx H 1 1.913 0.010 A 76 LYS HBy H 1 1.913 0.010 A 76 LYS HDx H 1 1.704 0.010 A 76 LYS HDy H 1 1.704 0.010 A 76 LYS HEx H 1 3.001 0.010 A 76 LYS HEy H 1 3.001 0.010 A 76 LYS HGx H 1 1.440 0.010 A 76 LYS HGy H 1 1.440 0.010 A 76 LYS C C 13 176.220 0.100 A 76 LYS CA C 13 56.765 0.100 A 76 LYS CB C 13 33.055 0.100 A 76 LYS CD C 13 30.600 0.100 A 76 LYS CE C 13 42.000 0.100 A 76 LYS CG C 13 24.850 0.100 A 76 LYS N N 15 122.725 0.067 A 77 ALA H H 1 8.308 0.002 A 77 ALA HA H 1 4.213 0.004 A 77 ALA HB% H 1 1.348 0.015 A 77 ALA C C 13 178.097 0.100 A 77 ALA CA C 13 52.740 0.100 A 77 ALA CB C 13 19.427 0.100 A 77 ALA N N 15 125.316 0.032 A 78 GLY H H 1 8.284 0.013 A 78 GLY HAx H 1 3.873 0.001 A 78 GLY HAy H 1 3.873 0.001 A 78 GLY C C 13 174.065 0.100 A 78 GLY CA C 13 45.497 0.100 A 78 GLY N N 15 107.778 0.014 A 79 ILE H H 1 7.882 0.001 A 79 ILE HA H 1 4.119 0.006 A 79 ILE HB H 1 1.834 0.010 A 79 ILE HD1% H 1 0.877 0.010 A 79 ILE HG1x H 1 1.369 0.010 A 79 ILE HG1y H 1 1.369 0.010 A 79 ILE HG2% H 1 1.110 0.010 A 79 ILE C C 13 176.160 0.100 A 79 ILE CA C 13 61.436 0.100 A 79 ILE CB C 13 38.904 0.100 A 79 ILE CD1 C 13 12.982 0.100 A 79 ILE CG1 C 13 27.280 0.100 A 79 ILE CG2 C 13 17.516 0.100 A 79 ILE N N 15 119.794 0.022 A 80 GLU H H 1 8.354 0.002 A 80 GLU HA H 1 4.282 0.013 A 80 GLU HBx H 1 1.871 0.010 A 80 GLU HBy H 1 1.871 0.010 A 80 GLU HGx H 1 2.294 0.010 A 80 GLU HGy H 1 2.294 0.010 A 80 GLU C C 13 176.174 0.100 A 80 GLU CA C 13 57.178 0.100 A 80 GLU CB C 13 30.019 0.100 A 80 GLU CG C 13 33.000 0.100 A 80 GLU N N 15 124.311 0.023 A 81 VAL H H 1 8.205 0.003 A 81 VAL HA H 1 3.985 0.010 A 81 VAL HB H 1 1.978 0.010 A 81 VAL HGx% H 1 0.854 0.010 A 81 VAL HGy% H 1 1.042 0.010 A 81 VAL C C 13 175.815 0.100 A 81 VAL CA C 13 62.865 0.100 A 81 VAL CB C 13 32.629 0.100 A 81 VAL CG1 C 13 20.946 0.100 A 81 VAL CG2 C 13 20.946 0.100 A 81 VAL N N 15 121.106 0.200 A 82 PHE H H 1 8.252 0.002 A 82 PHE HA H 1 4.551 0.010 A 82 PHE HB2 H 1 3.043 0.010 A 82 PHE HB3 H 1 2.900 0.010 A 82 PHE HDx H 1 7.155 0.010 A 82 PHE HDy H 1 7.155 0.010 A 82 PHE HEx H 1 7.544 0.010 A 82 PHE HEy H 1 7.544 0.010 A 82 PHE HZ H 1 7.155 0.010 A 82 PHE C C 13 175.631 0.100 A 82 PHE CA C 13 58.206 0.100 A 82 PHE CB C 13 39.431 0.100 A 82 PHE N N 15 123.622 0.024 A 83 ALA H H 1 8.184 0.001 A 83 ALA HA H 1 4.230 0.010 A 83 ALA HB% H 1 1.300 0.010 A 83 ALA C C 13 178.025 0.100 A 83 ALA CA C 13 52.731 0.100 A 83 ALA CB C 13 19.359 0.100 A 83 ALA N N 15 125.081 0.012 A 84 LEU H H 1 8.104 0.010 A 84 LEU HA H 1 4.167 0.010 A 84 LEU HBx H 1 1.605 0.010 A 84 LEU HBy H 1 1.605 0.010 A 84 LEU HDx% H 1 0.859 0.010 A 84 LEU HDy% H 1 0.838 0.010 A 84 LEU HG H 1 1.600 0.010 A 84 LEU C C 13 176.390 0.100 A 84 LEU CA C 13 55.786 0.100 A 84 LEU CB C 13 42.179 0.100 A 84 LEU CD1 C 13 24.265 0.100 A 84 LEU CD2 C 13 24.265 0.100 A 84 LEU CG C 13 26.878 0.100 A 84 LEU N N 15 119.064 0.100 A 85 VAL H H 1 8.155 0.006 A 85 VAL HA H 1 4.073 0.010 A 85 VAL HB H 1 2.023 0.004 A 85 VAL HGx% H 1 0.855 0.003 A 85 VAL HGy% H 1 0.855 0.003 A 85 VAL C C 13 176.521 0.100 A 85 VAL CA C 13 62.762 0.100 A 85 VAL CB C 13 32.498 0.100 A 85 VAL CG1 C 13 21.248 0.100 A 85 VAL CG2 C 13 21.248 0.100 A 85 VAL N N 15 121.743 0.047 A 86 THR H H 1 8.052 0.002 A 86 THR HA H 1 4.141 0.010 A 86 THR HB H 1 4.050 0.010 A 86 THR HG2% H 1 1.118 0.010 A 86 THR C C 13 174.706 0.100 A 86 THR CA C 13 62.351 0.100 A 86 THR CB C 13 69.618 0.100 A 86 THR CG2 C 13 21.500 0.100 A 86 THR N N 15 117.693 0.072 A 87 ALA H H 1 8.216 0.002 A 87 ALA HA H 1 4.170 0.010 A 87 ALA HB% H 1 1.329 0.001 A 87 ALA C C 13 178.003 0.100 A 87 ALA CA C 13 52.967 0.100 A 87 ALA CB C 13 18.326 0.100 A 87 ALA N N 15 126.174 0.005 A 88 ALA H H 1 8.129 0.001 A 88 ALA HA H 1 4.147 0.010 A 88 ALA HB% H 1 1.325 0.010 A 88 ALA C C 13 178.246 0.100 A 88 ALA CA C 13 52.961 0.100 A 88 ALA CB C 13 19.290 0.100 A 88 ALA N N 15 122.649 0.024 A 89 LEU H H 1 7.992 0.002 A 89 LEU HA H 1 4.153 0.010 A 89 LEU HBx H 1 1.599 0.002 A 89 LEU HBy H 1 1.599 0.002 A 89 LEU HDx% H 1 0.835 0.010 A 89 LEU HDy% H 1 0.776 0.010 A 89 LEU HG H 1 1.506 0.010 A 89 LEU C C 13 176.375 0.100 A 89 LEU CA C 13 57.099 0.100 A 89 LEU CB C 13 42.055 0.100 A 89 LEU CD1 C 13 24.440 0.100 A 89 LEU CD2 C 13 24.440 0.100 A 89 LEU CG C 13 26.870 0.100 A 89 LEU N N 15 120.616 0.049 A 90 ALA H H 1 8.168 0.009 A 90 ALA HA H 1 4.218 0.010 A 90 ALA HB% H 1 1.360 0.006 A 90 ALA C C 13 178.487 0.100 A 90 ALA CA C 13 53.043 0.100 A 90 ALA CB C 13 19.269 0.100 A 90 ALA N N 15 124.243 0.081 A 91 THR H H 1 7.988 0.002 A 91 THR HA H 1 4.181 0.010 A 91 THR HB H 1 4.137 0.010 A 91 THR HG2% H 1 1.128 0.010 A 91 THR C C 13 174.931 0.100 A 91 THR CA C 13 62.190 0.100 A 91 THR CB C 13 69.198 0.100 A 91 THR CG2 C 13 21.500 0.100 A 91 THR N N 15 112.659 0.075 A 92 ASP H H 1 8.254 0.009 A 92 ASP HA H 1 4.541 0.010 A 92 ASP HBx H 1 2.765 0.006 A 92 ASP HBy H 1 2.765 0.006 A 92 ASP C C 13 175.823 0.100 A 92 ASP CA C 13 53.570 0.100 A 92 ASP CB C 13 38.750 0.100 A 92 ASP N N 15 120.688 0.032 A 93 PHE H H 1 8.048 0.001 A 93 PHE HA H 1 4.547 0.010 A 93 PHE HBx H 1 3.060 0.002 A 93 PHE HBy H 1 3.060 0.002 A 93 PHE HDx H 1 7.131 0.010 A 93 PHE HDy H 1 7.131 0.010 A 93 PHE HEx H 1 7.010 0.010 A 93 PHE HEy H 1 7.010 0.010 A 93 PHE HZ H 1 7.367 0.010 A 93 PHE C C 13 176.384 0.100 A 93 PHE CA C 13 58.633 0.100 A 93 PHE CB C 13 39.451 0.100 A 93 PHE N N 15 120.763 0.020 A 94 VAL H H 1 7.904 0.001 A 94 VAL HA H 1 4.364 0.010 A 94 VAL HB H 1 2.006 0.010 A 94 VAL HGx% H 1 0.902 0.010 A 94 VAL HGy% H 1 0.902 0.010 A 94 VAL C C 13 176.851 0.100 A 94 VAL CA C 13 63.297 0.100 A 94 VAL CB C 13 29.241 0.100 A 94 VAL CG1 C 13 21.714 0.100 A 94 VAL CG2 C 13 21.444 0.100 A 94 VAL N N 15 121.478 0.001 A 95 ARG H H 1 8.146 0.010 A 95 ARG HA H 1 4.134 0.010 A 95 ARG HBx H 1 1.799 0.007 A 95 ARG HBy H 1 1.799 0.007 A 95 ARG HDx H 1 3.176 0.010 A 95 ARG HDy H 1 3.176 0.010 A 95 ARG HE H 1 7.134 0.010 A 95 ARG HGx H 1 1.606 0.010 A 95 ARG HGy H 1 1.606 0.010 A 95 ARG HH1x H 1 6.420 0.010 A 95 ARG HH1y H 1 6.420 0.010 A 95 ARG HH2x H 1 6.726 0.010 A 95 ARG HH2y H 1 6.726 0.010 A 95 ARG C C 13 177.395 0.100 A 95 ARG CA C 13 55.978 0.100 A 95 ARG CB C 13 31.070 0.100 A 95 ARG CD C 13 43.200 0.100 A 95 ARG CG C 13 27.165 0.100 A 95 ARG N N 15 122.920 0.100 A 95 ARG NE N 15 108.600 0.100 A 96 ARG H H 1 8.313 0.002 A 96 ARG HA H 1 4.180 0.010 A 96 ARG HBx H 1 1.791 0.010 A 96 ARG HBy H 1 1.791 0.010 A 96 ARG HDx H 1 3.136 0.010 A 96 ARG HDy H 1 3.136 0.010 A 96 ARG HE H 1 7.141 0.010 A 96 ARG HGx H 1 1.604 0.010 A 96 ARG HGy H 1 1.604 0.010 A 96 ARG HH1x H 1 6.420 0.010 A 96 ARG HH1y H 1 6.420 0.010 A 96 ARG HH2x H 1 6.726 0.010 A 96 ARG HH2y H 1 6.726 0.010 A 96 ARG C C 13 176.839 0.100 A 96 ARG CA C 13 56.831 0.100 A 96 ARG CB C 13 30.952 0.100 A 96 ARG CD C 13 43.200 0.100 A 96 ARG CG C 13 27.165 0.100 A 96 ARG N N 15 121.064 0.038 A 96 ARG NE N 15 108.617 0.100 A 97 GLU H H 1 8.356 0.001 A 97 GLU HA H 1 4.220 0.010 A 97 GLU HBx H 1 2.013 0.010 A 97 GLU HBy H 1 2.013 0.010 A 97 GLU HGx H 1 2.373 0.010 A 97 GLU HGy H 1 2.373 0.010 A 97 GLU C C 13 176.319 0.100 A 97 GLU CA C 13 57.408 0.100 A 97 GLU CB C 13 28.610 0.100 A 97 GLU CG C 13 33.000 0.100 A 97 GLU N N 15 121.754 0.036 A 98 GLU H H 1 8.328 0.002 A 98 GLU HA H 1 4.240 0.010 A 98 GLU HBx H 1 1.999 0.010 A 98 GLU HBy H 1 1.999 0.010 A 98 GLU HGx H 1 2.268 0.010 A 98 GLU HGy H 1 2.268 0.010 A 98 GLU C C 13 176.132 0.100 A 98 GLU CA C 13 57.666 0.100 A 98 GLU CB C 13 30.045 0.100 A 98 GLU CG C 13 33.000 0.100 A 98 GLU N N 15 121.414 0.037 A 99 GLU H H 1 8.418 0.002 A 99 GLU HA H 1 4.299 0.010 A 99 GLU HBx H 1 2.016 0.009 A 99 GLU HBy H 1 2.016 0.009 A 99 GLU HGx H 1 2.399 0.006 A 99 GLU HGy H 1 2.399 0.006 A 99 GLU C C 13 177.021 0.100 A 99 GLU CA C 13 57.397 0.100 A 99 GLU CB C 13 30.309 0.100 A 99 GLU CG C 13 33.000 0.100 A 99 GLU N N 15 121.312 0.041 A 100 ARG H H 1 8.013 0.002 A 100 ARG HA H 1 4.180 0.010 A 100 ARG HBx H 1 1.749 0.010 A 100 ARG HBy H 1 1.749 0.010 A 100 ARG HDx H 1 3.192 0.010 A 100 ARG HDy H 1 3.192 0.010 A 100 ARG HE H 1 7.094 0.010 A 100 ARG HGx H 1 1.663 0.010 A 100 ARG HGy H 1 1.663 0.010 A 100 ARG HH1x H 1 6.671 0.010 A 100 ARG HH1y H 1 6.671 0.010 A 100 ARG HH2x H 1 6.671 0.010 A 100 ARG HH2y H 1 6.671 0.010 A 100 ARG C C 13 176.313 0.100 A 100 ARG CA C 13 57.238 0.100 A 100 ARG CB C 13 30.298 0.100 A 100 ARG CD C 13 43.200 0.100 A 100 ARG CG C 13 27.165 0.100 A 100 ARG N N 15 121.871 0.100 A 100 ARG NE N 15 108.571 0.100 A 101 ARG H H 1 8.260 0.003 A 101 ARG HA H 1 4.260 0.010 A 101 ARG HBx H 1 1.768 0.010 A 101 ARG HBy H 1 1.768 0.010 A 101 ARG HDx H 1 3.222 0.010 A 101 ARG HDy H 1 3.222 0.010 A 101 ARG HE H 1 7.094 0.010 A 101 ARG HGx H 1 1.578 0.010 A 101 ARG HGy H 1 1.578 0.010 A 101 ARG HH1x H 1 6.671 0.010 A 101 ARG HH1y H 1 6.671 0.010 A 101 ARG HH2x H 1 6.671 0.010 A 101 ARG HH2y H 1 6.671 0.010 A 101 ARG C C 13 176.753 0.100 A 101 ARG CA C 13 56.492 0.100 A 101 ARG CB C 13 30.838 0.100 A 101 ARG CD C 13 43.200 0.100 A 101 ARG CG C 13 27.165 0.100 A 101 ARG N N 15 122.019 0.100 A 101 ARG NE N 15 108.571 0.100 A 102 GLY H H 1 8.380 0.002 A 102 GLY HAx H 1 3.849 0.010 A 102 GLY HAy H 1 3.849 0.010 A 102 GLY C C 13 173.145 0.100 A 102 GLY CA C 13 45.401 0.100 A 102 GLY N N 15 110.110 0.023 A 103 HIS H H 1 7.992 0.007 A 103 HIS HA H 1 4.442 0.010 A 103 HIS HB2 H 1 3.202 0.010 A 103 HIS HB3 H 1 3.043 0.010 A 103 HIS HD2 H 1 6.884 0.010 A 103 HIS HE1 H 1 8.577 0.010 A 103 HIS CA C 13 57.164 0.100 A 103 HIS CB C 13 29.612 0.100 A 103 HIS CD2 C 13 119.982 0.100 A 103 HIS CE1 C 13 136.494 0.100 A 103 HIS N N 15 122.017 0.110 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 1 SER H1 A 2 ALA H 1.0 1.8 5.5 2 2 A 1 SER HA A 1 SER HBx 1.0 1.8 3.5 3 2 A 1 SER HA A 1 SER HBy 1.0 1.8 3.5 4 3 A 2 ALA H A 1 SER HA 1.0 1.8 3.5 5 4 A 2 ALA H A 1 SER HBx 1.0 1.8 5.5 6 4 A 2 ALA H A 1 SER HBy 1.0 1.8 5.5 7 5 A 2 ALA H A 2 ALA HA 1.0 1.8 5.5 8 6 A 2 ALA H A 2 ALA HB% 1.0 1.8 4.5 9 7 A 2 ALA H A 5 GLU H 1.0 1.8 6.5 10 8 A 2 ALA H A 2 ALA HA 1.0 1.8 4.5 11 9 A 2 ALA HA A 2 ALA HB% 1.0 1.8 3.5 12 10 A 2 ALA H A 2 ALA HB% 1.0 1.8 3.5 13 11 A 2 ALA HA A 2 ALA HB% 1.0 1.8 3.5 14 12 A 2 ALA HB% A 3 ASP H 1.0 1.8 3.5 15 13 A 2 ALA HB% A 3 ASP H 1.0 1.8 4.5 16 14 A 3 ASP H A 3 ASP HA 1.0 1.8 4.5 17 15 A 3 ASP H A 3 ASP HA 1.0 1.8 4.5 18 16 A 3 ASP HA A 3 ASP HBx 1.0 1.8 3.5 19 16 A 3 ASP HA A 3 ASP HBy 1.0 1.8 3.5 20 17 A 3 ASP HA A 4 HIS H 1.0 1.8 5.5 21 18 A 3 ASP HA A 7 GLU H 1.0 1.8 5.5 22 19 A 2 ALA HB% A 3 ASP HBx 1.0 1.8 5.5 23 19 A 2 ALA HB% A 3 ASP HBy 1.0 1.8 5.5 24 20 A 4 HIS H A 3 ASP HBx 1.0 1.8 4.5 25 20 A 3 ASP HBy A 4 HIS H 1.0 1.8 4.5 26 21 A 2 ALA HB% A 4 HIS H 1.0 1.8 4.5 27 22 A 4 HIS H A 4 HIS HA 1.0 1.8 4.5 28 23 A 5 GLU H A 4 HIS H 1.0 1.8 3.5 29 24 A 4 HIS HA A 3 ASP HBx 1.0 1.8 5.5 30 24 A 3 ASP HBy A 4 HIS HA 1.0 1.8 5.5 31 25 A 4 HIS H A 4 HIS HA 1.0 1.8 4.5 32 26 A 5 GLU H A 4 HIS HA 1.0 1.8 5.5 33 27 A 4 HIS HA A 6 ARG H 1.0 1.8 5.5 34 28 A 4 HIS H A 4 HIS HB2 1.0 1.8 5.5 35 29 A 4 HIS HB2 A 4 HIS HB3 1.0 1.8 3.5 36 30 A 5 GLU H A 4 HIS HB2 1.0 1.8 4.5 37 31 A 4 HIS H A 4 HIS HB3 1.0 1.8 3.5 38 32 A 5 GLU H A 4 HIS HB3 1.0 1.8 5.5 39 33 A 2 ALA HB% A 4 HIS HD2 1.0 1.8 5.5 40 34 A 4 HIS H A 4 HIS HD2 1.0 1.8 5.5 41 35 A 2 ALA HB% A 4 HIS HE1 1.0 1.8 4.5 42 36 A 5 GLU H A 4 HIS HE1 1.0 1.8 5.5 43 37 A 2 ALA HB% A 5 GLU H 1.0 1.8 4.5 44 38 A 5 GLU H A 4 HIS H 1.0 1.8 3.5 45 39 A 5 GLU H A 5 GLU HA 1.0 1.8 4.5 46 40 A 5 GLU H A 5 GLU HA 1.0 1.8 4.5 47 41 A 6 ARG H A 5 GLU HA 1.0 1.8 5.5 48 42 A 5 GLU HA A 9 GLN H 1.0 1.8 5.5 49 43 A 2 ALA HB% A 5 GLU HBx 1.0 1.8 3.5 50 43 A 2 ALA HB% A 5 GLU HBy 1.0 1.8 3.5 51 44 A 5 GLU H A 5 GLU HBx 1.0 1.8 3.5 52 44 A 5 GLU H A 5 GLU HBy 1.0 1.8 3.5 53 45 A 5 GLU HBx A 5 GLU HGx 1.0 1.8 3.5 54 45 A 5 GLU HGy A 5 GLU HBx 1.0 1.8 3.5 55 45 A 5 GLU HBy A 5 GLU HGy 1.0 1.8 3.5 56 45 A 5 GLU HBy A 5 GLU HGx 1.0 1.8 3.5 57 46 A 2 ALA HB% A 5 GLU HGx 1.0 1.8 4.5 58 46 A 2 ALA HB% A 5 GLU HGy 1.0 1.8 4.5 59 47 A 5 GLU H A 5 GLU HGx 1.0 1.8 3.5 60 47 A 5 GLU H A 5 GLU HGy 1.0 1.8 3.5 61 48 A 5 GLU HBx A 5 GLU HGx 1.0 1.8 3.5 62 48 A 5 GLU HGy A 5 GLU HBx 1.0 1.8 3.5 63 48 A 5 GLU HBy A 5 GLU HGy 1.0 1.8 3.5 64 48 A 5 GLU HBy A 5 GLU HGx 1.0 1.8 3.5 65 49 A 6 ARG H A 5 GLU HGx 1.0 1.8 5.5 66 49 A 6 ARG H A 5 GLU HGy 1.0 1.8 5.5 67 50 A 2 ALA HB% A 6 ARG H 1.0 1.8 5.5 68 51 A 4 HIS H A 6 ARG H 1.0 1.8 5.5 69 52 A 6 ARG H A 5 GLU HA 1.0 1.8 5.5 70 53 A 6 ARG H A 6 ARG HA 1.0 1.8 4.5 71 54 A 6 ARG HA A 8 ALA H 1.0 1.8 5.5 72 55 A 6 ARG H A 6 ARG HBx 1.0 1.8 4.5 73 55 A 6 ARG H A 6 ARG HBy 1.0 1.8 4.5 74 56 A 6 ARG H A 6 ARG HDx 1.0 1.8 5.5 75 56 A 6 ARG H A 6 ARG HDy 1.0 1.8 5.5 76 57 A 6 ARG H A 6 ARG HGx 1.0 1.8 5.5 77 57 A 6 ARG H A 6 ARG HGy 1.0 1.8 5.5 78 58 A 6 ARG HH1% A 6 ARG HE 1.0 1.8 5.5 79 59 A 7 GLU H A 5 GLU HA 1.0 1.8 5.5 80 60 A 7 GLU HA A 10 LYS H 1.0 1.8 5.5 81 61 A 7 GLU HA A 11 ALA H 1.0 1.8 5.5 82 62 A 7 GLU H A 7 GLU HA 1.0 1.8 3.5 83 63 A 8 ALA H A 7 GLU HA 1.0 1.8 5.5 84 64 A 7 GLU H A 7 GLU HBx 1.0 1.8 3.5 85 64 A 7 GLU H A 7 GLU HBy 1.0 1.8 3.5 86 65 A 7 GLU HBx A 7 GLU HGx 1.0 1.8 3.5 87 65 A 7 GLU HBy A 7 GLU HGx 1.0 1.8 3.5 88 65 A 7 GLU HGy A 7 GLU HBx 1.0 1.8 3.5 89 65 A 7 GLU HBy A 7 GLU HGy 1.0 1.8 3.5 90 66 A 8 ALA H A 7 GLU HBx 1.0 1.8 3.5 91 66 A 8 ALA H A 7 GLU HBy 1.0 1.8 3.5 92 67 A 8 ALA HA A 7 GLU HBx 1.0 1.8 5.5 93 67 A 7 GLU HBy A 8 ALA HA 1.0 1.8 5.5 94 68 A 7 GLU HGx A 10 LYS HBx 1.0 1.8 4.5 95 68 A 7 GLU HGy A 10 LYS HBx 1.0 1.8 4.5 96 68 A 10 LYS HBy A 7 GLU HGx 1.0 1.8 4.5 97 68 A 7 GLU HGy A 10 LYS HBy 1.0 1.8 4.5 98 69 A 11 ALA H A 7 GLU HGx 1.0 1.8 5.5 99 69 A 11 ALA H A 7 GLU HGy 1.0 1.8 5.5 100 70 A 7 GLU H A 7 GLU HGx 1.0 1.8 5.5 101 70 A 7 GLU H A 7 GLU HGy 1.0 1.8 5.5 102 71 A 8 ALA H A 7 GLU HGx 1.0 1.8 5.5 103 71 A 8 ALA H A 7 GLU HGy 1.0 1.8 5.5 104 72 A 5 GLU HA A 8 ALA H 1.0 1.8 5.5 105 73 A 8 ALA H A 7 GLU HA 1.0 1.8 5.5 106 74 A 8 ALA H A 8 ALA HA 1.0 1.8 4.5 107 75 A 8 ALA HA A 12 GLU H 1.0 1.8 5.5 108 76 A 9 GLN H A 8 ALA HA 1.0 1.8 5.5 109 77 A 8 ALA H A 8 ALA HB% 1.0 1.8 3.5 110 78 A 5 GLU HA A 9 GLN H 1.0 1.8 5.5 111 79 A 9 GLN H A 8 ALA H 1.0 1.8 4.5 112 80 A 9 GLN H A 8 ALA HA 1.0 1.8 5.5 113 81 A 10 LYS H A 9 GLN HA 1.0 1.8 4.5 114 82 A 8 ALA HB% A 9 GLN HA 1.0 1.8 5.5 115 83 A 9 GLN HE21 A 9 GLN HE22 1.0 1.8 3.5 116 84 A 9 GLN HE21 A 9 GLN HE22 1.0 1.8 3.5 117 85 A 9 GLN HE21 A 9 GLN HBx 1.0 1.8 4.5 118 85 A 9 GLN HE21 A 9 GLN HBy 1.0 1.8 4.5 119 86 A 9 GLN HE22 A 9 GLN HBx 1.0 1.8 4.5 120 86 A 9 GLN HE22 A 9 GLN HBy 1.0 1.8 4.5 121 87 A 9 GLN HE21 A 9 GLN HGx 1.0 1.8 4.5 122 87 A 9 GLN HE21 A 9 GLN HGy 1.0 1.8 4.5 123 88 A 9 GLN HE22 A 9 GLN HGx 1.0 1.8 4.5 124 88 A 9 GLN HE22 A 9 GLN HGy 1.0 1.8 4.5 125 89 A 9 GLN HBy A 9 GLN HGx 1.0 1.8 3.5 126 89 A 9 GLN HBx A 9 GLN HGx 1.0 1.8 3.5 127 89 A 9 GLN HGy A 9 GLN HBx 1.0 1.8 3.5 128 89 A 9 GLN HBy A 9 GLN HGy 1.0 1.8 3.5 129 90 A 10 LYS HBx A 10 LYS HGx 1.0 1.8 4.5 130 90 A 10 LYS HBy A 10 LYS HGx 1.0 1.8 4.5 131 90 A 10 LYS HGy A 10 LYS HBx 1.0 1.8 4.5 132 90 A 10 LYS HBy A 10 LYS HGy 1.0 1.8 4.5 133 91 A 11 ALA H A 11 ALA HA 1.0 1.8 4.5 134 92 A 11 ALA H A 11 ALA HA 1.0 1.8 4.5 135 93 A 11 ALA HA A 14 GLU H 1.0 1.8 4.5 136 94 A 11 ALA H A 11 ALA HB% 1.0 1.8 3.5 137 95 A 8 ALA HA A 11 ALA HB% 1.0 1.8 3.5 138 96 A 12 GLU H A 11 ALA HA 1.0 1.8 4.5 139 97 A 8 ALA HA A 12 GLU H 1.0 1.8 5.5 140 98 A 12 GLU H A 12 GLU HA 1.0 1.8 4.5 141 99 A 12 GLU HA A 15 LEU H 1.0 1.8 5.5 142 100 A 12 GLU HA A 15 LEU HB2 1.0 1.8 5.5 143 101 A 12 GLU H A 12 GLU HBx 1.0 1.8 3.5 144 101 A 12 GLU H A 12 GLU HBy 1.0 1.8 3.5 145 102 A 12 GLU H A 12 GLU HGx 1.0 1.8 4.5 146 102 A 12 GLU H A 12 GLU HGy 1.0 1.8 4.5 147 103 A 13 GLU H A 12 GLU HGx 1.0 1.8 5.5 148 103 A 12 GLU HGy A 13 GLU H 1.0 1.8 5.5 149 104 A 13 GLU H A 10 LYS HA 1.0 1.8 4.5 150 105 A 11 ALA H A 13 GLU H 1.0 1.8 5.5 151 106 A 14 GLU H A 13 GLU H 1.0 1.8 4.5 152 107 A 13 GLU H A 13 GLU HA 1.0 1.8 4.5 153 108 A 13 GLU H A 13 GLU HBx 1.0 1.8 3.5 154 108 A 13 GLU H A 13 GLU HBy 1.0 1.8 3.5 155 109 A 13 GLU HBx A 13 GLU HGx 1.0 1.8 3.5 156 109 A 13 GLU HBy A 13 GLU HGx 1.0 1.8 3.5 157 109 A 13 GLU HGy A 13 GLU HBx 1.0 1.8 3.5 158 109 A 13 GLU HBy A 13 GLU HGy 1.0 1.8 3.5 159 110 A 13 GLU H A 13 GLU HGx 1.0 1.8 5.5 160 110 A 13 GLU H A 13 GLU HGy 1.0 1.8 5.5 161 111 A 11 ALA HA A 14 GLU H 1.0 1.8 4.5 162 112 A 14 GLU H A 14 GLU HA 1.0 1.8 3.5 163 113 A 14 GLU HA A 17 LYS H 1.0 1.8 5.5 164 114 A 14 GLU H A 14 GLU HBx 1.0 1.8 3.5 165 114 A 14 GLU H A 14 GLU HBy 1.0 1.8 3.5 166 115 A 14 GLU H A 14 GLU HGx 1.0 1.8 5.5 167 115 A 14 GLU H A 14 GLU HGy 1.0 1.8 5.5 168 116 A 12 GLU HA A 15 LEU H 1.0 1.8 5.5 169 117 A 15 LEU H A 15 LEU HA 1.0 1.8 4.5 170 118 A 15 LEU H A 15 LEU HA 1.0 1.8 3.5 171 119 A 15 LEU HB2 A 15 LEU HA 1.0 1.8 4.5 172 120 A 15 LEU HA A 19 LEU H 1.0 1.8 5.5 173 121 A 15 LEU H A 15 LEU HB3 1.0 1.8 3.5 174 122 A 19 LEU H A 15 LEU HG 1.0 1.8 5.5 175 123 A 15 LEU H A 15 LEU HDx% 1.0 1.8 4.5 176 124 A 15 LEU HA A 16 GLN H 1.0 1.8 5.5 177 125 A 16 GLN H A 16 GLN HE21 1.0 1.8 5.5 178 126 A 15 LEU HB3 A 16 GLN HA 1.0 1.8 5.5 179 127 A 17 LYS H A 16 GLN HA 1.0 1.8 5.5 180 128 A 16 GLN HA A 20 GLU H 1.0 1.8 5.5 181 129 A 16 GLN HE21 A 16 GLN HE22 1.0 1.8 3.5 182 130 A 16 GLN H A 16 GLN HBx 1.0 1.8 3.5 183 130 A 16 GLN H A 16 GLN HBy 1.0 1.8 3.5 184 131 A 16 GLN HA A 16 GLN HBx 1.0 1.8 4.5 185 131 A 16 GLN HA A 16 GLN HBy 1.0 1.8 4.5 186 132 A 16 GLN HE21 A 16 GLN HBx 1.0 1.8 4.5 187 132 A 16 GLN HE21 A 16 GLN HBy 1.0 1.8 4.5 188 133 A 16 GLN HE22 A 16 GLN HBx 1.0 1.8 4.5 189 133 A 16 GLN HE22 A 16 GLN HBy 1.0 1.8 4.5 190 134 A 16 GLN HBy A 16 GLN HGx 1.0 1.8 3.5 191 134 A 16 GLN HBx A 16 GLN HGx 1.0 1.8 3.5 192 134 A 16 GLN HGy A 16 GLN HBx 1.0 1.8 3.5 193 134 A 16 GLN HBy A 16 GLN HGy 1.0 1.8 3.5 194 135 A 16 GLN HBy A 20 GLU HGx 1.0 1.8 4.5 195 135 A 16 GLN HBx A 20 GLU HGx 1.0 1.8 4.5 196 135 A 20 GLU HGy A 16 GLN HBx 1.0 1.8 4.5 197 135 A 16 GLN HBy A 20 GLU HGy 1.0 1.8 4.5 198 136 A 16 GLN H A 16 GLN HGx 1.0 1.8 3.5 199 136 A 16 GLN H A 16 GLN HGy 1.0 1.8 3.5 200 137 A 16 GLN HE22 A 16 GLN HGx 1.0 1.8 4.5 201 137 A 16 GLN HE22 A 16 GLN HGy 1.0 1.8 4.5 202 138 A 14 GLU HA A 17 LYS H 1.0 1.8 5.5 203 139 A 17 LYS H A 15 LEU HA 1.0 1.8 5.5 204 140 A 17 LYS H A 17 LYS HA 1.0 1.8 4.5 205 141 A 17 LYS HA A 18 VAL H 1.0 1.8 5.5 206 142 A 20 GLU H A 17 LYS HA 1.0 1.8 5.5 207 143 A 17 LYS H A 17 LYS HBx 1.0 1.8 3.5 208 143 A 17 LYS H A 17 LYS HBy 1.0 1.8 3.5 209 144 A 17 LYS H A 17 LYS HDx 1.0 1.8 5.5 210 144 A 17 LYS H A 17 LYS HDy 1.0 1.8 5.5 211 145 A 17 LYS HBx A 17 LYS HDx 1.0 1.8 4.5 212 145 A 17 LYS HBy A 17 LYS HDx 1.0 1.8 4.5 213 145 A 17 LYS HDy A 17 LYS HBx 1.0 1.8 4.5 214 145 A 17 LYS HBy A 17 LYS HDy 1.0 1.8 4.5 215 146 A 18 VAL H A 17 LYS HDx 1.0 1.8 5.5 216 146 A 18 VAL H A 17 LYS HDy 1.0 1.8 5.5 217 147 A 17 LYS HEy A 17 LYS HGx 1.0 1.8 4.5 218 147 A 17 LYS HEx A 17 LYS HGx 1.0 1.8 4.5 219 147 A 17 LYS HGy A 17 LYS HEx 1.0 1.8 4.5 220 147 A 17 LYS HEy A 17 LYS HGy 1.0 1.8 4.5 221 148 A 17 LYS H A 17 LYS HGx 1.0 1.8 5.5 222 148 A 17 LYS H A 17 LYS HGy 1.0 1.8 5.5 223 149 A 15 LEU HA A 18 VAL H 1.0 1.8 4.5 224 150 A 19 LEU H A 18 VAL H 1.0 1.8 3.5 225 151 A 18 VAL H A 18 VAL HA 1.0 1.8 3.5 226 152 A 18 VAL H A 18 VAL HB 1.0 1.8 3.5 227 153 A 19 LEU H A 18 VAL HB 1.0 1.8 3.5 228 154 A 17 LYS HGx A 18 VAL HGx% 1.0 1.8 5.5 229 154 A 17 LYS HGy A 18 VAL HGx% 1.0 1.8 5.5 230 154 A 18 VAL HGy% A 17 LYS HGx 1.0 1.8 5.5 231 154 A 17 LYS HGy A 18 VAL HGy% 1.0 1.8 5.5 232 155 A 18 VAL H A 18 VAL HGx% 1.0 1.8 3.5 233 155 A 18 VAL H A 18 VAL HGy% 1.0 1.8 3.5 234 156 A 15 LEU HA A 19 LEU H 1.0 1.8 5.5 235 157 A 19 LEU H A 18 VAL H 1.0 1.8 3.5 236 158 A 19 LEU H A 19 LEU HA 1.0 1.8 4.5 237 159 A 20 GLU H A 19 LEU HA 1.0 1.8 5.5 238 160 A 18 VAL H A 19 LEU HG 1.0 1.8 5.5 239 161 A 19 LEU H A 19 LEU HG 1.0 1.8 3.5 240 162 A 15 LEU HDx% A 19 LEU HBx 1.0 1.8 5.5 241 162 A 15 LEU HDx% A 19 LEU HBy 1.0 1.8 5.5 242 163 A 19 LEU HBy A 19 LEU HDx% 1.0 1.8 4.5 243 163 A 19 LEU HDx% A 19 LEU HBx 1.0 1.8 4.5 244 164 A 20 GLU H A 19 LEU HDx% 1.0 1.8 5.5 245 165 A 19 LEU H A 19 LEU HDy% 1.0 1.8 4.5 246 166 A 20 GLU H A 20 GLU HA 1.0 1.8 3.5 247 167 A 20 GLU H A 20 GLU HA 1.0 1.8 3.5 248 168 A 20 GLU H A 20 GLU HBx 1.0 1.8 3.5 249 168 A 20 GLU H A 20 GLU HBy 1.0 1.8 3.5 250 169 A 20 GLU HBy A 20 GLU HGx 1.0 1.8 3.5 251 169 A 20 GLU HGy A 20 GLU HBx 1.0 1.8 3.5 252 169 A 20 GLU HGy A 20 GLU HBy 1.0 1.8 3.5 253 169 A 20 GLU HBx A 20 GLU HGx 1.0 1.8 3.5 254 170 A 21 GLU H A 20 GLU HBx 1.0 1.8 3.5 255 170 A 20 GLU HBy A 21 GLU H 1.0 1.8 3.5 256 171 A 21 GLU HA A 20 GLU HBx 1.0 1.8 5.5 257 171 A 20 GLU HBy A 21 GLU HA 1.0 1.8 5.5 258 172 A 20 GLU H A 20 GLU HGx 1.0 1.8 3.5 259 172 A 20 GLU H A 20 GLU HGy 1.0 1.8 3.5 260 173 A 20 GLU HA A 21 GLU H 1.0 1.8 5.5 261 174 A 21 GLU H A 21 GLU HA 1.0 1.8 3.5 262 175 A 21 GLU HA A 22 ALA H 1.0 1.8 5.5 263 176 A 21 GLU HA A 25 LYS H 1.0 1.8 5.5 264 177 A 21 GLU HA A 21 GLU HBx 1.0 1.8 4.5 265 177 A 21 GLU HA A 21 GLU HBy 1.0 1.8 4.5 266 178 A 22 ALA H A 21 GLU HBx 1.0 1.8 3.5 267 178 A 22 ALA H A 21 GLU HBy 1.0 1.8 3.5 268 179 A 22 ALA H A 21 GLU HGx 1.0 1.8 4.5 269 179 A 22 ALA H A 21 GLU HGy 1.0 1.8 4.5 270 180 A 22 ALA H A 22 ALA HA 1.0 1.8 3.5 271 181 A 22 ALA HA A 22 ALA HB% 1.0 1.8 4.5 272 182 A 22 ALA HA A 23 SER H 1.0 1.8 5.5 273 183 A 25 LYS H A 22 ALA HA 1.0 1.8 4.5 274 184 A 22 ALA HA A 26 ALA H 1.0 1.8 5.5 275 185 A 22 ALA H A 22 ALA HB% 1.0 1.8 3.5 276 186 A 22 ALA HB% A 23 SER H 1.0 1.8 3.5 277 187 A 23 SER H A 23 SER HA 1.0 1.8 4.5 278 188 A 23 SER HA A 24 LYS H 1.0 1.8 5.5 279 189 A 23 SER HA A 26 ALA HB% 1.0 1.8 3.5 280 190 A 23 SER H A 23 SER HBx 1.0 1.8 3.5 281 190 A 23 SER H A 23 SER HBy 1.0 1.8 3.5 282 191 A 24 LYS H A 23 SER HBx 1.0 1.8 4.5 283 191 A 24 LYS H A 23 SER HBy 1.0 1.8 4.5 284 192 A 23 SER HBy A 24 LYS HBx 1.0 1.8 4.5 285 192 A 23 SER HBx A 24 LYS HBx 1.0 1.8 4.5 286 192 A 24 LYS HBy A 23 SER HBx 1.0 1.8 4.5 287 192 A 23 SER HBy A 24 LYS HBy 1.0 1.8 4.5 288 193 A 24 LYS H A 24 LYS HA 1.0 1.8 4.5 289 194 A 24 LYS H A 24 LYS HA 1.0 1.8 3.5 290 195 A 25 LYS H A 24 LYS HA 1.0 1.8 5.5 291 196 A 24 LYS H A 24 LYS HBx 1.0 1.8 3.5 292 196 A 24 LYS H A 24 LYS HBy 1.0 1.8 3.5 293 197 A 25 LYS H A 24 LYS HBx 1.0 1.8 3.5 294 197 A 25 LYS H A 24 LYS HBy 1.0 1.8 3.5 295 198 A 24 LYS H A 24 LYS HDx 1.0 1.8 5.5 296 198 A 24 LYS H A 24 LYS HDy 1.0 1.8 5.5 297 199 A 25 LYS H A 24 LYS HDx 1.0 1.8 3.5 298 199 A 25 LYS H A 24 LYS HDy 1.0 1.8 3.5 299 200 A 24 LYS H A 24 LYS HGx 1.0 1.8 5.5 300 200 A 24 LYS H A 24 LYS HGy 1.0 1.8 5.5 301 201 A 25 LYS H A 24 LYS HGx 1.0 1.8 5.5 302 201 A 25 LYS H A 24 LYS HGy 1.0 1.8 5.5 303 202 A 27 VAL HB A 24 LYS HGx 1.0 1.8 5.5 304 202 A 24 LYS HGy A 27 VAL HB 1.0 1.8 5.5 305 203 A 25 LYS H A 24 LYS HA 1.0 1.8 5.5 306 204 A 25 LYS H A 25 LYS HA 1.0 1.8 3.5 307 205 A 26 ALA H A 25 LYS HA 1.0 1.8 5.5 308 206 A 25 LYS HA A 28 GLU H 1.0 1.8 4.5 309 207 A 25 LYS HA A 29 ALA H 1.0 1.8 5.5 310 208 A 25 LYS H A 25 LYS HBx 1.0 1.8 3.5 311 208 A 25 LYS H A 25 LYS HBy 1.0 1.8 3.5 312 209 A 26 ALA H A 25 LYS HBx 1.0 1.8 4.5 313 209 A 26 ALA H A 25 LYS HBy 1.0 1.8 4.5 314 210 A 25 LYS H A 25 LYS HDx 1.0 1.8 5.5 315 210 A 25 LYS H A 25 LYS HDy 1.0 1.8 5.5 316 211 A 24 LYS HDy A 25 LYS HEx 1.0 1.8 4.5 317 211 A 24 LYS HDx A 25 LYS HEx 1.0 1.8 4.5 318 211 A 25 LYS HEy A 24 LYS HDx 1.0 1.8 4.5 319 211 A 24 LYS HDy A 25 LYS HEy 1.0 1.8 4.5 320 212 A 25 LYS HDy A 25 LYS HEx 1.0 1.8 4.5 321 212 A 25 LYS HDx A 25 LYS HEx 1.0 1.8 4.5 322 212 A 25 LYS HEy A 25 LYS HDx 1.0 1.8 4.5 323 212 A 25 LYS HDy A 25 LYS HEy 1.0 1.8 4.5 324 213 A 25 LYS HEy A 25 LYS HGx 1.0 1.8 4.5 325 213 A 25 LYS HEx A 25 LYS HGx 1.0 1.8 4.5 326 213 A 25 LYS HGy A 25 LYS HEx 1.0 1.8 4.5 327 213 A 25 LYS HEy A 25 LYS HGy 1.0 1.8 4.5 328 214 A 25 LYS H A 25 LYS HGx 1.0 1.8 3.5 329 214 A 25 LYS H A 25 LYS HGy 1.0 1.8 3.5 330 215 A 26 ALA H A 26 ALA HA 1.0 1.8 4.5 331 216 A 26 ALA HA A 27 VAL H 1.0 1.8 5.5 332 217 A 29 ALA H A 26 ALA HA 1.0 1.8 5.5 333 218 A 26 ALA H A 26 ALA HB% 1.0 1.8 3.5 334 219 A 26 ALA HB% A 27 VAL H 1.0 1.8 3.5 335 220 A 24 LYS HA A 27 VAL H 1.0 1.8 5.5 336 221 A 26 ALA HA A 27 VAL H 1.0 1.8 5.5 337 222 A 26 ALA HB% A 27 VAL H 1.0 1.8 4.5 338 223 A 27 VAL H A 27 VAL HA 1.0 1.8 4.5 339 224 A 28 GLU H A 27 VAL H 1.0 1.8 3.5 340 225 A 29 ALA H A 27 VAL H 1.0 1.8 5.5 341 226 A 27 VAL H A 27 VAL HA 1.0 1.8 3.5 342 227 A 27 VAL HB A 24 LYS HGx 1.0 1.8 5.5 343 227 A 24 LYS HGy A 27 VAL HB 1.0 1.8 5.5 344 228 A 27 VAL HB A 27 VAL H 1.0 1.8 3.5 345 229 A 27 VAL HB A 28 GLU H 1.0 1.8 3.5 346 230 A 26 ALA HB% A 27 VAL HGx% 1.0 1.8 4.5 347 230 A 26 ALA HB% A 27 VAL HGy% 1.0 1.8 4.5 348 231 A 27 VAL H A 27 VAL HGx% 1.0 1.8 3.5 349 231 A 27 VAL H A 27 VAL HGy% 1.0 1.8 3.5 350 232 A 25 LYS HA A 28 GLU H 1.0 1.8 4.5 351 233 A 28 GLU H A 27 VAL HA 1.0 1.8 4.5 352 234 A 28 GLU H A 28 GLU HA 1.0 1.8 3.5 353 235 A 29 ALA H A 28 GLU HA 1.0 1.8 5.5 354 236 A 24 LYS HEy A 28 GLU HBx 1.0 1.8 5.5 355 236 A 24 LYS HEx A 28 GLU HBx 1.0 1.8 5.5 356 236 A 28 GLU HBy A 24 LYS HEx 1.0 1.8 5.5 357 236 A 28 GLU HBy A 24 LYS HEy 1.0 1.8 5.5 358 237 A 24 LYS HGy A 28 GLU HBx 1.0 1.8 5.5 359 237 A 28 GLU HBy A 24 LYS HGx 1.0 1.8 5.5 360 237 A 24 LYS HGy A 28 GLU HBy 1.0 1.8 5.5 361 237 A 24 LYS HGx A 28 GLU HBx 1.0 1.8 5.5 362 238 A 25 LYS HGx A 28 GLU HBx 1.0 1.8 5.5 363 238 A 25 LYS HGy A 28 GLU HBx 1.0 1.8 5.5 364 238 A 28 GLU HBy A 25 LYS HGx 1.0 1.8 5.5 365 238 A 25 LYS HGy A 28 GLU HBy 1.0 1.8 5.5 366 239 A 28 GLU H A 28 GLU HBx 1.0 1.8 3.5 367 239 A 28 GLU H A 28 GLU HBy 1.0 1.8 3.5 368 240 A 28 GLU HBx A 28 GLU HGx 1.0 1.8 3.5 369 240 A 28 GLU HBy A 28 GLU HGx 1.0 1.8 3.5 370 240 A 28 GLU HGy A 28 GLU HBx 1.0 1.8 3.5 371 240 A 28 GLU HBy A 28 GLU HGy 1.0 1.8 3.5 372 241 A 29 ALA H A 28 GLU HBx 1.0 1.8 3.5 373 241 A 29 ALA H A 28 GLU HBy 1.0 1.8 3.5 374 242 A 29 ALA HA A 28 GLU HBx 1.0 1.8 5.5 375 242 A 28 GLU HBy A 29 ALA HA 1.0 1.8 5.5 376 243 A 29 ALA H A 28 GLU HGx 1.0 1.8 5.5 377 243 A 29 ALA H A 28 GLU HGy 1.0 1.8 5.5 378 244 A 29 ALA H A 27 VAL HA 1.0 1.8 5.5 379 245 A 29 ALA H A 29 ALA HA 1.0 1.8 4.5 380 246 A 29 ALA H A 29 ALA HA 1.0 1.8 4.5 381 247 A 29 ALA HA A 30 GLU H 1.0 1.8 5.5 382 248 A 29 ALA H A 29 ALA HB% 1.0 1.8 3.5 383 249 A 30 GLU HA A 31 ARG H 1.0 1.8 5.5 384 250 A 30 GLU HA A 33 ALA HB% 1.0 1.8 4.5 385 251 A 30 GLU H A 30 GLU HBx 1.0 1.8 3.5 386 251 A 30 GLU H A 30 GLU HBy 1.0 1.8 3.5 387 252 A 30 GLU HBx A 30 GLU HGx 1.0 1.8 3.5 388 252 A 30 GLU HBy A 30 GLU HGx 1.0 1.8 3.5 389 252 A 30 GLU HGy A 30 GLU HBx 1.0 1.8 3.5 390 252 A 30 GLU HBy A 30 GLU HGy 1.0 1.8 3.5 391 253 A 31 ARG H A 30 GLU HGx 1.0 1.8 5.5 392 253 A 31 ARG H A 30 GLU HGy 1.0 1.8 5.5 393 254 A 30 GLU HA A 31 ARG H 1.0 1.8 5.5 394 255 A 31 ARG H A 31 ARG HE 1.0 1.8 6.5 395 256 A 31 ARG H A 31 ARG HA 1.0 1.8 4.5 396 257 A 31 ARG HA A 31 ARG HBx 1.0 1.8 4.5 397 257 A 31 ARG HA A 31 ARG HBy 1.0 1.8 4.5 398 258 A 31 ARG HA A 32 GLY H 1.0 1.8 3.5 399 259 A 31 ARG HE A 31 ARG HDx 1.0 1.8 3.5 400 259 A 31 ARG HE A 31 ARG HDy 1.0 1.8 3.5 401 260 A 31 ARG H A 31 ARG HBx 1.0 1.8 3.5 402 260 A 31 ARG H A 31 ARG HBy 1.0 1.8 3.5 403 261 A 31 ARG HE A 31 ARG HBx 1.0 1.8 5.5 404 261 A 31 ARG HE A 31 ARG HBy 1.0 1.8 5.5 405 262 A 31 ARG HBx A 31 ARG HGx 1.0 1.8 3.5 406 262 A 31 ARG HGy A 31 ARG HBx 1.0 1.8 3.5 407 262 A 31 ARG HBy A 31 ARG HGy 1.0 1.8 3.5 408 262 A 31 ARG HBy A 31 ARG HGx 1.0 1.8 3.5 409 263 A 31 ARG H A 31 ARG HDx 1.0 1.8 5.5 410 263 A 31 ARG H A 31 ARG HDy 1.0 1.8 5.5 411 264 A 31 ARG HE A 31 ARG HDx 1.0 1.8 3.5 412 264 A 31 ARG HE A 31 ARG HDy 1.0 1.8 3.5 413 265 A 32 GLY H A 31 ARG HDx 1.0 1.8 4.5 414 265 A 32 GLY H A 31 ARG HDy 1.0 1.8 4.5 415 266 A 31 ARG H A 31 ARG HGx 1.0 1.8 3.5 416 266 A 31 ARG H A 31 ARG HGy 1.0 1.8 3.5 417 267 A 31 ARG HE A 31 ARG HGx 1.0 1.8 3.5 418 267 A 31 ARG HE A 31 ARG HGy 1.0 1.8 3.5 419 268 A 32 GLY H A 31 ARG HGx 1.0 1.8 5.5 420 268 A 32 GLY H A 31 ARG HGy 1.0 1.8 5.5 421 269 A 31 ARG HE A 31 ARG HH1% 1.0 1.8 4.5 422 270 A 31 ARG HE A 31 ARG HH2% 1.0 1.8 4.5 423 271 A 32 GLY H A 31 ARG HDx 1.0 1.8 5.5 424 271 A 32 GLY H A 31 ARG HDy 1.0 1.8 5.5 425 272 A 32 GLY H A 32 GLY HAx 1.0 1.8 4.5 426 272 A 32 GLY H A 32 GLY HAy 1.0 1.8 4.5 427 273 A 31 ARG HBy A 32 GLY HAx 1.0 1.8 4.5 428 273 A 31 ARG HBx A 32 GLY HAx 1.0 1.8 4.5 429 273 A 32 GLY HAy A 31 ARG HBx 1.0 1.8 4.5 430 273 A 31 ARG HBy A 32 GLY HAy 1.0 1.8 4.5 431 274 A 32 GLY H A 32 GLY HAx 1.0 1.8 3.5 432 274 A 32 GLY H A 32 GLY HAy 1.0 1.8 3.5 433 275 A 33 ALA H A 32 GLY HAx 1.0 1.8 3.5 434 275 A 32 GLY HAy A 33 ALA H 1.0 1.8 3.5 435 276 A 33 ALA H A 32 GLY HAx 1.0 1.8 4.5 436 276 A 32 GLY HAy A 33 ALA H 1.0 1.8 4.5 437 277 A 33 ALA H A 33 ALA HA 1.0 1.8 4.5 438 278 A 33 ALA HB% A 33 ALA HA 1.0 1.8 3.5 439 279 A 33 ALA HA A 34 PRO HD2 1.0 1.8 4.5 440 280 A 33 ALA HB% A 33 ALA H 1.0 1.8 3.5 441 281 A 33 ALA HB% A 36 ALA HA 1.0 1.8 5.5 442 282 A 34 PRO HD2 A 34 PRO HA 1.0 1.8 5.5 443 283 A 33 ALA HB% A 34 PRO HD2 1.0 1.8 3.5 444 284 A 33 ALA HB% A 34 PRO HD3 1.0 1.8 5.5 445 285 A 35 GLY H A 34 PRO HBx 1.0 1.8 4.5 446 285 A 34 PRO HBy A 35 GLY H 1.0 1.8 4.5 447 286 A 33 ALA HB% A 34 PRO HGx 1.0 1.8 5.5 448 286 A 33 ALA HB% A 34 PRO HGy 1.0 1.8 5.5 449 287 A 34 PRO HBy A 34 PRO HGx 1.0 1.8 3.5 450 287 A 34 PRO HBx A 34 PRO HGx 1.0 1.8 3.5 451 287 A 34 PRO HGy A 34 PRO HBx 1.0 1.8 3.5 452 287 A 34 PRO HBy A 34 PRO HGy 1.0 1.8 3.5 453 288 A 34 PRO HA A 35 GLY H 1.0 1.8 5.5 454 289 A 35 GLY H A 36 ALA H 1.0 1.8 5.5 455 290 A 35 GLY H A 35 GLY HAx 1.0 1.8 3.5 456 290 A 35 GLY H A 35 GLY HAy 1.0 1.8 3.5 457 291 A 36 ALA H A 35 GLY HAx 1.0 1.8 3.5 458 291 A 36 ALA H A 35 GLY HAy 1.0 1.8 3.5 459 292 A 36 ALA H A 35 GLY HAx 1.0 1.8 4.5 460 292 A 36 ALA H A 35 GLY HAy 1.0 1.8 4.5 461 293 A 33 ALA HB% A 36 ALA HA 1.0 1.8 5.5 462 294 A 36 ALA HA A 36 ALA H 1.0 1.8 4.5 463 295 A 36 ALA H A 36 ALA HB% 1.0 1.8 3.5 464 296 A 36 ALA HB% A 37 ALA H 1.0 1.8 4.5 465 297 A 36 ALA HA A 37 ALA H 1.0 1.8 4.5 466 298 A 37 ALA H A 37 ALA HA 1.0 1.8 4.5 467 299 A 36 ALA HA A 37 ALA HB% 1.0 1.8 5.5 468 300 A 37 ALA H A 37 ALA HB% 1.0 1.8 4.5 469 301 A 38 LEU HA A 38 LEU H 1.0 1.8 4.5 470 302 A 38 LEU HA A 38 LEU HBx 1.0 1.8 4.5 471 302 A 38 LEU HA A 38 LEU HBy 1.0 1.8 4.5 472 303 A 38 LEU H A 38 LEU HG 1.0 1.8 5.5 473 304 A 38 LEU H A 38 LEU HBx 1.0 1.8 3.5 474 304 A 38 LEU H A 38 LEU HBy 1.0 1.8 3.5 475 305 A 38 LEU H A 38 LEU HDx% 1.0 1.8 5.5 476 305 A 38 LEU H A 38 LEU HDy% 1.0 1.8 5.5 477 306 A 39 ILE H A 38 LEU HDx% 1.0 1.8 5.5 478 306 A 38 LEU HDy% A 39 ILE H 1.0 1.8 5.5 479 307 A 39 ILE H A 39 ILE HA 1.0 1.8 3.5 480 308 A 39 ILE HB A 39 ILE HG1x 1.0 1.8 4.5 481 308 A 39 ILE HB A 39 ILE HG1y 1.0 1.8 4.5 482 309 A 39 ILE HB A 39 ILE HG2% 1.0 1.8 4.5 483 310 A 39 ILE HB A 40 SER H 1.0 1.8 5.5 484 311 A 39 ILE HD1% A 39 ILE HG1x 1.0 1.8 4.5 485 311 A 39 ILE HG1y A 39 ILE HD1% 1.0 1.8 4.5 486 312 A 39 ILE HG2% A 39 ILE HD1% 1.0 1.8 4.5 487 313 A 36 ALA HB% A 39 ILE HG1x 1.0 1.8 5.5 488 313 A 36 ALA HB% A 39 ILE HG1y 1.0 1.8 5.5 489 314 A 39 ILE H A 39 ILE HG1x 1.0 1.8 4.5 490 314 A 39 ILE H A 39 ILE HG1y 1.0 1.8 4.5 491 315 A 39 ILE HB A 39 ILE HG1x 1.0 1.8 4.5 492 315 A 39 ILE HB A 39 ILE HG1y 1.0 1.8 4.5 493 316 A 39 ILE H A 39 ILE HG2% 1.0 1.8 4.5 494 317 A 39 ILE HB A 39 ILE HG2% 1.0 1.8 4.5 495 318 A 39 ILE HG2% A 40 SER H 1.0 1.8 5.5 496 319 A 40 SER H A 40 SER HA 1.0 1.8 4.5 497 320 A 40 SER HA A 39 ILE HG1x 1.0 1.8 5.5 498 320 A 39 ILE HG1y A 40 SER HA 1.0 1.8 5.5 499 321 A 40 SER H A 40 SER HA 1.0 1.8 4.5 500 322 A 40 SER HA A 41 TYR H 1.0 1.8 4.5 501 323 A 42 PRO HD3 A 40 SER HBx 1.0 1.8 5.5 502 323 A 40 SER HBy A 42 PRO HD3 1.0 1.8 5.5 503 324 A 40 SER HA A 41 TYR H 1.0 1.8 4.5 504 325 A 41 TYR H A 41 TYR HA 1.0 1.8 4.5 505 326 A 41 TYR HB2 A 41 TYR HB3 1.0 1.8 4.5 506 327 A 42 PRO HA A 43 ASP H 1.0 1.8 5.5 507 328 A 42 PRO HD3 A 42 PRO HD2 1.0 1.8 3.5 508 329 A 43 ASP H A 42 PRO HD2 1.0 1.8 5.5 509 330 A 42 PRO HD3 A 42 PRO HD2 1.0 1.8 3.5 510 331 A 42 PRO HD3 A 43 ASP H 1.0 1.8 4.5 511 332 A 42 PRO HBx A 42 PRO HGx 1.0 1.8 4.5 512 332 A 42 PRO HBy A 42 PRO HGx 1.0 1.8 4.5 513 332 A 42 PRO HGy A 42 PRO HBx 1.0 1.8 4.5 514 332 A 42 PRO HBy A 42 PRO HGy 1.0 1.8 4.5 515 333 A 43 ASP H A 42 PRO HBx 1.0 1.8 5.5 516 333 A 43 ASP H A 42 PRO HBy 1.0 1.8 5.5 517 334 A 43 ASP H A 43 ASP HA 1.0 1.8 3.5 518 335 A 43 ASP HA A 44 ALA H 1.0 1.8 4.5 519 336 A 43 ASP HA A 45 ILE H 1.0 1.8 5.5 520 337 A 43 ASP HA A 45 ILE HG2% 1.0 1.8 5.5 521 338 A 43 ASP H A 43 ASP HB2 1.0 1.8 5.5 522 339 A 43 ASP HB2 A 43 ASP HB3 1.0 1.8 4.5 523 340 A 44 ALA H A 43 ASP HB2 1.0 1.8 5.5 524 341 A 44 ALA H A 43 ASP HB3 1.0 1.8 5.5 525 342 A 43 ASP H A 44 ALA H 1.0 1.8 4.5 526 343 A 44 ALA H A 45 ILE H 1.0 1.8 4.5 527 344 A 44 ALA H A 44 ALA HA 1.0 1.8 4.5 528 345 A 45 ILE H A 44 ALA HA 1.0 1.8 5.5 529 346 A 44 ALA H A 44 ALA HB% 1.0 1.8 3.5 530 347 A 45 ILE H A 44 ALA HB% 1.0 1.8 4.5 531 348 A 44 ALA HB% A 46 TRP H 1.0 1.8 5.5 532 349 A 44 ALA H A 45 ILE H 1.0 1.8 3.5 533 350 A 45 ILE H A 46 TRP H 1.0 1.8 4.5 534 351 A 45 ILE H A 45 ILE HA 1.0 1.8 4.5 535 352 A 46 TRP H A 45 ILE HA 1.0 1.8 5.5 536 353 A 45 ILE H A 45 ILE HB 1.0 1.8 3.5 537 354 A 46 TRP H A 45 ILE HB 1.0 1.8 5.5 538 355 A 45 ILE H A 45 ILE HD1% 1.0 1.8 5.5 539 356 A 45 ILE HD1% A 45 ILE HG1x 1.0 1.8 5.5 540 356 A 45 ILE HD1% A 45 ILE HG1y 1.0 1.8 5.5 541 357 A 45 ILE HG2% A 45 ILE HD1% 1.0 1.8 4.5 542 358 A 46 TRP H A 45 ILE HD1% 1.0 1.8 5.5 543 359 A 45 ILE HD1% A 49 VAL HGy% 1.0 1.8 4.5 544 360 A 45 ILE H A 45 ILE HG1x 1.0 1.8 5.5 545 360 A 45 ILE H A 45 ILE HG1y 1.0 1.8 5.5 546 361 A 46 TRP H A 45 ILE HG1x 1.0 1.8 5.5 547 361 A 46 TRP H A 45 ILE HG1y 1.0 1.8 5.5 548 362 A 45 ILE H A 45 ILE HG2% 1.0 1.8 4.5 549 363 A 45 ILE HG2% A 45 ILE HG1x 1.0 1.8 4.5 550 363 A 45 ILE HG2% A 45 ILE HG1y 1.0 1.8 4.5 551 364 A 45 ILE H A 46 TRP H 1.0 1.8 4.5 552 365 A 46 TRP H A 47 TRP H 1.0 1.8 4.5 553 366 A 46 TRP H A 46 TRP HA 1.0 1.8 4.5 554 367 A 47 TRP H A 46 TRP HA 1.0 1.8 5.5 555 368 A 46 TRP HD1 A 46 TRP HE1 1.0 1.8 3.5 556 369 A 46 TRP HE1 A 46 TRP HZ2 1.0 1.8 4.5 557 370 A 46 TRP H A 46 TRP HBx 1.0 1.8 4.5 558 370 A 46 TRP H A 46 TRP HBy 1.0 1.8 4.5 559 371 A 46 TRP HE1 A 46 TRP HBx 1.0 1.8 5.5 560 371 A 46 TRP HE1 A 46 TRP HBy 1.0 1.8 5.5 561 372 A 47 TRP H A 46 TRP HBx 1.0 1.8 4.5 562 372 A 47 TRP H A 46 TRP HBy 1.0 1.8 4.5 563 373 A 47 TRP H A 48 SER H 1.0 1.8 4.5 564 374 A 47 TRP H A 47 TRP HA 1.0 1.8 4.5 565 375 A 48 SER H A 47 TRP HA 1.0 1.8 4.5 566 376 A 47 TRP HA A 50 GLU H 1.0 1.8 5.5 567 377 A 48 SER H A 47 TRP HB2 1.0 1.8 5.5 568 378 A 47 TRP H A 47 TRP HB3 1.0 1.8 4.5 569 379 A 47 TRP HD1 A 47 TRP HE1 1.0 1.8 3.5 570 380 A 47 TRP H A 47 TRP HE3 1.0 1.8 4.5 571 381 A 47 TRP HE1 A 47 TRP HZ2 1.0 1.8 4.5 572 382 A 46 TRP H A 48 SER H 1.0 1.8 5.5 573 383 A 48 SER H A 48 SER HA 1.0 1.8 4.5 574 384 A 48 SER HA A 49 VAL H 1.0 1.8 4.5 575 385 A 48 SER HA A 51 THR H 1.0 1.8 5.5 576 386 A 48 SER H A 48 SER HBx 1.0 1.8 4.5 577 386 A 48 SER H A 48 SER HBy 1.0 1.8 4.5 578 387 A 49 VAL H A 48 SER HBx 1.0 1.8 4.5 579 387 A 49 VAL H A 48 SER HBy 1.0 1.8 4.5 580 388 A 52 ALA HB% A 48 SER HBx 1.0 1.8 5.5 581 388 A 48 SER HBy A 52 ALA HB% 1.0 1.8 5.5 582 389 A 49 VAL H A 49 VAL HA 1.0 1.8 4.5 583 390 A 51 THR H A 49 VAL HA 1.0 1.8 5.5 584 391 A 49 VAL H A 49 VAL HB 1.0 1.8 3.5 585 392 A 49 VAL HB A 50 GLU HGx 1.0 1.8 5.5 586 392 A 49 VAL HB A 50 GLU HGy 1.0 1.8 5.5 587 393 A 49 VAL H A 49 VAL HGx% 1.0 1.8 5.5 588 394 A 50 GLU H A 49 VAL HGx% 1.0 1.8 4.5 589 395 A 45 ILE HG2% A 49 VAL HGy% 1.0 1.8 5.5 590 396 A 49 VAL H A 49 VAL HGy% 1.0 1.8 3.5 591 397 A 50 GLU H A 49 VAL HGy% 1.0 1.8 5.5 592 398 A 53 THR HG2% A 49 VAL HGy% 1.0 1.8 5.5 593 399 A 50 GLU H A 50 GLU HA 1.0 1.8 4.5 594 400 A 50 GLU H A 50 GLU HBx 1.0 1.8 3.5 595 400 A 50 GLU H A 50 GLU HBy 1.0 1.8 3.5 596 401 A 51 THR H A 50 GLU HBx 1.0 1.8 5.5 597 401 A 51 THR H A 50 GLU HBy 1.0 1.8 5.5 598 402 A 49 VAL H A 50 GLU HGx 1.0 1.8 5.5 599 402 A 49 VAL H A 50 GLU HGy 1.0 1.8 5.5 600 403 A 50 GLU H A 50 GLU HGx 1.0 1.8 4.5 601 403 A 50 GLU H A 50 GLU HGy 1.0 1.8 4.5 602 404 A 51 THR H A 50 GLU HGx 1.0 1.8 4.5 603 404 A 51 THR H A 50 GLU HGy 1.0 1.8 4.5 604 405 A 51 THR H A 50 GLU HA 1.0 1.8 4.5 605 406 A 51 THR H A 50 GLU HBx 1.0 1.8 5.5 606 406 A 51 THR H A 50 GLU HBy 1.0 1.8 5.5 607 407 A 51 THR H A 51 THR HA 1.0 1.8 3.5 608 408 A 51 THR HA A 53 THR H 1.0 1.8 5.5 609 409 A 51 THR H A 51 THR HB 1.0 1.8 4.5 610 410 A 52 ALA HB% A 51 THR HB 1.0 1.8 5.5 611 411 A 51 THR H A 51 THR HG2% 1.0 1.8 5.5 612 412 A 51 THR HG2% A 52 ALA H 1.0 1.8 4.5 613 413 A 52 ALA HB% A 51 THR HG2% 1.0 1.8 4.5 614 414 A 51 THR H A 52 ALA H 1.0 1.8 4.5 615 415 A 52 ALA HB% A 52 ALA H 1.0 1.8 4.5 616 416 A 52 ALA H A 52 ALA HA 1.0 1.8 3.5 617 417 A 53 THR H A 52 ALA HA 1.0 1.8 5.5 618 418 A 52 ALA HB% A 52 ALA H 1.0 1.8 3.5 619 419 A 52 ALA HB% A 53 THR H 1.0 1.8 4.5 620 420 A 52 ALA HB% A 54 THR H 1.0 1.8 5.5 621 421 A 53 THR H A 52 ALA HA 1.0 1.8 5.5 622 422 A 52 ALA HB% A 53 THR H 1.0 1.8 4.5 623 423 A 52 ALA HB% A 53 THR HA 1.0 1.8 5.5 624 424 A 53 THR H A 53 THR HA 1.0 1.8 3.5 625 425 A 53 THR H A 53 THR HB 1.0 1.8 5.5 626 426 A 54 THR H A 53 THR HB 1.0 1.8 5.5 627 427 A 53 THR HG2% A 53 THR H 1.0 1.8 3.5 628 428 A 53 THR HG2% A 54 THR H 1.0 1.8 5.5 629 429 A 53 THR HG2% A 55 VAL H 1.0 1.8 5.5 630 430 A 52 ALA HA A 54 THR H 1.0 1.8 4.5 631 431 A 52 ALA HB% A 54 THR H 1.0 1.8 5.5 632 432 A 54 THR H A 54 THR HA 1.0 1.8 3.5 633 433 A 54 THR H A 54 THR HB 1.0 1.8 5.5 634 434 A 54 THR H A 54 THR HG2% 1.0 1.8 3.5 635 435 A 55 VAL H A 54 THR HG2% 1.0 1.8 5.5 636 436 A 55 VAL H A 55 VAL HA 1.0 1.8 4.5 637 437 A 55 VAL H A 56 GLY H 1.0 1.8 3.5 638 438 A 55 VAL H A 55 VAL HA 1.0 1.8 3.5 639 439 A 55 VAL HA A 56 GLY H 1.0 1.8 5.5 640 440 A 55 VAL H A 55 VAL HB 1.0 1.8 3.5 641 441 A 56 GLY H A 55 VAL HB 1.0 1.8 4.5 642 442 A 53 THR HG2% A 55 VAL HGx% 1.0 1.8 4.5 643 442 A 53 THR HG2% A 55 VAL HGy% 1.0 1.8 4.5 644 443 A 55 VAL H A 55 VAL HGx% 1.0 1.8 3.5 645 443 A 55 VAL H A 55 VAL HGy% 1.0 1.8 3.5 646 444 A 56 GLY H A 55 VAL HGx% 1.0 1.8 4.5 647 444 A 56 GLY H A 55 VAL HGy% 1.0 1.8 4.5 648 445 A 56 GLY HA2 A 55 VAL HGx% 1.0 1.8 5.5 649 445 A 55 VAL HGy% A 56 GLY HA2 1.0 1.8 5.5 650 446 A 57 TYR H A 55 VAL HGx% 1.0 1.8 4.5 651 446 A 55 VAL HGy% A 57 TYR H 1.0 1.8 4.5 652 447 A 56 GLY H A 56 GLY HA2 1.0 1.8 4.5 653 448 A 56 GLY H A 57 TYR H 1.0 1.8 4.5 654 449 A 56 GLY H A 56 GLY HA3 1.0 1.8 4.5 655 450 A 56 GLY H A 57 TYR H 1.0 1.8 4.5 656 451 A 57 TYR H A 57 TYR HA 1.0 1.8 5.5 657 452 A 57 TYR H A 58 GLY H 1.0 1.8 4.5 658 453 A 57 TYR H A 57 TYR HA 1.0 1.8 3.5 659 454 A 57 TYR HA A 57 TYR HB3 1.0 1.8 4.5 660 455 A 57 TYR HA A 58 GLY H 1.0 1.8 5.5 661 456 A 57 TYR HA A 57 TYR HB2 1.0 1.8 4.5 662 457 A 57 TYR HB3 A 57 TYR HB2 1.0 1.8 3.5 663 458 A 58 GLY H A 57 TYR HD% 1.0 1.8 5.5 664 459 A 56 GLY HA2 A 58 GLY H 1.0 1.8 5.5 665 460 A 57 TYR HA A 58 GLY H 1.0 1.8 5.5 666 461 A 58 GLY H A 58 GLY HAx 1.0 1.8 3.5 667 461 A 58 GLY H A 58 GLY HAy 1.0 1.8 3.5 668 462 A 58 GLY H A 59 ASP H 1.0 1.8 3.5 669 463 A 59 ASP H A 59 ASP HBx 1.0 1.8 4.5 670 463 A 59 ASP H A 59 ASP HBy 1.0 1.8 4.5 671 464 A 59 ASP H A 59 ASP HA 1.0 1.8 3.5 672 465 A 59 ASP HA A 59 ASP HBx 1.0 1.8 4.5 673 465 A 59 ASP HBy A 59 ASP HA 1.0 1.8 4.5 674 466 A 59 ASP HA A 60 ARG H 1.0 1.8 5.5 675 467 A 59 ASP H A 59 ASP HBx 1.0 1.8 3.5 676 467 A 59 ASP H A 59 ASP HBy 1.0 1.8 3.5 677 468 A 60 ARG H A 59 ASP HBx 1.0 1.8 4.5 678 468 A 59 ASP HBy A 60 ARG H 1.0 1.8 4.5 679 469 A 60 ARG H A 60 ARG HA 1.0 1.8 3.5 680 470 A 60 ARG HA A 61 TYR HBx 1.0 1.8 5.5 681 470 A 60 ARG HA A 61 TYR HBy 1.0 1.8 5.5 682 471 A 60 ARG H A 60 ARG HBx 1.0 1.8 4.5 683 471 A 60 ARG H A 60 ARG HBy 1.0 1.8 4.5 684 472 A 61 TYR H A 60 ARG HGx 1.0 1.8 5.5 685 472 A 60 ARG HGy A 61 TYR H 1.0 1.8 5.5 686 473 A 60 ARG HH1% A 60 ARG HE 1.0 1.8 5.5 687 474 A 60 ARG HE A 60 ARG HH2% 1.0 1.8 5.5 688 475 A 61 TYR HA A 62 PRO HDx 1.0 1.8 4.5 689 475 A 61 TYR HA A 62 PRO HDy 1.0 1.8 4.5 690 476 A 61 TYR HA A 61 TYR HBx 1.0 1.8 4.5 691 476 A 61 TYR HBy A 61 TYR HA 1.0 1.8 4.5 692 477 A 62 PRO HA A 63 VAL H 1.0 1.8 3.5 693 478 A 61 TYR HBy A 62 PRO HDx 1.0 1.8 5.5 694 478 A 61 TYR HBx A 62 PRO HDx 1.0 1.8 5.5 695 478 A 62 PRO HDy A 61 TYR HBx 1.0 1.8 5.5 696 478 A 61 TYR HBy A 62 PRO HDy 1.0 1.8 5.5 697 479 A 62 PRO HA A 62 PRO HDx 1.0 1.8 4.5 698 479 A 62 PRO HDy A 62 PRO HA 1.0 1.8 4.5 699 480 A 63 VAL H A 63 VAL HA 1.0 1.8 4.5 700 481 A 63 VAL H A 63 VAL HB 1.0 1.8 5.5 701 482 A 63 VAL HB A 64 THR H 1.0 1.8 5.5 702 483 A 63 VAL H A 63 VAL HGx% 1.0 1.8 4.5 703 484 A 64 THR H A 63 VAL HGx% 1.0 1.8 5.5 704 485 A 64 THR HG2% A 63 VAL HGx% 1.0 1.8 5.5 705 486 A 64 THR H A 64 THR HA 1.0 1.8 4.5 706 487 A 64 THR HA A 66 GLU H 1.0 1.8 5.5 707 488 A 64 THR H A 64 THR HB 1.0 1.8 5.5 708 489 A 64 THR HB A 65 GLU H 1.0 1.8 4.5 709 490 A 64 THR H A 64 THR HG2% 1.0 1.8 4.5 710 491 A 64 THR HG2% A 65 GLU H 1.0 1.8 5.5 711 492 A 64 THR HG2% A 67 GLY H 1.0 1.8 6.5 712 493 A 65 GLU H A 65 GLU HA 1.0 1.8 3.5 713 494 A 66 GLU H A 65 GLU HA 1.0 1.8 5.5 714 495 A 65 GLU H A 65 GLU HB2 1.0 1.8 4.5 715 496 A 66 GLU H A 65 GLU HB2 1.0 1.8 5.5 716 497 A 65 GLU H A 65 GLU HB3 1.0 1.8 4.5 717 498 A 65 GLU H A 65 GLU HGx 1.0 1.8 5.5 718 498 A 65 GLU H A 65 GLU HGy 1.0 1.8 5.5 719 499 A 67 GLY H A 66 GLU HA 1.0 1.8 5.5 720 500 A 66 GLU H A 66 GLU HBx 1.0 1.8 4.5 721 500 A 66 GLU H A 66 GLU HBy 1.0 1.8 4.5 722 501 A 66 GLU HBx A 66 GLU HGx 1.0 1.8 3.5 723 501 A 66 GLU HBy A 66 GLU HGx 1.0 1.8 3.5 724 501 A 66 GLU HGy A 66 GLU HBx 1.0 1.8 3.5 725 501 A 66 GLU HBy A 66 GLU HGy 1.0 1.8 3.5 726 502 A 67 GLY H A 66 GLU HBx 1.0 1.8 4.5 727 502 A 67 GLY H A 66 GLU HBy 1.0 1.8 4.5 728 503 A 67 GLY H A 66 GLU HGx 1.0 1.8 5.5 729 503 A 67 GLY H A 66 GLU HGy 1.0 1.8 5.5 730 504 A 67 GLY H A 67 GLY HAx 1.0 1.8 3.5 731 504 A 67 GLY H A 67 GLY HAy 1.0 1.8 3.5 732 505 A 67 GLY H A 68 ARG H 1.0 1.8 4.5 733 506 A 68 ARG H A 68 ARG HA 1.0 1.8 4.5 734 507 A 68 ARG HE A 68 ARG HDx 1.0 1.8 3.5 735 507 A 68 ARG HE A 68 ARG HDy 1.0 1.8 3.5 736 508 A 68 ARG HE A 68 ARG HDx 1.0 1.8 3.5 737 508 A 68 ARG HE A 68 ARG HDy 1.0 1.8 3.5 738 509 A 68 ARG HE A 68 ARG HH1% 1.0 1.8 4.5 739 510 A 68 ARG HE A 68 ARG HH2% 1.0 1.8 4.5 740 511 A 69 LYS HA A 69 LYS H 1.0 1.8 3.5 741 512 A 69 LYS HBx A 69 LYS HGx 1.0 1.8 5.5 742 512 A 69 LYS HGy A 69 LYS HBx 1.0 1.8 5.5 743 512 A 69 LYS HBy A 69 LYS HGy 1.0 1.8 5.5 744 512 A 69 LYS HBy A 69 LYS HGx 1.0 1.8 5.5 745 513 A 69 LYS HDx A 69 LYS HEx 1.0 1.8 5.5 746 513 A 69 LYS HDy A 69 LYS HEx 1.0 1.8 5.5 747 513 A 69 LYS HEy A 69 LYS HDx 1.0 1.8 5.5 748 513 A 69 LYS HDy A 69 LYS HEy 1.0 1.8 5.5 749 514 A 70 VAL H A 72 GLU H 1.0 1.8 5.5 750 515 A 70 VAL H A 70 VAL HA 1.0 1.8 3.5 751 516 A 70 VAL HB A 71 ALA HA 1.0 1.8 5.5 752 517 A 70 VAL HB A 71 ALA HB% 1.0 1.8 5.5 753 518 A 71 ALA HA A 70 VAL HGx% 1.0 1.8 4.5 754 519 A 70 VAL HGx% A 71 ALA H 1.0 1.8 4.5 755 520 A 71 ALA HA A 71 ALA H 1.0 1.8 4.5 756 521 A 71 ALA HB% A 71 ALA H 1.0 1.8 4.5 757 522 A 71 ALA HA A 71 ALA H 1.0 1.8 4.5 758 523 A 72 GLU H A 71 ALA HA 1.0 1.8 5.5 759 524 A 71 ALA HB% A 71 ALA H 1.0 1.8 3.5 760 525 A 72 GLU H A 72 GLU HA 1.0 1.8 4.5 761 526 A 71 ALA HB% A 72 GLU HA 1.0 1.8 5.5 762 527 A 72 GLU H A 72 GLU HA 1.0 1.8 4.5 763 528 A 72 GLU HA A 76 LYS H 1.0 1.8 5.5 764 529 A 71 ALA HB% A 72 GLU HBx 1.0 1.8 5.5 765 529 A 71 ALA HB% A 72 GLU HBy 1.0 1.8 5.5 766 530 A 72 GLU H A 72 GLU HBx 1.0 1.8 3.5 767 530 A 72 GLU H A 72 GLU HBy 1.0 1.8 3.5 768 531 A 72 GLU HBy A 72 GLU HGx 1.0 1.8 4.5 769 531 A 72 GLU HGy A 72 GLU HBx 1.0 1.8 4.5 770 531 A 72 GLU HBy A 72 GLU HGy 1.0 1.8 4.5 771 531 A 72 GLU HBx A 72 GLU HGx 1.0 1.8 4.5 772 532 A 72 GLU H A 72 GLU HGx 1.0 1.8 6.5 773 532 A 72 GLU H A 72 GLU HGy 1.0 1.8 6.5 774 533 A 71 ALA H A 73 GLN H 1.0 1.8 5.5 775 534 A 72 GLU HA A 73 GLN H 1.0 1.8 5.5 776 535 A 73 GLN H A 73 GLN HA 1.0 1.8 3.5 777 536 A 73 GLN HA A 77 ALA HB% 1.0 1.8 5.5 778 537 A 73 GLN HE22 A 73 GLN HE21 1.0 1.8 3.5 779 538 A 73 GLN HE21 A 73 GLN HBx 1.0 1.8 4.5 780 538 A 73 GLN HE21 A 73 GLN HBy 1.0 1.8 4.5 781 539 A 73 GLN HE22 A 73 GLN HBx 1.0 1.8 4.5 782 539 A 73 GLN HE22 A 73 GLN HBy 1.0 1.8 4.5 783 540 A 73 GLN HE21 A 73 GLN HGx 1.0 1.8 4.5 784 540 A 73 GLN HE21 A 73 GLN HGy 1.0 1.8 4.5 785 541 A 73 GLN HBy A 73 GLN HGx 1.0 1.8 3.5 786 541 A 73 GLN HBx A 73 GLN HGx 1.0 1.8 3.5 787 541 A 73 GLN HGy A 73 GLN HBx 1.0 1.8 3.5 788 541 A 73 GLN HBy A 73 GLN HGy 1.0 1.8 3.5 789 542 A 74 VAL H A 73 GLN HGx 1.0 1.8 4.5 790 542 A 73 GLN HGy A 74 VAL H 1.0 1.8 4.5 791 543 A 72 GLU HA A 74 VAL H 1.0 1.8 5.5 792 544 A 74 VAL H A 74 VAL HA 1.0 1.8 4.5 793 545 A 74 VAL H A 74 VAL HA 1.0 1.8 4.5 794 546 A 71 ALA HB% A 74 VAL HB 1.0 1.8 5.5 795 547 A 74 VAL H A 74 VAL HB 1.0 1.8 3.5 796 548 A 71 ALA HA A 74 VAL HGx% 1.0 1.8 5.5 797 549 A 74 VAL H A 74 VAL HGx% 1.0 1.8 5.5 798 550 A 74 VAL HGx% A 78 GLY H 1.0 1.8 5.5 799 551 A 71 ALA HA A 74 VAL HGy% 1.0 1.8 4.5 800 552 A 77 ALA HB% A 74 VAL HGy% 1.0 1.8 5.5 801 553 A 71 ALA HB% A 75 MET H 1.0 1.8 5.5 802 554 A 72 GLU HA A 75 MET H 1.0 1.8 5.5 803 555 A 75 MET HA A 79 ILE H 1.0 1.8 5.5 804 556 A 71 ALA HA A 75 MET HE% 1.0 1.8 4.5 805 557 A 71 ALA HB% A 75 MET HE% 1.0 1.8 3.5 806 558 A 75 MET HE% A 72 GLU HGx 1.0 1.8 4.5 807 558 A 72 GLU HGy A 75 MET HE% 1.0 1.8 4.5 808 559 A 72 GLU HA A 76 LYS H 1.0 1.8 5.5 809 560 A 76 LYS H A 76 LYS HA 1.0 1.8 4.5 810 561 A 76 LYS H A 76 LYS HA 1.0 1.8 3.5 811 562 A 76 LYS HA A 77 ALA H 1.0 1.8 5.5 812 563 A 78 GLY H A 76 LYS HA 1.0 1.8 5.5 813 564 A 76 LYS H A 76 LYS HBx 1.0 1.8 4.5 814 564 A 76 LYS H A 76 LYS HBy 1.0 1.8 4.5 815 565 A 76 LYS HBx A 76 LYS HGx 1.0 1.8 5.5 816 565 A 76 LYS HBy A 76 LYS HGx 1.0 1.8 5.5 817 565 A 76 LYS HGy A 76 LYS HBx 1.0 1.8 5.5 818 565 A 76 LYS HBy A 76 LYS HGy 1.0 1.8 5.5 819 566 A 76 LYS HBx A 80 GLU HGx 1.0 1.8 5.5 820 566 A 76 LYS HBy A 80 GLU HGx 1.0 1.8 5.5 821 566 A 80 GLU HGy A 76 LYS HBx 1.0 1.8 5.5 822 566 A 76 LYS HBy A 80 GLU HGy 1.0 1.8 5.5 823 567 A 76 LYS H A 76 LYS HDx 1.0 1.8 5.5 824 567 A 76 LYS H A 76 LYS HDy 1.0 1.8 5.5 825 568 A 77 ALA HA A 76 LYS HDx 1.0 1.8 5.5 826 568 A 76 LYS HDy A 77 ALA HA 1.0 1.8 5.5 827 569 A 76 LYS HDx A 80 GLU HGx 1.0 1.8 5.5 828 569 A 76 LYS HDy A 80 GLU HGx 1.0 1.8 5.5 829 569 A 80 GLU HGy A 76 LYS HDx 1.0 1.8 5.5 830 569 A 80 GLU HGy A 76 LYS HDy 1.0 1.8 5.5 831 570 A 76 LYS HGy A 80 GLU HGx 1.0 1.8 4.5 832 570 A 76 LYS HGx A 80 GLU HGx 1.0 1.8 4.5 833 570 A 80 GLU HGy A 76 LYS HGx 1.0 1.8 4.5 834 570 A 76 LYS HGy A 80 GLU HGy 1.0 1.8 4.5 835 571 A 76 LYS HA A 77 ALA H 1.0 1.8 5.5 836 572 A 77 ALA H A 77 ALA HA 1.0 1.8 4.5 837 573 A 77 ALA HB% A 77 ALA H 1.0 1.8 4.5 838 574 A 79 ILE H A 77 ALA H 1.0 1.8 5.5 839 575 A 77 ALA H A 77 ALA HA 1.0 1.8 4.5 840 576 A 78 GLY H A 77 ALA HA 1.0 1.8 5.5 841 577 A 77 ALA HB% A 77 ALA H 1.0 1.8 3.5 842 578 A 77 ALA HB% A 78 GLY H 1.0 1.8 4.5 843 579 A 78 GLY H A 76 LYS HA 1.0 1.8 5.5 844 580 A 78 GLY H A 77 ALA HA 1.0 1.8 5.5 845 581 A 77 ALA HB% A 78 GLY H 1.0 1.8 4.5 846 582 A 78 GLY H A 78 GLY HAx 1.0 1.8 4.5 847 582 A 78 GLY H A 78 GLY HAy 1.0 1.8 4.5 848 583 A 78 GLY H A 79 ILE H 1.0 1.8 4.5 849 584 A 78 GLY H A 78 GLY HAx 1.0 1.8 3.5 850 584 A 78 GLY H A 78 GLY HAy 1.0 1.8 3.5 851 585 A 79 ILE H A 78 GLY HAx 1.0 1.8 4.5 852 585 A 79 ILE H A 78 GLY HAy 1.0 1.8 4.5 853 586 A 78 GLY H A 79 ILE H 1.0 1.8 4.5 854 587 A 79 ILE H A 79 ILE HA 1.0 1.8 4.5 855 588 A 79 ILE H A 80 GLU H 1.0 1.8 4.5 856 589 A 79 ILE H A 79 ILE HA 1.0 1.8 4.5 857 590 A 79 ILE HA A 80 GLU H 1.0 1.8 5.5 858 591 A 79 ILE HA A 82 PHE HB2 1.0 1.8 5.5 859 592 A 76 LYS H A 79 ILE HD1% 1.0 1.8 5.5 860 593 A 79 ILE HD1% A 76 LYS HBx 1.0 1.8 5.5 861 593 A 76 LYS HBy A 79 ILE HD1% 1.0 1.8 5.5 862 594 A 79 ILE H A 79 ILE HG1x 1.0 1.8 4.5 863 594 A 79 ILE H A 79 ILE HG1y 1.0 1.8 4.5 864 595 A 79 ILE HG2% A 79 ILE HG1x 1.0 1.8 3.5 865 595 A 79 ILE HG1y A 79 ILE HG2% 1.0 1.8 3.5 866 596 A 79 ILE H A 79 ILE HG2% 1.0 1.8 5.5 867 597 A 79 ILE HG2% A 79 ILE HG1x 1.0 1.8 3.5 868 597 A 79 ILE HG1y A 79 ILE HG2% 1.0 1.8 3.5 869 598 A 80 GLU H A 79 ILE HG2% 1.0 1.8 5.5 870 599 A 76 LYS HA A 80 GLU H 1.0 1.8 5.5 871 600 A 80 GLU H A 80 GLU HA 1.0 1.8 4.5 872 601 A 80 GLU HA A 81 VAL H 1.0 1.8 4.5 873 602 A 80 GLU HA A 83 ALA HB% 1.0 1.8 3.5 874 603 A 77 ALA HB% A 80 GLU HBx 1.0 1.8 5.5 875 603 A 77 ALA HB% A 80 GLU HBy 1.0 1.8 5.5 876 604 A 80 GLU H A 80 GLU HBx 1.0 1.8 3.5 877 604 A 80 GLU H A 80 GLU HBy 1.0 1.8 3.5 878 605 A 83 ALA HB% A 80 GLU HBx 1.0 1.8 5.5 879 605 A 83 ALA HB% A 80 GLU HBy 1.0 1.8 5.5 880 606 A 76 LYS HBx A 80 GLU HGx 1.0 1.8 5.5 881 606 A 76 LYS HBy A 80 GLU HGx 1.0 1.8 5.5 882 606 A 80 GLU HGy A 76 LYS HBx 1.0 1.8 5.5 883 606 A 76 LYS HBy A 80 GLU HGy 1.0 1.8 5.5 884 607 A 77 ALA HA A 80 GLU HGx 1.0 1.8 5.5 885 607 A 80 GLU HGy A 77 ALA HA 1.0 1.8 5.5 886 608 A 80 GLU H A 80 GLU HGx 1.0 1.8 4.5 887 608 A 80 GLU HGy A 80 GLU H 1.0 1.8 4.5 888 609 A 77 ALA HA A 81 VAL H 1.0 1.8 5.5 889 610 A 81 VAL H A 78 GLY HAx 1.0 1.8 4.5 890 610 A 78 GLY HAy A 81 VAL H 1.0 1.8 4.5 891 611 A 79 ILE HA A 81 VAL H 1.0 1.8 5.5 892 612 A 81 VAL H A 81 VAL HA 1.0 1.8 3.5 893 613 A 81 VAL H A 81 VAL HB 1.0 1.8 3.5 894 614 A 78 GLY HAy A 81 VAL HGx% 1.0 1.8 5.5 895 614 A 81 VAL HGx% A 78 GLY HAx 1.0 1.8 5.5 896 615 A 81 VAL H A 81 VAL HGx% 1.0 1.8 5.5 897 616 A 84 LEU HBy A 81 VAL HGx% 1.0 1.8 5.5 898 616 A 81 VAL HGx% A 84 LEU HBx 1.0 1.8 5.5 899 617 A 77 ALA HA A 81 VAL HGy% 1.0 1.8 4.5 900 618 A 78 GLY HAx A 81 VAL HGy% 1.0 1.8 5.5 901 618 A 78 GLY HAy A 81 VAL HGy% 1.0 1.8 5.5 902 619 A 79 ILE HA A 82 PHE H 1.0 1.8 5.5 903 620 A 81 VAL HB A 82 PHE HA 1.0 1.8 5.5 904 621 A 82 PHE H A 82 PHE HA 1.0 1.8 4.5 905 622 A 82 PHE HA A 82 PHE HB2 1.0 1.8 5.5 906 623 A 82 PHE HA A 83 ALA H 1.0 1.8 5.5 907 624 A 82 PHE H A 82 PHE HB2 1.0 1.8 4.5 908 625 A 82 PHE HB2 A 82 PHE HB3 1.0 1.8 3.5 909 626 A 83 ALA H A 82 PHE HB2 1.0 1.8 5.5 910 627 A 83 ALA HA A 82 PHE HB2 1.0 1.8 5.5 911 628 A 82 PHE H A 82 PHE HB3 1.0 1.8 5.5 912 629 A 82 PHE HB2 A 82 PHE HB3 1.0 1.8 3.5 913 630 A 83 ALA H A 82 PHE HB3 1.0 1.8 4.5 914 631 A 82 PHE H A 82 PHE HD% 1.0 1.8 4.5 915 632 A 83 ALA H A 83 ALA HA 1.0 1.8 4.5 916 633 A 83 ALA HB% A 83 ALA H 1.0 1.8 4.5 917 634 A 83 ALA HA A 82 PHE HB2 1.0 1.8 5.5 918 635 A 83 ALA H A 83 ALA HA 1.0 1.8 3.5 919 636 A 83 ALA HB% A 83 ALA HA 1.0 1.8 3.5 920 637 A 83 ALA HB% A 83 ALA H 1.0 1.8 3.5 921 638 A 81 VAL HA A 84 LEU H 1.0 1.8 4.5 922 639 A 83 ALA HB% A 84 LEU HA 1.0 1.8 5.5 923 640 A 84 LEU H A 84 LEU HA 1.0 1.8 3.5 924 641 A 84 LEU HA A 84 LEU HBx 1.0 1.8 4.5 925 641 A 84 LEU HBy A 84 LEU HA 1.0 1.8 4.5 926 642 A 84 LEU HA A 86 THR H 1.0 1.8 5.5 927 643 A 84 LEU HG A 85 VAL H 1.0 1.8 5.5 928 644 A 85 VAL H A 84 LEU HBx 1.0 1.8 3.5 929 644 A 84 LEU HBy A 85 VAL H 1.0 1.8 3.5 930 645 A 84 LEU H A 84 LEU HDx% 1.0 1.8 5.5 931 646 A 85 VAL H A 84 LEU HDx% 1.0 1.8 5.5 932 647 A 84 LEU H A 84 LEU HDy% 1.0 1.8 5.5 933 648 A 85 VAL H A 84 LEU HDy% 1.0 1.8 3.5 934 649 A 85 VAL HB A 84 LEU HDy% 1.0 1.8 5.5 935 650 A 86 THR H A 84 LEU HDy% 1.0 1.8 5.5 936 651 A 85 VAL H A 85 VAL HA 1.0 1.8 5.5 937 652 A 86 THR H A 85 VAL HA 1.0 1.8 5.5 938 653 A 85 VAL H A 85 VAL HB 1.0 1.8 3.5 939 654 A 85 VAL HB A 85 VAL HA 1.0 1.8 4.5 940 655 A 86 THR H A 85 VAL HB 1.0 1.8 4.5 941 656 A 84 LEU HBy A 85 VAL HGx% 1.0 1.8 4.5 942 656 A 84 LEU HBx A 85 VAL HGx% 1.0 1.8 4.5 943 656 A 85 VAL HGy% A 84 LEU HBx 1.0 1.8 4.5 944 656 A 84 LEU HBy A 85 VAL HGy% 1.0 1.8 4.5 945 657 A 85 VAL H A 85 VAL HGx% 1.0 1.8 3.5 946 657 A 85 VAL H A 85 VAL HGy% 1.0 1.8 3.5 947 658 A 89 LEU H A 85 VAL HGx% 1.0 1.8 5.5 948 658 A 85 VAL HGy% A 89 LEU H 1.0 1.8 5.5 949 659 A 86 THR H A 85 VAL HB 1.0 1.8 5.5 950 660 A 86 THR H A 86 THR HA 1.0 1.8 3.5 951 661 A 86 THR HA A 87 ALA H 1.0 1.8 5.5 952 662 A 86 THR HA A 88 ALA H 1.0 1.8 5.5 953 663 A 89 LEU H A 86 THR HA 1.0 1.8 4.5 954 664 A 86 THR HA A 89 LEU HBx 1.0 1.8 4.5 955 664 A 86 THR HA A 89 LEU HBy 1.0 1.8 4.5 956 665 A 86 THR HA A 90 ALA H 1.0 1.8 5.5 957 666 A 86 THR H A 86 THR HB 1.0 1.8 3.5 958 667 A 86 THR H A 86 THR HG2% 1.0 1.8 5.5 959 668 A 87 ALA H A 86 THR HG2% 1.0 1.8 4.5 960 669 A 87 ALA H A 87 ALA HB% 1.0 1.8 4.5 961 670 A 87 ALA H A 87 ALA HA 1.0 1.8 3.5 962 671 A 88 ALA H A 87 ALA HA 1.0 1.8 5.5 963 672 A 89 LEU H A 87 ALA HA 1.0 1.8 5.5 964 673 A 87 ALA HA A 91 THR H 1.0 1.8 5.5 965 674 A 87 ALA H A 87 ALA HB% 1.0 1.8 3.5 966 675 A 88 ALA H A 87 ALA HB% 1.0 1.8 3.5 967 676 A 89 LEU H A 87 ALA HB% 1.0 1.8 5.5 968 677 A 85 VAL HA A 88 ALA H 1.0 1.8 5.5 969 678 A 88 ALA H A 88 ALA HA 1.0 1.8 3.5 970 679 A 88 ALA HA A 88 ALA HB% 1.0 1.8 3.5 971 680 A 89 LEU H A 88 ALA HA 1.0 1.8 5.5 972 681 A 88 ALA HA A 92 ASP H 1.0 1.8 5.5 973 682 A 88 ALA H A 88 ALA HB% 1.0 1.8 3.5 974 683 A 89 LEU H A 88 ALA H 1.0 1.8 3.5 975 684 A 88 ALA HB% A 89 LEU HA 1.0 1.8 5.5 976 685 A 89 LEU H A 89 LEU HA 1.0 1.8 3.5 977 686 A 89 LEU HA A 89 LEU HBx 1.0 1.8 4.5 978 686 A 89 LEU HBy A 89 LEU HA 1.0 1.8 4.5 979 687 A 90 ALA H A 89 LEU HA 1.0 1.8 5.5 980 688 A 91 THR H A 89 LEU HA 1.0 1.8 5.5 981 689 A 92 ASP H A 89 LEU HA 1.0 1.8 4.5 982 690 A 89 LEU HA A 92 ASP HBx 1.0 1.8 5.5 983 690 A 89 LEU HA A 92 ASP HBy 1.0 1.8 5.5 984 691 A 86 THR H A 89 LEU HG 1.0 1.8 5.5 985 692 A 86 THR HA A 89 LEU HG 1.0 1.8 5.5 986 693 A 89 LEU H A 89 LEU HBx 1.0 1.8 3.5 987 693 A 89 LEU H A 89 LEU HBy 1.0 1.8 3.5 988 694 A 90 ALA H A 89 LEU HBx 1.0 1.8 4.5 989 694 A 89 LEU HBy A 90 ALA H 1.0 1.8 4.5 990 695 A 90 ALA HA A 89 LEU HBx 1.0 1.8 5.5 991 695 A 89 LEU HBy A 90 ALA HA 1.0 1.8 5.5 992 696 A 91 THR H A 89 LEU HBx 1.0 1.8 5.5 993 696 A 89 LEU HBy A 91 THR H 1.0 1.8 5.5 994 697 A 89 LEU H A 89 LEU HDx% 1.0 1.8 5.5 995 698 A 90 ALA H A 91 THR H 1.0 1.8 3.5 996 699 A 90 ALA HA A 89 LEU HBx 1.0 1.8 5.5 997 699 A 89 LEU HBy A 90 ALA HA 1.0 1.8 5.5 998 700 A 90 ALA H A 90 ALA HA 1.0 1.8 4.5 999 701 A 90 ALA HA A 93 PHE HBx 1.0 1.8 5.5 1000 701 A 90 ALA HA A 93 PHE HBy 1.0 1.8 5.5 1001 702 A 90 ALA H A 90 ALA HB% 1.0 1.8 3.5 1002 703 A 91 THR H A 90 ALA HB% 1.0 1.8 4.5 1003 704 A 91 THR H A 90 ALA HA 1.0 1.8 4.5 1004 705 A 91 THR H A 91 THR HA 1.0 1.8 3.5 1005 706 A 91 THR H A 91 THR HG2% 1.0 1.8 5.5 1006 707 A 92 ASP H A 91 THR HG2% 1.0 1.8 4.5 1007 708 A 88 ALA HA A 92 ASP H 1.0 1.8 5.5 1008 709 A 92 ASP H A 89 LEU HA 1.0 1.8 4.5 1009 710 A 91 THR H A 92 ASP H 1.0 1.8 3.5 1010 711 A 92 ASP H A 91 THR HA 1.0 1.8 5.5 1011 712 A 92 ASP H A 92 ASP HA 1.0 1.8 4.5 1012 713 A 91 THR HG2% A 92 ASP HA 1.0 1.8 4.5 1013 714 A 92 ASP H A 92 ASP HA 1.0 1.8 3.5 1014 715 A 92 ASP HA A 93 PHE H 1.0 1.8 5.5 1015 716 A 92 ASP HA A 94 VAL H 1.0 1.8 5.5 1016 717 A 91 THR H A 92 ASP HBx 1.0 1.8 5.5 1017 717 A 91 THR H A 92 ASP HBy 1.0 1.8 5.5 1018 718 A 92 ASP H A 92 ASP HBx 1.0 1.8 3.5 1019 718 A 92 ASP H A 92 ASP HBy 1.0 1.8 3.5 1020 719 A 93 PHE H A 92 ASP HBx 1.0 1.8 4.5 1021 719 A 92 ASP HBy A 93 PHE H 1.0 1.8 4.5 1022 720 A 94 VAL H A 92 ASP HBx 1.0 1.8 5.5 1023 720 A 92 ASP HBy A 94 VAL H 1.0 1.8 5.5 1024 721 A 90 ALA HA A 93 PHE H 1.0 1.8 4.5 1025 722 A 93 PHE H A 93 PHE HA 1.0 1.8 4.5 1026 723 A 93 PHE H A 93 PHE HA 1.0 1.8 3.5 1027 724 A 93 PHE HA A 93 PHE HBx 1.0 1.8 5.5 1028 724 A 93 PHE HBy A 93 PHE HA 1.0 1.8 5.5 1029 725 A 94 VAL H A 93 PHE HA 1.0 1.8 5.5 1030 726 A 93 PHE H A 93 PHE HBx 1.0 1.8 3.5 1031 726 A 93 PHE HBy A 93 PHE H 1.0 1.8 3.5 1032 727 A 94 VAL H A 93 PHE HBx 1.0 1.8 4.5 1033 727 A 93 PHE HBy A 94 VAL H 1.0 1.8 4.5 1034 728 A 90 ALA HA A 93 PHE HD% 1.0 1.8 3.5 1035 729 A 93 PHE H A 93 PHE HD% 1.0 1.8 4.5 1036 730 A 94 VAL H A 93 PHE HD% 1.0 1.8 5.5 1037 731 A 93 PHE HD% A 96 ARG HDx 1.0 1.8 5.5 1038 731 A 93 PHE HD% A 96 ARG HDy 1.0 1.8 5.5 1039 732 A 94 VAL H A 95 ARG H 1.0 1.8 3.5 1040 733 A 94 VAL H A 94 VAL HA 1.0 1.8 3.5 1041 734 A 95 ARG H A 94 VAL HA 1.0 1.8 5.5 1042 735 A 95 ARG H A 94 VAL HB 1.0 1.8 3.5 1043 736 A 90 ALA HB% A 94 VAL HGx% 1.0 1.8 4.5 1044 736 A 90 ALA HB% A 94 VAL HGy% 1.0 1.8 4.5 1045 737 A 91 THR HG2% A 94 VAL HGx% 1.0 1.8 5.5 1046 737 A 91 THR HG2% A 94 VAL HGy% 1.0 1.8 5.5 1047 738 A 94 VAL H A 94 VAL HGx% 1.0 1.8 3.5 1048 738 A 94 VAL H A 94 VAL HGy% 1.0 1.8 3.5 1049 739 A 94 VAL H A 95 ARG H 1.0 1.8 3.5 1050 740 A 95 ARG H A 95 ARG HA 1.0 1.8 4.5 1051 741 A 95 ARG HE A 95 ARG HDx 1.0 1.8 4.5 1052 741 A 95 ARG HE A 95 ARG HDy 1.0 1.8 4.5 1053 742 A 96 ARG H A 95 ARG HBx 1.0 1.8 3.5 1054 742 A 95 ARG HBy A 96 ARG H 1.0 1.8 3.5 1055 743 A 95 ARG HE A 95 ARG HH1% 1.0 1.8 4.5 1056 744 A 95 ARG HE A 95 ARG HH2% 1.0 1.8 4.5 1057 745 A 96 ARG H A 96 ARG HA 1.0 1.8 4.5 1058 746 A 96 ARG H A 96 ARG HDx 1.0 1.8 5.5 1059 746 A 96 ARG HDy A 96 ARG H 1.0 1.8 5.5 1060 747 A 96 ARG HA A 100 ARG H 1.0 1.8 5.5 1061 748 A 96 ARG H A 96 ARG HA 1.0 1.8 4.5 1062 749 A 96 ARG HE A 96 ARG HDx 1.0 1.8 3.5 1063 749 A 96 ARG HDy A 96 ARG HE 1.0 1.8 3.5 1064 750 A 96 ARG H A 96 ARG HBx 1.0 1.8 3.5 1065 750 A 96 ARG H A 96 ARG HBy 1.0 1.8 3.5 1066 751 A 96 ARG H A 96 ARG HDx 1.0 1.8 5.5 1067 751 A 96 ARG HDy A 96 ARG H 1.0 1.8 5.5 1068 752 A 96 ARG HE A 96 ARG HDx 1.0 1.8 3.5 1069 752 A 96 ARG HDy A 96 ARG HE 1.0 1.8 3.5 1070 753 A 96 ARG H A 96 ARG HGx 1.0 1.8 5.5 1071 753 A 96 ARG H A 96 ARG HGy 1.0 1.8 5.5 1072 754 A 96 ARG HE A 96 ARG HGx 1.0 1.8 3.5 1073 754 A 96 ARG HE A 96 ARG HGy 1.0 1.8 3.5 1074 755 A 97 GLU H A 96 ARG HGx 1.0 1.8 5.5 1075 755 A 96 ARG HGy A 97 GLU H 1.0 1.8 5.5 1076 756 A 96 ARG HE A 96 ARG HH1% 1.0 1.8 4.5 1077 757 A 96 ARG HE A 96 ARG HH2% 1.0 1.8 4.5 1078 758 A 96 ARG HA A 97 GLU H 1.0 1.8 5.5 1079 759 A 97 GLU H A 97 GLU HA 1.0 1.8 4.5 1080 760 A 97 GLU HA A 100 ARG HBx 1.0 1.8 4.5 1081 760 A 97 GLU HA A 100 ARG HBy 1.0 1.8 4.5 1082 761 A 97 GLU H A 97 GLU HA 1.0 1.8 4.5 1083 762 A 97 GLU HA A 98 GLU H 1.0 1.8 5.5 1084 763 A 97 GLU H A 97 GLU HBx 1.0 1.8 3.5 1085 763 A 97 GLU H A 97 GLU HBy 1.0 1.8 3.5 1086 764 A 98 GLU H A 97 GLU HBx 1.0 1.8 3.5 1087 764 A 98 GLU H A 97 GLU HBy 1.0 1.8 3.5 1088 765 A 97 GLU HBy A 98 GLU HGx 1.0 1.8 4.5 1089 765 A 97 GLU HBx A 98 GLU HGx 1.0 1.8 4.5 1090 765 A 98 GLU HGy A 97 GLU HBx 1.0 1.8 4.5 1091 765 A 97 GLU HBy A 98 GLU HGy 1.0 1.8 4.5 1092 766 A 97 GLU H A 97 GLU HGx 1.0 1.8 5.5 1093 766 A 97 GLU H A 97 GLU HGy 1.0 1.8 5.5 1094 767 A 97 GLU HBx A 97 GLU HGx 1.0 1.8 3.5 1095 767 A 97 GLU HBy A 97 GLU HGx 1.0 1.8 3.5 1096 767 A 97 GLU HGy A 97 GLU HBx 1.0 1.8 3.5 1097 767 A 97 GLU HBy A 97 GLU HGy 1.0 1.8 3.5 1098 768 A 97 GLU HA A 98 GLU H 1.0 1.8 5.5 1099 769 A 98 GLU H A 98 GLU HA 1.0 1.8 4.5 1100 770 A 98 GLU HA A 101 ARG H 1.0 1.8 5.5 1101 771 A 98 GLU HA A 101 ARG HBx 1.0 1.8 4.5 1102 771 A 98 GLU HA A 101 ARG HBy 1.0 1.8 4.5 1103 772 A 98 GLU H A 98 GLU HA 1.0 1.8 4.5 1104 773 A 98 GLU H A 98 GLU HBx 1.0 1.8 3.5 1105 773 A 98 GLU H A 98 GLU HBy 1.0 1.8 3.5 1106 774 A 98 GLU HBx A 98 GLU HGx 1.0 1.8 3.5 1107 774 A 98 GLU HBy A 98 GLU HGx 1.0 1.8 3.5 1108 774 A 98 GLU HGy A 98 GLU HBx 1.0 1.8 3.5 1109 774 A 98 GLU HGy A 98 GLU HBy 1.0 1.8 3.5 1110 775 A 99 GLU H A 98 GLU HBx 1.0 1.8 4.5 1111 775 A 98 GLU HBy A 99 GLU H 1.0 1.8 4.5 1112 776 A 98 GLU H A 98 GLU HGx 1.0 1.8 4.5 1113 776 A 98 GLU H A 98 GLU HGy 1.0 1.8 4.5 1114 777 A 99 GLU HA A 102 GLY HAx 1.0 1.8 5.5 1115 777 A 99 GLU HA A 102 GLY HAy 1.0 1.8 5.5 1116 778 A 99 GLU H A 99 GLU HA 1.0 1.8 4.5 1117 779 A 99 GLU H A 99 GLU HBx 1.0 1.8 4.5 1118 779 A 99 GLU H A 99 GLU HBy 1.0 1.8 4.5 1119 780 A 99 GLU HBx A 99 GLU HGx 1.0 1.8 3.5 1120 780 A 99 GLU HBy A 99 GLU HGx 1.0 1.8 3.5 1121 780 A 99 GLU HGy A 99 GLU HBx 1.0 1.8 3.5 1122 780 A 99 GLU HBy A 99 GLU HGy 1.0 1.8 3.5 1123 781 A 99 GLU H A 99 GLU HGx 1.0 1.8 5.5 1124 781 A 99 GLU H A 99 GLU HGy 1.0 1.8 5.5 1125 782 A 100 ARG H A 99 GLU H 1.0 1.8 4.5 1126 783 A 100 ARG H A 99 GLU HA 1.0 1.8 5.5 1127 784 A 100 ARG H A 100 ARG HA 1.0 1.8 4.5 1128 785 A 100 ARG HA A 100 ARG HBx 1.0 1.8 4.5 1129 785 A 100 ARG HBy A 100 ARG HA 1.0 1.8 4.5 1130 786 A 101 ARG H A 100 ARG HBx 1.0 1.8 4.5 1131 786 A 100 ARG HBy A 101 ARG H 1.0 1.8 4.5 1132 787 A 100 ARG HH1% A 100 ARG HE 1.0 1.8 4.5 1133 788 A 100 ARG HH1% A 101 ARG HE 1.0 1.8 4.5 1134 789 A 100 ARG HE A 100 ARG HH2% 1.0 1.8 4.5 1135 790 A 101 ARG HE A 100 ARG HH2% 1.0 1.8 4.5 1136 791 A 97 GLU HA A 101 ARG H 1.0 1.8 5.5 1137 792 A 98 GLU HA A 101 ARG H 1.0 1.8 5.5 1138 793 A 101 ARG HA A 100 ARG HBx 1.0 1.8 5.5 1139 793 A 100 ARG HBy A 101 ARG HA 1.0 1.8 5.5 1140 794 A 101 ARG H A 101 ARG HA 1.0 1.8 4.5 1141 795 A 101 ARG HA A 101 ARG HBx 1.0 1.8 4.5 1142 795 A 101 ARG HBy A 101 ARG HA 1.0 1.8 4.5 1143 796 A 101 ARG H A 101 ARG HBx 1.0 1.8 3.5 1144 796 A 101 ARG H A 101 ARG HBy 1.0 1.8 3.5 1145 797 A 101 ARG HBy A 101 ARG HGx 1.0 1.8 3.5 1146 797 A 101 ARG HGy A 101 ARG HBx 1.0 1.8 3.5 1147 797 A 101 ARG HBy A 101 ARG HGy 1.0 1.8 3.5 1148 797 A 101 ARG HBx A 101 ARG HGx 1.0 1.8 3.5 1149 798 A 102 GLY H A 101 ARG HBx 1.0 1.8 5.5 1150 798 A 101 ARG HBy A 102 GLY H 1.0 1.8 5.5 1151 799 A 101 ARG H A 101 ARG HGx 1.0 1.8 3.5 1152 799 A 101 ARG H A 101 ARG HGy 1.0 1.8 3.5 1153 800 A 102 GLY H A 101 ARG HGx 1.0 1.8 5.5 1154 800 A 101 ARG HGy A 102 GLY H 1.0 1.8 5.5 1155 801 A 101 ARG HE A 101 ARG HH1% 1.0 1.8 4.5 1156 802 A 101 ARG HE A 101 ARG HH2% 1.0 1.8 4.5 1157 803 A 100 ARG HA A 102 GLY H 1.0 1.8 5.5 1158 804 A 102 GLY H A 101 ARG HBx 1.0 1.8 5.5 1159 804 A 101 ARG HBy A 102 GLY H 1.0 1.8 5.5 1160 805 A 101 ARG HBx A 102 GLY HAx 1.0 1.8 4.5 1161 805 A 101 ARG HBy A 102 GLY HAx 1.0 1.8 4.5 1162 805 A 102 GLY HAy A 101 ARG HBx 1.0 1.8 4.5 1163 805 A 101 ARG HBy A 102 GLY HAy 1.0 1.8 4.5 1164 806 A 102 GLY H A 102 GLY HAx 1.0 1.8 3.5 1165 806 A 102 GLY HAy A 102 GLY H 1.0 1.8 3.5 1166 807 A 103 HIS H A 102 GLY HAx 1.0 1.8 3.5 1167 807 A 102 GLY HAy A 103 HIS H 1.0 1.8 3.5 1168 808 A 99 GLU HA A 103 HIS H 1.0 1.8 4.5 1169 809 A 103 HIS H A 103 HIS HA 1.0 1.8 4.5 1170 810 A 103 HIS H A 103 HIS HB2 1.0 1.8 4.5 1171 811 A 103 HIS HB2 A 103 HIS HB3 1.0 1.8 3.5 1172 812 A 103 HIS H A 103 HIS HB3 1.0 1.8 4.5 1173 813 A 103 HIS HB2 A 103 HIS HB3 1.0 1.8 3.5 1174 814 A 47 TRP HE1 A 38 LEU HDx% 1.0 1.8 5.5 1175 814 A 38 LEU HDy% A 47 TRP HE1 1.0 1.8 5.5 1176 815 A 1 SER H1 A 6 ARG HDx 1.0 1.8 5.5 1177 815 A 1 SER H1 A 6 ARG HDy 1.0 1.8 5.5 1178 816 A 6 ARG H A 1 SER HBx 1.0 1.8 6.5 1179 816 A 1 SER HBy A 6 ARG H 1.0 1.8 6.5 1180 817 A 15 LEU H A 81 VAL HGx% 1.0 1.8 4.5 1181 818 A 51 THR HA A 56 GLY H 1.0 1.8 4.5 1182 819 A 15 LEU HDx% A 78 GLY H 1.0 1.8 5.5 1183 820 A 12 GLU H A 81 VAL HGx% 1.0 1.8 4.5 1184 821 A 12 GLU H A 85 VAL HGx% 1.0 1.8 4.5 1185 821 A 12 GLU H A 85 VAL HGy% 1.0 1.8 4.5 1186 822 A 36 ALA H A 63 VAL HGx% 1.0 1.8 4.5 1187 823 A 44 ALA H A 38 LEU HDx% 1.0 1.8 4.5 1188 823 A 38 LEU HDy% A 44 ALA H 1.0 1.8 4.5 1189 824 A 48 SER H A 38 LEU HDx% 1.0 1.8 4.5 1190 824 A 38 LEU HDy% A 48 SER H 1.0 1.8 4.5 1191 825 A 2 ALA HB% A 95 ARG HE 1.0 1.8 5.5 1192 826 A 52 ALA HB% A 78 GLY H 1.0 1.8 4.5 1193 827 A 5 GLU HA A 88 ALA HB% 1.0 1.8 3.5 1194 828 A 47 TRP HE1 A 61 TYR HA 1.0 1.8 5.5 1195 829 A 47 TRP HZ2 A 71 ALA HA 1.0 1.8 3.5 1196 830 A 47 TRP HZ2 A 71 ALA HA 1.0 1.8 3.5 1197 831 A 71 ALA HA A 47 TRP HH2 1.0 1.8 3.5 1198 832 A 8 ALA HA A 85 VAL HA 1.0 1.8 3.5 1199 833 A 29 ALA HA A 66 GLU HBx 1.0 1.8 3.5 1200 833 A 29 ALA HA A 66 GLU HBy 1.0 1.8 3.5 1201 834 A 77 ALA HA A 18 VAL HGx% 1.0 1.8 4.5 1202 834 A 18 VAL HGy% A 77 ALA HA 1.0 1.8 4.5 1203 835 A 8 ALA HA A 85 VAL HGx% 1.0 1.8 3.5 1204 835 A 8 ALA HA A 85 VAL HGy% 1.0 1.8 3.5 1205 836 A 8 ALA HA A 84 LEU HDy% 1.0 1.8 3.5 1206 837 A 8 ALA HA A 85 VAL HGx% 1.0 1.8 3.5 1207 837 A 8 ALA HA A 85 VAL HGy% 1.0 1.8 3.5 1208 838 A 52 ALA HA A 74 VAL HGx% 1.0 1.8 3.5 1209 839 A 8 ALA HA A 84 LEU HDy% 1.0 1.8 3.5 1210 840 A 15 LEU HDx% A 78 GLY HAx 1.0 1.8 4.5 1211 840 A 15 LEU HDx% A 78 GLY HAy 1.0 1.8 4.5 1212 841 A 15 LEU HDy% A 78 GLY HAx 1.0 1.8 4.5 1213 841 A 78 GLY HAy A 15 LEU HDy% 1.0 1.8 4.5 1214 842 A 15 LEU HDy% A 78 GLY HAx 1.0 1.8 4.5 1215 842 A 78 GLY HAy A 15 LEU HDy% 1.0 1.8 4.5 1216 843 A 54 THR HG2% A 78 GLY HAx 1.0 1.8 5.5 1217 843 A 54 THR HG2% A 78 GLY HAy 1.0 1.8 5.5 1218 844 A 39 ILE HB A 31 ARG HDx 1.0 1.8 4.5 1219 844 A 31 ARG HDy A 39 ILE HB 1.0 1.8 4.5 1220 845 A 39 ILE HB A 31 ARG HDx 1.0 1.8 4.5 1221 845 A 31 ARG HDy A 39 ILE HB 1.0 1.8 4.5 1222 846 A 43 ASP HB2 A 60 ARG HDx 1.0 1.8 5.5 1223 846 A 43 ASP HB2 A 60 ARG HDy 1.0 1.8 5.5 1224 847 A 43 ASP HB3 A 60 ARG HDx 1.0 1.8 6.5 1225 847 A 43 ASP HB3 A 60 ARG HDy 1.0 1.8 6.5 1226 848 A 84 LEU HG A 7 GLU HGx 1.0 1.8 4.5 1227 848 A 7 GLU HGy A 84 LEU HG 1.0 1.8 4.5 1228 849 A 38 LEU HBx A 60 ARG HDx 1.0 1.8 5.5 1229 849 A 60 ARG HDy A 38 LEU HBx 1.0 1.8 5.5 1230 849 A 38 LEU HBy A 60 ARG HDy 1.0 1.8 5.5 1231 849 A 38 LEU HBy A 60 ARG HDx 1.0 1.8 5.5 1232 850 A 54 THR HG2% A 79 ILE HG1x 1.0 1.8 3.5 1233 850 A 54 THR HG2% A 79 ILE HG1y 1.0 1.8 3.5 1234 851 A 77 ALA HB% A 18 VAL HGx% 1.0 1.8 5.5 1235 851 A 18 VAL HGy% A 77 ALA HB% 1.0 1.8 5.5 1236 852 A 11 ALA HB% A 81 VAL HGy% 1.0 1.8 4.5 1237 853 A 77 ALA HB% A 18 VAL HGx% 1.0 1.8 4.5 1238 853 A 18 VAL HGy% A 77 ALA HB% 1.0 1.8 4.5 1239 854 A 29 ALA HB% A 70 VAL HGy% 1.0 1.8 4.5 1240 855 A 5 GLU H A 88 ALA HB% 1.0 1.8 4.5 1241 856 A 52 ALA HB% A 78 GLY H 1.0 1.8 4.5 1242 857 A 52 ALA HB% A 82 PHE HE% 1.0 1.8 4.5 1243 858 A 52 ALA HB% A 82 PHE HE% 1.0 1.8 4.5 1244 859 A 71 ALA HB% A 47 TRP HH2 1.0 1.8 5.5 1245 860 A 26 ALA HB% A 47 TRP HE3 1.0 1.8 5.5 1246 861 A 2 ALA HB% A 95 ARG HE 1.0 1.8 5.5 1247 862 A 5 GLU HA A 88 ALA HB% 1.0 1.8 4.5 1248 863 A 52 ALA HB% A 82 PHE HE% 1.0 1.8 4.5 1249 864 A 8 ALA HB% A 85 VAL HA 1.0 1.8 3.5 1250 865 A 4 HIS HB2 A 88 ALA HB% 1.0 1.8 3.5 1251 866 A 71 ALA HB% A 62 PRO HGx 1.0 1.8 4.5 1252 866 A 71 ALA HB% A 62 PRO HGy 1.0 1.8 4.5 1253 867 A 18 VAL HB A 77 ALA HB% 1.0 1.8 3.5 1254 868 A 71 ALA HB% A 62 PRO HGx 1.0 1.8 3.5 1255 868 A 71 ALA HB% A 62 PRO HGy 1.0 1.8 3.5 1256 869 A 18 VAL HB A 77 ALA HB% 1.0 1.8 3.5 1257 870 A 52 ALA HB% A 19 LEU HDy% 1.0 1.8 4.5 1258 871 A 26 ALA HB% A 44 ALA HB% 1.0 1.8 4.5 1259 872 A 54 THR HG2% A 79 ILE HD1% 1.0 1.8 3.5 1260 873 A 53 THR HG2% A 15 LEU HDy% 1.0 1.8 4.5 1261 874 A 51 THR HG2% A 74 VAL HGx% 1.0 1.8 3.5 1262 875 A 54 THR HG2% A 79 ILE HD1% 1.0 1.8 3.5 1263 876 A 45 ILE HD1% A 19 LEU HDy% 1.0 1.8 6.5 1264 877 A 45 ILE HD1% A 19 LEU HDy% 1.0 1.8 6.5 1265 878 A 15 LEU H A 81 VAL HGx% 1.0 1.8 4.5 1266 879 A 15 LEU H A 81 VAL HGx% 1.0 1.8 4.5 1267 880 A 8 ALA H A 88 ALA HB% 1.0 1.8 4.5 1268 881 A 8 ALA H A 88 ALA HB% 1.0 1.8 4.5 1269 882 A 52 ALA HA A 78 GLY H 1.0 1.8 4.5 1270 883 A 52 ALA HA A 78 GLY H 1.0 1.8 4.5 1271 884 A 61 TYR H A 38 LEU HDx% 1.0 1.8 4.5 1272 884 A 38 LEU HDy% A 61 TYR H 1.0 1.8 4.5 1273 885 A 37 ALA HB% A 60 ARG HA 1.0 1.8 4.5 1274 886 A 26 ALA HA A 38 LEU HDx% 1.0 1.8 4.5 1275 886 A 26 ALA HA A 38 LEU HDy% 1.0 1.8 4.5 1276 887 A 26 ALA HA A 38 LEU HDx% 1.0 1.8 4.5 1277 887 A 26 ALA HA A 38 LEU HDy% 1.0 1.8 4.5 1278 888 A 51 THR HG2% A 74 VAL HGy% 1.0 1.8 4.5 1279 889 A 26 ALA HA A 70 VAL HGy% 1.0 1.8 4.5 1280 890 A 26 ALA HA A 70 VAL HGy% 1.0 1.8 4.5 1281 891 A 82 PHE H A 15 LEU HDy% 1.0 1.8 4.5 1282 892 A 54 THR HG2% A 79 ILE H 1.0 1.8 4.5 1283 893 A 88 ALA HB% A 5 GLU HGx 1.0 1.8 4.5 1284 893 A 5 GLU HGy A 88 ALA HB% 1.0 1.8 4.5 1285 894 A 52 ALA HB% A 75 MET HA 1.0 1.8 5.5 1286 895 A 52 ALA HB% A 75 MET HA 1.0 1.8 5.5 1287 896 A 15 LEU HDx% A 52 ALA HA 1.0 1.8 5.5 1288 897 A 15 LEU HDx% A 52 ALA HA 1.0 1.8 5.5 1289 898 A 63 VAL H A 30 GLU HGx 1.0 1.8 5.5 1290 898 A 30 GLU HGy A 63 VAL H 1.0 1.8 5.5 1291 899 A 15 LEU HDx% A 81 VAL HB 1.0 1.8 5.5 1292 900 A 26 ALA HA A 70 VAL HGx% 1.0 1.8 5.5 1293 901 A 26 ALA HA A 70 VAL HGx% 1.0 1.8 5.5 1294 902 A 77 ALA HB% A 14 GLU HGx 1.0 1.8 5.5 1295 902 A 14 GLU HGy A 77 ALA HB% 1.0 1.8 5.5 1296 903 A 4 HIS HB3 A 88 ALA HB% 1.0 1.8 5.5 1297 904 A 4 HIS HB3 A 88 ALA HB% 1.0 1.8 5.5 1298 905 A 52 ALA HB% A 18 VAL HGx% 1.0 1.8 5.5 1299 905 A 18 VAL HGy% A 52 ALA HB% 1.0 1.8 5.5 1300 906 A 52 ALA HB% A 18 VAL HGx% 1.0 1.8 5.5 1301 906 A 18 VAL HGy% A 52 ALA HB% 1.0 1.8 5.5 1302 907 A 47 TRP HE1 A 71 ALA HB% 1.0 1.8 5.5 1303 908 A 49 VAL H A 19 LEU HDx% 1.0 1.8 5.5 1304 909 A 47 TRP HB3 A 60 ARG HGx 1.0 1.8 5.5 1305 909 A 47 TRP HB3 A 60 ARG HGy 1.0 1.8 5.5 1306 910 A 8 ALA HA A 85 VAL H 1.0 1.8 5.5 1307 911 A 35 GLY HAy A 63 VAL HGx% 1.0 1.8 5.5 1308 911 A 63 VAL HGx% A 35 GLY HAx 1.0 1.8 5.5 1309 912 A 15 LEU HDx% A 77 ALA HA 1.0 1.8 5.5 1310 913 A 15 LEU HDx% A 77 ALA HA 1.0 1.8 5.5 1311 914 A 33 ALA HB% A 63 VAL HB 1.0 1.8 5.5 1312 915 A 33 ALA HB% A 63 VAL HB 1.0 1.8 5.5 1313 916 A 8 ALA HA A 84 LEU HBx 1.0 1.8 5.5 1314 916 A 8 ALA HA A 84 LEU HBy 1.0 1.8 5.5 1315 917 A 8 ALA HA A 84 LEU HBx 1.0 1.8 5.5 1316 917 A 8 ALA HA A 84 LEU HBy 1.0 1.8 5.5 1317 918 A 8 ALA HA A 84 LEU HBx 1.0 1.8 5.5 1318 918 A 8 ALA HA A 84 LEU HBy 1.0 1.8 5.5 1319 919 A 22 ALA HB% A 71 ALA HA 1.0 1.8 5.5 1320 920 A 22 ALA HB% A 71 ALA HA 1.0 1.8 5.5 1321 921 A 52 ALA HA A 75 MET HBx 1.0 1.8 5.5 1322 921 A 52 ALA HA A 75 MET HBy 1.0 1.8 5.5 1323 922 A 53 THR HG2% A 19 LEU HDy% 1.0 1.8 5.5 1324 923 A 53 THR HG2% A 19 LEU HDy% 1.0 1.8 5.5 1325 924 A 38 LEU HA A 61 TYR H 1.0 1.8 5.5 1326 925 A 38 LEU HA A 61 TYR H 1.0 1.8 5.5 1327 926 A 52 ALA HA A 19 LEU HDy% 1.0 1.8 5.5 1328 927 A 52 ALA HA A 19 LEU HDy% 1.0 1.8 5.5 1329 928 A 98 GLU HA A 103 HIS H 1.0 1.8 5.5 1330 929 A 52 ALA HB% A 74 VAL HB 1.0 1.8 5.5 1331 930 A 78 GLY HAy A 19 LEU HDy% 1.0 1.8 5.5 1332 930 A 19 LEU HDy% A 78 GLY HAx 1.0 1.8 5.5 1333 931 A 49 VAL HB A 19 LEU HDy% 1.0 1.8 5.5 1334 932 A 26 ALA HB% A 44 ALA HA 1.0 1.8 5.5 1335 933 A 26 ALA HB% A 44 ALA HA 1.0 1.8 5.5 1336 934 A 33 ALA HB% A 63 VAL HGx% 1.0 1.8 5.5 1337 935 A 7 GLU H A 88 ALA HB% 1.0 1.8 5.5 1338 936 A 8 ALA HB% A 88 ALA HA 1.0 1.8 5.5 1339 937 A 53 THR HG2% A 19 LEU HDx% 1.0 1.8 5.5 1340 938 A 53 THR HG2% A 19 LEU HDx% 1.0 1.8 5.5 1341 939 A 18 VAL H A 77 ALA HB% 1.0 1.8 5.5 1342 940 A 26 ALA HA A 62 PRO HBx 1.0 1.8 5.5 1343 940 A 26 ALA HA A 62 PRO HBy 1.0 1.8 5.5 1344 941 A 29 ALA H A 66 GLU HBx 1.0 1.8 5.5 1345 941 A 29 ALA H A 66 GLU HBy 1.0 1.8 5.5 1346 942 A 51 THR HG2% A 19 LEU HDy% 1.0 1.8 5.5 1347 943 A 26 ALA HB% A 62 PRO HDx 1.0 1.8 5.5 1348 943 A 26 ALA HB% A 62 PRO HDy 1.0 1.8 5.5 1349 944 A 14 GLU H A 81 VAL HGx% 1.0 1.8 5.5 1350 945 A 52 ALA HA A 15 LEU HDy% 1.0 1.8 5.5 1351 946 A 88 ALA HB% A 5 GLU HBx 1.0 1.8 5.5 1352 946 A 5 GLU HBy A 88 ALA HB% 1.0 1.8 5.5 1353 947 A 15 LEU HDx% A 53 THR HG2% 1.0 1.8 5.5 1354 948 A 15 LEU HDx% A 53 THR HG2% 1.0 1.8 5.5 1355 949 A 15 LEU HDx% A 53 THR HG2% 1.0 1.8 5.5 1356 950 A 11 ALA HB% A 82 PHE H 1.0 1.8 5.5 1357 951 A 26 ALA HB% A 48 SER HBx 1.0 1.8 5.5 1358 951 A 26 ALA HB% A 48 SER HBy 1.0 1.8 5.5 1359 952 A 36 ALA HA A 63 VAL HB 1.0 1.8 5.5 1360 953 A 36 ALA HA A 63 VAL HB 1.0 1.8 5.5 1361 954 A 33 ALA HB% A 64 THR H 1.0 1.8 5.5 1362 955 A 52 ALA HA A 74 VAL HB 1.0 1.8 5.5 1363 956 A 71 ALA HA A 62 PRO HGx 1.0 1.8 5.5 1364 956 A 71 ALA HA A 62 PRO HGy 1.0 1.8 5.5 1365 957 A 18 VAL HB A 52 ALA HB% 1.0 1.8 5.5 1366 958 A 18 VAL HB A 52 ALA HB% 1.0 1.8 5.5 1367 959 A 51 THR HB A 71 ALA HB% 1.0 1.8 5.5 1368 960 A 51 THR HB A 71 ALA HB% 1.0 1.8 5.5 1369 961 A 8 ALA HB% A 85 VAL HB 1.0 1.8 5.5 1370 962 A 50 GLU H A 19 LEU HDy% 1.0 1.8 5.5 1371 963 A 52 ALA HB% A 75 MET H 1.0 1.8 5.5 1372 964 A 8 ALA HA A 84 LEU HG 1.0 1.8 5.5 1373 965 A 8 ALA HA A 84 LEU HG 1.0 1.8 5.5 1374 966 A 15 LEU HA A 52 ALA HB% 1.0 1.8 5.5 1375 967 A 15 LEU HA A 52 ALA HB% 1.0 1.8 5.5 1376 968 A 39 ILE H A 30 GLU HGx 1.0 1.8 5.5 1377 968 A 30 GLU HGy A 39 ILE H 1.0 1.8 5.5 1378 969 A 54 THR H A 79 ILE HG1x 1.0 1.8 5.5 1379 969 A 54 THR H A 79 ILE HG1y 1.0 1.8 5.5 1380 970 A 52 ALA HB% A 19 LEU HBx 1.0 1.8 5.5 1381 970 A 19 LEU HBy A 52 ALA HB% 1.0 1.8 5.5 1382 971 A 29 ALA HA A 67 GLY H 1.0 1.8 5.5 1383 972 A 29 ALA HA A 67 GLY H 1.0 1.8 5.5 1384 973 A 52 ALA HA A 77 ALA HB% 1.0 1.8 5.5 1385 974 A 52 ALA HA A 77 ALA HB% 1.0 1.8 5.5 1386 975 A 9 GLN H A 88 ALA HB% 1.0 1.8 5.5 1387 976 A 9 GLN H A 88 ALA HB% 1.0 1.8 5.5 1388 977 A 15 LEU H A 81 VAL HB 1.0 1.8 6.5 1389 978 A 26 ALA HB% A 74 VAL HGy% 1.0 1.8 6.5 1390 979 A 15 LEU H A 81 VAL HB 1.0 1.8 6.5 1391 980 A 15 LEU H A 77 ALA HB% 1.0 1.8 6.5 1392 981 A 15 LEU H A 77 ALA HB% 1.0 1.8 6.5 1393 982 A 15 LEU HDx% A 79 ILE H 1.0 1.8 6.5 1394 983 A 4 HIS HB2 A 87 ALA HB% 1.0 1.8 6.5 1395 984 A 11 ALA HB% A 85 VAL HB 1.0 1.8 6.5 1396 985 A 77 ALA HB% A 14 GLU HBx 1.0 1.8 6.5 1397 985 A 14 GLU HBy A 77 ALA HB% 1.0 1.8 6.5 1398 986 A 77 ALA HB% A 14 GLU HBx 1.0 1.8 6.5 1399 986 A 14 GLU HBy A 77 ALA HB% 1.0 1.8 6.5 1400 987 A 18 VAL HA A 77 ALA HB% 1.0 1.8 6.5 1401 988 A 18 VAL HA A 77 ALA HB% 1.0 1.8 6.5 1402 989 A 33 ALA HB% A 63 VAL H 1.0 1.8 6.5 1403 990 A 41 TYR HE% A 24 LYS HEx 1.0 1.8 6.5 1404 990 A 24 LYS HEy A 41 TYR HE% 1.0 1.8 6.5 1405 991 A 55 VAL HB A 50 GLU HGx 1.0 1.8 6.5 1406 991 A 50 GLU HGy A 55 VAL HB 1.0 1.8 6.5 1407 992 A 55 VAL HB A 50 GLU HGx 1.0 1.8 6.5 1408 992 A 50 GLU HGy A 55 VAL HB 1.0 1.8 6.5 1409 993 A 52 ALA HA A 77 ALA H 1.0 1.8 6.5 1410 994 A 52 ALA HA A 77 ALA H 1.0 1.8 6.5 1411 995 A 12 GLU H A 84 LEU HDy% 1.0 1.8 6.5 1412 996 A 71 ALA HB% A 47 TRP HZ3 1.0 1.8 6.5 1413 997 A 87 ALA HB% A 7 GLU HBx 1.0 1.8 6.5 1414 997 A 7 GLU HBy A 87 ALA HB% 1.0 1.8 6.5 1415 998 A 9 GLN H A 85 VAL HGx% 1.0 1.8 6.5 1416 998 A 9 GLN H A 85 VAL HGy% 1.0 1.8 6.5 1417 999 A 73 GLN HE21 A 21 GLU HBx 1.0 1.8 6.5 1418 999 A 21 GLU HBy A 73 GLN HE21 1.0 1.8 6.5 1419 1000 A 4 HIS H A 88 ALA HB% 1.0 1.8 6.5 1420 1001 A 88 ALA HB% A 7 GLU HGx 1.0 1.8 6.5 1421 1001 A 7 GLU HGy A 88 ALA HB% 1.0 1.8 6.5 1422 1002 A 6 ARG H A 88 ALA HB% 1.0 1.8 6.5 1423 1003 A 4 HIS HB3 A 87 ALA HB% 1.0 1.8 6.5 1424 1004 A 4 HIS HB3 A 87 ALA HB% 1.0 1.8 6.5 1425 1005 A 26 ALA HB% A 62 PRO HGx 1.0 1.8 6.5 1426 1005 A 26 ALA HB% A 62 PRO HGy 1.0 1.8 6.5 1427 1006 A 26 ALA HB% A 62 PRO HGx 1.0 1.8 6.5 1428 1006 A 26 ALA HB% A 62 PRO HGy 1.0 1.8 6.5 1429 1007 A 79 ILE H A 15 LEU HDy% 1.0 1.8 6.5 1430 1008 A 18 VAL HGx% A 78 GLY HAx 1.0 1.8 6.5 1431 1008 A 18 VAL HGy% A 78 GLY HAx 1.0 1.8 6.5 1432 1008 A 78 GLY HAy A 18 VAL HGx% 1.0 1.8 6.5 1433 1008 A 18 VAL HGy% A 78 GLY HAy 1.0 1.8 6.5 1434 1009 A 18 VAL HGx% A 78 GLY HAx 1.0 1.8 6.5 1435 1009 A 18 VAL HGy% A 78 GLY HAx 1.0 1.8 6.5 1436 1009 A 78 GLY HAy A 18 VAL HGx% 1.0 1.8 6.5 1437 1009 A 18 VAL HGy% A 78 GLY HAy 1.0 1.8 6.5 1438 1010 A 18 VAL HGx% A 78 GLY HAx 1.0 1.8 6.5 1439 1010 A 18 VAL HGy% A 78 GLY HAx 1.0 1.8 6.5 1440 1010 A 78 GLY HAy A 18 VAL HGx% 1.0 1.8 6.5 1441 1010 A 18 VAL HGy% A 78 GLY HAy 1.0 1.8 6.5 1442 1011 A 53 THR HG2% A 74 VAL HGx% 1.0 1.8 6.5 1443 1012 A 53 THR HG2% A 74 VAL HGx% 1.0 1.8 6.5 1444 1013 A 26 ALA HA A 47 TRP HH2 1.0 1.8 6.5 1445 1014 A 52 ALA HB% A 81 VAL HGy% 1.0 1.8 6.5 1446 1015 A 4 HIS HE1 A 88 ALA HB% 1.0 1.8 6.5 1447 1016 A 4 HIS HE1 A 88 ALA HB% 1.0 1.8 6.5 1448 1017 A 26 ALA HB% A 47 TRP HB3 1.0 1.8 6.5 1449 1018 A 26 ALA HB% A 47 TRP HB3 1.0 1.8 6.5 1450 1019 A 78 GLY HAy A 19 LEU HDx% 1.0 1.8 6.5 1451 1019 A 19 LEU HDx% A 78 GLY HAx 1.0 1.8 6.5 1452 1020 A 38 LEU HA A 60 ARG HA 1.0 1.8 6.5 1453 1021 A 52 ALA HA A 79 ILE HD1% 1.0 1.8 6.5 1454 1022 A 52 ALA HA A 79 ILE HD1% 1.0 1.8 6.5 1455 1023 A 85 VAL H A 12 GLU HGx 1.0 1.8 6.5 1456 1023 A 12 GLU HGy A 85 VAL H 1.0 1.8 6.5 1457 1024 A 30 GLU H A 66 GLU HBx 1.0 1.8 6.5 1458 1024 A 30 GLU H A 66 GLU HBy 1.0 1.8 6.5 1459 1025 A 77 ALA HB% A 17 LYS HEx 1.0 1.8 6.5 1460 1025 A 17 LYS HEy A 77 ALA HB% 1.0 1.8 6.5 1461 1026 A 22 ALA HB% A 71 ALA HB% 1.0 1.8 6.5 1462 1027 A 46 TRP H A 38 LEU HDx% 1.0 1.8 6.5 1463 1027 A 38 LEU HDy% A 46 TRP H 1.0 1.8 6.5 1464 1028 A 52 ALA HA A 76 LYS H 1.0 1.8 6.5 1465 1029 A 22 ALA HB% A 71 ALA HB% 1.0 1.8 6.5 1466 1030 A 52 ALA HA A 76 LYS H 1.0 1.8 6.5 1467 1031 A 87 ALA HB% A 7 GLU HGx 1.0 1.8 6.5 1468 1031 A 7 GLU HGy A 87 ALA HB% 1.0 1.8 6.5 1469 1032 A 2 ALA HA A 3 ASP H 1.0 1.8 4.5 1470 1033 A 2 ALA HA A 3 ASP H 1.0 1.8 4.5 1471 1034 A 3 ASP H A 3 ASP HBx 1.0 1.8 4.5 1472 1034 A 3 ASP H A 3 ASP HBy 1.0 1.8 4.5 1473 1035 A 27 VAL HA A 30 GLU H 1.0 1.8 6.5 1474 1036 A 26 ALA HA A 29 ALA HB% 1.0 1.8 5.5 1475 1037 A 27 VAL HA A 30 GLU H 1.0 1.8 6.5 1476 1038 A 30 GLU H A 30 GLU HA 1.0 1.8 4.5 1477 1039 A 33 ALA HB% A 30 GLU HBx 1.0 1.8 6.5 1478 1039 A 33 ALA HB% A 30 GLU HBy 1.0 1.8 6.5 1479 1040 A 30 GLU H A 30 GLU HGx 1.0 1.8 4.5 1480 1040 A 30 GLU H A 30 GLU HGy 1.0 1.8 4.5 1481 1041 A 32 GLY H A 31 ARG HBx 1.0 1.8 4.5 1482 1041 A 31 ARG HBy A 32 GLY H 1.0 1.8 4.5 1483 1042 A 39 ILE H A 39 ILE HD1% 1.0 1.8 5.5 1484 1043 A 37 ALA HB% A 39 ILE HG1x 1.0 1.8 6.5 1485 1043 A 37 ALA HB% A 39 ILE HG1y 1.0 1.8 6.5 1486 1044 A 40 SER H A 39 ILE HG1x 1.0 1.8 4.5 1487 1044 A 39 ILE HG1y A 40 SER H 1.0 1.8 4.5 1488 1045 A 43 ASP HB3 A 40 SER HBx 1.0 1.8 5.5 1489 1045 A 40 SER HBy A 43 ASP HB3 1.0 1.8 5.5 1490 1046 A 43 ASP H A 43 ASP HB3 1.0 1.8 4.5 1491 1047 A 43 ASP HB2 A 44 ALA HA 1.0 1.8 6.5 1492 1048 A 47 TRP H A 47 TRP HB2 1.0 1.8 5.5 1493 1049 A 47 TRP HA A 47 TRP HE1 1.0 1.8 6.5 1494 1050 A 57 TYR H A 57 TYR HB2 1.0 1.8 4.5 1495 1051 A 60 ARG H A 60 ARG HGx 1.0 1.8 5.5 1496 1051 A 60 ARG H A 60 ARG HGy 1.0 1.8 5.5 1497 1052 A 64 THR HA A 65 GLU H 1.0 1.8 5.5 1498 1053 A 66 GLU H A 64 THR HB 1.0 1.8 6.5 1499 1054 A 66 GLU H A 65 GLU HB3 1.0 1.8 4.5 1500 1055 A 64 THR H A 67 GLY H 1.0 1.8 5.5 1501 1056 A 96 ARG H A 95 ARG HGx 1.0 1.8 5.5 1502 1056 A 96 ARG H A 95 ARG HGy 1.0 1.8 5.5 1503 1057 A 99 GLU H A 95 ARG HGx 1.0 1.8 6.5 1504 1057 A 99 GLU H A 95 ARG HGy 1.0 1.8 6.5 1505 1058 A 36 ALA HA A 63 VAL HGy% 1.0 1.8 5.5 1506 1059 A 31 ARG H A 39 ILE HA 1.0 1.8 5.5 1507 1060 A 26 ALA HB% A 70 VAL HB 1.0 1.8 5.5 1508 1061 A 38 LEU H A 30 GLU HBx 1.0 1.8 6.5 1509 1061 A 30 GLU HBy A 38 LEU H 1.0 1.8 6.5 1510 1062 A 33 ALA HB% A 64 THR HB 1.0 1.8 6.5 1511 1063 A 33 ALA HB% A 64 THR HB 1.0 1.8 6.5 1512 1064 A 68 ARG HA A 62 PRO HDx 1.0 1.8 6.5 1513 1064 A 62 PRO HDy A 68 ARG HA 1.0 1.8 6.5 1514 1065 A 36 ALA HB% A 63 VAL H 1.0 1.8 6.5 1515 1066 A 47 TRP HB2 A 60 ARG H 1.0 1.8 6.5 1516 1067 A 36 ALA HA A 30 GLU HBx 1.0 1.8 6.5 1517 1067 A 30 GLU HBy A 36 ALA HA 1.0 1.8 6.5 1518 1068 A 39 ILE HA A 44 ALA HB% 1.0 1.8 6.5 1519 1069 A 35 GLY HAy A 63 VAL HGy% 1.0 1.8 6.5 1520 1069 A 35 GLY HAx A 63 VAL HGy% 1.0 1.8 6.5 1521 1070 A 26 ALA HB% A 38 LEU HA 1.0 1.8 6.5 1522 1071 A 51 THR HG2% A 19 LEU HDy% 1.0 1.8 5.5 1523 1071 A 51 THR HG2% A 19 LEU HDx% 1.0 1.8 5.5 1524 1072 A 47 TRP HB2 A 59 ASP HBx 1.0 1.8 5.5 1525 1072 A 47 TRP HB2 A 59 ASP HBy 1.0 1.8 5.5 1526 1073 A 47 TRP HB3 A 59 ASP HBx 1.0 1.8 5.5 1527 1073 A 47 TRP HB3 A 59 ASP HBy 1.0 1.8 5.5 1528 1074 A 33 ALA HB% A 65 GLU H 1.0 1.8 5.5 1529 1075 A 33 ALA HB% A 65 GLU HB3 1.0 1.8 5.5 1530 1076 A 33 ALA HB% A 65 GLU HA 1.0 1.8 5.5 1531 1077 A 33 ALA HB% A 65 GLU HB2 1.0 1.8 5.5 1532 1078 A 33 ALA HB% A 65 GLU HGx 1.0 1.8 5.5 1533 1078 A 33 ALA HB% A 65 GLU HGy 1.0 1.8 5.5 1534 1079 A 34 PRO HD2 A 65 GLU HA 1.0 1.8 5.5 1535 1080 A 34 PRO HD2 A 65 GLU HA 1.0 1.8 5.5 1536 1081 A 52 ALA HA A 18 VAL HGx% 1.0 1.8 5.5 1537 1081 A 18 VAL HGy% A 52 ALA HA 1.0 1.8 5.5 1538 1082 A 22 ALA HB% A 52 ALA HB% 1.0 1.8 5.5 1539 1083 A 22 ALA HB% A 52 ALA HB% 1.0 1.8 5.5 1540 1084 A 22 ALA HB% A 52 ALA HB% 1.0 1.8 5.5 1541 1085 A 22 ALA HB% A 52 ALA HB% 1.0 1.8 5.5 1542 1086 A 15 LEU HDx% A 51 THR HG2% 1.0 1.8 5.5 1543 1087 A 29 ALA HB% A 63 VAL H 1.0 1.8 5.5 1544 1088 A 26 ALA HB% A 48 SER H 1.0 1.8 5.5 1545 1089 A 27 VAL HB A 41 TYR H 1.0 1.8 5.5 1546 1090 A 26 ALA HB% A 48 SER HA 1.0 1.8 5.5 1547 1091 A 54 THR HG2% A 15 LEU HDy% 1.0 1.8 5.5 1548 1092 A 27 VAL HB A 38 LEU HDx% 1.0 1.8 5.5 1549 1092 A 27 VAL HB A 38 LEU HDy% 1.0 1.8 5.5 1550 1093 A 16 GLN HA A 52 ALA HB% 1.0 1.8 5.5 1551 1094 A 30 GLU HA A 36 ALA HA 1.0 1.8 5.5 1552 1095 A 51 THR H A 19 LEU HDx% 1.0 1.8 5.5 1553 1096 A 26 ALA HB% A 47 TRP HE1 1.0 1.8 5.5 1554 1097 A 27 VAL HB A 40 SER H 1.0 1.8 5.5 1555 1098 A 15 LEU HG A 52 ALA HA 1.0 1.8 5.5 1556 1099 A 52 ALA HB% A 16 GLN HGx 1.0 1.8 5.5 1557 1099 A 16 GLN HGy A 52 ALA HB% 1.0 1.8 5.5 1558 1100 A 27 VAL HA A 44 ALA HA 1.0 1.8 5.5 1559 1101 A 27 VAL HA A 44 ALA HA 1.0 1.8 5.5 1560 1102 A 27 VAL HA A 44 ALA HA 1.0 1.8 5.5 1561 1103 A 27 VAL HA A 44 ALA HA 1.0 1.8 5.5 1562 1104 A 17 LYS H A 16 GLN HBx 1.0 1.8 4.5 1563 1104 A 17 LYS H A 16 GLN HBy 1.0 1.8 4.5 1564 1105 A 9 GLN H A 8 ALA HB% 1.0 1.8 4.5 1565 1106 A 72 GLU H A 71 ALA HB% 1.0 1.8 4.5 1566 1107 A 72 GLU H A 71 ALA HB% 1.0 1.8 4.5 1567 1108 A 61 TYR H A 38 LEU HBx 1.0 1.8 4.5 1568 1108 A 38 LEU HBy A 61 TYR H 1.0 1.8 4.5 1569 1109 A 15 LEU HA A 77 ALA HB% 1.0 1.8 4.5 1570 1110 A 89 LEU H A 90 ALA H 1.0 1.8 4.5 1571 1111 A 89 LEU H A 90 ALA H 1.0 1.8 4.5 1572 1112 A 56 GLY HA2 A 57 TYR H 1.0 1.8 4.5 1573 1113 A 56 GLY HA2 A 57 TYR H 1.0 1.8 4.5 1574 1114 A 77 ALA HA A 80 GLU HBx 1.0 1.8 4.5 1575 1114 A 77 ALA HA A 80 GLU HBy 1.0 1.8 4.5 1576 1115 A 6 ARG H A 5 GLU HBx 1.0 1.8 4.5 1577 1115 A 6 ARG H A 5 GLU HBy 1.0 1.8 4.5 1578 1116 A 40 SER H A 40 SER HBx 1.0 1.8 4.5 1579 1116 A 40 SER H A 40 SER HBy 1.0 1.8 4.5 1580 1117 A 71 ALA HB% A 62 PRO HDx 1.0 1.8 4.5 1581 1117 A 62 PRO HDy A 71 ALA HB% 1.0 1.8 4.5 1582 1118 A 71 ALA HB% A 62 PRO HDx 1.0 1.8 4.5 1583 1118 A 62 PRO HDy A 71 ALA HB% 1.0 1.8 4.5 1584 1119 A 92 ASP H A 93 PHE H 1.0 1.8 4.5 1585 1120 A 68 ARG HE A 68 ARG HGx 1.0 1.8 4.5 1586 1120 A 68 ARG HE A 68 ARG HGy 1.0 1.8 4.5 1587 1121 A 89 LEU H A 88 ALA HB% 1.0 1.8 4.5 1588 1122 A 89 LEU H A 88 ALA HB% 1.0 1.8 4.5 1589 1123 A 71 ALA HA A 74 VAL HB 1.0 1.8 4.5 1590 1124 A 49 VAL H A 19 LEU HDy% 1.0 1.8 4.5 1591 1125 A 36 ALA HA A 63 VAL HGx% 1.0 1.8 4.5 1592 1126 A 36 ALA HA A 63 VAL HGx% 1.0 1.8 4.5 1593 1127 A 36 ALA HA A 63 VAL HGx% 1.0 1.8 4.5 1594 1128 A 86 THR H A 85 VAL HGx% 1.0 1.8 4.5 1595 1128 A 86 THR H A 85 VAL HGy% 1.0 1.8 4.5 1596 1129 A 77 ALA HB% A 73 GLN HGx 1.0 1.8 4.5 1597 1129 A 77 ALA HB% A 73 GLN HGy 1.0 1.8 4.5 1598 1130 A 97 GLU H A 96 ARG HBx 1.0 1.8 4.5 1599 1130 A 96 ARG HBy A 97 GLU H 1.0 1.8 4.5 1600 1131 A 97 GLU H A 96 ARG HBx 1.0 1.8 4.5 1601 1131 A 96 ARG HBy A 97 GLU H 1.0 1.8 4.5 1602 1132 A 53 THR HG2% A 49 VAL HGx% 1.0 1.8 4.5 1603 1133 A 66 GLU H A 66 GLU HGx 1.0 1.8 4.5 1604 1133 A 66 GLU H A 66 GLU HGy 1.0 1.8 4.5 1605 1134 A 19 LEU H A 19 LEU HDx% 1.0 1.8 5.5 1606 1135 A 66 GLU H A 65 GLU HGx 1.0 1.8 5.5 1607 1135 A 66 GLU H A 65 GLU HGy 1.0 1.8 5.5 1608 1136 A 26 ALA HB% A 30 GLU HGx 1.0 1.8 5.5 1609 1136 A 26 ALA HB% A 30 GLU HGy 1.0 1.8 5.5 1610 1137 A 26 ALA HA A 70 VAL HB 1.0 1.8 5.5 1611 1138 A 57 TYR H A 57 TYR HD% 1.0 1.8 5.5 1612 1139 A 58 GLY H A 57 TYR HB2 1.0 1.8 5.5 1613 1140 A 51 THR HA A 54 THR HA 1.0 1.8 5.5 1614 1141 A 87 ALA HA A 90 ALA HB% 1.0 1.8 5.5 1615 1142 A 97 GLU H A 96 ARG HDx 1.0 1.8 5.5 1616 1142 A 96 ARG HDy A 97 GLU H 1.0 1.8 5.5 1617 1143 A 97 GLU H A 96 ARG HDx 1.0 1.8 5.5 1618 1143 A 96 ARG HDy A 97 GLU H 1.0 1.8 5.5 1619 1144 A 7 GLU H A 4 HIS HA 1.0 1.8 5.5 1620 1145 A 92 ASP H A 91 THR HB 1.0 1.8 5.5 1621 1146 A 92 ASP H A 91 THR HB 1.0 1.8 5.5 1622 1147 A 10 LYS HGx A 14 GLU HBx 1.0 1.8 5.5 1623 1147 A 10 LYS HGy A 14 GLU HBx 1.0 1.8 5.5 1624 1147 A 14 GLU HBy A 10 LYS HGx 1.0 1.8 5.5 1625 1147 A 10 LYS HGy A 14 GLU HBy 1.0 1.8 5.5 1626 1148 A 88 ALA HB% A 7 GLU HBx 1.0 1.8 5.5 1627 1148 A 7 GLU HBy A 88 ALA HB% 1.0 1.8 5.5 1628 1149 A 85 VAL HA A 88 ALA HB% 1.0 1.8 5.5 1629 1150 A 57 TYR HB2 A 59 ASP HBx 1.0 1.8 5.5 1630 1150 A 57 TYR HB2 A 59 ASP HBy 1.0 1.8 5.5 1631 1151 A 84 LEU HA A 87 ALA H 1.0 1.8 5.5 1632 1152 A 58 GLY H A 60 ARG H 1.0 1.8 5.5 1633 1153 A 15 LEU HDx% A 77 ALA H 1.0 1.8 5.5 1634 1154 A 8 ALA HA A 84 LEU HDx% 1.0 1.8 5.5 1635 1155 A 8 ALA HA A 84 LEU HDx% 1.0 1.8 5.5 1636 1156 A 90 ALA HA A 94 VAL HGx% 1.0 1.8 5.5 1637 1156 A 90 ALA HA A 94 VAL HGy% 1.0 1.8 5.5 1638 1157 A 12 GLU HBx A 16 GLN HGx 1.0 1.8 5.5 1639 1157 A 12 GLU HBy A 16 GLN HGx 1.0 1.8 5.5 1640 1157 A 16 GLN HGy A 12 GLU HBx 1.0 1.8 5.5 1641 1157 A 12 GLU HBy A 16 GLN HGy 1.0 1.8 5.5 1642 1158 A 53 THR HG2% A 78 GLY HAx 1.0 1.8 5.5 1643 1158 A 53 THR HG2% A 78 GLY HAy 1.0 1.8 5.5 1644 1159 A 8 ALA HA A 88 ALA HB% 1.0 1.8 5.5 1645 1160 A 8 ALA HA A 88 ALA HB% 1.0 1.8 5.5 1646 1161 A 90 ALA H A 89 LEU HDx% 1.0 1.8 5.5 1647 1162 A 26 ALA HB% A 70 VAL HGy% 1.0 1.8 5.5 1648 1163 A 52 ALA HB% A 82 PHE HZ 1.0 1.8 5.5 1649 1164 A 79 ILE HG2% A 83 ALA H 1.0 1.8 5.5 1650 1165 A 85 VAL HB A 89 LEU HDx% 1.0 1.8 5.5 1651 1166 A 17 LYS H A 17 LYS HEx 1.0 1.8 5.5 1652 1166 A 17 LYS H A 17 LYS HEy 1.0 1.8 5.5 1653 1167 A 50 GLU HA A 53 THR H 1.0 1.8 5.5 1654 1168 A 90 ALA H A 87 ALA HA 1.0 1.8 5.5 1655 1169 A 9 GLN H A 84 LEU HDy% 1.0 1.8 6.5 1656 1170 A 69 LYS HA A 68 ARG HBx 1.0 1.8 6.5 1657 1170 A 69 LYS HA A 68 ARG HBy 1.0 1.8 6.5 1658 1171 A 47 TRP H A 49 VAL H 1.0 1.8 6.5 1659 1172 A 37 ALA HB% A 62 PRO HDx 1.0 1.8 6.5 1660 1172 A 37 ALA HB% A 62 PRO HDy 1.0 1.8 6.5 1661 1173 A 86 THR HG2% A 89 LEU HDx% 1.0 1.8 6.5 1662 1174 A 52 ALA HB% A 82 PHE HD% 1.0 1.8 6.5 1663 1175 A 85 VAL H A 81 VAL HGx% 1.0 1.8 6.5 1664 1176 A 74 VAL HGx% A 78 GLY HAx 1.0 1.8 6.5 1665 1176 A 74 VAL HGx% A 78 GLY HAy 1.0 1.8 6.5 1666 1177 A 7 GLU HGx A 84 LEU HBx 1.0 1.8 6.5 1667 1177 A 7 GLU HGy A 84 LEU HBx 1.0 1.8 6.5 1668 1177 A 84 LEU HBy A 7 GLU HGx 1.0 1.8 6.5 1669 1177 A 7 GLU HGy A 84 LEU HBy 1.0 1.8 6.5 1670 1178 A 94 VAL HA A 93 PHE HBx 1.0 1.8 6.5 1671 1178 A 93 PHE HBy A 94 VAL HA 1.0 1.8 6.5 1672 1179 A 57 TYR HD% A 59 ASP H 1.0 1.8 6.5 1673 1180 A 52 ALA HB% A 74 VAL HGy% 1.0 1.8 6.5 1674 1181 A 83 ALA H A 82 PHE HD% 1.0 1.8 6.5 1675 1182 A 49 VAL HA A 53 THR H 1.0 1.8 6.5 1676 1183 A 70 VAL HGx% A 74 VAL H 1.0 1.8 6.5 1677 1184 A 53 THR HA A 82 PHE HB2 1.0 1.8 6.5 1678 1185 A 65 GLU HB3 A 34 PRO HBx 1.0 1.8 6.5 1679 1185 A 34 PRO HBy A 65 GLU HB3 1.0 1.8 6.5 1680 1186 A 18 VAL HB A 74 VAL HGy% 1.0 1.8 6.5 1681 1187 A 52 ALA HB% A 79 ILE H 1.0 1.8 6.5 1682 1188 A 52 ALA HB% A 79 ILE H 1.0 1.8 6.5 1683 1189 A 46 TRP HBx A 60 ARG HGx 1.0 1.8 6.5 1684 1189 A 46 TRP HBy A 60 ARG HGx 1.0 1.8 6.5 1685 1189 A 60 ARG HGy A 46 TRP HBx 1.0 1.8 6.5 1686 1189 A 46 TRP HBy A 60 ARG HGy 1.0 1.8 6.5 1687 1190 A 51 THR HB A 56 GLY H 1.0 1.8 6.5 1688 1191 A 51 THR HB A 56 GLY H 1.0 1.8 6.5 1689 1192 A 83 ALA HA A 86 THR HB 1.0 1.8 6.5 1690 1193 A 88 ALA HB% A 92 ASP HBx 1.0 1.8 6.5 1691 1193 A 88 ALA HB% A 92 ASP HBy 1.0 1.8 6.5 1692 1194 A 64 THR HG2% A 63 VAL HGy% 1.0 1.8 6.5 1693 1195 A 52 ALA HA A 79 ILE HG1x 1.0 1.8 6.5 1694 1195 A 52 ALA HA A 79 ILE HG1y 1.0 1.8 6.5 1695 1196 A 52 ALA HA A 79 ILE HG1x 1.0 1.8 6.5 1696 1196 A 52 ALA HA A 79 ILE HG1y 1.0 1.8 6.5 1697 1197 A 52 ALA HA A 79 ILE HG1x 1.0 1.8 6.5 1698 1197 A 52 ALA HA A 79 ILE HG1y 1.0 1.8 6.5 1699 1198 A 90 ALA HA A 94 VAL H 1.0 1.8 6.5 1700 1199 A 93 PHE H A 93 PHE HE% 1.0 1.8 6.5 1701 1200 A 26 ALA HB% A 30 GLU HBx 1.0 1.8 6.5 1702 1200 A 26 ALA HB% A 30 GLU HBy 1.0 1.8 6.5 1703 1201 A 51 THR HG2% A 56 GLY HA2 1.0 1.8 6.5 1704 1202 A 52 ALA HB% A 77 ALA H 1.0 1.8 6.5 1705 1203 A 33 ALA HB% A 64 THR HA 1.0 1.8 6.5 1706 1204 A 52 ALA HB% A 77 ALA H 1.0 1.8 6.5 1707 1205 A 52 ALA H A 78 GLY HAx 1.0 1.8 6.5 1708 1205 A 52 ALA H A 78 GLY HAy 1.0 1.8 6.5 1709 1206 A 27 VAL HA A 38 LEU HA 1.0 1.8 6.5 1710 1207 A 15 LEU HDx% A 54 THR H 1.0 1.8 6.5 1711 1208 A 52 ALA HA A 19 LEU HDx% 1.0 1.8 6.5 1712 1209 A 42 PRO HA A 23 SER HBx 1.0 1.8 6.5 1713 1209 A 23 SER HBy A 42 PRO HA 1.0 1.8 6.5 1714 1210 A 52 ALA HA A 82 PHE HE% 1.0 1.8 6.5 1715 1211 A 48 SER H A 19 LEU HDx% 1.0 1.8 6.5 1716 1212 A 23 SER H A 38 LEU HDx% 1.0 1.8 6.5 1717 1212 A 23 SER H A 38 LEU HDy% 1.0 1.8 6.5 1718 1213 A 26 ALA HB% A 44 ALA H 1.0 1.8 6.5 1719 1214 A 16 GLN H A 52 ALA HB% 1.0 1.8 6.5 1720 1215 A 81 VAL HA A 85 VAL H 1.0 1.8 6.5 1721 1216 A 26 ALA HA A 47 TRP HZ2 1.0 1.8 6.5 1722 1217 A 26 ALA HA A 47 TRP HZ2 1.0 1.8 6.5 1723 1218 A 29 ALA HA A 66 GLU H 1.0 1.8 6.5 1724 1219 A 26 ALA HB% A 45 ILE H 1.0 1.8 6.5 1725 1220 A 26 ALA HB% A 45 ILE H 1.0 1.8 6.5 1726 1221 A 24 LYS H A 45 ILE HB 1.0 1.8 6.5 1727 1222 A 22 ALA HB% A 51 THR HB 1.0 1.8 6.5 1728 1223 A 22 ALA HB% A 51 THR HB 1.0 1.8 6.5 1729 1224 A 15 LEU HDx% A 54 THR HG2% 1.0 1.8 6.5 1730 1225 A 15 LEU HDx% A 54 THR HG2% 1.0 1.8 6.5 1731 1226 A 15 LEU HDx% A 54 THR HG2% 1.0 1.8 6.5 1732 1227 A 24 LYS H A 45 ILE HA 1.0 1.8 6.5 1733 1228 A 24 LYS H A 45 ILE HA 1.0 1.8 6.5 1734 1229 A 50 GLU HGx A 60 ARG HBx 1.0 1.8 6.5 1735 1229 A 50 GLU HGy A 60 ARG HBx 1.0 1.8 6.5 1736 1229 A 60 ARG HBy A 50 GLU HGx 1.0 1.8 6.5 1737 1229 A 50 GLU HGy A 60 ARG HBy 1.0 1.8 6.5 1738 1230 A 88 ALA HB% A 91 THR HB 1.0 1.8 6.5 1739 1231 A 85 VAL HB A 12 GLU HGx 1.0 1.8 6.5 1740 1231 A 12 GLU HGy A 85 VAL HB 1.0 1.8 6.5 1741 1232 A 23 SER H A 48 SER HA 1.0 1.8 6.5 1742 1233 A 23 SER H A 48 SER HA 1.0 1.8 6.5 1743 1234 A 32 GLY H A 66 GLU HBx 1.0 1.8 6.5 1744 1234 A 32 GLY H A 66 GLU HBy 1.0 1.8 6.5 1745 1235 A 29 ALA HB% A 68 ARG HBx 1.0 1.8 6.5 1746 1235 A 29 ALA HB% A 68 ARG HBy 1.0 1.8 6.5 1747 1236 A 27 VAL HA A 40 SER HBx 1.0 1.8 6.5 1748 1236 A 27 VAL HA A 40 SER HBy 1.0 1.8 6.5 1749 1237 A 51 THR HG2% A 78 GLY HAx 1.0 1.8 6.5 1750 1237 A 51 THR HG2% A 78 GLY HAy 1.0 1.8 6.5 1751 1238 A 51 THR HG2% A 19 LEU HDx% 1.0 1.8 6.5 1752 1239 A 71 ALA H A 68 ARG HBx 1.0 1.8 6.5 1753 1239 A 71 ALA H A 68 ARG HBy 1.0 1.8 6.5 1754 1240 A 23 SER H A 70 VAL HGx% 1.0 1.8 6.5 1755 1241 A 36 ALA H A 30 GLU HBx 1.0 1.8 6.5 1756 1241 A 30 GLU HBy A 36 ALA H 1.0 1.8 6.5 1757 1242 A 19 LEU HG A 52 ALA HA 1.0 1.8 6.5 1758 1243 A 48 SER HA A 71 ALA HA 1.0 1.8 6.5 1759 1244 A 18 VAL H A 52 ALA HB% 1.0 1.8 6.5 1760 1245 A 18 VAL H A 52 ALA HB% 1.0 1.8 6.5 1761 1246 A 30 GLU H A 39 ILE HA 1.0 1.8 6.5 1762 1247 A 89 LEU HA A 93 PHE H 1.0 1.8 6.5 1763 1248 A 25 LYS HBy A 67 GLY HAx 1.0 1.8 6.5 1764 1248 A 25 LYS HBx A 67 GLY HAx 1.0 1.8 6.5 1765 1248 A 67 GLY HAy A 25 LYS HBx 1.0 1.8 6.5 1766 1248 A 25 LYS HBy A 67 GLY HAy 1.0 1.8 6.5 1767 1249 A 44 ALA HB% A 25 LYS HBx 1.0 1.8 6.5 1768 1249 A 25 LYS HBy A 44 ALA HB% 1.0 1.8 6.5 1769 1250 A 26 ALA HB% A 51 THR HG2% 1.0 1.8 6.5 1770 1251 A 34 PRO HA A 65 GLU HB3 1.0 1.8 6.5 1771 1252 A 47 TRP HE1 A 59 ASP HBx 1.0 1.8 6.5 1772 1252 A 47 TRP HE1 A 59 ASP HBy 1.0 1.8 6.5 1773 1253 A 45 ILE HD1% B 69 LYS HEx 1.0 1.8 6.5 1774 1253 A 45 ILE HD1% B 69 LYS HEy 1.0 1.8 6.5 1775 1254 A 45 ILE HG1y B 69 LYS HEx 1.0 1.8 6.5 1776 1254 B 69 LYS HEy A 45 ILE HG1x 1.0 1.8 6.5 1777 1254 A 45 ILE HG1y B 69 LYS HEy 1.0 1.8 6.5 1778 1254 A 45 ILE HG1x B 69 LYS HEx 1.0 1.8 6.5 1779 1255 A 45 ILE HG2% B 64 THR HG21 1.0 1.8 5.5 1780 1256 A 46 TRP HD1 B 68 ARG HDx 1.0 1.8 5.5 1781 1256 A 46 TRP HD1 B 68 ARG HDy 1.0 1.8 5.5 1782 1257 A 46 TRP HE1 B 64 THR HA 1.0 1.8 5.5 1783 1258 A 46 TRP HE1 B 64 THR HG21 1.0 1.8 5.5 1784 1259 A 46 TRP HE1 B 68 ARG HA 1.0 1.8 5.5 1785 1260 A 46 TRP HE1 B 68 ARG HBx 1.0 1.8 5.5 1786 1260 A 46 TRP HE1 B 68 ARG HBy 1.0 1.8 5.5 1787 1261 A 46 TRP HE3 B 68 ARG HDx 1.0 1.8 6.5 1788 1261 B 68 ARG HDy A 46 TRP HE3 1.0 1.8 6.5 1789 1262 A 46 TRP HZ2 B 68 ARG HBx 1.0 1.8 6.5 1790 1262 A 46 TRP HZ2 B 68 ARG HBy 1.0 1.8 6.5 1791 1263 A 46 TRP HBy B 68 ARG HBx 1.0 1.8 6.5 1792 1263 A 46 TRP HBx B 68 ARG HBx 1.0 1.8 6.5 1793 1263 B 68 ARG HBy A 46 TRP HBx 1.0 1.8 6.5 1794 1263 A 46 TRP HBy B 68 ARG HBy 1.0 1.8 6.5 1795 1264 A 46 TRP HBx B 68 ARG HDx 1.0 1.8 6.5 1796 1264 B 68 ARG HDy A 46 TRP HBx 1.0 1.8 6.5 1797 1264 A 46 TRP HBy B 68 ARG HDy 1.0 1.8 6.5 1798 1264 A 46 TRP HBy B 68 ARG HDx 1.0 1.8 6.5 1799 1265 A 46 TRP HBx B 68 ARG HGx 1.0 1.8 6.5 1800 1265 A 46 TRP HBy B 68 ARG HGx 1.0 1.8 6.5 1801 1265 B 68 ARG HGy A 46 TRP HBx 1.0 1.8 6.5 1802 1265 A 46 TRP HBy B 68 ARG HGy 1.0 1.8 6.5 1803 1266 A 49 VAL HGx% B 72 GLU HGx 1.0 1.8 6.5 1804 1266 A 49 VAL HGy% B 72 GLU HGx 1.0 1.8 6.5 1805 1266 B 72 GLU HGy A 49 VAL HGy% 1.0 1.8 6.5 1806 1266 A 49 VAL HGx% B 72 GLU HGy 1.0 1.8 6.5 1807 1267 A 50 GLU HA B 72 GLU HA 1.0 1.8 5.5 1808 1268 B 71 ALA HB1 A 50 GLU HBx 1.0 1.8 5.5 1809 1268 A 50 GLU HBy B 71 ALA HB1 1.0 1.8 5.5 1810 1269 A 55 VAL HB B 75 MET HE1 1.0 1.8 5.5 1811 1270 B 54 THR HB A 55 VAL HGx% 1.0 1.8 6.5 1812 1270 A 55 VAL HGy% B 54 THR HB 1.0 1.8 6.5 1813 1271 A 57 TYR HB3 B 56 GLY HAy 1.0 1.8 5.5 1814 1272 A 57 TYR HB3 B 61 TYR HA 1.0 1.8 5.5 1815 1273 A 57 TYR HD% B 60 ARG H 1.0 1.8 5.5 1816 1274 A 57 TYR HD% B 71 ALA HB1 1.0 1.8 5.5 1817 1275 A 57 TYR HE% B 58 GLY H 1.0 1.8 5.5 1818 1276 A 59 ASP HA B 61 TYR HBx 1.0 1.8 5.5 1819 1276 A 59 ASP HA B 61 TYR HBy 1.0 1.8 5.5 1820 1277 B 61 TYR HE% A 59 ASP HBx 1.0 1.8 6.5 1821 1277 A 59 ASP HBy B 61 TYR HE% 1.0 1.8 6.5 1822 1278 A 81 VAL HGy% B 76 LYS HEx 1.0 1.8 6.5 1823 1278 B 76 LYS HEy A 81 VAL HGy% 1.0 1.8 6.5 1824 1278 A 81 VAL HGx% B 76 LYS HEy 1.0 1.8 6.5 1825 1278 A 81 VAL HGx% B 76 LYS HEx 1.0 1.8 6.5 1826 1279 A 82 PHE HD% B 76 LYS HEx 1.0 1.8 6.5 1827 1279 A 82 PHE HD% B 76 LYS HEy 1.0 1.8 6.5 1828 1280 A 82 PHE HE% B 76 LYS HEx 1.0 1.8 6.5 1829 1280 A 82 PHE HE% B 76 LYS HEy 1.0 1.8 6.5 1830 1281 A 89 LEU HA B 84 LEU HD21 1.0 1.8 6.5 1831 1281 A 89 LEU HA B 84 LEU HD11 1.0 1.8 6.5 1832 1282 B 86 THR H A 89 LEU HBx 1.0 1.8 5.5 1833 1282 A 89 LEU HBy B 86 THR H 1.0 1.8 5.5 1834 1283 B 87 ALA H A 89 LEU HBx 1.0 1.8 5.5 1835 1283 A 89 LEU HBy B 87 ALA H 1.0 1.8 5.5 1836 1284 B 83 ALA H A 89 LEU HDx% 1.0 1.8 5.5 1837 1285 B 87 ALA H A 89 LEU HDx% 1.0 1.8 5.5 1838 1286 B 87 ALA HB1 A 89 LEU HDy% 1.0 1.8 6.5 1839 1286 A 89 LEU HDx% B 87 ALA HB1 1.0 1.8 6.5 1840 1287 B 86 THR HB A 92 ASP HBx 1.0 1.8 5.5 1841 1287 A 92 ASP HBy B 86 THR HB 1.0 1.8 5.5 1842 1288 B 90 ALA HB1 A 92 ASP HBx 1.0 1.8 6.5 1843 1288 A 92 ASP HBy B 90 ALA HB1 1.0 1.8 6.5 1844 1289 A 93 PHE H B 86 THR HG21 1.0 1.8 5.5 1845 1290 A 93 PHE H B 87 ALA H 1.0 1.8 5.5 1846 1291 B 90 ALA H A 93 PHE HBx 1.0 1.8 5.5 1847 1291 A 93 PHE HBy B 90 ALA H 1.0 1.8 5.5 1848 1292 A 96 ARG HE B 94 VAL HB 1.0 1.8 5.5 1849 1293 B 4 HIS H A 96 ARG HBx 1.0 1.8 6.5 1850 1293 A 96 ARG HBy B 4 HIS H 1.0 1.8 6.5 1851 1294 B 87 ALA HB1 A 96 ARG HBx 1.0 1.8 5.5 1852 1294 A 96 ARG HBy B 87 ALA HB1 1.0 1.8 5.5 1853 1295 B 87 ALA HB1 A 96 ARG HDx 1.0 1.8 6.5 1854 1295 A 96 ARG HDy B 87 ALA HB1 1.0 1.8 6.5 1855 1296 B 90 ALA HB1 A 96 ARG HDx 1.0 1.8 6.5 1856 1296 A 96 ARG HDy B 90 ALA HB1 1.0 1.8 6.5 1857 1297 B 91 THR HG21 A 96 ARG HDx 1.0 1.8 6.5 1858 1297 A 96 ARG HDy B 91 THR HG21 1.0 1.8 6.5 1859 1298 A 43 ASP HB3 B 64 THR HB 1.0 1.8 6.5 1860 1299 B 60 ARG H A 57 TYR HE% 1.0 1.8 6.5 1861 1300 A 46 TRP HH2 B 69 LYS H 1.0 1.8 6.5 1862 1301 A 50 GLU HGy B 68 ARG HGx 1.0 1.8 6.5 1863 1301 A 50 GLU HGx B 68 ARG HGx 1.0 1.8 6.5 1864 1301 B 68 ARG HGy A 50 GLU HGx 1.0 1.8 6.5 1865 1301 A 50 GLU HGy B 68 ARG HGy 1.0 1.8 6.5 1866 1302 A 93 PHE H B 91 THR HG21 1.0 1.8 6.5 1867 1303 A 46 TRP HD1 B 65 GLU H 1.0 1.8 6.5 1868 1304 B 84 LEU HG A 89 LEU HDy% 1.0 1.8 6.5 1869 1305 A 46 TRP HZ3 B 68 ARG HDx 1.0 1.8 6.5 1870 1305 B 68 ARG HDy A 46 TRP HZ3 1.0 1.8 6.5 1871 1306 A 46 TRP HZ3 B 68 ARG HDx 1.0 1.8 6.5 1872 1306 B 68 ARG HDy A 46 TRP HZ3 1.0 1.8 6.5 1873 1307 A 49 VAL HB B 68 ARG HE 1.0 1.8 6.5 1874 1308 A 60 ARG HE B 68 ARG HE 1.0 1.8 6.5 1875 1309 A 45 ILE HD1% B 64 THR HG21 1.0 1.8 6.5 1876 1310 A 46 TRP HE3 B 68 ARG HBx 1.0 1.8 6.5 1877 1310 B 68 ARG HBy A 46 TRP HE3 1.0 1.8 6.5 1878 1311 A 89 LEU HA B 84 LEU HBx 1.0 1.8 6.5 1879 1311 A 89 LEU HA B 84 LEU HBy 1.0 1.8 6.5 1880 1312 A 49 VAL H B 68 ARG HGx 1.0 1.8 6.5 1881 1312 A 49 VAL H B 68 ARG HGy 1.0 1.8 6.5 1882 1313 A 45 ILE HG1x B 68 ARG HDx 1.0 1.8 6.5 1883 1313 B 68 ARG HDy A 45 ILE HG1x 1.0 1.8 6.5 1884 1313 A 45 ILE HG1y B 68 ARG HDy 1.0 1.8 6.5 1885 1313 A 45 ILE HG1y B 68 ARG HDx 1.0 1.8 6.5 1886 1314 A 59 ASP HBy B 63 VAL HG21 1.0 1.8 6.5 1887 1314 A 59 ASP HBx B 63 VAL HG21 1.0 1.8 6.5 1888 1314 B 63 VAL HG11 A 59 ASP HBx 1.0 1.8 6.5 1889 1314 A 59 ASP HBy B 63 VAL HG11 1.0 1.8 6.5 1890 1315 A 49 VAL HGx% B 73 GLN HBx 1.0 1.8 6.5 1891 1315 A 49 VAL HGy% B 73 GLN HBx 1.0 1.8 6.5 1892 1315 B 73 GLN HBy A 49 VAL HGy% 1.0 1.8 6.5 1893 1315 A 49 VAL HGx% B 73 GLN HBy 1.0 1.8 6.5 1894 1316 A 46 TRP HE1 B 69 LYS HA 1.0 1.8 6.5 1895 1317 A 82 PHE HB3 B 76 LYS HGx 1.0 1.8 6.5 1896 1317 A 82 PHE HB2 B 76 LYS HGx 1.0 1.8 6.5 1897 1317 B 76 LYS HGy A 82 PHE HB3 1.0 1.8 6.5 1898 1317 A 82 PHE HB2 B 76 LYS HGy 1.0 1.8 6.5 1899 1318 B 91 THR HB A 94 VAL HGx% 1.0 1.8 6.5 1900 1318 A 94 VAL HGy% B 91 THR HB 1.0 1.8 6.5 1901 1319 A 92 ASP HBy B 89 LEU HD21 1.0 1.8 6.5 1902 1319 A 92 ASP HBx B 89 LEU HD21 1.0 1.8 6.5 1903 1319 B 89 LEU HD11 A 92 ASP HBx 1.0 1.8 6.5 1904 1319 A 92 ASP HBy B 89 LEU HD11 1.0 1.8 6.5 1905 1320 A 92 ASP HBy B 89 LEU HBx 1.0 1.8 6.5 1906 1320 A 92 ASP HBx B 89 LEU HBx 1.0 1.8 6.5 1907 1320 B 89 LEU HBy A 92 ASP HBx 1.0 1.8 6.5 1908 1320 A 92 ASP HBy B 89 LEU HBy 1.0 1.8 6.5 1909 1321 A 90 ALA HA B 91 THR HG21 1.0 1.8 6.5 1910 1322 B 1 SER H1 B 2 ALA H 1.0 1.8 5.5 1911 1323 B 1 SER HA B 1 SER HBx 1.0 1.8 3.5 1912 1323 B 1 SER HA B 1 SER HBy 1.0 1.8 3.5 1913 1324 B 2 ALA H B 1 SER HA 1.0 1.8 3.5 1914 1325 B 2 ALA H B 1 SER HBx 1.0 1.8 5.5 1915 1325 B 2 ALA H B 1 SER HBy 1.0 1.8 5.5 1916 1326 B 2 ALA H B 2 ALA HA 1.0 1.8 5.5 1917 1327 B 2 ALA H B 2 ALA HB1 1.0 1.8 4.5 1918 1328 B 2 ALA H B 5 GLU H 1.0 1.8 6.5 1919 1329 B 2 ALA H B 2 ALA HA 1.0 1.8 4.5 1920 1330 B 2 ALA HA B 2 ALA HB1 1.0 1.8 3.5 1921 1331 B 2 ALA H B 2 ALA HB1 1.0 1.8 3.5 1922 1332 B 2 ALA HA B 2 ALA HB1 1.0 1.8 3.5 1923 1333 B 2 ALA HB1 B 3 ASP H 1.0 1.8 3.5 1924 1334 B 2 ALA HB1 B 3 ASP H 1.0 1.8 4.5 1925 1335 B 3 ASP H B 3 ASP HA 1.0 1.8 4.5 1926 1336 B 3 ASP H B 3 ASP HA 1.0 1.8 4.5 1927 1337 B 3 ASP HA B 3 ASP HBx 1.0 1.8 3.5 1928 1337 B 3 ASP HA B 3 ASP HBy 1.0 1.8 3.5 1929 1338 B 4 HIS H B 3 ASP HA 1.0 1.8 5.5 1930 1339 B 3 ASP HA B 7 GLU H 1.0 1.8 5.5 1931 1340 B 2 ALA HB1 B 3 ASP HBx 1.0 1.8 5.5 1932 1340 B 2 ALA HB1 B 3 ASP HBy 1.0 1.8 5.5 1933 1341 B 4 HIS H B 3 ASP HBx 1.0 1.8 4.5 1934 1341 B 4 HIS H B 3 ASP HBy 1.0 1.8 4.5 1935 1342 B 4 HIS H B 2 ALA HB1 1.0 1.8 4.5 1936 1343 B 4 HIS H B 4 HIS HA 1.0 1.8 4.5 1937 1344 B 4 HIS H B 5 GLU H 1.0 1.8 3.5 1938 1345 B 4 HIS HA B 3 ASP HBx 1.0 1.8 5.5 1939 1345 B 3 ASP HBy B 4 HIS HA 1.0 1.8 5.5 1940 1346 B 4 HIS H B 4 HIS HA 1.0 1.8 4.5 1941 1347 B 5 GLU H B 4 HIS HA 1.0 1.8 5.5 1942 1348 B 4 HIS HA B 6 ARG H 1.0 1.8 5.5 1943 1349 B 4 HIS H B 4 HIS HBx 1.0 1.8 5.5 1944 1350 B 4 HIS HBx B 4 HIS HBy 1.0 1.8 3.5 1945 1351 B 5 GLU H B 4 HIS HBx 1.0 1.8 4.5 1946 1352 B 4 HIS H B 4 HIS HBy 1.0 1.8 3.5 1947 1353 B 5 GLU H B 4 HIS HBy 1.0 1.8 5.5 1948 1354 B 2 ALA HB1 B 4 HIS HD2 1.0 1.8 5.5 1949 1355 B 4 HIS H B 4 HIS HD2 1.0 1.8 5.5 1950 1356 B 2 ALA HB1 B 4 HIS HE1 1.0 1.8 4.5 1951 1357 B 5 GLU H B 4 HIS HE1 1.0 1.8 5.5 1952 1358 B 2 ALA HB1 B 5 GLU H 1.0 1.8 4.5 1953 1359 B 4 HIS H B 5 GLU H 1.0 1.8 3.5 1954 1360 B 5 GLU H B 5 GLU HA 1.0 1.8 4.5 1955 1361 B 5 GLU H B 5 GLU HA 1.0 1.8 4.5 1956 1362 B 6 ARG H B 5 GLU HA 1.0 1.8 5.5 1957 1363 B 5 GLU HA B 9 GLN H 1.0 1.8 5.5 1958 1364 B 2 ALA HB1 B 5 GLU HBx 1.0 1.8 3.5 1959 1364 B 2 ALA HB1 B 5 GLU HBy 1.0 1.8 3.5 1960 1365 B 5 GLU H B 5 GLU HBx 1.0 1.8 3.5 1961 1365 B 5 GLU H B 5 GLU HBy 1.0 1.8 3.5 1962 1366 B 5 GLU HBx B 5 GLU HGx 1.0 1.8 3.5 1963 1366 B 5 GLU HBy B 5 GLU HGx 1.0 1.8 3.5 1964 1366 B 5 GLU HGy B 5 GLU HBx 1.0 1.8 3.5 1965 1366 B 5 GLU HBy B 5 GLU HGy 1.0 1.8 3.5 1966 1367 B 2 ALA HB1 B 5 GLU HGx 1.0 1.8 4.5 1967 1367 B 2 ALA HB1 B 5 GLU HGy 1.0 1.8 4.5 1968 1368 B 5 GLU H B 5 GLU HGx 1.0 1.8 3.5 1969 1368 B 5 GLU H B 5 GLU HGy 1.0 1.8 3.5 1970 1369 B 5 GLU HBx B 5 GLU HGx 1.0 1.8 3.5 1971 1369 B 5 GLU HBy B 5 GLU HGx 1.0 1.8 3.5 1972 1369 B 5 GLU HGy B 5 GLU HBx 1.0 1.8 3.5 1973 1369 B 5 GLU HBy B 5 GLU HGy 1.0 1.8 3.5 1974 1370 B 6 ARG H B 5 GLU HGx 1.0 1.8 5.5 1975 1370 B 6 ARG H B 5 GLU HGy 1.0 1.8 5.5 1976 1371 B 2 ALA HB1 B 6 ARG H 1.0 1.8 5.5 1977 1372 B 4 HIS H B 6 ARG H 1.0 1.8 5.5 1978 1373 B 6 ARG H B 5 GLU HA 1.0 1.8 5.5 1979 1374 B 6 ARG H B 6 ARG HA 1.0 1.8 4.5 1980 1375 B 6 ARG HA B 8 ALA H 1.0 1.8 5.5 1981 1376 B 6 ARG H B 6 ARG HBx 1.0 1.8 4.5 1982 1376 B 6 ARG H B 6 ARG HBy 1.0 1.8 4.5 1983 1377 B 6 ARG H B 6 ARG HDx 1.0 1.8 5.5 1984 1377 B 6 ARG H B 6 ARG HDy 1.0 1.8 5.5 1985 1378 B 6 ARG H B 6 ARG HGx 1.0 1.8 5.5 1986 1378 B 6 ARG H B 6 ARG HGy 1.0 1.8 5.5 1987 1379 B 6 ARG HH1% B 6 ARG HE 1.0 1.8 5.5 1988 1380 B 7 GLU H B 5 GLU HA 1.0 1.8 5.5 1989 1381 B 7 GLU HA B 10 LYS H 1.0 1.8 5.5 1990 1382 B 7 GLU HA B 11 ALA H 1.0 1.8 5.5 1991 1383 B 7 GLU H B 7 GLU HA 1.0 1.8 3.5 1992 1384 B 8 ALA H B 7 GLU HA 1.0 1.8 5.5 1993 1385 B 7 GLU H B 7 GLU HBx 1.0 1.8 3.5 1994 1385 B 7 GLU H B 7 GLU HBy 1.0 1.8 3.5 1995 1386 B 7 GLU HBx B 7 GLU HGx 1.0 1.8 3.5 1996 1386 B 7 GLU HBy B 7 GLU HGx 1.0 1.8 3.5 1997 1386 B 7 GLU HGy B 7 GLU HBx 1.0 1.8 3.5 1998 1386 B 7 GLU HBy B 7 GLU HGy 1.0 1.8 3.5 1999 1387 B 8 ALA H B 7 GLU HBx 1.0 1.8 3.5 2000 1387 B 8 ALA H B 7 GLU HBy 1.0 1.8 3.5 2001 1388 B 8 ALA HA B 7 GLU HBx 1.0 1.8 5.5 2002 1388 B 7 GLU HBy B 8 ALA HA 1.0 1.8 5.5 2003 1389 B 7 GLU HGy B 10 LYS HBx 1.0 1.8 4.5 2004 1389 B 7 GLU HGx B 10 LYS HBx 1.0 1.8 4.5 2005 1389 B 10 LYS HBy B 7 GLU HGx 1.0 1.8 4.5 2006 1389 B 7 GLU HGy B 10 LYS HBy 1.0 1.8 4.5 2007 1390 B 11 ALA H B 7 GLU HGx 1.0 1.8 5.5 2008 1390 B 11 ALA H B 7 GLU HGy 1.0 1.8 5.5 2009 1391 B 7 GLU H B 7 GLU HGx 1.0 1.8 5.5 2010 1391 B 7 GLU H B 7 GLU HGy 1.0 1.8 5.5 2011 1392 B 8 ALA H B 7 GLU HGx 1.0 1.8 5.5 2012 1392 B 8 ALA H B 7 GLU HGy 1.0 1.8 5.5 2013 1393 B 5 GLU HA B 8 ALA H 1.0 1.8 5.5 2014 1394 B 8 ALA H B 7 GLU HA 1.0 1.8 5.5 2015 1395 B 8 ALA H B 8 ALA HA 1.0 1.8 4.5 2016 1396 B 8 ALA HA B 12 GLU H 1.0 1.8 5.5 2017 1397 B 9 GLN H B 8 ALA HA 1.0 1.8 5.5 2018 1398 B 8 ALA H B 8 ALA HB1 1.0 1.8 3.5 2019 1399 B 5 GLU HA B 9 GLN H 1.0 1.8 5.5 2020 1400 B 9 GLN H B 8 ALA H 1.0 1.8 4.5 2021 1401 B 9 GLN H B 8 ALA HA 1.0 1.8 5.5 2022 1402 B 10 LYS H B 9 GLN HA 1.0 1.8 4.5 2023 1403 B 8 ALA HB1 B 9 GLN HA 1.0 1.8 5.5 2024 1404 B 9 GLN HE2x B 9 GLN HE2y 1.0 1.8 3.5 2025 1405 B 9 GLN HE2x B 9 GLN HE2y 1.0 1.8 3.5 2026 1406 B 9 GLN HE2x B 9 GLN HBx 1.0 1.8 4.5 2027 1406 B 9 GLN HE2x B 9 GLN HBy 1.0 1.8 4.5 2028 1407 B 9 GLN HE2y B 9 GLN HBx 1.0 1.8 4.5 2029 1407 B 9 GLN HE2y B 9 GLN HBy 1.0 1.8 4.5 2030 1408 B 9 GLN HE2x B 9 GLN HGx 1.0 1.8 4.5 2031 1408 B 9 GLN HE2x B 9 GLN HGy 1.0 1.8 4.5 2032 1409 B 9 GLN HE2y B 9 GLN HGx 1.0 1.8 4.5 2033 1409 B 9 GLN HE2y B 9 GLN HGy 1.0 1.8 4.5 2034 1410 B 9 GLN HBy B 9 GLN HGx 1.0 1.8 3.5 2035 1410 B 9 GLN HBx B 9 GLN HGx 1.0 1.8 3.5 2036 1410 B 9 GLN HGy B 9 GLN HBx 1.0 1.8 3.5 2037 1410 B 9 GLN HBy B 9 GLN HGy 1.0 1.8 3.5 2038 1411 B 10 LYS HBx B 10 LYS HGx 1.0 1.8 4.5 2039 1411 B 10 LYS HBy B 10 LYS HGx 1.0 1.8 4.5 2040 1411 B 10 LYS HGy B 10 LYS HBx 1.0 1.8 4.5 2041 1411 B 10 LYS HBy B 10 LYS HGy 1.0 1.8 4.5 2042 1412 B 11 ALA H B 11 ALA HA 1.0 1.8 4.5 2043 1413 B 11 ALA H B 11 ALA HA 1.0 1.8 4.5 2044 1414 B 11 ALA HA B 14 GLU H 1.0 1.8 4.5 2045 1415 B 11 ALA H B 11 ALA HB1 1.0 1.8 3.5 2046 1416 B 8 ALA HA B 11 ALA HB1 1.0 1.8 3.5 2047 1417 B 12 GLU H B 11 ALA HA 1.0 1.8 4.5 2048 1418 B 8 ALA HA B 12 GLU H 1.0 1.8 5.5 2049 1419 B 12 GLU H B 12 GLU HA 1.0 1.8 4.5 2050 1420 B 12 GLU HA B 15 LEU H 1.0 1.8 5.5 2051 1421 B 12 GLU HA B 15 LEU HBx 1.0 1.8 5.5 2052 1422 B 12 GLU H B 12 GLU HBx 1.0 1.8 3.5 2053 1422 B 12 GLU H B 12 GLU HBy 1.0 1.8 3.5 2054 1423 B 12 GLU H B 12 GLU HGx 1.0 1.8 4.5 2055 1423 B 12 GLU H B 12 GLU HGy 1.0 1.8 4.5 2056 1424 B 13 GLU H B 12 GLU HGx 1.0 1.8 5.5 2057 1424 B 12 GLU HGy B 13 GLU H 1.0 1.8 5.5 2058 1425 B 13 GLU H B 10 LYS HA 1.0 1.8 4.5 2059 1426 B 11 ALA H B 13 GLU H 1.0 1.8 5.5 2060 1427 B 14 GLU H B 13 GLU H 1.0 1.8 4.5 2061 1428 B 13 GLU H B 13 GLU HA 1.0 1.8 4.5 2062 1429 B 13 GLU H B 13 GLU HBx 1.0 1.8 3.5 2063 1429 B 13 GLU H B 13 GLU HBy 1.0 1.8 3.5 2064 1430 B 13 GLU HBx B 13 GLU HGx 1.0 1.8 3.5 2065 1430 B 13 GLU HBy B 13 GLU HGx 1.0 1.8 3.5 2066 1430 B 13 GLU HGy B 13 GLU HBx 1.0 1.8 3.5 2067 1430 B 13 GLU HBy B 13 GLU HGy 1.0 1.8 3.5 2068 1431 B 13 GLU H B 13 GLU HGx 1.0 1.8 5.5 2069 1431 B 13 GLU H B 13 GLU HGy 1.0 1.8 5.5 2070 1432 B 11 ALA HA B 14 GLU H 1.0 1.8 4.5 2071 1433 B 14 GLU H B 14 GLU HA 1.0 1.8 3.5 2072 1434 B 14 GLU HA B 17 LYS H 1.0 1.8 5.5 2073 1435 B 14 GLU H B 14 GLU HBx 1.0 1.8 3.5 2074 1435 B 14 GLU H B 14 GLU HBy 1.0 1.8 3.5 2075 1436 B 14 GLU H B 14 GLU HGx 1.0 1.8 5.5 2076 1436 B 14 GLU H B 14 GLU HGy 1.0 1.8 5.5 2077 1437 B 12 GLU HA B 15 LEU H 1.0 1.8 5.5 2078 1438 B 15 LEU H B 15 LEU HA 1.0 1.8 4.5 2079 1439 B 15 LEU H B 15 LEU HA 1.0 1.8 3.5 2080 1440 B 15 LEU HBx B 15 LEU HA 1.0 1.8 4.5 2081 1441 B 15 LEU HA B 19 LEU H 1.0 1.8 5.5 2082 1442 B 15 LEU H B 15 LEU HBy 1.0 1.8 3.5 2083 1443 B 19 LEU H B 15 LEU HG 1.0 1.8 5.5 2084 1444 B 15 LEU H B 15 LEU HD11 1.0 1.8 4.5 2085 1445 B 15 LEU HA B 16 GLN H 1.0 1.8 5.5 2086 1446 B 16 GLN H B 16 GLN HE2x 1.0 1.8 5.5 2087 1447 B 15 LEU HBy B 16 GLN HA 1.0 1.8 5.5 2088 1448 B 17 LYS H B 16 GLN HA 1.0 1.8 5.5 2089 1449 B 16 GLN HA B 20 GLU H 1.0 1.8 5.5 2090 1450 B 16 GLN HE2x B 16 GLN HE2y 1.0 1.8 3.5 2091 1451 B 16 GLN H B 16 GLN HBx 1.0 1.8 3.5 2092 1451 B 16 GLN H B 16 GLN HBy 1.0 1.8 3.5 2093 1452 B 16 GLN HA B 16 GLN HBx 1.0 1.8 4.5 2094 1452 B 16 GLN HA B 16 GLN HBy 1.0 1.8 4.5 2095 1453 B 16 GLN HE2x B 16 GLN HBx 1.0 1.8 4.5 2096 1453 B 16 GLN HE2x B 16 GLN HBy 1.0 1.8 4.5 2097 1454 B 16 GLN HE2y B 16 GLN HBx 1.0 1.8 4.5 2098 1454 B 16 GLN HE2y B 16 GLN HBy 1.0 1.8 4.5 2099 1455 B 16 GLN HBy B 16 GLN HGx 1.0 1.8 3.5 2100 1455 B 16 GLN HBx B 16 GLN HGx 1.0 1.8 3.5 2101 1455 B 16 GLN HGy B 16 GLN HBx 1.0 1.8 3.5 2102 1455 B 16 GLN HBy B 16 GLN HGy 1.0 1.8 3.5 2103 1456 B 16 GLN HBy B 20 GLU HGx 1.0 1.8 4.5 2104 1456 B 16 GLN HBx B 20 GLU HGx 1.0 1.8 4.5 2105 1456 B 20 GLU HGy B 16 GLN HBx 1.0 1.8 4.5 2106 1456 B 16 GLN HBy B 20 GLU HGy 1.0 1.8 4.5 2107 1457 B 16 GLN H B 16 GLN HGx 1.0 1.8 3.5 2108 1457 B 16 GLN H B 16 GLN HGy 1.0 1.8 3.5 2109 1458 B 16 GLN HE2y B 16 GLN HGx 1.0 1.8 4.5 2110 1458 B 16 GLN HE2y B 16 GLN HGy 1.0 1.8 4.5 2111 1459 B 14 GLU HA B 17 LYS H 1.0 1.8 5.5 2112 1460 B 17 LYS H B 15 LEU HA 1.0 1.8 5.5 2113 1461 B 17 LYS H B 17 LYS HA 1.0 1.8 4.5 2114 1462 B 17 LYS HA B 18 VAL H 1.0 1.8 5.5 2115 1463 B 20 GLU H B 17 LYS HA 1.0 1.8 5.5 2116 1464 B 17 LYS H B 17 LYS HBx 1.0 1.8 3.5 2117 1464 B 17 LYS H B 17 LYS HBy 1.0 1.8 3.5 2118 1465 B 17 LYS H B 17 LYS HDx 1.0 1.8 5.5 2119 1465 B 17 LYS H B 17 LYS HDy 1.0 1.8 5.5 2120 1466 B 17 LYS HBy B 17 LYS HDx 1.0 1.8 4.5 2121 1466 B 17 LYS HBx B 17 LYS HDx 1.0 1.8 4.5 2122 1466 B 17 LYS HDy B 17 LYS HBx 1.0 1.8 4.5 2123 1466 B 17 LYS HBy B 17 LYS HDy 1.0 1.8 4.5 2124 1467 B 18 VAL H B 17 LYS HDx 1.0 1.8 5.5 2125 1467 B 18 VAL H B 17 LYS HDy 1.0 1.8 5.5 2126 1468 B 17 LYS HEx B 17 LYS HGx 1.0 1.8 4.5 2127 1468 B 17 LYS HEy B 17 LYS HGx 1.0 1.8 4.5 2128 1468 B 17 LYS HGy B 17 LYS HEx 1.0 1.8 4.5 2129 1468 B 17 LYS HEy B 17 LYS HGy 1.0 1.8 4.5 2130 1469 B 17 LYS H B 17 LYS HGx 1.0 1.8 5.5 2131 1469 B 17 LYS H B 17 LYS HGy 1.0 1.8 5.5 2132 1470 B 15 LEU HA B 18 VAL H 1.0 1.8 4.5 2133 1471 B 19 LEU H B 18 VAL H 1.0 1.8 3.5 2134 1472 B 18 VAL H B 18 VAL HA 1.0 1.8 3.5 2135 1473 B 18 VAL H B 18 VAL HB 1.0 1.8 3.5 2136 1474 B 19 LEU H B 18 VAL HB 1.0 1.8 3.5 2137 1475 B 17 LYS HGy B 18 VAL HG11 1.0 1.8 5.5 2138 1475 B 18 VAL HG21 B 17 LYS HGx 1.0 1.8 5.5 2139 1475 B 17 LYS HGy B 18 VAL HG21 1.0 1.8 5.5 2140 1475 B 17 LYS HGx B 18 VAL HG11 1.0 1.8 5.5 2141 1476 B 18 VAL H B 18 VAL HG11 1.0 1.8 3.5 2142 1476 B 18 VAL H B 18 VAL HG21 1.0 1.8 3.5 2143 1477 B 15 LEU HA B 19 LEU H 1.0 1.8 5.5 2144 1478 B 19 LEU H B 18 VAL H 1.0 1.8 3.5 2145 1479 B 19 LEU H B 19 LEU HA 1.0 1.8 4.5 2146 1480 B 20 GLU H B 19 LEU HA 1.0 1.8 5.5 2147 1481 B 18 VAL H B 19 LEU HG 1.0 1.8 5.5 2148 1482 B 19 LEU H B 19 LEU HG 1.0 1.8 3.5 2149 1483 B 15 LEU HD11 B 19 LEU HBx 1.0 1.8 5.5 2150 1483 B 15 LEU HD11 B 19 LEU HBy 1.0 1.8 5.5 2151 1484 B 19 LEU HD11 B 19 LEU HBx 1.0 1.8 4.5 2152 1484 B 19 LEU HBy B 19 LEU HD11 1.0 1.8 4.5 2153 1485 B 20 GLU H B 19 LEU HD11 1.0 1.8 5.5 2154 1486 B 19 LEU H B 19 LEU HD21 1.0 1.8 4.5 2155 1487 B 20 GLU H B 20 GLU HA 1.0 1.8 3.5 2156 1488 B 20 GLU H B 20 GLU HA 1.0 1.8 3.5 2157 1489 B 20 GLU H B 20 GLU HBx 1.0 1.8 3.5 2158 1489 B 20 GLU H B 20 GLU HBy 1.0 1.8 3.5 2159 1490 B 20 GLU HBx B 20 GLU HGx 1.0 1.8 3.5 2160 1490 B 20 GLU HBy B 20 GLU HGx 1.0 1.8 3.5 2161 1490 B 20 GLU HGy B 20 GLU HBx 1.0 1.8 3.5 2162 1490 B 20 GLU HGy B 20 GLU HBy 1.0 1.8 3.5 2163 1491 B 21 GLU H B 20 GLU HBx 1.0 1.8 3.5 2164 1491 B 20 GLU HBy B 21 GLU H 1.0 1.8 3.5 2165 1492 B 21 GLU HA B 20 GLU HBx 1.0 1.8 5.5 2166 1492 B 20 GLU HBy B 21 GLU HA 1.0 1.8 5.5 2167 1493 B 20 GLU H B 20 GLU HGx 1.0 1.8 3.5 2168 1493 B 20 GLU H B 20 GLU HGy 1.0 1.8 3.5 2169 1494 B 20 GLU HA B 21 GLU H 1.0 1.8 5.5 2170 1495 B 21 GLU H B 21 GLU HA 1.0 1.8 3.5 2171 1496 B 21 GLU HA B 22 ALA H 1.0 1.8 5.5 2172 1497 B 21 GLU HA B 25 LYS H 1.0 1.8 5.5 2173 1498 B 21 GLU HA B 21 GLU HBx 1.0 1.8 4.5 2174 1498 B 21 GLU HA B 21 GLU HBy 1.0 1.8 4.5 2175 1499 B 22 ALA H B 21 GLU HBx 1.0 1.8 3.5 2176 1499 B 22 ALA H B 21 GLU HBy 1.0 1.8 3.5 2177 1500 B 22 ALA H B 21 GLU HGx 1.0 1.8 4.5 2178 1500 B 22 ALA H B 21 GLU HGy 1.0 1.8 4.5 2179 1501 B 22 ALA H B 22 ALA HA 1.0 1.8 3.5 2180 1502 B 22 ALA HA B 22 ALA HB1 1.0 1.8 4.5 2181 1503 B 22 ALA HA B 23 SER H 1.0 1.8 5.5 2182 1504 B 25 LYS H B 22 ALA HA 1.0 1.8 4.5 2183 1505 B 22 ALA HA B 26 ALA H 1.0 1.8 5.5 2184 1506 B 22 ALA H B 22 ALA HB1 1.0 1.8 3.5 2185 1507 B 22 ALA HB1 B 23 SER H 1.0 1.8 3.5 2186 1508 B 23 SER H B 23 SER HA 1.0 1.8 4.5 2187 1509 B 23 SER HA B 24 LYS H 1.0 1.8 5.5 2188 1510 B 23 SER HA B 26 ALA HB1 1.0 1.8 3.5 2189 1511 B 23 SER H B 23 SER HBx 1.0 1.8 3.5 2190 1511 B 23 SER H B 23 SER HBy 1.0 1.8 3.5 2191 1512 B 24 LYS H B 23 SER HBx 1.0 1.8 4.5 2192 1512 B 24 LYS H B 23 SER HBy 1.0 1.8 4.5 2193 1513 B 23 SER HBx B 24 LYS HBx 1.0 1.8 4.5 2194 1513 B 23 SER HBy B 24 LYS HBx 1.0 1.8 4.5 2195 1513 B 24 LYS HBy B 23 SER HBx 1.0 1.8 4.5 2196 1513 B 23 SER HBy B 24 LYS HBy 1.0 1.8 4.5 2197 1514 B 24 LYS H B 24 LYS HA 1.0 1.8 4.5 2198 1515 B 24 LYS H B 24 LYS HA 1.0 1.8 3.5 2199 1516 B 25 LYS H B 24 LYS HA 1.0 1.8 5.5 2200 1517 B 24 LYS H B 24 LYS HBx 1.0 1.8 3.5 2201 1517 B 24 LYS H B 24 LYS HBy 1.0 1.8 3.5 2202 1518 B 25 LYS H B 24 LYS HBx 1.0 1.8 3.5 2203 1518 B 25 LYS H B 24 LYS HBy 1.0 1.8 3.5 2204 1519 B 24 LYS H B 24 LYS HDx 1.0 1.8 5.5 2205 1519 B 24 LYS H B 24 LYS HDy 1.0 1.8 5.5 2206 1520 B 25 LYS H B 24 LYS HDx 1.0 1.8 3.5 2207 1520 B 25 LYS H B 24 LYS HDy 1.0 1.8 3.5 2208 1521 B 24 LYS H B 24 LYS HGx 1.0 1.8 5.5 2209 1521 B 24 LYS H B 24 LYS HGy 1.0 1.8 5.5 2210 1522 B 25 LYS H B 24 LYS HGx 1.0 1.8 5.5 2211 1522 B 25 LYS H B 24 LYS HGy 1.0 1.8 5.5 2212 1523 B 27 VAL HB B 24 LYS HGx 1.0 1.8 5.5 2213 1523 B 24 LYS HGy B 27 VAL HB 1.0 1.8 5.5 2214 1524 B 25 LYS H B 24 LYS HA 1.0 1.8 5.5 2215 1525 B 25 LYS H B 25 LYS HA 1.0 1.8 3.5 2216 1526 B 26 ALA H B 25 LYS HA 1.0 1.8 5.5 2217 1527 B 25 LYS HA B 28 GLU H 1.0 1.8 4.5 2218 1528 B 25 LYS HA B 29 ALA H 1.0 1.8 5.5 2219 1529 B 25 LYS H B 25 LYS HBx 1.0 1.8 3.5 2220 1529 B 25 LYS H B 25 LYS HBy 1.0 1.8 3.5 2221 1530 B 26 ALA H B 25 LYS HBx 1.0 1.8 4.5 2222 1530 B 26 ALA H B 25 LYS HBy 1.0 1.8 4.5 2223 1531 B 25 LYS H B 25 LYS HDx 1.0 1.8 5.5 2224 1531 B 25 LYS H B 25 LYS HDy 1.0 1.8 5.5 2225 1532 B 24 LYS HDx B 25 LYS HEx 1.0 1.8 4.5 2226 1532 B 24 LYS HDy B 25 LYS HEx 1.0 1.8 4.5 2227 1532 B 25 LYS HEy B 24 LYS HDx 1.0 1.8 4.5 2228 1532 B 24 LYS HDy B 25 LYS HEy 1.0 1.8 4.5 2229 1533 B 25 LYS HDy B 25 LYS HEx 1.0 1.8 4.5 2230 1533 B 25 LYS HEy B 25 LYS HDx 1.0 1.8 4.5 2231 1533 B 25 LYS HDy B 25 LYS HEy 1.0 1.8 4.5 2232 1533 B 25 LYS HDx B 25 LYS HEx 1.0 1.8 4.5 2233 1534 B 25 LYS HEx B 25 LYS HGx 1.0 1.8 4.5 2234 1534 B 25 LYS HEy B 25 LYS HGx 1.0 1.8 4.5 2235 1534 B 25 LYS HGy B 25 LYS HEx 1.0 1.8 4.5 2236 1534 B 25 LYS HEy B 25 LYS HGy 1.0 1.8 4.5 2237 1535 B 25 LYS H B 25 LYS HGx 1.0 1.8 3.5 2238 1535 B 25 LYS H B 25 LYS HGy 1.0 1.8 3.5 2239 1536 B 26 ALA H B 26 ALA HA 1.0 1.8 4.5 2240 1537 B 26 ALA HA B 27 VAL H 1.0 1.8 5.5 2241 1538 B 29 ALA H B 26 ALA HA 1.0 1.8 5.5 2242 1539 B 26 ALA H B 26 ALA HB1 1.0 1.8 3.5 2243 1540 B 26 ALA HB1 B 27 VAL H 1.0 1.8 3.5 2244 1541 B 24 LYS HA B 27 VAL H 1.0 1.8 5.5 2245 1542 B 26 ALA HA B 27 VAL H 1.0 1.8 5.5 2246 1543 B 26 ALA HB1 B 27 VAL H 1.0 1.8 4.5 2247 1544 B 27 VAL H B 27 VAL HA 1.0 1.8 4.5 2248 1545 B 28 GLU H B 27 VAL H 1.0 1.8 3.5 2249 1546 B 29 ALA H B 27 VAL H 1.0 1.8 5.5 2250 1547 B 27 VAL H B 27 VAL HA 1.0 1.8 3.5 2251 1548 B 27 VAL HB B 24 LYS HGx 1.0 1.8 5.5 2252 1548 B 24 LYS HGy B 27 VAL HB 1.0 1.8 5.5 2253 1549 B 27 VAL HB B 27 VAL H 1.0 1.8 3.5 2254 1550 B 27 VAL HB B 28 GLU H 1.0 1.8 3.5 2255 1551 B 26 ALA HB1 B 27 VAL HG11 1.0 1.8 4.5 2256 1551 B 26 ALA HB1 B 27 VAL HG21 1.0 1.8 4.5 2257 1552 B 27 VAL H B 27 VAL HG11 1.0 1.8 3.5 2258 1552 B 27 VAL H B 27 VAL HG21 1.0 1.8 3.5 2259 1553 B 25 LYS HA B 28 GLU H 1.0 1.8 4.5 2260 1554 B 28 GLU H B 27 VAL HA 1.0 1.8 4.5 2261 1555 B 28 GLU H B 28 GLU HA 1.0 1.8 3.5 2262 1556 B 29 ALA H B 28 GLU HA 1.0 1.8 5.5 2263 1557 B 24 LYS HEx B 28 GLU HBx 1.0 1.8 5.5 2264 1557 B 28 GLU HBy B 24 LYS HEx 1.0 1.8 5.5 2265 1557 B 28 GLU HBy B 24 LYS HEy 1.0 1.8 5.5 2266 1557 B 24 LYS HEy B 28 GLU HBx 1.0 1.8 5.5 2267 1558 B 24 LYS HGx B 28 GLU HBx 1.0 1.8 5.5 2268 1558 B 24 LYS HGy B 28 GLU HBx 1.0 1.8 5.5 2269 1558 B 28 GLU HBy B 24 LYS HGx 1.0 1.8 5.5 2270 1558 B 24 LYS HGy B 28 GLU HBy 1.0 1.8 5.5 2271 1559 B 25 LYS HGy B 28 GLU HBx 1.0 1.8 5.5 2272 1559 B 25 LYS HGx B 28 GLU HBx 1.0 1.8 5.5 2273 1559 B 28 GLU HBy B 25 LYS HGx 1.0 1.8 5.5 2274 1559 B 25 LYS HGy B 28 GLU HBy 1.0 1.8 5.5 2275 1560 B 28 GLU H B 28 GLU HBx 1.0 1.8 3.5 2276 1560 B 28 GLU H B 28 GLU HBy 1.0 1.8 3.5 2277 1561 B 28 GLU HBx B 28 GLU HGx 1.0 1.8 3.5 2278 1561 B 28 GLU HBy B 28 GLU HGx 1.0 1.8 3.5 2279 1561 B 28 GLU HGy B 28 GLU HBx 1.0 1.8 3.5 2280 1561 B 28 GLU HBy B 28 GLU HGy 1.0 1.8 3.5 2281 1562 B 29 ALA H B 28 GLU HBx 1.0 1.8 3.5 2282 1562 B 29 ALA H B 28 GLU HBy 1.0 1.8 3.5 2283 1563 B 29 ALA HA B 28 GLU HBx 1.0 1.8 5.5 2284 1563 B 28 GLU HBy B 29 ALA HA 1.0 1.8 5.5 2285 1564 B 29 ALA H B 28 GLU HGx 1.0 1.8 5.5 2286 1564 B 29 ALA H B 28 GLU HGy 1.0 1.8 5.5 2287 1565 B 29 ALA H B 27 VAL HA 1.0 1.8 5.5 2288 1566 B 29 ALA H B 29 ALA HA 1.0 1.8 4.5 2289 1567 B 29 ALA H B 29 ALA HA 1.0 1.8 4.5 2290 1568 B 29 ALA HA B 30 GLU H 1.0 1.8 5.5 2291 1569 B 29 ALA H B 29 ALA HB1 1.0 1.8 3.5 2292 1570 B 30 GLU HA B 31 ARG H 1.0 1.8 5.5 2293 1571 B 30 GLU HA B 33 ALA HB1 1.0 1.8 4.5 2294 1572 B 30 GLU H B 30 GLU HBx 1.0 1.8 3.5 2295 1572 B 30 GLU H B 30 GLU HBy 1.0 1.8 3.5 2296 1573 B 30 GLU HBx B 30 GLU HGx 1.0 1.8 3.5 2297 1573 B 30 GLU HBy B 30 GLU HGx 1.0 1.8 3.5 2298 1573 B 30 GLU HGy B 30 GLU HBx 1.0 1.8 3.5 2299 1573 B 30 GLU HBy B 30 GLU HGy 1.0 1.8 3.5 2300 1574 B 31 ARG H B 30 GLU HGx 1.0 1.8 5.5 2301 1574 B 31 ARG H B 30 GLU HGy 1.0 1.8 5.5 2302 1575 B 30 GLU HA B 31 ARG H 1.0 1.8 5.5 2303 1576 B 31 ARG H B 31 ARG HE 1.0 1.8 6.5 2304 1577 B 31 ARG H B 31 ARG HA 1.0 1.8 4.5 2305 1578 B 31 ARG HA B 31 ARG HBx 1.0 1.8 4.5 2306 1578 B 31 ARG HA B 31 ARG HBy 1.0 1.8 4.5 2307 1579 B 31 ARG HA B 32 GLY H 1.0 1.8 3.5 2308 1580 B 31 ARG HE B 31 ARG HDx 1.0 1.8 3.5 2309 1580 B 31 ARG HE B 31 ARG HDy 1.0 1.8 3.5 2310 1581 B 31 ARG H B 31 ARG HBx 1.0 1.8 3.5 2311 1581 B 31 ARG H B 31 ARG HBy 1.0 1.8 3.5 2312 1582 B 31 ARG HE B 31 ARG HBx 1.0 1.8 5.5 2313 1582 B 31 ARG HE B 31 ARG HBy 1.0 1.8 5.5 2314 1583 B 31 ARG HBy B 31 ARG HGx 1.0 1.8 3.5 2315 1583 B 31 ARG HBx B 31 ARG HGx 1.0 1.8 3.5 2316 1583 B 31 ARG HGy B 31 ARG HBx 1.0 1.8 3.5 2317 1583 B 31 ARG HBy B 31 ARG HGy 1.0 1.8 3.5 2318 1584 B 31 ARG H B 31 ARG HDx 1.0 1.8 5.5 2319 1584 B 31 ARG H B 31 ARG HDy 1.0 1.8 5.5 2320 1585 B 31 ARG HE B 31 ARG HDx 1.0 1.8 3.5 2321 1585 B 31 ARG HE B 31 ARG HDy 1.0 1.8 3.5 2322 1586 B 32 GLY H B 31 ARG HDx 1.0 1.8 4.5 2323 1586 B 32 GLY H B 31 ARG HDy 1.0 1.8 4.5 2324 1587 B 31 ARG H B 31 ARG HGx 1.0 1.8 3.5 2325 1587 B 31 ARG H B 31 ARG HGy 1.0 1.8 3.5 2326 1588 B 31 ARG HE B 31 ARG HGx 1.0 1.8 3.5 2327 1588 B 31 ARG HE B 31 ARG HGy 1.0 1.8 3.5 2328 1589 B 32 GLY H B 31 ARG HGx 1.0 1.8 5.5 2329 1589 B 32 GLY H B 31 ARG HGy 1.0 1.8 5.5 2330 1590 B 31 ARG HE B 31 ARG HH1% 1.0 1.8 4.5 2331 1591 B 31 ARG HE B 31 ARG HH2% 1.0 1.8 4.5 2332 1592 B 32 GLY H B 31 ARG HDx 1.0 1.8 5.5 2333 1592 B 32 GLY H B 31 ARG HDy 1.0 1.8 5.5 2334 1593 B 32 GLY H B 32 GLY HAx 1.0 1.8 4.5 2335 1593 B 32 GLY H B 32 GLY HAy 1.0 1.8 4.5 2336 1594 B 31 ARG HBy B 32 GLY HAx 1.0 1.8 4.5 2337 1594 B 31 ARG HBx B 32 GLY HAx 1.0 1.8 4.5 2338 1594 B 32 GLY HAy B 31 ARG HBx 1.0 1.8 4.5 2339 1594 B 31 ARG HBy B 32 GLY HAy 1.0 1.8 4.5 2340 1595 B 32 GLY H B 32 GLY HAx 1.0 1.8 3.5 2341 1595 B 32 GLY H B 32 GLY HAy 1.0 1.8 3.5 2342 1596 B 33 ALA H B 32 GLY HAx 1.0 1.8 3.5 2343 1596 B 32 GLY HAy B 33 ALA H 1.0 1.8 3.5 2344 1597 B 33 ALA H B 32 GLY HAx 1.0 1.8 4.5 2345 1597 B 32 GLY HAy B 33 ALA H 1.0 1.8 4.5 2346 1598 B 33 ALA H B 33 ALA HA 1.0 1.8 4.5 2347 1599 B 33 ALA HB1 B 33 ALA HA 1.0 1.8 3.5 2348 1600 B 33 ALA HA B 34 PRO HDx 1.0 1.8 4.5 2349 1601 B 33 ALA HB1 B 33 ALA H 1.0 1.8 3.5 2350 1602 B 33 ALA HB1 B 36 ALA HA 1.0 1.8 5.5 2351 1603 B 34 PRO HDx B 34 PRO HA 1.0 1.8 5.5 2352 1604 B 33 ALA HB1 B 34 PRO HDx 1.0 1.8 3.5 2353 1605 B 33 ALA HB1 B 34 PRO HDy 1.0 1.8 5.5 2354 1606 B 35 GLY H B 34 PRO HBx 1.0 1.8 4.5 2355 1606 B 34 PRO HBy B 35 GLY H 1.0 1.8 4.5 2356 1607 B 33 ALA HB1 B 34 PRO HGx 1.0 1.8 5.5 2357 1607 B 33 ALA HB1 B 34 PRO HGy 1.0 1.8 5.5 2358 1608 B 34 PRO HBy B 34 PRO HGx 1.0 1.8 3.5 2359 1608 B 34 PRO HBx B 34 PRO HGx 1.0 1.8 3.5 2360 1608 B 34 PRO HGy B 34 PRO HBx 1.0 1.8 3.5 2361 1608 B 34 PRO HBy B 34 PRO HGy 1.0 1.8 3.5 2362 1609 B 34 PRO HA B 35 GLY H 1.0 1.8 5.5 2363 1610 B 35 GLY H B 36 ALA H 1.0 1.8 5.5 2364 1611 B 35 GLY H B 35 GLY HAx 1.0 1.8 3.5 2365 1611 B 35 GLY H B 35 GLY HAy 1.0 1.8 3.5 2366 1612 B 36 ALA H B 35 GLY HAx 1.0 1.8 3.5 2367 1612 B 36 ALA H B 35 GLY HAy 1.0 1.8 3.5 2368 1613 B 36 ALA H B 35 GLY HAx 1.0 1.8 4.5 2369 1613 B 36 ALA H B 35 GLY HAy 1.0 1.8 4.5 2370 1614 B 33 ALA HB1 B 36 ALA HA 1.0 1.8 5.5 2371 1615 B 36 ALA HA B 36 ALA H 1.0 1.8 4.5 2372 1616 B 36 ALA H B 36 ALA HB1 1.0 1.8 3.5 2373 1617 B 36 ALA HB1 B 37 ALA H 1.0 1.8 4.5 2374 1618 B 36 ALA HA B 37 ALA H 1.0 1.8 4.5 2375 1619 B 37 ALA H B 37 ALA HA 1.0 1.8 4.5 2376 1620 B 36 ALA HA B 37 ALA HB1 1.0 1.8 5.5 2377 1621 B 37 ALA H B 37 ALA HB1 1.0 1.8 4.5 2378 1622 B 38 LEU HA B 38 LEU H 1.0 1.8 4.5 2379 1623 B 38 LEU HA B 38 LEU HBx 1.0 1.8 4.5 2380 1623 B 38 LEU HA B 38 LEU HBy 1.0 1.8 4.5 2381 1624 B 38 LEU H B 38 LEU HG 1.0 1.8 5.5 2382 1625 B 38 LEU H B 38 LEU HBx 1.0 1.8 3.5 2383 1625 B 38 LEU H B 38 LEU HBy 1.0 1.8 3.5 2384 1626 B 38 LEU H B 38 LEU HD11 1.0 1.8 5.5 2385 1626 B 38 LEU H B 38 LEU HD21 1.0 1.8 5.5 2386 1627 B 39 ILE H B 38 LEU HD11 1.0 1.8 5.5 2387 1627 B 38 LEU HD21 B 39 ILE H 1.0 1.8 5.5 2388 1628 B 39 ILE H B 39 ILE HA 1.0 1.8 3.5 2389 1629 B 39 ILE HB B 39 ILE HG1x 1.0 1.8 4.5 2390 1629 B 39 ILE HB B 39 ILE HG1y 1.0 1.8 4.5 2391 1630 B 39 ILE HB B 39 ILE HG21 1.0 1.8 4.5 2392 1631 B 39 ILE HB B 40 SER H 1.0 1.8 5.5 2393 1632 B 39 ILE HD11 B 39 ILE HG1x 1.0 1.8 4.5 2394 1632 B 39 ILE HG1y B 39 ILE HD11 1.0 1.8 4.5 2395 1633 B 39 ILE HG21 B 39 ILE HD11 1.0 1.8 4.5 2396 1634 B 36 ALA HB1 B 39 ILE HG1x 1.0 1.8 5.5 2397 1634 B 36 ALA HB1 B 39 ILE HG1y 1.0 1.8 5.5 2398 1635 B 39 ILE H B 39 ILE HG1x 1.0 1.8 4.5 2399 1635 B 39 ILE H B 39 ILE HG1y 1.0 1.8 4.5 2400 1636 B 39 ILE HB B 39 ILE HG1x 1.0 1.8 4.5 2401 1636 B 39 ILE HB B 39 ILE HG1y 1.0 1.8 4.5 2402 1637 B 39 ILE H B 39 ILE HG21 1.0 1.8 4.5 2403 1638 B 39 ILE HB B 39 ILE HG21 1.0 1.8 4.5 2404 1639 B 39 ILE HG21 B 40 SER H 1.0 1.8 5.5 2405 1640 B 40 SER H B 40 SER HA 1.0 1.8 4.5 2406 1641 B 40 SER HA B 39 ILE HG1x 1.0 1.8 5.5 2407 1641 B 39 ILE HG1y B 40 SER HA 1.0 1.8 5.5 2408 1642 B 40 SER H B 40 SER HA 1.0 1.8 4.5 2409 1643 B 40 SER HA B 41 TYR H 1.0 1.8 4.5 2410 1644 B 42 PRO HDy B 40 SER HBx 1.0 1.8 5.5 2411 1644 B 40 SER HBy B 42 PRO HDy 1.0 1.8 5.5 2412 1645 B 40 SER HA B 41 TYR H 1.0 1.8 4.5 2413 1646 B 41 TYR H B 41 TYR HA 1.0 1.8 4.5 2414 1647 B 41 TYR HBx B 41 TYR HBy 1.0 1.8 4.5 2415 1648 B 42 PRO HA B 43 ASP H 1.0 1.8 5.5 2416 1649 B 42 PRO HDy B 42 PRO HDx 1.0 1.8 3.5 2417 1650 B 43 ASP H B 42 PRO HDx 1.0 1.8 5.5 2418 1651 B 42 PRO HDy B 42 PRO HDx 1.0 1.8 3.5 2419 1652 B 42 PRO HDy B 43 ASP H 1.0 1.8 4.5 2420 1653 B 42 PRO HBx B 42 PRO HGx 1.0 1.8 4.5 2421 1653 B 42 PRO HBy B 42 PRO HGx 1.0 1.8 4.5 2422 1653 B 42 PRO HGy B 42 PRO HBx 1.0 1.8 4.5 2423 1653 B 42 PRO HBy B 42 PRO HGy 1.0 1.8 4.5 2424 1654 B 43 ASP H B 42 PRO HBx 1.0 1.8 5.5 2425 1654 B 43 ASP H B 42 PRO HBy 1.0 1.8 5.5 2426 1655 B 43 ASP H B 43 ASP HA 1.0 1.8 3.5 2427 1656 B 43 ASP HA B 44 ALA H 1.0 1.8 4.5 2428 1657 B 43 ASP HA B 45 ILE H 1.0 1.8 5.5 2429 1658 B 43 ASP HA B 45 ILE HG21 1.0 1.8 5.5 2430 1659 B 43 ASP H B 43 ASP HBx 1.0 1.8 5.5 2431 1660 B 43 ASP HBx B 43 ASP HBy 1.0 1.8 4.5 2432 1661 B 44 ALA H B 43 ASP HBx 1.0 1.8 5.5 2433 1662 B 44 ALA H B 43 ASP HBy 1.0 1.8 5.5 2434 1663 B 43 ASP H B 44 ALA H 1.0 1.8 4.5 2435 1664 B 44 ALA H B 45 ILE H 1.0 1.8 4.5 2436 1665 B 44 ALA H B 44 ALA HA 1.0 1.8 4.5 2437 1666 B 45 ILE H B 44 ALA HA 1.0 1.8 5.5 2438 1667 B 44 ALA H B 44 ALA HB1 1.0 1.8 3.5 2439 1668 B 45 ILE H B 44 ALA HB1 1.0 1.8 4.5 2440 1669 B 44 ALA HB1 B 46 TRP H 1.0 1.8 5.5 2441 1670 B 44 ALA H B 45 ILE H 1.0 1.8 3.5 2442 1671 B 45 ILE H B 46 TRP H 1.0 1.8 4.5 2443 1672 B 45 ILE H B 45 ILE HA 1.0 1.8 4.5 2444 1673 B 46 TRP H B 45 ILE HA 1.0 1.8 5.5 2445 1674 B 45 ILE H B 45 ILE HB 1.0 1.8 3.5 2446 1675 B 46 TRP H B 45 ILE HB 1.0 1.8 5.5 2447 1676 B 45 ILE H B 45 ILE HD11 1.0 1.8 5.5 2448 1677 B 45 ILE HD11 B 45 ILE HG1x 1.0 1.8 5.5 2449 1677 B 45 ILE HD11 B 45 ILE HG1y 1.0 1.8 5.5 2450 1678 B 45 ILE HG21 B 45 ILE HD11 1.0 1.8 4.5 2451 1679 B 46 TRP H B 45 ILE HD11 1.0 1.8 5.5 2452 1680 B 45 ILE HD11 B 49 VAL HG21 1.0 1.8 4.5 2453 1681 B 45 ILE H B 45 ILE HG1x 1.0 1.8 5.5 2454 1681 B 45 ILE H B 45 ILE HG1y 1.0 1.8 5.5 2455 1682 B 46 TRP H B 45 ILE HG1x 1.0 1.8 5.5 2456 1682 B 46 TRP H B 45 ILE HG1y 1.0 1.8 5.5 2457 1683 B 45 ILE H B 45 ILE HG21 1.0 1.8 4.5 2458 1684 B 45 ILE HG21 B 45 ILE HG1x 1.0 1.8 4.5 2459 1684 B 45 ILE HG21 B 45 ILE HG1y 1.0 1.8 4.5 2460 1685 B 45 ILE H B 46 TRP H 1.0 1.8 4.5 2461 1686 B 46 TRP H B 47 TRP H 1.0 1.8 4.5 2462 1687 B 46 TRP H B 46 TRP HA 1.0 1.8 4.5 2463 1688 B 47 TRP H B 46 TRP HA 1.0 1.8 5.5 2464 1689 B 46 TRP HD1 B 46 TRP HE1 1.0 1.8 3.5 2465 1690 B 46 TRP HE1 B 46 TRP HZ2 1.0 1.8 4.5 2466 1691 B 46 TRP H B 46 TRP HBx 1.0 1.8 4.5 2467 1691 B 46 TRP H B 46 TRP HBy 1.0 1.8 4.5 2468 1692 B 46 TRP HE1 B 46 TRP HBx 1.0 1.8 5.5 2469 1692 B 46 TRP HE1 B 46 TRP HBy 1.0 1.8 5.5 2470 1693 B 47 TRP H B 46 TRP HBx 1.0 1.8 4.5 2471 1693 B 47 TRP H B 46 TRP HBy 1.0 1.8 4.5 2472 1694 B 47 TRP H B 48 SER H 1.0 1.8 4.5 2473 1695 B 47 TRP H B 47 TRP HA 1.0 1.8 4.5 2474 1696 B 48 SER H B 47 TRP HA 1.0 1.8 4.5 2475 1697 B 47 TRP HA B 50 GLU H 1.0 1.8 5.5 2476 1698 B 48 SER H B 47 TRP HBx 1.0 1.8 5.5 2477 1699 B 47 TRP H B 47 TRP HBy 1.0 1.8 4.5 2478 1700 B 47 TRP HD1 B 47 TRP HE1 1.0 1.8 3.5 2479 1701 B 47 TRP H B 47 TRP HE3 1.0 1.8 4.5 2480 1702 B 47 TRP HE1 B 47 TRP HZ2 1.0 1.8 4.5 2481 1703 B 46 TRP H B 48 SER H 1.0 1.8 5.5 2482 1704 B 48 SER H B 48 SER HA 1.0 1.8 4.5 2483 1705 B 48 SER HA B 49 VAL H 1.0 1.8 4.5 2484 1706 B 48 SER HA B 51 THR H 1.0 1.8 5.5 2485 1707 B 48 SER H B 48 SER HBx 1.0 1.8 4.5 2486 1707 B 48 SER H B 48 SER HBy 1.0 1.8 4.5 2487 1708 B 49 VAL H B 48 SER HBx 1.0 1.8 4.5 2488 1708 B 49 VAL H B 48 SER HBy 1.0 1.8 4.5 2489 1709 B 52 ALA HB1 B 48 SER HBx 1.0 1.8 5.5 2490 1709 B 48 SER HBy B 52 ALA HB1 1.0 1.8 5.5 2491 1710 B 49 VAL H B 49 VAL HA 1.0 1.8 4.5 2492 1711 B 51 THR H B 49 VAL HA 1.0 1.8 5.5 2493 1712 B 49 VAL H B 49 VAL HB 1.0 1.8 3.5 2494 1713 B 49 VAL HB B 50 GLU HGx 1.0 1.8 5.5 2495 1713 B 49 VAL HB B 50 GLU HGy 1.0 1.8 5.5 2496 1714 B 49 VAL H B 49 VAL HG11 1.0 1.8 5.5 2497 1715 B 50 GLU H B 49 VAL HG11 1.0 1.8 4.5 2498 1716 B 45 ILE HG21 B 49 VAL HG21 1.0 1.8 5.5 2499 1717 B 49 VAL H B 49 VAL HG21 1.0 1.8 3.5 2500 1718 B 50 GLU H B 49 VAL HG21 1.0 1.8 5.5 2501 1719 B 53 THR HG21 B 49 VAL HG21 1.0 1.8 5.5 2502 1720 B 50 GLU H B 50 GLU HA 1.0 1.8 4.5 2503 1721 B 50 GLU H B 50 GLU HBx 1.0 1.8 3.5 2504 1721 B 50 GLU H B 50 GLU HBy 1.0 1.8 3.5 2505 1722 B 51 THR H B 50 GLU HBx 1.0 1.8 5.5 2506 1722 B 51 THR H B 50 GLU HBy 1.0 1.8 5.5 2507 1723 B 49 VAL H B 50 GLU HGx 1.0 1.8 5.5 2508 1723 B 49 VAL H B 50 GLU HGy 1.0 1.8 5.5 2509 1724 B 50 GLU H B 50 GLU HGx 1.0 1.8 4.5 2510 1724 B 50 GLU H B 50 GLU HGy 1.0 1.8 4.5 2511 1725 B 51 THR H B 50 GLU HGx 1.0 1.8 4.5 2512 1725 B 51 THR H B 50 GLU HGy 1.0 1.8 4.5 2513 1726 B 51 THR H B 50 GLU HA 1.0 1.8 4.5 2514 1727 B 51 THR H B 50 GLU HBx 1.0 1.8 5.5 2515 1727 B 51 THR H B 50 GLU HBy 1.0 1.8 5.5 2516 1728 B 51 THR H B 51 THR HA 1.0 1.8 3.5 2517 1729 B 51 THR HA B 53 THR H 1.0 1.8 5.5 2518 1730 B 51 THR H B 51 THR HB 1.0 1.8 4.5 2519 1731 B 52 ALA HB1 B 51 THR HB 1.0 1.8 5.5 2520 1732 B 51 THR H B 51 THR HG21 1.0 1.8 5.5 2521 1733 B 51 THR HG21 B 52 ALA H 1.0 1.8 4.5 2522 1734 B 52 ALA HB1 B 51 THR HG21 1.0 1.8 4.5 2523 1735 B 51 THR H B 52 ALA H 1.0 1.8 4.5 2524 1736 B 52 ALA HB1 B 52 ALA H 1.0 1.8 4.5 2525 1737 B 52 ALA H B 52 ALA HA 1.0 1.8 3.5 2526 1738 B 53 THR H B 52 ALA HA 1.0 1.8 5.5 2527 1739 B 52 ALA HB1 B 52 ALA H 1.0 1.8 3.5 2528 1740 B 52 ALA HB1 B 53 THR H 1.0 1.8 4.5 2529 1741 B 52 ALA HB1 B 54 THR H 1.0 1.8 5.5 2530 1742 B 53 THR H B 52 ALA HA 1.0 1.8 5.5 2531 1743 B 52 ALA HB1 B 53 THR H 1.0 1.8 4.5 2532 1744 B 52 ALA HB1 B 53 THR HA 1.0 1.8 5.5 2533 1745 B 53 THR H B 53 THR HA 1.0 1.8 3.5 2534 1746 B 53 THR H B 53 THR HB 1.0 1.8 5.5 2535 1747 B 54 THR H B 53 THR HB 1.0 1.8 5.5 2536 1748 B 53 THR HG21 B 53 THR H 1.0 1.8 3.5 2537 1749 B 53 THR HG21 B 54 THR H 1.0 1.8 5.5 2538 1750 B 53 THR HG21 B 55 VAL H 1.0 1.8 5.5 2539 1751 B 52 ALA HA B 54 THR H 1.0 1.8 4.5 2540 1752 B 52 ALA HB1 B 54 THR H 1.0 1.8 5.5 2541 1753 B 54 THR H B 54 THR HA 1.0 1.8 3.5 2542 1754 B 54 THR HB B 54 THR H 1.0 1.8 5.5 2543 1755 B 54 THR H B 54 THR HG21 1.0 1.8 3.5 2544 1756 B 55 VAL H B 54 THR HG21 1.0 1.8 5.5 2545 1757 B 55 VAL H B 55 VAL HA 1.0 1.8 4.5 2546 1758 B 55 VAL H B 56 GLY H 1.0 1.8 3.5 2547 1759 B 55 VAL H B 55 VAL HA 1.0 1.8 3.5 2548 1760 B 55 VAL HA B 56 GLY H 1.0 1.8 5.5 2549 1761 B 55 VAL H B 55 VAL HB 1.0 1.8 3.5 2550 1762 B 56 GLY H B 55 VAL HB 1.0 1.8 4.5 2551 1763 B 53 THR HG21 B 55 VAL HG11 1.0 1.8 4.5 2552 1763 B 53 THR HG21 B 55 VAL HG21 1.0 1.8 4.5 2553 1764 B 55 VAL H B 55 VAL HG11 1.0 1.8 3.5 2554 1764 B 55 VAL H B 55 VAL HG21 1.0 1.8 3.5 2555 1765 B 56 GLY H B 55 VAL HG11 1.0 1.8 4.5 2556 1765 B 56 GLY H B 55 VAL HG21 1.0 1.8 4.5 2557 1766 B 56 GLY HAx B 55 VAL HG11 1.0 1.8 5.5 2558 1766 B 55 VAL HG21 B 56 GLY HAx 1.0 1.8 5.5 2559 1767 B 57 TYR H B 55 VAL HG11 1.0 1.8 4.5 2560 1767 B 55 VAL HG21 B 57 TYR H 1.0 1.8 4.5 2561 1768 B 56 GLY H B 56 GLY HAx 1.0 1.8 4.5 2562 1769 B 56 GLY H B 57 TYR H 1.0 1.8 4.5 2563 1770 B 56 GLY HAy B 56 GLY H 1.0 1.8 4.5 2564 1771 B 56 GLY H B 57 TYR H 1.0 1.8 4.5 2565 1772 B 57 TYR H B 57 TYR HA 1.0 1.8 5.5 2566 1773 B 58 GLY H B 57 TYR H 1.0 1.8 4.5 2567 1774 B 57 TYR H B 57 TYR HA 1.0 1.8 3.5 2568 1775 B 57 TYR HA B 57 TYR HBy 1.0 1.8 4.5 2569 1776 B 58 GLY H B 57 TYR HA 1.0 1.8 5.5 2570 1777 B 57 TYR HA B 57 TYR HBx 1.0 1.8 4.5 2571 1778 B 57 TYR HBy B 57 TYR HBx 1.0 1.8 3.5 2572 1779 B 58 GLY H B 57 TYR HD% 1.0 1.8 5.5 2573 1780 B 58 GLY H B 56 GLY HAx 1.0 1.8 5.5 2574 1781 B 58 GLY H B 57 TYR HA 1.0 1.8 5.5 2575 1782 B 58 GLY H B 58 GLY HAx 1.0 1.8 3.5 2576 1782 B 58 GLY H B 58 GLY HAy 1.0 1.8 3.5 2577 1783 B 58 GLY H B 59 ASP H 1.0 1.8 3.5 2578 1784 B 59 ASP H B 59 ASP HBx 1.0 1.8 4.5 2579 1784 B 59 ASP H B 59 ASP HBy 1.0 1.8 4.5 2580 1785 B 59 ASP H B 59 ASP HA 1.0 1.8 3.5 2581 1786 B 59 ASP HA B 59 ASP HBx 1.0 1.8 4.5 2582 1786 B 59 ASP HBy B 59 ASP HA 1.0 1.8 4.5 2583 1787 B 60 ARG H B 59 ASP HA 1.0 1.8 5.5 2584 1788 B 59 ASP H B 59 ASP HBx 1.0 1.8 3.5 2585 1788 B 59 ASP H B 59 ASP HBy 1.0 1.8 3.5 2586 1789 B 60 ARG H B 59 ASP HBx 1.0 1.8 4.5 2587 1789 B 60 ARG H B 59 ASP HBy 1.0 1.8 4.5 2588 1790 B 60 ARG H B 60 ARG HA 1.0 1.8 3.5 2589 1791 B 60 ARG HA B 61 TYR HBx 1.0 1.8 5.5 2590 1791 B 61 TYR HBy B 60 ARG HA 1.0 1.8 5.5 2591 1792 B 60 ARG H B 60 ARG HBx 1.0 1.8 4.5 2592 1792 B 60 ARG H B 60 ARG HBy 1.0 1.8 4.5 2593 1793 B 61 TYR H B 60 ARG HGx 1.0 1.8 5.5 2594 1793 B 60 ARG HGy B 61 TYR H 1.0 1.8 5.5 2595 1794 B 60 ARG HH1% B 60 ARG HE 1.0 1.8 5.5 2596 1795 B 60 ARG HE B 60 ARG HH2% 1.0 1.8 5.5 2597 1796 B 61 TYR HA B 62 PRO HDx 1.0 1.8 4.5 2598 1796 B 61 TYR HA B 62 PRO HDy 1.0 1.8 4.5 2599 1797 B 61 TYR HA B 61 TYR HBx 1.0 1.8 4.5 2600 1797 B 61 TYR HA B 61 TYR HBy 1.0 1.8 4.5 2601 1798 B 62 PRO HA B 63 VAL H 1.0 1.8 3.5 2602 1799 B 61 TYR HBy B 62 PRO HDx 1.0 1.8 5.5 2603 1799 B 61 TYR HBx B 62 PRO HDx 1.0 1.8 5.5 2604 1799 B 62 PRO HDy B 61 TYR HBx 1.0 1.8 5.5 2605 1799 B 61 TYR HBy B 62 PRO HDy 1.0 1.8 5.5 2606 1800 B 62 PRO HA B 62 PRO HDx 1.0 1.8 4.5 2607 1800 B 62 PRO HDy B 62 PRO HA 1.0 1.8 4.5 2608 1801 B 63 VAL H B 63 VAL HA 1.0 1.8 4.5 2609 1802 B 63 VAL H B 63 VAL HB 1.0 1.8 5.5 2610 1803 B 63 VAL HB B 64 THR H 1.0 1.8 5.5 2611 1804 B 63 VAL HG11 B 63 VAL H 1.0 1.8 4.5 2612 1805 B 63 VAL HG11 B 64 THR H 1.0 1.8 5.5 2613 1806 B 64 THR HG21 B 63 VAL HG11 1.0 1.8 5.5 2614 1807 B 64 THR HA B 64 THR H 1.0 1.8 4.5 2615 1808 B 64 THR HA B 66 GLU H 1.0 1.8 5.5 2616 1809 B 64 THR HB B 64 THR H 1.0 1.8 5.5 2617 1810 B 64 THR HB B 65 GLU H 1.0 1.8 4.5 2618 1811 B 64 THR HG21 B 64 THR H 1.0 1.8 4.5 2619 1812 B 64 THR HG21 B 65 GLU H 1.0 1.8 5.5 2620 1813 B 64 THR HG21 B 67 GLY H 1.0 1.8 6.5 2621 1814 B 65 GLU H B 65 GLU HA 1.0 1.8 3.5 2622 1815 B 66 GLU H B 65 GLU HA 1.0 1.8 5.5 2623 1816 B 65 GLU H B 65 GLU HBx 1.0 1.8 4.5 2624 1817 B 66 GLU H B 65 GLU HBx 1.0 1.8 5.5 2625 1818 B 65 GLU H B 65 GLU HBy 1.0 1.8 4.5 2626 1819 B 65 GLU H B 65 GLU HGx 1.0 1.8 5.5 2627 1819 B 65 GLU H B 65 GLU HGy 1.0 1.8 5.5 2628 1820 B 67 GLY H B 66 GLU HA 1.0 1.8 5.5 2629 1821 B 66 GLU H B 66 GLU HBx 1.0 1.8 4.5 2630 1821 B 66 GLU H B 66 GLU HBy 1.0 1.8 4.5 2631 1822 B 66 GLU HBy B 66 GLU HGx 1.0 1.8 3.5 2632 1822 B 66 GLU HBx B 66 GLU HGx 1.0 1.8 3.5 2633 1822 B 66 GLU HGy B 66 GLU HBx 1.0 1.8 3.5 2634 1822 B 66 GLU HBy B 66 GLU HGy 1.0 1.8 3.5 2635 1823 B 67 GLY H B 66 GLU HBx 1.0 1.8 4.5 2636 1823 B 67 GLY H B 66 GLU HBy 1.0 1.8 4.5 2637 1824 B 67 GLY H B 66 GLU HGx 1.0 1.8 5.5 2638 1824 B 67 GLY H B 66 GLU HGy 1.0 1.8 5.5 2639 1825 B 67 GLY H B 67 GLY HAx 1.0 1.8 3.5 2640 1825 B 67 GLY H B 67 GLY HAy 1.0 1.8 3.5 2641 1826 B 67 GLY H B 68 ARG H 1.0 1.8 4.5 2642 1827 B 68 ARG HA B 68 ARG H 1.0 1.8 4.5 2643 1828 B 68 ARG HE B 68 ARG HDx 1.0 1.8 3.5 2644 1828 B 68 ARG HDy B 68 ARG HE 1.0 1.8 3.5 2645 1829 B 68 ARG HE B 68 ARG HDx 1.0 1.8 3.5 2646 1829 B 68 ARG HDy B 68 ARG HE 1.0 1.8 3.5 2647 1830 B 68 ARG HE B 68 ARG HH1% 1.0 1.8 4.5 2648 1831 B 68 ARG HE B 68 ARG HH2% 1.0 1.8 4.5 2649 1832 B 69 LYS H B 69 LYS HA 1.0 1.8 3.5 2650 1833 B 69 LYS HBy B 69 LYS HGx 1.0 1.8 5.5 2651 1833 B 69 LYS HBx B 69 LYS HGx 1.0 1.8 5.5 2652 1833 B 69 LYS HGy B 69 LYS HBx 1.0 1.8 5.5 2653 1833 B 69 LYS HBy B 69 LYS HGy 1.0 1.8 5.5 2654 1834 B 69 LYS HDy B 69 LYS HEx 1.0 1.8 5.5 2655 1834 B 69 LYS HDx B 69 LYS HEx 1.0 1.8 5.5 2656 1834 B 69 LYS HEy B 69 LYS HDx 1.0 1.8 5.5 2657 1834 B 69 LYS HEy B 69 LYS HDy 1.0 1.8 5.5 2658 1835 B 70 VAL H B 72 GLU H 1.0 1.8 5.5 2659 1836 B 70 VAL H B 70 VAL HA 1.0 1.8 3.5 2660 1837 B 70 VAL HB B 71 ALA HA 1.0 1.8 5.5 2661 1838 B 71 ALA HB1 B 70 VAL HB 1.0 1.8 5.5 2662 1839 B 71 ALA HA B 70 VAL HG11 1.0 1.8 4.5 2663 1840 B 70 VAL HG11 B 71 ALA H 1.0 1.8 4.5 2664 1841 B 71 ALA HA B 71 ALA H 1.0 1.8 4.5 2665 1842 B 71 ALA HB1 B 71 ALA H 1.0 1.8 4.5 2666 1843 B 71 ALA HA B 71 ALA H 1.0 1.8 4.5 2667 1844 B 72 GLU H B 71 ALA HA 1.0 1.8 5.5 2668 1845 B 71 ALA HB1 B 71 ALA H 1.0 1.8 3.5 2669 1846 B 72 GLU HA B 72 GLU H 1.0 1.8 4.5 2670 1847 B 72 GLU HA B 71 ALA HB1 1.0 1.8 5.5 2671 1848 B 72 GLU HA B 72 GLU H 1.0 1.8 4.5 2672 1849 B 72 GLU HA B 76 LYS H 1.0 1.8 5.5 2673 1850 B 71 ALA HB1 B 72 GLU HBx 1.0 1.8 5.5 2674 1850 B 71 ALA HB1 B 72 GLU HBy 1.0 1.8 5.5 2675 1851 B 72 GLU H B 72 GLU HBx 1.0 1.8 3.5 2676 1851 B 72 GLU H B 72 GLU HBy 1.0 1.8 3.5 2677 1852 B 72 GLU HBx B 72 GLU HGx 1.0 1.8 4.5 2678 1852 B 72 GLU HBy B 72 GLU HGx 1.0 1.8 4.5 2679 1852 B 72 GLU HGy B 72 GLU HBx 1.0 1.8 4.5 2680 1852 B 72 GLU HGy B 72 GLU HBy 1.0 1.8 4.5 2681 1853 B 72 GLU H B 72 GLU HGx 1.0 1.8 6.5 2682 1853 B 72 GLU HGy B 72 GLU H 1.0 1.8 6.5 2683 1854 B 71 ALA H B 73 GLN H 1.0 1.8 5.5 2684 1855 B 72 GLU HA B 73 GLN H 1.0 1.8 5.5 2685 1856 B 73 GLN H B 73 GLN HA 1.0 1.8 3.5 2686 1857 B 73 GLN HA B 77 ALA HB1 1.0 1.8 5.5 2687 1858 B 73 GLN HE2y B 73 GLN HE2x 1.0 1.8 3.5 2688 1859 B 73 GLN HE2x B 73 GLN HBx 1.0 1.8 4.5 2689 1859 B 73 GLN HBy B 73 GLN HE2x 1.0 1.8 4.5 2690 1860 B 73 GLN HE2y B 73 GLN HBx 1.0 1.8 4.5 2691 1860 B 73 GLN HBy B 73 GLN HE2y 1.0 1.8 4.5 2692 1861 B 73 GLN HE2x B 73 GLN HGx 1.0 1.8 4.5 2693 1861 B 73 GLN HE2x B 73 GLN HGy 1.0 1.8 4.5 2694 1862 B 73 GLN HBy B 73 GLN HGx 1.0 1.8 3.5 2695 1862 B 73 GLN HBx B 73 GLN HGx 1.0 1.8 3.5 2696 1862 B 73 GLN HGy B 73 GLN HBx 1.0 1.8 3.5 2697 1862 B 73 GLN HBy B 73 GLN HGy 1.0 1.8 3.5 2698 1863 B 74 VAL H B 73 GLN HGx 1.0 1.8 4.5 2699 1863 B 73 GLN HGy B 74 VAL H 1.0 1.8 4.5 2700 1864 B 72 GLU HA B 74 VAL H 1.0 1.8 5.5 2701 1865 B 74 VAL H B 74 VAL HA 1.0 1.8 4.5 2702 1866 B 74 VAL H B 74 VAL HA 1.0 1.8 4.5 2703 1867 B 71 ALA HB1 B 74 VAL HB 1.0 1.8 5.5 2704 1868 B 74 VAL H B 74 VAL HB 1.0 1.8 3.5 2705 1869 B 71 ALA HA B 74 VAL HG11 1.0 1.8 5.5 2706 1870 B 74 VAL H B 74 VAL HG11 1.0 1.8 5.5 2707 1871 B 74 VAL HG11 B 78 GLY H 1.0 1.8 5.5 2708 1872 B 71 ALA HA B 74 VAL HG21 1.0 1.8 4.5 2709 1873 B 77 ALA HB1 B 74 VAL HG21 1.0 1.8 5.5 2710 1874 B 71 ALA HB1 B 75 MET H 1.0 1.8 5.5 2711 1875 B 72 GLU HA B 75 MET H 1.0 1.8 5.5 2712 1876 B 75 MET HA B 79 ILE H 1.0 1.8 5.5 2713 1877 B 75 MET HE1 B 71 ALA HA 1.0 1.8 4.5 2714 1878 B 71 ALA HB1 B 75 MET HE1 1.0 1.8 3.5 2715 1879 B 75 MET HE1 B 72 GLU HGx 1.0 1.8 4.5 2716 1879 B 72 GLU HGy B 75 MET HE1 1.0 1.8 4.5 2717 1880 B 72 GLU HA B 76 LYS H 1.0 1.8 5.5 2718 1881 B 76 LYS H B 76 LYS HA 1.0 1.8 4.5 2719 1882 B 76 LYS H B 76 LYS HA 1.0 1.8 3.5 2720 1883 B 76 LYS HA B 77 ALA H 1.0 1.8 5.5 2721 1884 B 78 GLY H B 76 LYS HA 1.0 1.8 5.5 2722 1885 B 76 LYS H B 76 LYS HBx 1.0 1.8 4.5 2723 1885 B 76 LYS H B 76 LYS HBy 1.0 1.8 4.5 2724 1886 B 76 LYS HBx B 76 LYS HGx 1.0 1.8 5.5 2725 1886 B 76 LYS HBy B 76 LYS HGx 1.0 1.8 5.5 2726 1886 B 76 LYS HGy B 76 LYS HBx 1.0 1.8 5.5 2727 1886 B 76 LYS HGy B 76 LYS HBy 1.0 1.8 5.5 2728 1887 B 76 LYS HBx B 80 GLU HGx 1.0 1.8 5.5 2729 1887 B 76 LYS HBy B 80 GLU HGx 1.0 1.8 5.5 2730 1887 B 80 GLU HGy B 76 LYS HBx 1.0 1.8 5.5 2731 1887 B 76 LYS HBy B 80 GLU HGy 1.0 1.8 5.5 2732 1888 B 76 LYS H B 76 LYS HDx 1.0 1.8 5.5 2733 1888 B 76 LYS H B 76 LYS HDy 1.0 1.8 5.5 2734 1889 B 77 ALA HA B 76 LYS HDx 1.0 1.8 5.5 2735 1889 B 76 LYS HDy B 77 ALA HA 1.0 1.8 5.5 2736 1890 B 76 LYS HDy B 80 GLU HGx 1.0 1.8 5.5 2737 1890 B 76 LYS HDx B 80 GLU HGx 1.0 1.8 5.5 2738 1890 B 80 GLU HGy B 76 LYS HDx 1.0 1.8 5.5 2739 1890 B 80 GLU HGy B 76 LYS HDy 1.0 1.8 5.5 2740 1891 B 76 LYS HGx B 80 GLU HGx 1.0 1.8 4.5 2741 1891 B 76 LYS HGy B 80 GLU HGx 1.0 1.8 4.5 2742 1891 B 80 GLU HGy B 76 LYS HGx 1.0 1.8 4.5 2743 1891 B 76 LYS HGy B 80 GLU HGy 1.0 1.8 4.5 2744 1892 B 76 LYS HA B 77 ALA H 1.0 1.8 5.5 2745 1893 B 77 ALA H B 77 ALA HA 1.0 1.8 4.5 2746 1894 B 77 ALA HB1 B 77 ALA H 1.0 1.8 4.5 2747 1895 B 79 ILE H B 77 ALA H 1.0 1.8 5.5 2748 1896 B 77 ALA H B 77 ALA HA 1.0 1.8 4.5 2749 1897 B 78 GLY H B 77 ALA HA 1.0 1.8 5.5 2750 1898 B 77 ALA HB1 B 77 ALA H 1.0 1.8 3.5 2751 1899 B 77 ALA HB1 B 78 GLY H 1.0 1.8 4.5 2752 1900 B 78 GLY H B 76 LYS HA 1.0 1.8 5.5 2753 1901 B 78 GLY H B 77 ALA HA 1.0 1.8 5.5 2754 1902 B 77 ALA HB1 B 78 GLY H 1.0 1.8 4.5 2755 1903 B 78 GLY H B 78 GLY HAx 1.0 1.8 4.5 2756 1903 B 78 GLY H B 78 GLY HAy 1.0 1.8 4.5 2757 1904 B 78 GLY H B 79 ILE H 1.0 1.8 4.5 2758 1905 B 78 GLY H B 78 GLY HAx 1.0 1.8 3.5 2759 1905 B 78 GLY H B 78 GLY HAy 1.0 1.8 3.5 2760 1906 B 79 ILE H B 78 GLY HAx 1.0 1.8 4.5 2761 1906 B 79 ILE H B 78 GLY HAy 1.0 1.8 4.5 2762 1907 B 78 GLY H B 79 ILE H 1.0 1.8 4.5 2763 1908 B 79 ILE H B 79 ILE HA 1.0 1.8 4.5 2764 1909 B 79 ILE H B 80 GLU H 1.0 1.8 4.5 2765 1910 B 79 ILE H B 79 ILE HA 1.0 1.8 4.5 2766 1911 B 79 ILE HA B 80 GLU H 1.0 1.8 5.5 2767 1912 B 79 ILE HA B 82 PHE HBx 1.0 1.8 5.5 2768 1913 B 76 LYS H B 79 ILE HD11 1.0 1.8 5.5 2769 1914 B 79 ILE HD11 B 76 LYS HBx 1.0 1.8 5.5 2770 1914 B 76 LYS HBy B 79 ILE HD11 1.0 1.8 5.5 2771 1915 B 79 ILE H B 79 ILE HG1x 1.0 1.8 4.5 2772 1915 B 79 ILE H B 79 ILE HG1y 1.0 1.8 4.5 2773 1916 B 79 ILE HG21 B 79 ILE HG1x 1.0 1.8 3.5 2774 1916 B 79 ILE HG1y B 79 ILE HG21 1.0 1.8 3.5 2775 1917 B 79 ILE H B 79 ILE HG21 1.0 1.8 5.5 2776 1918 B 79 ILE HG21 B 79 ILE HG1x 1.0 1.8 3.5 2777 1918 B 79 ILE HG1y B 79 ILE HG21 1.0 1.8 3.5 2778 1919 B 80 GLU H B 79 ILE HG21 1.0 1.8 5.5 2779 1920 B 76 LYS HA B 80 GLU H 1.0 1.8 5.5 2780 1921 B 80 GLU H B 80 GLU HA 1.0 1.8 4.5 2781 1922 B 80 GLU HA B 81 VAL H 1.0 1.8 4.5 2782 1923 B 80 GLU HA B 83 ALA HB1 1.0 1.8 3.5 2783 1924 B 77 ALA HB1 B 80 GLU HBx 1.0 1.8 5.5 2784 1924 B 77 ALA HB1 B 80 GLU HBy 1.0 1.8 5.5 2785 1925 B 80 GLU H B 80 GLU HBx 1.0 1.8 3.5 2786 1925 B 80 GLU H B 80 GLU HBy 1.0 1.8 3.5 2787 1926 B 83 ALA HB1 B 80 GLU HBx 1.0 1.8 5.5 2788 1926 B 83 ALA HB1 B 80 GLU HBy 1.0 1.8 5.5 2789 1927 B 76 LYS HBx B 80 GLU HGx 1.0 1.8 5.5 2790 1927 B 76 LYS HBy B 80 GLU HGx 1.0 1.8 5.5 2791 1927 B 80 GLU HGy B 76 LYS HBx 1.0 1.8 5.5 2792 1927 B 76 LYS HBy B 80 GLU HGy 1.0 1.8 5.5 2793 1928 B 77 ALA HA B 80 GLU HGx 1.0 1.8 5.5 2794 1928 B 80 GLU HGy B 77 ALA HA 1.0 1.8 5.5 2795 1929 B 80 GLU H B 80 GLU HGx 1.0 1.8 4.5 2796 1929 B 80 GLU HGy B 80 GLU H 1.0 1.8 4.5 2797 1930 B 77 ALA HA B 81 VAL H 1.0 1.8 5.5 2798 1931 B 81 VAL H B 78 GLY HAx 1.0 1.8 4.5 2799 1931 B 78 GLY HAy B 81 VAL H 1.0 1.8 4.5 2800 1932 B 79 ILE HA B 81 VAL H 1.0 1.8 5.5 2801 1933 B 81 VAL H B 81 VAL HA 1.0 1.8 3.5 2802 1934 B 81 VAL H B 81 VAL HB 1.0 1.8 3.5 2803 1935 B 78 GLY HAy B 81 VAL HG11 1.0 1.8 5.5 2804 1935 B 81 VAL HG11 B 78 GLY HAx 1.0 1.8 5.5 2805 1936 B 81 VAL H B 81 VAL HG11 1.0 1.8 5.5 2806 1937 B 84 LEU HBy B 81 VAL HG11 1.0 1.8 5.5 2807 1937 B 81 VAL HG11 B 84 LEU HBx 1.0 1.8 5.5 2808 1938 B 77 ALA HA B 81 VAL HG21 1.0 1.8 4.5 2809 1939 B 78 GLY HAy B 81 VAL HG21 1.0 1.8 5.5 2810 1939 B 78 GLY HAx B 81 VAL HG21 1.0 1.8 5.5 2811 1940 B 79 ILE HA B 82 PHE H 1.0 1.8 5.5 2812 1941 B 81 VAL HB B 82 PHE HA 1.0 1.8 5.5 2813 1942 B 82 PHE H B 82 PHE HA 1.0 1.8 4.5 2814 1943 B 82 PHE HA B 82 PHE HBx 1.0 1.8 5.5 2815 1944 B 83 ALA H B 82 PHE HA 1.0 1.8 5.5 2816 1945 B 82 PHE H B 82 PHE HBx 1.0 1.8 4.5 2817 1946 B 82 PHE HBx B 82 PHE HBy 1.0 1.8 3.5 2818 1947 B 83 ALA H B 82 PHE HBx 1.0 1.8 5.5 2819 1948 B 83 ALA HA B 82 PHE HBx 1.0 1.8 5.5 2820 1949 B 82 PHE H B 82 PHE HBy 1.0 1.8 5.5 2821 1950 B 82 PHE HBx B 82 PHE HBy 1.0 1.8 3.5 2822 1951 B 83 ALA H B 82 PHE HBy 1.0 1.8 4.5 2823 1952 B 82 PHE H B 82 PHE HD% 1.0 1.8 4.5 2824 1953 B 83 ALA H B 83 ALA HA 1.0 1.8 4.5 2825 1954 B 83 ALA H B 83 ALA HB1 1.0 1.8 4.5 2826 1955 B 83 ALA HA B 82 PHE HBx 1.0 1.8 5.5 2827 1956 B 83 ALA H B 83 ALA HA 1.0 1.8 3.5 2828 1957 B 83 ALA HB1 B 83 ALA HA 1.0 1.8 3.5 2829 1958 B 83 ALA H B 83 ALA HB1 1.0 1.8 3.5 2830 1959 B 81 VAL HA B 84 LEU H 1.0 1.8 4.5 2831 1960 B 83 ALA HB1 B 84 LEU HA 1.0 1.8 5.5 2832 1961 B 84 LEU H B 84 LEU HA 1.0 1.8 3.5 2833 1962 B 84 LEU HA B 84 LEU HBx 1.0 1.8 4.5 2834 1962 B 84 LEU HBy B 84 LEU HA 1.0 1.8 4.5 2835 1963 B 86 THR H B 84 LEU HA 1.0 1.8 5.5 2836 1964 B 84 LEU HG B 85 VAL H 1.0 1.8 5.5 2837 1965 B 85 VAL H B 84 LEU HBx 1.0 1.8 3.5 2838 1965 B 84 LEU HBy B 85 VAL H 1.0 1.8 3.5 2839 1966 B 84 LEU HD11 B 84 LEU H 1.0 1.8 5.5 2840 1967 B 84 LEU HD11 B 85 VAL H 1.0 1.8 5.5 2841 1968 B 84 LEU H B 84 LEU HD21 1.0 1.8 5.5 2842 1969 B 85 VAL H B 84 LEU HD21 1.0 1.8 3.5 2843 1970 B 85 VAL HB B 84 LEU HD21 1.0 1.8 5.5 2844 1971 B 86 THR H B 84 LEU HD21 1.0 1.8 5.5 2845 1972 B 85 VAL H B 85 VAL HA 1.0 1.8 5.5 2846 1973 B 86 THR H B 85 VAL HA 1.0 1.8 5.5 2847 1974 B 85 VAL H B 85 VAL HB 1.0 1.8 3.5 2848 1975 B 85 VAL HB B 85 VAL HA 1.0 1.8 4.5 2849 1976 B 86 THR H B 85 VAL HB 1.0 1.8 4.5 2850 1977 B 84 LEU HBy B 85 VAL HG11 1.0 1.8 4.5 2851 1977 B 84 LEU HBx B 85 VAL HG11 1.0 1.8 4.5 2852 1977 B 85 VAL HG21 B 84 LEU HBx 1.0 1.8 4.5 2853 1977 B 84 LEU HBy B 85 VAL HG21 1.0 1.8 4.5 2854 1978 B 85 VAL H B 85 VAL HG11 1.0 1.8 3.5 2855 1978 B 85 VAL H B 85 VAL HG21 1.0 1.8 3.5 2856 1979 B 89 LEU H B 85 VAL HG11 1.0 1.8 5.5 2857 1979 B 85 VAL HG21 B 89 LEU H 1.0 1.8 5.5 2858 1980 B 86 THR H B 85 VAL HB 1.0 1.8 5.5 2859 1981 B 86 THR H B 86 THR HA 1.0 1.8 3.5 2860 1982 B 87 ALA H B 86 THR HA 1.0 1.8 5.5 2861 1983 B 86 THR HA B 88 ALA H 1.0 1.8 5.5 2862 1984 B 89 LEU H B 86 THR HA 1.0 1.8 4.5 2863 1985 B 86 THR HA B 89 LEU HBx 1.0 1.8 4.5 2864 1985 B 89 LEU HBy B 86 THR HA 1.0 1.8 4.5 2865 1986 B 90 ALA H B 86 THR HA 1.0 1.8 5.5 2866 1987 B 86 THR H B 86 THR HB 1.0 1.8 3.5 2867 1988 B 86 THR H B 86 THR HG21 1.0 1.8 5.5 2868 1989 B 87 ALA H B 86 THR HG21 1.0 1.8 4.5 2869 1990 B 87 ALA H B 87 ALA HB1 1.0 1.8 4.5 2870 1991 B 87 ALA H B 87 ALA HA 1.0 1.8 3.5 2871 1992 B 88 ALA H B 87 ALA HA 1.0 1.8 5.5 2872 1993 B 89 LEU H B 87 ALA HA 1.0 1.8 5.5 2873 1994 B 87 ALA HA B 91 THR H 1.0 1.8 5.5 2874 1995 B 87 ALA H B 87 ALA HB1 1.0 1.8 3.5 2875 1996 B 87 ALA HB1 B 88 ALA H 1.0 1.8 3.5 2876 1997 B 87 ALA HB1 B 89 LEU H 1.0 1.8 5.5 2877 1998 B 85 VAL HA B 88 ALA H 1.0 1.8 5.5 2878 1999 B 88 ALA H B 88 ALA HA 1.0 1.8 3.5 2879 2000 B 88 ALA HA B 88 ALA HB1 1.0 1.8 3.5 2880 2001 B 89 LEU H B 88 ALA HA 1.0 1.8 5.5 2881 2002 B 88 ALA HA B 92 ASP H 1.0 1.8 5.5 2882 2003 B 88 ALA H B 88 ALA HB1 1.0 1.8 3.5 2883 2004 B 89 LEU H B 88 ALA H 1.0 1.8 3.5 2884 2005 B 88 ALA HB1 B 89 LEU HA 1.0 1.8 5.5 2885 2006 B 89 LEU H B 89 LEU HA 1.0 1.8 3.5 2886 2007 B 89 LEU HA B 89 LEU HBx 1.0 1.8 4.5 2887 2007 B 89 LEU HBy B 89 LEU HA 1.0 1.8 4.5 2888 2008 B 90 ALA H B 89 LEU HA 1.0 1.8 5.5 2889 2009 B 91 THR H B 89 LEU HA 1.0 1.8 5.5 2890 2010 B 92 ASP H B 89 LEU HA 1.0 1.8 4.5 2891 2011 B 89 LEU HA B 92 ASP HBx 1.0 1.8 5.5 2892 2011 B 89 LEU HA B 92 ASP HBy 1.0 1.8 5.5 2893 2012 B 86 THR H B 89 LEU HG 1.0 1.8 5.5 2894 2013 B 86 THR HA B 89 LEU HG 1.0 1.8 5.5 2895 2014 B 89 LEU H B 89 LEU HBx 1.0 1.8 3.5 2896 2014 B 89 LEU HBy B 89 LEU H 1.0 1.8 3.5 2897 2015 B 90 ALA H B 89 LEU HBx 1.0 1.8 4.5 2898 2015 B 90 ALA H B 89 LEU HBy 1.0 1.8 4.5 2899 2016 B 90 ALA HA B 89 LEU HBx 1.0 1.8 5.5 2900 2016 B 89 LEU HBy B 90 ALA HA 1.0 1.8 5.5 2901 2017 B 91 THR H B 89 LEU HBx 1.0 1.8 5.5 2902 2017 B 89 LEU HBy B 91 THR H 1.0 1.8 5.5 2903 2018 B 89 LEU HD11 B 89 LEU H 1.0 1.8 5.5 2904 2019 B 90 ALA H B 91 THR H 1.0 1.8 3.5 2905 2020 B 90 ALA HA B 89 LEU HBx 1.0 1.8 5.5 2906 2020 B 89 LEU HBy B 90 ALA HA 1.0 1.8 5.5 2907 2021 B 90 ALA H B 90 ALA HA 1.0 1.8 4.5 2908 2022 B 90 ALA HA B 93 PHE HBx 1.0 1.8 5.5 2909 2022 B 90 ALA HA B 93 PHE HBy 1.0 1.8 5.5 2910 2023 B 90 ALA HB1 B 90 ALA H 1.0 1.8 3.5 2911 2024 B 90 ALA HB1 B 91 THR H 1.0 1.8 4.5 2912 2025 B 91 THR H B 90 ALA HA 1.0 1.8 4.5 2913 2026 B 91 THR H B 91 THR HA 1.0 1.8 3.5 2914 2027 B 91 THR HG21 B 91 THR H 1.0 1.8 5.5 2915 2028 B 91 THR HG21 B 92 ASP H 1.0 1.8 4.5 2916 2029 B 88 ALA HA B 92 ASP H 1.0 1.8 5.5 2917 2030 B 92 ASP H B 89 LEU HA 1.0 1.8 4.5 2918 2031 B 91 THR H B 92 ASP H 1.0 1.8 3.5 2919 2032 B 92 ASP H B 91 THR HA 1.0 1.8 5.5 2920 2033 B 92 ASP H B 92 ASP HA 1.0 1.8 4.5 2921 2034 B 91 THR HG21 B 92 ASP HA 1.0 1.8 4.5 2922 2035 B 92 ASP H B 92 ASP HA 1.0 1.8 3.5 2923 2036 B 92 ASP HA B 93 PHE H 1.0 1.8 5.5 2924 2037 B 92 ASP HA B 94 VAL H 1.0 1.8 5.5 2925 2038 B 91 THR H B 92 ASP HBx 1.0 1.8 5.5 2926 2038 B 91 THR H B 92 ASP HBy 1.0 1.8 5.5 2927 2039 B 92 ASP H B 92 ASP HBx 1.0 1.8 3.5 2928 2039 B 92 ASP H B 92 ASP HBy 1.0 1.8 3.5 2929 2040 B 93 PHE H B 92 ASP HBx 1.0 1.8 4.5 2930 2040 B 92 ASP HBy B 93 PHE H 1.0 1.8 4.5 2931 2041 B 94 VAL H B 92 ASP HBx 1.0 1.8 5.5 2932 2041 B 92 ASP HBy B 94 VAL H 1.0 1.8 5.5 2933 2042 B 90 ALA HA B 93 PHE H 1.0 1.8 4.5 2934 2043 B 93 PHE H B 93 PHE HA 1.0 1.8 4.5 2935 2044 B 93 PHE H B 93 PHE HA 1.0 1.8 3.5 2936 2045 B 93 PHE HA B 93 PHE HBx 1.0 1.8 5.5 2937 2045 B 93 PHE HBy B 93 PHE HA 1.0 1.8 5.5 2938 2046 B 94 VAL H B 93 PHE HA 1.0 1.8 5.5 2939 2047 B 93 PHE H B 93 PHE HBx 1.0 1.8 3.5 2940 2047 B 93 PHE HBy B 93 PHE H 1.0 1.8 3.5 2941 2048 B 94 VAL H B 93 PHE HBx 1.0 1.8 4.5 2942 2048 B 93 PHE HBy B 94 VAL H 1.0 1.8 4.5 2943 2049 B 90 ALA HA B 93 PHE HD% 1.0 1.8 3.5 2944 2050 B 93 PHE H B 93 PHE HD% 1.0 1.8 4.5 2945 2051 B 94 VAL H B 93 PHE HD% 1.0 1.8 5.5 2946 2052 B 93 PHE HD% B 96 ARG HDx 1.0 1.8 5.5 2947 2052 B 93 PHE HD% B 96 ARG HDy 1.0 1.8 5.5 2948 2053 B 94 VAL H B 95 ARG H 1.0 1.8 3.5 2949 2054 B 94 VAL H B 94 VAL HA 1.0 1.8 3.5 2950 2055 B 95 ARG H B 94 VAL HA 1.0 1.8 5.5 2951 2056 B 94 VAL HB B 95 ARG H 1.0 1.8 3.5 2952 2057 B 90 ALA HB1 B 94 VAL HG11 1.0 1.8 4.5 2953 2057 B 90 ALA HB1 B 94 VAL HG21 1.0 1.8 4.5 2954 2058 B 91 THR HG21 B 94 VAL HG11 1.0 1.8 5.5 2955 2058 B 91 THR HG21 B 94 VAL HG21 1.0 1.8 5.5 2956 2059 B 94 VAL H B 94 VAL HG11 1.0 1.8 3.5 2957 2059 B 94 VAL H B 94 VAL HG21 1.0 1.8 3.5 2958 2060 B 94 VAL H B 95 ARG H 1.0 1.8 3.5 2959 2061 B 95 ARG H B 95 ARG HA 1.0 1.8 4.5 2960 2062 B 95 ARG HE B 95 ARG HDx 1.0 1.8 4.5 2961 2062 B 95 ARG HE B 95 ARG HDy 1.0 1.8 4.5 2962 2063 B 96 ARG H B 95 ARG HBx 1.0 1.8 3.5 2963 2063 B 95 ARG HBy B 96 ARG H 1.0 1.8 3.5 2964 2064 B 95 ARG HE B 95 ARG HH1% 1.0 1.8 4.5 2965 2065 B 95 ARG HE B 95 ARG HH2% 1.0 1.8 4.5 2966 2066 B 96 ARG H B 96 ARG HA 1.0 1.8 4.5 2967 2067 B 96 ARG H B 96 ARG HDx 1.0 1.8 5.5 2968 2067 B 96 ARG HDy B 96 ARG H 1.0 1.8 5.5 2969 2068 B 96 ARG HA B 100 ARG H 1.0 1.8 5.5 2970 2069 B 96 ARG H B 96 ARG HA 1.0 1.8 4.5 2971 2070 B 96 ARG HE B 96 ARG HDx 1.0 1.8 3.5 2972 2070 B 96 ARG HDy B 96 ARG HE 1.0 1.8 3.5 2973 2071 B 96 ARG H B 96 ARG HBx 1.0 1.8 3.5 2974 2071 B 96 ARG H B 96 ARG HBy 1.0 1.8 3.5 2975 2072 B 96 ARG H B 96 ARG HDx 1.0 1.8 5.5 2976 2072 B 96 ARG HDy B 96 ARG H 1.0 1.8 5.5 2977 2073 B 96 ARG HE B 96 ARG HDx 1.0 1.8 3.5 2978 2073 B 96 ARG HDy B 96 ARG HE 1.0 1.8 3.5 2979 2074 B 96 ARG H B 96 ARG HGx 1.0 1.8 5.5 2980 2074 B 96 ARG H B 96 ARG HGy 1.0 1.8 5.5 2981 2075 B 96 ARG HE B 96 ARG HGx 1.0 1.8 3.5 2982 2075 B 96 ARG HE B 96 ARG HGy 1.0 1.8 3.5 2983 2076 B 97 GLU H B 96 ARG HGx 1.0 1.8 5.5 2984 2076 B 96 ARG HGy B 97 GLU H 1.0 1.8 5.5 2985 2077 B 96 ARG HE B 96 ARG HH1% 1.0 1.8 4.5 2986 2078 B 96 ARG HE B 96 ARG HH2% 1.0 1.8 4.5 2987 2079 B 96 ARG HA B 97 GLU H 1.0 1.8 5.5 2988 2080 B 97 GLU H B 97 GLU HA 1.0 1.8 4.5 2989 2081 B 97 GLU HA B 100 ARG HBx 1.0 1.8 4.5 2990 2081 B 97 GLU HA B 100 ARG HBy 1.0 1.8 4.5 2991 2082 B 97 GLU H B 97 GLU HA 1.0 1.8 4.5 2992 2083 B 97 GLU HA B 98 GLU H 1.0 1.8 5.5 2993 2084 B 97 GLU H B 97 GLU HBx 1.0 1.8 3.5 2994 2084 B 97 GLU H B 97 GLU HBy 1.0 1.8 3.5 2995 2085 B 98 GLU H B 97 GLU HBx 1.0 1.8 3.5 2996 2085 B 98 GLU H B 97 GLU HBy 1.0 1.8 3.5 2997 2086 B 97 GLU HBy B 98 GLU HGx 1.0 1.8 4.5 2998 2086 B 97 GLU HBx B 98 GLU HGx 1.0 1.8 4.5 2999 2086 B 98 GLU HGy B 97 GLU HBx 1.0 1.8 4.5 3000 2086 B 97 GLU HBy B 98 GLU HGy 1.0 1.8 4.5 3001 2087 B 97 GLU H B 97 GLU HGx 1.0 1.8 5.5 3002 2087 B 97 GLU H B 97 GLU HGy 1.0 1.8 5.5 3003 2088 B 97 GLU HBx B 97 GLU HGx 1.0 1.8 3.5 3004 2088 B 97 GLU HBy B 97 GLU HGx 1.0 1.8 3.5 3005 2088 B 97 GLU HGy B 97 GLU HBx 1.0 1.8 3.5 3006 2088 B 97 GLU HBy B 97 GLU HGy 1.0 1.8 3.5 3007 2089 B 97 GLU HA B 98 GLU H 1.0 1.8 5.5 3008 2090 B 98 GLU H B 98 GLU HA 1.0 1.8 4.5 3009 2091 B 98 GLU HA B 101 ARG H 1.0 1.8 5.5 3010 2092 B 98 GLU HA B 101 ARG HBx 1.0 1.8 4.5 3011 2092 B 98 GLU HA B 101 ARG HBy 1.0 1.8 4.5 3012 2093 B 98 GLU H B 98 GLU HA 1.0 1.8 4.5 3013 2094 B 98 GLU H B 98 GLU HBx 1.0 1.8 3.5 3014 2094 B 98 GLU H B 98 GLU HBy 1.0 1.8 3.5 3015 2095 B 98 GLU HBx B 98 GLU HGx 1.0 1.8 3.5 3016 2095 B 98 GLU HBy B 98 GLU HGx 1.0 1.8 3.5 3017 2095 B 98 GLU HGy B 98 GLU HBx 1.0 1.8 3.5 3018 2095 B 98 GLU HGy B 98 GLU HBy 1.0 1.8 3.5 3019 2096 B 99 GLU H B 98 GLU HBx 1.0 1.8 4.5 3020 2096 B 98 GLU HBy B 99 GLU H 1.0 1.8 4.5 3021 2097 B 98 GLU H B 98 GLU HGx 1.0 1.8 4.5 3022 2097 B 98 GLU H B 98 GLU HGy 1.0 1.8 4.5 3023 2098 B 99 GLU HA B 102 GLY HAx 1.0 1.8 5.5 3024 2098 B 99 GLU HA B 102 GLY HAy 1.0 1.8 5.5 3025 2099 B 99 GLU H B 99 GLU HA 1.0 1.8 4.5 3026 2100 B 99 GLU H B 99 GLU HBx 1.0 1.8 4.5 3027 2100 B 99 GLU H B 99 GLU HBy 1.0 1.8 4.5 3028 2101 B 99 GLU HBy B 99 GLU HGx 1.0 1.8 3.5 3029 2101 B 99 GLU HGy B 99 GLU HBx 1.0 1.8 3.5 3030 2101 B 99 GLU HBy B 99 GLU HGy 1.0 1.8 3.5 3031 2101 B 99 GLU HBx B 99 GLU HGx 1.0 1.8 3.5 3032 2102 B 99 GLU H B 99 GLU HGx 1.0 1.8 5.5 3033 2102 B 99 GLU H B 99 GLU HGy 1.0 1.8 5.5 3034 2103 B 100 ARG H B 99 GLU H 1.0 1.8 4.5 3035 2104 B 100 ARG H B 99 GLU HA 1.0 1.8 5.5 3036 2105 B 100 ARG H B 100 ARG HA 1.0 1.8 4.5 3037 2106 B 100 ARG HA B 100 ARG HBx 1.0 1.8 4.5 3038 2106 B 100 ARG HBy B 100 ARG HA 1.0 1.8 4.5 3039 2107 B 101 ARG H B 100 ARG HBx 1.0 1.8 4.5 3040 2107 B 100 ARG HBy B 101 ARG H 1.0 1.8 4.5 3041 2108 B 100 ARG HH1% B 100 ARG HE 1.0 1.8 4.5 3042 2109 B 100 ARG HH1% B 101 ARG HE 1.0 1.8 4.5 3043 2110 B 100 ARG HE B 100 ARG HH2% 1.0 1.8 4.5 3044 2111 B 101 ARG HE B 100 ARG HH2% 1.0 1.8 4.5 3045 2112 B 97 GLU HA B 101 ARG H 1.0 1.8 5.5 3046 2113 B 98 GLU HA B 101 ARG H 1.0 1.8 5.5 3047 2114 B 101 ARG HA B 100 ARG HBx 1.0 1.8 5.5 3048 2114 B 100 ARG HBy B 101 ARG HA 1.0 1.8 5.5 3049 2115 B 101 ARG H B 101 ARG HA 1.0 1.8 4.5 3050 2116 B 101 ARG HA B 101 ARG HBx 1.0 1.8 4.5 3051 2116 B 101 ARG HBy B 101 ARG HA 1.0 1.8 4.5 3052 2117 B 101 ARG H B 101 ARG HBx 1.0 1.8 3.5 3053 2117 B 101 ARG H B 101 ARG HBy 1.0 1.8 3.5 3054 2118 B 101 ARG HBy B 101 ARG HGx 1.0 1.8 3.5 3055 2118 B 101 ARG HBx B 101 ARG HGx 1.0 1.8 3.5 3056 2118 B 101 ARG HGy B 101 ARG HBx 1.0 1.8 3.5 3057 2118 B 101 ARG HBy B 101 ARG HGy 1.0 1.8 3.5 3058 2119 B 102 GLY H B 101 ARG HBx 1.0 1.8 5.5 3059 2119 B 101 ARG HBy B 102 GLY H 1.0 1.8 5.5 3060 2120 B 101 ARG H B 101 ARG HGx 1.0 1.8 3.5 3061 2120 B 101 ARG H B 101 ARG HGy 1.0 1.8 3.5 3062 2121 B 102 GLY H B 101 ARG HGx 1.0 1.8 5.5 3063 2121 B 101 ARG HGy B 102 GLY H 1.0 1.8 5.5 3064 2122 B 101 ARG HE B 101 ARG HH1% 1.0 1.8 4.5 3065 2123 B 101 ARG HE B 101 ARG HH2% 1.0 1.8 4.5 3066 2124 B 100 ARG HA B 102 GLY H 1.0 1.8 5.5 3067 2125 B 102 GLY H B 101 ARG HBx 1.0 1.8 5.5 3068 2125 B 101 ARG HBy B 102 GLY H 1.0 1.8 5.5 3069 2126 B 101 ARG HBx B 102 GLY HAx 1.0 1.8 4.5 3070 2126 B 101 ARG HBy B 102 GLY HAx 1.0 1.8 4.5 3071 2126 B 102 GLY HAy B 101 ARG HBx 1.0 1.8 4.5 3072 2126 B 101 ARG HBy B 102 GLY HAy 1.0 1.8 4.5 3073 2127 B 102 GLY H B 102 GLY HAx 1.0 1.8 3.5 3074 2127 B 102 GLY HAy B 102 GLY H 1.0 1.8 3.5 3075 2128 B 103 HIS H B 102 GLY HAx 1.0 1.8 3.5 3076 2128 B 102 GLY HAy B 103 HIS H 1.0 1.8 3.5 3077 2129 B 99 GLU HA B 103 HIS H 1.0 1.8 4.5 3078 2130 B 103 HIS H B 103 HIS HA 1.0 1.8 4.5 3079 2131 B 103 HIS H B 103 HIS HBx 1.0 1.8 4.5 3080 2132 B 103 HIS HBx B 103 HIS HBy 1.0 1.8 3.5 3081 2133 B 103 HIS H B 103 HIS HBy 1.0 1.8 4.5 3082 2134 B 103 HIS HBx B 103 HIS HBy 1.0 1.8 3.5 3083 2135 B 47 TRP HE1 B 38 LEU HD11 1.0 1.8 5.5 3084 2135 B 38 LEU HD21 B 47 TRP HE1 1.0 1.8 5.5 3085 2136 B 1 SER H1 B 6 ARG HDx 1.0 1.8 5.5 3086 2136 B 1 SER H1 B 6 ARG HDy 1.0 1.8 5.5 3087 2137 B 6 ARG H B 1 SER HBx 1.0 1.8 6.5 3088 2137 B 1 SER HBy B 6 ARG H 1.0 1.8 6.5 3089 2138 B 15 LEU H B 81 VAL HG11 1.0 1.8 4.5 3090 2139 B 51 THR HA B 56 GLY H 1.0 1.8 4.5 3091 2140 B 15 LEU HD11 B 78 GLY H 1.0 1.8 5.5 3092 2141 B 12 GLU H B 81 VAL HG11 1.0 1.8 4.5 3093 2142 B 12 GLU H B 85 VAL HG11 1.0 1.8 4.5 3094 2142 B 12 GLU H B 85 VAL HG21 1.0 1.8 4.5 3095 2143 B 63 VAL HG11 B 36 ALA H 1.0 1.8 4.5 3096 2144 B 44 ALA H B 38 LEU HD11 1.0 1.8 4.5 3097 2144 B 38 LEU HD21 B 44 ALA H 1.0 1.8 4.5 3098 2145 B 48 SER H B 38 LEU HD11 1.0 1.8 4.5 3099 2145 B 38 LEU HD21 B 48 SER H 1.0 1.8 4.5 3100 2146 B 2 ALA HB1 B 95 ARG HE 1.0 1.8 5.5 3101 2147 B 52 ALA HB1 B 78 GLY H 1.0 1.8 4.5 3102 2148 B 5 GLU HA B 88 ALA HB1 1.0 1.8 3.5 3103 2149 B 61 TYR HA B 47 TRP HE1 1.0 1.8 5.5 3104 2150 B 47 TRP HZ2 B 71 ALA HA 1.0 1.8 3.5 3105 2151 B 47 TRP HZ2 B 71 ALA HA 1.0 1.8 3.5 3106 2152 B 71 ALA HA B 47 TRP HH2 1.0 1.8 3.5 3107 2153 B 8 ALA HA B 85 VAL HA 1.0 1.8 3.5 3108 2154 B 29 ALA HA B 66 GLU HBx 1.0 1.8 3.5 3109 2154 B 29 ALA HA B 66 GLU HBy 1.0 1.8 3.5 3110 2155 B 77 ALA HA B 18 VAL HG11 1.0 1.8 4.5 3111 2155 B 18 VAL HG21 B 77 ALA HA 1.0 1.8 4.5 3112 2156 B 8 ALA HA B 85 VAL HG11 1.0 1.8 3.5 3113 2156 B 8 ALA HA B 85 VAL HG21 1.0 1.8 3.5 3114 2157 B 8 ALA HA B 84 LEU HD21 1.0 1.8 3.5 3115 2158 B 8 ALA HA B 85 VAL HG11 1.0 1.8 3.5 3116 2158 B 8 ALA HA B 85 VAL HG21 1.0 1.8 3.5 3117 2159 B 52 ALA HA B 74 VAL HG11 1.0 1.8 3.5 3118 2160 B 8 ALA HA B 84 LEU HD21 1.0 1.8 3.5 3119 2161 B 15 LEU HD11 B 78 GLY HAx 1.0 1.8 4.5 3120 2161 B 15 LEU HD11 B 78 GLY HAy 1.0 1.8 4.5 3121 2162 B 15 LEU HD21 B 78 GLY HAx 1.0 1.8 4.5 3122 2162 B 78 GLY HAy B 15 LEU HD21 1.0 1.8 4.5 3123 2163 B 15 LEU HD21 B 78 GLY HAx 1.0 1.8 4.5 3124 2163 B 78 GLY HAy B 15 LEU HD21 1.0 1.8 4.5 3125 2164 B 54 THR HG21 B 78 GLY HAx 1.0 1.8 5.5 3126 2164 B 54 THR HG21 B 78 GLY HAy 1.0 1.8 5.5 3127 2165 B 39 ILE HB B 31 ARG HDx 1.0 1.8 4.5 3128 2165 B 31 ARG HDy B 39 ILE HB 1.0 1.8 4.5 3129 2166 B 39 ILE HB B 31 ARG HDx 1.0 1.8 4.5 3130 2166 B 31 ARG HDy B 39 ILE HB 1.0 1.8 4.5 3131 2167 B 43 ASP HBx B 60 ARG HDx 1.0 1.8 5.5 3132 2167 B 43 ASP HBx B 60 ARG HDy 1.0 1.8 5.5 3133 2168 B 43 ASP HBy B 60 ARG HDx 1.0 1.8 6.5 3134 2168 B 43 ASP HBy B 60 ARG HDy 1.0 1.8 6.5 3135 2169 B 84 LEU HG B 7 GLU HGx 1.0 1.8 4.5 3136 2169 B 84 LEU HG B 7 GLU HGy 1.0 1.8 4.5 3137 2170 B 38 LEU HBx B 60 ARG HDx 1.0 1.8 5.5 3138 2170 B 38 LEU HBy B 60 ARG HDx 1.0 1.8 5.5 3139 2170 B 60 ARG HDy B 38 LEU HBx 1.0 1.8 5.5 3140 2170 B 38 LEU HBy B 60 ARG HDy 1.0 1.8 5.5 3141 2171 B 54 THR HG21 B 79 ILE HG1x 1.0 1.8 3.5 3142 2171 B 54 THR HG21 B 79 ILE HG1y 1.0 1.8 3.5 3143 2172 B 77 ALA HB1 B 18 VAL HG11 1.0 1.8 5.5 3144 2172 B 18 VAL HG21 B 77 ALA HB1 1.0 1.8 5.5 3145 2173 B 11 ALA HB1 B 81 VAL HG21 1.0 1.8 4.5 3146 2174 B 77 ALA HB1 B 18 VAL HG11 1.0 1.8 4.5 3147 2174 B 18 VAL HG21 B 77 ALA HB1 1.0 1.8 4.5 3148 2175 B 29 ALA HB1 B 70 VAL HG21 1.0 1.8 4.5 3149 2176 B 5 GLU H B 88 ALA HB1 1.0 1.8 4.5 3150 2177 B 52 ALA HB1 B 78 GLY H 1.0 1.8 4.5 3151 2178 B 52 ALA HB1 B 82 PHE HE% 1.0 1.8 4.5 3152 2179 B 52 ALA HB1 B 82 PHE HE% 1.0 1.8 4.5 3153 2180 B 71 ALA HB1 B 47 TRP HH2 1.0 1.8 5.5 3154 2181 B 26 ALA HB1 B 47 TRP HE3 1.0 1.8 5.5 3155 2182 B 2 ALA HB1 B 95 ARG HE 1.0 1.8 5.5 3156 2183 B 5 GLU HA B 88 ALA HB1 1.0 1.8 4.5 3157 2184 B 52 ALA HB1 B 82 PHE HE% 1.0 1.8 4.5 3158 2185 B 8 ALA HB1 B 85 VAL HA 1.0 1.8 3.5 3159 2186 B 4 HIS HBx B 88 ALA HB1 1.0 1.8 3.5 3160 2187 B 71 ALA HB1 B 62 PRO HGx 1.0 1.8 4.5 3161 2187 B 71 ALA HB1 B 62 PRO HGy 1.0 1.8 4.5 3162 2188 B 18 VAL HB B 77 ALA HB1 1.0 1.8 3.5 3163 2189 B 71 ALA HB1 B 62 PRO HGx 1.0 1.8 3.5 3164 2189 B 71 ALA HB1 B 62 PRO HGy 1.0 1.8 3.5 3165 2190 B 18 VAL HB B 77 ALA HB1 1.0 1.8 3.5 3166 2191 B 52 ALA HB1 B 19 LEU HD21 1.0 1.8 4.5 3167 2192 B 26 ALA HB1 B 44 ALA HB1 1.0 1.8 4.5 3168 2193 B 54 THR HG21 B 79 ILE HD11 1.0 1.8 3.5 3169 2194 B 53 THR HG21 B 15 LEU HD21 1.0 1.8 4.5 3170 2195 B 51 THR HG21 B 74 VAL HG11 1.0 1.8 3.5 3171 2196 B 54 THR HG21 B 79 ILE HD11 1.0 1.8 3.5 3172 2197 B 45 ILE HD11 B 19 LEU HD21 1.0 1.8 6.5 3173 2198 B 45 ILE HD11 B 19 LEU HD21 1.0 1.8 6.5 3174 2199 B 15 LEU H B 81 VAL HG11 1.0 1.8 4.5 3175 2200 B 15 LEU H B 81 VAL HG11 1.0 1.8 4.5 3176 2201 B 8 ALA H B 88 ALA HB1 1.0 1.8 4.5 3177 2202 B 8 ALA H B 88 ALA HB1 1.0 1.8 4.5 3178 2203 B 52 ALA HA B 78 GLY H 1.0 1.8 4.5 3179 2204 B 52 ALA HA B 78 GLY H 1.0 1.8 4.5 3180 2205 B 61 TYR H B 38 LEU HD11 1.0 1.8 4.5 3181 2205 B 38 LEU HD21 B 61 TYR H 1.0 1.8 4.5 3182 2206 B 37 ALA HB1 B 60 ARG HA 1.0 1.8 4.5 3183 2207 B 26 ALA HA B 38 LEU HD11 1.0 1.8 4.5 3184 2207 B 26 ALA HA B 38 LEU HD21 1.0 1.8 4.5 3185 2208 B 26 ALA HA B 38 LEU HD11 1.0 1.8 4.5 3186 2208 B 26 ALA HA B 38 LEU HD21 1.0 1.8 4.5 3187 2209 B 51 THR HG21 B 74 VAL HG21 1.0 1.8 4.5 3188 2210 B 26 ALA HA B 70 VAL HG21 1.0 1.8 4.5 3189 2211 B 26 ALA HA B 70 VAL HG21 1.0 1.8 4.5 3190 2212 B 82 PHE H B 15 LEU HD21 1.0 1.8 4.5 3191 2213 B 54 THR HG21 B 79 ILE H 1.0 1.8 4.5 3192 2214 B 88 ALA HB1 B 5 GLU HGx 1.0 1.8 4.5 3193 2214 B 5 GLU HGy B 88 ALA HB1 1.0 1.8 4.5 3194 2215 B 52 ALA HB1 B 75 MET HA 1.0 1.8 5.5 3195 2216 B 52 ALA HB1 B 75 MET HA 1.0 1.8 5.5 3196 2217 B 15 LEU HD11 B 52 ALA HA 1.0 1.8 5.5 3197 2218 B 15 LEU HD11 B 52 ALA HA 1.0 1.8 5.5 3198 2219 B 63 VAL H B 30 GLU HGx 1.0 1.8 5.5 3199 2219 B 30 GLU HGy B 63 VAL H 1.0 1.8 5.5 3200 2220 B 15 LEU HD11 B 81 VAL HB 1.0 1.8 5.5 3201 2221 B 26 ALA HA B 70 VAL HG11 1.0 1.8 5.5 3202 2222 B 26 ALA HA B 70 VAL HG11 1.0 1.8 5.5 3203 2223 B 77 ALA HB1 B 14 GLU HGx 1.0 1.8 5.5 3204 2223 B 14 GLU HGy B 77 ALA HB1 1.0 1.8 5.5 3205 2224 B 4 HIS HBy B 88 ALA HB1 1.0 1.8 5.5 3206 2225 B 4 HIS HBy B 88 ALA HB1 1.0 1.8 5.5 3207 2226 B 52 ALA HB1 B 18 VAL HG11 1.0 1.8 5.5 3208 2226 B 18 VAL HG21 B 52 ALA HB1 1.0 1.8 5.5 3209 2227 B 52 ALA HB1 B 18 VAL HG11 1.0 1.8 5.5 3210 2227 B 18 VAL HG21 B 52 ALA HB1 1.0 1.8 5.5 3211 2228 B 71 ALA HB1 B 47 TRP HE1 1.0 1.8 5.5 3212 2229 B 49 VAL H B 19 LEU HD11 1.0 1.8 5.5 3213 2230 B 47 TRP HBy B 60 ARG HGx 1.0 1.8 5.5 3214 2230 B 47 TRP HBy B 60 ARG HGy 1.0 1.8 5.5 3215 2231 B 8 ALA HA B 85 VAL H 1.0 1.8 5.5 3216 2232 B 63 VAL HG11 B 35 GLY HAx 1.0 1.8 5.5 3217 2232 B 63 VAL HG11 B 35 GLY HAy 1.0 1.8 5.5 3218 2233 B 15 LEU HD11 B 77 ALA HA 1.0 1.8 5.5 3219 2234 B 15 LEU HD11 B 77 ALA HA 1.0 1.8 5.5 3220 2235 B 33 ALA HB1 B 63 VAL HB 1.0 1.8 5.5 3221 2236 B 33 ALA HB1 B 63 VAL HB 1.0 1.8 5.5 3222 2237 B 8 ALA HA B 84 LEU HBx 1.0 1.8 5.5 3223 2237 B 84 LEU HBy B 8 ALA HA 1.0 1.8 5.5 3224 2238 B 8 ALA HA B 84 LEU HBx 1.0 1.8 5.5 3225 2238 B 84 LEU HBy B 8 ALA HA 1.0 1.8 5.5 3226 2239 B 8 ALA HA B 84 LEU HBx 1.0 1.8 5.5 3227 2239 B 84 LEU HBy B 8 ALA HA 1.0 1.8 5.5 3228 2240 B 22 ALA HB1 B 71 ALA HA 1.0 1.8 5.5 3229 2241 B 22 ALA HB1 B 71 ALA HA 1.0 1.8 5.5 3230 2242 B 52 ALA HA B 75 MET HBx 1.0 1.8 5.5 3231 2242 B 52 ALA HA B 75 MET HBy 1.0 1.8 5.5 3232 2243 B 53 THR HG21 B 19 LEU HD21 1.0 1.8 5.5 3233 2244 B 53 THR HG21 B 19 LEU HD21 1.0 1.8 5.5 3234 2245 B 38 LEU HA B 61 TYR H 1.0 1.8 5.5 3235 2246 B 38 LEU HA B 61 TYR H 1.0 1.8 5.5 3236 2247 B 52 ALA HA B 19 LEU HD21 1.0 1.8 5.5 3237 2248 B 52 ALA HA B 19 LEU HD21 1.0 1.8 5.5 3238 2249 B 98 GLU HA B 103 HIS H 1.0 1.8 5.5 3239 2250 B 52 ALA HB1 B 74 VAL HB 1.0 1.8 5.5 3240 2251 B 78 GLY HAy B 19 LEU HD21 1.0 1.8 5.5 3241 2251 B 19 LEU HD21 B 78 GLY HAx 1.0 1.8 5.5 3242 2252 B 49 VAL HB B 19 LEU HD21 1.0 1.8 5.5 3243 2253 B 26 ALA HB1 B 44 ALA HA 1.0 1.8 5.5 3244 2254 B 26 ALA HB1 B 44 ALA HA 1.0 1.8 5.5 3245 2255 B 63 VAL HG11 B 33 ALA HB1 1.0 1.8 5.5 3246 2256 B 7 GLU H B 88 ALA HB1 1.0 1.8 5.5 3247 2257 B 8 ALA HB1 B 88 ALA HA 1.0 1.8 5.5 3248 2258 B 53 THR HG21 B 19 LEU HD11 1.0 1.8 5.5 3249 2259 B 53 THR HG21 B 19 LEU HD11 1.0 1.8 5.5 3250 2260 B 18 VAL H B 77 ALA HB1 1.0 1.8 5.5 3251 2261 B 26 ALA HA B 62 PRO HBx 1.0 1.8 5.5 3252 2261 B 26 ALA HA B 62 PRO HBy 1.0 1.8 5.5 3253 2262 B 29 ALA H B 66 GLU HBx 1.0 1.8 5.5 3254 2262 B 29 ALA H B 66 GLU HBy 1.0 1.8 5.5 3255 2263 B 51 THR HG21 B 19 LEU HD21 1.0 1.8 5.5 3256 2264 B 26 ALA HB1 B 62 PRO HDx 1.0 1.8 5.5 3257 2264 B 26 ALA HB1 B 62 PRO HDy 1.0 1.8 5.5 3258 2265 B 14 GLU H B 81 VAL HG11 1.0 1.8 5.5 3259 2266 B 52 ALA HA B 15 LEU HD21 1.0 1.8 5.5 3260 2267 B 88 ALA HB1 B 5 GLU HBx 1.0 1.8 5.5 3261 2267 B 5 GLU HBy B 88 ALA HB1 1.0 1.8 5.5 3262 2268 B 15 LEU HD11 B 53 THR HG21 1.0 1.8 5.5 3263 2269 B 15 LEU HD11 B 53 THR HG21 1.0 1.8 5.5 3264 2270 B 15 LEU HD11 B 53 THR HG21 1.0 1.8 5.5 3265 2271 B 11 ALA HB1 B 82 PHE H 1.0 1.8 5.5 3266 2272 B 26 ALA HB1 B 48 SER HBx 1.0 1.8 5.5 3267 2272 B 26 ALA HB1 B 48 SER HBy 1.0 1.8 5.5 3268 2273 B 36 ALA HA B 63 VAL HB 1.0 1.8 5.5 3269 2274 B 36 ALA HA B 63 VAL HB 1.0 1.8 5.5 3270 2275 B 33 ALA HB1 B 64 THR H 1.0 1.8 5.5 3271 2276 B 52 ALA HA B 74 VAL HB 1.0 1.8 5.5 3272 2277 B 71 ALA HA B 62 PRO HGx 1.0 1.8 5.5 3273 2277 B 71 ALA HA B 62 PRO HGy 1.0 1.8 5.5 3274 2278 B 18 VAL HB B 52 ALA HB1 1.0 1.8 5.5 3275 2279 B 18 VAL HB B 52 ALA HB1 1.0 1.8 5.5 3276 2280 B 71 ALA HB1 B 51 THR HB 1.0 1.8 5.5 3277 2281 B 71 ALA HB1 B 51 THR HB 1.0 1.8 5.5 3278 2282 B 8 ALA HB1 B 85 VAL HB 1.0 1.8 5.5 3279 2283 B 50 GLU H B 19 LEU HD21 1.0 1.8 5.5 3280 2284 B 52 ALA HB1 B 75 MET H 1.0 1.8 5.5 3281 2285 B 84 LEU HG B 8 ALA HA 1.0 1.8 5.5 3282 2286 B 84 LEU HG B 8 ALA HA 1.0 1.8 5.5 3283 2287 B 15 LEU HA B 52 ALA HB1 1.0 1.8 5.5 3284 2288 B 15 LEU HA B 52 ALA HB1 1.0 1.8 5.5 3285 2289 B 39 ILE H B 30 GLU HGx 1.0 1.8 5.5 3286 2289 B 30 GLU HGy B 39 ILE H 1.0 1.8 5.5 3287 2290 B 54 THR H B 79 ILE HG1x 1.0 1.8 5.5 3288 2290 B 54 THR H B 79 ILE HG1y 1.0 1.8 5.5 3289 2291 B 52 ALA HB1 B 19 LEU HBx 1.0 1.8 5.5 3290 2291 B 19 LEU HBy B 52 ALA HB1 1.0 1.8 5.5 3291 2292 B 29 ALA HA B 67 GLY H 1.0 1.8 5.5 3292 2293 B 29 ALA HA B 67 GLY H 1.0 1.8 5.5 3293 2294 B 52 ALA HA B 77 ALA HB1 1.0 1.8 5.5 3294 2295 B 52 ALA HA B 77 ALA HB1 1.0 1.8 5.5 3295 2296 B 9 GLN H B 88 ALA HB1 1.0 1.8 5.5 3296 2297 B 9 GLN H B 88 ALA HB1 1.0 1.8 5.5 3297 2298 B 15 LEU H B 81 VAL HB 1.0 1.8 6.5 3298 2299 B 26 ALA HB1 B 74 VAL HG21 1.0 1.8 6.5 3299 2300 B 15 LEU H B 81 VAL HB 1.0 1.8 6.5 3300 2301 B 15 LEU H B 77 ALA HB1 1.0 1.8 6.5 3301 2302 B 15 LEU H B 77 ALA HB1 1.0 1.8 6.5 3302 2303 B 15 LEU HD11 B 79 ILE H 1.0 1.8 6.5 3303 2304 B 87 ALA HB1 B 4 HIS HBx 1.0 1.8 6.5 3304 2305 B 11 ALA HB1 B 85 VAL HB 1.0 1.8 6.5 3305 2306 B 77 ALA HB1 B 14 GLU HBx 1.0 1.8 6.5 3306 2306 B 14 GLU HBy B 77 ALA HB1 1.0 1.8 6.5 3307 2307 B 77 ALA HB1 B 14 GLU HBx 1.0 1.8 6.5 3308 2307 B 14 GLU HBy B 77 ALA HB1 1.0 1.8 6.5 3309 2308 B 18 VAL HA B 77 ALA HB1 1.0 1.8 6.5 3310 2309 B 18 VAL HA B 77 ALA HB1 1.0 1.8 6.5 3311 2310 B 33 ALA HB1 B 63 VAL H 1.0 1.8 6.5 3312 2311 B 41 TYR HE% B 24 LYS HEx 1.0 1.8 6.5 3313 2311 B 24 LYS HEy B 41 TYR HE% 1.0 1.8 6.5 3314 2312 B 55 VAL HB B 50 GLU HGx 1.0 1.8 6.5 3315 2312 B 50 GLU HGy B 55 VAL HB 1.0 1.8 6.5 3316 2313 B 55 VAL HB B 50 GLU HGx 1.0 1.8 6.5 3317 2313 B 50 GLU HGy B 55 VAL HB 1.0 1.8 6.5 3318 2314 B 52 ALA HA B 77 ALA H 1.0 1.8 6.5 3319 2315 B 52 ALA HA B 77 ALA H 1.0 1.8 6.5 3320 2316 B 12 GLU H B 84 LEU HD21 1.0 1.8 6.5 3321 2317 B 71 ALA HB1 B 47 TRP HZ3 1.0 1.8 6.5 3322 2318 B 87 ALA HB1 B 7 GLU HBx 1.0 1.8 6.5 3323 2318 B 87 ALA HB1 B 7 GLU HBy 1.0 1.8 6.5 3324 2319 B 9 GLN H B 85 VAL HG11 1.0 1.8 6.5 3325 2319 B 9 GLN H B 85 VAL HG21 1.0 1.8 6.5 3326 2320 B 73 GLN HE2x B 21 GLU HBx 1.0 1.8 6.5 3327 2320 B 21 GLU HBy B 73 GLN HE2x 1.0 1.8 6.5 3328 2321 B 4 HIS H B 88 ALA HB1 1.0 1.8 6.5 3329 2322 B 88 ALA HB1 B 7 GLU HGx 1.0 1.8 6.5 3330 2322 B 7 GLU HGy B 88 ALA HB1 1.0 1.8 6.5 3331 2323 B 6 ARG H B 88 ALA HB1 1.0 1.8 6.5 3332 2324 B 87 ALA HB1 B 4 HIS HBy 1.0 1.8 6.5 3333 2325 B 87 ALA HB1 B 4 HIS HBy 1.0 1.8 6.5 3334 2326 B 26 ALA HB1 B 62 PRO HGx 1.0 1.8 6.5 3335 2326 B 26 ALA HB1 B 62 PRO HGy 1.0 1.8 6.5 3336 2327 B 26 ALA HB1 B 62 PRO HGx 1.0 1.8 6.5 3337 2327 B 26 ALA HB1 B 62 PRO HGy 1.0 1.8 6.5 3338 2328 B 79 ILE H B 15 LEU HD21 1.0 1.8 6.5 3339 2329 B 18 VAL HG21 B 78 GLY HAx 1.0 1.8 6.5 3340 2329 B 18 VAL HG11 B 78 GLY HAx 1.0 1.8 6.5 3341 2329 B 78 GLY HAy B 18 VAL HG11 1.0 1.8 6.5 3342 2329 B 18 VAL HG21 B 78 GLY HAy 1.0 1.8 6.5 3343 2330 B 18 VAL HG21 B 78 GLY HAx 1.0 1.8 6.5 3344 2330 B 18 VAL HG11 B 78 GLY HAx 1.0 1.8 6.5 3345 2330 B 78 GLY HAy B 18 VAL HG11 1.0 1.8 6.5 3346 2330 B 18 VAL HG21 B 78 GLY HAy 1.0 1.8 6.5 3347 2331 B 18 VAL HG21 B 78 GLY HAx 1.0 1.8 6.5 3348 2331 B 18 VAL HG11 B 78 GLY HAx 1.0 1.8 6.5 3349 2331 B 78 GLY HAy B 18 VAL HG11 1.0 1.8 6.5 3350 2331 B 18 VAL HG21 B 78 GLY HAy 1.0 1.8 6.5 3351 2332 B 53 THR HG21 B 74 VAL HG11 1.0 1.8 6.5 3352 2333 B 53 THR HG21 B 74 VAL HG11 1.0 1.8 6.5 3353 2334 B 26 ALA HA B 47 TRP HH2 1.0 1.8 6.5 3354 2335 B 52 ALA HB1 B 81 VAL HG21 1.0 1.8 6.5 3355 2336 B 4 HIS HE1 B 88 ALA HB1 1.0 1.8 6.5 3356 2337 B 4 HIS HE1 B 88 ALA HB1 1.0 1.8 6.5 3357 2338 B 26 ALA HB1 B 47 TRP HBy 1.0 1.8 6.5 3358 2339 B 26 ALA HB1 B 47 TRP HBy 1.0 1.8 6.5 3359 2340 B 78 GLY HAy B 19 LEU HD11 1.0 1.8 6.5 3360 2340 B 19 LEU HD11 B 78 GLY HAx 1.0 1.8 6.5 3361 2341 B 38 LEU HA B 60 ARG HA 1.0 1.8 6.5 3362 2342 B 52 ALA HA B 79 ILE HD11 1.0 1.8 6.5 3363 2343 B 52 ALA HA B 79 ILE HD11 1.0 1.8 6.5 3364 2344 B 85 VAL H B 12 GLU HGx 1.0 1.8 6.5 3365 2344 B 12 GLU HGy B 85 VAL H 1.0 1.8 6.5 3366 2345 B 30 GLU H B 66 GLU HBx 1.0 1.8 6.5 3367 2345 B 30 GLU H B 66 GLU HBy 1.0 1.8 6.5 3368 2346 B 77 ALA HB1 B 17 LYS HEx 1.0 1.8 6.5 3369 2346 B 17 LYS HEy B 77 ALA HB1 1.0 1.8 6.5 3370 2347 B 71 ALA HB1 B 22 ALA HB1 1.0 1.8 6.5 3371 2348 B 46 TRP H B 38 LEU HD11 1.0 1.8 6.5 3372 2348 B 38 LEU HD21 B 46 TRP H 1.0 1.8 6.5 3373 2349 B 52 ALA HA B 76 LYS H 1.0 1.8 6.5 3374 2350 B 71 ALA HB1 B 22 ALA HB1 1.0 1.8 6.5 3375 2351 B 52 ALA HA B 76 LYS H 1.0 1.8 6.5 3376 2352 B 87 ALA HB1 B 7 GLU HGx 1.0 1.8 6.5 3377 2352 B 87 ALA HB1 B 7 GLU HGy 1.0 1.8 6.5 3378 2353 B 2 ALA HA B 3 ASP H 1.0 1.8 4.5 3379 2354 B 2 ALA HA B 3 ASP H 1.0 1.8 4.5 3380 2355 B 3 ASP H B 3 ASP HBx 1.0 1.8 4.5 3381 2355 B 3 ASP H B 3 ASP HBy 1.0 1.8 4.5 3382 2356 B 27 VAL HA B 30 GLU H 1.0 1.8 6.5 3383 2357 B 26 ALA HA B 29 ALA HB1 1.0 1.8 5.5 3384 2358 B 27 VAL HA B 30 GLU H 1.0 1.8 6.5 3385 2359 B 30 GLU H B 30 GLU HA 1.0 1.8 4.5 3386 2360 B 33 ALA HB1 B 30 GLU HBx 1.0 1.8 6.5 3387 2360 B 33 ALA HB1 B 30 GLU HBy 1.0 1.8 6.5 3388 2361 B 30 GLU H B 30 GLU HGx 1.0 1.8 4.5 3389 2361 B 30 GLU H B 30 GLU HGy 1.0 1.8 4.5 3390 2362 B 32 GLY H B 31 ARG HBx 1.0 1.8 4.5 3391 2362 B 31 ARG HBy B 32 GLY H 1.0 1.8 4.5 3392 2363 B 39 ILE H B 39 ILE HD11 1.0 1.8 5.5 3393 2364 B 37 ALA HB1 B 39 ILE HG1x 1.0 1.8 6.5 3394 2364 B 37 ALA HB1 B 39 ILE HG1y 1.0 1.8 6.5 3395 2365 B 40 SER H B 39 ILE HG1x 1.0 1.8 4.5 3396 2365 B 39 ILE HG1y B 40 SER H 1.0 1.8 4.5 3397 2366 B 43 ASP HBy B 40 SER HBx 1.0 1.8 5.5 3398 2366 B 40 SER HBy B 43 ASP HBy 1.0 1.8 5.5 3399 2367 B 43 ASP H B 43 ASP HBy 1.0 1.8 4.5 3400 2368 B 43 ASP HBx B 44 ALA HA 1.0 1.8 6.5 3401 2369 B 47 TRP H B 47 TRP HBx 1.0 1.8 5.5 3402 2370 B 47 TRP HA B 47 TRP HE1 1.0 1.8 6.5 3403 2371 B 57 TYR H B 57 TYR HBx 1.0 1.8 4.5 3404 2372 B 60 ARG H B 60 ARG HGx 1.0 1.8 5.5 3405 2372 B 60 ARG H B 60 ARG HGy 1.0 1.8 5.5 3406 2373 B 64 THR HA B 65 GLU H 1.0 1.8 5.5 3407 2374 B 64 THR HB B 66 GLU H 1.0 1.8 6.5 3408 2375 B 66 GLU H B 65 GLU HBy 1.0 1.8 4.5 3409 2376 B 64 THR H B 67 GLY H 1.0 1.8 5.5 3410 2377 B 96 ARG H B 95 ARG HGx 1.0 1.8 5.5 3411 2377 B 96 ARG H B 95 ARG HGy 1.0 1.8 5.5 3412 2378 B 99 GLU H B 95 ARG HGx 1.0 1.8 6.5 3413 2378 B 99 GLU H B 95 ARG HGy 1.0 1.8 6.5 3414 2379 B 36 ALA HA B 63 VAL HG21 1.0 1.8 5.5 3415 2380 B 31 ARG H B 39 ILE HA 1.0 1.8 5.5 3416 2381 B 26 ALA HB1 B 70 VAL HB 1.0 1.8 5.5 3417 2382 B 38 LEU H B 30 GLU HBx 1.0 1.8 6.5 3418 2382 B 30 GLU HBy B 38 LEU H 1.0 1.8 6.5 3419 2383 B 64 THR HB B 33 ALA HB1 1.0 1.8 6.5 3420 2384 B 64 THR HB B 33 ALA HB1 1.0 1.8 6.5 3421 2385 B 68 ARG HA B 62 PRO HDx 1.0 1.8 6.5 3422 2385 B 68 ARG HA B 62 PRO HDy 1.0 1.8 6.5 3423 2386 B 36 ALA HB1 B 63 VAL H 1.0 1.8 6.5 3424 2387 B 60 ARG H B 47 TRP HBx 1.0 1.8 6.5 3425 2388 B 36 ALA HA B 30 GLU HBx 1.0 1.8 6.5 3426 2388 B 30 GLU HBy B 36 ALA HA 1.0 1.8 6.5 3427 2389 B 39 ILE HA B 44 ALA HB1 1.0 1.8 6.5 3428 2390 B 35 GLY HAy B 63 VAL HG21 1.0 1.8 6.5 3429 2390 B 35 GLY HAx B 63 VAL HG21 1.0 1.8 6.5 3430 2391 B 26 ALA HB1 B 38 LEU HA 1.0 1.8 6.5 3431 2392 B 51 THR HG21 B 19 LEU HD21 1.0 1.8 5.5 3432 2392 B 51 THR HG21 B 19 LEU HD11 1.0 1.8 5.5 3433 2393 B 47 TRP HBx B 59 ASP HBx 1.0 1.8 5.5 3434 2393 B 47 TRP HBx B 59 ASP HBy 1.0 1.8 5.5 3435 2394 B 47 TRP HBy B 59 ASP HBx 1.0 1.8 5.5 3436 2394 B 47 TRP HBy B 59 ASP HBy 1.0 1.8 5.5 3437 2395 B 65 GLU H B 33 ALA HB1 1.0 1.8 5.5 3438 2396 B 33 ALA HB1 B 65 GLU HBy 1.0 1.8 5.5 3439 2397 B 33 ALA HB1 B 65 GLU HA 1.0 1.8 5.5 3440 2398 B 33 ALA HB1 B 65 GLU HBx 1.0 1.8 5.5 3441 2399 B 33 ALA HB1 B 65 GLU HGx 1.0 1.8 5.5 3442 2399 B 33 ALA HB1 B 65 GLU HGy 1.0 1.8 5.5 3443 2400 B 34 PRO HDx B 65 GLU HA 1.0 1.8 5.5 3444 2401 B 34 PRO HDx B 65 GLU HA 1.0 1.8 5.5 3445 2402 B 52 ALA HA B 18 VAL HG11 1.0 1.8 5.5 3446 2402 B 18 VAL HG21 B 52 ALA HA 1.0 1.8 5.5 3447 2403 B 22 ALA HB1 B 52 ALA HB1 1.0 1.8 5.5 3448 2404 B 22 ALA HB1 B 52 ALA HB1 1.0 1.8 5.5 3449 2405 B 22 ALA HB1 B 52 ALA HB1 1.0 1.8 5.5 3450 2406 B 22 ALA HB1 B 52 ALA HB1 1.0 1.8 5.5 3451 2407 B 15 LEU HD11 B 51 THR HG21 1.0 1.8 5.5 3452 2408 B 29 ALA HB1 B 63 VAL H 1.0 1.8 5.5 3453 2409 B 26 ALA HB1 B 48 SER H 1.0 1.8 5.5 3454 2410 B 27 VAL HB B 41 TYR H 1.0 1.8 5.5 3455 2411 B 26 ALA HB1 B 48 SER HA 1.0 1.8 5.5 3456 2412 B 54 THR HG21 B 15 LEU HD21 1.0 1.8 5.5 3457 2413 B 27 VAL HB B 38 LEU HD11 1.0 1.8 5.5 3458 2413 B 27 VAL HB B 38 LEU HD21 1.0 1.8 5.5 3459 2414 B 16 GLN HA B 52 ALA HB1 1.0 1.8 5.5 3460 2415 B 30 GLU HA B 36 ALA HA 1.0 1.8 5.5 3461 2416 B 51 THR H B 19 LEU HD11 1.0 1.8 5.5 3462 2417 B 26 ALA HB1 B 47 TRP HE1 1.0 1.8 5.5 3463 2418 B 27 VAL HB B 40 SER H 1.0 1.8 5.5 3464 2419 B 15 LEU HG B 52 ALA HA 1.0 1.8 5.5 3465 2420 B 52 ALA HB1 B 16 GLN HGx 1.0 1.8 5.5 3466 2420 B 16 GLN HGy B 52 ALA HB1 1.0 1.8 5.5 3467 2421 B 27 VAL HA B 44 ALA HA 1.0 1.8 5.5 3468 2422 B 27 VAL HA B 44 ALA HA 1.0 1.8 5.5 3469 2423 B 27 VAL HA B 44 ALA HA 1.0 1.8 5.5 3470 2424 B 27 VAL HA B 44 ALA HA 1.0 1.8 5.5 3471 2425 B 17 LYS H B 16 GLN HBx 1.0 1.8 4.5 3472 2425 B 17 LYS H B 16 GLN HBy 1.0 1.8 4.5 3473 2426 B 9 GLN H B 8 ALA HB1 1.0 1.8 4.5 3474 2427 B 71 ALA HB1 B 72 GLU H 1.0 1.8 4.5 3475 2428 B 71 ALA HB1 B 72 GLU H 1.0 1.8 4.5 3476 2429 B 61 TYR H B 38 LEU HBx 1.0 1.8 4.5 3477 2429 B 38 LEU HBy B 61 TYR H 1.0 1.8 4.5 3478 2430 B 15 LEU HA B 77 ALA HB1 1.0 1.8 4.5 3479 2431 B 90 ALA H B 89 LEU H 1.0 1.8 4.5 3480 2432 B 90 ALA H B 89 LEU H 1.0 1.8 4.5 3481 2433 B 56 GLY HAx B 57 TYR H 1.0 1.8 4.5 3482 2434 B 56 GLY HAx B 57 TYR H 1.0 1.8 4.5 3483 2435 B 77 ALA HA B 80 GLU HBx 1.0 1.8 4.5 3484 2435 B 77 ALA HA B 80 GLU HBy 1.0 1.8 4.5 3485 2436 B 6 ARG H B 5 GLU HBx 1.0 1.8 4.5 3486 2436 B 6 ARG H B 5 GLU HBy 1.0 1.8 4.5 3487 2437 B 40 SER H B 40 SER HBx 1.0 1.8 4.5 3488 2437 B 40 SER H B 40 SER HBy 1.0 1.8 4.5 3489 2438 B 71 ALA HB1 B 62 PRO HDx 1.0 1.8 4.5 3490 2438 B 71 ALA HB1 B 62 PRO HDy 1.0 1.8 4.5 3491 2439 B 71 ALA HB1 B 62 PRO HDx 1.0 1.8 4.5 3492 2439 B 71 ALA HB1 B 62 PRO HDy 1.0 1.8 4.5 3493 2440 B 92 ASP H B 93 PHE H 1.0 1.8 4.5 3494 2441 B 68 ARG HE B 68 ARG HGx 1.0 1.8 4.5 3495 2441 B 68 ARG HGy B 68 ARG HE 1.0 1.8 4.5 3496 2442 B 89 LEU H B 88 ALA HB1 1.0 1.8 4.5 3497 2443 B 89 LEU H B 88 ALA HB1 1.0 1.8 4.5 3498 2444 B 71 ALA HA B 74 VAL HB 1.0 1.8 4.5 3499 2445 B 49 VAL H B 19 LEU HD21 1.0 1.8 4.5 3500 2446 B 63 VAL HG11 B 36 ALA HA 1.0 1.8 4.5 3501 2447 B 63 VAL HG11 B 36 ALA HA 1.0 1.8 4.5 3502 2448 B 63 VAL HG11 B 36 ALA HA 1.0 1.8 4.5 3503 2449 B 86 THR H B 85 VAL HG11 1.0 1.8 4.5 3504 2449 B 86 THR H B 85 VAL HG21 1.0 1.8 4.5 3505 2450 B 77 ALA HB1 B 73 GLN HGx 1.0 1.8 4.5 3506 2450 B 77 ALA HB1 B 73 GLN HGy 1.0 1.8 4.5 3507 2451 B 97 GLU H B 96 ARG HBx 1.0 1.8 4.5 3508 2451 B 96 ARG HBy B 97 GLU H 1.0 1.8 4.5 3509 2452 B 97 GLU H B 96 ARG HBx 1.0 1.8 4.5 3510 2452 B 96 ARG HBy B 97 GLU H 1.0 1.8 4.5 3511 2453 B 53 THR HG21 B 49 VAL HG11 1.0 1.8 4.5 3512 2454 B 66 GLU H B 66 GLU HGx 1.0 1.8 4.5 3513 2454 B 66 GLU H B 66 GLU HGy 1.0 1.8 4.5 3514 2455 B 19 LEU H B 19 LEU HD11 1.0 1.8 5.5 3515 2456 B 66 GLU H B 65 GLU HGx 1.0 1.8 5.5 3516 2456 B 66 GLU H B 65 GLU HGy 1.0 1.8 5.5 3517 2457 B 26 ALA HB1 B 30 GLU HGx 1.0 1.8 5.5 3518 2457 B 26 ALA HB1 B 30 GLU HGy 1.0 1.8 5.5 3519 2458 B 26 ALA HA B 70 VAL HB 1.0 1.8 5.5 3520 2459 B 57 TYR H B 57 TYR HD% 1.0 1.8 5.5 3521 2460 B 58 GLY H B 57 TYR HBx 1.0 1.8 5.5 3522 2461 B 51 THR HA B 54 THR HA 1.0 1.8 5.5 3523 2462 B 90 ALA HB1 B 87 ALA HA 1.0 1.8 5.5 3524 2463 B 97 GLU H B 96 ARG HDx 1.0 1.8 5.5 3525 2463 B 96 ARG HDy B 97 GLU H 1.0 1.8 5.5 3526 2464 B 97 GLU H B 96 ARG HDx 1.0 1.8 5.5 3527 2464 B 96 ARG HDy B 97 GLU H 1.0 1.8 5.5 3528 2465 B 7 GLU H B 4 HIS HA 1.0 1.8 5.5 3529 2466 B 91 THR HB B 92 ASP H 1.0 1.8 5.5 3530 2467 B 91 THR HB B 92 ASP H 1.0 1.8 5.5 3531 2468 B 10 LYS HGy B 14 GLU HBx 1.0 1.8 5.5 3532 2468 B 10 LYS HGx B 14 GLU HBx 1.0 1.8 5.5 3533 2468 B 14 GLU HBy B 10 LYS HGx 1.0 1.8 5.5 3534 2468 B 10 LYS HGy B 14 GLU HBy 1.0 1.8 5.5 3535 2469 B 88 ALA HB1 B 7 GLU HBx 1.0 1.8 5.5 3536 2469 B 7 GLU HBy B 88 ALA HB1 1.0 1.8 5.5 3537 2470 B 85 VAL HA B 88 ALA HB1 1.0 1.8 5.5 3538 2471 B 57 TYR HBx B 59 ASP HBx 1.0 1.8 5.5 3539 2471 B 57 TYR HBx B 59 ASP HBy 1.0 1.8 5.5 3540 2472 B 87 ALA H B 84 LEU HA 1.0 1.8 5.5 3541 2473 B 60 ARG H B 58 GLY H 1.0 1.8 5.5 3542 2474 B 15 LEU HD11 B 77 ALA H 1.0 1.8 5.5 3543 2475 B 84 LEU HD11 B 8 ALA HA 1.0 1.8 5.5 3544 2476 B 84 LEU HD11 B 8 ALA HA 1.0 1.8 5.5 3545 2477 B 90 ALA HA B 94 VAL HG11 1.0 1.8 5.5 3546 2477 B 90 ALA HA B 94 VAL HG21 1.0 1.8 5.5 3547 2478 B 12 GLU HBx B 16 GLN HGx 1.0 1.8 5.5 3548 2478 B 12 GLU HBy B 16 GLN HGx 1.0 1.8 5.5 3549 2478 B 16 GLN HGy B 12 GLU HBx 1.0 1.8 5.5 3550 2478 B 12 GLU HBy B 16 GLN HGy 1.0 1.8 5.5 3551 2479 B 53 THR HG21 B 78 GLY HAx 1.0 1.8 5.5 3552 2479 B 53 THR HG21 B 78 GLY HAy 1.0 1.8 5.5 3553 2480 B 8 ALA HA B 88 ALA HB1 1.0 1.8 5.5 3554 2481 B 8 ALA HA B 88 ALA HB1 1.0 1.8 5.5 3555 2482 B 90 ALA H B 89 LEU HD11 1.0 1.8 5.5 3556 2483 B 26 ALA HB1 B 70 VAL HG21 1.0 1.8 5.5 3557 2484 B 52 ALA HB1 B 82 PHE HZ 1.0 1.8 5.5 3558 2485 B 83 ALA H B 79 ILE HG21 1.0 1.8 5.5 3559 2486 B 89 LEU HD11 B 85 VAL HB 1.0 1.8 5.5 3560 2487 B 17 LYS H B 17 LYS HEx 1.0 1.8 5.5 3561 2487 B 17 LYS H B 17 LYS HEy 1.0 1.8 5.5 3562 2488 B 50 GLU HA B 53 THR H 1.0 1.8 5.5 3563 2489 B 90 ALA H B 87 ALA HA 1.0 1.8 5.5 3564 2490 B 9 GLN H B 84 LEU HD21 1.0 1.8 6.5 3565 2491 B 69 LYS HA B 68 ARG HBx 1.0 1.8 6.5 3566 2491 B 68 ARG HBy B 69 LYS HA 1.0 1.8 6.5 3567 2492 B 47 TRP H B 49 VAL H 1.0 1.8 6.5 3568 2493 B 37 ALA HB1 B 62 PRO HDx 1.0 1.8 6.5 3569 2493 B 37 ALA HB1 B 62 PRO HDy 1.0 1.8 6.5 3570 2494 B 86 THR HG21 B 89 LEU HD11 1.0 1.8 6.5 3571 2495 B 52 ALA HB1 B 82 PHE HD% 1.0 1.8 6.5 3572 2496 B 85 VAL H B 81 VAL HG11 1.0 1.8 6.5 3573 2497 B 74 VAL HG11 B 78 GLY HAx 1.0 1.8 6.5 3574 2497 B 74 VAL HG11 B 78 GLY HAy 1.0 1.8 6.5 3575 2498 B 7 GLU HGy B 84 LEU HBx 1.0 1.8 6.5 3576 2498 B 7 GLU HGx B 84 LEU HBx 1.0 1.8 6.5 3577 2498 B 84 LEU HBy B 7 GLU HGx 1.0 1.8 6.5 3578 2498 B 84 LEU HBy B 7 GLU HGy 1.0 1.8 6.5 3579 2499 B 94 VAL HA B 93 PHE HBx 1.0 1.8 6.5 3580 2499 B 93 PHE HBy B 94 VAL HA 1.0 1.8 6.5 3581 2500 B 57 TYR HD% B 59 ASP H 1.0 1.8 6.5 3582 2501 B 52 ALA HB1 B 74 VAL HG21 1.0 1.8 6.5 3583 2502 B 83 ALA H B 82 PHE HD% 1.0 1.8 6.5 3584 2503 B 49 VAL HA B 53 THR H 1.0 1.8 6.5 3585 2504 B 70 VAL HG11 B 74 VAL H 1.0 1.8 6.5 3586 2505 B 53 THR HA B 82 PHE HBx 1.0 1.8 6.5 3587 2506 B 65 GLU HBy B 34 PRO HBx 1.0 1.8 6.5 3588 2506 B 34 PRO HBy B 65 GLU HBy 1.0 1.8 6.5 3589 2507 B 18 VAL HB B 74 VAL HG21 1.0 1.8 6.5 3590 2508 B 52 ALA HB1 B 79 ILE H 1.0 1.8 6.5 3591 2509 B 52 ALA HB1 B 79 ILE H 1.0 1.8 6.5 3592 2510 B 46 TRP HBy B 60 ARG HGx 1.0 1.8 6.5 3593 2510 B 46 TRP HBx B 60 ARG HGx 1.0 1.8 6.5 3594 2510 B 60 ARG HGy B 46 TRP HBx 1.0 1.8 6.5 3595 2510 B 46 TRP HBy B 60 ARG HGy 1.0 1.8 6.5 3596 2511 B 51 THR HB B 56 GLY H 1.0 1.8 6.5 3597 2512 B 51 THR HB B 56 GLY H 1.0 1.8 6.5 3598 2513 B 86 THR HB B 83 ALA HA 1.0 1.8 6.5 3599 2514 B 88 ALA HB1 B 92 ASP HBx 1.0 1.8 6.5 3600 2514 B 88 ALA HB1 B 92 ASP HBy 1.0 1.8 6.5 3601 2515 B 64 THR HG21 B 63 VAL HG21 1.0 1.8 6.5 3602 2516 B 52 ALA HA B 79 ILE HG1x 1.0 1.8 6.5 3603 2516 B 52 ALA HA B 79 ILE HG1y 1.0 1.8 6.5 3604 2517 B 52 ALA HA B 79 ILE HG1x 1.0 1.8 6.5 3605 2517 B 52 ALA HA B 79 ILE HG1y 1.0 1.8 6.5 3606 2518 B 52 ALA HA B 79 ILE HG1x 1.0 1.8 6.5 3607 2518 B 52 ALA HA B 79 ILE HG1y 1.0 1.8 6.5 3608 2519 B 90 ALA HA B 94 VAL H 1.0 1.8 6.5 3609 2520 B 93 PHE H B 93 PHE HE% 1.0 1.8 6.5 3610 2521 B 26 ALA HB1 B 30 GLU HBx 1.0 1.8 6.5 3611 2521 B 26 ALA HB1 B 30 GLU HBy 1.0 1.8 6.5 3612 2522 B 51 THR HG21 B 56 GLY HAx 1.0 1.8 6.5 3613 2523 B 52 ALA HB1 B 77 ALA H 1.0 1.8 6.5 3614 2524 B 64 THR HA B 33 ALA HB1 1.0 1.8 6.5 3615 2525 B 52 ALA HB1 B 77 ALA H 1.0 1.8 6.5 3616 2526 B 52 ALA H B 78 GLY HAx 1.0 1.8 6.5 3617 2526 B 52 ALA H B 78 GLY HAy 1.0 1.8 6.5 3618 2527 B 27 VAL HA B 38 LEU HA 1.0 1.8 6.5 3619 2528 B 15 LEU HD11 B 54 THR H 1.0 1.8 6.5 3620 2529 B 52 ALA HA B 19 LEU HD11 1.0 1.8 6.5 3621 2530 B 42 PRO HA B 23 SER HBx 1.0 1.8 6.5 3622 2530 B 23 SER HBy B 42 PRO HA 1.0 1.8 6.5 3623 2531 B 52 ALA HA B 82 PHE HE% 1.0 1.8 6.5 3624 2532 B 48 SER H B 19 LEU HD11 1.0 1.8 6.5 3625 2533 B 23 SER H B 38 LEU HD11 1.0 1.8 6.5 3626 2533 B 23 SER H B 38 LEU HD21 1.0 1.8 6.5 3627 2534 B 26 ALA HB1 B 44 ALA H 1.0 1.8 6.5 3628 2535 B 16 GLN H B 52 ALA HB1 1.0 1.8 6.5 3629 2536 B 81 VAL HA B 85 VAL H 1.0 1.8 6.5 3630 2537 B 26 ALA HA B 47 TRP HZ2 1.0 1.8 6.5 3631 2538 B 26 ALA HA B 47 TRP HZ2 1.0 1.8 6.5 3632 2539 B 29 ALA HA B 66 GLU H 1.0 1.8 6.5 3633 2540 B 26 ALA HB1 B 45 ILE H 1.0 1.8 6.5 3634 2541 B 26 ALA HB1 B 45 ILE H 1.0 1.8 6.5 3635 2542 B 24 LYS H B 45 ILE HB 1.0 1.8 6.5 3636 2543 B 22 ALA HB1 B 51 THR HB 1.0 1.8 6.5 3637 2544 B 22 ALA HB1 B 51 THR HB 1.0 1.8 6.5 3638 2545 B 15 LEU HD11 B 54 THR HG21 1.0 1.8 6.5 3639 2546 B 15 LEU HD11 B 54 THR HG21 1.0 1.8 6.5 3640 2547 B 15 LEU HD11 B 54 THR HG21 1.0 1.8 6.5 3641 2548 B 24 LYS H B 45 ILE HA 1.0 1.8 6.5 3642 2549 B 24 LYS H B 45 ILE HA 1.0 1.8 6.5 3643 2550 B 50 GLU HGx B 60 ARG HBx 1.0 1.8 6.5 3644 2550 B 50 GLU HGy B 60 ARG HBx 1.0 1.8 6.5 3645 2550 B 60 ARG HBy B 50 GLU HGx 1.0 1.8 6.5 3646 2550 B 50 GLU HGy B 60 ARG HBy 1.0 1.8 6.5 3647 2551 B 91 THR HB B 88 ALA HB1 1.0 1.8 6.5 3648 2552 B 85 VAL HB B 12 GLU HGx 1.0 1.8 6.5 3649 2552 B 12 GLU HGy B 85 VAL HB 1.0 1.8 6.5 3650 2553 B 23 SER H B 48 SER HA 1.0 1.8 6.5 3651 2554 B 23 SER H B 48 SER HA 1.0 1.8 6.5 3652 2555 B 32 GLY H B 66 GLU HBx 1.0 1.8 6.5 3653 2555 B 32 GLY H B 66 GLU HBy 1.0 1.8 6.5 3654 2556 B 29 ALA HB1 B 68 ARG HBx 1.0 1.8 6.5 3655 2556 B 68 ARG HBy B 29 ALA HB1 1.0 1.8 6.5 3656 2557 B 27 VAL HA B 40 SER HBx 1.0 1.8 6.5 3657 2557 B 27 VAL HA B 40 SER HBy 1.0 1.8 6.5 3658 2558 B 51 THR HG21 B 78 GLY HAx 1.0 1.8 6.5 3659 2558 B 51 THR HG21 B 78 GLY HAy 1.0 1.8 6.5 3660 2559 B 51 THR HG21 B 19 LEU HD11 1.0 1.8 6.5 3661 2560 B 71 ALA H B 68 ARG HBx 1.0 1.8 6.5 3662 2560 B 68 ARG HBy B 71 ALA H 1.0 1.8 6.5 3663 2561 B 23 SER H B 70 VAL HG11 1.0 1.8 6.5 3664 2562 B 36 ALA H B 30 GLU HBx 1.0 1.8 6.5 3665 2562 B 30 GLU HBy B 36 ALA H 1.0 1.8 6.5 3666 2563 B 19 LEU HG B 52 ALA HA 1.0 1.8 6.5 3667 2564 B 48 SER HA B 71 ALA HA 1.0 1.8 6.5 3668 2565 B 18 VAL H B 52 ALA HB1 1.0 1.8 6.5 3669 2566 B 18 VAL H B 52 ALA HB1 1.0 1.8 6.5 3670 2567 B 30 GLU H B 39 ILE HA 1.0 1.8 6.5 3671 2568 B 89 LEU HA B 93 PHE H 1.0 1.8 6.5 3672 2569 B 25 LYS HBy B 67 GLY HAx 1.0 1.8 6.5 3673 2569 B 25 LYS HBx B 67 GLY HAx 1.0 1.8 6.5 3674 2569 B 67 GLY HAy B 25 LYS HBx 1.0 1.8 6.5 3675 2569 B 25 LYS HBy B 67 GLY HAy 1.0 1.8 6.5 3676 2570 B 44 ALA HB1 B 25 LYS HBx 1.0 1.8 6.5 3677 2570 B 25 LYS HBy B 44 ALA HB1 1.0 1.8 6.5 3678 2571 B 26 ALA HB1 B 51 THR HG21 1.0 1.8 6.5 3679 2572 B 34 PRO HA B 65 GLU HBy 1.0 1.8 6.5 3680 2573 B 47 TRP HE1 B 59 ASP HBx 1.0 1.8 6.5 3681 2573 B 47 TRP HE1 B 59 ASP HBy 1.0 1.8 6.5 3682 2574 B 45 ILE HD11 C 69 LYS HEx 1.0 1.8 6.5 3683 2574 B 45 ILE HD11 C 69 LYS HEy 1.0 1.8 6.5 3684 2575 B 45 ILE HG1y C 69 LYS HEx 1.0 1.8 6.5 3685 2575 B 45 ILE HG1x C 69 LYS HEx 1.0 1.8 6.5 3686 2575 C 69 LYS HEy B 45 ILE HG1x 1.0 1.8 6.5 3687 2575 B 45 ILE HG1y C 69 LYS HEy 1.0 1.8 6.5 3688 2576 B 45 ILE HG21 C 64 THR HG21 1.0 1.8 5.5 3689 2577 B 46 TRP HD1 C 68 ARG HDx 1.0 1.8 5.5 3690 2577 B 46 TRP HD1 C 68 ARG HDy 1.0 1.8 5.5 3691 2578 B 46 TRP HE1 C 64 THR HA 1.0 1.8 5.5 3692 2579 B 46 TRP HE1 C 64 THR HG21 1.0 1.8 5.5 3693 2580 B 46 TRP HE1 C 68 ARG HA 1.0 1.8 5.5 3694 2581 B 46 TRP HE1 C 68 ARG HBx 1.0 1.8 5.5 3695 2581 B 46 TRP HE1 C 68 ARG HBy 1.0 1.8 5.5 3696 2582 B 46 TRP HE3 C 68 ARG HDx 1.0 1.8 6.5 3697 2582 C 68 ARG HDy B 46 TRP HE3 1.0 1.8 6.5 3698 2583 B 46 TRP HZ2 C 68 ARG HBx 1.0 1.8 6.5 3699 2583 B 46 TRP HZ2 C 68 ARG HBy 1.0 1.8 6.5 3700 2584 B 46 TRP HBy C 68 ARG HBx 1.0 1.8 6.5 3701 2584 B 46 TRP HBx C 68 ARG HBx 1.0 1.8 6.5 3702 2584 C 68 ARG HBy B 46 TRP HBx 1.0 1.8 6.5 3703 2584 B 46 TRP HBy C 68 ARG HBy 1.0 1.8 6.5 3704 2585 B 46 TRP HBy C 68 ARG HDx 1.0 1.8 6.5 3705 2585 B 46 TRP HBx C 68 ARG HDx 1.0 1.8 6.5 3706 2585 C 68 ARG HDy B 46 TRP HBx 1.0 1.8 6.5 3707 2585 B 46 TRP HBy C 68 ARG HDy 1.0 1.8 6.5 3708 2586 B 46 TRP HBy C 68 ARG HGx 1.0 1.8 6.5 3709 2586 B 46 TRP HBx C 68 ARG HGx 1.0 1.8 6.5 3710 2586 C 68 ARG HGy B 46 TRP HBx 1.0 1.8 6.5 3711 2586 B 46 TRP HBy C 68 ARG HGy 1.0 1.8 6.5 3712 2587 B 49 VAL HG11 C 72 GLU HGx 1.0 1.8 6.5 3713 2587 B 49 VAL HG21 C 72 GLU HGx 1.0 1.8 6.5 3714 2587 C 72 GLU HGy B 49 VAL HG21 1.0 1.8 6.5 3715 2587 B 49 VAL HG11 C 72 GLU HGy 1.0 1.8 6.5 3716 2588 B 50 GLU HA C 72 GLU HA 1.0 1.8 5.5 3717 2589 C 71 ALA HB1 B 50 GLU HBx 1.0 1.8 5.5 3718 2589 B 50 GLU HBy C 71 ALA HB1 1.0 1.8 5.5 3719 2590 B 55 VAL HB C 75 MET HE1 1.0 1.8 5.5 3720 2591 C 54 THR HB B 55 VAL HG11 1.0 1.8 6.5 3721 2591 B 55 VAL HG21 C 54 THR HB 1.0 1.8 6.5 3722 2592 B 57 TYR HBy C 56 GLY HAy 1.0 1.8 5.5 3723 2593 B 57 TYR HBy C 61 TYR HA 1.0 1.8 5.5 3724 2594 B 57 TYR HD% C 60 ARG H 1.0 1.8 5.5 3725 2595 B 57 TYR HD% C 71 ALA HB1 1.0 1.8 5.5 3726 2596 B 57 TYR HE% C 58 GLY H 1.0 1.8 5.5 3727 2597 B 59 ASP HA C 61 TYR HBx 1.0 1.8 5.5 3728 2597 B 59 ASP HA C 61 TYR HBy 1.0 1.8 5.5 3729 2598 C 61 TYR HE% B 59 ASP HBx 1.0 1.8 6.5 3730 2598 B 59 ASP HBy C 61 TYR HE% 1.0 1.8 6.5 3731 2599 B 81 VAL HG21 C 76 LYS HEx 1.0 1.8 6.5 3732 2599 B 81 VAL HG11 C 76 LYS HEx 1.0 1.8 6.5 3733 2599 C 76 LYS HEy B 81 VAL HG21 1.0 1.8 6.5 3734 2599 B 81 VAL HG11 C 76 LYS HEy 1.0 1.8 6.5 3735 2600 B 82 PHE HD% C 76 LYS HEx 1.0 1.8 6.5 3736 2600 B 82 PHE HD% C 76 LYS HEy 1.0 1.8 6.5 3737 2601 B 82 PHE HE% C 76 LYS HEx 1.0 1.8 6.5 3738 2601 B 82 PHE HE% C 76 LYS HEy 1.0 1.8 6.5 3739 2602 B 89 LEU HA C 84 LEU HD21 1.0 1.8 6.5 3740 2602 B 89 LEU HA C 84 LEU HD11 1.0 1.8 6.5 3741 2603 C 86 THR H B 89 LEU HBx 1.0 1.8 5.5 3742 2603 B 89 LEU HBy C 86 THR H 1.0 1.8 5.5 3743 2604 C 87 ALA H B 89 LEU HBx 1.0 1.8 5.5 3744 2604 B 89 LEU HBy C 87 ALA H 1.0 1.8 5.5 3745 2605 B 89 LEU HD11 C 83 ALA H 1.0 1.8 5.5 3746 2606 B 89 LEU HD11 C 87 ALA H 1.0 1.8 5.5 3747 2607 C 87 ALA HB1 B 89 LEU HD21 1.0 1.8 6.5 3748 2607 B 89 LEU HD11 C 87 ALA HB1 1.0 1.8 6.5 3749 2608 C 86 THR HB B 92 ASP HBx 1.0 1.8 5.5 3750 2608 B 92 ASP HBy C 86 THR HB 1.0 1.8 5.5 3751 2609 C 90 ALA HB1 B 92 ASP HBx 1.0 1.8 6.5 3752 2609 B 92 ASP HBy C 90 ALA HB1 1.0 1.8 6.5 3753 2610 B 93 PHE H C 86 THR HG21 1.0 1.8 5.5 3754 2611 B 93 PHE H C 87 ALA H 1.0 1.8 5.5 3755 2612 C 90 ALA H B 93 PHE HBx 1.0 1.8 5.5 3756 2612 B 93 PHE HBy C 90 ALA H 1.0 1.8 5.5 3757 2613 B 96 ARG HE C 94 VAL HB 1.0 1.8 5.5 3758 2614 C 4 HIS H B 96 ARG HBx 1.0 1.8 6.5 3759 2614 B 96 ARG HBy C 4 HIS H 1.0 1.8 6.5 3760 2615 C 87 ALA HB1 B 96 ARG HBx 1.0 1.8 5.5 3761 2615 B 96 ARG HBy C 87 ALA HB1 1.0 1.8 5.5 3762 2616 C 87 ALA HB1 B 96 ARG HDx 1.0 1.8 6.5 3763 2616 B 96 ARG HDy C 87 ALA HB1 1.0 1.8 6.5 3764 2617 C 90 ALA HB1 B 96 ARG HDx 1.0 1.8 6.5 3765 2617 B 96 ARG HDy C 90 ALA HB1 1.0 1.8 6.5 3766 2618 C 91 THR HG21 B 96 ARG HDx 1.0 1.8 6.5 3767 2618 B 96 ARG HDy C 91 THR HG21 1.0 1.8 6.5 3768 2619 B 43 ASP HBy C 64 THR HB 1.0 1.8 6.5 3769 2620 C 60 ARG H B 57 TYR HE% 1.0 1.8 6.5 3770 2621 B 46 TRP HH2 C 69 LYS H 1.0 1.8 6.5 3771 2622 B 50 GLU HGx C 68 ARG HGx 1.0 1.8 6.5 3772 2622 C 68 ARG HGy B 50 GLU HGx 1.0 1.8 6.5 3773 2622 B 50 GLU HGy C 68 ARG HGy 1.0 1.8 6.5 3774 2622 B 50 GLU HGy C 68 ARG HGx 1.0 1.8 6.5 3775 2623 B 93 PHE H C 91 THR HG21 1.0 1.8 6.5 3776 2624 B 46 TRP HD1 C 65 GLU H 1.0 1.8 6.5 3777 2625 C 84 LEU HG B 89 LEU HD21 1.0 1.8 6.5 3778 2626 B 46 TRP HZ3 C 68 ARG HDx 1.0 1.8 6.5 3779 2626 C 68 ARG HDy B 46 TRP HZ3 1.0 1.8 6.5 3780 2627 B 46 TRP HZ3 C 68 ARG HDx 1.0 1.8 6.5 3781 2627 C 68 ARG HDy B 46 TRP HZ3 1.0 1.8 6.5 3782 2628 B 49 VAL HB C 68 ARG HE 1.0 1.8 6.5 3783 2629 B 60 ARG HE C 68 ARG HE 1.0 1.8 6.5 3784 2630 B 45 ILE HD11 C 64 THR HG21 1.0 1.8 6.5 3785 2631 B 46 TRP HE3 C 68 ARG HBx 1.0 1.8 6.5 3786 2631 C 68 ARG HBy B 46 TRP HE3 1.0 1.8 6.5 3787 2632 B 89 LEU HA C 84 LEU HBx 1.0 1.8 6.5 3788 2632 B 89 LEU HA C 84 LEU HBy 1.0 1.8 6.5 3789 2633 B 49 VAL H C 68 ARG HGx 1.0 1.8 6.5 3790 2633 B 49 VAL H C 68 ARG HGy 1.0 1.8 6.5 3791 2634 B 45 ILE HG1y C 68 ARG HDx 1.0 1.8 6.5 3792 2634 B 45 ILE HG1x C 68 ARG HDx 1.0 1.8 6.5 3793 2634 C 68 ARG HDy B 45 ILE HG1x 1.0 1.8 6.5 3794 2634 B 45 ILE HG1y C 68 ARG HDy 1.0 1.8 6.5 3795 2635 B 59 ASP HBy C 63 VAL HG21 1.0 1.8 6.5 3796 2635 B 59 ASP HBx C 63 VAL HG21 1.0 1.8 6.5 3797 2635 C 63 VAL HG11 B 59 ASP HBx 1.0 1.8 6.5 3798 2635 B 59 ASP HBy C 63 VAL HG11 1.0 1.8 6.5 3799 2636 B 49 VAL HG11 C 73 GLN HBx 1.0 1.8 6.5 3800 2636 B 49 VAL HG21 C 73 GLN HBx 1.0 1.8 6.5 3801 2636 C 73 GLN HBy B 49 VAL HG21 1.0 1.8 6.5 3802 2636 B 49 VAL HG11 C 73 GLN HBy 1.0 1.8 6.5 3803 2637 B 46 TRP HE1 C 69 LYS HA 1.0 1.8 6.5 3804 2638 B 82 PHE HBy C 76 LYS HGx 1.0 1.8 6.5 3805 2638 B 82 PHE HBx C 76 LYS HGx 1.0 1.8 6.5 3806 2638 C 76 LYS HGy B 82 PHE HBy 1.0 1.8 6.5 3807 2638 B 82 PHE HBx C 76 LYS HGy 1.0 1.8 6.5 3808 2639 C 91 THR HB B 94 VAL HG11 1.0 1.8 6.5 3809 2639 B 94 VAL HG21 C 91 THR HB 1.0 1.8 6.5 3810 2640 B 92 ASP HBy C 89 LEU HD21 1.0 1.8 6.5 3811 2640 B 92 ASP HBx C 89 LEU HD21 1.0 1.8 6.5 3812 2640 C 89 LEU HD11 B 92 ASP HBx 1.0 1.8 6.5 3813 2640 B 92 ASP HBy C 89 LEU HD11 1.0 1.8 6.5 3814 2641 B 92 ASP HBy C 89 LEU HBx 1.0 1.8 6.5 3815 2641 B 92 ASP HBx C 89 LEU HBx 1.0 1.8 6.5 3816 2641 C 89 LEU HBy B 92 ASP HBx 1.0 1.8 6.5 3817 2641 B 92 ASP HBy C 89 LEU HBy 1.0 1.8 6.5 3818 2642 B 90 ALA HA C 91 THR HG21 1.0 1.8 6.5 3819 2643 C 1 SER H1 C 2 ALA H 1.0 1.8 5.5 3820 2644 C 1 SER HA C 1 SER HBx 1.0 1.8 3.5 3821 2644 C 1 SER HA C 1 SER HBy 1.0 1.8 3.5 3822 2645 C 2 ALA H C 1 SER HA 1.0 1.8 3.5 3823 2646 C 2 ALA H C 1 SER HBx 1.0 1.8 5.5 3824 2646 C 2 ALA H C 1 SER HBy 1.0 1.8 5.5 3825 2647 C 2 ALA H C 2 ALA HA 1.0 1.8 5.5 3826 2648 C 2 ALA H C 2 ALA HB1 1.0 1.8 4.5 3827 2649 C 2 ALA H C 5 GLU H 1.0 1.8 6.5 3828 2650 C 2 ALA H C 2 ALA HA 1.0 1.8 4.5 3829 2651 C 2 ALA HA C 2 ALA HB1 1.0 1.8 3.5 3830 2652 C 2 ALA H C 2 ALA HB1 1.0 1.8 3.5 3831 2653 C 2 ALA HA C 2 ALA HB1 1.0 1.8 3.5 3832 2654 C 2 ALA HB1 C 3 ASP H 1.0 1.8 3.5 3833 2655 C 2 ALA HB1 C 3 ASP H 1.0 1.8 4.5 3834 2656 C 3 ASP H C 3 ASP HA 1.0 1.8 4.5 3835 2657 C 3 ASP H C 3 ASP HA 1.0 1.8 4.5 3836 2658 C 3 ASP HA C 3 ASP HBx 1.0 1.8 3.5 3837 2658 C 3 ASP HA C 3 ASP HBy 1.0 1.8 3.5 3838 2659 C 4 HIS H C 3 ASP HA 1.0 1.8 5.5 3839 2660 C 3 ASP HA C 7 GLU H 1.0 1.8 5.5 3840 2661 C 2 ALA HB1 C 3 ASP HBx 1.0 1.8 5.5 3841 2661 C 2 ALA HB1 C 3 ASP HBy 1.0 1.8 5.5 3842 2662 C 4 HIS H C 3 ASP HBx 1.0 1.8 4.5 3843 2662 C 4 HIS H C 3 ASP HBy 1.0 1.8 4.5 3844 2663 C 4 HIS H C 2 ALA HB1 1.0 1.8 4.5 3845 2664 C 4 HIS H C 4 HIS HA 1.0 1.8 4.5 3846 2665 C 4 HIS H C 5 GLU H 1.0 1.8 3.5 3847 2666 C 4 HIS HA C 3 ASP HBx 1.0 1.8 5.5 3848 2666 C 3 ASP HBy C 4 HIS HA 1.0 1.8 5.5 3849 2667 C 4 HIS H C 4 HIS HA 1.0 1.8 4.5 3850 2668 C 5 GLU H C 4 HIS HA 1.0 1.8 5.5 3851 2669 C 4 HIS HA C 6 ARG H 1.0 1.8 5.5 3852 2670 C 4 HIS H C 4 HIS HBx 1.0 1.8 5.5 3853 2671 C 4 HIS HBx C 4 HIS HBy 1.0 1.8 3.5 3854 2672 C 5 GLU H C 4 HIS HBx 1.0 1.8 4.5 3855 2673 C 4 HIS H C 4 HIS HBy 1.0 1.8 3.5 3856 2674 C 5 GLU H C 4 HIS HBy 1.0 1.8 5.5 3857 2675 C 2 ALA HB1 C 4 HIS HD2 1.0 1.8 5.5 3858 2676 C 4 HIS H C 4 HIS HD2 1.0 1.8 5.5 3859 2677 C 2 ALA HB1 C 4 HIS HE1 1.0 1.8 4.5 3860 2678 C 5 GLU H C 4 HIS HE1 1.0 1.8 5.5 3861 2679 C 2 ALA HB1 C 5 GLU H 1.0 1.8 4.5 3862 2680 C 4 HIS H C 5 GLU H 1.0 1.8 3.5 3863 2681 C 5 GLU H C 5 GLU HA 1.0 1.8 4.5 3864 2682 C 5 GLU H C 5 GLU HA 1.0 1.8 4.5 3865 2683 C 6 ARG H C 5 GLU HA 1.0 1.8 5.5 3866 2684 C 5 GLU HA C 9 GLN H 1.0 1.8 5.5 3867 2685 C 2 ALA HB1 C 5 GLU HBx 1.0 1.8 3.5 3868 2685 C 2 ALA HB1 C 5 GLU HBy 1.0 1.8 3.5 3869 2686 C 5 GLU H C 5 GLU HBx 1.0 1.8 3.5 3870 2686 C 5 GLU H C 5 GLU HBy 1.0 1.8 3.5 3871 2687 C 5 GLU HBx C 5 GLU HGx 1.0 1.8 3.5 3872 2687 C 5 GLU HBy C 5 GLU HGx 1.0 1.8 3.5 3873 2687 C 5 GLU HGy C 5 GLU HBx 1.0 1.8 3.5 3874 2687 C 5 GLU HBy C 5 GLU HGy 1.0 1.8 3.5 3875 2688 C 2 ALA HB1 C 5 GLU HGx 1.0 1.8 4.5 3876 2688 C 2 ALA HB1 C 5 GLU HGy 1.0 1.8 4.5 3877 2689 C 5 GLU H C 5 GLU HGx 1.0 1.8 3.5 3878 2689 C 5 GLU H C 5 GLU HGy 1.0 1.8 3.5 3879 2690 C 5 GLU HBx C 5 GLU HGx 1.0 1.8 3.5 3880 2690 C 5 GLU HBy C 5 GLU HGx 1.0 1.8 3.5 3881 2690 C 5 GLU HGy C 5 GLU HBx 1.0 1.8 3.5 3882 2690 C 5 GLU HBy C 5 GLU HGy 1.0 1.8 3.5 3883 2691 C 6 ARG H C 5 GLU HGx 1.0 1.8 5.5 3884 2691 C 6 ARG H C 5 GLU HGy 1.0 1.8 5.5 3885 2692 C 2 ALA HB1 C 6 ARG H 1.0 1.8 5.5 3886 2693 C 4 HIS H C 6 ARG H 1.0 1.8 5.5 3887 2694 C 6 ARG H C 5 GLU HA 1.0 1.8 5.5 3888 2695 C 6 ARG H C 6 ARG HA 1.0 1.8 4.5 3889 2696 C 6 ARG HA C 8 ALA H 1.0 1.8 5.5 3890 2697 C 6 ARG H C 6 ARG HBx 1.0 1.8 4.5 3891 2697 C 6 ARG H C 6 ARG HBy 1.0 1.8 4.5 3892 2698 C 6 ARG H C 6 ARG HDx 1.0 1.8 5.5 3893 2698 C 6 ARG H C 6 ARG HDy 1.0 1.8 5.5 3894 2699 C 6 ARG H C 6 ARG HGx 1.0 1.8 5.5 3895 2699 C 6 ARG H C 6 ARG HGy 1.0 1.8 5.5 3896 2700 C 6 ARG HH1% C 6 ARG HE 1.0 1.8 5.5 3897 2701 C 7 GLU H C 5 GLU HA 1.0 1.8 5.5 3898 2702 C 7 GLU HA C 10 LYS H 1.0 1.8 5.5 3899 2703 C 7 GLU HA C 11 ALA H 1.0 1.8 5.5 3900 2704 C 7 GLU H C 7 GLU HA 1.0 1.8 3.5 3901 2705 C 8 ALA H C 7 GLU HA 1.0 1.8 5.5 3902 2706 C 7 GLU H C 7 GLU HBx 1.0 1.8 3.5 3903 2706 C 7 GLU H C 7 GLU HBy 1.0 1.8 3.5 3904 2707 C 7 GLU HBx C 7 GLU HGx 1.0 1.8 3.5 3905 2707 C 7 GLU HBy C 7 GLU HGx 1.0 1.8 3.5 3906 2707 C 7 GLU HGy C 7 GLU HBx 1.0 1.8 3.5 3907 2707 C 7 GLU HBy C 7 GLU HGy 1.0 1.8 3.5 3908 2708 C 8 ALA H C 7 GLU HBx 1.0 1.8 3.5 3909 2708 C 8 ALA H C 7 GLU HBy 1.0 1.8 3.5 3910 2709 C 8 ALA HA C 7 GLU HBx 1.0 1.8 5.5 3911 2709 C 7 GLU HBy C 8 ALA HA 1.0 1.8 5.5 3912 2710 C 7 GLU HGy C 10 LYS HBx 1.0 1.8 4.5 3913 2710 C 7 GLU HGx C 10 LYS HBx 1.0 1.8 4.5 3914 2710 C 10 LYS HBy C 7 GLU HGx 1.0 1.8 4.5 3915 2710 C 7 GLU HGy C 10 LYS HBy 1.0 1.8 4.5 3916 2711 C 11 ALA H C 7 GLU HGx 1.0 1.8 5.5 3917 2711 C 11 ALA H C 7 GLU HGy 1.0 1.8 5.5 3918 2712 C 7 GLU H C 7 GLU HGx 1.0 1.8 5.5 3919 2712 C 7 GLU H C 7 GLU HGy 1.0 1.8 5.5 3920 2713 C 8 ALA H C 7 GLU HGx 1.0 1.8 5.5 3921 2713 C 8 ALA H C 7 GLU HGy 1.0 1.8 5.5 3922 2714 C 5 GLU HA C 8 ALA H 1.0 1.8 5.5 3923 2715 C 8 ALA H C 7 GLU HA 1.0 1.8 5.5 3924 2716 C 8 ALA H C 8 ALA HA 1.0 1.8 4.5 3925 2717 C 8 ALA HA C 12 GLU H 1.0 1.8 5.5 3926 2718 C 9 GLN H C 8 ALA HA 1.0 1.8 5.5 3927 2719 C 8 ALA H C 8 ALA HB1 1.0 1.8 3.5 3928 2720 C 5 GLU HA C 9 GLN H 1.0 1.8 5.5 3929 2721 C 9 GLN H C 8 ALA H 1.0 1.8 4.5 3930 2722 C 9 GLN H C 8 ALA HA 1.0 1.8 5.5 3931 2723 C 10 LYS H C 9 GLN HA 1.0 1.8 4.5 3932 2724 C 8 ALA HB1 C 9 GLN HA 1.0 1.8 5.5 3933 2725 C 9 GLN HE2x C 9 GLN HE2y 1.0 1.8 3.5 3934 2726 C 9 GLN HE2x C 9 GLN HE2y 1.0 1.8 3.5 3935 2727 C 9 GLN HE2x C 9 GLN HBx 1.0 1.8 4.5 3936 2727 C 9 GLN HE2x C 9 GLN HBy 1.0 1.8 4.5 3937 2728 C 9 GLN HE2y C 9 GLN HBx 1.0 1.8 4.5 3938 2728 C 9 GLN HE2y C 9 GLN HBy 1.0 1.8 4.5 3939 2729 C 9 GLN HE2x C 9 GLN HGx 1.0 1.8 4.5 3940 2729 C 9 GLN HE2x C 9 GLN HGy 1.0 1.8 4.5 3941 2730 C 9 GLN HE2y C 9 GLN HGx 1.0 1.8 4.5 3942 2730 C 9 GLN HE2y C 9 GLN HGy 1.0 1.8 4.5 3943 2731 C 9 GLN HBy C 9 GLN HGx 1.0 1.8 3.5 3944 2731 C 9 GLN HBx C 9 GLN HGx 1.0 1.8 3.5 3945 2731 C 9 GLN HGy C 9 GLN HBx 1.0 1.8 3.5 3946 2731 C 9 GLN HBy C 9 GLN HGy 1.0 1.8 3.5 3947 2732 C 10 LYS HBy C 10 LYS HGx 1.0 1.8 4.5 3948 2732 C 10 LYS HGy C 10 LYS HBx 1.0 1.8 4.5 3949 2732 C 10 LYS HBy C 10 LYS HGy 1.0 1.8 4.5 3950 2732 C 10 LYS HBx C 10 LYS HGx 1.0 1.8 4.5 3951 2733 C 11 ALA H C 11 ALA HA 1.0 1.8 4.5 3952 2734 C 11 ALA H C 11 ALA HA 1.0 1.8 4.5 3953 2735 C 11 ALA HA C 14 GLU H 1.0 1.8 4.5 3954 2736 C 11 ALA H C 11 ALA HB1 1.0 1.8 3.5 3955 2737 C 8 ALA HA C 11 ALA HB1 1.0 1.8 3.5 3956 2738 C 12 GLU H C 11 ALA HA 1.0 1.8 4.5 3957 2739 C 8 ALA HA C 12 GLU H 1.0 1.8 5.5 3958 2740 C 12 GLU H C 12 GLU HA 1.0 1.8 4.5 3959 2741 C 12 GLU HA C 15 LEU H 1.0 1.8 5.5 3960 2742 C 12 GLU HA C 15 LEU HBx 1.0 1.8 5.5 3961 2743 C 12 GLU H C 12 GLU HBx 1.0 1.8 3.5 3962 2743 C 12 GLU H C 12 GLU HBy 1.0 1.8 3.5 3963 2744 C 12 GLU H C 12 GLU HGx 1.0 1.8 4.5 3964 2744 C 12 GLU H C 12 GLU HGy 1.0 1.8 4.5 3965 2745 C 13 GLU H C 12 GLU HGx 1.0 1.8 5.5 3966 2745 C 12 GLU HGy C 13 GLU H 1.0 1.8 5.5 3967 2746 C 13 GLU H C 10 LYS HA 1.0 1.8 4.5 3968 2747 C 11 ALA H C 13 GLU H 1.0 1.8 5.5 3969 2748 C 14 GLU H C 13 GLU H 1.0 1.8 4.5 3970 2749 C 13 GLU H C 13 GLU HA 1.0 1.8 4.5 3971 2750 C 13 GLU H C 13 GLU HBx 1.0 1.8 3.5 3972 2750 C 13 GLU H C 13 GLU HBy 1.0 1.8 3.5 3973 2751 C 13 GLU HBx C 13 GLU HGx 1.0 1.8 3.5 3974 2751 C 13 GLU HBy C 13 GLU HGx 1.0 1.8 3.5 3975 2751 C 13 GLU HGy C 13 GLU HBx 1.0 1.8 3.5 3976 2751 C 13 GLU HBy C 13 GLU HGy 1.0 1.8 3.5 3977 2752 C 13 GLU H C 13 GLU HGx 1.0 1.8 5.5 3978 2752 C 13 GLU H C 13 GLU HGy 1.0 1.8 5.5 3979 2753 C 11 ALA HA C 14 GLU H 1.0 1.8 4.5 3980 2754 C 14 GLU H C 14 GLU HA 1.0 1.8 3.5 3981 2755 C 14 GLU HA C 17 LYS H 1.0 1.8 5.5 3982 2756 C 14 GLU H C 14 GLU HBx 1.0 1.8 3.5 3983 2756 C 14 GLU H C 14 GLU HBy 1.0 1.8 3.5 3984 2757 C 14 GLU H C 14 GLU HGx 1.0 1.8 5.5 3985 2757 C 14 GLU H C 14 GLU HGy 1.0 1.8 5.5 3986 2758 C 12 GLU HA C 15 LEU H 1.0 1.8 5.5 3987 2759 C 15 LEU H C 15 LEU HA 1.0 1.8 4.5 3988 2760 C 15 LEU H C 15 LEU HA 1.0 1.8 3.5 3989 2761 C 15 LEU HBx C 15 LEU HA 1.0 1.8 4.5 3990 2762 C 15 LEU HA C 19 LEU H 1.0 1.8 5.5 3991 2763 C 15 LEU H C 15 LEU HBy 1.0 1.8 3.5 3992 2764 C 19 LEU H C 15 LEU HG 1.0 1.8 5.5 3993 2765 C 15 LEU H C 15 LEU HD11 1.0 1.8 4.5 3994 2766 C 15 LEU HA C 16 GLN H 1.0 1.8 5.5 3995 2767 C 16 GLN H C 16 GLN HE2x 1.0 1.8 5.5 3996 2768 C 15 LEU HBy C 16 GLN HA 1.0 1.8 5.5 3997 2769 C 17 LYS H C 16 GLN HA 1.0 1.8 5.5 3998 2770 C 16 GLN HA C 20 GLU H 1.0 1.8 5.5 3999 2771 C 16 GLN HE2x C 16 GLN HE2y 1.0 1.8 3.5 4000 2772 C 16 GLN H C 16 GLN HBx 1.0 1.8 3.5 4001 2772 C 16 GLN H C 16 GLN HBy 1.0 1.8 3.5 4002 2773 C 16 GLN HA C 16 GLN HBx 1.0 1.8 4.5 4003 2773 C 16 GLN HA C 16 GLN HBy 1.0 1.8 4.5 4004 2774 C 16 GLN HE2x C 16 GLN HBx 1.0 1.8 4.5 4005 2774 C 16 GLN HE2x C 16 GLN HBy 1.0 1.8 4.5 4006 2775 C 16 GLN HE2y C 16 GLN HBx 1.0 1.8 4.5 4007 2775 C 16 GLN HE2y C 16 GLN HBy 1.0 1.8 4.5 4008 2776 C 16 GLN HBy C 16 GLN HGx 1.0 1.8 3.5 4009 2776 C 16 GLN HGy C 16 GLN HBx 1.0 1.8 3.5 4010 2776 C 16 GLN HBy C 16 GLN HGy 1.0 1.8 3.5 4011 2776 C 16 GLN HBx C 16 GLN HGx 1.0 1.8 3.5 4012 2777 C 16 GLN HBx C 20 GLU HGx 1.0 1.8 4.5 4013 2777 C 16 GLN HBy C 20 GLU HGx 1.0 1.8 4.5 4014 2777 C 20 GLU HGy C 16 GLN HBx 1.0 1.8 4.5 4015 2777 C 16 GLN HBy C 20 GLU HGy 1.0 1.8 4.5 4016 2778 C 16 GLN H C 16 GLN HGx 1.0 1.8 3.5 4017 2778 C 16 GLN H C 16 GLN HGy 1.0 1.8 3.5 4018 2779 C 16 GLN HE2y C 16 GLN HGx 1.0 1.8 4.5 4019 2779 C 16 GLN HE2y C 16 GLN HGy 1.0 1.8 4.5 4020 2780 C 14 GLU HA C 17 LYS H 1.0 1.8 5.5 4021 2781 C 17 LYS H C 15 LEU HA 1.0 1.8 5.5 4022 2782 C 17 LYS H C 17 LYS HA 1.0 1.8 4.5 4023 2783 C 17 LYS HA C 18 VAL H 1.0 1.8 5.5 4024 2784 C 20 GLU H C 17 LYS HA 1.0 1.8 5.5 4025 2785 C 17 LYS H C 17 LYS HBx 1.0 1.8 3.5 4026 2785 C 17 LYS H C 17 LYS HBy 1.0 1.8 3.5 4027 2786 C 17 LYS H C 17 LYS HDx 1.0 1.8 5.5 4028 2786 C 17 LYS H C 17 LYS HDy 1.0 1.8 5.5 4029 2787 C 17 LYS HBx C 17 LYS HDx 1.0 1.8 4.5 4030 2787 C 17 LYS HBy C 17 LYS HDx 1.0 1.8 4.5 4031 2787 C 17 LYS HDy C 17 LYS HBx 1.0 1.8 4.5 4032 2787 C 17 LYS HBy C 17 LYS HDy 1.0 1.8 4.5 4033 2788 C 18 VAL H C 17 LYS HDx 1.0 1.8 5.5 4034 2788 C 18 VAL H C 17 LYS HDy 1.0 1.8 5.5 4035 2789 C 17 LYS HEx C 17 LYS HGx 1.0 1.8 4.5 4036 2789 C 17 LYS HEy C 17 LYS HGx 1.0 1.8 4.5 4037 2789 C 17 LYS HGy C 17 LYS HEx 1.0 1.8 4.5 4038 2789 C 17 LYS HEy C 17 LYS HGy 1.0 1.8 4.5 4039 2790 C 17 LYS H C 17 LYS HGx 1.0 1.8 5.5 4040 2790 C 17 LYS H C 17 LYS HGy 1.0 1.8 5.5 4041 2791 C 15 LEU HA C 18 VAL H 1.0 1.8 4.5 4042 2792 C 19 LEU H C 18 VAL H 1.0 1.8 3.5 4043 2793 C 18 VAL H C 18 VAL HA 1.0 1.8 3.5 4044 2794 C 18 VAL H C 18 VAL HB 1.0 1.8 3.5 4045 2795 C 19 LEU H C 18 VAL HB 1.0 1.8 3.5 4046 2796 C 17 LYS HGx C 18 VAL HG11 1.0 1.8 5.5 4047 2796 C 17 LYS HGy C 18 VAL HG11 1.0 1.8 5.5 4048 2796 C 18 VAL HG21 C 17 LYS HGx 1.0 1.8 5.5 4049 2796 C 17 LYS HGy C 18 VAL HG21 1.0 1.8 5.5 4050 2797 C 18 VAL H C 18 VAL HG11 1.0 1.8 3.5 4051 2797 C 18 VAL H C 18 VAL HG21 1.0 1.8 3.5 4052 2798 C 15 LEU HA C 19 LEU H 1.0 1.8 5.5 4053 2799 C 19 LEU H C 18 VAL H 1.0 1.8 3.5 4054 2800 C 19 LEU H C 19 LEU HA 1.0 1.8 4.5 4055 2801 C 20 GLU H C 19 LEU HA 1.0 1.8 5.5 4056 2802 C 18 VAL H C 19 LEU HG 1.0 1.8 5.5 4057 2803 C 19 LEU H C 19 LEU HG 1.0 1.8 3.5 4058 2804 C 15 LEU HD11 C 19 LEU HBx 1.0 1.8 5.5 4059 2804 C 15 LEU HD11 C 19 LEU HBy 1.0 1.8 5.5 4060 2805 C 19 LEU HD11 C 19 LEU HBx 1.0 1.8 4.5 4061 2805 C 19 LEU HBy C 19 LEU HD11 1.0 1.8 4.5 4062 2806 C 20 GLU H C 19 LEU HD11 1.0 1.8 5.5 4063 2807 C 19 LEU H C 19 LEU HD21 1.0 1.8 4.5 4064 2808 C 20 GLU H C 20 GLU HA 1.0 1.8 3.5 4065 2809 C 20 GLU H C 20 GLU HA 1.0 1.8 3.5 4066 2810 C 20 GLU H C 20 GLU HBx 1.0 1.8 3.5 4067 2810 C 20 GLU H C 20 GLU HBy 1.0 1.8 3.5 4068 2811 C 20 GLU HBx C 20 GLU HGx 1.0 1.8 3.5 4069 2811 C 20 GLU HBy C 20 GLU HGx 1.0 1.8 3.5 4070 2811 C 20 GLU HGy C 20 GLU HBx 1.0 1.8 3.5 4071 2811 C 20 GLU HGy C 20 GLU HBy 1.0 1.8 3.5 4072 2812 C 21 GLU H C 20 GLU HBx 1.0 1.8 3.5 4073 2812 C 20 GLU HBy C 21 GLU H 1.0 1.8 3.5 4074 2813 C 21 GLU HA C 20 GLU HBx 1.0 1.8 5.5 4075 2813 C 20 GLU HBy C 21 GLU HA 1.0 1.8 5.5 4076 2814 C 20 GLU H C 20 GLU HGx 1.0 1.8 3.5 4077 2814 C 20 GLU H C 20 GLU HGy 1.0 1.8 3.5 4078 2815 C 20 GLU HA C 21 GLU H 1.0 1.8 5.5 4079 2816 C 21 GLU H C 21 GLU HA 1.0 1.8 3.5 4080 2817 C 21 GLU HA C 22 ALA H 1.0 1.8 5.5 4081 2818 C 21 GLU HA C 25 LYS H 1.0 1.8 5.5 4082 2819 C 21 GLU HA C 21 GLU HBx 1.0 1.8 4.5 4083 2819 C 21 GLU HA C 21 GLU HBy 1.0 1.8 4.5 4084 2820 C 22 ALA H C 21 GLU HBx 1.0 1.8 3.5 4085 2820 C 22 ALA H C 21 GLU HBy 1.0 1.8 3.5 4086 2821 C 22 ALA H C 21 GLU HGx 1.0 1.8 4.5 4087 2821 C 22 ALA H C 21 GLU HGy 1.0 1.8 4.5 4088 2822 C 22 ALA H C 22 ALA HA 1.0 1.8 3.5 4089 2823 C 22 ALA HA C 22 ALA HB1 1.0 1.8 4.5 4090 2824 C 22 ALA HA C 23 SER H 1.0 1.8 5.5 4091 2825 C 25 LYS H C 22 ALA HA 1.0 1.8 4.5 4092 2826 C 22 ALA HA C 26 ALA H 1.0 1.8 5.5 4093 2827 C 22 ALA H C 22 ALA HB1 1.0 1.8 3.5 4094 2828 C 22 ALA HB1 C 23 SER H 1.0 1.8 3.5 4095 2829 C 23 SER H C 23 SER HA 1.0 1.8 4.5 4096 2830 C 23 SER HA C 24 LYS H 1.0 1.8 5.5 4097 2831 C 23 SER HA C 26 ALA HB1 1.0 1.8 3.5 4098 2832 C 23 SER H C 23 SER HBx 1.0 1.8 3.5 4099 2832 C 23 SER H C 23 SER HBy 1.0 1.8 3.5 4100 2833 C 24 LYS H C 23 SER HBx 1.0 1.8 4.5 4101 2833 C 24 LYS H C 23 SER HBy 1.0 1.8 4.5 4102 2834 C 23 SER HBx C 24 LYS HBx 1.0 1.8 4.5 4103 2834 C 23 SER HBy C 24 LYS HBx 1.0 1.8 4.5 4104 2834 C 24 LYS HBy C 23 SER HBx 1.0 1.8 4.5 4105 2834 C 23 SER HBy C 24 LYS HBy 1.0 1.8 4.5 4106 2835 C 24 LYS H C 24 LYS HA 1.0 1.8 4.5 4107 2836 C 24 LYS H C 24 LYS HA 1.0 1.8 3.5 4108 2837 C 25 LYS H C 24 LYS HA 1.0 1.8 5.5 4109 2838 C 24 LYS H C 24 LYS HBx 1.0 1.8 3.5 4110 2838 C 24 LYS H C 24 LYS HBy 1.0 1.8 3.5 4111 2839 C 25 LYS H C 24 LYS HBx 1.0 1.8 3.5 4112 2839 C 25 LYS H C 24 LYS HBy 1.0 1.8 3.5 4113 2840 C 24 LYS H C 24 LYS HDx 1.0 1.8 5.5 4114 2840 C 24 LYS H C 24 LYS HDy 1.0 1.8 5.5 4115 2841 C 25 LYS H C 24 LYS HDx 1.0 1.8 3.5 4116 2841 C 25 LYS H C 24 LYS HDy 1.0 1.8 3.5 4117 2842 C 24 LYS H C 24 LYS HGx 1.0 1.8 5.5 4118 2842 C 24 LYS H C 24 LYS HGy 1.0 1.8 5.5 4119 2843 C 25 LYS H C 24 LYS HGx 1.0 1.8 5.5 4120 2843 C 25 LYS H C 24 LYS HGy 1.0 1.8 5.5 4121 2844 C 27 VAL HB C 24 LYS HGx 1.0 1.8 5.5 4122 2844 C 24 LYS HGy C 27 VAL HB 1.0 1.8 5.5 4123 2845 C 25 LYS H C 24 LYS HA 1.0 1.8 5.5 4124 2846 C 25 LYS H C 25 LYS HA 1.0 1.8 3.5 4125 2847 C 26 ALA H C 25 LYS HA 1.0 1.8 5.5 4126 2848 C 25 LYS HA C 28 GLU H 1.0 1.8 4.5 4127 2849 C 25 LYS HA C 29 ALA H 1.0 1.8 5.5 4128 2850 C 25 LYS H C 25 LYS HBx 1.0 1.8 3.5 4129 2850 C 25 LYS H C 25 LYS HBy 1.0 1.8 3.5 4130 2851 C 26 ALA H C 25 LYS HBx 1.0 1.8 4.5 4131 2851 C 26 ALA H C 25 LYS HBy 1.0 1.8 4.5 4132 2852 C 25 LYS H C 25 LYS HDx 1.0 1.8 5.5 4133 2852 C 25 LYS H C 25 LYS HDy 1.0 1.8 5.5 4134 2853 C 24 LYS HDy C 25 LYS HEx 1.0 1.8 4.5 4135 2853 C 25 LYS HEy C 24 LYS HDx 1.0 1.8 4.5 4136 2853 C 24 LYS HDy C 25 LYS HEy 1.0 1.8 4.5 4137 2853 C 24 LYS HDx C 25 LYS HEx 1.0 1.8 4.5 4138 2854 C 25 LYS HDx C 25 LYS HEx 1.0 1.8 4.5 4139 2854 C 25 LYS HDy C 25 LYS HEx 1.0 1.8 4.5 4140 2854 C 25 LYS HEy C 25 LYS HDx 1.0 1.8 4.5 4141 2854 C 25 LYS HDy C 25 LYS HEy 1.0 1.8 4.5 4142 2855 C 25 LYS HEy C 25 LYS HGx 1.0 1.8 4.5 4143 2855 C 25 LYS HGy C 25 LYS HEx 1.0 1.8 4.5 4144 2855 C 25 LYS HEy C 25 LYS HGy 1.0 1.8 4.5 4145 2855 C 25 LYS HEx C 25 LYS HGx 1.0 1.8 4.5 4146 2856 C 25 LYS H C 25 LYS HGx 1.0 1.8 3.5 4147 2856 C 25 LYS H C 25 LYS HGy 1.0 1.8 3.5 4148 2857 C 26 ALA H C 26 ALA HA 1.0 1.8 4.5 4149 2858 C 26 ALA HA C 27 VAL H 1.0 1.8 5.5 4150 2859 C 29 ALA H C 26 ALA HA 1.0 1.8 5.5 4151 2860 C 26 ALA H C 26 ALA HB1 1.0 1.8 3.5 4152 2861 C 26 ALA HB1 C 27 VAL H 1.0 1.8 3.5 4153 2862 C 24 LYS HA C 27 VAL H 1.0 1.8 5.5 4154 2863 C 26 ALA HA C 27 VAL H 1.0 1.8 5.5 4155 2864 C 26 ALA HB1 C 27 VAL H 1.0 1.8 4.5 4156 2865 C 27 VAL H C 27 VAL HA 1.0 1.8 4.5 4157 2866 C 28 GLU H C 27 VAL H 1.0 1.8 3.5 4158 2867 C 29 ALA H C 27 VAL H 1.0 1.8 5.5 4159 2868 C 27 VAL H C 27 VAL HA 1.0 1.8 3.5 4160 2869 C 27 VAL HB C 24 LYS HGx 1.0 1.8 5.5 4161 2869 C 24 LYS HGy C 27 VAL HB 1.0 1.8 5.5 4162 2870 C 27 VAL HB C 27 VAL H 1.0 1.8 3.5 4163 2871 C 27 VAL HB C 28 GLU H 1.0 1.8 3.5 4164 2872 C 26 ALA HB1 C 27 VAL HG11 1.0 1.8 4.5 4165 2872 C 26 ALA HB1 C 27 VAL HG21 1.0 1.8 4.5 4166 2873 C 27 VAL H C 27 VAL HG11 1.0 1.8 3.5 4167 2873 C 27 VAL H C 27 VAL HG21 1.0 1.8 3.5 4168 2874 C 25 LYS HA C 28 GLU H 1.0 1.8 4.5 4169 2875 C 28 GLU H C 27 VAL HA 1.0 1.8 4.5 4170 2876 C 28 GLU H C 28 GLU HA 1.0 1.8 3.5 4171 2877 C 29 ALA H C 28 GLU HA 1.0 1.8 5.5 4172 2878 C 24 LYS HEy C 28 GLU HBx 1.0 1.8 5.5 4173 2878 C 24 LYS HEx C 28 GLU HBx 1.0 1.8 5.5 4174 2878 C 28 GLU HBy C 24 LYS HEx 1.0 1.8 5.5 4175 2878 C 28 GLU HBy C 24 LYS HEy 1.0 1.8 5.5 4176 2879 C 24 LYS HGx C 28 GLU HBx 1.0 1.8 5.5 4177 2879 C 24 LYS HGy C 28 GLU HBx 1.0 1.8 5.5 4178 2879 C 28 GLU HBy C 24 LYS HGx 1.0 1.8 5.5 4179 2879 C 24 LYS HGy C 28 GLU HBy 1.0 1.8 5.5 4180 2880 C 25 LYS HGy C 28 GLU HBx 1.0 1.8 5.5 4181 2880 C 25 LYS HGx C 28 GLU HBx 1.0 1.8 5.5 4182 2880 C 28 GLU HBy C 25 LYS HGx 1.0 1.8 5.5 4183 2880 C 25 LYS HGy C 28 GLU HBy 1.0 1.8 5.5 4184 2881 C 28 GLU H C 28 GLU HBx 1.0 1.8 3.5 4185 2881 C 28 GLU H C 28 GLU HBy 1.0 1.8 3.5 4186 2882 C 28 GLU HBx C 28 GLU HGx 1.0 1.8 3.5 4187 2882 C 28 GLU HBy C 28 GLU HGx 1.0 1.8 3.5 4188 2882 C 28 GLU HGy C 28 GLU HBx 1.0 1.8 3.5 4189 2882 C 28 GLU HBy C 28 GLU HGy 1.0 1.8 3.5 4190 2883 C 29 ALA H C 28 GLU HBx 1.0 1.8 3.5 4191 2883 C 29 ALA H C 28 GLU HBy 1.0 1.8 3.5 4192 2884 C 29 ALA HA C 28 GLU HBx 1.0 1.8 5.5 4193 2884 C 28 GLU HBy C 29 ALA HA 1.0 1.8 5.5 4194 2885 C 29 ALA H C 28 GLU HGx 1.0 1.8 5.5 4195 2885 C 29 ALA H C 28 GLU HGy 1.0 1.8 5.5 4196 2886 C 29 ALA H C 27 VAL HA 1.0 1.8 5.5 4197 2887 C 29 ALA H C 29 ALA HA 1.0 1.8 4.5 4198 2888 C 29 ALA H C 29 ALA HA 1.0 1.8 4.5 4199 2889 C 29 ALA HA C 30 GLU H 1.0 1.8 5.5 4200 2890 C 29 ALA H C 29 ALA HB1 1.0 1.8 3.5 4201 2891 C 30 GLU HA C 31 ARG H 1.0 1.8 5.5 4202 2892 C 30 GLU HA C 33 ALA HB1 1.0 1.8 4.5 4203 2893 C 30 GLU H C 30 GLU HBx 1.0 1.8 3.5 4204 2893 C 30 GLU H C 30 GLU HBy 1.0 1.8 3.5 4205 2894 C 30 GLU HBx C 30 GLU HGx 1.0 1.8 3.5 4206 2894 C 30 GLU HBy C 30 GLU HGx 1.0 1.8 3.5 4207 2894 C 30 GLU HGy C 30 GLU HBx 1.0 1.8 3.5 4208 2894 C 30 GLU HBy C 30 GLU HGy 1.0 1.8 3.5 4209 2895 C 31 ARG H C 30 GLU HGx 1.0 1.8 5.5 4210 2895 C 31 ARG H C 30 GLU HGy 1.0 1.8 5.5 4211 2896 C 30 GLU HA C 31 ARG H 1.0 1.8 5.5 4212 2897 C 31 ARG H C 31 ARG HE 1.0 1.8 6.5 4213 2898 C 31 ARG H C 31 ARG HA 1.0 1.8 4.5 4214 2899 C 31 ARG HA C 31 ARG HBx 1.0 1.8 4.5 4215 2899 C 31 ARG HA C 31 ARG HBy 1.0 1.8 4.5 4216 2900 C 31 ARG HA C 32 GLY H 1.0 1.8 3.5 4217 2901 C 31 ARG HE C 31 ARG HDx 1.0 1.8 3.5 4218 2901 C 31 ARG HE C 31 ARG HDy 1.0 1.8 3.5 4219 2902 C 31 ARG H C 31 ARG HBx 1.0 1.8 3.5 4220 2902 C 31 ARG H C 31 ARG HBy 1.0 1.8 3.5 4221 2903 C 31 ARG HE C 31 ARG HBx 1.0 1.8 5.5 4222 2903 C 31 ARG HE C 31 ARG HBy 1.0 1.8 5.5 4223 2904 C 31 ARG HBy C 31 ARG HGx 1.0 1.8 3.5 4224 2904 C 31 ARG HBx C 31 ARG HGx 1.0 1.8 3.5 4225 2904 C 31 ARG HGy C 31 ARG HBx 1.0 1.8 3.5 4226 2904 C 31 ARG HBy C 31 ARG HGy 1.0 1.8 3.5 4227 2905 C 31 ARG H C 31 ARG HDx 1.0 1.8 5.5 4228 2905 C 31 ARG H C 31 ARG HDy 1.0 1.8 5.5 4229 2906 C 31 ARG HE C 31 ARG HDx 1.0 1.8 3.5 4230 2906 C 31 ARG HE C 31 ARG HDy 1.0 1.8 3.5 4231 2907 C 32 GLY H C 31 ARG HDx 1.0 1.8 4.5 4232 2907 C 32 GLY H C 31 ARG HDy 1.0 1.8 4.5 4233 2908 C 31 ARG H C 31 ARG HGx 1.0 1.8 3.5 4234 2908 C 31 ARG H C 31 ARG HGy 1.0 1.8 3.5 4235 2909 C 31 ARG HE C 31 ARG HGx 1.0 1.8 3.5 4236 2909 C 31 ARG HE C 31 ARG HGy 1.0 1.8 3.5 4237 2910 C 32 GLY H C 31 ARG HGx 1.0 1.8 5.5 4238 2910 C 32 GLY H C 31 ARG HGy 1.0 1.8 5.5 4239 2911 C 31 ARG HE C 31 ARG HH1% 1.0 1.8 4.5 4240 2912 C 31 ARG HE C 31 ARG HH2% 1.0 1.8 4.5 4241 2913 C 32 GLY H C 31 ARG HDx 1.0 1.8 5.5 4242 2913 C 32 GLY H C 31 ARG HDy 1.0 1.8 5.5 4243 2914 C 32 GLY H C 32 GLY HAx 1.0 1.8 4.5 4244 2914 C 32 GLY H C 32 GLY HAy 1.0 1.8 4.5 4245 2915 C 31 ARG HBy C 32 GLY HAx 1.0 1.8 4.5 4246 2915 C 31 ARG HBx C 32 GLY HAx 1.0 1.8 4.5 4247 2915 C 32 GLY HAy C 31 ARG HBx 1.0 1.8 4.5 4248 2915 C 31 ARG HBy C 32 GLY HAy 1.0 1.8 4.5 4249 2916 C 32 GLY H C 32 GLY HAx 1.0 1.8 3.5 4250 2916 C 32 GLY H C 32 GLY HAy 1.0 1.8 3.5 4251 2917 C 33 ALA H C 32 GLY HAx 1.0 1.8 3.5 4252 2917 C 32 GLY HAy C 33 ALA H 1.0 1.8 3.5 4253 2918 C 33 ALA H C 32 GLY HAx 1.0 1.8 4.5 4254 2918 C 32 GLY HAy C 33 ALA H 1.0 1.8 4.5 4255 2919 C 33 ALA H C 33 ALA HA 1.0 1.8 4.5 4256 2920 C 33 ALA HB1 C 33 ALA HA 1.0 1.8 3.5 4257 2921 C 33 ALA HA C 34 PRO HDx 1.0 1.8 4.5 4258 2922 C 33 ALA HB1 C 33 ALA H 1.0 1.8 3.5 4259 2923 C 33 ALA HB1 C 36 ALA HA 1.0 1.8 5.5 4260 2924 C 34 PRO HDx C 34 PRO HA 1.0 1.8 5.5 4261 2925 C 33 ALA HB1 C 34 PRO HDx 1.0 1.8 3.5 4262 2926 C 33 ALA HB1 C 34 PRO HDy 1.0 1.8 5.5 4263 2927 C 35 GLY H C 34 PRO HBx 1.0 1.8 4.5 4264 2927 C 34 PRO HBy C 35 GLY H 1.0 1.8 4.5 4265 2928 C 33 ALA HB1 C 34 PRO HGx 1.0 1.8 5.5 4266 2928 C 33 ALA HB1 C 34 PRO HGy 1.0 1.8 5.5 4267 2929 C 34 PRO HBx C 34 PRO HGx 1.0 1.8 3.5 4268 2929 C 34 PRO HBy C 34 PRO HGx 1.0 1.8 3.5 4269 2929 C 34 PRO HGy C 34 PRO HBx 1.0 1.8 3.5 4270 2929 C 34 PRO HBy C 34 PRO HGy 1.0 1.8 3.5 4271 2930 C 34 PRO HA C 35 GLY H 1.0 1.8 5.5 4272 2931 C 35 GLY H C 36 ALA H 1.0 1.8 5.5 4273 2932 C 35 GLY H C 35 GLY HAx 1.0 1.8 3.5 4274 2932 C 35 GLY H C 35 GLY HAy 1.0 1.8 3.5 4275 2933 C 36 ALA H C 35 GLY HAx 1.0 1.8 3.5 4276 2933 C 36 ALA H C 35 GLY HAy 1.0 1.8 3.5 4277 2934 C 36 ALA H C 35 GLY HAx 1.0 1.8 4.5 4278 2934 C 36 ALA H C 35 GLY HAy 1.0 1.8 4.5 4279 2935 C 33 ALA HB1 C 36 ALA HA 1.0 1.8 5.5 4280 2936 C 36 ALA HA C 36 ALA H 1.0 1.8 4.5 4281 2937 C 36 ALA H C 36 ALA HB1 1.0 1.8 3.5 4282 2938 C 36 ALA HB1 C 37 ALA H 1.0 1.8 4.5 4283 2939 C 36 ALA HA C 37 ALA H 1.0 1.8 4.5 4284 2940 C 37 ALA H C 37 ALA HA 1.0 1.8 4.5 4285 2941 C 36 ALA HA C 37 ALA HB1 1.0 1.8 5.5 4286 2942 C 37 ALA H C 37 ALA HB1 1.0 1.8 4.5 4287 2943 C 38 LEU HA C 38 LEU H 1.0 1.8 4.5 4288 2944 C 38 LEU HA C 38 LEU HBx 1.0 1.8 4.5 4289 2944 C 38 LEU HA C 38 LEU HBy 1.0 1.8 4.5 4290 2945 C 38 LEU H C 38 LEU HG 1.0 1.8 5.5 4291 2946 C 38 LEU H C 38 LEU HBx 1.0 1.8 3.5 4292 2946 C 38 LEU H C 38 LEU HBy 1.0 1.8 3.5 4293 2947 C 38 LEU H C 38 LEU HD11 1.0 1.8 5.5 4294 2947 C 38 LEU H C 38 LEU HD21 1.0 1.8 5.5 4295 2948 C 39 ILE H C 38 LEU HD11 1.0 1.8 5.5 4296 2948 C 38 LEU HD21 C 39 ILE H 1.0 1.8 5.5 4297 2949 C 39 ILE H C 39 ILE HA 1.0 1.8 3.5 4298 2950 C 39 ILE HB C 39 ILE HG1x 1.0 1.8 4.5 4299 2950 C 39 ILE HB C 39 ILE HG1y 1.0 1.8 4.5 4300 2951 C 39 ILE HB C 39 ILE HG21 1.0 1.8 4.5 4301 2952 C 39 ILE HB C 40 SER H 1.0 1.8 5.5 4302 2953 C 39 ILE HD11 C 39 ILE HG1x 1.0 1.8 4.5 4303 2953 C 39 ILE HG1y C 39 ILE HD11 1.0 1.8 4.5 4304 2954 C 39 ILE HG21 C 39 ILE HD11 1.0 1.8 4.5 4305 2955 C 36 ALA HB1 C 39 ILE HG1x 1.0 1.8 5.5 4306 2955 C 36 ALA HB1 C 39 ILE HG1y 1.0 1.8 5.5 4307 2956 C 39 ILE H C 39 ILE HG1x 1.0 1.8 4.5 4308 2956 C 39 ILE H C 39 ILE HG1y 1.0 1.8 4.5 4309 2957 C 39 ILE HB C 39 ILE HG1x 1.0 1.8 4.5 4310 2957 C 39 ILE HB C 39 ILE HG1y 1.0 1.8 4.5 4311 2958 C 39 ILE H C 39 ILE HG21 1.0 1.8 4.5 4312 2959 C 39 ILE HB C 39 ILE HG21 1.0 1.8 4.5 4313 2960 C 39 ILE HG21 C 40 SER H 1.0 1.8 5.5 4314 2961 C 40 SER H C 40 SER HA 1.0 1.8 4.5 4315 2962 C 40 SER HA C 39 ILE HG1x 1.0 1.8 5.5 4316 2962 C 39 ILE HG1y C 40 SER HA 1.0 1.8 5.5 4317 2963 C 40 SER H C 40 SER HA 1.0 1.8 4.5 4318 2964 C 40 SER HA C 41 TYR H 1.0 1.8 4.5 4319 2965 C 42 PRO HDy C 40 SER HBx 1.0 1.8 5.5 4320 2965 C 40 SER HBy C 42 PRO HDy 1.0 1.8 5.5 4321 2966 C 40 SER HA C 41 TYR H 1.0 1.8 4.5 4322 2967 C 41 TYR H C 41 TYR HA 1.0 1.8 4.5 4323 2968 C 41 TYR HBx C 41 TYR HBy 1.0 1.8 4.5 4324 2969 C 42 PRO HA C 43 ASP H 1.0 1.8 5.5 4325 2970 C 42 PRO HDy C 42 PRO HDx 1.0 1.8 3.5 4326 2971 C 43 ASP H C 42 PRO HDx 1.0 1.8 5.5 4327 2972 C 42 PRO HDy C 42 PRO HDx 1.0 1.8 3.5 4328 2973 C 42 PRO HDy C 43 ASP H 1.0 1.8 4.5 4329 2974 C 42 PRO HBx C 42 PRO HGx 1.0 1.8 4.5 4330 2974 C 42 PRO HBy C 42 PRO HGx 1.0 1.8 4.5 4331 2974 C 42 PRO HGy C 42 PRO HBx 1.0 1.8 4.5 4332 2974 C 42 PRO HBy C 42 PRO HGy 1.0 1.8 4.5 4333 2975 C 43 ASP H C 42 PRO HBx 1.0 1.8 5.5 4334 2975 C 43 ASP H C 42 PRO HBy 1.0 1.8 5.5 4335 2976 C 43 ASP H C 43 ASP HA 1.0 1.8 3.5 4336 2977 C 43 ASP HA C 44 ALA H 1.0 1.8 4.5 4337 2978 C 43 ASP HA C 45 ILE H 1.0 1.8 5.5 4338 2979 C 43 ASP HA C 45 ILE HG21 1.0 1.8 5.5 4339 2980 C 43 ASP H C 43 ASP HBx 1.0 1.8 5.5 4340 2981 C 43 ASP HBx C 43 ASP HBy 1.0 1.8 4.5 4341 2982 C 44 ALA H C 43 ASP HBx 1.0 1.8 5.5 4342 2983 C 44 ALA H C 43 ASP HBy 1.0 1.8 5.5 4343 2984 C 43 ASP H C 44 ALA H 1.0 1.8 4.5 4344 2985 C 44 ALA H C 45 ILE H 1.0 1.8 4.5 4345 2986 C 44 ALA H C 44 ALA HA 1.0 1.8 4.5 4346 2987 C 45 ILE H C 44 ALA HA 1.0 1.8 5.5 4347 2988 C 44 ALA H C 44 ALA HB1 1.0 1.8 3.5 4348 2989 C 45 ILE H C 44 ALA HB1 1.0 1.8 4.5 4349 2990 C 44 ALA HB1 C 46 TRP H 1.0 1.8 5.5 4350 2991 C 44 ALA H C 45 ILE H 1.0 1.8 3.5 4351 2992 C 45 ILE H C 46 TRP H 1.0 1.8 4.5 4352 2993 C 45 ILE H C 45 ILE HA 1.0 1.8 4.5 4353 2994 C 46 TRP H C 45 ILE HA 1.0 1.8 5.5 4354 2995 C 45 ILE H C 45 ILE HB 1.0 1.8 3.5 4355 2996 C 46 TRP H C 45 ILE HB 1.0 1.8 5.5 4356 2997 C 45 ILE H C 45 ILE HD11 1.0 1.8 5.5 4357 2998 C 45 ILE HD11 C 45 ILE HG1x 1.0 1.8 5.5 4358 2998 C 45 ILE HD11 C 45 ILE HG1y 1.0 1.8 5.5 4359 2999 C 45 ILE HG21 C 45 ILE HD11 1.0 1.8 4.5 4360 3000 C 46 TRP H C 45 ILE HD11 1.0 1.8 5.5 4361 3001 C 45 ILE HD11 C 49 VAL HG21 1.0 1.8 4.5 4362 3002 C 45 ILE H C 45 ILE HG1x 1.0 1.8 5.5 4363 3002 C 45 ILE H C 45 ILE HG1y 1.0 1.8 5.5 4364 3003 C 46 TRP H C 45 ILE HG1x 1.0 1.8 5.5 4365 3003 C 46 TRP H C 45 ILE HG1y 1.0 1.8 5.5 4366 3004 C 45 ILE H C 45 ILE HG21 1.0 1.8 4.5 4367 3005 C 45 ILE HG21 C 45 ILE HG1x 1.0 1.8 4.5 4368 3005 C 45 ILE HG21 C 45 ILE HG1y 1.0 1.8 4.5 4369 3006 C 45 ILE H C 46 TRP H 1.0 1.8 4.5 4370 3007 C 46 TRP H C 47 TRP H 1.0 1.8 4.5 4371 3008 C 46 TRP H C 46 TRP HA 1.0 1.8 4.5 4372 3009 C 47 TRP H C 46 TRP HA 1.0 1.8 5.5 4373 3010 C 46 TRP HD1 C 46 TRP HE1 1.0 1.8 3.5 4374 3011 C 46 TRP HE1 C 46 TRP HZ2 1.0 1.8 4.5 4375 3012 C 46 TRP H C 46 TRP HBx 1.0 1.8 4.5 4376 3012 C 46 TRP H C 46 TRP HBy 1.0 1.8 4.5 4377 3013 C 46 TRP HE1 C 46 TRP HBx 1.0 1.8 5.5 4378 3013 C 46 TRP HE1 C 46 TRP HBy 1.0 1.8 5.5 4379 3014 C 47 TRP H C 46 TRP HBx 1.0 1.8 4.5 4380 3014 C 47 TRP H C 46 TRP HBy 1.0 1.8 4.5 4381 3015 C 47 TRP H C 48 SER H 1.0 1.8 4.5 4382 3016 C 47 TRP H C 47 TRP HA 1.0 1.8 4.5 4383 3017 C 48 SER H C 47 TRP HA 1.0 1.8 4.5 4384 3018 C 47 TRP HA C 50 GLU H 1.0 1.8 5.5 4385 3019 C 48 SER H C 47 TRP HBx 1.0 1.8 5.5 4386 3020 C 47 TRP H C 47 TRP HBy 1.0 1.8 4.5 4387 3021 C 47 TRP HD1 C 47 TRP HE1 1.0 1.8 3.5 4388 3022 C 47 TRP H C 47 TRP HE3 1.0 1.8 4.5 4389 3023 C 47 TRP HE1 C 47 TRP HZ2 1.0 1.8 4.5 4390 3024 C 46 TRP H C 48 SER H 1.0 1.8 5.5 4391 3025 C 48 SER H C 48 SER HA 1.0 1.8 4.5 4392 3026 C 48 SER HA C 49 VAL H 1.0 1.8 4.5 4393 3027 C 48 SER HA C 51 THR H 1.0 1.8 5.5 4394 3028 C 48 SER H C 48 SER HBx 1.0 1.8 4.5 4395 3028 C 48 SER H C 48 SER HBy 1.0 1.8 4.5 4396 3029 C 49 VAL H C 48 SER HBx 1.0 1.8 4.5 4397 3029 C 49 VAL H C 48 SER HBy 1.0 1.8 4.5 4398 3030 C 52 ALA HB1 C 48 SER HBx 1.0 1.8 5.5 4399 3030 C 48 SER HBy C 52 ALA HB1 1.0 1.8 5.5 4400 3031 C 49 VAL H C 49 VAL HA 1.0 1.8 4.5 4401 3032 C 51 THR H C 49 VAL HA 1.0 1.8 5.5 4402 3033 C 49 VAL H C 49 VAL HB 1.0 1.8 3.5 4403 3034 C 49 VAL HB C 50 GLU HGx 1.0 1.8 5.5 4404 3034 C 49 VAL HB C 50 GLU HGy 1.0 1.8 5.5 4405 3035 C 49 VAL H C 49 VAL HG11 1.0 1.8 5.5 4406 3036 C 50 GLU H C 49 VAL HG11 1.0 1.8 4.5 4407 3037 C 45 ILE HG21 C 49 VAL HG21 1.0 1.8 5.5 4408 3038 C 49 VAL H C 49 VAL HG21 1.0 1.8 3.5 4409 3039 C 50 GLU H C 49 VAL HG21 1.0 1.8 5.5 4410 3040 C 53 THR HG21 C 49 VAL HG21 1.0 1.8 5.5 4411 3041 C 50 GLU H C 50 GLU HA 1.0 1.8 4.5 4412 3042 C 50 GLU H C 50 GLU HBx 1.0 1.8 3.5 4413 3042 C 50 GLU H C 50 GLU HBy 1.0 1.8 3.5 4414 3043 C 51 THR H C 50 GLU HBx 1.0 1.8 5.5 4415 3043 C 51 THR H C 50 GLU HBy 1.0 1.8 5.5 4416 3044 C 49 VAL H C 50 GLU HGx 1.0 1.8 5.5 4417 3044 C 49 VAL H C 50 GLU HGy 1.0 1.8 5.5 4418 3045 C 50 GLU H C 50 GLU HGx 1.0 1.8 4.5 4419 3045 C 50 GLU H C 50 GLU HGy 1.0 1.8 4.5 4420 3046 C 51 THR H C 50 GLU HGx 1.0 1.8 4.5 4421 3046 C 51 THR H C 50 GLU HGy 1.0 1.8 4.5 4422 3047 C 51 THR H C 50 GLU HA 1.0 1.8 4.5 4423 3048 C 51 THR H C 50 GLU HBx 1.0 1.8 5.5 4424 3048 C 51 THR H C 50 GLU HBy 1.0 1.8 5.5 4425 3049 C 51 THR H C 51 THR HA 1.0 1.8 3.5 4426 3050 C 51 THR HA C 53 THR H 1.0 1.8 5.5 4427 3051 C 51 THR H C 51 THR HB 1.0 1.8 4.5 4428 3052 C 52 ALA HB1 C 51 THR HB 1.0 1.8 5.5 4429 3053 C 51 THR H C 51 THR HG21 1.0 1.8 5.5 4430 3054 C 51 THR HG21 C 52 ALA H 1.0 1.8 4.5 4431 3055 C 52 ALA HB1 C 51 THR HG21 1.0 1.8 4.5 4432 3056 C 51 THR H C 52 ALA H 1.0 1.8 4.5 4433 3057 C 52 ALA HB1 C 52 ALA H 1.0 1.8 4.5 4434 3058 C 52 ALA H C 52 ALA HA 1.0 1.8 3.5 4435 3059 C 53 THR H C 52 ALA HA 1.0 1.8 5.5 4436 3060 C 52 ALA HB1 C 52 ALA H 1.0 1.8 3.5 4437 3061 C 52 ALA HB1 C 53 THR H 1.0 1.8 4.5 4438 3062 C 52 ALA HB1 C 54 THR H 1.0 1.8 5.5 4439 3063 C 53 THR H C 52 ALA HA 1.0 1.8 5.5 4440 3064 C 52 ALA HB1 C 53 THR H 1.0 1.8 4.5 4441 3065 C 52 ALA HB1 C 53 THR HA 1.0 1.8 5.5 4442 3066 C 53 THR H C 53 THR HA 1.0 1.8 3.5 4443 3067 C 53 THR H C 53 THR HB 1.0 1.8 5.5 4444 3068 C 54 THR H C 53 THR HB 1.0 1.8 5.5 4445 3069 C 53 THR HG21 C 53 THR H 1.0 1.8 3.5 4446 3070 C 53 THR HG21 C 54 THR H 1.0 1.8 5.5 4447 3071 C 53 THR HG21 C 55 VAL H 1.0 1.8 5.5 4448 3072 C 52 ALA HA C 54 THR H 1.0 1.8 4.5 4449 3073 C 52 ALA HB1 C 54 THR H 1.0 1.8 5.5 4450 3074 C 54 THR H C 54 THR HA 1.0 1.8 3.5 4451 3075 C 54 THR HB C 54 THR H 1.0 1.8 5.5 4452 3076 C 54 THR H C 54 THR HG21 1.0 1.8 3.5 4453 3077 C 55 VAL H C 54 THR HG21 1.0 1.8 5.5 4454 3078 C 55 VAL H C 55 VAL HA 1.0 1.8 4.5 4455 3079 C 55 VAL H C 56 GLY H 1.0 1.8 3.5 4456 3080 C 55 VAL H C 55 VAL HA 1.0 1.8 3.5 4457 3081 C 55 VAL HA C 56 GLY H 1.0 1.8 5.5 4458 3082 C 55 VAL H C 55 VAL HB 1.0 1.8 3.5 4459 3083 C 56 GLY H C 55 VAL HB 1.0 1.8 4.5 4460 3084 C 53 THR HG21 C 55 VAL HG11 1.0 1.8 4.5 4461 3084 C 53 THR HG21 C 55 VAL HG21 1.0 1.8 4.5 4462 3085 C 55 VAL H C 55 VAL HG11 1.0 1.8 3.5 4463 3085 C 55 VAL H C 55 VAL HG21 1.0 1.8 3.5 4464 3086 C 56 GLY H C 55 VAL HG11 1.0 1.8 4.5 4465 3086 C 56 GLY H C 55 VAL HG21 1.0 1.8 4.5 4466 3087 C 56 GLY HAx C 55 VAL HG11 1.0 1.8 5.5 4467 3087 C 55 VAL HG21 C 56 GLY HAx 1.0 1.8 5.5 4468 3088 C 57 TYR H C 55 VAL HG11 1.0 1.8 4.5 4469 3088 C 55 VAL HG21 C 57 TYR H 1.0 1.8 4.5 4470 3089 C 56 GLY H C 56 GLY HAx 1.0 1.8 4.5 4471 3090 C 56 GLY H C 57 TYR H 1.0 1.8 4.5 4472 3091 C 56 GLY HAy C 56 GLY H 1.0 1.8 4.5 4473 3092 C 56 GLY H C 57 TYR H 1.0 1.8 4.5 4474 3093 C 57 TYR H C 57 TYR HA 1.0 1.8 5.5 4475 3094 C 58 GLY H C 57 TYR H 1.0 1.8 4.5 4476 3095 C 57 TYR H C 57 TYR HA 1.0 1.8 3.5 4477 3096 C 57 TYR HA C 57 TYR HBy 1.0 1.8 4.5 4478 3097 C 58 GLY H C 57 TYR HA 1.0 1.8 5.5 4479 3098 C 57 TYR HA C 57 TYR HBx 1.0 1.8 4.5 4480 3099 C 57 TYR HBy C 57 TYR HBx 1.0 1.8 3.5 4481 3100 C 58 GLY H C 57 TYR HD% 1.0 1.8 5.5 4482 3101 C 58 GLY H C 56 GLY HAx 1.0 1.8 5.5 4483 3102 C 58 GLY H C 57 TYR HA 1.0 1.8 5.5 4484 3103 C 58 GLY H C 58 GLY HAx 1.0 1.8 3.5 4485 3103 C 58 GLY H C 58 GLY HAy 1.0 1.8 3.5 4486 3104 C 58 GLY H C 59 ASP H 1.0 1.8 3.5 4487 3105 C 59 ASP H C 59 ASP HBx 1.0 1.8 4.5 4488 3105 C 59 ASP H C 59 ASP HBy 1.0 1.8 4.5 4489 3106 C 59 ASP H C 59 ASP HA 1.0 1.8 3.5 4490 3107 C 59 ASP HA C 59 ASP HBx 1.0 1.8 4.5 4491 3107 C 59 ASP HBy C 59 ASP HA 1.0 1.8 4.5 4492 3108 C 60 ARG H C 59 ASP HA 1.0 1.8 5.5 4493 3109 C 59 ASP H C 59 ASP HBx 1.0 1.8 3.5 4494 3109 C 59 ASP H C 59 ASP HBy 1.0 1.8 3.5 4495 3110 C 60 ARG H C 59 ASP HBx 1.0 1.8 4.5 4496 3110 C 60 ARG H C 59 ASP HBy 1.0 1.8 4.5 4497 3111 C 60 ARG H C 60 ARG HA 1.0 1.8 3.5 4498 3112 C 60 ARG HA C 61 TYR HBx 1.0 1.8 5.5 4499 3112 C 61 TYR HBy C 60 ARG HA 1.0 1.8 5.5 4500 3113 C 60 ARG H C 60 ARG HBx 1.0 1.8 4.5 4501 3113 C 60 ARG H C 60 ARG HBy 1.0 1.8 4.5 4502 3114 C 61 TYR H C 60 ARG HGx 1.0 1.8 5.5 4503 3114 C 60 ARG HGy C 61 TYR H 1.0 1.8 5.5 4504 3115 C 60 ARG HH1% C 60 ARG HE 1.0 1.8 5.5 4505 3116 C 60 ARG HE C 60 ARG HH2% 1.0 1.8 5.5 4506 3117 C 61 TYR HA C 62 PRO HDx 1.0 1.8 4.5 4507 3117 C 61 TYR HA C 62 PRO HDy 1.0 1.8 4.5 4508 3118 C 61 TYR HA C 61 TYR HBx 1.0 1.8 4.5 4509 3118 C 61 TYR HA C 61 TYR HBy 1.0 1.8 4.5 4510 3119 C 62 PRO HA C 63 VAL H 1.0 1.8 3.5 4511 3120 C 61 TYR HBx C 62 PRO HDx 1.0 1.8 5.5 4512 3120 C 61 TYR HBy C 62 PRO HDx 1.0 1.8 5.5 4513 3120 C 62 PRO HDy C 61 TYR HBx 1.0 1.8 5.5 4514 3120 C 61 TYR HBy C 62 PRO HDy 1.0 1.8 5.5 4515 3121 C 62 PRO HA C 62 PRO HDx 1.0 1.8 4.5 4516 3121 C 62 PRO HDy C 62 PRO HA 1.0 1.8 4.5 4517 3122 C 63 VAL H C 63 VAL HA 1.0 1.8 4.5 4518 3123 C 63 VAL H C 63 VAL HB 1.0 1.8 5.5 4519 3124 C 63 VAL HB C 64 THR H 1.0 1.8 5.5 4520 3125 C 63 VAL HG11 C 63 VAL H 1.0 1.8 4.5 4521 3126 C 63 VAL HG11 C 64 THR H 1.0 1.8 5.5 4522 3127 C 64 THR HG21 C 63 VAL HG11 1.0 1.8 5.5 4523 3128 C 64 THR HA C 64 THR H 1.0 1.8 4.5 4524 3129 C 64 THR HA C 66 GLU H 1.0 1.8 5.5 4525 3130 C 64 THR HB C 64 THR H 1.0 1.8 5.5 4526 3131 C 64 THR HB C 65 GLU H 1.0 1.8 4.5 4527 3132 C 64 THR HG21 C 64 THR H 1.0 1.8 4.5 4528 3133 C 64 THR HG21 C 65 GLU H 1.0 1.8 5.5 4529 3134 C 64 THR HG21 C 67 GLY H 1.0 1.8 6.5 4530 3135 C 65 GLU H C 65 GLU HA 1.0 1.8 3.5 4531 3136 C 66 GLU H C 65 GLU HA 1.0 1.8 5.5 4532 3137 C 65 GLU H C 65 GLU HBx 1.0 1.8 4.5 4533 3138 C 66 GLU H C 65 GLU HBx 1.0 1.8 5.5 4534 3139 C 65 GLU H C 65 GLU HBy 1.0 1.8 4.5 4535 3140 C 65 GLU H C 65 GLU HGx 1.0 1.8 5.5 4536 3140 C 65 GLU H C 65 GLU HGy 1.0 1.8 5.5 4537 3141 C 67 GLY H C 66 GLU HA 1.0 1.8 5.5 4538 3142 C 66 GLU H C 66 GLU HBx 1.0 1.8 4.5 4539 3142 C 66 GLU H C 66 GLU HBy 1.0 1.8 4.5 4540 3143 C 66 GLU HBx C 66 GLU HGx 1.0 1.8 3.5 4541 3143 C 66 GLU HBy C 66 GLU HGx 1.0 1.8 3.5 4542 3143 C 66 GLU HGy C 66 GLU HBx 1.0 1.8 3.5 4543 3143 C 66 GLU HBy C 66 GLU HGy 1.0 1.8 3.5 4544 3144 C 67 GLY H C 66 GLU HBx 1.0 1.8 4.5 4545 3144 C 67 GLY H C 66 GLU HBy 1.0 1.8 4.5 4546 3145 C 67 GLY H C 66 GLU HGx 1.0 1.8 5.5 4547 3145 C 67 GLY H C 66 GLU HGy 1.0 1.8 5.5 4548 3146 C 67 GLY H C 67 GLY HAx 1.0 1.8 3.5 4549 3146 C 67 GLY H C 67 GLY HAy 1.0 1.8 3.5 4550 3147 C 67 GLY H C 68 ARG H 1.0 1.8 4.5 4551 3148 C 68 ARG HA C 68 ARG H 1.0 1.8 4.5 4552 3149 C 68 ARG HE C 68 ARG HDx 1.0 1.8 3.5 4553 3149 C 68 ARG HDy C 68 ARG HE 1.0 1.8 3.5 4554 3150 C 68 ARG HE C 68 ARG HDx 1.0 1.8 3.5 4555 3150 C 68 ARG HDy C 68 ARG HE 1.0 1.8 3.5 4556 3151 C 68 ARG HE C 68 ARG HH1% 1.0 1.8 4.5 4557 3152 C 68 ARG HE C 68 ARG HH2% 1.0 1.8 4.5 4558 3153 C 69 LYS H C 69 LYS HA 1.0 1.8 3.5 4559 3154 C 69 LYS HBy C 69 LYS HGx 1.0 1.8 5.5 4560 3154 C 69 LYS HBx C 69 LYS HGx 1.0 1.8 5.5 4561 3154 C 69 LYS HGy C 69 LYS HBx 1.0 1.8 5.5 4562 3154 C 69 LYS HBy C 69 LYS HGy 1.0 1.8 5.5 4563 3155 C 69 LYS HDx C 69 LYS HEx 1.0 1.8 5.5 4564 3155 C 69 LYS HDy C 69 LYS HEx 1.0 1.8 5.5 4565 3155 C 69 LYS HEy C 69 LYS HDx 1.0 1.8 5.5 4566 3155 C 69 LYS HEy C 69 LYS HDy 1.0 1.8 5.5 4567 3156 C 70 VAL H C 72 GLU H 1.0 1.8 5.5 4568 3157 C 70 VAL H C 70 VAL HA 1.0 1.8 3.5 4569 3158 C 70 VAL HB C 71 ALA HA 1.0 1.8 5.5 4570 3159 C 71 ALA HB1 C 70 VAL HB 1.0 1.8 5.5 4571 3160 C 71 ALA HA C 70 VAL HG11 1.0 1.8 4.5 4572 3161 C 70 VAL HG11 C 71 ALA H 1.0 1.8 4.5 4573 3162 C 71 ALA HA C 71 ALA H 1.0 1.8 4.5 4574 3163 C 71 ALA HB1 C 71 ALA H 1.0 1.8 4.5 4575 3164 C 71 ALA HA C 71 ALA H 1.0 1.8 4.5 4576 3165 C 72 GLU H C 71 ALA HA 1.0 1.8 5.5 4577 3166 C 71 ALA HB1 C 71 ALA H 1.0 1.8 3.5 4578 3167 C 72 GLU HA C 72 GLU H 1.0 1.8 4.5 4579 3168 C 72 GLU HA C 71 ALA HB1 1.0 1.8 5.5 4580 3169 C 72 GLU HA C 72 GLU H 1.0 1.8 4.5 4581 3170 C 72 GLU HA C 76 LYS H 1.0 1.8 5.5 4582 3171 C 71 ALA HB1 C 72 GLU HBx 1.0 1.8 5.5 4583 3171 C 71 ALA HB1 C 72 GLU HBy 1.0 1.8 5.5 4584 3172 C 72 GLU H C 72 GLU HBx 1.0 1.8 3.5 4585 3172 C 72 GLU H C 72 GLU HBy 1.0 1.8 3.5 4586 3173 C 72 GLU HBx C 72 GLU HGx 1.0 1.8 4.5 4587 3173 C 72 GLU HBy C 72 GLU HGx 1.0 1.8 4.5 4588 3173 C 72 GLU HGy C 72 GLU HBx 1.0 1.8 4.5 4589 3173 C 72 GLU HGy C 72 GLU HBy 1.0 1.8 4.5 4590 3174 C 72 GLU H C 72 GLU HGx 1.0 1.8 6.5 4591 3174 C 72 GLU HGy C 72 GLU H 1.0 1.8 6.5 4592 3175 C 71 ALA H C 73 GLN H 1.0 1.8 5.5 4593 3176 C 72 GLU HA C 73 GLN H 1.0 1.8 5.5 4594 3177 C 73 GLN H C 73 GLN HA 1.0 1.8 3.5 4595 3178 C 73 GLN HA C 77 ALA HB1 1.0 1.8 5.5 4596 3179 C 73 GLN HE2y C 73 GLN HE2x 1.0 1.8 3.5 4597 3180 C 73 GLN HE2x C 73 GLN HBx 1.0 1.8 4.5 4598 3180 C 73 GLN HBy C 73 GLN HE2x 1.0 1.8 4.5 4599 3181 C 73 GLN HE2y C 73 GLN HBx 1.0 1.8 4.5 4600 3181 C 73 GLN HBy C 73 GLN HE2y 1.0 1.8 4.5 4601 3182 C 73 GLN HE2x C 73 GLN HGx 1.0 1.8 4.5 4602 3182 C 73 GLN HE2x C 73 GLN HGy 1.0 1.8 4.5 4603 3183 C 73 GLN HBy C 73 GLN HGx 1.0 1.8 3.5 4604 3183 C 73 GLN HBx C 73 GLN HGx 1.0 1.8 3.5 4605 3183 C 73 GLN HGy C 73 GLN HBx 1.0 1.8 3.5 4606 3183 C 73 GLN HBy C 73 GLN HGy 1.0 1.8 3.5 4607 3184 C 74 VAL H C 73 GLN HGx 1.0 1.8 4.5 4608 3184 C 73 GLN HGy C 74 VAL H 1.0 1.8 4.5 4609 3185 C 72 GLU HA C 74 VAL H 1.0 1.8 5.5 4610 3186 C 74 VAL H C 74 VAL HA 1.0 1.8 4.5 4611 3187 C 74 VAL H C 74 VAL HA 1.0 1.8 4.5 4612 3188 C 71 ALA HB1 C 74 VAL HB 1.0 1.8 5.5 4613 3189 C 74 VAL H C 74 VAL HB 1.0 1.8 3.5 4614 3190 C 71 ALA HA C 74 VAL HG11 1.0 1.8 5.5 4615 3191 C 74 VAL H C 74 VAL HG11 1.0 1.8 5.5 4616 3192 C 74 VAL HG11 C 78 GLY H 1.0 1.8 5.5 4617 3193 C 71 ALA HA C 74 VAL HG21 1.0 1.8 4.5 4618 3194 C 77 ALA HB1 C 74 VAL HG21 1.0 1.8 5.5 4619 3195 C 71 ALA HB1 C 75 MET H 1.0 1.8 5.5 4620 3196 C 72 GLU HA C 75 MET H 1.0 1.8 5.5 4621 3197 C 75 MET HA C 79 ILE H 1.0 1.8 5.5 4622 3198 C 75 MET HE1 C 71 ALA HA 1.0 1.8 4.5 4623 3199 C 71 ALA HB1 C 75 MET HE1 1.0 1.8 3.5 4624 3200 C 75 MET HE1 C 72 GLU HGx 1.0 1.8 4.5 4625 3200 C 72 GLU HGy C 75 MET HE1 1.0 1.8 4.5 4626 3201 C 72 GLU HA C 76 LYS H 1.0 1.8 5.5 4627 3202 C 76 LYS H C 76 LYS HA 1.0 1.8 4.5 4628 3203 C 76 LYS H C 76 LYS HA 1.0 1.8 3.5 4629 3204 C 76 LYS HA C 77 ALA H 1.0 1.8 5.5 4630 3205 C 78 GLY H C 76 LYS HA 1.0 1.8 5.5 4631 3206 C 76 LYS H C 76 LYS HBx 1.0 1.8 4.5 4632 3206 C 76 LYS H C 76 LYS HBy 1.0 1.8 4.5 4633 3207 C 76 LYS HBy C 76 LYS HGx 1.0 1.8 5.5 4634 3207 C 76 LYS HBx C 76 LYS HGx 1.0 1.8 5.5 4635 3207 C 76 LYS HGy C 76 LYS HBx 1.0 1.8 5.5 4636 3207 C 76 LYS HGy C 76 LYS HBy 1.0 1.8 5.5 4637 3208 C 76 LYS HBy C 80 GLU HGx 1.0 1.8 5.5 4638 3208 C 76 LYS HBx C 80 GLU HGx 1.0 1.8 5.5 4639 3208 C 80 GLU HGy C 76 LYS HBx 1.0 1.8 5.5 4640 3208 C 76 LYS HBy C 80 GLU HGy 1.0 1.8 5.5 4641 3209 C 76 LYS H C 76 LYS HDx 1.0 1.8 5.5 4642 3209 C 76 LYS H C 76 LYS HDy 1.0 1.8 5.5 4643 3210 C 77 ALA HA C 76 LYS HDx 1.0 1.8 5.5 4644 3210 C 76 LYS HDy C 77 ALA HA 1.0 1.8 5.5 4645 3211 C 76 LYS HDy C 80 GLU HGx 1.0 1.8 5.5 4646 3211 C 76 LYS HDx C 80 GLU HGx 1.0 1.8 5.5 4647 3211 C 80 GLU HGy C 76 LYS HDx 1.0 1.8 5.5 4648 3211 C 80 GLU HGy C 76 LYS HDy 1.0 1.8 5.5 4649 3212 C 76 LYS HGx C 80 GLU HGx 1.0 1.8 4.5 4650 3212 C 76 LYS HGy C 80 GLU HGx 1.0 1.8 4.5 4651 3212 C 80 GLU HGy C 76 LYS HGx 1.0 1.8 4.5 4652 3212 C 76 LYS HGy C 80 GLU HGy 1.0 1.8 4.5 4653 3213 C 76 LYS HA C 77 ALA H 1.0 1.8 5.5 4654 3214 C 77 ALA H C 77 ALA HA 1.0 1.8 4.5 4655 3215 C 77 ALA HB1 C 77 ALA H 1.0 1.8 4.5 4656 3216 C 79 ILE H C 77 ALA H 1.0 1.8 5.5 4657 3217 C 77 ALA H C 77 ALA HA 1.0 1.8 4.5 4658 3218 C 78 GLY H C 77 ALA HA 1.0 1.8 5.5 4659 3219 C 77 ALA HB1 C 77 ALA H 1.0 1.8 3.5 4660 3220 C 77 ALA HB1 C 78 GLY H 1.0 1.8 4.5 4661 3221 C 78 GLY H C 76 LYS HA 1.0 1.8 5.5 4662 3222 C 78 GLY H C 77 ALA HA 1.0 1.8 5.5 4663 3223 C 77 ALA HB1 C 78 GLY H 1.0 1.8 4.5 4664 3224 C 78 GLY H C 78 GLY HAx 1.0 1.8 4.5 4665 3224 C 78 GLY H C 78 GLY HAy 1.0 1.8 4.5 4666 3225 C 78 GLY H C 79 ILE H 1.0 1.8 4.5 4667 3226 C 78 GLY H C 78 GLY HAx 1.0 1.8 3.5 4668 3226 C 78 GLY H C 78 GLY HAy 1.0 1.8 3.5 4669 3227 C 79 ILE H C 78 GLY HAx 1.0 1.8 4.5 4670 3227 C 79 ILE H C 78 GLY HAy 1.0 1.8 4.5 4671 3228 C 78 GLY H C 79 ILE H 1.0 1.8 4.5 4672 3229 C 79 ILE H C 79 ILE HA 1.0 1.8 4.5 4673 3230 C 79 ILE H C 80 GLU H 1.0 1.8 4.5 4674 3231 C 79 ILE H C 79 ILE HA 1.0 1.8 4.5 4675 3232 C 79 ILE HA C 80 GLU H 1.0 1.8 5.5 4676 3233 C 79 ILE HA C 82 PHE HBx 1.0 1.8 5.5 4677 3234 C 76 LYS H C 79 ILE HD11 1.0 1.8 5.5 4678 3235 C 79 ILE HD11 C 76 LYS HBx 1.0 1.8 5.5 4679 3235 C 76 LYS HBy C 79 ILE HD11 1.0 1.8 5.5 4680 3236 C 79 ILE H C 79 ILE HG1x 1.0 1.8 4.5 4681 3236 C 79 ILE H C 79 ILE HG1y 1.0 1.8 4.5 4682 3237 C 79 ILE HG21 C 79 ILE HG1x 1.0 1.8 3.5 4683 3237 C 79 ILE HG1y C 79 ILE HG21 1.0 1.8 3.5 4684 3238 C 79 ILE H C 79 ILE HG21 1.0 1.8 5.5 4685 3239 C 79 ILE HG21 C 79 ILE HG1x 1.0 1.8 3.5 4686 3239 C 79 ILE HG1y C 79 ILE HG21 1.0 1.8 3.5 4687 3240 C 80 GLU H C 79 ILE HG21 1.0 1.8 5.5 4688 3241 C 76 LYS HA C 80 GLU H 1.0 1.8 5.5 4689 3242 C 80 GLU H C 80 GLU HA 1.0 1.8 4.5 4690 3243 C 80 GLU HA C 81 VAL H 1.0 1.8 4.5 4691 3244 C 80 GLU HA C 83 ALA HB1 1.0 1.8 3.5 4692 3245 C 77 ALA HB1 C 80 GLU HBx 1.0 1.8 5.5 4693 3245 C 77 ALA HB1 C 80 GLU HBy 1.0 1.8 5.5 4694 3246 C 80 GLU H C 80 GLU HBx 1.0 1.8 3.5 4695 3246 C 80 GLU H C 80 GLU HBy 1.0 1.8 3.5 4696 3247 C 83 ALA HB1 C 80 GLU HBx 1.0 1.8 5.5 4697 3247 C 83 ALA HB1 C 80 GLU HBy 1.0 1.8 5.5 4698 3248 C 76 LYS HBy C 80 GLU HGx 1.0 1.8 5.5 4699 3248 C 76 LYS HBx C 80 GLU HGx 1.0 1.8 5.5 4700 3248 C 80 GLU HGy C 76 LYS HBx 1.0 1.8 5.5 4701 3248 C 76 LYS HBy C 80 GLU HGy 1.0 1.8 5.5 4702 3249 C 77 ALA HA C 80 GLU HGx 1.0 1.8 5.5 4703 3249 C 80 GLU HGy C 77 ALA HA 1.0 1.8 5.5 4704 3250 C 80 GLU H C 80 GLU HGx 1.0 1.8 4.5 4705 3250 C 80 GLU HGy C 80 GLU H 1.0 1.8 4.5 4706 3251 C 77 ALA HA C 81 VAL H 1.0 1.8 5.5 4707 3252 C 81 VAL H C 78 GLY HAx 1.0 1.8 4.5 4708 3252 C 78 GLY HAy C 81 VAL H 1.0 1.8 4.5 4709 3253 C 79 ILE HA C 81 VAL H 1.0 1.8 5.5 4710 3254 C 81 VAL H C 81 VAL HA 1.0 1.8 3.5 4711 3255 C 81 VAL H C 81 VAL HB 1.0 1.8 3.5 4712 3256 C 81 VAL HG11 C 78 GLY HAx 1.0 1.8 5.5 4713 3256 C 78 GLY HAy C 81 VAL HG11 1.0 1.8 5.5 4714 3257 C 81 VAL H C 81 VAL HG11 1.0 1.8 5.5 4715 3258 C 84 LEU HBy C 81 VAL HG11 1.0 1.8 5.5 4716 3258 C 81 VAL HG11 C 84 LEU HBx 1.0 1.8 5.5 4717 3259 C 77 ALA HA C 81 VAL HG21 1.0 1.8 4.5 4718 3260 C 78 GLY HAy C 81 VAL HG21 1.0 1.8 5.5 4719 3260 C 78 GLY HAx C 81 VAL HG21 1.0 1.8 5.5 4720 3261 C 79 ILE HA C 82 PHE H 1.0 1.8 5.5 4721 3262 C 81 VAL HB C 82 PHE HA 1.0 1.8 5.5 4722 3263 C 82 PHE H C 82 PHE HA 1.0 1.8 4.5 4723 3264 C 82 PHE HA C 82 PHE HBx 1.0 1.8 5.5 4724 3265 C 83 ALA H C 82 PHE HA 1.0 1.8 5.5 4725 3266 C 82 PHE H C 82 PHE HBx 1.0 1.8 4.5 4726 3267 C 82 PHE HBx C 82 PHE HBy 1.0 1.8 3.5 4727 3268 C 83 ALA H C 82 PHE HBx 1.0 1.8 5.5 4728 3269 C 83 ALA HA C 82 PHE HBx 1.0 1.8 5.5 4729 3270 C 82 PHE H C 82 PHE HBy 1.0 1.8 5.5 4730 3271 C 82 PHE HBx C 82 PHE HBy 1.0 1.8 3.5 4731 3272 C 83 ALA H C 82 PHE HBy 1.0 1.8 4.5 4732 3273 C 82 PHE H C 82 PHE HD% 1.0 1.8 4.5 4733 3274 C 83 ALA H C 83 ALA HA 1.0 1.8 4.5 4734 3275 C 83 ALA H C 83 ALA HB1 1.0 1.8 4.5 4735 3276 C 83 ALA HA C 82 PHE HBx 1.0 1.8 5.5 4736 3277 C 83 ALA H C 83 ALA HA 1.0 1.8 3.5 4737 3278 C 83 ALA HB1 C 83 ALA HA 1.0 1.8 3.5 4738 3279 C 83 ALA H C 83 ALA HB1 1.0 1.8 3.5 4739 3280 C 81 VAL HA C 84 LEU H 1.0 1.8 4.5 4740 3281 C 83 ALA HB1 C 84 LEU HA 1.0 1.8 5.5 4741 3282 C 84 LEU H C 84 LEU HA 1.0 1.8 3.5 4742 3283 C 84 LEU HA C 84 LEU HBx 1.0 1.8 4.5 4743 3283 C 84 LEU HBy C 84 LEU HA 1.0 1.8 4.5 4744 3284 C 86 THR H C 84 LEU HA 1.0 1.8 5.5 4745 3285 C 84 LEU HG C 85 VAL H 1.0 1.8 5.5 4746 3286 C 85 VAL H C 84 LEU HBx 1.0 1.8 3.5 4747 3286 C 84 LEU HBy C 85 VAL H 1.0 1.8 3.5 4748 3287 C 84 LEU HD11 C 84 LEU H 1.0 1.8 5.5 4749 3288 C 84 LEU HD11 C 85 VAL H 1.0 1.8 5.5 4750 3289 C 84 LEU H C 84 LEU HD21 1.0 1.8 5.5 4751 3290 C 85 VAL H C 84 LEU HD21 1.0 1.8 3.5 4752 3291 C 85 VAL HB C 84 LEU HD21 1.0 1.8 5.5 4753 3292 C 86 THR H C 84 LEU HD21 1.0 1.8 5.5 4754 3293 C 85 VAL H C 85 VAL HA 1.0 1.8 5.5 4755 3294 C 86 THR H C 85 VAL HA 1.0 1.8 5.5 4756 3295 C 85 VAL H C 85 VAL HB 1.0 1.8 3.5 4757 3296 C 85 VAL HB C 85 VAL HA 1.0 1.8 4.5 4758 3297 C 86 THR H C 85 VAL HB 1.0 1.8 4.5 4759 3298 C 84 LEU HBy C 85 VAL HG11 1.0 1.8 4.5 4760 3298 C 84 LEU HBx C 85 VAL HG11 1.0 1.8 4.5 4761 3298 C 85 VAL HG21 C 84 LEU HBx 1.0 1.8 4.5 4762 3298 C 84 LEU HBy C 85 VAL HG21 1.0 1.8 4.5 4763 3299 C 85 VAL H C 85 VAL HG11 1.0 1.8 3.5 4764 3299 C 85 VAL H C 85 VAL HG21 1.0 1.8 3.5 4765 3300 C 89 LEU H C 85 VAL HG11 1.0 1.8 5.5 4766 3300 C 85 VAL HG21 C 89 LEU H 1.0 1.8 5.5 4767 3301 C 86 THR H C 85 VAL HB 1.0 1.8 5.5 4768 3302 C 86 THR H C 86 THR HA 1.0 1.8 3.5 4769 3303 C 87 ALA H C 86 THR HA 1.0 1.8 5.5 4770 3304 C 86 THR HA C 88 ALA H 1.0 1.8 5.5 4771 3305 C 89 LEU H C 86 THR HA 1.0 1.8 4.5 4772 3306 C 86 THR HA C 89 LEU HBx 1.0 1.8 4.5 4773 3306 C 89 LEU HBy C 86 THR HA 1.0 1.8 4.5 4774 3307 C 90 ALA H C 86 THR HA 1.0 1.8 5.5 4775 3308 C 86 THR H C 86 THR HB 1.0 1.8 3.5 4776 3309 C 86 THR H C 86 THR HG21 1.0 1.8 5.5 4777 3310 C 87 ALA H C 86 THR HG21 1.0 1.8 4.5 4778 3311 C 87 ALA H C 87 ALA HB1 1.0 1.8 4.5 4779 3312 C 87 ALA H C 87 ALA HA 1.0 1.8 3.5 4780 3313 C 88 ALA H C 87 ALA HA 1.0 1.8 5.5 4781 3314 C 89 LEU H C 87 ALA HA 1.0 1.8 5.5 4782 3315 C 87 ALA HA C 91 THR H 1.0 1.8 5.5 4783 3316 C 87 ALA H C 87 ALA HB1 1.0 1.8 3.5 4784 3317 C 87 ALA HB1 C 88 ALA H 1.0 1.8 3.5 4785 3318 C 87 ALA HB1 C 89 LEU H 1.0 1.8 5.5 4786 3319 C 85 VAL HA C 88 ALA H 1.0 1.8 5.5 4787 3320 C 88 ALA H C 88 ALA HA 1.0 1.8 3.5 4788 3321 C 88 ALA HA C 88 ALA HB1 1.0 1.8 3.5 4789 3322 C 89 LEU H C 88 ALA HA 1.0 1.8 5.5 4790 3323 C 88 ALA HA C 92 ASP H 1.0 1.8 5.5 4791 3324 C 88 ALA H C 88 ALA HB1 1.0 1.8 3.5 4792 3325 C 89 LEU H C 88 ALA H 1.0 1.8 3.5 4793 3326 C 88 ALA HB1 C 89 LEU HA 1.0 1.8 5.5 4794 3327 C 89 LEU H C 89 LEU HA 1.0 1.8 3.5 4795 3328 C 89 LEU HA C 89 LEU HBx 1.0 1.8 4.5 4796 3328 C 89 LEU HBy C 89 LEU HA 1.0 1.8 4.5 4797 3329 C 90 ALA H C 89 LEU HA 1.0 1.8 5.5 4798 3330 C 91 THR H C 89 LEU HA 1.0 1.8 5.5 4799 3331 C 92 ASP H C 89 LEU HA 1.0 1.8 4.5 4800 3332 C 89 LEU HA C 92 ASP HBx 1.0 1.8 5.5 4801 3332 C 89 LEU HA C 92 ASP HBy 1.0 1.8 5.5 4802 3333 C 86 THR H C 89 LEU HG 1.0 1.8 5.5 4803 3334 C 86 THR HA C 89 LEU HG 1.0 1.8 5.5 4804 3335 C 89 LEU H C 89 LEU HBx 1.0 1.8 3.5 4805 3335 C 89 LEU HBy C 89 LEU H 1.0 1.8 3.5 4806 3336 C 90 ALA H C 89 LEU HBx 1.0 1.8 4.5 4807 3336 C 90 ALA H C 89 LEU HBy 1.0 1.8 4.5 4808 3337 C 90 ALA HA C 89 LEU HBx 1.0 1.8 5.5 4809 3337 C 89 LEU HBy C 90 ALA HA 1.0 1.8 5.5 4810 3338 C 91 THR H C 89 LEU HBx 1.0 1.8 5.5 4811 3338 C 89 LEU HBy C 91 THR H 1.0 1.8 5.5 4812 3339 C 89 LEU HD11 C 89 LEU H 1.0 1.8 5.5 4813 3340 C 90 ALA H C 91 THR H 1.0 1.8 3.5 4814 3341 C 90 ALA HA C 89 LEU HBx 1.0 1.8 5.5 4815 3341 C 89 LEU HBy C 90 ALA HA 1.0 1.8 5.5 4816 3342 C 90 ALA H C 90 ALA HA 1.0 1.8 4.5 4817 3343 C 90 ALA HA C 93 PHE HBx 1.0 1.8 5.5 4818 3343 C 90 ALA HA C 93 PHE HBy 1.0 1.8 5.5 4819 3344 C 90 ALA HB1 C 90 ALA H 1.0 1.8 3.5 4820 3345 C 90 ALA HB1 C 91 THR H 1.0 1.8 4.5 4821 3346 C 91 THR H C 90 ALA HA 1.0 1.8 4.5 4822 3347 C 91 THR H C 91 THR HA 1.0 1.8 3.5 4823 3348 C 91 THR HG21 C 91 THR H 1.0 1.8 5.5 4824 3349 C 91 THR HG21 C 92 ASP H 1.0 1.8 4.5 4825 3350 C 88 ALA HA C 92 ASP H 1.0 1.8 5.5 4826 3351 C 92 ASP H C 89 LEU HA 1.0 1.8 4.5 4827 3352 C 91 THR H C 92 ASP H 1.0 1.8 3.5 4828 3353 C 92 ASP H C 91 THR HA 1.0 1.8 5.5 4829 3354 C 92 ASP H C 92 ASP HA 1.0 1.8 4.5 4830 3355 C 91 THR HG21 C 92 ASP HA 1.0 1.8 4.5 4831 3356 C 92 ASP H C 92 ASP HA 1.0 1.8 3.5 4832 3357 C 92 ASP HA C 93 PHE H 1.0 1.8 5.5 4833 3358 C 92 ASP HA C 94 VAL H 1.0 1.8 5.5 4834 3359 C 91 THR H C 92 ASP HBx 1.0 1.8 5.5 4835 3359 C 91 THR H C 92 ASP HBy 1.0 1.8 5.5 4836 3360 C 92 ASP H C 92 ASP HBx 1.0 1.8 3.5 4837 3360 C 92 ASP H C 92 ASP HBy 1.0 1.8 3.5 4838 3361 C 93 PHE H C 92 ASP HBx 1.0 1.8 4.5 4839 3361 C 92 ASP HBy C 93 PHE H 1.0 1.8 4.5 4840 3362 C 94 VAL H C 92 ASP HBx 1.0 1.8 5.5 4841 3362 C 92 ASP HBy C 94 VAL H 1.0 1.8 5.5 4842 3363 C 90 ALA HA C 93 PHE H 1.0 1.8 4.5 4843 3364 C 93 PHE H C 93 PHE HA 1.0 1.8 4.5 4844 3365 C 93 PHE H C 93 PHE HA 1.0 1.8 3.5 4845 3366 C 93 PHE HA C 93 PHE HBx 1.0 1.8 5.5 4846 3366 C 93 PHE HBy C 93 PHE HA 1.0 1.8 5.5 4847 3367 C 94 VAL H C 93 PHE HA 1.0 1.8 5.5 4848 3368 C 93 PHE H C 93 PHE HBx 1.0 1.8 3.5 4849 3368 C 93 PHE HBy C 93 PHE H 1.0 1.8 3.5 4850 3369 C 94 VAL H C 93 PHE HBx 1.0 1.8 4.5 4851 3369 C 93 PHE HBy C 94 VAL H 1.0 1.8 4.5 4852 3370 C 90 ALA HA C 93 PHE HD% 1.0 1.8 3.5 4853 3371 C 93 PHE H C 93 PHE HD% 1.0 1.8 4.5 4854 3372 C 94 VAL H C 93 PHE HD% 1.0 1.8 5.5 4855 3373 C 93 PHE HD% C 96 ARG HDx 1.0 1.8 5.5 4856 3373 C 93 PHE HD% C 96 ARG HDy 1.0 1.8 5.5 4857 3374 C 94 VAL H C 95 ARG H 1.0 1.8 3.5 4858 3375 C 94 VAL H C 94 VAL HA 1.0 1.8 3.5 4859 3376 C 95 ARG H C 94 VAL HA 1.0 1.8 5.5 4860 3377 C 94 VAL HB C 95 ARG H 1.0 1.8 3.5 4861 3378 C 90 ALA HB1 C 94 VAL HG11 1.0 1.8 4.5 4862 3378 C 90 ALA HB1 C 94 VAL HG21 1.0 1.8 4.5 4863 3379 C 91 THR HG21 C 94 VAL HG11 1.0 1.8 5.5 4864 3379 C 91 THR HG21 C 94 VAL HG21 1.0 1.8 5.5 4865 3380 C 94 VAL H C 94 VAL HG11 1.0 1.8 3.5 4866 3380 C 94 VAL H C 94 VAL HG21 1.0 1.8 3.5 4867 3381 C 94 VAL H C 95 ARG H 1.0 1.8 3.5 4868 3382 C 95 ARG H C 95 ARG HA 1.0 1.8 4.5 4869 3383 C 95 ARG HE C 95 ARG HDx 1.0 1.8 4.5 4870 3383 C 95 ARG HE C 95 ARG HDy 1.0 1.8 4.5 4871 3384 C 96 ARG H C 95 ARG HBx 1.0 1.8 3.5 4872 3384 C 95 ARG HBy C 96 ARG H 1.0 1.8 3.5 4873 3385 C 95 ARG HE C 95 ARG HH1% 1.0 1.8 4.5 4874 3386 C 95 ARG HE C 95 ARG HH2% 1.0 1.8 4.5 4875 3387 C 96 ARG H C 96 ARG HA 1.0 1.8 4.5 4876 3388 C 96 ARG H C 96 ARG HDx 1.0 1.8 5.5 4877 3388 C 96 ARG HDy C 96 ARG H 1.0 1.8 5.5 4878 3389 C 96 ARG HA C 100 ARG H 1.0 1.8 5.5 4879 3390 C 96 ARG H C 96 ARG HA 1.0 1.8 4.5 4880 3391 C 96 ARG HE C 96 ARG HDx 1.0 1.8 3.5 4881 3391 C 96 ARG HDy C 96 ARG HE 1.0 1.8 3.5 4882 3392 C 96 ARG H C 96 ARG HBx 1.0 1.8 3.5 4883 3392 C 96 ARG H C 96 ARG HBy 1.0 1.8 3.5 4884 3393 C 96 ARG H C 96 ARG HDx 1.0 1.8 5.5 4885 3393 C 96 ARG HDy C 96 ARG H 1.0 1.8 5.5 4886 3394 C 96 ARG HE C 96 ARG HDx 1.0 1.8 3.5 4887 3394 C 96 ARG HDy C 96 ARG HE 1.0 1.8 3.5 4888 3395 C 96 ARG H C 96 ARG HGx 1.0 1.8 5.5 4889 3395 C 96 ARG H C 96 ARG HGy 1.0 1.8 5.5 4890 3396 C 96 ARG HE C 96 ARG HGx 1.0 1.8 3.5 4891 3396 C 96 ARG HE C 96 ARG HGy 1.0 1.8 3.5 4892 3397 C 97 GLU H C 96 ARG HGx 1.0 1.8 5.5 4893 3397 C 96 ARG HGy C 97 GLU H 1.0 1.8 5.5 4894 3398 C 96 ARG HE C 96 ARG HH1% 1.0 1.8 4.5 4895 3399 C 96 ARG HE C 96 ARG HH2% 1.0 1.8 4.5 4896 3400 C 96 ARG HA C 97 GLU H 1.0 1.8 5.5 4897 3401 C 97 GLU H C 97 GLU HA 1.0 1.8 4.5 4898 3402 C 97 GLU HA C 100 ARG HBx 1.0 1.8 4.5 4899 3402 C 97 GLU HA C 100 ARG HBy 1.0 1.8 4.5 4900 3403 C 97 GLU H C 97 GLU HA 1.0 1.8 4.5 4901 3404 C 97 GLU HA C 98 GLU H 1.0 1.8 5.5 4902 3405 C 97 GLU H C 97 GLU HBx 1.0 1.8 3.5 4903 3405 C 97 GLU H C 97 GLU HBy 1.0 1.8 3.5 4904 3406 C 98 GLU H C 97 GLU HBx 1.0 1.8 3.5 4905 3406 C 98 GLU H C 97 GLU HBy 1.0 1.8 3.5 4906 3407 C 97 GLU HBx C 98 GLU HGx 1.0 1.8 4.5 4907 3407 C 97 GLU HBy C 98 GLU HGx 1.0 1.8 4.5 4908 3407 C 98 GLU HGy C 97 GLU HBx 1.0 1.8 4.5 4909 3407 C 97 GLU HBy C 98 GLU HGy 1.0 1.8 4.5 4910 3408 C 97 GLU H C 97 GLU HGx 1.0 1.8 5.5 4911 3408 C 97 GLU H C 97 GLU HGy 1.0 1.8 5.5 4912 3409 C 97 GLU HBx C 97 GLU HGx 1.0 1.8 3.5 4913 3409 C 97 GLU HBy C 97 GLU HGx 1.0 1.8 3.5 4914 3409 C 97 GLU HGy C 97 GLU HBx 1.0 1.8 3.5 4915 3409 C 97 GLU HBy C 97 GLU HGy 1.0 1.8 3.5 4916 3410 C 97 GLU HA C 98 GLU H 1.0 1.8 5.5 4917 3411 C 98 GLU H C 98 GLU HA 1.0 1.8 4.5 4918 3412 C 98 GLU HA C 101 ARG H 1.0 1.8 5.5 4919 3413 C 98 GLU HA C 101 ARG HBx 1.0 1.8 4.5 4920 3413 C 98 GLU HA C 101 ARG HBy 1.0 1.8 4.5 4921 3414 C 98 GLU H C 98 GLU HA 1.0 1.8 4.5 4922 3415 C 98 GLU H C 98 GLU HBx 1.0 1.8 3.5 4923 3415 C 98 GLU H C 98 GLU HBy 1.0 1.8 3.5 4924 3416 C 98 GLU HBx C 98 GLU HGx 1.0 1.8 3.5 4925 3416 C 98 GLU HBy C 98 GLU HGx 1.0 1.8 3.5 4926 3416 C 98 GLU HGy C 98 GLU HBx 1.0 1.8 3.5 4927 3416 C 98 GLU HGy C 98 GLU HBy 1.0 1.8 3.5 4928 3417 C 99 GLU H C 98 GLU HBx 1.0 1.8 4.5 4929 3417 C 98 GLU HBy C 99 GLU H 1.0 1.8 4.5 4930 3418 C 98 GLU H C 98 GLU HGx 1.0 1.8 4.5 4931 3418 C 98 GLU H C 98 GLU HGy 1.0 1.8 4.5 4932 3419 C 99 GLU HA C 102 GLY HAx 1.0 1.8 5.5 4933 3419 C 99 GLU HA C 102 GLY HAy 1.0 1.8 5.5 4934 3420 C 99 GLU H C 99 GLU HA 1.0 1.8 4.5 4935 3421 C 99 GLU H C 99 GLU HBx 1.0 1.8 4.5 4936 3421 C 99 GLU H C 99 GLU HBy 1.0 1.8 4.5 4937 3422 C 99 GLU HBx C 99 GLU HGx 1.0 1.8 3.5 4938 3422 C 99 GLU HBy C 99 GLU HGx 1.0 1.8 3.5 4939 3422 C 99 GLU HGy C 99 GLU HBx 1.0 1.8 3.5 4940 3422 C 99 GLU HBy C 99 GLU HGy 1.0 1.8 3.5 4941 3423 C 99 GLU H C 99 GLU HGx 1.0 1.8 5.5 4942 3423 C 99 GLU H C 99 GLU HGy 1.0 1.8 5.5 4943 3424 C 100 ARG H C 99 GLU H 1.0 1.8 4.5 4944 3425 C 100 ARG H C 99 GLU HA 1.0 1.8 5.5 4945 3426 C 100 ARG H C 100 ARG HA 1.0 1.8 4.5 4946 3427 C 100 ARG HA C 100 ARG HBx 1.0 1.8 4.5 4947 3427 C 100 ARG HBy C 100 ARG HA 1.0 1.8 4.5 4948 3428 C 101 ARG H C 100 ARG HBx 1.0 1.8 4.5 4949 3428 C 100 ARG HBy C 101 ARG H 1.0 1.8 4.5 4950 3429 C 100 ARG HH1% C 100 ARG HE 1.0 1.8 4.5 4951 3430 C 100 ARG HH1% C 101 ARG HE 1.0 1.8 4.5 4952 3431 C 100 ARG HE C 100 ARG HH2% 1.0 1.8 4.5 4953 3432 C 101 ARG HE C 100 ARG HH2% 1.0 1.8 4.5 4954 3433 C 97 GLU HA C 101 ARG H 1.0 1.8 5.5 4955 3434 C 98 GLU HA C 101 ARG H 1.0 1.8 5.5 4956 3435 C 101 ARG HA C 100 ARG HBx 1.0 1.8 5.5 4957 3435 C 100 ARG HBy C 101 ARG HA 1.0 1.8 5.5 4958 3436 C 101 ARG H C 101 ARG HA 1.0 1.8 4.5 4959 3437 C 101 ARG HA C 101 ARG HBx 1.0 1.8 4.5 4960 3437 C 101 ARG HBy C 101 ARG HA 1.0 1.8 4.5 4961 3438 C 101 ARG H C 101 ARG HBx 1.0 1.8 3.5 4962 3438 C 101 ARG H C 101 ARG HBy 1.0 1.8 3.5 4963 3439 C 101 ARG HBy C 101 ARG HGx 1.0 1.8 3.5 4964 3439 C 101 ARG HBx C 101 ARG HGx 1.0 1.8 3.5 4965 3439 C 101 ARG HGy C 101 ARG HBx 1.0 1.8 3.5 4966 3439 C 101 ARG HBy C 101 ARG HGy 1.0 1.8 3.5 4967 3440 C 102 GLY H C 101 ARG HBx 1.0 1.8 5.5 4968 3440 C 101 ARG HBy C 102 GLY H 1.0 1.8 5.5 4969 3441 C 101 ARG H C 101 ARG HGx 1.0 1.8 3.5 4970 3441 C 101 ARG H C 101 ARG HGy 1.0 1.8 3.5 4971 3442 C 102 GLY H C 101 ARG HGx 1.0 1.8 5.5 4972 3442 C 101 ARG HGy C 102 GLY H 1.0 1.8 5.5 4973 3443 C 101 ARG HE C 101 ARG HH1% 1.0 1.8 4.5 4974 3444 C 101 ARG HE C 101 ARG HH2% 1.0 1.8 4.5 4975 3445 C 100 ARG HA C 102 GLY H 1.0 1.8 5.5 4976 3446 C 102 GLY H C 101 ARG HBx 1.0 1.8 5.5 4977 3446 C 101 ARG HBy C 102 GLY H 1.0 1.8 5.5 4978 3447 C 101 ARG HBx C 102 GLY HAx 1.0 1.8 4.5 4979 3447 C 101 ARG HBy C 102 GLY HAx 1.0 1.8 4.5 4980 3447 C 102 GLY HAy C 101 ARG HBx 1.0 1.8 4.5 4981 3447 C 101 ARG HBy C 102 GLY HAy 1.0 1.8 4.5 4982 3448 C 102 GLY H C 102 GLY HAx 1.0 1.8 3.5 4983 3448 C 102 GLY HAy C 102 GLY H 1.0 1.8 3.5 4984 3449 C 103 HIS H C 102 GLY HAx 1.0 1.8 3.5 4985 3449 C 102 GLY HAy C 103 HIS H 1.0 1.8 3.5 4986 3450 C 99 GLU HA C 103 HIS H 1.0 1.8 4.5 4987 3451 C 103 HIS H C 103 HIS HA 1.0 1.8 4.5 4988 3452 C 103 HIS H C 103 HIS HBx 1.0 1.8 4.5 4989 3453 C 103 HIS HBx C 103 HIS HBy 1.0 1.8 3.5 4990 3454 C 103 HIS H C 103 HIS HBy 1.0 1.8 4.5 4991 3455 C 103 HIS HBx C 103 HIS HBy 1.0 1.8 3.5 4992 3456 C 47 TRP HE1 C 38 LEU HD11 1.0 1.8 5.5 4993 3456 C 38 LEU HD21 C 47 TRP HE1 1.0 1.8 5.5 4994 3457 C 1 SER H1 C 6 ARG HDx 1.0 1.8 5.5 4995 3457 C 1 SER H1 C 6 ARG HDy 1.0 1.8 5.5 4996 3458 C 6 ARG H C 1 SER HBx 1.0 1.8 6.5 4997 3458 C 1 SER HBy C 6 ARG H 1.0 1.8 6.5 4998 3459 C 15 LEU H C 81 VAL HG11 1.0 1.8 4.5 4999 3460 C 51 THR HA C 56 GLY H 1.0 1.8 4.5 5000 3461 C 15 LEU HD11 C 78 GLY H 1.0 1.8 5.5 5001 3462 C 12 GLU H C 81 VAL HG11 1.0 1.8 4.5 5002 3463 C 12 GLU H C 85 VAL HG11 1.0 1.8 4.5 5003 3463 C 12 GLU H C 85 VAL HG21 1.0 1.8 4.5 5004 3464 C 63 VAL HG11 C 36 ALA H 1.0 1.8 4.5 5005 3465 C 44 ALA H C 38 LEU HD11 1.0 1.8 4.5 5006 3465 C 38 LEU HD21 C 44 ALA H 1.0 1.8 4.5 5007 3466 C 48 SER H C 38 LEU HD11 1.0 1.8 4.5 5008 3466 C 38 LEU HD21 C 48 SER H 1.0 1.8 4.5 5009 3467 C 2 ALA HB1 C 95 ARG HE 1.0 1.8 5.5 5010 3468 C 52 ALA HB1 C 78 GLY H 1.0 1.8 4.5 5011 3469 C 5 GLU HA C 88 ALA HB1 1.0 1.8 3.5 5012 3470 C 61 TYR HA C 47 TRP HE1 1.0 1.8 5.5 5013 3471 C 47 TRP HZ2 C 71 ALA HA 1.0 1.8 3.5 5014 3472 C 47 TRP HZ2 C 71 ALA HA 1.0 1.8 3.5 5015 3473 C 71 ALA HA C 47 TRP HH2 1.0 1.8 3.5 5016 3474 C 8 ALA HA C 85 VAL HA 1.0 1.8 3.5 5017 3475 C 29 ALA HA C 66 GLU HBx 1.0 1.8 3.5 5018 3475 C 29 ALA HA C 66 GLU HBy 1.0 1.8 3.5 5019 3476 C 77 ALA HA C 18 VAL HG11 1.0 1.8 4.5 5020 3476 C 18 VAL HG21 C 77 ALA HA 1.0 1.8 4.5 5021 3477 C 8 ALA HA C 85 VAL HG11 1.0 1.8 3.5 5022 3477 C 8 ALA HA C 85 VAL HG21 1.0 1.8 3.5 5023 3478 C 8 ALA HA C 84 LEU HD21 1.0 1.8 3.5 5024 3479 C 8 ALA HA C 85 VAL HG11 1.0 1.8 3.5 5025 3479 C 8 ALA HA C 85 VAL HG21 1.0 1.8 3.5 5026 3480 C 52 ALA HA C 74 VAL HG11 1.0 1.8 3.5 5027 3481 C 8 ALA HA C 84 LEU HD21 1.0 1.8 3.5 5028 3482 C 15 LEU HD11 C 78 GLY HAx 1.0 1.8 4.5 5029 3482 C 15 LEU HD11 C 78 GLY HAy 1.0 1.8 4.5 5030 3483 C 15 LEU HD21 C 78 GLY HAx 1.0 1.8 4.5 5031 3483 C 78 GLY HAy C 15 LEU HD21 1.0 1.8 4.5 5032 3484 C 15 LEU HD21 C 78 GLY HAx 1.0 1.8 4.5 5033 3484 C 78 GLY HAy C 15 LEU HD21 1.0 1.8 4.5 5034 3485 C 54 THR HG21 C 78 GLY HAx 1.0 1.8 5.5 5035 3485 C 54 THR HG21 C 78 GLY HAy 1.0 1.8 5.5 5036 3486 C 39 ILE HB C 31 ARG HDx 1.0 1.8 4.5 5037 3486 C 31 ARG HDy C 39 ILE HB 1.0 1.8 4.5 5038 3487 C 39 ILE HB C 31 ARG HDx 1.0 1.8 4.5 5039 3487 C 31 ARG HDy C 39 ILE HB 1.0 1.8 4.5 5040 3488 C 43 ASP HBx C 60 ARG HDx 1.0 1.8 5.5 5041 3488 C 43 ASP HBx C 60 ARG HDy 1.0 1.8 5.5 5042 3489 C 43 ASP HBy C 60 ARG HDx 1.0 1.8 6.5 5043 3489 C 43 ASP HBy C 60 ARG HDy 1.0 1.8 6.5 5044 3490 C 84 LEU HG C 7 GLU HGx 1.0 1.8 4.5 5045 3490 C 84 LEU HG C 7 GLU HGy 1.0 1.8 4.5 5046 3491 C 38 LEU HBx C 60 ARG HDx 1.0 1.8 5.5 5047 3491 C 38 LEU HBy C 60 ARG HDx 1.0 1.8 5.5 5048 3491 C 60 ARG HDy C 38 LEU HBx 1.0 1.8 5.5 5049 3491 C 38 LEU HBy C 60 ARG HDy 1.0 1.8 5.5 5050 3492 C 54 THR HG21 C 79 ILE HG1x 1.0 1.8 3.5 5051 3492 C 54 THR HG21 C 79 ILE HG1y 1.0 1.8 3.5 5052 3493 C 77 ALA HB1 C 18 VAL HG11 1.0 1.8 5.5 5053 3493 C 18 VAL HG21 C 77 ALA HB1 1.0 1.8 5.5 5054 3494 C 11 ALA HB1 C 81 VAL HG21 1.0 1.8 4.5 5055 3495 C 77 ALA HB1 C 18 VAL HG11 1.0 1.8 4.5 5056 3495 C 18 VAL HG21 C 77 ALA HB1 1.0 1.8 4.5 5057 3496 C 29 ALA HB1 C 70 VAL HG21 1.0 1.8 4.5 5058 3497 C 5 GLU H C 88 ALA HB1 1.0 1.8 4.5 5059 3498 C 52 ALA HB1 C 78 GLY H 1.0 1.8 4.5 5060 3499 C 52 ALA HB1 C 82 PHE HE% 1.0 1.8 4.5 5061 3500 C 52 ALA HB1 C 82 PHE HE% 1.0 1.8 4.5 5062 3501 C 71 ALA HB1 C 47 TRP HH2 1.0 1.8 5.5 5063 3502 C 26 ALA HB1 C 47 TRP HE3 1.0 1.8 5.5 5064 3503 C 2 ALA HB1 C 95 ARG HE 1.0 1.8 5.5 5065 3504 C 5 GLU HA C 88 ALA HB1 1.0 1.8 4.5 5066 3505 C 52 ALA HB1 C 82 PHE HE% 1.0 1.8 4.5 5067 3506 C 8 ALA HB1 C 85 VAL HA 1.0 1.8 3.5 5068 3507 C 4 HIS HBx C 88 ALA HB1 1.0 1.8 3.5 5069 3508 C 71 ALA HB1 C 62 PRO HGx 1.0 1.8 4.5 5070 3508 C 71 ALA HB1 C 62 PRO HGy 1.0 1.8 4.5 5071 3509 C 18 VAL HB C 77 ALA HB1 1.0 1.8 3.5 5072 3510 C 71 ALA HB1 C 62 PRO HGx 1.0 1.8 3.5 5073 3510 C 71 ALA HB1 C 62 PRO HGy 1.0 1.8 3.5 5074 3511 C 18 VAL HB C 77 ALA HB1 1.0 1.8 3.5 5075 3512 C 52 ALA HB1 C 19 LEU HD21 1.0 1.8 4.5 5076 3513 C 26 ALA HB1 C 44 ALA HB1 1.0 1.8 4.5 5077 3514 C 54 THR HG21 C 79 ILE HD11 1.0 1.8 3.5 5078 3515 C 53 THR HG21 C 15 LEU HD21 1.0 1.8 4.5 5079 3516 C 51 THR HG21 C 74 VAL HG11 1.0 1.8 3.5 5080 3517 C 54 THR HG21 C 79 ILE HD11 1.0 1.8 3.5 5081 3518 C 45 ILE HD11 C 19 LEU HD21 1.0 1.8 6.5 5082 3519 C 45 ILE HD11 C 19 LEU HD21 1.0 1.8 6.5 5083 3520 C 15 LEU H C 81 VAL HG11 1.0 1.8 4.5 5084 3521 C 15 LEU H C 81 VAL HG11 1.0 1.8 4.5 5085 3522 C 8 ALA H C 88 ALA HB1 1.0 1.8 4.5 5086 3523 C 8 ALA H C 88 ALA HB1 1.0 1.8 4.5 5087 3524 C 52 ALA HA C 78 GLY H 1.0 1.8 4.5 5088 3525 C 52 ALA HA C 78 GLY H 1.0 1.8 4.5 5089 3526 C 61 TYR H C 38 LEU HD11 1.0 1.8 4.5 5090 3526 C 38 LEU HD21 C 61 TYR H 1.0 1.8 4.5 5091 3527 C 37 ALA HB1 C 60 ARG HA 1.0 1.8 4.5 5092 3528 C 26 ALA HA C 38 LEU HD11 1.0 1.8 4.5 5093 3528 C 26 ALA HA C 38 LEU HD21 1.0 1.8 4.5 5094 3529 C 26 ALA HA C 38 LEU HD11 1.0 1.8 4.5 5095 3529 C 26 ALA HA C 38 LEU HD21 1.0 1.8 4.5 5096 3530 C 51 THR HG21 C 74 VAL HG21 1.0 1.8 4.5 5097 3531 C 26 ALA HA C 70 VAL HG21 1.0 1.8 4.5 5098 3532 C 26 ALA HA C 70 VAL HG21 1.0 1.8 4.5 5099 3533 C 82 PHE H C 15 LEU HD21 1.0 1.8 4.5 5100 3534 C 54 THR HG21 C 79 ILE H 1.0 1.8 4.5 5101 3535 C 88 ALA HB1 C 5 GLU HGx 1.0 1.8 4.5 5102 3535 C 5 GLU HGy C 88 ALA HB1 1.0 1.8 4.5 5103 3536 C 52 ALA HB1 C 75 MET HA 1.0 1.8 5.5 5104 3537 C 52 ALA HB1 C 75 MET HA 1.0 1.8 5.5 5105 3538 C 15 LEU HD11 C 52 ALA HA 1.0 1.8 5.5 5106 3539 C 15 LEU HD11 C 52 ALA HA 1.0 1.8 5.5 5107 3540 C 63 VAL H C 30 GLU HGx 1.0 1.8 5.5 5108 3540 C 30 GLU HGy C 63 VAL H 1.0 1.8 5.5 5109 3541 C 15 LEU HD11 C 81 VAL HB 1.0 1.8 5.5 5110 3542 C 26 ALA HA C 70 VAL HG11 1.0 1.8 5.5 5111 3543 C 26 ALA HA C 70 VAL HG11 1.0 1.8 5.5 5112 3544 C 77 ALA HB1 C 14 GLU HGx 1.0 1.8 5.5 5113 3544 C 14 GLU HGy C 77 ALA HB1 1.0 1.8 5.5 5114 3545 C 4 HIS HBy C 88 ALA HB1 1.0 1.8 5.5 5115 3546 C 4 HIS HBy C 88 ALA HB1 1.0 1.8 5.5 5116 3547 C 52 ALA HB1 C 18 VAL HG11 1.0 1.8 5.5 5117 3547 C 18 VAL HG21 C 52 ALA HB1 1.0 1.8 5.5 5118 3548 C 52 ALA HB1 C 18 VAL HG11 1.0 1.8 5.5 5119 3548 C 18 VAL HG21 C 52 ALA HB1 1.0 1.8 5.5 5120 3549 C 71 ALA HB1 C 47 TRP HE1 1.0 1.8 5.5 5121 3550 C 49 VAL H C 19 LEU HD11 1.0 1.8 5.5 5122 3551 C 47 TRP HBy C 60 ARG HGx 1.0 1.8 5.5 5123 3551 C 47 TRP HBy C 60 ARG HGy 1.0 1.8 5.5 5124 3552 C 8 ALA HA C 85 VAL H 1.0 1.8 5.5 5125 3553 C 63 VAL HG11 C 35 GLY HAy 1.0 1.8 5.5 5126 3553 C 63 VAL HG11 C 35 GLY HAx 1.0 1.8 5.5 5127 3554 C 15 LEU HD11 C 77 ALA HA 1.0 1.8 5.5 5128 3555 C 15 LEU HD11 C 77 ALA HA 1.0 1.8 5.5 5129 3556 C 33 ALA HB1 C 63 VAL HB 1.0 1.8 5.5 5130 3557 C 33 ALA HB1 C 63 VAL HB 1.0 1.8 5.5 5131 3558 C 8 ALA HA C 84 LEU HBx 1.0 1.8 5.5 5132 3558 C 84 LEU HBy C 8 ALA HA 1.0 1.8 5.5 5133 3559 C 8 ALA HA C 84 LEU HBx 1.0 1.8 5.5 5134 3559 C 84 LEU HBy C 8 ALA HA 1.0 1.8 5.5 5135 3560 C 8 ALA HA C 84 LEU HBx 1.0 1.8 5.5 5136 3560 C 84 LEU HBy C 8 ALA HA 1.0 1.8 5.5 5137 3561 C 22 ALA HB1 C 71 ALA HA 1.0 1.8 5.5 5138 3562 C 22 ALA HB1 C 71 ALA HA 1.0 1.8 5.5 5139 3563 C 52 ALA HA C 75 MET HBx 1.0 1.8 5.5 5140 3563 C 52 ALA HA C 75 MET HBy 1.0 1.8 5.5 5141 3564 C 53 THR HG21 C 19 LEU HD21 1.0 1.8 5.5 5142 3565 C 53 THR HG21 C 19 LEU HD21 1.0 1.8 5.5 5143 3566 C 38 LEU HA C 61 TYR H 1.0 1.8 5.5 5144 3567 C 38 LEU HA C 61 TYR H 1.0 1.8 5.5 5145 3568 C 52 ALA HA C 19 LEU HD21 1.0 1.8 5.5 5146 3569 C 52 ALA HA C 19 LEU HD21 1.0 1.8 5.5 5147 3570 C 98 GLU HA C 103 HIS H 1.0 1.8 5.5 5148 3571 C 52 ALA HB1 C 74 VAL HB 1.0 1.8 5.5 5149 3572 C 78 GLY HAy C 19 LEU HD21 1.0 1.8 5.5 5150 3572 C 19 LEU HD21 C 78 GLY HAx 1.0 1.8 5.5 5151 3573 C 49 VAL HB C 19 LEU HD21 1.0 1.8 5.5 5152 3574 C 26 ALA HB1 C 44 ALA HA 1.0 1.8 5.5 5153 3575 C 26 ALA HB1 C 44 ALA HA 1.0 1.8 5.5 5154 3576 C 63 VAL HG11 C 33 ALA HB1 1.0 1.8 5.5 5155 3577 C 7 GLU H C 88 ALA HB1 1.0 1.8 5.5 5156 3578 C 8 ALA HB1 C 88 ALA HA 1.0 1.8 5.5 5157 3579 C 53 THR HG21 C 19 LEU HD11 1.0 1.8 5.5 5158 3580 C 53 THR HG21 C 19 LEU HD11 1.0 1.8 5.5 5159 3581 C 18 VAL H C 77 ALA HB1 1.0 1.8 5.5 5160 3582 C 26 ALA HA C 62 PRO HBx 1.0 1.8 5.5 5161 3582 C 26 ALA HA C 62 PRO HBy 1.0 1.8 5.5 5162 3583 C 29 ALA H C 66 GLU HBx 1.0 1.8 5.5 5163 3583 C 29 ALA H C 66 GLU HBy 1.0 1.8 5.5 5164 3584 C 51 THR HG21 C 19 LEU HD21 1.0 1.8 5.5 5165 3585 C 26 ALA HB1 C 62 PRO HDx 1.0 1.8 5.5 5166 3585 C 26 ALA HB1 C 62 PRO HDy 1.0 1.8 5.5 5167 3586 C 14 GLU H C 81 VAL HG11 1.0 1.8 5.5 5168 3587 C 52 ALA HA C 15 LEU HD21 1.0 1.8 5.5 5169 3588 C 88 ALA HB1 C 5 GLU HBx 1.0 1.8 5.5 5170 3588 C 5 GLU HBy C 88 ALA HB1 1.0 1.8 5.5 5171 3589 C 15 LEU HD11 C 53 THR HG21 1.0 1.8 5.5 5172 3590 C 15 LEU HD11 C 53 THR HG21 1.0 1.8 5.5 5173 3591 C 15 LEU HD11 C 53 THR HG21 1.0 1.8 5.5 5174 3592 C 11 ALA HB1 C 82 PHE H 1.0 1.8 5.5 5175 3593 C 26 ALA HB1 C 48 SER HBx 1.0 1.8 5.5 5176 3593 C 26 ALA HB1 C 48 SER HBy 1.0 1.8 5.5 5177 3594 C 36 ALA HA C 63 VAL HB 1.0 1.8 5.5 5178 3595 C 36 ALA HA C 63 VAL HB 1.0 1.8 5.5 5179 3596 C 33 ALA HB1 C 64 THR H 1.0 1.8 5.5 5180 3597 C 52 ALA HA C 74 VAL HB 1.0 1.8 5.5 5181 3598 C 71 ALA HA C 62 PRO HGx 1.0 1.8 5.5 5182 3598 C 71 ALA HA C 62 PRO HGy 1.0 1.8 5.5 5183 3599 C 18 VAL HB C 52 ALA HB1 1.0 1.8 5.5 5184 3600 C 18 VAL HB C 52 ALA HB1 1.0 1.8 5.5 5185 3601 C 71 ALA HB1 C 51 THR HB 1.0 1.8 5.5 5186 3602 C 71 ALA HB1 C 51 THR HB 1.0 1.8 5.5 5187 3603 C 8 ALA HB1 C 85 VAL HB 1.0 1.8 5.5 5188 3604 C 50 GLU H C 19 LEU HD21 1.0 1.8 5.5 5189 3605 C 52 ALA HB1 C 75 MET H 1.0 1.8 5.5 5190 3606 C 84 LEU HG C 8 ALA HA 1.0 1.8 5.5 5191 3607 C 84 LEU HG C 8 ALA HA 1.0 1.8 5.5 5192 3608 C 15 LEU HA C 52 ALA HB1 1.0 1.8 5.5 5193 3609 C 15 LEU HA C 52 ALA HB1 1.0 1.8 5.5 5194 3610 C 39 ILE H C 30 GLU HGx 1.0 1.8 5.5 5195 3610 C 30 GLU HGy C 39 ILE H 1.0 1.8 5.5 5196 3611 C 54 THR H C 79 ILE HG1x 1.0 1.8 5.5 5197 3611 C 54 THR H C 79 ILE HG1y 1.0 1.8 5.5 5198 3612 C 52 ALA HB1 C 19 LEU HBx 1.0 1.8 5.5 5199 3612 C 19 LEU HBy C 52 ALA HB1 1.0 1.8 5.5 5200 3613 C 29 ALA HA C 67 GLY H 1.0 1.8 5.5 5201 3614 C 29 ALA HA C 67 GLY H 1.0 1.8 5.5 5202 3615 C 52 ALA HA C 77 ALA HB1 1.0 1.8 5.5 5203 3616 C 52 ALA HA C 77 ALA HB1 1.0 1.8 5.5 5204 3617 C 9 GLN H C 88 ALA HB1 1.0 1.8 5.5 5205 3618 C 9 GLN H C 88 ALA HB1 1.0 1.8 5.5 5206 3619 C 15 LEU H C 81 VAL HB 1.0 1.8 6.5 5207 3620 C 26 ALA HB1 C 74 VAL HG21 1.0 1.8 6.5 5208 3621 C 15 LEU H C 81 VAL HB 1.0 1.8 6.5 5209 3622 C 15 LEU H C 77 ALA HB1 1.0 1.8 6.5 5210 3623 C 15 LEU H C 77 ALA HB1 1.0 1.8 6.5 5211 3624 C 15 LEU HD11 C 79 ILE H 1.0 1.8 6.5 5212 3625 C 87 ALA HB1 C 4 HIS HBx 1.0 1.8 6.5 5213 3626 C 11 ALA HB1 C 85 VAL HB 1.0 1.8 6.5 5214 3627 C 77 ALA HB1 C 14 GLU HBx 1.0 1.8 6.5 5215 3627 C 14 GLU HBy C 77 ALA HB1 1.0 1.8 6.5 5216 3628 C 77 ALA HB1 C 14 GLU HBx 1.0 1.8 6.5 5217 3628 C 14 GLU HBy C 77 ALA HB1 1.0 1.8 6.5 5218 3629 C 18 VAL HA C 77 ALA HB1 1.0 1.8 6.5 5219 3630 C 18 VAL HA C 77 ALA HB1 1.0 1.8 6.5 5220 3631 C 33 ALA HB1 C 63 VAL H 1.0 1.8 6.5 5221 3632 C 41 TYR HE% C 24 LYS HEx 1.0 1.8 6.5 5222 3632 C 24 LYS HEy C 41 TYR HE% 1.0 1.8 6.5 5223 3633 C 55 VAL HB C 50 GLU HGx 1.0 1.8 6.5 5224 3633 C 50 GLU HGy C 55 VAL HB 1.0 1.8 6.5 5225 3634 C 55 VAL HB C 50 GLU HGx 1.0 1.8 6.5 5226 3634 C 50 GLU HGy C 55 VAL HB 1.0 1.8 6.5 5227 3635 C 52 ALA HA C 77 ALA H 1.0 1.8 6.5 5228 3636 C 52 ALA HA C 77 ALA H 1.0 1.8 6.5 5229 3637 C 12 GLU H C 84 LEU HD21 1.0 1.8 6.5 5230 3638 C 71 ALA HB1 C 47 TRP HZ3 1.0 1.8 6.5 5231 3639 C 87 ALA HB1 C 7 GLU HBx 1.0 1.8 6.5 5232 3639 C 87 ALA HB1 C 7 GLU HBy 1.0 1.8 6.5 5233 3640 C 9 GLN H C 85 VAL HG11 1.0 1.8 6.5 5234 3640 C 9 GLN H C 85 VAL HG21 1.0 1.8 6.5 5235 3641 C 73 GLN HE2x C 21 GLU HBx 1.0 1.8 6.5 5236 3641 C 21 GLU HBy C 73 GLN HE2x 1.0 1.8 6.5 5237 3642 C 4 HIS H C 88 ALA HB1 1.0 1.8 6.5 5238 3643 C 88 ALA HB1 C 7 GLU HGx 1.0 1.8 6.5 5239 3643 C 7 GLU HGy C 88 ALA HB1 1.0 1.8 6.5 5240 3644 C 6 ARG H C 88 ALA HB1 1.0 1.8 6.5 5241 3645 C 87 ALA HB1 C 4 HIS HBy 1.0 1.8 6.5 5242 3646 C 87 ALA HB1 C 4 HIS HBy 1.0 1.8 6.5 5243 3647 C 26 ALA HB1 C 62 PRO HGx 1.0 1.8 6.5 5244 3647 C 26 ALA HB1 C 62 PRO HGy 1.0 1.8 6.5 5245 3648 C 26 ALA HB1 C 62 PRO HGx 1.0 1.8 6.5 5246 3648 C 26 ALA HB1 C 62 PRO HGy 1.0 1.8 6.5 5247 3649 C 79 ILE H C 15 LEU HD21 1.0 1.8 6.5 5248 3650 C 18 VAL HG21 C 78 GLY HAx 1.0 1.8 6.5 5249 3650 C 18 VAL HG11 C 78 GLY HAx 1.0 1.8 6.5 5250 3650 C 78 GLY HAy C 18 VAL HG11 1.0 1.8 6.5 5251 3650 C 18 VAL HG21 C 78 GLY HAy 1.0 1.8 6.5 5252 3651 C 18 VAL HG21 C 78 GLY HAx 1.0 1.8 6.5 5253 3651 C 18 VAL HG11 C 78 GLY HAx 1.0 1.8 6.5 5254 3651 C 78 GLY HAy C 18 VAL HG11 1.0 1.8 6.5 5255 3651 C 18 VAL HG21 C 78 GLY HAy 1.0 1.8 6.5 5256 3652 C 18 VAL HG21 C 78 GLY HAx 1.0 1.8 6.5 5257 3652 C 18 VAL HG11 C 78 GLY HAx 1.0 1.8 6.5 5258 3652 C 78 GLY HAy C 18 VAL HG11 1.0 1.8 6.5 5259 3652 C 18 VAL HG21 C 78 GLY HAy 1.0 1.8 6.5 5260 3653 C 53 THR HG21 C 74 VAL HG11 1.0 1.8 6.5 5261 3654 C 53 THR HG21 C 74 VAL HG11 1.0 1.8 6.5 5262 3655 C 26 ALA HA C 47 TRP HH2 1.0 1.8 6.5 5263 3656 C 52 ALA HB1 C 81 VAL HG21 1.0 1.8 6.5 5264 3657 C 4 HIS HE1 C 88 ALA HB1 1.0 1.8 6.5 5265 3658 C 4 HIS HE1 C 88 ALA HB1 1.0 1.8 6.5 5266 3659 C 26 ALA HB1 C 47 TRP HBy 1.0 1.8 6.5 5267 3660 C 26 ALA HB1 C 47 TRP HBy 1.0 1.8 6.5 5268 3661 C 78 GLY HAy C 19 LEU HD11 1.0 1.8 6.5 5269 3661 C 19 LEU HD11 C 78 GLY HAx 1.0 1.8 6.5 5270 3662 C 38 LEU HA C 60 ARG HA 1.0 1.8 6.5 5271 3663 C 52 ALA HA C 79 ILE HD11 1.0 1.8 6.5 5272 3664 C 52 ALA HA C 79 ILE HD11 1.0 1.8 6.5 5273 3665 C 85 VAL H C 12 GLU HGx 1.0 1.8 6.5 5274 3665 C 12 GLU HGy C 85 VAL H 1.0 1.8 6.5 5275 3666 C 30 GLU H C 66 GLU HBx 1.0 1.8 6.5 5276 3666 C 30 GLU H C 66 GLU HBy 1.0 1.8 6.5 5277 3667 C 77 ALA HB1 C 17 LYS HEx 1.0 1.8 6.5 5278 3667 C 17 LYS HEy C 77 ALA HB1 1.0 1.8 6.5 5279 3668 C 71 ALA HB1 C 22 ALA HB1 1.0 1.8 6.5 5280 3669 C 46 TRP H C 38 LEU HD11 1.0 1.8 6.5 5281 3669 C 38 LEU HD21 C 46 TRP H 1.0 1.8 6.5 5282 3670 C 52 ALA HA C 76 LYS H 1.0 1.8 6.5 5283 3671 C 71 ALA HB1 C 22 ALA HB1 1.0 1.8 6.5 5284 3672 C 52 ALA HA C 76 LYS H 1.0 1.8 6.5 5285 3673 C 87 ALA HB1 C 7 GLU HGx 1.0 1.8 6.5 5286 3673 C 87 ALA HB1 C 7 GLU HGy 1.0 1.8 6.5 5287 3674 C 2 ALA HA C 3 ASP H 1.0 1.8 4.5 5288 3675 C 2 ALA HA C 3 ASP H 1.0 1.8 4.5 5289 3676 C 3 ASP H C 3 ASP HBx 1.0 1.8 4.5 5290 3676 C 3 ASP H C 3 ASP HBy 1.0 1.8 4.5 5291 3677 C 27 VAL HA C 30 GLU H 1.0 1.8 6.5 5292 3678 C 26 ALA HA C 29 ALA HB1 1.0 1.8 5.5 5293 3679 C 27 VAL HA C 30 GLU H 1.0 1.8 6.5 5294 3680 C 30 GLU H C 30 GLU HA 1.0 1.8 4.5 5295 3681 C 33 ALA HB1 C 30 GLU HBx 1.0 1.8 6.5 5296 3681 C 33 ALA HB1 C 30 GLU HBy 1.0 1.8 6.5 5297 3682 C 30 GLU H C 30 GLU HGx 1.0 1.8 4.5 5298 3682 C 30 GLU H C 30 GLU HGy 1.0 1.8 4.5 5299 3683 C 32 GLY H C 31 ARG HBx 1.0 1.8 4.5 5300 3683 C 31 ARG HBy C 32 GLY H 1.0 1.8 4.5 5301 3684 C 39 ILE H C 39 ILE HD11 1.0 1.8 5.5 5302 3685 C 37 ALA HB1 C 39 ILE HG1x 1.0 1.8 6.5 5303 3685 C 37 ALA HB1 C 39 ILE HG1y 1.0 1.8 6.5 5304 3686 C 40 SER H C 39 ILE HG1x 1.0 1.8 4.5 5305 3686 C 39 ILE HG1y C 40 SER H 1.0 1.8 4.5 5306 3687 C 43 ASP HBy C 40 SER HBx 1.0 1.8 5.5 5307 3687 C 40 SER HBy C 43 ASP HBy 1.0 1.8 5.5 5308 3688 C 43 ASP H C 43 ASP HBy 1.0 1.8 4.5 5309 3689 C 43 ASP HBx C 44 ALA HA 1.0 1.8 6.5 5310 3690 C 47 TRP H C 47 TRP HBx 1.0 1.8 5.5 5311 3691 C 47 TRP HA C 47 TRP HE1 1.0 1.8 6.5 5312 3692 C 57 TYR H C 57 TYR HBx 1.0 1.8 4.5 5313 3693 C 60 ARG H C 60 ARG HGx 1.0 1.8 5.5 5314 3693 C 60 ARG H C 60 ARG HGy 1.0 1.8 5.5 5315 3694 C 64 THR HA C 65 GLU H 1.0 1.8 5.5 5316 3695 C 64 THR HB C 66 GLU H 1.0 1.8 6.5 5317 3696 C 66 GLU H C 65 GLU HBy 1.0 1.8 4.5 5318 3697 C 64 THR H C 67 GLY H 1.0 1.8 5.5 5319 3698 C 96 ARG H C 95 ARG HGx 1.0 1.8 5.5 5320 3698 C 96 ARG H C 95 ARG HGy 1.0 1.8 5.5 5321 3699 C 99 GLU H C 95 ARG HGx 1.0 1.8 6.5 5322 3699 C 99 GLU H C 95 ARG HGy 1.0 1.8 6.5 5323 3700 C 36 ALA HA C 63 VAL HG21 1.0 1.8 5.5 5324 3701 C 31 ARG H C 39 ILE HA 1.0 1.8 5.5 5325 3702 C 26 ALA HB1 C 70 VAL HB 1.0 1.8 5.5 5326 3703 C 38 LEU H C 30 GLU HBx 1.0 1.8 6.5 5327 3703 C 30 GLU HBy C 38 LEU H 1.0 1.8 6.5 5328 3704 C 64 THR HB C 33 ALA HB1 1.0 1.8 6.5 5329 3705 C 64 THR HB C 33 ALA HB1 1.0 1.8 6.5 5330 3706 C 68 ARG HA C 62 PRO HDx 1.0 1.8 6.5 5331 3706 C 68 ARG HA C 62 PRO HDy 1.0 1.8 6.5 5332 3707 C 36 ALA HB1 C 63 VAL H 1.0 1.8 6.5 5333 3708 C 60 ARG H C 47 TRP HBx 1.0 1.8 6.5 5334 3709 C 36 ALA HA C 30 GLU HBx 1.0 1.8 6.5 5335 3709 C 30 GLU HBy C 36 ALA HA 1.0 1.8 6.5 5336 3710 C 39 ILE HA C 44 ALA HB1 1.0 1.8 6.5 5337 3711 C 35 GLY HAy C 63 VAL HG21 1.0 1.8 6.5 5338 3711 C 35 GLY HAx C 63 VAL HG21 1.0 1.8 6.5 5339 3712 C 26 ALA HB1 C 38 LEU HA 1.0 1.8 6.5 5340 3713 C 51 THR HG21 C 19 LEU HD21 1.0 1.8 5.5 5341 3713 C 51 THR HG21 C 19 LEU HD11 1.0 1.8 5.5 5342 3714 C 47 TRP HBx C 59 ASP HBx 1.0 1.8 5.5 5343 3714 C 47 TRP HBx C 59 ASP HBy 1.0 1.8 5.5 5344 3715 C 47 TRP HBy C 59 ASP HBx 1.0 1.8 5.5 5345 3715 C 47 TRP HBy C 59 ASP HBy 1.0 1.8 5.5 5346 3716 C 65 GLU H C 33 ALA HB1 1.0 1.8 5.5 5347 3717 C 33 ALA HB1 C 65 GLU HBy 1.0 1.8 5.5 5348 3718 C 33 ALA HB1 C 65 GLU HA 1.0 1.8 5.5 5349 3719 C 33 ALA HB1 C 65 GLU HBx 1.0 1.8 5.5 5350 3720 C 33 ALA HB1 C 65 GLU HGx 1.0 1.8 5.5 5351 3720 C 33 ALA HB1 C 65 GLU HGy 1.0 1.8 5.5 5352 3721 C 34 PRO HDx C 65 GLU HA 1.0 1.8 5.5 5353 3722 C 34 PRO HDx C 65 GLU HA 1.0 1.8 5.5 5354 3723 C 52 ALA HA C 18 VAL HG11 1.0 1.8 5.5 5355 3723 C 18 VAL HG21 C 52 ALA HA 1.0 1.8 5.5 5356 3724 C 22 ALA HB1 C 52 ALA HB1 1.0 1.8 5.5 5357 3725 C 22 ALA HB1 C 52 ALA HB1 1.0 1.8 5.5 5358 3726 C 22 ALA HB1 C 52 ALA HB1 1.0 1.8 5.5 5359 3727 C 22 ALA HB1 C 52 ALA HB1 1.0 1.8 5.5 5360 3728 C 15 LEU HD11 C 51 THR HG21 1.0 1.8 5.5 5361 3729 C 29 ALA HB1 C 63 VAL H 1.0 1.8 5.5 5362 3730 C 26 ALA HB1 C 48 SER H 1.0 1.8 5.5 5363 3731 C 27 VAL HB C 41 TYR H 1.0 1.8 5.5 5364 3732 C 26 ALA HB1 C 48 SER HA 1.0 1.8 5.5 5365 3733 C 54 THR HG21 C 15 LEU HD21 1.0 1.8 5.5 5366 3734 C 27 VAL HB C 38 LEU HD11 1.0 1.8 5.5 5367 3734 C 27 VAL HB C 38 LEU HD21 1.0 1.8 5.5 5368 3735 C 16 GLN HA C 52 ALA HB1 1.0 1.8 5.5 5369 3736 C 30 GLU HA C 36 ALA HA 1.0 1.8 5.5 5370 3737 C 51 THR H C 19 LEU HD11 1.0 1.8 5.5 5371 3738 C 26 ALA HB1 C 47 TRP HE1 1.0 1.8 5.5 5372 3739 C 27 VAL HB C 40 SER H 1.0 1.8 5.5 5373 3740 C 15 LEU HG C 52 ALA HA 1.0 1.8 5.5 5374 3741 C 52 ALA HB1 C 16 GLN HGx 1.0 1.8 5.5 5375 3741 C 16 GLN HGy C 52 ALA HB1 1.0 1.8 5.5 5376 3742 C 27 VAL HA C 44 ALA HA 1.0 1.8 5.5 5377 3743 C 27 VAL HA C 44 ALA HA 1.0 1.8 5.5 5378 3744 C 27 VAL HA C 44 ALA HA 1.0 1.8 5.5 5379 3745 C 27 VAL HA C 44 ALA HA 1.0 1.8 5.5 5380 3746 C 17 LYS H C 16 GLN HBx 1.0 1.8 4.5 5381 3746 C 17 LYS H C 16 GLN HBy 1.0 1.8 4.5 5382 3747 C 9 GLN H C 8 ALA HB1 1.0 1.8 4.5 5383 3748 C 71 ALA HB1 C 72 GLU H 1.0 1.8 4.5 5384 3749 C 71 ALA HB1 C 72 GLU H 1.0 1.8 4.5 5385 3750 C 61 TYR H C 38 LEU HBx 1.0 1.8 4.5 5386 3750 C 38 LEU HBy C 61 TYR H 1.0 1.8 4.5 5387 3751 C 15 LEU HA C 77 ALA HB1 1.0 1.8 4.5 5388 3752 C 90 ALA H C 89 LEU H 1.0 1.8 4.5 5389 3753 C 90 ALA H C 89 LEU H 1.0 1.8 4.5 5390 3754 C 56 GLY HAx C 57 TYR H 1.0 1.8 4.5 5391 3755 C 56 GLY HAx C 57 TYR H 1.0 1.8 4.5 5392 3756 C 77 ALA HA C 80 GLU HBx 1.0 1.8 4.5 5393 3756 C 77 ALA HA C 80 GLU HBy 1.0 1.8 4.5 5394 3757 C 6 ARG H C 5 GLU HBx 1.0 1.8 4.5 5395 3757 C 6 ARG H C 5 GLU HBy 1.0 1.8 4.5 5396 3758 C 40 SER H C 40 SER HBx 1.0 1.8 4.5 5397 3758 C 40 SER H C 40 SER HBy 1.0 1.8 4.5 5398 3759 C 71 ALA HB1 C 62 PRO HDx 1.0 1.8 4.5 5399 3759 C 71 ALA HB1 C 62 PRO HDy 1.0 1.8 4.5 5400 3760 C 71 ALA HB1 C 62 PRO HDx 1.0 1.8 4.5 5401 3760 C 71 ALA HB1 C 62 PRO HDy 1.0 1.8 4.5 5402 3761 C 92 ASP H C 93 PHE H 1.0 1.8 4.5 5403 3762 C 68 ARG HE C 68 ARG HGx 1.0 1.8 4.5 5404 3762 C 68 ARG HGy C 68 ARG HE 1.0 1.8 4.5 5405 3763 C 89 LEU H C 88 ALA HB1 1.0 1.8 4.5 5406 3764 C 89 LEU H C 88 ALA HB1 1.0 1.8 4.5 5407 3765 C 71 ALA HA C 74 VAL HB 1.0 1.8 4.5 5408 3766 C 49 VAL H C 19 LEU HD21 1.0 1.8 4.5 5409 3767 C 63 VAL HG11 C 36 ALA HA 1.0 1.8 4.5 5410 3768 C 63 VAL HG11 C 36 ALA HA 1.0 1.8 4.5 5411 3769 C 63 VAL HG11 C 36 ALA HA 1.0 1.8 4.5 5412 3770 C 86 THR H C 85 VAL HG11 1.0 1.8 4.5 5413 3770 C 86 THR H C 85 VAL HG21 1.0 1.8 4.5 5414 3771 C 77 ALA HB1 C 73 GLN HGx 1.0 1.8 4.5 5415 3771 C 77 ALA HB1 C 73 GLN HGy 1.0 1.8 4.5 5416 3772 C 97 GLU H C 96 ARG HBx 1.0 1.8 4.5 5417 3772 C 96 ARG HBy C 97 GLU H 1.0 1.8 4.5 5418 3773 C 97 GLU H C 96 ARG HBx 1.0 1.8 4.5 5419 3773 C 96 ARG HBy C 97 GLU H 1.0 1.8 4.5 5420 3774 C 53 THR HG21 C 49 VAL HG11 1.0 1.8 4.5 5421 3775 C 66 GLU H C 66 GLU HGx 1.0 1.8 4.5 5422 3775 C 66 GLU H C 66 GLU HGy 1.0 1.8 4.5 5423 3776 C 19 LEU H C 19 LEU HD11 1.0 1.8 5.5 5424 3777 C 66 GLU H C 65 GLU HGx 1.0 1.8 5.5 5425 3777 C 66 GLU H C 65 GLU HGy 1.0 1.8 5.5 5426 3778 C 26 ALA HB1 C 30 GLU HGx 1.0 1.8 5.5 5427 3778 C 26 ALA HB1 C 30 GLU HGy 1.0 1.8 5.5 5428 3779 C 26 ALA HA C 70 VAL HB 1.0 1.8 5.5 5429 3780 C 57 TYR H C 57 TYR HD% 1.0 1.8 5.5 5430 3781 C 58 GLY H C 57 TYR HBx 1.0 1.8 5.5 5431 3782 C 51 THR HA C 54 THR HA 1.0 1.8 5.5 5432 3783 C 90 ALA HB1 C 87 ALA HA 1.0 1.8 5.5 5433 3784 C 97 GLU H C 96 ARG HDx 1.0 1.8 5.5 5434 3784 C 96 ARG HDy C 97 GLU H 1.0 1.8 5.5 5435 3785 C 97 GLU H C 96 ARG HDx 1.0 1.8 5.5 5436 3785 C 96 ARG HDy C 97 GLU H 1.0 1.8 5.5 5437 3786 C 7 GLU H C 4 HIS HA 1.0 1.8 5.5 5438 3787 C 91 THR HB C 92 ASP H 1.0 1.8 5.5 5439 3788 C 91 THR HB C 92 ASP H 1.0 1.8 5.5 5440 3789 C 10 LYS HGx C 14 GLU HBx 1.0 1.8 5.5 5441 3789 C 10 LYS HGy C 14 GLU HBx 1.0 1.8 5.5 5442 3789 C 14 GLU HBy C 10 LYS HGx 1.0 1.8 5.5 5443 3789 C 10 LYS HGy C 14 GLU HBy 1.0 1.8 5.5 5444 3790 C 88 ALA HB1 C 7 GLU HBx 1.0 1.8 5.5 5445 3790 C 7 GLU HBy C 88 ALA HB1 1.0 1.8 5.5 5446 3791 C 85 VAL HA C 88 ALA HB1 1.0 1.8 5.5 5447 3792 C 57 TYR HBx C 59 ASP HBx 1.0 1.8 5.5 5448 3792 C 57 TYR HBx C 59 ASP HBy 1.0 1.8 5.5 5449 3793 C 87 ALA H C 84 LEU HA 1.0 1.8 5.5 5450 3794 C 60 ARG H C 58 GLY H 1.0 1.8 5.5 5451 3795 C 15 LEU HD11 C 77 ALA H 1.0 1.8 5.5 5452 3796 C 84 LEU HD11 C 8 ALA HA 1.0 1.8 5.5 5453 3797 C 84 LEU HD11 C 8 ALA HA 1.0 1.8 5.5 5454 3798 C 90 ALA HA C 94 VAL HG11 1.0 1.8 5.5 5455 3798 C 90 ALA HA C 94 VAL HG21 1.0 1.8 5.5 5456 3799 C 12 GLU HBx C 16 GLN HGx 1.0 1.8 5.5 5457 3799 C 12 GLU HBy C 16 GLN HGx 1.0 1.8 5.5 5458 3799 C 16 GLN HGy C 12 GLU HBx 1.0 1.8 5.5 5459 3799 C 12 GLU HBy C 16 GLN HGy 1.0 1.8 5.5 5460 3800 C 53 THR HG21 C 78 GLY HAx 1.0 1.8 5.5 5461 3800 C 53 THR HG21 C 78 GLY HAy 1.0 1.8 5.5 5462 3801 C 8 ALA HA C 88 ALA HB1 1.0 1.8 5.5 5463 3802 C 8 ALA HA C 88 ALA HB1 1.0 1.8 5.5 5464 3803 C 90 ALA H C 89 LEU HD11 1.0 1.8 5.5 5465 3804 C 26 ALA HB1 C 70 VAL HG21 1.0 1.8 5.5 5466 3805 C 52 ALA HB1 C 82 PHE HZ 1.0 1.8 5.5 5467 3806 C 83 ALA H C 79 ILE HG21 1.0 1.8 5.5 5468 3807 C 89 LEU HD11 C 85 VAL HB 1.0 1.8 5.5 5469 3808 C 17 LYS H C 17 LYS HEx 1.0 1.8 5.5 5470 3808 C 17 LYS H C 17 LYS HEy 1.0 1.8 5.5 5471 3809 C 50 GLU HA C 53 THR H 1.0 1.8 5.5 5472 3810 C 90 ALA H C 87 ALA HA 1.0 1.8 5.5 5473 3811 C 9 GLN H C 84 LEU HD21 1.0 1.8 6.5 5474 3812 C 69 LYS HA C 68 ARG HBx 1.0 1.8 6.5 5475 3812 C 68 ARG HBy C 69 LYS HA 1.0 1.8 6.5 5476 3813 C 47 TRP H C 49 VAL H 1.0 1.8 6.5 5477 3814 C 37 ALA HB1 C 62 PRO HDx 1.0 1.8 6.5 5478 3814 C 37 ALA HB1 C 62 PRO HDy 1.0 1.8 6.5 5479 3815 C 86 THR HG21 C 89 LEU HD11 1.0 1.8 6.5 5480 3816 C 52 ALA HB1 C 82 PHE HD% 1.0 1.8 6.5 5481 3817 C 85 VAL H C 81 VAL HG11 1.0 1.8 6.5 5482 3818 C 74 VAL HG11 C 78 GLY HAx 1.0 1.8 6.5 5483 3818 C 74 VAL HG11 C 78 GLY HAy 1.0 1.8 6.5 5484 3819 C 7 GLU HGy C 84 LEU HBx 1.0 1.8 6.5 5485 3819 C 7 GLU HGx C 84 LEU HBx 1.0 1.8 6.5 5486 3819 C 84 LEU HBy C 7 GLU HGx 1.0 1.8 6.5 5487 3819 C 84 LEU HBy C 7 GLU HGy 1.0 1.8 6.5 5488 3820 C 94 VAL HA C 93 PHE HBx 1.0 1.8 6.5 5489 3820 C 93 PHE HBy C 94 VAL HA 1.0 1.8 6.5 5490 3821 C 57 TYR HD% C 59 ASP H 1.0 1.8 6.5 5491 3822 C 52 ALA HB1 C 74 VAL HG21 1.0 1.8 6.5 5492 3823 C 83 ALA H C 82 PHE HD% 1.0 1.8 6.5 5493 3824 C 49 VAL HA C 53 THR H 1.0 1.8 6.5 5494 3825 C 70 VAL HG11 C 74 VAL H 1.0 1.8 6.5 5495 3826 C 53 THR HA C 82 PHE HBx 1.0 1.8 6.5 5496 3827 C 65 GLU HBy C 34 PRO HBx 1.0 1.8 6.5 5497 3827 C 34 PRO HBy C 65 GLU HBy 1.0 1.8 6.5 5498 3828 C 18 VAL HB C 74 VAL HG21 1.0 1.8 6.5 5499 3829 C 52 ALA HB1 C 79 ILE H 1.0 1.8 6.5 5500 3830 C 52 ALA HB1 C 79 ILE H 1.0 1.8 6.5 5501 3831 C 46 TRP HBy C 60 ARG HGx 1.0 1.8 6.5 5502 3831 C 46 TRP HBx C 60 ARG HGx 1.0 1.8 6.5 5503 3831 C 60 ARG HGy C 46 TRP HBx 1.0 1.8 6.5 5504 3831 C 46 TRP HBy C 60 ARG HGy 1.0 1.8 6.5 5505 3832 C 51 THR HB C 56 GLY H 1.0 1.8 6.5 5506 3833 C 51 THR HB C 56 GLY H 1.0 1.8 6.5 5507 3834 C 86 THR HB C 83 ALA HA 1.0 1.8 6.5 5508 3835 C 88 ALA HB1 C 92 ASP HBx 1.0 1.8 6.5 5509 3835 C 88 ALA HB1 C 92 ASP HBy 1.0 1.8 6.5 5510 3836 C 64 THR HG21 C 63 VAL HG21 1.0 1.8 6.5 5511 3837 C 52 ALA HA C 79 ILE HG1x 1.0 1.8 6.5 5512 3837 C 52 ALA HA C 79 ILE HG1y 1.0 1.8 6.5 5513 3838 C 52 ALA HA C 79 ILE HG1x 1.0 1.8 6.5 5514 3838 C 52 ALA HA C 79 ILE HG1y 1.0 1.8 6.5 5515 3839 C 52 ALA HA C 79 ILE HG1x 1.0 1.8 6.5 5516 3839 C 52 ALA HA C 79 ILE HG1y 1.0 1.8 6.5 5517 3840 C 90 ALA HA C 94 VAL H 1.0 1.8 6.5 5518 3841 C 93 PHE H C 93 PHE HE% 1.0 1.8 6.5 5519 3842 C 26 ALA HB1 C 30 GLU HBx 1.0 1.8 6.5 5520 3842 C 26 ALA HB1 C 30 GLU HBy 1.0 1.8 6.5 5521 3843 C 51 THR HG21 C 56 GLY HAx 1.0 1.8 6.5 5522 3844 C 52 ALA HB1 C 77 ALA H 1.0 1.8 6.5 5523 3845 C 64 THR HA C 33 ALA HB1 1.0 1.8 6.5 5524 3846 C 52 ALA HB1 C 77 ALA H 1.0 1.8 6.5 5525 3847 C 52 ALA H C 78 GLY HAx 1.0 1.8 6.5 5526 3847 C 52 ALA H C 78 GLY HAy 1.0 1.8 6.5 5527 3848 C 27 VAL HA C 38 LEU HA 1.0 1.8 6.5 5528 3849 C 15 LEU HD11 C 54 THR H 1.0 1.8 6.5 5529 3850 C 52 ALA HA C 19 LEU HD11 1.0 1.8 6.5 5530 3851 C 42 PRO HA C 23 SER HBx 1.0 1.8 6.5 5531 3851 C 23 SER HBy C 42 PRO HA 1.0 1.8 6.5 5532 3852 C 52 ALA HA C 82 PHE HE% 1.0 1.8 6.5 5533 3853 C 48 SER H C 19 LEU HD11 1.0 1.8 6.5 5534 3854 C 23 SER H C 38 LEU HD11 1.0 1.8 6.5 5535 3854 C 23 SER H C 38 LEU HD21 1.0 1.8 6.5 5536 3855 C 26 ALA HB1 C 44 ALA H 1.0 1.8 6.5 5537 3856 C 16 GLN H C 52 ALA HB1 1.0 1.8 6.5 5538 3857 C 81 VAL HA C 85 VAL H 1.0 1.8 6.5 5539 3858 C 26 ALA HA C 47 TRP HZ2 1.0 1.8 6.5 5540 3859 C 26 ALA HA C 47 TRP HZ2 1.0 1.8 6.5 5541 3860 C 29 ALA HA C 66 GLU H 1.0 1.8 6.5 5542 3861 C 26 ALA HB1 C 45 ILE H 1.0 1.8 6.5 5543 3862 C 26 ALA HB1 C 45 ILE H 1.0 1.8 6.5 5544 3863 C 24 LYS H C 45 ILE HB 1.0 1.8 6.5 5545 3864 C 22 ALA HB1 C 51 THR HB 1.0 1.8 6.5 5546 3865 C 22 ALA HB1 C 51 THR HB 1.0 1.8 6.5 5547 3866 C 15 LEU HD11 C 54 THR HG21 1.0 1.8 6.5 5548 3867 C 15 LEU HD11 C 54 THR HG21 1.0 1.8 6.5 5549 3868 C 15 LEU HD11 C 54 THR HG21 1.0 1.8 6.5 5550 3869 C 24 LYS H C 45 ILE HA 1.0 1.8 6.5 5551 3870 C 24 LYS H C 45 ILE HA 1.0 1.8 6.5 5552 3871 C 50 GLU HGx C 60 ARG HBx 1.0 1.8 6.5 5553 3871 C 50 GLU HGy C 60 ARG HBx 1.0 1.8 6.5 5554 3871 C 60 ARG HBy C 50 GLU HGx 1.0 1.8 6.5 5555 3871 C 50 GLU HGy C 60 ARG HBy 1.0 1.8 6.5 5556 3872 C 91 THR HB C 88 ALA HB1 1.0 1.8 6.5 5557 3873 C 85 VAL HB C 12 GLU HGx 1.0 1.8 6.5 5558 3873 C 12 GLU HGy C 85 VAL HB 1.0 1.8 6.5 5559 3874 C 23 SER H C 48 SER HA 1.0 1.8 6.5 5560 3875 C 23 SER H C 48 SER HA 1.0 1.8 6.5 5561 3876 C 32 GLY H C 66 GLU HBx 1.0 1.8 6.5 5562 3876 C 32 GLY H C 66 GLU HBy 1.0 1.8 6.5 5563 3877 C 29 ALA HB1 C 68 ARG HBx 1.0 1.8 6.5 5564 3877 C 68 ARG HBy C 29 ALA HB1 1.0 1.8 6.5 5565 3878 C 27 VAL HA C 40 SER HBx 1.0 1.8 6.5 5566 3878 C 27 VAL HA C 40 SER HBy 1.0 1.8 6.5 5567 3879 C 51 THR HG21 C 78 GLY HAx 1.0 1.8 6.5 5568 3879 C 51 THR HG21 C 78 GLY HAy 1.0 1.8 6.5 5569 3880 C 51 THR HG21 C 19 LEU HD11 1.0 1.8 6.5 5570 3881 C 71 ALA H C 68 ARG HBx 1.0 1.8 6.5 5571 3881 C 68 ARG HBy C 71 ALA H 1.0 1.8 6.5 5572 3882 C 23 SER H C 70 VAL HG11 1.0 1.8 6.5 5573 3883 C 36 ALA H C 30 GLU HBx 1.0 1.8 6.5 5574 3883 C 30 GLU HBy C 36 ALA H 1.0 1.8 6.5 5575 3884 C 19 LEU HG C 52 ALA HA 1.0 1.8 6.5 5576 3885 C 48 SER HA C 71 ALA HA 1.0 1.8 6.5 5577 3886 C 18 VAL H C 52 ALA HB1 1.0 1.8 6.5 5578 3887 C 18 VAL H C 52 ALA HB1 1.0 1.8 6.5 5579 3888 C 30 GLU H C 39 ILE HA 1.0 1.8 6.5 5580 3889 C 89 LEU HA C 93 PHE H 1.0 1.8 6.5 5581 3890 C 25 LYS HBx C 67 GLY HAx 1.0 1.8 6.5 5582 3890 C 25 LYS HBy C 67 GLY HAx 1.0 1.8 6.5 5583 3890 C 67 GLY HAy C 25 LYS HBx 1.0 1.8 6.5 5584 3890 C 25 LYS HBy C 67 GLY HAy 1.0 1.8 6.5 5585 3891 C 44 ALA HB1 C 25 LYS HBx 1.0 1.8 6.5 5586 3891 C 25 LYS HBy C 44 ALA HB1 1.0 1.8 6.5 5587 3892 C 26 ALA HB1 C 51 THR HG21 1.0 1.8 6.5 5588 3893 C 34 PRO HA C 65 GLU HBy 1.0 1.8 6.5 5589 3894 C 47 TRP HE1 C 59 ASP HBx 1.0 1.8 6.5 5590 3894 C 47 TRP HE1 C 59 ASP HBy 1.0 1.8 6.5 5591 3895 C 45 ILE HD11 D 69 LYS HEx 1.0 1.8 6.5 5592 3895 C 45 ILE HD11 D 69 LYS HEy 1.0 1.8 6.5 5593 3896 C 45 ILE HG1x D 69 LYS HEx 1.0 1.8 6.5 5594 3896 C 45 ILE HG1y D 69 LYS HEx 1.0 1.8 6.5 5595 3896 D 69 LYS HEy C 45 ILE HG1x 1.0 1.8 6.5 5596 3896 C 45 ILE HG1y D 69 LYS HEy 1.0 1.8 6.5 5597 3897 C 45 ILE HG21 D 64 THR HG21 1.0 1.8 5.5 5598 3898 C 46 TRP HD1 D 68 ARG HDx 1.0 1.8 5.5 5599 3898 C 46 TRP HD1 D 68 ARG HDy 1.0 1.8 5.5 5600 3899 C 46 TRP HE1 D 64 THR HA 1.0 1.8 5.5 5601 3900 C 46 TRP HE1 D 64 THR HG21 1.0 1.8 5.5 5602 3901 C 46 TRP HE1 D 68 ARG HA 1.0 1.8 5.5 5603 3902 C 46 TRP HE1 D 68 ARG HBx 1.0 1.8 5.5 5604 3902 C 46 TRP HE1 D 68 ARG HBy 1.0 1.8 5.5 5605 3903 C 46 TRP HE3 D 68 ARG HDx 1.0 1.8 6.5 5606 3903 D 68 ARG HDy C 46 TRP HE3 1.0 1.8 6.5 5607 3904 C 46 TRP HZ2 D 68 ARG HBx 1.0 1.8 6.5 5608 3904 C 46 TRP HZ2 D 68 ARG HBy 1.0 1.8 6.5 5609 3905 C 46 TRP HBx D 68 ARG HBx 1.0 1.8 6.5 5610 3905 C 46 TRP HBy D 68 ARG HBx 1.0 1.8 6.5 5611 3905 D 68 ARG HBy C 46 TRP HBx 1.0 1.8 6.5 5612 3905 C 46 TRP HBy D 68 ARG HBy 1.0 1.8 6.5 5613 3906 C 46 TRP HBx D 68 ARG HDx 1.0 1.8 6.5 5614 3906 C 46 TRP HBy D 68 ARG HDx 1.0 1.8 6.5 5615 3906 D 68 ARG HDy C 46 TRP HBx 1.0 1.8 6.5 5616 3906 C 46 TRP HBy D 68 ARG HDy 1.0 1.8 6.5 5617 3907 C 46 TRP HBx D 68 ARG HGx 1.0 1.8 6.5 5618 3907 C 46 TRP HBy D 68 ARG HGx 1.0 1.8 6.5 5619 3907 D 68 ARG HGy C 46 TRP HBx 1.0 1.8 6.5 5620 3907 C 46 TRP HBy D 68 ARG HGy 1.0 1.8 6.5 5621 3908 C 49 VAL HG11 D 72 GLU HGx 1.0 1.8 6.5 5622 3908 C 49 VAL HG21 D 72 GLU HGx 1.0 1.8 6.5 5623 3908 D 72 GLU HGy C 49 VAL HG21 1.0 1.8 6.5 5624 3908 C 49 VAL HG11 D 72 GLU HGy 1.0 1.8 6.5 5625 3909 C 50 GLU HA D 72 GLU HA 1.0 1.8 5.5 5626 3910 D 71 ALA HB1 C 50 GLU HBx 1.0 1.8 5.5 5627 3910 C 50 GLU HBy D 71 ALA HB1 1.0 1.8 5.5 5628 3911 C 55 VAL HB D 75 MET HE1 1.0 1.8 5.5 5629 3912 D 54 THR HB C 55 VAL HG11 1.0 1.8 6.5 5630 3912 C 55 VAL HG21 D 54 THR HB 1.0 1.8 6.5 5631 3913 C 57 TYR HBy D 56 GLY HAy 1.0 1.8 5.5 5632 3914 C 57 TYR HBy D 61 TYR HA 1.0 1.8 5.5 5633 3915 C 57 TYR HD% D 60 ARG H 1.0 1.8 5.5 5634 3916 C 57 TYR HD% D 71 ALA HB1 1.0 1.8 5.5 5635 3917 C 57 TYR HE% D 58 GLY H 1.0 1.8 5.5 5636 3918 C 59 ASP HA D 61 TYR HBx 1.0 1.8 5.5 5637 3918 C 59 ASP HA D 61 TYR HBy 1.0 1.8 5.5 5638 3919 D 61 TYR HE% C 59 ASP HBx 1.0 1.8 6.5 5639 3919 C 59 ASP HBy D 61 TYR HE% 1.0 1.8 6.5 5640 3920 C 81 VAL HG11 D 76 LYS HEx 1.0 1.8 6.5 5641 3920 C 81 VAL HG21 D 76 LYS HEx 1.0 1.8 6.5 5642 3920 D 76 LYS HEy C 81 VAL HG21 1.0 1.8 6.5 5643 3920 C 81 VAL HG11 D 76 LYS HEy 1.0 1.8 6.5 5644 3921 C 82 PHE HD% D 76 LYS HEx 1.0 1.8 6.5 5645 3921 C 82 PHE HD% D 76 LYS HEy 1.0 1.8 6.5 5646 3922 C 82 PHE HE% D 76 LYS HEx 1.0 1.8 6.5 5647 3922 C 82 PHE HE% D 76 LYS HEy 1.0 1.8 6.5 5648 3923 C 89 LEU HA D 84 LEU HD21 1.0 1.8 6.5 5649 3923 C 89 LEU HA D 84 LEU HD11 1.0 1.8 6.5 5650 3924 D 86 THR H C 89 LEU HBx 1.0 1.8 5.5 5651 3924 C 89 LEU HBy D 86 THR H 1.0 1.8 5.5 5652 3925 D 87 ALA H C 89 LEU HBx 1.0 1.8 5.5 5653 3925 C 89 LEU HBy D 87 ALA H 1.0 1.8 5.5 5654 3926 C 89 LEU HD11 D 83 ALA H 1.0 1.8 5.5 5655 3927 C 89 LEU HD11 D 87 ALA H 1.0 1.8 5.5 5656 3928 D 87 ALA HB1 C 89 LEU HD21 1.0 1.8 6.5 5657 3928 C 89 LEU HD11 D 87 ALA HB1 1.0 1.8 6.5 5658 3929 D 86 THR HB C 92 ASP HBx 1.0 1.8 5.5 5659 3929 C 92 ASP HBy D 86 THR HB 1.0 1.8 5.5 5660 3930 D 90 ALA HB1 C 92 ASP HBx 1.0 1.8 6.5 5661 3930 C 92 ASP HBy D 90 ALA HB1 1.0 1.8 6.5 5662 3931 C 93 PHE H D 86 THR HG21 1.0 1.8 5.5 5663 3932 C 93 PHE H D 87 ALA H 1.0 1.8 5.5 5664 3933 D 90 ALA H C 93 PHE HBx 1.0 1.8 5.5 5665 3933 C 93 PHE HBy D 90 ALA H 1.0 1.8 5.5 5666 3934 C 96 ARG HE D 94 VAL HB 1.0 1.8 5.5 5667 3935 D 4 HIS H C 96 ARG HBx 1.0 1.8 6.5 5668 3935 C 96 ARG HBy D 4 HIS H 1.0 1.8 6.5 5669 3936 D 87 ALA HB1 C 96 ARG HBx 1.0 1.8 5.5 5670 3936 C 96 ARG HBy D 87 ALA HB1 1.0 1.8 5.5 5671 3937 D 87 ALA HB1 C 96 ARG HDx 1.0 1.8 6.5 5672 3937 C 96 ARG HDy D 87 ALA HB1 1.0 1.8 6.5 5673 3938 D 90 ALA HB1 C 96 ARG HDx 1.0 1.8 6.5 5674 3938 C 96 ARG HDy D 90 ALA HB1 1.0 1.8 6.5 5675 3939 D 91 THR HG21 C 96 ARG HDx 1.0 1.8 6.5 5676 3939 C 96 ARG HDy D 91 THR HG21 1.0 1.8 6.5 5677 3940 C 43 ASP HBy D 64 THR HB 1.0 1.8 6.5 5678 3941 D 60 ARG H C 57 TYR HE% 1.0 1.8 6.5 5679 3942 C 46 TRP HH2 D 69 LYS H 1.0 1.8 6.5 5680 3943 C 50 GLU HGy D 68 ARG HGx 1.0 1.8 6.5 5681 3943 C 50 GLU HGx D 68 ARG HGx 1.0 1.8 6.5 5682 3943 D 68 ARG HGy C 50 GLU HGx 1.0 1.8 6.5 5683 3943 C 50 GLU HGy D 68 ARG HGy 1.0 1.8 6.5 5684 3944 C 93 PHE H D 91 THR HG21 1.0 1.8 6.5 5685 3945 C 46 TRP HD1 D 65 GLU H 1.0 1.8 6.5 5686 3946 D 84 LEU HG C 89 LEU HD21 1.0 1.8 6.5 5687 3947 C 46 TRP HZ3 D 68 ARG HDx 1.0 1.8 6.5 5688 3947 D 68 ARG HDy C 46 TRP HZ3 1.0 1.8 6.5 5689 3948 C 46 TRP HZ3 D 68 ARG HDx 1.0 1.8 6.5 5690 3948 D 68 ARG HDy C 46 TRP HZ3 1.0 1.8 6.5 5691 3949 C 49 VAL HB D 68 ARG HE 1.0 1.8 6.5 5692 3950 C 60 ARG HE D 68 ARG HE 1.0 1.8 6.5 5693 3951 C 45 ILE HD11 D 64 THR HG21 1.0 1.8 6.5 5694 3952 C 46 TRP HE3 D 68 ARG HBx 1.0 1.8 6.5 5695 3952 D 68 ARG HBy C 46 TRP HE3 1.0 1.8 6.5 5696 3953 C 89 LEU HA D 84 LEU HBx 1.0 1.8 6.5 5697 3953 C 89 LEU HA D 84 LEU HBy 1.0 1.8 6.5 5698 3954 C 49 VAL H D 68 ARG HGx 1.0 1.8 6.5 5699 3954 C 49 VAL H D 68 ARG HGy 1.0 1.8 6.5 5700 3955 C 45 ILE HG1x D 68 ARG HDx 1.0 1.8 6.5 5701 3955 C 45 ILE HG1y D 68 ARG HDx 1.0 1.8 6.5 5702 3955 D 68 ARG HDy C 45 ILE HG1x 1.0 1.8 6.5 5703 3955 C 45 ILE HG1y D 68 ARG HDy 1.0 1.8 6.5 5704 3956 C 59 ASP HBx D 63 VAL HG21 1.0 1.8 6.5 5705 3956 C 59 ASP HBy D 63 VAL HG21 1.0 1.8 6.5 5706 3956 D 63 VAL HG11 C 59 ASP HBx 1.0 1.8 6.5 5707 3956 C 59 ASP HBy D 63 VAL HG11 1.0 1.8 6.5 5708 3957 C 49 VAL HG21 D 73 GLN HBx 1.0 1.8 6.5 5709 3957 C 49 VAL HG11 D 73 GLN HBx 1.0 1.8 6.5 5710 3957 D 73 GLN HBy C 49 VAL HG21 1.0 1.8 6.5 5711 3957 C 49 VAL HG11 D 73 GLN HBy 1.0 1.8 6.5 5712 3958 C 46 TRP HE1 D 69 LYS HA 1.0 1.8 6.5 5713 3959 C 82 PHE HBx D 76 LYS HGx 1.0 1.8 6.5 5714 3959 C 82 PHE HBy D 76 LYS HGx 1.0 1.8 6.5 5715 3959 D 76 LYS HGy C 82 PHE HBy 1.0 1.8 6.5 5716 3959 C 82 PHE HBx D 76 LYS HGy 1.0 1.8 6.5 5717 3960 D 91 THR HB C 94 VAL HG11 1.0 1.8 6.5 5718 3960 C 94 VAL HG21 D 91 THR HB 1.0 1.8 6.5 5719 3961 C 92 ASP HBy D 89 LEU HD21 1.0 1.8 6.5 5720 3961 C 92 ASP HBx D 89 LEU HD21 1.0 1.8 6.5 5721 3961 D 89 LEU HD11 C 92 ASP HBx 1.0 1.8 6.5 5722 3961 C 92 ASP HBy D 89 LEU HD11 1.0 1.8 6.5 5723 3962 C 92 ASP HBy D 89 LEU HBx 1.0 1.8 6.5 5724 3962 C 92 ASP HBx D 89 LEU HBx 1.0 1.8 6.5 5725 3962 D 89 LEU HBy C 92 ASP HBx 1.0 1.8 6.5 5726 3962 C 92 ASP HBy D 89 LEU HBy 1.0 1.8 6.5 5727 3963 C 90 ALA HA D 91 THR HG21 1.0 1.8 6.5 5728 3964 D 1 SER H1 D 2 ALA H 1.0 1.8 5.5 5729 3965 D 1 SER HA D 1 SER HBx 1.0 1.8 3.5 5730 3965 D 1 SER HA D 1 SER HBy 1.0 1.8 3.5 5731 3966 D 2 ALA H D 1 SER HA 1.0 1.8 3.5 5732 3967 D 2 ALA H D 1 SER HBx 1.0 1.8 5.5 5733 3967 D 2 ALA H D 1 SER HBy 1.0 1.8 5.5 5734 3968 D 2 ALA H D 2 ALA HA 1.0 1.8 5.5 5735 3969 D 2 ALA H D 2 ALA HB1 1.0 1.8 4.5 5736 3970 D 2 ALA H D 5 GLU H 1.0 1.8 6.5 5737 3971 D 2 ALA H D 2 ALA HA 1.0 1.8 4.5 5738 3972 D 2 ALA HA D 2 ALA HB1 1.0 1.8 3.5 5739 3973 D 2 ALA H D 2 ALA HB1 1.0 1.8 3.5 5740 3974 D 2 ALA HA D 2 ALA HB1 1.0 1.8 3.5 5741 3975 D 2 ALA HB1 D 3 ASP H 1.0 1.8 3.5 5742 3976 D 2 ALA HB1 D 3 ASP H 1.0 1.8 4.5 5743 3977 D 3 ASP H D 3 ASP HA 1.0 1.8 4.5 5744 3978 D 3 ASP H D 3 ASP HA 1.0 1.8 4.5 5745 3979 D 3 ASP HA D 3 ASP HBx 1.0 1.8 3.5 5746 3979 D 3 ASP HA D 3 ASP HBy 1.0 1.8 3.5 5747 3980 D 4 HIS H D 3 ASP HA 1.0 1.8 5.5 5748 3981 D 3 ASP HA D 7 GLU H 1.0 1.8 5.5 5749 3982 D 2 ALA HB1 D 3 ASP HBx 1.0 1.8 5.5 5750 3982 D 2 ALA HB1 D 3 ASP HBy 1.0 1.8 5.5 5751 3983 D 4 HIS H D 3 ASP HBx 1.0 1.8 4.5 5752 3983 D 4 HIS H D 3 ASP HBy 1.0 1.8 4.5 5753 3984 D 4 HIS H D 2 ALA HB1 1.0 1.8 4.5 5754 3985 D 4 HIS H D 4 HIS HA 1.0 1.8 4.5 5755 3986 D 4 HIS H D 5 GLU H 1.0 1.8 3.5 5756 3987 D 4 HIS HA D 3 ASP HBx 1.0 1.8 5.5 5757 3987 D 3 ASP HBy D 4 HIS HA 1.0 1.8 5.5 5758 3988 D 4 HIS H D 4 HIS HA 1.0 1.8 4.5 5759 3989 D 5 GLU H D 4 HIS HA 1.0 1.8 5.5 5760 3990 D 4 HIS HA D 6 ARG H 1.0 1.8 5.5 5761 3991 D 4 HIS H D 4 HIS HBx 1.0 1.8 5.5 5762 3992 D 4 HIS HBx D 4 HIS HBy 1.0 1.8 3.5 5763 3993 D 5 GLU H D 4 HIS HBx 1.0 1.8 4.5 5764 3994 D 4 HIS H D 4 HIS HBy 1.0 1.8 3.5 5765 3995 D 5 GLU H D 4 HIS HBy 1.0 1.8 5.5 5766 3996 D 2 ALA HB1 D 4 HIS HD2 1.0 1.8 5.5 5767 3997 D 4 HIS H D 4 HIS HD2 1.0 1.8 5.5 5768 3998 D 2 ALA HB1 D 4 HIS HE1 1.0 1.8 4.5 5769 3999 D 5 GLU H D 4 HIS HE1 1.0 1.8 5.5 5770 4000 D 2 ALA HB1 D 5 GLU H 1.0 1.8 4.5 5771 4001 D 4 HIS H D 5 GLU H 1.0 1.8 3.5 5772 4002 D 5 GLU H D 5 GLU HA 1.0 1.8 4.5 5773 4003 D 5 GLU H D 5 GLU HA 1.0 1.8 4.5 5774 4004 D 6 ARG H D 5 GLU HA 1.0 1.8 5.5 5775 4005 D 5 GLU HA D 9 GLN H 1.0 1.8 5.5 5776 4006 D 2 ALA HB1 D 5 GLU HBx 1.0 1.8 3.5 5777 4006 D 2 ALA HB1 D 5 GLU HBy 1.0 1.8 3.5 5778 4007 D 5 GLU H D 5 GLU HBx 1.0 1.8 3.5 5779 4007 D 5 GLU H D 5 GLU HBy 1.0 1.8 3.5 5780 4008 D 5 GLU HBx D 5 GLU HGx 1.0 1.8 3.5 5781 4008 D 5 GLU HBy D 5 GLU HGx 1.0 1.8 3.5 5782 4008 D 5 GLU HGy D 5 GLU HBx 1.0 1.8 3.5 5783 4008 D 5 GLU HBy D 5 GLU HGy 1.0 1.8 3.5 5784 4009 D 2 ALA HB1 D 5 GLU HGx 1.0 1.8 4.5 5785 4009 D 2 ALA HB1 D 5 GLU HGy 1.0 1.8 4.5 5786 4010 D 5 GLU H D 5 GLU HGx 1.0 1.8 3.5 5787 4010 D 5 GLU H D 5 GLU HGy 1.0 1.8 3.5 5788 4011 D 5 GLU HBx D 5 GLU HGx 1.0 1.8 3.5 5789 4011 D 5 GLU HBy D 5 GLU HGx 1.0 1.8 3.5 5790 4011 D 5 GLU HGy D 5 GLU HBx 1.0 1.8 3.5 5791 4011 D 5 GLU HBy D 5 GLU HGy 1.0 1.8 3.5 5792 4012 D 6 ARG H D 5 GLU HGx 1.0 1.8 5.5 5793 4012 D 6 ARG H D 5 GLU HGy 1.0 1.8 5.5 5794 4013 D 2 ALA HB1 D 6 ARG H 1.0 1.8 5.5 5795 4014 D 4 HIS H D 6 ARG H 1.0 1.8 5.5 5796 4015 D 6 ARG H D 5 GLU HA 1.0 1.8 5.5 5797 4016 D 6 ARG H D 6 ARG HA 1.0 1.8 4.5 5798 4017 D 6 ARG HA D 8 ALA H 1.0 1.8 5.5 5799 4018 D 6 ARG H D 6 ARG HBx 1.0 1.8 4.5 5800 4018 D 6 ARG H D 6 ARG HBy 1.0 1.8 4.5 5801 4019 D 6 ARG H D 6 ARG HDx 1.0 1.8 5.5 5802 4019 D 6 ARG H D 6 ARG HDy 1.0 1.8 5.5 5803 4020 D 6 ARG H D 6 ARG HGx 1.0 1.8 5.5 5804 4020 D 6 ARG H D 6 ARG HGy 1.0 1.8 5.5 5805 4021 D 6 ARG HH1% D 6 ARG HE 1.0 1.8 5.5 5806 4022 D 7 GLU H D 5 GLU HA 1.0 1.8 5.5 5807 4023 D 7 GLU HA D 10 LYS H 1.0 1.8 5.5 5808 4024 D 7 GLU HA D 11 ALA H 1.0 1.8 5.5 5809 4025 D 7 GLU H D 7 GLU HA 1.0 1.8 3.5 5810 4026 D 8 ALA H D 7 GLU HA 1.0 1.8 5.5 5811 4027 D 7 GLU H D 7 GLU HBx 1.0 1.8 3.5 5812 4027 D 7 GLU H D 7 GLU HBy 1.0 1.8 3.5 5813 4028 D 7 GLU HBx D 7 GLU HGx 1.0 1.8 3.5 5814 4028 D 7 GLU HBy D 7 GLU HGx 1.0 1.8 3.5 5815 4028 D 7 GLU HGy D 7 GLU HBx 1.0 1.8 3.5 5816 4028 D 7 GLU HBy D 7 GLU HGy 1.0 1.8 3.5 5817 4029 D 8 ALA H D 7 GLU HBx 1.0 1.8 3.5 5818 4029 D 8 ALA H D 7 GLU HBy 1.0 1.8 3.5 5819 4030 D 8 ALA HA D 7 GLU HBx 1.0 1.8 5.5 5820 4030 D 7 GLU HBy D 8 ALA HA 1.0 1.8 5.5 5821 4031 D 7 GLU HGy D 10 LYS HBx 1.0 1.8 4.5 5822 4031 D 10 LYS HBy D 7 GLU HGx 1.0 1.8 4.5 5823 4031 D 7 GLU HGy D 10 LYS HBy 1.0 1.8 4.5 5824 4031 D 7 GLU HGx D 10 LYS HBx 1.0 1.8 4.5 5825 4032 D 11 ALA H D 7 GLU HGx 1.0 1.8 5.5 5826 4032 D 11 ALA H D 7 GLU HGy 1.0 1.8 5.5 5827 4033 D 7 GLU H D 7 GLU HGx 1.0 1.8 5.5 5828 4033 D 7 GLU H D 7 GLU HGy 1.0 1.8 5.5 5829 4034 D 8 ALA H D 7 GLU HGx 1.0 1.8 5.5 5830 4034 D 8 ALA H D 7 GLU HGy 1.0 1.8 5.5 5831 4035 D 5 GLU HA D 8 ALA H 1.0 1.8 5.5 5832 4036 D 8 ALA H D 7 GLU HA 1.0 1.8 5.5 5833 4037 D 8 ALA H D 8 ALA HA 1.0 1.8 4.5 5834 4038 D 8 ALA HA D 12 GLU H 1.0 1.8 5.5 5835 4039 D 9 GLN H D 8 ALA HA 1.0 1.8 5.5 5836 4040 D 8 ALA H D 8 ALA HB1 1.0 1.8 3.5 5837 4041 D 5 GLU HA D 9 GLN H 1.0 1.8 5.5 5838 4042 D 9 GLN H D 8 ALA H 1.0 1.8 4.5 5839 4043 D 9 GLN H D 8 ALA HA 1.0 1.8 5.5 5840 4044 D 10 LYS H D 9 GLN HA 1.0 1.8 4.5 5841 4045 D 8 ALA HB1 D 9 GLN HA 1.0 1.8 5.5 5842 4046 D 9 GLN HE2x D 9 GLN HE2y 1.0 1.8 3.5 5843 4047 D 9 GLN HE2x D 9 GLN HE2y 1.0 1.8 3.5 5844 4048 D 9 GLN HE2x D 9 GLN HBx 1.0 1.8 4.5 5845 4048 D 9 GLN HE2x D 9 GLN HBy 1.0 1.8 4.5 5846 4049 D 9 GLN HE2y D 9 GLN HBx 1.0 1.8 4.5 5847 4049 D 9 GLN HE2y D 9 GLN HBy 1.0 1.8 4.5 5848 4050 D 9 GLN HE2x D 9 GLN HGx 1.0 1.8 4.5 5849 4050 D 9 GLN HE2x D 9 GLN HGy 1.0 1.8 4.5 5850 4051 D 9 GLN HE2y D 9 GLN HGx 1.0 1.8 4.5 5851 4051 D 9 GLN HE2y D 9 GLN HGy 1.0 1.8 4.5 5852 4052 D 9 GLN HBx D 9 GLN HGx 1.0 1.8 3.5 5853 4052 D 9 GLN HBy D 9 GLN HGx 1.0 1.8 3.5 5854 4052 D 9 GLN HGy D 9 GLN HBx 1.0 1.8 3.5 5855 4052 D 9 GLN HBy D 9 GLN HGy 1.0 1.8 3.5 5856 4053 D 10 LYS HBy D 10 LYS HGx 1.0 1.8 4.5 5857 4053 D 10 LYS HBx D 10 LYS HGx 1.0 1.8 4.5 5858 4053 D 10 LYS HGy D 10 LYS HBx 1.0 1.8 4.5 5859 4053 D 10 LYS HBy D 10 LYS HGy 1.0 1.8 4.5 5860 4054 D 11 ALA H D 11 ALA HA 1.0 1.8 4.5 5861 4055 D 11 ALA H D 11 ALA HA 1.0 1.8 4.5 5862 4056 D 11 ALA HA D 14 GLU H 1.0 1.8 4.5 5863 4057 D 11 ALA H D 11 ALA HB1 1.0 1.8 3.5 5864 4058 D 8 ALA HA D 11 ALA HB1 1.0 1.8 3.5 5865 4059 D 12 GLU H D 11 ALA HA 1.0 1.8 4.5 5866 4060 D 8 ALA HA D 12 GLU H 1.0 1.8 5.5 5867 4061 D 12 GLU H D 12 GLU HA 1.0 1.8 4.5 5868 4062 D 12 GLU HA D 15 LEU H 1.0 1.8 5.5 5869 4063 D 12 GLU HA D 15 LEU HBx 1.0 1.8 5.5 5870 4064 D 12 GLU H D 12 GLU HBx 1.0 1.8 3.5 5871 4064 D 12 GLU H D 12 GLU HBy 1.0 1.8 3.5 5872 4065 D 12 GLU H D 12 GLU HGx 1.0 1.8 4.5 5873 4065 D 12 GLU H D 12 GLU HGy 1.0 1.8 4.5 5874 4066 D 13 GLU H D 12 GLU HGx 1.0 1.8 5.5 5875 4066 D 12 GLU HGy D 13 GLU H 1.0 1.8 5.5 5876 4067 D 13 GLU H D 10 LYS HA 1.0 1.8 4.5 5877 4068 D 11 ALA H D 13 GLU H 1.0 1.8 5.5 5878 4069 D 14 GLU H D 13 GLU H 1.0 1.8 4.5 5879 4070 D 13 GLU H D 13 GLU HA 1.0 1.8 4.5 5880 4071 D 13 GLU H D 13 GLU HBx 1.0 1.8 3.5 5881 4071 D 13 GLU H D 13 GLU HBy 1.0 1.8 3.5 5882 4072 D 13 GLU HBx D 13 GLU HGx 1.0 1.8 3.5 5883 4072 D 13 GLU HBy D 13 GLU HGx 1.0 1.8 3.5 5884 4072 D 13 GLU HGy D 13 GLU HBx 1.0 1.8 3.5 5885 4072 D 13 GLU HBy D 13 GLU HGy 1.0 1.8 3.5 5886 4073 D 13 GLU H D 13 GLU HGx 1.0 1.8 5.5 5887 4073 D 13 GLU H D 13 GLU HGy 1.0 1.8 5.5 5888 4074 D 11 ALA HA D 14 GLU H 1.0 1.8 4.5 5889 4075 D 14 GLU H D 14 GLU HA 1.0 1.8 3.5 5890 4076 D 14 GLU HA D 17 LYS H 1.0 1.8 5.5 5891 4077 D 14 GLU H D 14 GLU HBx 1.0 1.8 3.5 5892 4077 D 14 GLU H D 14 GLU HBy 1.0 1.8 3.5 5893 4078 D 14 GLU H D 14 GLU HGx 1.0 1.8 5.5 5894 4078 D 14 GLU H D 14 GLU HGy 1.0 1.8 5.5 5895 4079 D 12 GLU HA D 15 LEU H 1.0 1.8 5.5 5896 4080 D 15 LEU H D 15 LEU HA 1.0 1.8 4.5 5897 4081 D 15 LEU H D 15 LEU HA 1.0 1.8 3.5 5898 4082 D 15 LEU HBx D 15 LEU HA 1.0 1.8 4.5 5899 4083 D 15 LEU HA D 19 LEU H 1.0 1.8 5.5 5900 4084 D 15 LEU H D 15 LEU HBy 1.0 1.8 3.5 5901 4085 D 19 LEU H D 15 LEU HG 1.0 1.8 5.5 5902 4086 D 15 LEU H D 15 LEU HD11 1.0 1.8 4.5 5903 4087 D 15 LEU HA D 16 GLN H 1.0 1.8 5.5 5904 4088 D 16 GLN H D 16 GLN HE2x 1.0 1.8 5.5 5905 4089 D 15 LEU HBy D 16 GLN HA 1.0 1.8 5.5 5906 4090 D 17 LYS H D 16 GLN HA 1.0 1.8 5.5 5907 4091 D 16 GLN HA D 20 GLU H 1.0 1.8 5.5 5908 4092 D 16 GLN HE2x D 16 GLN HE2y 1.0 1.8 3.5 5909 4093 D 16 GLN H D 16 GLN HBx 1.0 1.8 3.5 5910 4093 D 16 GLN H D 16 GLN HBy 1.0 1.8 3.5 5911 4094 D 16 GLN HA D 16 GLN HBx 1.0 1.8 4.5 5912 4094 D 16 GLN HA D 16 GLN HBy 1.0 1.8 4.5 5913 4095 D 16 GLN HE2x D 16 GLN HBx 1.0 1.8 4.5 5914 4095 D 16 GLN HE2x D 16 GLN HBy 1.0 1.8 4.5 5915 4096 D 16 GLN HE2y D 16 GLN HBx 1.0 1.8 4.5 5916 4096 D 16 GLN HE2y D 16 GLN HBy 1.0 1.8 4.5 5917 4097 D 16 GLN HBy D 16 GLN HGx 1.0 1.8 3.5 5918 4097 D 16 GLN HBx D 16 GLN HGx 1.0 1.8 3.5 5919 4097 D 16 GLN HGy D 16 GLN HBx 1.0 1.8 3.5 5920 4097 D 16 GLN HBy D 16 GLN HGy 1.0 1.8 3.5 5921 4098 D 16 GLN HBx D 20 GLU HGx 1.0 1.8 4.5 5922 4098 D 16 GLN HBy D 20 GLU HGx 1.0 1.8 4.5 5923 4098 D 20 GLU HGy D 16 GLN HBx 1.0 1.8 4.5 5924 4098 D 16 GLN HBy D 20 GLU HGy 1.0 1.8 4.5 5925 4099 D 16 GLN H D 16 GLN HGx 1.0 1.8 3.5 5926 4099 D 16 GLN H D 16 GLN HGy 1.0 1.8 3.5 5927 4100 D 16 GLN HE2y D 16 GLN HGx 1.0 1.8 4.5 5928 4100 D 16 GLN HE2y D 16 GLN HGy 1.0 1.8 4.5 5929 4101 D 14 GLU HA D 17 LYS H 1.0 1.8 5.5 5930 4102 D 17 LYS H D 15 LEU HA 1.0 1.8 5.5 5931 4103 D 17 LYS H D 17 LYS HA 1.0 1.8 4.5 5932 4104 D 17 LYS HA D 18 VAL H 1.0 1.8 5.5 5933 4105 D 20 GLU H D 17 LYS HA 1.0 1.8 5.5 5934 4106 D 17 LYS H D 17 LYS HBx 1.0 1.8 3.5 5935 4106 D 17 LYS H D 17 LYS HBy 1.0 1.8 3.5 5936 4107 D 17 LYS H D 17 LYS HDx 1.0 1.8 5.5 5937 4107 D 17 LYS H D 17 LYS HDy 1.0 1.8 5.5 5938 4108 D 17 LYS HBx D 17 LYS HDx 1.0 1.8 4.5 5939 4108 D 17 LYS HBy D 17 LYS HDx 1.0 1.8 4.5 5940 4108 D 17 LYS HDy D 17 LYS HBx 1.0 1.8 4.5 5941 4108 D 17 LYS HBy D 17 LYS HDy 1.0 1.8 4.5 5942 4109 D 18 VAL H D 17 LYS HDx 1.0 1.8 5.5 5943 4109 D 18 VAL H D 17 LYS HDy 1.0 1.8 5.5 5944 4110 D 17 LYS HEy D 17 LYS HGx 1.0 1.8 4.5 5945 4110 D 17 LYS HEx D 17 LYS HGx 1.0 1.8 4.5 5946 4110 D 17 LYS HGy D 17 LYS HEx 1.0 1.8 4.5 5947 4110 D 17 LYS HEy D 17 LYS HGy 1.0 1.8 4.5 5948 4111 D 17 LYS H D 17 LYS HGx 1.0 1.8 5.5 5949 4111 D 17 LYS H D 17 LYS HGy 1.0 1.8 5.5 5950 4112 D 15 LEU HA D 18 VAL H 1.0 1.8 4.5 5951 4113 D 19 LEU H D 18 VAL H 1.0 1.8 3.5 5952 4114 D 18 VAL H D 18 VAL HA 1.0 1.8 3.5 5953 4115 D 18 VAL H D 18 VAL HB 1.0 1.8 3.5 5954 4116 D 19 LEU H D 18 VAL HB 1.0 1.8 3.5 5955 4117 D 17 LYS HGx D 18 VAL HG11 1.0 1.8 5.5 5956 4117 D 17 LYS HGy D 18 VAL HG11 1.0 1.8 5.5 5957 4117 D 18 VAL HG21 D 17 LYS HGx 1.0 1.8 5.5 5958 4117 D 17 LYS HGy D 18 VAL HG21 1.0 1.8 5.5 5959 4118 D 18 VAL H D 18 VAL HG11 1.0 1.8 3.5 5960 4118 D 18 VAL H D 18 VAL HG21 1.0 1.8 3.5 5961 4119 D 15 LEU HA D 19 LEU H 1.0 1.8 5.5 5962 4120 D 19 LEU H D 18 VAL H 1.0 1.8 3.5 5963 4121 D 19 LEU H D 19 LEU HA 1.0 1.8 4.5 5964 4122 D 20 GLU H D 19 LEU HA 1.0 1.8 5.5 5965 4123 D 18 VAL H D 19 LEU HG 1.0 1.8 5.5 5966 4124 D 19 LEU H D 19 LEU HG 1.0 1.8 3.5 5967 4125 D 15 LEU HD11 D 19 LEU HBx 1.0 1.8 5.5 5968 4125 D 15 LEU HD11 D 19 LEU HBy 1.0 1.8 5.5 5969 4126 D 19 LEU HD11 D 19 LEU HBx 1.0 1.8 4.5 5970 4126 D 19 LEU HBy D 19 LEU HD11 1.0 1.8 4.5 5971 4127 D 20 GLU H D 19 LEU HD11 1.0 1.8 5.5 5972 4128 D 19 LEU H D 19 LEU HD21 1.0 1.8 4.5 5973 4129 D 20 GLU H D 20 GLU HA 1.0 1.8 3.5 5974 4130 D 20 GLU H D 20 GLU HA 1.0 1.8 3.5 5975 4131 D 20 GLU H D 20 GLU HBx 1.0 1.8 3.5 5976 4131 D 20 GLU H D 20 GLU HBy 1.0 1.8 3.5 5977 4132 D 20 GLU HBy D 20 GLU HGx 1.0 1.8 3.5 5978 4132 D 20 GLU HBx D 20 GLU HGx 1.0 1.8 3.5 5979 4132 D 20 GLU HGy D 20 GLU HBx 1.0 1.8 3.5 5980 4132 D 20 GLU HGy D 20 GLU HBy 1.0 1.8 3.5 5981 4133 D 21 GLU H D 20 GLU HBx 1.0 1.8 3.5 5982 4133 D 20 GLU HBy D 21 GLU H 1.0 1.8 3.5 5983 4134 D 21 GLU HA D 20 GLU HBx 1.0 1.8 5.5 5984 4134 D 20 GLU HBy D 21 GLU HA 1.0 1.8 5.5 5985 4135 D 20 GLU H D 20 GLU HGx 1.0 1.8 3.5 5986 4135 D 20 GLU H D 20 GLU HGy 1.0 1.8 3.5 5987 4136 D 20 GLU HA D 21 GLU H 1.0 1.8 5.5 5988 4137 D 21 GLU H D 21 GLU HA 1.0 1.8 3.5 5989 4138 D 21 GLU HA D 22 ALA H 1.0 1.8 5.5 5990 4139 D 21 GLU HA D 25 LYS H 1.0 1.8 5.5 5991 4140 D 21 GLU HA D 21 GLU HBx 1.0 1.8 4.5 5992 4140 D 21 GLU HA D 21 GLU HBy 1.0 1.8 4.5 5993 4141 D 22 ALA H D 21 GLU HBx 1.0 1.8 3.5 5994 4141 D 22 ALA H D 21 GLU HBy 1.0 1.8 3.5 5995 4142 D 22 ALA H D 21 GLU HGx 1.0 1.8 4.5 5996 4142 D 22 ALA H D 21 GLU HGy 1.0 1.8 4.5 5997 4143 D 22 ALA H D 22 ALA HA 1.0 1.8 3.5 5998 4144 D 22 ALA HA D 22 ALA HB1 1.0 1.8 4.5 5999 4145 D 22 ALA HA D 23 SER H 1.0 1.8 5.5 6000 4146 D 25 LYS H D 22 ALA HA 1.0 1.8 4.5 6001 4147 D 22 ALA HA D 26 ALA H 1.0 1.8 5.5 6002 4148 D 22 ALA H D 22 ALA HB1 1.0 1.8 3.5 6003 4149 D 22 ALA HB1 D 23 SER H 1.0 1.8 3.5 6004 4150 D 23 SER H D 23 SER HA 1.0 1.8 4.5 6005 4151 D 23 SER HA D 24 LYS H 1.0 1.8 5.5 6006 4152 D 23 SER HA D 26 ALA HB1 1.0 1.8 3.5 6007 4153 D 23 SER H D 23 SER HBx 1.0 1.8 3.5 6008 4153 D 23 SER H D 23 SER HBy 1.0 1.8 3.5 6009 4154 D 24 LYS H D 23 SER HBx 1.0 1.8 4.5 6010 4154 D 24 LYS H D 23 SER HBy 1.0 1.8 4.5 6011 4155 D 23 SER HBx D 24 LYS HBx 1.0 1.8 4.5 6012 4155 D 23 SER HBy D 24 LYS HBx 1.0 1.8 4.5 6013 4155 D 24 LYS HBy D 23 SER HBx 1.0 1.8 4.5 6014 4155 D 23 SER HBy D 24 LYS HBy 1.0 1.8 4.5 6015 4156 D 24 LYS H D 24 LYS HA 1.0 1.8 4.5 6016 4157 D 24 LYS H D 24 LYS HA 1.0 1.8 3.5 6017 4158 D 25 LYS H D 24 LYS HA 1.0 1.8 5.5 6018 4159 D 24 LYS H D 24 LYS HBx 1.0 1.8 3.5 6019 4159 D 24 LYS H D 24 LYS HBy 1.0 1.8 3.5 6020 4160 D 25 LYS H D 24 LYS HBx 1.0 1.8 3.5 6021 4160 D 25 LYS H D 24 LYS HBy 1.0 1.8 3.5 6022 4161 D 24 LYS H D 24 LYS HDx 1.0 1.8 5.5 6023 4161 D 24 LYS H D 24 LYS HDy 1.0 1.8 5.5 6024 4162 D 25 LYS H D 24 LYS HDx 1.0 1.8 3.5 6025 4162 D 25 LYS H D 24 LYS HDy 1.0 1.8 3.5 6026 4163 D 24 LYS H D 24 LYS HGx 1.0 1.8 5.5 6027 4163 D 24 LYS H D 24 LYS HGy 1.0 1.8 5.5 6028 4164 D 25 LYS H D 24 LYS HGx 1.0 1.8 5.5 6029 4164 D 25 LYS H D 24 LYS HGy 1.0 1.8 5.5 6030 4165 D 27 VAL HB D 24 LYS HGx 1.0 1.8 5.5 6031 4165 D 24 LYS HGy D 27 VAL HB 1.0 1.8 5.5 6032 4166 D 25 LYS H D 24 LYS HA 1.0 1.8 5.5 6033 4167 D 25 LYS H D 25 LYS HA 1.0 1.8 3.5 6034 4168 D 26 ALA H D 25 LYS HA 1.0 1.8 5.5 6035 4169 D 25 LYS HA D 28 GLU H 1.0 1.8 4.5 6036 4170 D 25 LYS HA D 29 ALA H 1.0 1.8 5.5 6037 4171 D 25 LYS H D 25 LYS HBx 1.0 1.8 3.5 6038 4171 D 25 LYS H D 25 LYS HBy 1.0 1.8 3.5 6039 4172 D 26 ALA H D 25 LYS HBx 1.0 1.8 4.5 6040 4172 D 26 ALA H D 25 LYS HBy 1.0 1.8 4.5 6041 4173 D 25 LYS H D 25 LYS HDx 1.0 1.8 5.5 6042 4173 D 25 LYS H D 25 LYS HDy 1.0 1.8 5.5 6043 4174 D 24 LYS HDx D 25 LYS HEx 1.0 1.8 4.5 6044 4174 D 24 LYS HDy D 25 LYS HEx 1.0 1.8 4.5 6045 4174 D 25 LYS HEy D 24 LYS HDx 1.0 1.8 4.5 6046 4174 D 24 LYS HDy D 25 LYS HEy 1.0 1.8 4.5 6047 4175 D 25 LYS HDy D 25 LYS HEx 1.0 1.8 4.5 6048 4175 D 25 LYS HDx D 25 LYS HEx 1.0 1.8 4.5 6049 4175 D 25 LYS HEy D 25 LYS HDx 1.0 1.8 4.5 6050 4175 D 25 LYS HDy D 25 LYS HEy 1.0 1.8 4.5 6051 4176 D 25 LYS HEy D 25 LYS HGx 1.0 1.8 4.5 6052 4176 D 25 LYS HGy D 25 LYS HEx 1.0 1.8 4.5 6053 4176 D 25 LYS HEy D 25 LYS HGy 1.0 1.8 4.5 6054 4176 D 25 LYS HEx D 25 LYS HGx 1.0 1.8 4.5 6055 4177 D 25 LYS H D 25 LYS HGx 1.0 1.8 3.5 6056 4177 D 25 LYS H D 25 LYS HGy 1.0 1.8 3.5 6057 4178 D 26 ALA H D 26 ALA HA 1.0 1.8 4.5 6058 4179 D 26 ALA HA D 27 VAL H 1.0 1.8 5.5 6059 4180 D 29 ALA H D 26 ALA HA 1.0 1.8 5.5 6060 4181 D 26 ALA H D 26 ALA HB1 1.0 1.8 3.5 6061 4182 D 26 ALA HB1 D 27 VAL H 1.0 1.8 3.5 6062 4183 D 24 LYS HA D 27 VAL H 1.0 1.8 5.5 6063 4184 D 26 ALA HA D 27 VAL H 1.0 1.8 5.5 6064 4185 D 26 ALA HB1 D 27 VAL H 1.0 1.8 4.5 6065 4186 D 27 VAL H D 27 VAL HA 1.0 1.8 4.5 6066 4187 D 28 GLU H D 27 VAL H 1.0 1.8 3.5 6067 4188 D 29 ALA H D 27 VAL H 1.0 1.8 5.5 6068 4189 D 27 VAL H D 27 VAL HA 1.0 1.8 3.5 6069 4190 D 27 VAL HB D 24 LYS HGx 1.0 1.8 5.5 6070 4190 D 24 LYS HGy D 27 VAL HB 1.0 1.8 5.5 6071 4191 D 27 VAL HB D 27 VAL H 1.0 1.8 3.5 6072 4192 D 27 VAL HB D 28 GLU H 1.0 1.8 3.5 6073 4193 D 26 ALA HB1 D 27 VAL HG11 1.0 1.8 4.5 6074 4193 D 26 ALA HB1 D 27 VAL HG21 1.0 1.8 4.5 6075 4194 D 27 VAL H D 27 VAL HG11 1.0 1.8 3.5 6076 4194 D 27 VAL H D 27 VAL HG21 1.0 1.8 3.5 6077 4195 D 25 LYS HA D 28 GLU H 1.0 1.8 4.5 6078 4196 D 28 GLU H D 27 VAL HA 1.0 1.8 4.5 6079 4197 D 28 GLU H D 28 GLU HA 1.0 1.8 3.5 6080 4198 D 29 ALA H D 28 GLU HA 1.0 1.8 5.5 6081 4199 D 24 LYS HEx D 28 GLU HBx 1.0 1.8 5.5 6082 4199 D 24 LYS HEy D 28 GLU HBx 1.0 1.8 5.5 6083 4199 D 28 GLU HBy D 24 LYS HEx 1.0 1.8 5.5 6084 4199 D 28 GLU HBy D 24 LYS HEy 1.0 1.8 5.5 6085 4200 D 24 LYS HGx D 28 GLU HBx 1.0 1.8 5.5 6086 4200 D 24 LYS HGy D 28 GLU HBx 1.0 1.8 5.5 6087 4200 D 28 GLU HBy D 24 LYS HGx 1.0 1.8 5.5 6088 4200 D 24 LYS HGy D 28 GLU HBy 1.0 1.8 5.5 6089 4201 D 25 LYS HGy D 28 GLU HBx 1.0 1.8 5.5 6090 4201 D 28 GLU HBy D 25 LYS HGx 1.0 1.8 5.5 6091 4201 D 25 LYS HGy D 28 GLU HBy 1.0 1.8 5.5 6092 4201 D 25 LYS HGx D 28 GLU HBx 1.0 1.8 5.5 6093 4202 D 28 GLU H D 28 GLU HBx 1.0 1.8 3.5 6094 4202 D 28 GLU H D 28 GLU HBy 1.0 1.8 3.5 6095 4203 D 28 GLU HBx D 28 GLU HGx 1.0 1.8 3.5 6096 4203 D 28 GLU HBy D 28 GLU HGx 1.0 1.8 3.5 6097 4203 D 28 GLU HGy D 28 GLU HBx 1.0 1.8 3.5 6098 4203 D 28 GLU HBy D 28 GLU HGy 1.0 1.8 3.5 6099 4204 D 29 ALA H D 28 GLU HBx 1.0 1.8 3.5 6100 4204 D 29 ALA H D 28 GLU HBy 1.0 1.8 3.5 6101 4205 D 29 ALA HA D 28 GLU HBx 1.0 1.8 5.5 6102 4205 D 28 GLU HBy D 29 ALA HA 1.0 1.8 5.5 6103 4206 D 29 ALA H D 28 GLU HGx 1.0 1.8 5.5 6104 4206 D 29 ALA H D 28 GLU HGy 1.0 1.8 5.5 6105 4207 D 29 ALA H D 27 VAL HA 1.0 1.8 5.5 6106 4208 D 29 ALA H D 29 ALA HA 1.0 1.8 4.5 6107 4209 D 29 ALA H D 29 ALA HA 1.0 1.8 4.5 6108 4210 D 29 ALA HA D 30 GLU H 1.0 1.8 5.5 6109 4211 D 29 ALA H D 29 ALA HB1 1.0 1.8 3.5 6110 4212 D 30 GLU HA D 31 ARG H 1.0 1.8 5.5 6111 4213 D 30 GLU HA D 33 ALA HB1 1.0 1.8 4.5 6112 4214 D 30 GLU H D 30 GLU HBx 1.0 1.8 3.5 6113 4214 D 30 GLU H D 30 GLU HBy 1.0 1.8 3.5 6114 4215 D 30 GLU HBx D 30 GLU HGx 1.0 1.8 3.5 6115 4215 D 30 GLU HBy D 30 GLU HGx 1.0 1.8 3.5 6116 4215 D 30 GLU HGy D 30 GLU HBx 1.0 1.8 3.5 6117 4215 D 30 GLU HBy D 30 GLU HGy 1.0 1.8 3.5 6118 4216 D 31 ARG H D 30 GLU HGx 1.0 1.8 5.5 6119 4216 D 31 ARG H D 30 GLU HGy 1.0 1.8 5.5 6120 4217 D 30 GLU HA D 31 ARG H 1.0 1.8 5.5 6121 4218 D 31 ARG H D 31 ARG HE 1.0 1.8 6.5 6122 4219 D 31 ARG H D 31 ARG HA 1.0 1.8 4.5 6123 4220 D 31 ARG HA D 31 ARG HBx 1.0 1.8 4.5 6124 4220 D 31 ARG HA D 31 ARG HBy 1.0 1.8 4.5 6125 4221 D 31 ARG HA D 32 GLY H 1.0 1.8 3.5 6126 4222 D 31 ARG HE D 31 ARG HDx 1.0 1.8 3.5 6127 4222 D 31 ARG HE D 31 ARG HDy 1.0 1.8 3.5 6128 4223 D 31 ARG H D 31 ARG HBx 1.0 1.8 3.5 6129 4223 D 31 ARG H D 31 ARG HBy 1.0 1.8 3.5 6130 4224 D 31 ARG HE D 31 ARG HBx 1.0 1.8 5.5 6131 4224 D 31 ARG HE D 31 ARG HBy 1.0 1.8 5.5 6132 4225 D 31 ARG HBy D 31 ARG HGx 1.0 1.8 3.5 6133 4225 D 31 ARG HBx D 31 ARG HGx 1.0 1.8 3.5 6134 4225 D 31 ARG HGy D 31 ARG HBx 1.0 1.8 3.5 6135 4225 D 31 ARG HBy D 31 ARG HGy 1.0 1.8 3.5 6136 4226 D 31 ARG H D 31 ARG HDx 1.0 1.8 5.5 6137 4226 D 31 ARG H D 31 ARG HDy 1.0 1.8 5.5 6138 4227 D 31 ARG HE D 31 ARG HDx 1.0 1.8 3.5 6139 4227 D 31 ARG HE D 31 ARG HDy 1.0 1.8 3.5 6140 4228 D 32 GLY H D 31 ARG HDx 1.0 1.8 4.5 6141 4228 D 32 GLY H D 31 ARG HDy 1.0 1.8 4.5 6142 4229 D 31 ARG H D 31 ARG HGx 1.0 1.8 3.5 6143 4229 D 31 ARG H D 31 ARG HGy 1.0 1.8 3.5 6144 4230 D 31 ARG HE D 31 ARG HGx 1.0 1.8 3.5 6145 4230 D 31 ARG HE D 31 ARG HGy 1.0 1.8 3.5 6146 4231 D 32 GLY H D 31 ARG HGx 1.0 1.8 5.5 6147 4231 D 32 GLY H D 31 ARG HGy 1.0 1.8 5.5 6148 4232 D 31 ARG HE D 31 ARG HH1% 1.0 1.8 4.5 6149 4233 D 31 ARG HE D 31 ARG HH2% 1.0 1.8 4.5 6150 4234 D 32 GLY H D 31 ARG HDx 1.0 1.8 5.5 6151 4234 D 32 GLY H D 31 ARG HDy 1.0 1.8 5.5 6152 4235 D 32 GLY H D 32 GLY HAx 1.0 1.8 4.5 6153 4235 D 32 GLY H D 32 GLY HAy 1.0 1.8 4.5 6154 4236 D 31 ARG HBx D 32 GLY HAx 1.0 1.8 4.5 6155 4236 D 31 ARG HBy D 32 GLY HAx 1.0 1.8 4.5 6156 4236 D 32 GLY HAy D 31 ARG HBx 1.0 1.8 4.5 6157 4236 D 31 ARG HBy D 32 GLY HAy 1.0 1.8 4.5 6158 4237 D 32 GLY H D 32 GLY HAx 1.0 1.8 3.5 6159 4237 D 32 GLY H D 32 GLY HAy 1.0 1.8 3.5 6160 4238 D 33 ALA H D 32 GLY HAx 1.0 1.8 3.5 6161 4238 D 32 GLY HAy D 33 ALA H 1.0 1.8 3.5 6162 4239 D 33 ALA H D 32 GLY HAx 1.0 1.8 4.5 6163 4239 D 32 GLY HAy D 33 ALA H 1.0 1.8 4.5 6164 4240 D 33 ALA H D 33 ALA HA 1.0 1.8 4.5 6165 4241 D 33 ALA HB1 D 33 ALA HA 1.0 1.8 3.5 6166 4242 D 33 ALA HA D 34 PRO HDx 1.0 1.8 4.5 6167 4243 D 33 ALA HB1 D 33 ALA H 1.0 1.8 3.5 6168 4244 D 33 ALA HB1 D 36 ALA HA 1.0 1.8 5.5 6169 4245 D 34 PRO HDx D 34 PRO HA 1.0 1.8 5.5 6170 4246 D 33 ALA HB1 D 34 PRO HDx 1.0 1.8 3.5 6171 4247 D 33 ALA HB1 D 34 PRO HDy 1.0 1.8 5.5 6172 4248 D 35 GLY H D 34 PRO HBx 1.0 1.8 4.5 6173 4248 D 34 PRO HBy D 35 GLY H 1.0 1.8 4.5 6174 4249 D 33 ALA HB1 D 34 PRO HGx 1.0 1.8 5.5 6175 4249 D 33 ALA HB1 D 34 PRO HGy 1.0 1.8 5.5 6176 4250 D 34 PRO HBx D 34 PRO HGx 1.0 1.8 3.5 6177 4250 D 34 PRO HBy D 34 PRO HGx 1.0 1.8 3.5 6178 4250 D 34 PRO HGy D 34 PRO HBx 1.0 1.8 3.5 6179 4250 D 34 PRO HBy D 34 PRO HGy 1.0 1.8 3.5 6180 4251 D 34 PRO HA D 35 GLY H 1.0 1.8 5.5 6181 4252 D 35 GLY H D 36 ALA H 1.0 1.8 5.5 6182 4253 D 35 GLY H D 35 GLY HAx 1.0 1.8 3.5 6183 4253 D 35 GLY H D 35 GLY HAy 1.0 1.8 3.5 6184 4254 D 36 ALA H D 35 GLY HAx 1.0 1.8 3.5 6185 4254 D 36 ALA H D 35 GLY HAy 1.0 1.8 3.5 6186 4255 D 36 ALA H D 35 GLY HAx 1.0 1.8 4.5 6187 4255 D 36 ALA H D 35 GLY HAy 1.0 1.8 4.5 6188 4256 D 33 ALA HB1 D 36 ALA HA 1.0 1.8 5.5 6189 4257 D 36 ALA HA D 36 ALA H 1.0 1.8 4.5 6190 4258 D 36 ALA H D 36 ALA HB1 1.0 1.8 3.5 6191 4259 D 36 ALA HB1 D 37 ALA H 1.0 1.8 4.5 6192 4260 D 36 ALA HA D 37 ALA H 1.0 1.8 4.5 6193 4261 D 37 ALA H D 37 ALA HA 1.0 1.8 4.5 6194 4262 D 36 ALA HA D 37 ALA HB1 1.0 1.8 5.5 6195 4263 D 37 ALA H D 37 ALA HB1 1.0 1.8 4.5 6196 4264 D 38 LEU HA D 38 LEU H 1.0 1.8 4.5 6197 4265 D 38 LEU HA D 38 LEU HBx 1.0 1.8 4.5 6198 4265 D 38 LEU HA D 38 LEU HBy 1.0 1.8 4.5 6199 4266 D 38 LEU H D 38 LEU HG 1.0 1.8 5.5 6200 4267 D 38 LEU H D 38 LEU HBx 1.0 1.8 3.5 6201 4267 D 38 LEU H D 38 LEU HBy 1.0 1.8 3.5 6202 4268 D 38 LEU H D 38 LEU HD11 1.0 1.8 5.5 6203 4268 D 38 LEU H D 38 LEU HD21 1.0 1.8 5.5 6204 4269 D 39 ILE H D 38 LEU HD11 1.0 1.8 5.5 6205 4269 D 38 LEU HD21 D 39 ILE H 1.0 1.8 5.5 6206 4270 D 39 ILE H D 39 ILE HA 1.0 1.8 3.5 6207 4271 D 39 ILE HB D 39 ILE HG1x 1.0 1.8 4.5 6208 4271 D 39 ILE HB D 39 ILE HG1y 1.0 1.8 4.5 6209 4272 D 39 ILE HB D 39 ILE HG21 1.0 1.8 4.5 6210 4273 D 39 ILE HB D 40 SER H 1.0 1.8 5.5 6211 4274 D 39 ILE HD11 D 39 ILE HG1x 1.0 1.8 4.5 6212 4274 D 39 ILE HG1y D 39 ILE HD11 1.0 1.8 4.5 6213 4275 D 39 ILE HG21 D 39 ILE HD11 1.0 1.8 4.5 6214 4276 D 36 ALA HB1 D 39 ILE HG1x 1.0 1.8 5.5 6215 4276 D 36 ALA HB1 D 39 ILE HG1y 1.0 1.8 5.5 6216 4277 D 39 ILE H D 39 ILE HG1x 1.0 1.8 4.5 6217 4277 D 39 ILE H D 39 ILE HG1y 1.0 1.8 4.5 6218 4278 D 39 ILE HB D 39 ILE HG1x 1.0 1.8 4.5 6219 4278 D 39 ILE HB D 39 ILE HG1y 1.0 1.8 4.5 6220 4279 D 39 ILE H D 39 ILE HG21 1.0 1.8 4.5 6221 4280 D 39 ILE HB D 39 ILE HG21 1.0 1.8 4.5 6222 4281 D 39 ILE HG21 D 40 SER H 1.0 1.8 5.5 6223 4282 D 40 SER H D 40 SER HA 1.0 1.8 4.5 6224 4283 D 40 SER HA D 39 ILE HG1x 1.0 1.8 5.5 6225 4283 D 39 ILE HG1y D 40 SER HA 1.0 1.8 5.5 6226 4284 D 40 SER H D 40 SER HA 1.0 1.8 4.5 6227 4285 D 40 SER HA D 41 TYR H 1.0 1.8 4.5 6228 4286 D 42 PRO HDy D 40 SER HBx 1.0 1.8 5.5 6229 4286 D 40 SER HBy D 42 PRO HDy 1.0 1.8 5.5 6230 4287 D 40 SER HA D 41 TYR H 1.0 1.8 4.5 6231 4288 D 41 TYR H D 41 TYR HA 1.0 1.8 4.5 6232 4289 D 41 TYR HBx D 41 TYR HBy 1.0 1.8 4.5 6233 4290 D 42 PRO HA D 43 ASP H 1.0 1.8 5.5 6234 4291 D 42 PRO HDy D 42 PRO HDx 1.0 1.8 3.5 6235 4292 D 43 ASP H D 42 PRO HDx 1.0 1.8 5.5 6236 4293 D 42 PRO HDy D 42 PRO HDx 1.0 1.8 3.5 6237 4294 D 42 PRO HDy D 43 ASP H 1.0 1.8 4.5 6238 4295 D 42 PRO HBx D 42 PRO HGx 1.0 1.8 4.5 6239 4295 D 42 PRO HBy D 42 PRO HGx 1.0 1.8 4.5 6240 4295 D 42 PRO HGy D 42 PRO HBx 1.0 1.8 4.5 6241 4295 D 42 PRO HBy D 42 PRO HGy 1.0 1.8 4.5 6242 4296 D 43 ASP H D 42 PRO HBx 1.0 1.8 5.5 6243 4296 D 43 ASP H D 42 PRO HBy 1.0 1.8 5.5 6244 4297 D 43 ASP H D 43 ASP HA 1.0 1.8 3.5 6245 4298 D 43 ASP HA D 44 ALA H 1.0 1.8 4.5 6246 4299 D 43 ASP HA D 45 ILE H 1.0 1.8 5.5 6247 4300 D 43 ASP HA D 45 ILE HG21 1.0 1.8 5.5 6248 4301 D 43 ASP H D 43 ASP HBx 1.0 1.8 5.5 6249 4302 D 43 ASP HBx D 43 ASP HBy 1.0 1.8 4.5 6250 4303 D 44 ALA H D 43 ASP HBx 1.0 1.8 5.5 6251 4304 D 44 ALA H D 43 ASP HBy 1.0 1.8 5.5 6252 4305 D 43 ASP H D 44 ALA H 1.0 1.8 4.5 6253 4306 D 44 ALA H D 45 ILE H 1.0 1.8 4.5 6254 4307 D 44 ALA H D 44 ALA HA 1.0 1.8 4.5 6255 4308 D 45 ILE H D 44 ALA HA 1.0 1.8 5.5 6256 4309 D 44 ALA H D 44 ALA HB1 1.0 1.8 3.5 6257 4310 D 45 ILE H D 44 ALA HB1 1.0 1.8 4.5 6258 4311 D 44 ALA HB1 D 46 TRP H 1.0 1.8 5.5 6259 4312 D 44 ALA H D 45 ILE H 1.0 1.8 3.5 6260 4313 D 45 ILE H D 46 TRP H 1.0 1.8 4.5 6261 4314 D 45 ILE H D 45 ILE HA 1.0 1.8 4.5 6262 4315 D 46 TRP H D 45 ILE HA 1.0 1.8 5.5 6263 4316 D 45 ILE H D 45 ILE HB 1.0 1.8 3.5 6264 4317 D 46 TRP H D 45 ILE HB 1.0 1.8 5.5 6265 4318 D 45 ILE H D 45 ILE HD11 1.0 1.8 5.5 6266 4319 D 45 ILE HD11 D 45 ILE HG1x 1.0 1.8 5.5 6267 4319 D 45 ILE HD11 D 45 ILE HG1y 1.0 1.8 5.5 6268 4320 D 45 ILE HG21 D 45 ILE HD11 1.0 1.8 4.5 6269 4321 D 46 TRP H D 45 ILE HD11 1.0 1.8 5.5 6270 4322 D 45 ILE HD11 D 49 VAL HG21 1.0 1.8 4.5 6271 4323 D 45 ILE H D 45 ILE HG1x 1.0 1.8 5.5 6272 4323 D 45 ILE H D 45 ILE HG1y 1.0 1.8 5.5 6273 4324 D 46 TRP H D 45 ILE HG1x 1.0 1.8 5.5 6274 4324 D 46 TRP H D 45 ILE HG1y 1.0 1.8 5.5 6275 4325 D 45 ILE H D 45 ILE HG21 1.0 1.8 4.5 6276 4326 D 45 ILE HG21 D 45 ILE HG1x 1.0 1.8 4.5 6277 4326 D 45 ILE HG21 D 45 ILE HG1y 1.0 1.8 4.5 6278 4327 D 45 ILE H D 46 TRP H 1.0 1.8 4.5 6279 4328 D 46 TRP H D 47 TRP H 1.0 1.8 4.5 6280 4329 D 46 TRP H D 46 TRP HA 1.0 1.8 4.5 6281 4330 D 47 TRP H D 46 TRP HA 1.0 1.8 5.5 6282 4331 D 46 TRP HD1 D 46 TRP HE1 1.0 1.8 3.5 6283 4332 D 46 TRP HE1 D 46 TRP HZ2 1.0 1.8 4.5 6284 4333 D 46 TRP H D 46 TRP HBx 1.0 1.8 4.5 6285 4333 D 46 TRP H D 46 TRP HBy 1.0 1.8 4.5 6286 4334 D 46 TRP HE1 D 46 TRP HBx 1.0 1.8 5.5 6287 4334 D 46 TRP HE1 D 46 TRP HBy 1.0 1.8 5.5 6288 4335 D 47 TRP H D 46 TRP HBx 1.0 1.8 4.5 6289 4335 D 47 TRP H D 46 TRP HBy 1.0 1.8 4.5 6290 4336 D 47 TRP H D 48 SER H 1.0 1.8 4.5 6291 4337 D 47 TRP H D 47 TRP HA 1.0 1.8 4.5 6292 4338 D 48 SER H D 47 TRP HA 1.0 1.8 4.5 6293 4339 D 47 TRP HA D 50 GLU H 1.0 1.8 5.5 6294 4340 D 48 SER H D 47 TRP HBx 1.0 1.8 5.5 6295 4341 D 47 TRP H D 47 TRP HBy 1.0 1.8 4.5 6296 4342 D 47 TRP HD1 D 47 TRP HE1 1.0 1.8 3.5 6297 4343 D 47 TRP H D 47 TRP HE3 1.0 1.8 4.5 6298 4344 D 47 TRP HE1 D 47 TRP HZ2 1.0 1.8 4.5 6299 4345 D 46 TRP H D 48 SER H 1.0 1.8 5.5 6300 4346 D 48 SER H D 48 SER HA 1.0 1.8 4.5 6301 4347 D 48 SER HA D 49 VAL H 1.0 1.8 4.5 6302 4348 D 48 SER HA D 51 THR H 1.0 1.8 5.5 6303 4349 D 48 SER H D 48 SER HBx 1.0 1.8 4.5 6304 4349 D 48 SER H D 48 SER HBy 1.0 1.8 4.5 6305 4350 D 49 VAL H D 48 SER HBx 1.0 1.8 4.5 6306 4350 D 49 VAL H D 48 SER HBy 1.0 1.8 4.5 6307 4351 D 52 ALA HB1 D 48 SER HBx 1.0 1.8 5.5 6308 4351 D 48 SER HBy D 52 ALA HB1 1.0 1.8 5.5 6309 4352 D 49 VAL H D 49 VAL HA 1.0 1.8 4.5 6310 4353 D 51 THR H D 49 VAL HA 1.0 1.8 5.5 6311 4354 D 49 VAL H D 49 VAL HB 1.0 1.8 3.5 6312 4355 D 49 VAL HB D 50 GLU HGx 1.0 1.8 5.5 6313 4355 D 49 VAL HB D 50 GLU HGy 1.0 1.8 5.5 6314 4356 D 49 VAL H D 49 VAL HG11 1.0 1.8 5.5 6315 4357 D 50 GLU H D 49 VAL HG11 1.0 1.8 4.5 6316 4358 D 45 ILE HG21 D 49 VAL HG21 1.0 1.8 5.5 6317 4359 D 49 VAL H D 49 VAL HG21 1.0 1.8 3.5 6318 4360 D 50 GLU H D 49 VAL HG21 1.0 1.8 5.5 6319 4361 D 53 THR HG21 D 49 VAL HG21 1.0 1.8 5.5 6320 4362 D 50 GLU H D 50 GLU HA 1.0 1.8 4.5 6321 4363 D 50 GLU H D 50 GLU HBx 1.0 1.8 3.5 6322 4363 D 50 GLU H D 50 GLU HBy 1.0 1.8 3.5 6323 4364 D 51 THR H D 50 GLU HBx 1.0 1.8 5.5 6324 4364 D 51 THR H D 50 GLU HBy 1.0 1.8 5.5 6325 4365 D 49 VAL H D 50 GLU HGx 1.0 1.8 5.5 6326 4365 D 49 VAL H D 50 GLU HGy 1.0 1.8 5.5 6327 4366 D 50 GLU H D 50 GLU HGx 1.0 1.8 4.5 6328 4366 D 50 GLU H D 50 GLU HGy 1.0 1.8 4.5 6329 4367 D 51 THR H D 50 GLU HGx 1.0 1.8 4.5 6330 4367 D 51 THR H D 50 GLU HGy 1.0 1.8 4.5 6331 4368 D 51 THR H D 50 GLU HA 1.0 1.8 4.5 6332 4369 D 51 THR H D 50 GLU HBx 1.0 1.8 5.5 6333 4369 D 51 THR H D 50 GLU HBy 1.0 1.8 5.5 6334 4370 D 51 THR H D 51 THR HA 1.0 1.8 3.5 6335 4371 D 51 THR HA D 53 THR H 1.0 1.8 5.5 6336 4372 D 51 THR H D 51 THR HB 1.0 1.8 4.5 6337 4373 D 52 ALA HB1 D 51 THR HB 1.0 1.8 5.5 6338 4374 D 51 THR H D 51 THR HG21 1.0 1.8 5.5 6339 4375 D 51 THR HG21 D 52 ALA H 1.0 1.8 4.5 6340 4376 D 52 ALA HB1 D 51 THR HG21 1.0 1.8 4.5 6341 4377 D 51 THR H D 52 ALA H 1.0 1.8 4.5 6342 4378 D 52 ALA HB1 D 52 ALA H 1.0 1.8 4.5 6343 4379 D 52 ALA H D 52 ALA HA 1.0 1.8 3.5 6344 4380 D 53 THR H D 52 ALA HA 1.0 1.8 5.5 6345 4381 D 52 ALA HB1 D 52 ALA H 1.0 1.8 3.5 6346 4382 D 52 ALA HB1 D 53 THR H 1.0 1.8 4.5 6347 4383 D 52 ALA HB1 D 54 THR H 1.0 1.8 5.5 6348 4384 D 53 THR H D 52 ALA HA 1.0 1.8 5.5 6349 4385 D 52 ALA HB1 D 53 THR H 1.0 1.8 4.5 6350 4386 D 52 ALA HB1 D 53 THR HA 1.0 1.8 5.5 6351 4387 D 53 THR H D 53 THR HA 1.0 1.8 3.5 6352 4388 D 53 THR H D 53 THR HB 1.0 1.8 5.5 6353 4389 D 54 THR H D 53 THR HB 1.0 1.8 5.5 6354 4390 D 53 THR HG21 D 53 THR H 1.0 1.8 3.5 6355 4391 D 53 THR HG21 D 54 THR H 1.0 1.8 5.5 6356 4392 D 53 THR HG21 D 55 VAL H 1.0 1.8 5.5 6357 4393 D 52 ALA HA D 54 THR H 1.0 1.8 4.5 6358 4394 D 52 ALA HB1 D 54 THR H 1.0 1.8 5.5 6359 4395 D 54 THR H D 54 THR HA 1.0 1.8 3.5 6360 4396 D 54 THR HB D 54 THR H 1.0 1.8 5.5 6361 4397 D 54 THR H D 54 THR HG21 1.0 1.8 3.5 6362 4398 D 55 VAL H D 54 THR HG21 1.0 1.8 5.5 6363 4399 D 55 VAL H D 55 VAL HA 1.0 1.8 4.5 6364 4400 D 55 VAL H D 56 GLY H 1.0 1.8 3.5 6365 4401 D 55 VAL H D 55 VAL HA 1.0 1.8 3.5 6366 4402 D 55 VAL HA D 56 GLY H 1.0 1.8 5.5 6367 4403 D 55 VAL H D 55 VAL HB 1.0 1.8 3.5 6368 4404 D 56 GLY H D 55 VAL HB 1.0 1.8 4.5 6369 4405 D 53 THR HG21 D 55 VAL HG11 1.0 1.8 4.5 6370 4405 D 53 THR HG21 D 55 VAL HG21 1.0 1.8 4.5 6371 4406 D 55 VAL H D 55 VAL HG11 1.0 1.8 3.5 6372 4406 D 55 VAL H D 55 VAL HG21 1.0 1.8 3.5 6373 4407 D 56 GLY H D 55 VAL HG11 1.0 1.8 4.5 6374 4407 D 56 GLY H D 55 VAL HG21 1.0 1.8 4.5 6375 4408 D 56 GLY HAx D 55 VAL HG11 1.0 1.8 5.5 6376 4408 D 55 VAL HG21 D 56 GLY HAx 1.0 1.8 5.5 6377 4409 D 57 TYR H D 55 VAL HG11 1.0 1.8 4.5 6378 4409 D 55 VAL HG21 D 57 TYR H 1.0 1.8 4.5 6379 4410 D 56 GLY H D 56 GLY HAx 1.0 1.8 4.5 6380 4411 D 56 GLY H D 57 TYR H 1.0 1.8 4.5 6381 4412 D 56 GLY HAy D 56 GLY H 1.0 1.8 4.5 6382 4413 D 56 GLY H D 57 TYR H 1.0 1.8 4.5 6383 4414 D 57 TYR H D 57 TYR HA 1.0 1.8 5.5 6384 4415 D 58 GLY H D 57 TYR H 1.0 1.8 4.5 6385 4416 D 57 TYR H D 57 TYR HA 1.0 1.8 3.5 6386 4417 D 57 TYR HA D 57 TYR HBy 1.0 1.8 4.5 6387 4418 D 58 GLY H D 57 TYR HA 1.0 1.8 5.5 6388 4419 D 57 TYR HA D 57 TYR HBx 1.0 1.8 4.5 6389 4420 D 57 TYR HBy D 57 TYR HBx 1.0 1.8 3.5 6390 4421 D 58 GLY H D 57 TYR HD% 1.0 1.8 5.5 6391 4422 D 58 GLY H D 56 GLY HAx 1.0 1.8 5.5 6392 4423 D 58 GLY H D 57 TYR HA 1.0 1.8 5.5 6393 4424 D 58 GLY H D 58 GLY HAx 1.0 1.8 3.5 6394 4424 D 58 GLY H D 58 GLY HAy 1.0 1.8 3.5 6395 4425 D 58 GLY H D 59 ASP H 1.0 1.8 3.5 6396 4426 D 59 ASP H D 59 ASP HBx 1.0 1.8 4.5 6397 4426 D 59 ASP H D 59 ASP HBy 1.0 1.8 4.5 6398 4427 D 59 ASP H D 59 ASP HA 1.0 1.8 3.5 6399 4428 D 59 ASP HA D 59 ASP HBx 1.0 1.8 4.5 6400 4428 D 59 ASP HBy D 59 ASP HA 1.0 1.8 4.5 6401 4429 D 60 ARG H D 59 ASP HA 1.0 1.8 5.5 6402 4430 D 59 ASP H D 59 ASP HBx 1.0 1.8 3.5 6403 4430 D 59 ASP H D 59 ASP HBy 1.0 1.8 3.5 6404 4431 D 60 ARG H D 59 ASP HBx 1.0 1.8 4.5 6405 4431 D 60 ARG H D 59 ASP HBy 1.0 1.8 4.5 6406 4432 D 60 ARG H D 60 ARG HA 1.0 1.8 3.5 6407 4433 D 60 ARG HA D 61 TYR HBx 1.0 1.8 5.5 6408 4433 D 61 TYR HBy D 60 ARG HA 1.0 1.8 5.5 6409 4434 D 60 ARG H D 60 ARG HBx 1.0 1.8 4.5 6410 4434 D 60 ARG H D 60 ARG HBy 1.0 1.8 4.5 6411 4435 D 61 TYR H D 60 ARG HGx 1.0 1.8 5.5 6412 4435 D 60 ARG HGy D 61 TYR H 1.0 1.8 5.5 6413 4436 D 60 ARG HH1% D 60 ARG HE 1.0 1.8 5.5 6414 4437 D 60 ARG HE D 60 ARG HH2% 1.0 1.8 5.5 6415 4438 D 61 TYR HA D 62 PRO HDx 1.0 1.8 4.5 6416 4438 D 61 TYR HA D 62 PRO HDy 1.0 1.8 4.5 6417 4439 D 61 TYR HA D 61 TYR HBx 1.0 1.8 4.5 6418 4439 D 61 TYR HA D 61 TYR HBy 1.0 1.8 4.5 6419 4440 D 62 PRO HA D 63 VAL H 1.0 1.8 3.5 6420 4441 D 61 TYR HBx D 62 PRO HDx 1.0 1.8 5.5 6421 4441 D 61 TYR HBy D 62 PRO HDx 1.0 1.8 5.5 6422 4441 D 62 PRO HDy D 61 TYR HBx 1.0 1.8 5.5 6423 4441 D 61 TYR HBy D 62 PRO HDy 1.0 1.8 5.5 6424 4442 D 62 PRO HA D 62 PRO HDx 1.0 1.8 4.5 6425 4442 D 62 PRO HDy D 62 PRO HA 1.0 1.8 4.5 6426 4443 D 63 VAL H D 63 VAL HA 1.0 1.8 4.5 6427 4444 D 63 VAL H D 63 VAL HB 1.0 1.8 5.5 6428 4445 D 63 VAL HB D 64 THR H 1.0 1.8 5.5 6429 4446 D 63 VAL HG11 D 63 VAL H 1.0 1.8 4.5 6430 4447 D 63 VAL HG11 D 64 THR H 1.0 1.8 5.5 6431 4448 D 64 THR HG21 D 63 VAL HG11 1.0 1.8 5.5 6432 4449 D 64 THR HA D 64 THR H 1.0 1.8 4.5 6433 4450 D 64 THR HA D 66 GLU H 1.0 1.8 5.5 6434 4451 D 64 THR HB D 64 THR H 1.0 1.8 5.5 6435 4452 D 64 THR HB D 65 GLU H 1.0 1.8 4.5 6436 4453 D 64 THR HG21 D 64 THR H 1.0 1.8 4.5 6437 4454 D 64 THR HG21 D 65 GLU H 1.0 1.8 5.5 6438 4455 D 64 THR HG21 D 67 GLY H 1.0 1.8 6.5 6439 4456 D 65 GLU H D 65 GLU HA 1.0 1.8 3.5 6440 4457 D 66 GLU H D 65 GLU HA 1.0 1.8 5.5 6441 4458 D 65 GLU H D 65 GLU HBx 1.0 1.8 4.5 6442 4459 D 66 GLU H D 65 GLU HBx 1.0 1.8 5.5 6443 4460 D 65 GLU H D 65 GLU HBy 1.0 1.8 4.5 6444 4461 D 65 GLU H D 65 GLU HGx 1.0 1.8 5.5 6445 4461 D 65 GLU H D 65 GLU HGy 1.0 1.8 5.5 6446 4462 D 67 GLY H D 66 GLU HA 1.0 1.8 5.5 6447 4463 D 66 GLU H D 66 GLU HBx 1.0 1.8 4.5 6448 4463 D 66 GLU H D 66 GLU HBy 1.0 1.8 4.5 6449 4464 D 66 GLU HBx D 66 GLU HGx 1.0 1.8 3.5 6450 4464 D 66 GLU HBy D 66 GLU HGx 1.0 1.8 3.5 6451 4464 D 66 GLU HGy D 66 GLU HBx 1.0 1.8 3.5 6452 4464 D 66 GLU HBy D 66 GLU HGy 1.0 1.8 3.5 6453 4465 D 67 GLY H D 66 GLU HBx 1.0 1.8 4.5 6454 4465 D 67 GLY H D 66 GLU HBy 1.0 1.8 4.5 6455 4466 D 67 GLY H D 66 GLU HGx 1.0 1.8 5.5 6456 4466 D 67 GLY H D 66 GLU HGy 1.0 1.8 5.5 6457 4467 D 67 GLY H D 67 GLY HAx 1.0 1.8 3.5 6458 4467 D 67 GLY H D 67 GLY HAy 1.0 1.8 3.5 6459 4468 D 67 GLY H D 68 ARG H 1.0 1.8 4.5 6460 4469 D 68 ARG HA D 68 ARG H 1.0 1.8 4.5 6461 4470 D 68 ARG HE D 68 ARG HDx 1.0 1.8 3.5 6462 4470 D 68 ARG HDy D 68 ARG HE 1.0 1.8 3.5 6463 4471 D 68 ARG HE D 68 ARG HDx 1.0 1.8 3.5 6464 4471 D 68 ARG HDy D 68 ARG HE 1.0 1.8 3.5 6465 4472 D 68 ARG HE D 68 ARG HH1% 1.0 1.8 4.5 6466 4473 D 68 ARG HE D 68 ARG HH2% 1.0 1.8 4.5 6467 4474 D 69 LYS H D 69 LYS HA 1.0 1.8 3.5 6468 4475 D 69 LYS HBx D 69 LYS HGx 1.0 1.8 5.5 6469 4475 D 69 LYS HBy D 69 LYS HGx 1.0 1.8 5.5 6470 4475 D 69 LYS HGy D 69 LYS HBx 1.0 1.8 5.5 6471 4475 D 69 LYS HBy D 69 LYS HGy 1.0 1.8 5.5 6472 4476 D 69 LYS HDx D 69 LYS HEx 1.0 1.8 5.5 6473 4476 D 69 LYS HDy D 69 LYS HEx 1.0 1.8 5.5 6474 4476 D 69 LYS HEy D 69 LYS HDx 1.0 1.8 5.5 6475 4476 D 69 LYS HEy D 69 LYS HDy 1.0 1.8 5.5 6476 4477 D 70 VAL H D 72 GLU H 1.0 1.8 5.5 6477 4478 D 70 VAL H D 70 VAL HA 1.0 1.8 3.5 6478 4479 D 70 VAL HB D 71 ALA HA 1.0 1.8 5.5 6479 4480 D 71 ALA HB1 D 70 VAL HB 1.0 1.8 5.5 6480 4481 D 71 ALA HA D 70 VAL HG11 1.0 1.8 4.5 6481 4482 D 70 VAL HG11 D 71 ALA H 1.0 1.8 4.5 6482 4483 D 71 ALA HA D 71 ALA H 1.0 1.8 4.5 6483 4484 D 71 ALA HB1 D 71 ALA H 1.0 1.8 4.5 6484 4485 D 71 ALA HA D 71 ALA H 1.0 1.8 4.5 6485 4486 D 72 GLU H D 71 ALA HA 1.0 1.8 5.5 6486 4487 D 71 ALA HB1 D 71 ALA H 1.0 1.8 3.5 6487 4488 D 72 GLU HA D 72 GLU H 1.0 1.8 4.5 6488 4489 D 72 GLU HA D 71 ALA HB1 1.0 1.8 5.5 6489 4490 D 72 GLU HA D 72 GLU H 1.0 1.8 4.5 6490 4491 D 72 GLU HA D 76 LYS H 1.0 1.8 5.5 6491 4492 D 71 ALA HB1 D 72 GLU HBx 1.0 1.8 5.5 6492 4492 D 71 ALA HB1 D 72 GLU HBy 1.0 1.8 5.5 6493 4493 D 72 GLU H D 72 GLU HBx 1.0 1.8 3.5 6494 4493 D 72 GLU H D 72 GLU HBy 1.0 1.8 3.5 6495 4494 D 72 GLU HBx D 72 GLU HGx 1.0 1.8 4.5 6496 4494 D 72 GLU HBy D 72 GLU HGx 1.0 1.8 4.5 6497 4494 D 72 GLU HGy D 72 GLU HBx 1.0 1.8 4.5 6498 4494 D 72 GLU HGy D 72 GLU HBy 1.0 1.8 4.5 6499 4495 D 72 GLU H D 72 GLU HGx 1.0 1.8 6.5 6500 4495 D 72 GLU HGy D 72 GLU H 1.0 1.8 6.5 6501 4496 D 71 ALA H D 73 GLN H 1.0 1.8 5.5 6502 4497 D 72 GLU HA D 73 GLN H 1.0 1.8 5.5 6503 4498 D 73 GLN H D 73 GLN HA 1.0 1.8 3.5 6504 4499 D 73 GLN HA D 77 ALA HB1 1.0 1.8 5.5 6505 4500 D 73 GLN HE2y D 73 GLN HE2x 1.0 1.8 3.5 6506 4501 D 73 GLN HE2x D 73 GLN HBx 1.0 1.8 4.5 6507 4501 D 73 GLN HBy D 73 GLN HE2x 1.0 1.8 4.5 6508 4502 D 73 GLN HE2y D 73 GLN HBx 1.0 1.8 4.5 6509 4502 D 73 GLN HBy D 73 GLN HE2y 1.0 1.8 4.5 6510 4503 D 73 GLN HE2x D 73 GLN HGx 1.0 1.8 4.5 6511 4503 D 73 GLN HE2x D 73 GLN HGy 1.0 1.8 4.5 6512 4504 D 73 GLN HBx D 73 GLN HGx 1.0 1.8 3.5 6513 4504 D 73 GLN HBy D 73 GLN HGx 1.0 1.8 3.5 6514 4504 D 73 GLN HGy D 73 GLN HBx 1.0 1.8 3.5 6515 4504 D 73 GLN HBy D 73 GLN HGy 1.0 1.8 3.5 6516 4505 D 74 VAL H D 73 GLN HGx 1.0 1.8 4.5 6517 4505 D 73 GLN HGy D 74 VAL H 1.0 1.8 4.5 6518 4506 D 72 GLU HA D 74 VAL H 1.0 1.8 5.5 6519 4507 D 74 VAL H D 74 VAL HA 1.0 1.8 4.5 6520 4508 D 74 VAL H D 74 VAL HA 1.0 1.8 4.5 6521 4509 D 71 ALA HB1 D 74 VAL HB 1.0 1.8 5.5 6522 4510 D 74 VAL H D 74 VAL HB 1.0 1.8 3.5 6523 4511 D 71 ALA HA D 74 VAL HG11 1.0 1.8 5.5 6524 4512 D 74 VAL H D 74 VAL HG11 1.0 1.8 5.5 6525 4513 D 74 VAL HG11 D 78 GLY H 1.0 1.8 5.5 6526 4514 D 71 ALA HA D 74 VAL HG21 1.0 1.8 4.5 6527 4515 D 77 ALA HB1 D 74 VAL HG21 1.0 1.8 5.5 6528 4516 D 71 ALA HB1 D 75 MET H 1.0 1.8 5.5 6529 4517 D 72 GLU HA D 75 MET H 1.0 1.8 5.5 6530 4518 D 75 MET HA D 79 ILE H 1.0 1.8 5.5 6531 4519 D 75 MET HE1 D 71 ALA HA 1.0 1.8 4.5 6532 4520 D 71 ALA HB1 D 75 MET HE1 1.0 1.8 3.5 6533 4521 D 75 MET HE1 D 72 GLU HGx 1.0 1.8 4.5 6534 4521 D 72 GLU HGy D 75 MET HE1 1.0 1.8 4.5 6535 4522 D 72 GLU HA D 76 LYS H 1.0 1.8 5.5 6536 4523 D 76 LYS H D 76 LYS HA 1.0 1.8 4.5 6537 4524 D 76 LYS H D 76 LYS HA 1.0 1.8 3.5 6538 4525 D 76 LYS HA D 77 ALA H 1.0 1.8 5.5 6539 4526 D 78 GLY H D 76 LYS HA 1.0 1.8 5.5 6540 4527 D 76 LYS H D 76 LYS HBx 1.0 1.8 4.5 6541 4527 D 76 LYS H D 76 LYS HBy 1.0 1.8 4.5 6542 4528 D 76 LYS HBy D 76 LYS HGx 1.0 1.8 5.5 6543 4528 D 76 LYS HBx D 76 LYS HGx 1.0 1.8 5.5 6544 4528 D 76 LYS HGy D 76 LYS HBx 1.0 1.8 5.5 6545 4528 D 76 LYS HGy D 76 LYS HBy 1.0 1.8 5.5 6546 4529 D 76 LYS HBx D 80 GLU HGx 1.0 1.8 5.5 6547 4529 D 76 LYS HBy D 80 GLU HGx 1.0 1.8 5.5 6548 4529 D 80 GLU HGy D 76 LYS HBx 1.0 1.8 5.5 6549 4529 D 76 LYS HBy D 80 GLU HGy 1.0 1.8 5.5 6550 4530 D 76 LYS H D 76 LYS HDx 1.0 1.8 5.5 6551 4530 D 76 LYS H D 76 LYS HDy 1.0 1.8 5.5 6552 4531 D 77 ALA HA D 76 LYS HDx 1.0 1.8 5.5 6553 4531 D 76 LYS HDy D 77 ALA HA 1.0 1.8 5.5 6554 4532 D 76 LYS HDx D 80 GLU HGx 1.0 1.8 5.5 6555 4532 D 76 LYS HDy D 80 GLU HGx 1.0 1.8 5.5 6556 4532 D 80 GLU HGy D 76 LYS HDx 1.0 1.8 5.5 6557 4532 D 80 GLU HGy D 76 LYS HDy 1.0 1.8 5.5 6558 4533 D 76 LYS HGx D 80 GLU HGx 1.0 1.8 4.5 6559 4533 D 76 LYS HGy D 80 GLU HGx 1.0 1.8 4.5 6560 4533 D 80 GLU HGy D 76 LYS HGx 1.0 1.8 4.5 6561 4533 D 76 LYS HGy D 80 GLU HGy 1.0 1.8 4.5 6562 4534 D 76 LYS HA D 77 ALA H 1.0 1.8 5.5 6563 4535 D 77 ALA H D 77 ALA HA 1.0 1.8 4.5 6564 4536 D 77 ALA HB1 D 77 ALA H 1.0 1.8 4.5 6565 4537 D 79 ILE H D 77 ALA H 1.0 1.8 5.5 6566 4538 D 77 ALA H D 77 ALA HA 1.0 1.8 4.5 6567 4539 D 78 GLY H D 77 ALA HA 1.0 1.8 5.5 6568 4540 D 77 ALA HB1 D 77 ALA H 1.0 1.8 3.5 6569 4541 D 77 ALA HB1 D 78 GLY H 1.0 1.8 4.5 6570 4542 D 78 GLY H D 76 LYS HA 1.0 1.8 5.5 6571 4543 D 78 GLY H D 77 ALA HA 1.0 1.8 5.5 6572 4544 D 77 ALA HB1 D 78 GLY H 1.0 1.8 4.5 6573 4545 D 78 GLY H D 78 GLY HAx 1.0 1.8 4.5 6574 4545 D 78 GLY H D 78 GLY HAy 1.0 1.8 4.5 6575 4546 D 78 GLY H D 79 ILE H 1.0 1.8 4.5 6576 4547 D 78 GLY H D 78 GLY HAx 1.0 1.8 3.5 6577 4547 D 78 GLY H D 78 GLY HAy 1.0 1.8 3.5 6578 4548 D 79 ILE H D 78 GLY HAx 1.0 1.8 4.5 6579 4548 D 79 ILE H D 78 GLY HAy 1.0 1.8 4.5 6580 4549 D 78 GLY H D 79 ILE H 1.0 1.8 4.5 6581 4550 D 79 ILE H D 79 ILE HA 1.0 1.8 4.5 6582 4551 D 79 ILE H D 80 GLU H 1.0 1.8 4.5 6583 4552 D 79 ILE H D 79 ILE HA 1.0 1.8 4.5 6584 4553 D 79 ILE HA D 80 GLU H 1.0 1.8 5.5 6585 4554 D 79 ILE HA D 82 PHE HBx 1.0 1.8 5.5 6586 4555 D 76 LYS H D 79 ILE HD11 1.0 1.8 5.5 6587 4556 D 79 ILE HD11 D 76 LYS HBx 1.0 1.8 5.5 6588 4556 D 76 LYS HBy D 79 ILE HD11 1.0 1.8 5.5 6589 4557 D 79 ILE H D 79 ILE HG1x 1.0 1.8 4.5 6590 4557 D 79 ILE H D 79 ILE HG1y 1.0 1.8 4.5 6591 4558 D 79 ILE HG21 D 79 ILE HG1x 1.0 1.8 3.5 6592 4558 D 79 ILE HG1y D 79 ILE HG21 1.0 1.8 3.5 6593 4559 D 79 ILE H D 79 ILE HG21 1.0 1.8 5.5 6594 4560 D 79 ILE HG21 D 79 ILE HG1x 1.0 1.8 3.5 6595 4560 D 79 ILE HG1y D 79 ILE HG21 1.0 1.8 3.5 6596 4561 D 80 GLU H D 79 ILE HG21 1.0 1.8 5.5 6597 4562 D 76 LYS HA D 80 GLU H 1.0 1.8 5.5 6598 4563 D 80 GLU H D 80 GLU HA 1.0 1.8 4.5 6599 4564 D 80 GLU HA D 81 VAL H 1.0 1.8 4.5 6600 4565 D 80 GLU HA D 83 ALA HB1 1.0 1.8 3.5 6601 4566 D 77 ALA HB1 D 80 GLU HBx 1.0 1.8 5.5 6602 4566 D 77 ALA HB1 D 80 GLU HBy 1.0 1.8 5.5 6603 4567 D 80 GLU H D 80 GLU HBx 1.0 1.8 3.5 6604 4567 D 80 GLU H D 80 GLU HBy 1.0 1.8 3.5 6605 4568 D 83 ALA HB1 D 80 GLU HBx 1.0 1.8 5.5 6606 4568 D 83 ALA HB1 D 80 GLU HBy 1.0 1.8 5.5 6607 4569 D 76 LYS HBy D 80 GLU HGx 1.0 1.8 5.5 6608 4569 D 76 LYS HBx D 80 GLU HGx 1.0 1.8 5.5 6609 4569 D 80 GLU HGy D 76 LYS HBx 1.0 1.8 5.5 6610 4569 D 76 LYS HBy D 80 GLU HGy 1.0 1.8 5.5 6611 4570 D 77 ALA HA D 80 GLU HGx 1.0 1.8 5.5 6612 4570 D 80 GLU HGy D 77 ALA HA 1.0 1.8 5.5 6613 4571 D 80 GLU H D 80 GLU HGx 1.0 1.8 4.5 6614 4571 D 80 GLU HGy D 80 GLU H 1.0 1.8 4.5 6615 4572 D 77 ALA HA D 81 VAL H 1.0 1.8 5.5 6616 4573 D 81 VAL H D 78 GLY HAx 1.0 1.8 4.5 6617 4573 D 78 GLY HAy D 81 VAL H 1.0 1.8 4.5 6618 4574 D 79 ILE HA D 81 VAL H 1.0 1.8 5.5 6619 4575 D 81 VAL H D 81 VAL HA 1.0 1.8 3.5 6620 4576 D 81 VAL H D 81 VAL HB 1.0 1.8 3.5 6621 4577 D 81 VAL HG11 D 78 GLY HAx 1.0 1.8 5.5 6622 4577 D 78 GLY HAy D 81 VAL HG11 1.0 1.8 5.5 6623 4578 D 81 VAL H D 81 VAL HG11 1.0 1.8 5.5 6624 4579 D 84 LEU HBy D 81 VAL HG11 1.0 1.8 5.5 6625 4579 D 81 VAL HG11 D 84 LEU HBx 1.0 1.8 5.5 6626 4580 D 77 ALA HA D 81 VAL HG21 1.0 1.8 4.5 6627 4581 D 78 GLY HAx D 81 VAL HG21 1.0 1.8 5.5 6628 4581 D 78 GLY HAy D 81 VAL HG21 1.0 1.8 5.5 6629 4582 D 79 ILE HA D 82 PHE H 1.0 1.8 5.5 6630 4583 D 81 VAL HB D 82 PHE HA 1.0 1.8 5.5 6631 4584 D 82 PHE H D 82 PHE HA 1.0 1.8 4.5 6632 4585 D 82 PHE HA D 82 PHE HBx 1.0 1.8 5.5 6633 4586 D 83 ALA H D 82 PHE HA 1.0 1.8 5.5 6634 4587 D 82 PHE H D 82 PHE HBx 1.0 1.8 4.5 6635 4588 D 82 PHE HBx D 82 PHE HBy 1.0 1.8 3.5 6636 4589 D 83 ALA H D 82 PHE HBx 1.0 1.8 5.5 6637 4590 D 83 ALA HA D 82 PHE HBx 1.0 1.8 5.5 6638 4591 D 82 PHE H D 82 PHE HBy 1.0 1.8 5.5 6639 4592 D 82 PHE HBx D 82 PHE HBy 1.0 1.8 3.5 6640 4593 D 83 ALA H D 82 PHE HBy 1.0 1.8 4.5 6641 4594 D 82 PHE H D 82 PHE HD% 1.0 1.8 4.5 6642 4595 D 83 ALA H D 83 ALA HA 1.0 1.8 4.5 6643 4596 D 83 ALA H D 83 ALA HB1 1.0 1.8 4.5 6644 4597 D 83 ALA HA D 82 PHE HBx 1.0 1.8 5.5 6645 4598 D 83 ALA H D 83 ALA HA 1.0 1.8 3.5 6646 4599 D 83 ALA HB1 D 83 ALA HA 1.0 1.8 3.5 6647 4600 D 83 ALA H D 83 ALA HB1 1.0 1.8 3.5 6648 4601 D 81 VAL HA D 84 LEU H 1.0 1.8 4.5 6649 4602 D 83 ALA HB1 D 84 LEU HA 1.0 1.8 5.5 6650 4603 D 84 LEU H D 84 LEU HA 1.0 1.8 3.5 6651 4604 D 84 LEU HA D 84 LEU HBx 1.0 1.8 4.5 6652 4604 D 84 LEU HBy D 84 LEU HA 1.0 1.8 4.5 6653 4605 D 86 THR H D 84 LEU HA 1.0 1.8 5.5 6654 4606 D 84 LEU HG D 85 VAL H 1.0 1.8 5.5 6655 4607 D 85 VAL H D 84 LEU HBx 1.0 1.8 3.5 6656 4607 D 84 LEU HBy D 85 VAL H 1.0 1.8 3.5 6657 4608 D 84 LEU HD11 D 84 LEU H 1.0 1.8 5.5 6658 4609 D 84 LEU HD11 D 85 VAL H 1.0 1.8 5.5 6659 4610 D 84 LEU H D 84 LEU HD21 1.0 1.8 5.5 6660 4611 D 85 VAL H D 84 LEU HD21 1.0 1.8 3.5 6661 4612 D 85 VAL HB D 84 LEU HD21 1.0 1.8 5.5 6662 4613 D 86 THR H D 84 LEU HD21 1.0 1.8 5.5 6663 4614 D 85 VAL H D 85 VAL HA 1.0 1.8 5.5 6664 4615 D 86 THR H D 85 VAL HA 1.0 1.8 5.5 6665 4616 D 85 VAL H D 85 VAL HB 1.0 1.8 3.5 6666 4617 D 85 VAL HB D 85 VAL HA 1.0 1.8 4.5 6667 4618 D 86 THR H D 85 VAL HB 1.0 1.8 4.5 6668 4619 D 84 LEU HBy D 85 VAL HG11 1.0 1.8 4.5 6669 4619 D 84 LEU HBx D 85 VAL HG11 1.0 1.8 4.5 6670 4619 D 85 VAL HG21 D 84 LEU HBx 1.0 1.8 4.5 6671 4619 D 84 LEU HBy D 85 VAL HG21 1.0 1.8 4.5 6672 4620 D 85 VAL H D 85 VAL HG11 1.0 1.8 3.5 6673 4620 D 85 VAL H D 85 VAL HG21 1.0 1.8 3.5 6674 4621 D 89 LEU H D 85 VAL HG11 1.0 1.8 5.5 6675 4621 D 85 VAL HG21 D 89 LEU H 1.0 1.8 5.5 6676 4622 D 86 THR H D 85 VAL HB 1.0 1.8 5.5 6677 4623 D 86 THR H D 86 THR HA 1.0 1.8 3.5 6678 4624 D 87 ALA H D 86 THR HA 1.0 1.8 5.5 6679 4625 D 86 THR HA D 88 ALA H 1.0 1.8 5.5 6680 4626 D 89 LEU H D 86 THR HA 1.0 1.8 4.5 6681 4627 D 86 THR HA D 89 LEU HBx 1.0 1.8 4.5 6682 4627 D 89 LEU HBy D 86 THR HA 1.0 1.8 4.5 6683 4628 D 90 ALA H D 86 THR HA 1.0 1.8 5.5 6684 4629 D 86 THR H D 86 THR HB 1.0 1.8 3.5 6685 4630 D 86 THR H D 86 THR HG21 1.0 1.8 5.5 6686 4631 D 87 ALA H D 86 THR HG21 1.0 1.8 4.5 6687 4632 D 87 ALA H D 87 ALA HB1 1.0 1.8 4.5 6688 4633 D 87 ALA H D 87 ALA HA 1.0 1.8 3.5 6689 4634 D 88 ALA H D 87 ALA HA 1.0 1.8 5.5 6690 4635 D 89 LEU H D 87 ALA HA 1.0 1.8 5.5 6691 4636 D 87 ALA HA D 91 THR H 1.0 1.8 5.5 6692 4637 D 87 ALA H D 87 ALA HB1 1.0 1.8 3.5 6693 4638 D 87 ALA HB1 D 88 ALA H 1.0 1.8 3.5 6694 4639 D 87 ALA HB1 D 89 LEU H 1.0 1.8 5.5 6695 4640 D 85 VAL HA D 88 ALA H 1.0 1.8 5.5 6696 4641 D 88 ALA H D 88 ALA HA 1.0 1.8 3.5 6697 4642 D 88 ALA HA D 88 ALA HB1 1.0 1.8 3.5 6698 4643 D 89 LEU H D 88 ALA HA 1.0 1.8 5.5 6699 4644 D 88 ALA HA D 92 ASP H 1.0 1.8 5.5 6700 4645 D 88 ALA H D 88 ALA HB1 1.0 1.8 3.5 6701 4646 D 89 LEU H D 88 ALA H 1.0 1.8 3.5 6702 4647 D 88 ALA HB1 D 89 LEU HA 1.0 1.8 5.5 6703 4648 D 89 LEU H D 89 LEU HA 1.0 1.8 3.5 6704 4649 D 89 LEU HA D 89 LEU HBx 1.0 1.8 4.5 6705 4649 D 89 LEU HBy D 89 LEU HA 1.0 1.8 4.5 6706 4650 D 90 ALA H D 89 LEU HA 1.0 1.8 5.5 6707 4651 D 91 THR H D 89 LEU HA 1.0 1.8 5.5 6708 4652 D 92 ASP H D 89 LEU HA 1.0 1.8 4.5 6709 4653 D 89 LEU HA D 92 ASP HBx 1.0 1.8 5.5 6710 4653 D 89 LEU HA D 92 ASP HBy 1.0 1.8 5.5 6711 4654 D 86 THR H D 89 LEU HG 1.0 1.8 5.5 6712 4655 D 86 THR HA D 89 LEU HG 1.0 1.8 5.5 6713 4656 D 89 LEU H D 89 LEU HBx 1.0 1.8 3.5 6714 4656 D 89 LEU HBy D 89 LEU H 1.0 1.8 3.5 6715 4657 D 90 ALA H D 89 LEU HBx 1.0 1.8 4.5 6716 4657 D 90 ALA H D 89 LEU HBy 1.0 1.8 4.5 6717 4658 D 90 ALA HA D 89 LEU HBx 1.0 1.8 5.5 6718 4658 D 89 LEU HBy D 90 ALA HA 1.0 1.8 5.5 6719 4659 D 91 THR H D 89 LEU HBx 1.0 1.8 5.5 6720 4659 D 89 LEU HBy D 91 THR H 1.0 1.8 5.5 6721 4660 D 89 LEU HD11 D 89 LEU H 1.0 1.8 5.5 6722 4661 D 90 ALA H D 91 THR H 1.0 1.8 3.5 6723 4662 D 90 ALA HA D 89 LEU HBx 1.0 1.8 5.5 6724 4662 D 89 LEU HBy D 90 ALA HA 1.0 1.8 5.5 6725 4663 D 90 ALA H D 90 ALA HA 1.0 1.8 4.5 6726 4664 D 90 ALA HA D 93 PHE HBx 1.0 1.8 5.5 6727 4664 D 90 ALA HA D 93 PHE HBy 1.0 1.8 5.5 6728 4665 D 90 ALA HB1 D 90 ALA H 1.0 1.8 3.5 6729 4666 D 90 ALA HB1 D 91 THR H 1.0 1.8 4.5 6730 4667 D 91 THR H D 90 ALA HA 1.0 1.8 4.5 6731 4668 D 91 THR H D 91 THR HA 1.0 1.8 3.5 6732 4669 D 91 THR HG21 D 91 THR H 1.0 1.8 5.5 6733 4670 D 91 THR HG21 D 92 ASP H 1.0 1.8 4.5 6734 4671 D 88 ALA HA D 92 ASP H 1.0 1.8 5.5 6735 4672 D 92 ASP H D 89 LEU HA 1.0 1.8 4.5 6736 4673 D 91 THR H D 92 ASP H 1.0 1.8 3.5 6737 4674 D 92 ASP H D 91 THR HA 1.0 1.8 5.5 6738 4675 D 92 ASP H D 92 ASP HA 1.0 1.8 4.5 6739 4676 D 91 THR HG21 D 92 ASP HA 1.0 1.8 4.5 6740 4677 D 92 ASP H D 92 ASP HA 1.0 1.8 3.5 6741 4678 D 92 ASP HA D 93 PHE H 1.0 1.8 5.5 6742 4679 D 92 ASP HA D 94 VAL H 1.0 1.8 5.5 6743 4680 D 91 THR H D 92 ASP HBx 1.0 1.8 5.5 6744 4680 D 91 THR H D 92 ASP HBy 1.0 1.8 5.5 6745 4681 D 92 ASP H D 92 ASP HBx 1.0 1.8 3.5 6746 4681 D 92 ASP H D 92 ASP HBy 1.0 1.8 3.5 6747 4682 D 93 PHE H D 92 ASP HBx 1.0 1.8 4.5 6748 4682 D 92 ASP HBy D 93 PHE H 1.0 1.8 4.5 6749 4683 D 94 VAL H D 92 ASP HBx 1.0 1.8 5.5 6750 4683 D 92 ASP HBy D 94 VAL H 1.0 1.8 5.5 6751 4684 D 90 ALA HA D 93 PHE H 1.0 1.8 4.5 6752 4685 D 93 PHE H D 93 PHE HA 1.0 1.8 4.5 6753 4686 D 93 PHE H D 93 PHE HA 1.0 1.8 3.5 6754 4687 D 93 PHE HA D 93 PHE HBx 1.0 1.8 5.5 6755 4687 D 93 PHE HBy D 93 PHE HA 1.0 1.8 5.5 6756 4688 D 94 VAL H D 93 PHE HA 1.0 1.8 5.5 6757 4689 D 93 PHE H D 93 PHE HBx 1.0 1.8 3.5 6758 4689 D 93 PHE HBy D 93 PHE H 1.0 1.8 3.5 6759 4690 D 94 VAL H D 93 PHE HBx 1.0 1.8 4.5 6760 4690 D 93 PHE HBy D 94 VAL H 1.0 1.8 4.5 6761 4691 D 90 ALA HA D 93 PHE HD% 1.0 1.8 3.5 6762 4692 D 93 PHE H D 93 PHE HD% 1.0 1.8 4.5 6763 4693 D 94 VAL H D 93 PHE HD% 1.0 1.8 5.5 6764 4694 D 93 PHE HD% D 96 ARG HDx 1.0 1.8 5.5 6765 4694 D 93 PHE HD% D 96 ARG HDy 1.0 1.8 5.5 6766 4695 D 94 VAL H D 95 ARG H 1.0 1.8 3.5 6767 4696 D 94 VAL H D 94 VAL HA 1.0 1.8 3.5 6768 4697 D 95 ARG H D 94 VAL HA 1.0 1.8 5.5 6769 4698 D 94 VAL HB D 95 ARG H 1.0 1.8 3.5 6770 4699 D 90 ALA HB1 D 94 VAL HG11 1.0 1.8 4.5 6771 4699 D 90 ALA HB1 D 94 VAL HG21 1.0 1.8 4.5 6772 4700 D 91 THR HG21 D 94 VAL HG11 1.0 1.8 5.5 6773 4700 D 91 THR HG21 D 94 VAL HG21 1.0 1.8 5.5 6774 4701 D 94 VAL H D 94 VAL HG11 1.0 1.8 3.5 6775 4701 D 94 VAL H D 94 VAL HG21 1.0 1.8 3.5 6776 4702 D 94 VAL H D 95 ARG H 1.0 1.8 3.5 6777 4703 D 95 ARG H D 95 ARG HA 1.0 1.8 4.5 6778 4704 D 95 ARG HE D 95 ARG HDx 1.0 1.8 4.5 6779 4704 D 95 ARG HE D 95 ARG HDy 1.0 1.8 4.5 6780 4705 D 96 ARG H D 95 ARG HBx 1.0 1.8 3.5 6781 4705 D 95 ARG HBy D 96 ARG H 1.0 1.8 3.5 6782 4706 D 95 ARG HE D 95 ARG HH1% 1.0 1.8 4.5 6783 4707 D 95 ARG HE D 95 ARG HH2% 1.0 1.8 4.5 6784 4708 D 96 ARG H D 96 ARG HA 1.0 1.8 4.5 6785 4709 D 96 ARG H D 96 ARG HDx 1.0 1.8 5.5 6786 4709 D 96 ARG HDy D 96 ARG H 1.0 1.8 5.5 6787 4710 D 96 ARG HA D 100 ARG H 1.0 1.8 5.5 6788 4711 D 96 ARG H D 96 ARG HA 1.0 1.8 4.5 6789 4712 D 96 ARG HE D 96 ARG HDx 1.0 1.8 3.5 6790 4712 D 96 ARG HDy D 96 ARG HE 1.0 1.8 3.5 6791 4713 D 96 ARG H D 96 ARG HBx 1.0 1.8 3.5 6792 4713 D 96 ARG H D 96 ARG HBy 1.0 1.8 3.5 6793 4714 D 96 ARG H D 96 ARG HDx 1.0 1.8 5.5 6794 4714 D 96 ARG HDy D 96 ARG H 1.0 1.8 5.5 6795 4715 D 96 ARG HE D 96 ARG HDx 1.0 1.8 3.5 6796 4715 D 96 ARG HDy D 96 ARG HE 1.0 1.8 3.5 6797 4716 D 96 ARG H D 96 ARG HGx 1.0 1.8 5.5 6798 4716 D 96 ARG H D 96 ARG HGy 1.0 1.8 5.5 6799 4717 D 96 ARG HE D 96 ARG HGx 1.0 1.8 3.5 6800 4717 D 96 ARG HE D 96 ARG HGy 1.0 1.8 3.5 6801 4718 D 97 GLU H D 96 ARG HGx 1.0 1.8 5.5 6802 4718 D 96 ARG HGy D 97 GLU H 1.0 1.8 5.5 6803 4719 D 96 ARG HE D 96 ARG HH1% 1.0 1.8 4.5 6804 4720 D 96 ARG HE D 96 ARG HH2% 1.0 1.8 4.5 6805 4721 D 96 ARG HA D 97 GLU H 1.0 1.8 5.5 6806 4722 D 97 GLU H D 97 GLU HA 1.0 1.8 4.5 6807 4723 D 97 GLU HA D 100 ARG HBx 1.0 1.8 4.5 6808 4723 D 97 GLU HA D 100 ARG HBy 1.0 1.8 4.5 6809 4724 D 97 GLU H D 97 GLU HA 1.0 1.8 4.5 6810 4725 D 97 GLU HA D 98 GLU H 1.0 1.8 5.5 6811 4726 D 97 GLU H D 97 GLU HBx 1.0 1.8 3.5 6812 4726 D 97 GLU H D 97 GLU HBy 1.0 1.8 3.5 6813 4727 D 98 GLU H D 97 GLU HBx 1.0 1.8 3.5 6814 4727 D 98 GLU H D 97 GLU HBy 1.0 1.8 3.5 6815 4728 D 97 GLU HBy D 98 GLU HGx 1.0 1.8 4.5 6816 4728 D 98 GLU HGy D 97 GLU HBx 1.0 1.8 4.5 6817 4728 D 97 GLU HBy D 98 GLU HGy 1.0 1.8 4.5 6818 4728 D 97 GLU HBx D 98 GLU HGx 1.0 1.8 4.5 6819 4729 D 97 GLU H D 97 GLU HGx 1.0 1.8 5.5 6820 4729 D 97 GLU H D 97 GLU HGy 1.0 1.8 5.5 6821 4730 D 97 GLU HBy D 97 GLU HGx 1.0 1.8 3.5 6822 4730 D 97 GLU HBx D 97 GLU HGx 1.0 1.8 3.5 6823 4730 D 97 GLU HGy D 97 GLU HBx 1.0 1.8 3.5 6824 4730 D 97 GLU HBy D 97 GLU HGy 1.0 1.8 3.5 6825 4731 D 97 GLU HA D 98 GLU H 1.0 1.8 5.5 6826 4732 D 98 GLU H D 98 GLU HA 1.0 1.8 4.5 6827 4733 D 98 GLU HA D 101 ARG H 1.0 1.8 5.5 6828 4734 D 98 GLU HA D 101 ARG HBx 1.0 1.8 4.5 6829 4734 D 98 GLU HA D 101 ARG HBy 1.0 1.8 4.5 6830 4735 D 98 GLU H D 98 GLU HA 1.0 1.8 4.5 6831 4736 D 98 GLU H D 98 GLU HBx 1.0 1.8 3.5 6832 4736 D 98 GLU H D 98 GLU HBy 1.0 1.8 3.5 6833 4737 D 98 GLU HBx D 98 GLU HGx 1.0 1.8 3.5 6834 4737 D 98 GLU HBy D 98 GLU HGx 1.0 1.8 3.5 6835 4737 D 98 GLU HGy D 98 GLU HBx 1.0 1.8 3.5 6836 4737 D 98 GLU HGy D 98 GLU HBy 1.0 1.8 3.5 6837 4738 D 99 GLU H D 98 GLU HBx 1.0 1.8 4.5 6838 4738 D 98 GLU HBy D 99 GLU H 1.0 1.8 4.5 6839 4739 D 98 GLU H D 98 GLU HGx 1.0 1.8 4.5 6840 4739 D 98 GLU H D 98 GLU HGy 1.0 1.8 4.5 6841 4740 D 99 GLU HA D 102 GLY HAx 1.0 1.8 5.5 6842 4740 D 99 GLU HA D 102 GLY HAy 1.0 1.8 5.5 6843 4741 D 99 GLU H D 99 GLU HA 1.0 1.8 4.5 6844 4742 D 99 GLU H D 99 GLU HBx 1.0 1.8 4.5 6845 4742 D 99 GLU H D 99 GLU HBy 1.0 1.8 4.5 6846 4743 D 99 GLU HBy D 99 GLU HGx 1.0 1.8 3.5 6847 4743 D 99 GLU HBx D 99 GLU HGx 1.0 1.8 3.5 6848 4743 D 99 GLU HGy D 99 GLU HBx 1.0 1.8 3.5 6849 4743 D 99 GLU HBy D 99 GLU HGy 1.0 1.8 3.5 6850 4744 D 99 GLU H D 99 GLU HGx 1.0 1.8 5.5 6851 4744 D 99 GLU H D 99 GLU HGy 1.0 1.8 5.5 6852 4745 D 100 ARG H D 99 GLU H 1.0 1.8 4.5 6853 4746 D 100 ARG H D 99 GLU HA 1.0 1.8 5.5 6854 4747 D 100 ARG H D 100 ARG HA 1.0 1.8 4.5 6855 4748 D 100 ARG HA D 100 ARG HBx 1.0 1.8 4.5 6856 4748 D 100 ARG HBy D 100 ARG HA 1.0 1.8 4.5 6857 4749 D 101 ARG H D 100 ARG HBx 1.0 1.8 4.5 6858 4749 D 100 ARG HBy D 101 ARG H 1.0 1.8 4.5 6859 4750 D 100 ARG HH1% D 100 ARG HE 1.0 1.8 4.5 6860 4751 D 100 ARG HH1% D 101 ARG HE 1.0 1.8 4.5 6861 4752 D 100 ARG HE D 100 ARG HH2% 1.0 1.8 4.5 6862 4753 D 101 ARG HE D 100 ARG HH2% 1.0 1.8 4.5 6863 4754 D 97 GLU HA D 101 ARG H 1.0 1.8 5.5 6864 4755 D 98 GLU HA D 101 ARG H 1.0 1.8 5.5 6865 4756 D 101 ARG HA D 100 ARG HBx 1.0 1.8 5.5 6866 4756 D 100 ARG HBy D 101 ARG HA 1.0 1.8 5.5 6867 4757 D 101 ARG H D 101 ARG HA 1.0 1.8 4.5 6868 4758 D 101 ARG HA D 101 ARG HBx 1.0 1.8 4.5 6869 4758 D 101 ARG HBy D 101 ARG HA 1.0 1.8 4.5 6870 4759 D 101 ARG H D 101 ARG HBx 1.0 1.8 3.5 6871 4759 D 101 ARG H D 101 ARG HBy 1.0 1.8 3.5 6872 4760 D 101 ARG HBx D 101 ARG HGx 1.0 1.8 3.5 6873 4760 D 101 ARG HBy D 101 ARG HGx 1.0 1.8 3.5 6874 4760 D 101 ARG HGy D 101 ARG HBx 1.0 1.8 3.5 6875 4760 D 101 ARG HBy D 101 ARG HGy 1.0 1.8 3.5 6876 4761 D 102 GLY H D 101 ARG HBx 1.0 1.8 5.5 6877 4761 D 101 ARG HBy D 102 GLY H 1.0 1.8 5.5 6878 4762 D 101 ARG H D 101 ARG HGx 1.0 1.8 3.5 6879 4762 D 101 ARG H D 101 ARG HGy 1.0 1.8 3.5 6880 4763 D 102 GLY H D 101 ARG HGx 1.0 1.8 5.5 6881 4763 D 101 ARG HGy D 102 GLY H 1.0 1.8 5.5 6882 4764 D 101 ARG HE D 101 ARG HH1% 1.0 1.8 4.5 6883 4765 D 101 ARG HE D 101 ARG HH2% 1.0 1.8 4.5 6884 4766 D 100 ARG HA D 102 GLY H 1.0 1.8 5.5 6885 4767 D 102 GLY H D 101 ARG HBx 1.0 1.8 5.5 6886 4767 D 101 ARG HBy D 102 GLY H 1.0 1.8 5.5 6887 4768 D 101 ARG HBx D 102 GLY HAx 1.0 1.8 4.5 6888 4768 D 102 GLY HAy D 101 ARG HBx 1.0 1.8 4.5 6889 4768 D 101 ARG HBy D 102 GLY HAy 1.0 1.8 4.5 6890 4768 D 101 ARG HBy D 102 GLY HAx 1.0 1.8 4.5 6891 4769 D 102 GLY H D 102 GLY HAx 1.0 1.8 3.5 6892 4769 D 102 GLY HAy D 102 GLY H 1.0 1.8 3.5 6893 4770 D 103 HIS H D 102 GLY HAx 1.0 1.8 3.5 6894 4770 D 102 GLY HAy D 103 HIS H 1.0 1.8 3.5 6895 4771 D 99 GLU HA D 103 HIS H 1.0 1.8 4.5 6896 4772 D 103 HIS H D 103 HIS HA 1.0 1.8 4.5 6897 4773 D 103 HIS H D 103 HIS HBx 1.0 1.8 4.5 6898 4774 D 103 HIS HBx D 103 HIS HBy 1.0 1.8 3.5 6899 4775 D 103 HIS H D 103 HIS HBy 1.0 1.8 4.5 6900 4776 D 103 HIS HBx D 103 HIS HBy 1.0 1.8 3.5 6901 4777 D 47 TRP HE1 D 38 LEU HD11 1.0 1.8 5.5 6902 4777 D 38 LEU HD21 D 47 TRP HE1 1.0 1.8 5.5 6903 4778 D 1 SER H1 D 6 ARG HDx 1.0 1.8 5.5 6904 4778 D 1 SER H1 D 6 ARG HDy 1.0 1.8 5.5 6905 4779 D 6 ARG H D 1 SER HBx 1.0 1.8 6.5 6906 4779 D 1 SER HBy D 6 ARG H 1.0 1.8 6.5 6907 4780 D 15 LEU H D 81 VAL HG11 1.0 1.8 4.5 6908 4781 D 51 THR HA D 56 GLY H 1.0 1.8 4.5 6909 4782 D 15 LEU HD11 D 78 GLY H 1.0 1.8 5.5 6910 4783 D 12 GLU H D 81 VAL HG11 1.0 1.8 4.5 6911 4784 D 12 GLU H D 85 VAL HG11 1.0 1.8 4.5 6912 4784 D 12 GLU H D 85 VAL HG21 1.0 1.8 4.5 6913 4785 D 63 VAL HG11 D 36 ALA H 1.0 1.8 4.5 6914 4786 D 44 ALA H D 38 LEU HD11 1.0 1.8 4.5 6915 4786 D 38 LEU HD21 D 44 ALA H 1.0 1.8 4.5 6916 4787 D 48 SER H D 38 LEU HD11 1.0 1.8 4.5 6917 4787 D 38 LEU HD21 D 48 SER H 1.0 1.8 4.5 6918 4788 D 2 ALA HB1 D 95 ARG HE 1.0 1.8 5.5 6919 4789 D 52 ALA HB1 D 78 GLY H 1.0 1.8 4.5 6920 4790 D 5 GLU HA D 88 ALA HB1 1.0 1.8 3.5 6921 4791 D 61 TYR HA D 47 TRP HE1 1.0 1.8 5.5 6922 4792 D 47 TRP HZ2 D 71 ALA HA 1.0 1.8 3.5 6923 4793 D 47 TRP HZ2 D 71 ALA HA 1.0 1.8 3.5 6924 4794 D 71 ALA HA D 47 TRP HH2 1.0 1.8 3.5 6925 4795 D 8 ALA HA D 85 VAL HA 1.0 1.8 3.5 6926 4796 D 29 ALA HA D 66 GLU HBx 1.0 1.8 3.5 6927 4796 D 29 ALA HA D 66 GLU HBy 1.0 1.8 3.5 6928 4797 D 77 ALA HA D 18 VAL HG11 1.0 1.8 4.5 6929 4797 D 18 VAL HG21 D 77 ALA HA 1.0 1.8 4.5 6930 4798 D 8 ALA HA D 85 VAL HG11 1.0 1.8 3.5 6931 4798 D 8 ALA HA D 85 VAL HG21 1.0 1.8 3.5 6932 4799 D 8 ALA HA D 84 LEU HD21 1.0 1.8 3.5 6933 4800 D 8 ALA HA D 85 VAL HG11 1.0 1.8 3.5 6934 4800 D 8 ALA HA D 85 VAL HG21 1.0 1.8 3.5 6935 4801 D 52 ALA HA D 74 VAL HG11 1.0 1.8 3.5 6936 4802 D 8 ALA HA D 84 LEU HD21 1.0 1.8 3.5 6937 4803 D 15 LEU HD11 D 78 GLY HAx 1.0 1.8 4.5 6938 4803 D 15 LEU HD11 D 78 GLY HAy 1.0 1.8 4.5 6939 4804 D 15 LEU HD21 D 78 GLY HAx 1.0 1.8 4.5 6940 4804 D 78 GLY HAy D 15 LEU HD21 1.0 1.8 4.5 6941 4805 D 15 LEU HD21 D 78 GLY HAx 1.0 1.8 4.5 6942 4805 D 78 GLY HAy D 15 LEU HD21 1.0 1.8 4.5 6943 4806 D 54 THR HG21 D 78 GLY HAx 1.0 1.8 5.5 6944 4806 D 54 THR HG21 D 78 GLY HAy 1.0 1.8 5.5 6945 4807 D 39 ILE HB D 31 ARG HDx 1.0 1.8 4.5 6946 4807 D 31 ARG HDy D 39 ILE HB 1.0 1.8 4.5 6947 4808 D 39 ILE HB D 31 ARG HDx 1.0 1.8 4.5 6948 4808 D 31 ARG HDy D 39 ILE HB 1.0 1.8 4.5 6949 4809 D 43 ASP HBx D 60 ARG HDx 1.0 1.8 5.5 6950 4809 D 43 ASP HBx D 60 ARG HDy 1.0 1.8 5.5 6951 4810 D 43 ASP HBy D 60 ARG HDx 1.0 1.8 6.5 6952 4810 D 43 ASP HBy D 60 ARG HDy 1.0 1.8 6.5 6953 4811 D 84 LEU HG D 7 GLU HGx 1.0 1.8 4.5 6954 4811 D 84 LEU HG D 7 GLU HGy 1.0 1.8 4.5 6955 4812 D 38 LEU HBx D 60 ARG HDx 1.0 1.8 5.5 6956 4812 D 38 LEU HBy D 60 ARG HDx 1.0 1.8 5.5 6957 4812 D 60 ARG HDy D 38 LEU HBx 1.0 1.8 5.5 6958 4812 D 38 LEU HBy D 60 ARG HDy 1.0 1.8 5.5 6959 4813 D 54 THR HG21 D 79 ILE HG1x 1.0 1.8 3.5 6960 4813 D 54 THR HG21 D 79 ILE HG1y 1.0 1.8 3.5 6961 4814 D 77 ALA HB1 D 18 VAL HG11 1.0 1.8 5.5 6962 4814 D 18 VAL HG21 D 77 ALA HB1 1.0 1.8 5.5 6963 4815 D 11 ALA HB1 D 81 VAL HG21 1.0 1.8 4.5 6964 4816 D 77 ALA HB1 D 18 VAL HG11 1.0 1.8 4.5 6965 4816 D 18 VAL HG21 D 77 ALA HB1 1.0 1.8 4.5 6966 4817 D 29 ALA HB1 D 70 VAL HG21 1.0 1.8 4.5 6967 4818 D 5 GLU H D 88 ALA HB1 1.0 1.8 4.5 6968 4819 D 52 ALA HB1 D 78 GLY H 1.0 1.8 4.5 6969 4820 D 52 ALA HB1 D 82 PHE HE% 1.0 1.8 4.5 6970 4821 D 52 ALA HB1 D 82 PHE HE% 1.0 1.8 4.5 6971 4822 D 71 ALA HB1 D 47 TRP HH2 1.0 1.8 5.5 6972 4823 D 26 ALA HB1 D 47 TRP HE3 1.0 1.8 5.5 6973 4824 D 2 ALA HB1 D 95 ARG HE 1.0 1.8 5.5 6974 4825 D 5 GLU HA D 88 ALA HB1 1.0 1.8 4.5 6975 4826 D 52 ALA HB1 D 82 PHE HE% 1.0 1.8 4.5 6976 4827 D 8 ALA HB1 D 85 VAL HA 1.0 1.8 3.5 6977 4828 D 4 HIS HBx D 88 ALA HB1 1.0 1.8 3.5 6978 4829 D 71 ALA HB1 D 62 PRO HGx 1.0 1.8 4.5 6979 4829 D 71 ALA HB1 D 62 PRO HGy 1.0 1.8 4.5 6980 4830 D 18 VAL HB D 77 ALA HB1 1.0 1.8 3.5 6981 4831 D 71 ALA HB1 D 62 PRO HGx 1.0 1.8 3.5 6982 4831 D 71 ALA HB1 D 62 PRO HGy 1.0 1.8 3.5 6983 4832 D 18 VAL HB D 77 ALA HB1 1.0 1.8 3.5 6984 4833 D 52 ALA HB1 D 19 LEU HD21 1.0 1.8 4.5 6985 4834 D 26 ALA HB1 D 44 ALA HB1 1.0 1.8 4.5 6986 4835 D 54 THR HG21 D 79 ILE HD11 1.0 1.8 3.5 6987 4836 D 53 THR HG21 D 15 LEU HD21 1.0 1.8 4.5 6988 4837 D 51 THR HG21 D 74 VAL HG11 1.0 1.8 3.5 6989 4838 D 54 THR HG21 D 79 ILE HD11 1.0 1.8 3.5 6990 4839 D 45 ILE HD11 D 19 LEU HD21 1.0 1.8 6.5 6991 4840 D 45 ILE HD11 D 19 LEU HD21 1.0 1.8 6.5 6992 4841 D 15 LEU H D 81 VAL HG11 1.0 1.8 4.5 6993 4842 D 15 LEU H D 81 VAL HG11 1.0 1.8 4.5 6994 4843 D 8 ALA H D 88 ALA HB1 1.0 1.8 4.5 6995 4844 D 8 ALA H D 88 ALA HB1 1.0 1.8 4.5 6996 4845 D 52 ALA HA D 78 GLY H 1.0 1.8 4.5 6997 4846 D 52 ALA HA D 78 GLY H 1.0 1.8 4.5 6998 4847 D 61 TYR H D 38 LEU HD11 1.0 1.8 4.5 6999 4847 D 38 LEU HD21 D 61 TYR H 1.0 1.8 4.5 7000 4848 D 37 ALA HB1 D 60 ARG HA 1.0 1.8 4.5 7001 4849 D 26 ALA HA D 38 LEU HD11 1.0 1.8 4.5 7002 4849 D 26 ALA HA D 38 LEU HD21 1.0 1.8 4.5 7003 4850 D 26 ALA HA D 38 LEU HD11 1.0 1.8 4.5 7004 4850 D 26 ALA HA D 38 LEU HD21 1.0 1.8 4.5 7005 4851 D 51 THR HG21 D 74 VAL HG21 1.0 1.8 4.5 7006 4852 D 26 ALA HA D 70 VAL HG21 1.0 1.8 4.5 7007 4853 D 26 ALA HA D 70 VAL HG21 1.0 1.8 4.5 7008 4854 D 82 PHE H D 15 LEU HD21 1.0 1.8 4.5 7009 4855 D 54 THR HG21 D 79 ILE H 1.0 1.8 4.5 7010 4856 D 88 ALA HB1 D 5 GLU HGx 1.0 1.8 4.5 7011 4856 D 5 GLU HGy D 88 ALA HB1 1.0 1.8 4.5 7012 4857 D 52 ALA HB1 D 75 MET HA 1.0 1.8 5.5 7013 4858 D 52 ALA HB1 D 75 MET HA 1.0 1.8 5.5 7014 4859 D 15 LEU HD11 D 52 ALA HA 1.0 1.8 5.5 7015 4860 D 15 LEU HD11 D 52 ALA HA 1.0 1.8 5.5 7016 4861 D 63 VAL H D 30 GLU HGx 1.0 1.8 5.5 7017 4861 D 30 GLU HGy D 63 VAL H 1.0 1.8 5.5 7018 4862 D 15 LEU HD11 D 81 VAL HB 1.0 1.8 5.5 7019 4863 D 26 ALA HA D 70 VAL HG11 1.0 1.8 5.5 7020 4864 D 26 ALA HA D 70 VAL HG11 1.0 1.8 5.5 7021 4865 D 77 ALA HB1 D 14 GLU HGx 1.0 1.8 5.5 7022 4865 D 14 GLU HGy D 77 ALA HB1 1.0 1.8 5.5 7023 4866 D 4 HIS HBy D 88 ALA HB1 1.0 1.8 5.5 7024 4867 D 4 HIS HBy D 88 ALA HB1 1.0 1.8 5.5 7025 4868 D 52 ALA HB1 D 18 VAL HG11 1.0 1.8 5.5 7026 4868 D 18 VAL HG21 D 52 ALA HB1 1.0 1.8 5.5 7027 4869 D 52 ALA HB1 D 18 VAL HG11 1.0 1.8 5.5 7028 4869 D 18 VAL HG21 D 52 ALA HB1 1.0 1.8 5.5 7029 4870 D 71 ALA HB1 D 47 TRP HE1 1.0 1.8 5.5 7030 4871 D 49 VAL H D 19 LEU HD11 1.0 1.8 5.5 7031 4872 D 47 TRP HBy D 60 ARG HGx 1.0 1.8 5.5 7032 4872 D 47 TRP HBy D 60 ARG HGy 1.0 1.8 5.5 7033 4873 D 8 ALA HA D 85 VAL H 1.0 1.8 5.5 7034 4874 D 63 VAL HG11 D 35 GLY HAx 1.0 1.8 5.5 7035 4874 D 63 VAL HG11 D 35 GLY HAy 1.0 1.8 5.5 7036 4875 D 15 LEU HD11 D 77 ALA HA 1.0 1.8 5.5 7037 4876 D 15 LEU HD11 D 77 ALA HA 1.0 1.8 5.5 7038 4877 D 33 ALA HB1 D 63 VAL HB 1.0 1.8 5.5 7039 4878 D 33 ALA HB1 D 63 VAL HB 1.0 1.8 5.5 7040 4879 D 8 ALA HA D 84 LEU HBx 1.0 1.8 5.5 7041 4879 D 84 LEU HBy D 8 ALA HA 1.0 1.8 5.5 7042 4880 D 8 ALA HA D 84 LEU HBx 1.0 1.8 5.5 7043 4880 D 84 LEU HBy D 8 ALA HA 1.0 1.8 5.5 7044 4881 D 8 ALA HA D 84 LEU HBx 1.0 1.8 5.5 7045 4881 D 84 LEU HBy D 8 ALA HA 1.0 1.8 5.5 7046 4882 D 22 ALA HB1 D 71 ALA HA 1.0 1.8 5.5 7047 4883 D 22 ALA HB1 D 71 ALA HA 1.0 1.8 5.5 7048 4884 D 52 ALA HA D 75 MET HBx 1.0 1.8 5.5 7049 4884 D 52 ALA HA D 75 MET HBy 1.0 1.8 5.5 7050 4885 D 53 THR HG21 D 19 LEU HD21 1.0 1.8 5.5 7051 4886 D 53 THR HG21 D 19 LEU HD21 1.0 1.8 5.5 7052 4887 D 38 LEU HA D 61 TYR H 1.0 1.8 5.5 7053 4888 D 38 LEU HA D 61 TYR H 1.0 1.8 5.5 7054 4889 D 52 ALA HA D 19 LEU HD21 1.0 1.8 5.5 7055 4890 D 52 ALA HA D 19 LEU HD21 1.0 1.8 5.5 7056 4891 D 98 GLU HA D 103 HIS H 1.0 1.8 5.5 7057 4892 D 52 ALA HB1 D 74 VAL HB 1.0 1.8 5.5 7058 4893 D 78 GLY HAy D 19 LEU HD21 1.0 1.8 5.5 7059 4893 D 19 LEU HD21 D 78 GLY HAx 1.0 1.8 5.5 7060 4894 D 49 VAL HB D 19 LEU HD21 1.0 1.8 5.5 7061 4895 D 26 ALA HB1 D 44 ALA HA 1.0 1.8 5.5 7062 4896 D 26 ALA HB1 D 44 ALA HA 1.0 1.8 5.5 7063 4897 D 63 VAL HG11 D 33 ALA HB1 1.0 1.8 5.5 7064 4898 D 7 GLU H D 88 ALA HB1 1.0 1.8 5.5 7065 4899 D 8 ALA HB1 D 88 ALA HA 1.0 1.8 5.5 7066 4900 D 53 THR HG21 D 19 LEU HD11 1.0 1.8 5.5 7067 4901 D 53 THR HG21 D 19 LEU HD11 1.0 1.8 5.5 7068 4902 D 18 VAL H D 77 ALA HB1 1.0 1.8 5.5 7069 4903 D 26 ALA HA D 62 PRO HBx 1.0 1.8 5.5 7070 4903 D 26 ALA HA D 62 PRO HBy 1.0 1.8 5.5 7071 4904 D 29 ALA H D 66 GLU HBx 1.0 1.8 5.5 7072 4904 D 29 ALA H D 66 GLU HBy 1.0 1.8 5.5 7073 4905 D 51 THR HG21 D 19 LEU HD21 1.0 1.8 5.5 7074 4906 D 26 ALA HB1 D 62 PRO HDx 1.0 1.8 5.5 7075 4906 D 26 ALA HB1 D 62 PRO HDy 1.0 1.8 5.5 7076 4907 D 14 GLU H D 81 VAL HG11 1.0 1.8 5.5 7077 4908 D 52 ALA HA D 15 LEU HD21 1.0 1.8 5.5 7078 4909 D 88 ALA HB1 D 5 GLU HBx 1.0 1.8 5.5 7079 4909 D 5 GLU HBy D 88 ALA HB1 1.0 1.8 5.5 7080 4910 D 15 LEU HD11 D 53 THR HG21 1.0 1.8 5.5 7081 4911 D 15 LEU HD11 D 53 THR HG21 1.0 1.8 5.5 7082 4912 D 15 LEU HD11 D 53 THR HG21 1.0 1.8 5.5 7083 4913 D 11 ALA HB1 D 82 PHE H 1.0 1.8 5.5 7084 4914 D 26 ALA HB1 D 48 SER HBx 1.0 1.8 5.5 7085 4914 D 26 ALA HB1 D 48 SER HBy 1.0 1.8 5.5 7086 4915 D 36 ALA HA D 63 VAL HB 1.0 1.8 5.5 7087 4916 D 36 ALA HA D 63 VAL HB 1.0 1.8 5.5 7088 4917 D 33 ALA HB1 D 64 THR H 1.0 1.8 5.5 7089 4918 D 52 ALA HA D 74 VAL HB 1.0 1.8 5.5 7090 4919 D 71 ALA HA D 62 PRO HGx 1.0 1.8 5.5 7091 4919 D 71 ALA HA D 62 PRO HGy 1.0 1.8 5.5 7092 4920 D 18 VAL HB D 52 ALA HB1 1.0 1.8 5.5 7093 4921 D 18 VAL HB D 52 ALA HB1 1.0 1.8 5.5 7094 4922 D 71 ALA HB1 D 51 THR HB 1.0 1.8 5.5 7095 4923 D 71 ALA HB1 D 51 THR HB 1.0 1.8 5.5 7096 4924 D 8 ALA HB1 D 85 VAL HB 1.0 1.8 5.5 7097 4925 D 50 GLU H D 19 LEU HD21 1.0 1.8 5.5 7098 4926 D 52 ALA HB1 D 75 MET H 1.0 1.8 5.5 7099 4927 D 84 LEU HG D 8 ALA HA 1.0 1.8 5.5 7100 4928 D 84 LEU HG D 8 ALA HA 1.0 1.8 5.5 7101 4929 D 15 LEU HA D 52 ALA HB1 1.0 1.8 5.5 7102 4930 D 15 LEU HA D 52 ALA HB1 1.0 1.8 5.5 7103 4931 D 39 ILE H D 30 GLU HGx 1.0 1.8 5.5 7104 4931 D 30 GLU HGy D 39 ILE H 1.0 1.8 5.5 7105 4932 D 54 THR H D 79 ILE HG1x 1.0 1.8 5.5 7106 4932 D 54 THR H D 79 ILE HG1y 1.0 1.8 5.5 7107 4933 D 52 ALA HB1 D 19 LEU HBx 1.0 1.8 5.5 7108 4933 D 19 LEU HBy D 52 ALA HB1 1.0 1.8 5.5 7109 4934 D 29 ALA HA D 67 GLY H 1.0 1.8 5.5 7110 4935 D 29 ALA HA D 67 GLY H 1.0 1.8 5.5 7111 4936 D 52 ALA HA D 77 ALA HB1 1.0 1.8 5.5 7112 4937 D 52 ALA HA D 77 ALA HB1 1.0 1.8 5.5 7113 4938 D 9 GLN H D 88 ALA HB1 1.0 1.8 5.5 7114 4939 D 9 GLN H D 88 ALA HB1 1.0 1.8 5.5 7115 4940 D 15 LEU H D 81 VAL HB 1.0 1.8 6.5 7116 4941 D 26 ALA HB1 D 74 VAL HG21 1.0 1.8 6.5 7117 4942 D 15 LEU H D 81 VAL HB 1.0 1.8 6.5 7118 4943 D 15 LEU H D 77 ALA HB1 1.0 1.8 6.5 7119 4944 D 15 LEU H D 77 ALA HB1 1.0 1.8 6.5 7120 4945 D 15 LEU HD11 D 79 ILE H 1.0 1.8 6.5 7121 4946 D 87 ALA HB1 D 4 HIS HBx 1.0 1.8 6.5 7122 4947 D 11 ALA HB1 D 85 VAL HB 1.0 1.8 6.5 7123 4948 D 77 ALA HB1 D 14 GLU HBx 1.0 1.8 6.5 7124 4948 D 14 GLU HBy D 77 ALA HB1 1.0 1.8 6.5 7125 4949 D 77 ALA HB1 D 14 GLU HBx 1.0 1.8 6.5 7126 4949 D 14 GLU HBy D 77 ALA HB1 1.0 1.8 6.5 7127 4950 D 18 VAL HA D 77 ALA HB1 1.0 1.8 6.5 7128 4951 D 18 VAL HA D 77 ALA HB1 1.0 1.8 6.5 7129 4952 D 33 ALA HB1 D 63 VAL H 1.0 1.8 6.5 7130 4953 D 41 TYR HE% D 24 LYS HEx 1.0 1.8 6.5 7131 4953 D 24 LYS HEy D 41 TYR HE% 1.0 1.8 6.5 7132 4954 D 55 VAL HB D 50 GLU HGx 1.0 1.8 6.5 7133 4954 D 50 GLU HGy D 55 VAL HB 1.0 1.8 6.5 7134 4955 D 55 VAL HB D 50 GLU HGx 1.0 1.8 6.5 7135 4955 D 50 GLU HGy D 55 VAL HB 1.0 1.8 6.5 7136 4956 D 52 ALA HA D 77 ALA H 1.0 1.8 6.5 7137 4957 D 52 ALA HA D 77 ALA H 1.0 1.8 6.5 7138 4958 D 12 GLU H D 84 LEU HD21 1.0 1.8 6.5 7139 4959 D 71 ALA HB1 D 47 TRP HZ3 1.0 1.8 6.5 7140 4960 D 87 ALA HB1 D 7 GLU HBx 1.0 1.8 6.5 7141 4960 D 87 ALA HB1 D 7 GLU HBy 1.0 1.8 6.5 7142 4961 D 9 GLN H D 85 VAL HG11 1.0 1.8 6.5 7143 4961 D 9 GLN H D 85 VAL HG21 1.0 1.8 6.5 7144 4962 D 73 GLN HE2x D 21 GLU HBx 1.0 1.8 6.5 7145 4962 D 21 GLU HBy D 73 GLN HE2x 1.0 1.8 6.5 7146 4963 D 4 HIS H D 88 ALA HB1 1.0 1.8 6.5 7147 4964 D 88 ALA HB1 D 7 GLU HGx 1.0 1.8 6.5 7148 4964 D 7 GLU HGy D 88 ALA HB1 1.0 1.8 6.5 7149 4965 D 6 ARG H D 88 ALA HB1 1.0 1.8 6.5 7150 4966 D 87 ALA HB1 D 4 HIS HBy 1.0 1.8 6.5 7151 4967 D 87 ALA HB1 D 4 HIS HBy 1.0 1.8 6.5 7152 4968 D 26 ALA HB1 D 62 PRO HGx 1.0 1.8 6.5 7153 4968 D 26 ALA HB1 D 62 PRO HGy 1.0 1.8 6.5 7154 4969 D 26 ALA HB1 D 62 PRO HGx 1.0 1.8 6.5 7155 4969 D 26 ALA HB1 D 62 PRO HGy 1.0 1.8 6.5 7156 4970 D 79 ILE H D 15 LEU HD21 1.0 1.8 6.5 7157 4971 D 18 VAL HG11 D 78 GLY HAx 1.0 1.8 6.5 7158 4971 D 18 VAL HG21 D 78 GLY HAx 1.0 1.8 6.5 7159 4971 D 78 GLY HAy D 18 VAL HG11 1.0 1.8 6.5 7160 4971 D 18 VAL HG21 D 78 GLY HAy 1.0 1.8 6.5 7161 4972 D 18 VAL HG11 D 78 GLY HAx 1.0 1.8 6.5 7162 4972 D 18 VAL HG21 D 78 GLY HAx 1.0 1.8 6.5 7163 4972 D 78 GLY HAy D 18 VAL HG11 1.0 1.8 6.5 7164 4972 D 18 VAL HG21 D 78 GLY HAy 1.0 1.8 6.5 7165 4973 D 18 VAL HG11 D 78 GLY HAx 1.0 1.8 6.5 7166 4973 D 18 VAL HG21 D 78 GLY HAx 1.0 1.8 6.5 7167 4973 D 78 GLY HAy D 18 VAL HG11 1.0 1.8 6.5 7168 4973 D 18 VAL HG21 D 78 GLY HAy 1.0 1.8 6.5 7169 4974 D 53 THR HG21 D 74 VAL HG11 1.0 1.8 6.5 7170 4975 D 53 THR HG21 D 74 VAL HG11 1.0 1.8 6.5 7171 4976 D 26 ALA HA D 47 TRP HH2 1.0 1.8 6.5 7172 4977 D 52 ALA HB1 D 81 VAL HG21 1.0 1.8 6.5 7173 4978 D 4 HIS HE1 D 88 ALA HB1 1.0 1.8 6.5 7174 4979 D 4 HIS HE1 D 88 ALA HB1 1.0 1.8 6.5 7175 4980 D 26 ALA HB1 D 47 TRP HBy 1.0 1.8 6.5 7176 4981 D 26 ALA HB1 D 47 TRP HBy 1.0 1.8 6.5 7177 4982 D 78 GLY HAy D 19 LEU HD11 1.0 1.8 6.5 7178 4982 D 19 LEU HD11 D 78 GLY HAx 1.0 1.8 6.5 7179 4983 D 38 LEU HA D 60 ARG HA 1.0 1.8 6.5 7180 4984 D 52 ALA HA D 79 ILE HD11 1.0 1.8 6.5 7181 4985 D 52 ALA HA D 79 ILE HD11 1.0 1.8 6.5 7182 4986 D 85 VAL H D 12 GLU HGx 1.0 1.8 6.5 7183 4986 D 12 GLU HGy D 85 VAL H 1.0 1.8 6.5 7184 4987 D 30 GLU H D 66 GLU HBx 1.0 1.8 6.5 7185 4987 D 30 GLU H D 66 GLU HBy 1.0 1.8 6.5 7186 4988 D 77 ALA HB1 D 17 LYS HEx 1.0 1.8 6.5 7187 4988 D 17 LYS HEy D 77 ALA HB1 1.0 1.8 6.5 7188 4989 D 71 ALA HB1 D 22 ALA HB1 1.0 1.8 6.5 7189 4990 D 46 TRP H D 38 LEU HD11 1.0 1.8 6.5 7190 4990 D 38 LEU HD21 D 46 TRP H 1.0 1.8 6.5 7191 4991 D 52 ALA HA D 76 LYS H 1.0 1.8 6.5 7192 4992 D 71 ALA HB1 D 22 ALA HB1 1.0 1.8 6.5 7193 4993 D 52 ALA HA D 76 LYS H 1.0 1.8 6.5 7194 4994 D 87 ALA HB1 D 7 GLU HGx 1.0 1.8 6.5 7195 4994 D 87 ALA HB1 D 7 GLU HGy 1.0 1.8 6.5 7196 4995 D 2 ALA HA D 3 ASP H 1.0 1.8 4.5 7197 4996 D 2 ALA HA D 3 ASP H 1.0 1.8 4.5 7198 4997 D 3 ASP H D 3 ASP HBx 1.0 1.8 4.5 7199 4997 D 3 ASP H D 3 ASP HBy 1.0 1.8 4.5 7200 4998 D 27 VAL HA D 30 GLU H 1.0 1.8 6.5 7201 4999 D 26 ALA HA D 29 ALA HB1 1.0 1.8 5.5 7202 5000 D 27 VAL HA D 30 GLU H 1.0 1.8 6.5 7203 5001 D 30 GLU H D 30 GLU HA 1.0 1.8 4.5 7204 5002 D 33 ALA HB1 D 30 GLU HBx 1.0 1.8 6.5 7205 5002 D 33 ALA HB1 D 30 GLU HBy 1.0 1.8 6.5 7206 5003 D 30 GLU H D 30 GLU HGx 1.0 1.8 4.5 7207 5003 D 30 GLU H D 30 GLU HGy 1.0 1.8 4.5 7208 5004 D 32 GLY H D 31 ARG HBx 1.0 1.8 4.5 7209 5004 D 31 ARG HBy D 32 GLY H 1.0 1.8 4.5 7210 5005 D 39 ILE H D 39 ILE HD11 1.0 1.8 5.5 7211 5006 D 37 ALA HB1 D 39 ILE HG1x 1.0 1.8 6.5 7212 5006 D 37 ALA HB1 D 39 ILE HG1y 1.0 1.8 6.5 7213 5007 D 40 SER H D 39 ILE HG1x 1.0 1.8 4.5 7214 5007 D 39 ILE HG1y D 40 SER H 1.0 1.8 4.5 7215 5008 D 43 ASP HBy D 40 SER HBx 1.0 1.8 5.5 7216 5008 D 40 SER HBy D 43 ASP HBy 1.0 1.8 5.5 7217 5009 D 43 ASP H D 43 ASP HBy 1.0 1.8 4.5 7218 5010 D 43 ASP HBx D 44 ALA HA 1.0 1.8 6.5 7219 5011 D 47 TRP H D 47 TRP HBx 1.0 1.8 5.5 7220 5012 D 47 TRP HA D 47 TRP HE1 1.0 1.8 6.5 7221 5013 D 57 TYR H D 57 TYR HBx 1.0 1.8 4.5 7222 5014 D 60 ARG H D 60 ARG HGx 1.0 1.8 5.5 7223 5014 D 60 ARG H D 60 ARG HGy 1.0 1.8 5.5 7224 5015 D 64 THR HA D 65 GLU H 1.0 1.8 5.5 7225 5016 D 64 THR HB D 66 GLU H 1.0 1.8 6.5 7226 5017 D 66 GLU H D 65 GLU HBy 1.0 1.8 4.5 7227 5018 D 64 THR H D 67 GLY H 1.0 1.8 5.5 7228 5019 D 96 ARG H D 95 ARG HGx 1.0 1.8 5.5 7229 5019 D 96 ARG H D 95 ARG HGy 1.0 1.8 5.5 7230 5020 D 99 GLU H D 95 ARG HGx 1.0 1.8 6.5 7231 5020 D 99 GLU H D 95 ARG HGy 1.0 1.8 6.5 7232 5021 D 36 ALA HA D 63 VAL HG21 1.0 1.8 5.5 7233 5022 D 31 ARG H D 39 ILE HA 1.0 1.8 5.5 7234 5023 D 26 ALA HB1 D 70 VAL HB 1.0 1.8 5.5 7235 5024 D 38 LEU H D 30 GLU HBx 1.0 1.8 6.5 7236 5024 D 30 GLU HBy D 38 LEU H 1.0 1.8 6.5 7237 5025 D 64 THR HB D 33 ALA HB1 1.0 1.8 6.5 7238 5026 D 64 THR HB D 33 ALA HB1 1.0 1.8 6.5 7239 5027 D 68 ARG HA D 62 PRO HDx 1.0 1.8 6.5 7240 5027 D 68 ARG HA D 62 PRO HDy 1.0 1.8 6.5 7241 5028 D 36 ALA HB1 D 63 VAL H 1.0 1.8 6.5 7242 5029 D 60 ARG H D 47 TRP HBx 1.0 1.8 6.5 7243 5030 D 36 ALA HA D 30 GLU HBx 1.0 1.8 6.5 7244 5030 D 30 GLU HBy D 36 ALA HA 1.0 1.8 6.5 7245 5031 D 39 ILE HA D 44 ALA HB1 1.0 1.8 6.5 7246 5032 D 35 GLY HAx D 63 VAL HG21 1.0 1.8 6.5 7247 5032 D 35 GLY HAy D 63 VAL HG21 1.0 1.8 6.5 7248 5033 D 26 ALA HB1 D 38 LEU HA 1.0 1.8 6.5 7249 5034 D 51 THR HG21 D 19 LEU HD21 1.0 1.8 5.5 7250 5034 D 51 THR HG21 D 19 LEU HD11 1.0 1.8 5.5 7251 5035 D 47 TRP HBx D 59 ASP HBx 1.0 1.8 5.5 7252 5035 D 47 TRP HBx D 59 ASP HBy 1.0 1.8 5.5 7253 5036 D 47 TRP HBy D 59 ASP HBx 1.0 1.8 5.5 7254 5036 D 47 TRP HBy D 59 ASP HBy 1.0 1.8 5.5 7255 5037 D 65 GLU H D 33 ALA HB1 1.0 1.8 5.5 7256 5038 D 33 ALA HB1 D 65 GLU HBy 1.0 1.8 5.5 7257 5039 D 33 ALA HB1 D 65 GLU HA 1.0 1.8 5.5 7258 5040 D 33 ALA HB1 D 65 GLU HBx 1.0 1.8 5.5 7259 5041 D 33 ALA HB1 D 65 GLU HGx 1.0 1.8 5.5 7260 5041 D 33 ALA HB1 D 65 GLU HGy 1.0 1.8 5.5 7261 5042 D 34 PRO HDx D 65 GLU HA 1.0 1.8 5.5 7262 5043 D 34 PRO HDx D 65 GLU HA 1.0 1.8 5.5 7263 5044 D 52 ALA HA D 18 VAL HG11 1.0 1.8 5.5 7264 5044 D 18 VAL HG21 D 52 ALA HA 1.0 1.8 5.5 7265 5045 D 22 ALA HB1 D 52 ALA HB1 1.0 1.8 5.5 7266 5046 D 22 ALA HB1 D 52 ALA HB1 1.0 1.8 5.5 7267 5047 D 22 ALA HB1 D 52 ALA HB1 1.0 1.8 5.5 7268 5048 D 22 ALA HB1 D 52 ALA HB1 1.0 1.8 5.5 7269 5049 D 15 LEU HD11 D 51 THR HG21 1.0 1.8 5.5 7270 5050 D 29 ALA HB1 D 63 VAL H 1.0 1.8 5.5 7271 5051 D 26 ALA HB1 D 48 SER H 1.0 1.8 5.5 7272 5052 D 27 VAL HB D 41 TYR H 1.0 1.8 5.5 7273 5053 D 26 ALA HB1 D 48 SER HA 1.0 1.8 5.5 7274 5054 D 54 THR HG21 D 15 LEU HD21 1.0 1.8 5.5 7275 5055 D 27 VAL HB D 38 LEU HD11 1.0 1.8 5.5 7276 5055 D 27 VAL HB D 38 LEU HD21 1.0 1.8 5.5 7277 5056 D 16 GLN HA D 52 ALA HB1 1.0 1.8 5.5 7278 5057 D 30 GLU HA D 36 ALA HA 1.0 1.8 5.5 7279 5058 D 51 THR H D 19 LEU HD11 1.0 1.8 5.5 7280 5059 D 26 ALA HB1 D 47 TRP HE1 1.0 1.8 5.5 7281 5060 D 27 VAL HB D 40 SER H 1.0 1.8 5.5 7282 5061 D 15 LEU HG D 52 ALA HA 1.0 1.8 5.5 7283 5062 D 52 ALA HB1 D 16 GLN HGx 1.0 1.8 5.5 7284 5062 D 16 GLN HGy D 52 ALA HB1 1.0 1.8 5.5 7285 5063 D 27 VAL HA D 44 ALA HA 1.0 1.8 5.5 7286 5064 D 27 VAL HA D 44 ALA HA 1.0 1.8 5.5 7287 5065 D 27 VAL HA D 44 ALA HA 1.0 1.8 5.5 7288 5066 D 27 VAL HA D 44 ALA HA 1.0 1.8 5.5 7289 5067 D 17 LYS H D 16 GLN HBx 1.0 1.8 4.5 7290 5067 D 17 LYS H D 16 GLN HBy 1.0 1.8 4.5 7291 5068 D 9 GLN H D 8 ALA HB1 1.0 1.8 4.5 7292 5069 D 71 ALA HB1 D 72 GLU H 1.0 1.8 4.5 7293 5070 D 71 ALA HB1 D 72 GLU H 1.0 1.8 4.5 7294 5071 D 61 TYR H D 38 LEU HBx 1.0 1.8 4.5 7295 5071 D 38 LEU HBy D 61 TYR H 1.0 1.8 4.5 7296 5072 D 15 LEU HA D 77 ALA HB1 1.0 1.8 4.5 7297 5073 D 90 ALA H D 89 LEU H 1.0 1.8 4.5 7298 5074 D 90 ALA H D 89 LEU H 1.0 1.8 4.5 7299 5075 D 56 GLY HAx D 57 TYR H 1.0 1.8 4.5 7300 5076 D 56 GLY HAx D 57 TYR H 1.0 1.8 4.5 7301 5077 D 77 ALA HA D 80 GLU HBx 1.0 1.8 4.5 7302 5077 D 77 ALA HA D 80 GLU HBy 1.0 1.8 4.5 7303 5078 D 6 ARG H D 5 GLU HBx 1.0 1.8 4.5 7304 5078 D 6 ARG H D 5 GLU HBy 1.0 1.8 4.5 7305 5079 D 40 SER H D 40 SER HBx 1.0 1.8 4.5 7306 5079 D 40 SER H D 40 SER HBy 1.0 1.8 4.5 7307 5080 D 71 ALA HB1 D 62 PRO HDx 1.0 1.8 4.5 7308 5080 D 71 ALA HB1 D 62 PRO HDy 1.0 1.8 4.5 7309 5081 D 71 ALA HB1 D 62 PRO HDx 1.0 1.8 4.5 7310 5081 D 71 ALA HB1 D 62 PRO HDy 1.0 1.8 4.5 7311 5082 D 92 ASP H D 93 PHE H 1.0 1.8 4.5 7312 5083 D 68 ARG HE D 68 ARG HGx 1.0 1.8 4.5 7313 5083 D 68 ARG HGy D 68 ARG HE 1.0 1.8 4.5 7314 5084 D 89 LEU H D 88 ALA HB1 1.0 1.8 4.5 7315 5085 D 89 LEU H D 88 ALA HB1 1.0 1.8 4.5 7316 5086 D 71 ALA HA D 74 VAL HB 1.0 1.8 4.5 7317 5087 D 49 VAL H D 19 LEU HD21 1.0 1.8 4.5 7318 5088 D 63 VAL HG11 D 36 ALA HA 1.0 1.8 4.5 7319 5089 D 63 VAL HG11 D 36 ALA HA 1.0 1.8 4.5 7320 5090 D 63 VAL HG11 D 36 ALA HA 1.0 1.8 4.5 7321 5091 D 86 THR H D 85 VAL HG11 1.0 1.8 4.5 7322 5091 D 86 THR H D 85 VAL HG21 1.0 1.8 4.5 7323 5092 D 77 ALA HB1 D 73 GLN HGx 1.0 1.8 4.5 7324 5092 D 77 ALA HB1 D 73 GLN HGy 1.0 1.8 4.5 7325 5093 D 97 GLU H D 96 ARG HBx 1.0 1.8 4.5 7326 5093 D 96 ARG HBy D 97 GLU H 1.0 1.8 4.5 7327 5094 D 97 GLU H D 96 ARG HBx 1.0 1.8 4.5 7328 5094 D 96 ARG HBy D 97 GLU H 1.0 1.8 4.5 7329 5095 D 53 THR HG21 D 49 VAL HG11 1.0 1.8 4.5 7330 5096 D 66 GLU H D 66 GLU HGx 1.0 1.8 4.5 7331 5096 D 66 GLU H D 66 GLU HGy 1.0 1.8 4.5 7332 5097 D 19 LEU H D 19 LEU HD11 1.0 1.8 5.5 7333 5098 D 66 GLU H D 65 GLU HGx 1.0 1.8 5.5 7334 5098 D 66 GLU H D 65 GLU HGy 1.0 1.8 5.5 7335 5099 D 26 ALA HB1 D 30 GLU HGx 1.0 1.8 5.5 7336 5099 D 26 ALA HB1 D 30 GLU HGy 1.0 1.8 5.5 7337 5100 D 26 ALA HA D 70 VAL HB 1.0 1.8 5.5 7338 5101 D 57 TYR H D 57 TYR HD% 1.0 1.8 5.5 7339 5102 D 58 GLY H D 57 TYR HBx 1.0 1.8 5.5 7340 5103 D 51 THR HA D 54 THR HA 1.0 1.8 5.5 7341 5104 D 90 ALA HB1 D 87 ALA HA 1.0 1.8 5.5 7342 5105 D 97 GLU H D 96 ARG HDx 1.0 1.8 5.5 7343 5105 D 96 ARG HDy D 97 GLU H 1.0 1.8 5.5 7344 5106 D 97 GLU H D 96 ARG HDx 1.0 1.8 5.5 7345 5106 D 96 ARG HDy D 97 GLU H 1.0 1.8 5.5 7346 5107 D 7 GLU H D 4 HIS HA 1.0 1.8 5.5 7347 5108 D 91 THR HB D 92 ASP H 1.0 1.8 5.5 7348 5109 D 91 THR HB D 92 ASP H 1.0 1.8 5.5 7349 5110 D 10 LYS HGx D 14 GLU HBx 1.0 1.8 5.5 7350 5110 D 10 LYS HGy D 14 GLU HBx 1.0 1.8 5.5 7351 5110 D 14 GLU HBy D 10 LYS HGx 1.0 1.8 5.5 7352 5110 D 10 LYS HGy D 14 GLU HBy 1.0 1.8 5.5 7353 5111 D 88 ALA HB1 D 7 GLU HBx 1.0 1.8 5.5 7354 5111 D 7 GLU HBy D 88 ALA HB1 1.0 1.8 5.5 7355 5112 D 85 VAL HA D 88 ALA HB1 1.0 1.8 5.5 7356 5113 D 57 TYR HBx D 59 ASP HBx 1.0 1.8 5.5 7357 5113 D 57 TYR HBx D 59 ASP HBy 1.0 1.8 5.5 7358 5114 D 87 ALA H D 84 LEU HA 1.0 1.8 5.5 7359 5115 D 60 ARG H D 58 GLY H 1.0 1.8 5.5 7360 5116 D 15 LEU HD11 D 77 ALA H 1.0 1.8 5.5 7361 5117 D 84 LEU HD11 D 8 ALA HA 1.0 1.8 5.5 7362 5118 D 84 LEU HD11 D 8 ALA HA 1.0 1.8 5.5 7363 5119 D 90 ALA HA D 94 VAL HG11 1.0 1.8 5.5 7364 5119 D 90 ALA HA D 94 VAL HG21 1.0 1.8 5.5 7365 5120 D 12 GLU HBx D 16 GLN HGx 1.0 1.8 5.5 7366 5120 D 12 GLU HBy D 16 GLN HGx 1.0 1.8 5.5 7367 5120 D 16 GLN HGy D 12 GLU HBx 1.0 1.8 5.5 7368 5120 D 12 GLU HBy D 16 GLN HGy 1.0 1.8 5.5 7369 5121 D 53 THR HG21 D 78 GLY HAx 1.0 1.8 5.5 7370 5121 D 53 THR HG21 D 78 GLY HAy 1.0 1.8 5.5 7371 5122 D 8 ALA HA D 88 ALA HB1 1.0 1.8 5.5 7372 5123 D 8 ALA HA D 88 ALA HB1 1.0 1.8 5.5 7373 5124 D 90 ALA H D 89 LEU HD11 1.0 1.8 5.5 7374 5125 D 26 ALA HB1 D 70 VAL HG21 1.0 1.8 5.5 7375 5126 D 52 ALA HB1 D 82 PHE HZ 1.0 1.8 5.5 7376 5127 D 83 ALA H D 79 ILE HG21 1.0 1.8 5.5 7377 5128 D 89 LEU HD11 D 85 VAL HB 1.0 1.8 5.5 7378 5129 D 17 LYS H D 17 LYS HEx 1.0 1.8 5.5 7379 5129 D 17 LYS H D 17 LYS HEy 1.0 1.8 5.5 7380 5130 D 50 GLU HA D 53 THR H 1.0 1.8 5.5 7381 5131 D 90 ALA H D 87 ALA HA 1.0 1.8 5.5 7382 5132 D 9 GLN H D 84 LEU HD21 1.0 1.8 6.5 7383 5133 D 69 LYS HA D 68 ARG HBx 1.0 1.8 6.5 7384 5133 D 68 ARG HBy D 69 LYS HA 1.0 1.8 6.5 7385 5134 D 47 TRP H D 49 VAL H 1.0 1.8 6.5 7386 5135 D 37 ALA HB1 D 62 PRO HDx 1.0 1.8 6.5 7387 5135 D 37 ALA HB1 D 62 PRO HDy 1.0 1.8 6.5 7388 5136 D 86 THR HG21 D 89 LEU HD11 1.0 1.8 6.5 7389 5137 D 52 ALA HB1 D 82 PHE HD% 1.0 1.8 6.5 7390 5138 D 85 VAL H D 81 VAL HG11 1.0 1.8 6.5 7391 5139 D 74 VAL HG11 D 78 GLY HAx 1.0 1.8 6.5 7392 5139 D 74 VAL HG11 D 78 GLY HAy 1.0 1.8 6.5 7393 5140 D 7 GLU HGy D 84 LEU HBx 1.0 1.8 6.5 7394 5140 D 84 LEU HBy D 7 GLU HGx 1.0 1.8 6.5 7395 5140 D 84 LEU HBy D 7 GLU HGy 1.0 1.8 6.5 7396 5140 D 7 GLU HGx D 84 LEU HBx 1.0 1.8 6.5 7397 5141 D 94 VAL HA D 93 PHE HBx 1.0 1.8 6.5 7398 5141 D 93 PHE HBy D 94 VAL HA 1.0 1.8 6.5 7399 5142 D 57 TYR HD% D 59 ASP H 1.0 1.8 6.5 7400 5143 D 52 ALA HB1 D 74 VAL HG21 1.0 1.8 6.5 7401 5144 D 83 ALA H D 82 PHE HD% 1.0 1.8 6.5 7402 5145 D 49 VAL HA D 53 THR H 1.0 1.8 6.5 7403 5146 D 70 VAL HG11 D 74 VAL H 1.0 1.8 6.5 7404 5147 D 53 THR HA D 82 PHE HBx 1.0 1.8 6.5 7405 5148 D 65 GLU HBy D 34 PRO HBx 1.0 1.8 6.5 7406 5148 D 34 PRO HBy D 65 GLU HBy 1.0 1.8 6.5 7407 5149 D 18 VAL HB D 74 VAL HG21 1.0 1.8 6.5 7408 5150 D 52 ALA HB1 D 79 ILE H 1.0 1.8 6.5 7409 5151 D 52 ALA HB1 D 79 ILE H 1.0 1.8 6.5 7410 5152 D 46 TRP HBy D 60 ARG HGx 1.0 1.8 6.5 7411 5152 D 46 TRP HBx D 60 ARG HGx 1.0 1.8 6.5 7412 5152 D 60 ARG HGy D 46 TRP HBx 1.0 1.8 6.5 7413 5152 D 46 TRP HBy D 60 ARG HGy 1.0 1.8 6.5 7414 5153 D 51 THR HB D 56 GLY H 1.0 1.8 6.5 7415 5154 D 51 THR HB D 56 GLY H 1.0 1.8 6.5 7416 5155 D 86 THR HB D 83 ALA HA 1.0 1.8 6.5 7417 5156 D 88 ALA HB1 D 92 ASP HBx 1.0 1.8 6.5 7418 5156 D 88 ALA HB1 D 92 ASP HBy 1.0 1.8 6.5 7419 5157 D 64 THR HG21 D 63 VAL HG21 1.0 1.8 6.5 7420 5158 D 52 ALA HA D 79 ILE HG1x 1.0 1.8 6.5 7421 5158 D 52 ALA HA D 79 ILE HG1y 1.0 1.8 6.5 7422 5159 D 52 ALA HA D 79 ILE HG1x 1.0 1.8 6.5 7423 5159 D 52 ALA HA D 79 ILE HG1y 1.0 1.8 6.5 7424 5160 D 52 ALA HA D 79 ILE HG1x 1.0 1.8 6.5 7425 5160 D 52 ALA HA D 79 ILE HG1y 1.0 1.8 6.5 7426 5161 D 90 ALA HA D 94 VAL H 1.0 1.8 6.5 7427 5162 D 93 PHE H D 93 PHE HE% 1.0 1.8 6.5 7428 5163 D 26 ALA HB1 D 30 GLU HBx 1.0 1.8 6.5 7429 5163 D 26 ALA HB1 D 30 GLU HBy 1.0 1.8 6.5 7430 5164 D 51 THR HG21 D 56 GLY HAx 1.0 1.8 6.5 7431 5165 D 52 ALA HB1 D 77 ALA H 1.0 1.8 6.5 7432 5166 D 64 THR HA D 33 ALA HB1 1.0 1.8 6.5 7433 5167 D 52 ALA HB1 D 77 ALA H 1.0 1.8 6.5 7434 5168 D 52 ALA H D 78 GLY HAx 1.0 1.8 6.5 7435 5168 D 52 ALA H D 78 GLY HAy 1.0 1.8 6.5 7436 5169 D 27 VAL HA D 38 LEU HA 1.0 1.8 6.5 7437 5170 D 15 LEU HD11 D 54 THR H 1.0 1.8 6.5 7438 5171 D 52 ALA HA D 19 LEU HD11 1.0 1.8 6.5 7439 5172 D 42 PRO HA D 23 SER HBx 1.0 1.8 6.5 7440 5172 D 23 SER HBy D 42 PRO HA 1.0 1.8 6.5 7441 5173 D 52 ALA HA D 82 PHE HE% 1.0 1.8 6.5 7442 5174 D 48 SER H D 19 LEU HD11 1.0 1.8 6.5 7443 5175 D 23 SER H D 38 LEU HD11 1.0 1.8 6.5 7444 5175 D 23 SER H D 38 LEU HD21 1.0 1.8 6.5 7445 5176 D 26 ALA HB1 D 44 ALA H 1.0 1.8 6.5 7446 5177 D 16 GLN H D 52 ALA HB1 1.0 1.8 6.5 7447 5178 D 81 VAL HA D 85 VAL H 1.0 1.8 6.5 7448 5179 D 26 ALA HA D 47 TRP HZ2 1.0 1.8 6.5 7449 5180 D 26 ALA HA D 47 TRP HZ2 1.0 1.8 6.5 7450 5181 D 29 ALA HA D 66 GLU H 1.0 1.8 6.5 7451 5182 D 26 ALA HB1 D 45 ILE H 1.0 1.8 6.5 7452 5183 D 26 ALA HB1 D 45 ILE H 1.0 1.8 6.5 7453 5184 D 24 LYS H D 45 ILE HB 1.0 1.8 6.5 7454 5185 D 22 ALA HB1 D 51 THR HB 1.0 1.8 6.5 7455 5186 D 22 ALA HB1 D 51 THR HB 1.0 1.8 6.5 7456 5187 D 15 LEU HD11 D 54 THR HG21 1.0 1.8 6.5 7457 5188 D 15 LEU HD11 D 54 THR HG21 1.0 1.8 6.5 7458 5189 D 15 LEU HD11 D 54 THR HG21 1.0 1.8 6.5 7459 5190 D 24 LYS H D 45 ILE HA 1.0 1.8 6.5 7460 5191 D 24 LYS H D 45 ILE HA 1.0 1.8 6.5 7461 5192 D 50 GLU HGy D 60 ARG HBx 1.0 1.8 6.5 7462 5192 D 50 GLU HGx D 60 ARG HBx 1.0 1.8 6.5 7463 5192 D 60 ARG HBy D 50 GLU HGx 1.0 1.8 6.5 7464 5192 D 50 GLU HGy D 60 ARG HBy 1.0 1.8 6.5 7465 5193 D 91 THR HB D 88 ALA HB1 1.0 1.8 6.5 7466 5194 D 85 VAL HB D 12 GLU HGx 1.0 1.8 6.5 7467 5194 D 12 GLU HGy D 85 VAL HB 1.0 1.8 6.5 7468 5195 D 23 SER H D 48 SER HA 1.0 1.8 6.5 7469 5196 D 23 SER H D 48 SER HA 1.0 1.8 6.5 7470 5197 D 32 GLY H D 66 GLU HBx 1.0 1.8 6.5 7471 5197 D 32 GLY H D 66 GLU HBy 1.0 1.8 6.5 7472 5198 D 29 ALA HB1 D 68 ARG HBx 1.0 1.8 6.5 7473 5198 D 68 ARG HBy D 29 ALA HB1 1.0 1.8 6.5 7474 5199 D 27 VAL HA D 40 SER HBx 1.0 1.8 6.5 7475 5199 D 27 VAL HA D 40 SER HBy 1.0 1.8 6.5 7476 5200 D 51 THR HG21 D 78 GLY HAx 1.0 1.8 6.5 7477 5200 D 51 THR HG21 D 78 GLY HAy 1.0 1.8 6.5 7478 5201 D 51 THR HG21 D 19 LEU HD11 1.0 1.8 6.5 7479 5202 D 71 ALA H D 68 ARG HBx 1.0 1.8 6.5 7480 5202 D 68 ARG HBy D 71 ALA H 1.0 1.8 6.5 7481 5203 D 23 SER H D 70 VAL HG11 1.0 1.8 6.5 7482 5204 D 36 ALA H D 30 GLU HBx 1.0 1.8 6.5 7483 5204 D 30 GLU HBy D 36 ALA H 1.0 1.8 6.5 7484 5205 D 19 LEU HG D 52 ALA HA 1.0 1.8 6.5 7485 5206 D 48 SER HA D 71 ALA HA 1.0 1.8 6.5 7486 5207 D 18 VAL H D 52 ALA HB1 1.0 1.8 6.5 7487 5208 D 18 VAL H D 52 ALA HB1 1.0 1.8 6.5 7488 5209 D 30 GLU H D 39 ILE HA 1.0 1.8 6.5 7489 5210 D 89 LEU HA D 93 PHE H 1.0 1.8 6.5 7490 5211 D 25 LYS HBy D 67 GLY HAx 1.0 1.8 6.5 7491 5211 D 25 LYS HBx D 67 GLY HAx 1.0 1.8 6.5 7492 5211 D 67 GLY HAy D 25 LYS HBx 1.0 1.8 6.5 7493 5211 D 25 LYS HBy D 67 GLY HAy 1.0 1.8 6.5 7494 5212 D 44 ALA HB1 D 25 LYS HBx 1.0 1.8 6.5 7495 5212 D 25 LYS HBy D 44 ALA HB1 1.0 1.8 6.5 7496 5213 D 26 ALA HB1 D 51 THR HG21 1.0 1.8 6.5 7497 5214 D 34 PRO HA D 65 GLU HBy 1.0 1.8 6.5 7498 5215 D 47 TRP HE1 D 59 ASP HBx 1.0 1.8 6.5 7499 5215 D 47 TRP HE1 D 59 ASP HBy 1.0 1.8 6.5 7500 5216 D 45 ILE HD11 A 69 LYS HEx 1.0 1.8 6.5 7501 5216 A 69 LYS HEy D 45 ILE HD11 1.0 1.8 6.5 7502 5217 A 69 LYS HEx D 45 ILE HG1x 1.0 1.8 6.5 7503 5217 A 69 LYS HEy D 45 ILE HG1x 1.0 1.8 6.5 7504 5217 D 45 ILE HG1y A 69 LYS HEx 1.0 1.8 6.5 7505 5217 A 69 LYS HEy D 45 ILE HG1y 1.0 1.8 6.5 7506 5218 A 64 THR HG2% D 45 ILE HG21 1.0 1.8 5.5 7507 5219 D 46 TRP HD1 A 68 ARG HDx 1.0 1.8 5.5 7508 5219 A 68 ARG HDy D 46 TRP HD1 1.0 1.8 5.5 7509 5220 A 64 THR HA D 46 TRP HE1 1.0 1.8 5.5 7510 5221 A 64 THR HG2% D 46 TRP HE1 1.0 1.8 5.5 7511 5222 A 68 ARG HA D 46 TRP HE1 1.0 1.8 5.5 7512 5223 D 46 TRP HE1 A 68 ARG HBx 1.0 1.8 5.5 7513 5223 A 68 ARG HBy D 46 TRP HE1 1.0 1.8 5.5 7514 5224 D 46 TRP HE3 A 68 ARG HDx 1.0 1.8 6.5 7515 5224 A 68 ARG HDy D 46 TRP HE3 1.0 1.8 6.5 7516 5225 D 46 TRP HZ2 A 68 ARG HBx 1.0 1.8 6.5 7517 5225 A 68 ARG HBy D 46 TRP HZ2 1.0 1.8 6.5 7518 5226 A 68 ARG HBx D 46 TRP HBx 1.0 1.8 6.5 7519 5226 A 68 ARG HBy D 46 TRP HBx 1.0 1.8 6.5 7520 5226 D 46 TRP HBy A 68 ARG HBx 1.0 1.8 6.5 7521 5226 A 68 ARG HBy D 46 TRP HBy 1.0 1.8 6.5 7522 5227 A 68 ARG HDx D 46 TRP HBx 1.0 1.8 6.5 7523 5227 A 68 ARG HDy D 46 TRP HBx 1.0 1.8 6.5 7524 5227 D 46 TRP HBy A 68 ARG HDx 1.0 1.8 6.5 7525 5227 A 68 ARG HDy D 46 TRP HBy 1.0 1.8 6.5 7526 5228 A 68 ARG HGy D 46 TRP HBx 1.0 1.8 6.5 7527 5228 A 68 ARG HGx D 46 TRP HBx 1.0 1.8 6.5 7528 5228 D 46 TRP HBy A 68 ARG HGx 1.0 1.8 6.5 7529 5228 A 68 ARG HGy D 46 TRP HBy 1.0 1.8 6.5 7530 5229 A 72 GLU HGx D 49 VAL HG21 1.0 1.8 6.5 7531 5229 A 72 GLU HGy D 49 VAL HG21 1.0 1.8 6.5 7532 5229 D 49 VAL HG11 A 72 GLU HGx 1.0 1.8 6.5 7533 5229 A 72 GLU HGy D 49 VAL HG11 1.0 1.8 6.5 7534 5230 A 72 GLU HA D 50 GLU HA 1.0 1.8 5.5 7535 5231 A 71 ALA HB% D 50 GLU HBx 1.0 1.8 5.5 7536 5231 A 71 ALA HB% D 50 GLU HBy 1.0 1.8 5.5 7537 5232 A 75 MET HE% D 55 VAL HB 1.0 1.8 5.5 7538 5233 A 54 THR HB D 55 VAL HG11 1.0 1.8 6.5 7539 5233 A 54 THR HB D 55 VAL HG21 1.0 1.8 6.5 7540 5234 A 56 GLY HA3 D 57 TYR HBy 1.0 1.8 5.5 7541 5235 A 61 TYR HA D 57 TYR HBy 1.0 1.8 5.5 7542 5236 A 60 ARG H D 57 TYR HD% 1.0 1.8 5.5 7543 5237 A 71 ALA HB% D 57 TYR HD% 1.0 1.8 5.5 7544 5238 A 58 GLY H D 57 TYR HE% 1.0 1.8 5.5 7545 5239 D 59 ASP HA A 61 TYR HBx 1.0 1.8 5.5 7546 5239 A 61 TYR HBy D 59 ASP HA 1.0 1.8 5.5 7547 5240 A 61 TYR HE% D 59 ASP HBx 1.0 1.8 6.5 7548 5240 D 59 ASP HBy A 61 TYR HE% 1.0 1.8 6.5 7549 5241 A 76 LYS HEx D 81 VAL HG21 1.0 1.8 6.5 7550 5241 A 76 LYS HEy D 81 VAL HG21 1.0 1.8 6.5 7551 5241 D 81 VAL HG11 A 76 LYS HEx 1.0 1.8 6.5 7552 5241 D 81 VAL HG11 A 76 LYS HEy 1.0 1.8 6.5 7553 5242 D 82 PHE HD% A 76 LYS HEx 1.0 1.8 6.5 7554 5242 D 82 PHE HD% A 76 LYS HEy 1.0 1.8 6.5 7555 5243 D 82 PHE HE% A 76 LYS HEx 1.0 1.8 6.5 7556 5243 D 82 PHE HE% A 76 LYS HEy 1.0 1.8 6.5 7557 5244 D 89 LEU HA A 84 LEU HDy% 1.0 1.8 6.5 7558 5244 D 89 LEU HA A 84 LEU HDx% 1.0 1.8 6.5 7559 5245 A 86 THR H D 89 LEU HBx 1.0 1.8 5.5 7560 5245 A 86 THR H D 89 LEU HBy 1.0 1.8 5.5 7561 5246 A 87 ALA H D 89 LEU HBx 1.0 1.8 5.5 7562 5246 A 87 ALA H D 89 LEU HBy 1.0 1.8 5.5 7563 5247 A 83 ALA H D 89 LEU HD11 1.0 1.8 5.5 7564 5248 A 87 ALA H D 89 LEU HD11 1.0 1.8 5.5 7565 5249 A 87 ALA HB% D 89 LEU HD21 1.0 1.8 6.5 7566 5249 A 87 ALA HB% D 89 LEU HD11 1.0 1.8 6.5 7567 5250 A 86 THR HB D 92 ASP HBx 1.0 1.8 5.5 7568 5250 A 86 THR HB D 92 ASP HBy 1.0 1.8 5.5 7569 5251 A 90 ALA HB% D 92 ASP HBx 1.0 1.8 6.5 7570 5251 A 90 ALA HB% D 92 ASP HBy 1.0 1.8 6.5 7571 5252 A 86 THR HG2% D 93 PHE H 1.0 1.8 5.5 7572 5253 A 87 ALA H D 93 PHE H 1.0 1.8 5.5 7573 5254 A 90 ALA H D 93 PHE HBx 1.0 1.8 5.5 7574 5254 A 90 ALA H D 93 PHE HBy 1.0 1.8 5.5 7575 5255 A 94 VAL HB D 96 ARG HE 1.0 1.8 5.5 7576 5256 A 4 HIS H D 96 ARG HBx 1.0 1.8 6.5 7577 5256 A 4 HIS H D 96 ARG HBy 1.0 1.8 6.5 7578 5257 A 87 ALA HB% D 96 ARG HBx 1.0 1.8 5.5 7579 5257 A 87 ALA HB% D 96 ARG HBy 1.0 1.8 5.5 7580 5258 A 87 ALA HB% D 96 ARG HDx 1.0 1.8 6.5 7581 5258 A 87 ALA HB% D 96 ARG HDy 1.0 1.8 6.5 7582 5259 A 90 ALA HB% D 96 ARG HDx 1.0 1.8 6.5 7583 5259 A 90 ALA HB% D 96 ARG HDy 1.0 1.8 6.5 7584 5260 A 91 THR HG2% D 96 ARG HDx 1.0 1.8 6.5 7585 5260 A 91 THR HG2% D 96 ARG HDy 1.0 1.8 6.5 7586 5261 A 64 THR HB D 43 ASP HBy 1.0 1.8 6.5 7587 5262 A 60 ARG H D 57 TYR HE% 1.0 1.8 6.5 7588 5263 A 69 LYS H D 46 TRP HH2 1.0 1.8 6.5 7589 5264 A 68 ARG HGy D 50 GLU HGx 1.0 1.8 6.5 7590 5264 A 68 ARG HGx D 50 GLU HGx 1.0 1.8 6.5 7591 5264 D 50 GLU HGy A 68 ARG HGx 1.0 1.8 6.5 7592 5264 A 68 ARG HGy D 50 GLU HGy 1.0 1.8 6.5 7593 5265 A 91 THR HG2% D 93 PHE H 1.0 1.8 6.5 7594 5266 A 65 GLU H D 46 TRP HD1 1.0 1.8 6.5 7595 5267 A 84 LEU HG D 89 LEU HD21 1.0 1.8 6.5 7596 5268 D 46 TRP HZ3 A 68 ARG HDx 1.0 1.8 6.5 7597 5268 A 68 ARG HDy D 46 TRP HZ3 1.0 1.8 6.5 7598 5269 D 46 TRP HZ3 A 68 ARG HDx 1.0 1.8 6.5 7599 5269 A 68 ARG HDy D 46 TRP HZ3 1.0 1.8 6.5 7600 5270 A 68 ARG HE D 49 VAL HB 1.0 1.8 6.5 7601 5271 A 68 ARG HE D 60 ARG HE 1.0 1.8 6.5 7602 5272 A 64 THR HG2% D 45 ILE HD11 1.0 1.8 6.5 7603 5273 D 46 TRP HE3 A 68 ARG HBx 1.0 1.8 6.5 7604 5273 A 68 ARG HBy D 46 TRP HE3 1.0 1.8 6.5 7605 5274 D 89 LEU HA A 84 LEU HBx 1.0 1.8 6.5 7606 5274 A 84 LEU HBy D 89 LEU HA 1.0 1.8 6.5 7607 5275 D 49 VAL H A 68 ARG HGx 1.0 1.8 6.5 7608 5275 A 68 ARG HGy D 49 VAL H 1.0 1.8 6.5 7609 5276 A 68 ARG HDx D 45 ILE HG1x 1.0 1.8 6.5 7610 5276 D 45 ILE HG1y A 68 ARG HDx 1.0 1.8 6.5 7611 5276 A 68 ARG HDy D 45 ILE HG1y 1.0 1.8 6.5 7612 5276 A 68 ARG HDy D 45 ILE HG1x 1.0 1.8 6.5 7613 5277 A 63 VAL HGy% D 59 ASP HBx 1.0 1.8 6.5 7614 5277 A 63 VAL HGx% D 59 ASP HBx 1.0 1.8 6.5 7615 5277 D 59 ASP HBy A 63 VAL HGy% 1.0 1.8 6.5 7616 5277 D 59 ASP HBy A 63 VAL HGx% 1.0 1.8 6.5 7617 5278 A 73 GLN HBx D 49 VAL HG21 1.0 1.8 6.5 7618 5278 A 73 GLN HBy D 49 VAL HG21 1.0 1.8 6.5 7619 5278 D 49 VAL HG11 A 73 GLN HBx 1.0 1.8 6.5 7620 5278 A 73 GLN HBy D 49 VAL HG11 1.0 1.8 6.5 7621 5279 A 69 LYS HA D 46 TRP HE1 1.0 1.8 6.5 7622 5280 A 76 LYS HGy D 82 PHE HBy 1.0 1.8 6.5 7623 5280 A 76 LYS HGx D 82 PHE HBy 1.0 1.8 6.5 7624 5280 D 82 PHE HBx A 76 LYS HGx 1.0 1.8 6.5 7625 5280 A 76 LYS HGy D 82 PHE HBx 1.0 1.8 6.5 7626 5281 A 91 THR HB D 94 VAL HG11 1.0 1.8 6.5 7627 5281 A 91 THR HB D 94 VAL HG21 1.0 1.8 6.5 7628 5282 A 89 LEU HDy% D 92 ASP HBx 1.0 1.8 6.5 7629 5282 A 89 LEU HDx% D 92 ASP HBx 1.0 1.8 6.5 7630 5282 D 92 ASP HBy A 89 LEU HDy% 1.0 1.8 6.5 7631 5282 A 89 LEU HDx% D 92 ASP HBy 1.0 1.8 6.5 7632 5283 A 89 LEU HBx D 92 ASP HBx 1.0 1.8 6.5 7633 5283 A 89 LEU HBy D 92 ASP HBx 1.0 1.8 6.5 7634 5283 D 92 ASP HBy A 89 LEU HBx 1.0 1.8 6.5 7635 5283 A 89 LEU HBy D 92 ASP HBy 1.0 1.8 6.5 7636 5284 A 91 THR HG2% D 90 ALA HA 1.0 1.8 6.5 stop_ save_ save_CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_3 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 9 GLN H A 5 GLU O 1.0 1.5 2.5 2 2 A 5 GLU O A 9 GLN N 1.0 2.5 3.5 3 3 A 10 LYS H A 6 ARG O 1.0 1.5 2.5 4 4 A 6 ARG O A 10 LYS N 1.0 2.5 3.5 5 5 A 11 ALA H A 7 GLU O 1.0 1.5 2.5 6 6 A 7 GLU O A 11 ALA N 1.0 2.5 3.5 7 7 A 14 GLU H A 10 LYS O 1.0 1.5 2.5 8 8 A 10 LYS O A 14 GLU N 1.0 2.5 3.5 9 9 A 15 LEU H A 11 ALA O 1.0 1.5 2.5 10 10 A 11 ALA O A 15 LEU N 1.0 2.5 3.5 11 11 A 16 GLN H A 12 GLU O 1.0 1.5 2.5 12 12 A 12 GLU O A 16 GLN N 1.0 2.5 3.5 13 13 A 17 LYS H A 13 GLU O 1.0 1.5 2.5 14 14 A 13 GLU O A 17 LYS N 1.0 2.5 3.5 15 15 A 18 VAL H A 14 GLU O 1.0 1.5 2.5 16 16 A 14 GLU O A 18 VAL N 1.0 2.5 3.5 17 17 A 19 LEU H A 15 LEU O 1.0 1.5 2.5 18 18 A 15 LEU O A 19 LEU N 1.0 2.5 3.5 19 19 A 20 GLU H A 16 GLN O 1.0 1.5 2.5 20 20 A 16 GLN O A 20 GLU N 1.0 2.5 3.5 21 21 A 21 GLU H A 17 LYS O 1.0 1.5 2.5 22 22 A 17 LYS O A 21 GLU N 1.0 2.5 3.5 23 23 A 22 ALA H A 18 VAL O 1.0 1.5 2.5 24 24 A 18 VAL O A 22 ALA N 1.0 2.5 3.5 25 25 A 23 SER H A 19 LEU O 1.0 1.5 2.5 26 26 A 19 LEU O A 23 SER N 1.0 2.5 3.5 27 27 A 24 LYS H A 20 GLU O 1.0 1.5 2.5 28 28 A 20 GLU O A 24 LYS N 1.0 2.5 3.5 29 29 A 25 LYS H A 21 GLU O 1.0 1.5 2.5 30 30 A 21 GLU O A 25 LYS N 1.0 2.5 3.5 31 31 A 26 ALA H A 22 ALA O 1.0 1.5 2.5 32 32 A 22 ALA O A 26 ALA N 1.0 2.5 3.5 33 33 A 47 TRP H A 43 ASP O 1.0 1.5 2.5 34 34 A 43 ASP O A 47 TRP N 1.0 2.5 3.5 35 35 A 48 SER H A 44 ALA O 1.0 1.5 2.5 36 36 A 44 ALA O A 48 SER N 1.0 2.5 3.5 37 37 A 70 VAL H A 66 GLU O 1.0 1.5 2.5 38 38 A 66 GLU O A 70 VAL N 1.0 2.5 3.5 39 39 A 73 GLN H A 69 LYS O 1.0 1.5 2.5 40 40 A 69 LYS O A 73 GLN N 1.0 2.5 3.5 41 41 A 74 VAL H A 70 VAL O 1.0 1.5 2.5 42 42 A 70 VAL O A 74 VAL N 1.0 2.5 3.5 43 43 A 82 PHE H A 78 GLY O 1.0 1.5 2.5 44 44 A 78 GLY O A 82 PHE N 1.0 2.5 3.5 45 45 A 84 LEU H A 80 GLU O 1.0 1.5 2.5 46 46 A 80 GLU O A 84 LEU N 1.0 2.5 3.5 47 47 A 85 VAL H A 81 VAL O 1.0 1.5 2.5 48 48 A 81 VAL O A 85 VAL N 1.0 2.5 3.5 49 49 B 9 GLN H B 5 GLU O 1.0 1.5 2.5 50 50 B 5 GLU O B 9 GLN N 1.0 2.5 3.5 51 51 B 10 LYS H B 6 ARG O 1.0 1.5 2.5 52 52 B 6 ARG O B 10 LYS N 1.0 2.5 3.5 53 53 B 11 ALA H B 7 GLU O 1.0 1.5 2.5 54 54 B 7 GLU O B 11 ALA N 1.0 2.5 3.5 55 55 B 14 GLU H B 10 LYS O 1.0 1.5 2.5 56 56 B 10 LYS O B 14 GLU N 1.0 2.5 3.5 57 57 B 15 LEU H B 11 ALA O 1.0 1.5 2.5 58 58 B 11 ALA O B 15 LEU N 1.0 2.5 3.5 59 59 B 16 GLN H B 12 GLU O 1.0 1.5 2.5 60 60 B 12 GLU O B 16 GLN N 1.0 2.5 3.5 61 61 B 17 LYS H B 13 GLU O 1.0 1.5 2.5 62 62 B 13 GLU O B 17 LYS N 1.0 2.5 3.5 63 63 B 18 VAL H B 14 GLU O 1.0 1.5 2.5 64 64 B 14 GLU O B 18 VAL N 1.0 2.5 3.5 65 65 B 19 LEU H B 15 LEU O 1.0 1.5 2.5 66 66 B 15 LEU O B 19 LEU N 1.0 2.5 3.5 67 67 B 20 GLU H B 16 GLN O 1.0 1.5 2.5 68 68 B 16 GLN O B 20 GLU N 1.0 2.5 3.5 69 69 B 21 GLU H B 17 LYS O 1.0 1.5 2.5 70 70 B 17 LYS O B 21 GLU N 1.0 2.5 3.5 71 71 B 22 ALA H B 18 VAL O 1.0 1.5 2.5 72 72 B 18 VAL O B 22 ALA N 1.0 2.5 3.5 73 73 B 23 SER H B 19 LEU O 1.0 1.5 2.5 74 74 B 19 LEU O B 23 SER N 1.0 2.5 3.5 75 75 B 24 LYS H B 20 GLU O 1.0 1.5 2.5 76 76 B 20 GLU O B 24 LYS N 1.0 2.5 3.5 77 77 B 25 LYS H B 21 GLU O 1.0 1.5 2.5 78 78 B 21 GLU O B 25 LYS N 1.0 2.5 3.5 79 79 B 26 ALA H B 22 ALA O 1.0 1.5 2.5 80 80 B 22 ALA O B 26 ALA N 1.0 2.5 3.5 81 81 B 47 TRP H B 43 ASP O 1.0 1.5 2.5 82 82 B 43 ASP O B 47 TRP N 1.0 2.5 3.5 83 83 B 48 SER H B 44 ALA O 1.0 1.5 2.5 84 84 B 44 ALA O B 48 SER N 1.0 2.5 3.5 85 85 B 70 VAL H B 66 GLU O 1.0 1.5 2.5 86 86 B 66 GLU O B 70 VAL N 1.0 2.5 3.5 87 87 B 73 GLN H B 69 LYS O 1.0 1.5 2.5 88 88 B 69 LYS O B 73 GLN N 1.0 2.5 3.5 89 89 B 74 VAL H B 70 VAL O 1.0 1.5 2.5 90 90 B 70 VAL O B 74 VAL N 1.0 2.5 3.5 91 91 B 82 PHE H B 78 GLY O 1.0 1.5 2.5 92 92 B 78 GLY O B 82 PHE N 1.0 2.5 3.5 93 93 B 84 LEU H B 80 GLU O 1.0 1.5 2.5 94 94 B 80 GLU O B 84 LEU N 1.0 2.5 3.5 95 95 B 85 VAL H B 81 VAL O 1.0 1.5 2.5 96 96 B 81 VAL O B 85 VAL N 1.0 2.5 3.5 97 97 C 9 GLN H C 5 GLU O 1.0 1.5 2.5 98 98 C 5 GLU O C 9 GLN N 1.0 2.5 3.5 99 99 C 10 LYS H C 6 ARG O 1.0 1.5 2.5 100 100 C 6 ARG O C 10 LYS N 1.0 2.5 3.5 101 101 C 11 ALA H C 7 GLU O 1.0 1.5 2.5 102 102 C 7 GLU O C 11 ALA N 1.0 2.5 3.5 103 103 C 14 GLU H C 10 LYS O 1.0 1.5 2.5 104 104 C 10 LYS O C 14 GLU N 1.0 2.5 3.5 105 105 C 15 LEU H C 11 ALA O 1.0 1.5 2.5 106 106 C 11 ALA O C 15 LEU N 1.0 2.5 3.5 107 107 C 16 GLN H C 12 GLU O 1.0 1.5 2.5 108 108 C 12 GLU O C 16 GLN N 1.0 2.5 3.5 109 109 C 17 LYS H C 13 GLU O 1.0 1.5 2.5 110 110 C 13 GLU O C 17 LYS N 1.0 2.5 3.5 111 111 C 18 VAL H C 14 GLU O 1.0 1.5 2.5 112 112 C 14 GLU O C 18 VAL N 1.0 2.5 3.5 113 113 C 19 LEU H C 15 LEU O 1.0 1.5 2.5 114 114 C 15 LEU O C 19 LEU N 1.0 2.5 3.5 115 115 C 20 GLU H C 16 GLN O 1.0 1.5 2.5 116 116 C 16 GLN O C 20 GLU N 1.0 2.5 3.5 117 117 C 21 GLU H C 17 LYS O 1.0 1.5 2.5 118 118 C 17 LYS O C 21 GLU N 1.0 2.5 3.5 119 119 C 22 ALA H C 18 VAL O 1.0 1.5 2.5 120 120 C 18 VAL O C 22 ALA N 1.0 2.5 3.5 121 121 C 23 SER H C 19 LEU O 1.0 1.5 2.5 122 122 C 19 LEU O C 23 SER N 1.0 2.5 3.5 123 123 C 24 LYS H C 20 GLU O 1.0 1.5 2.5 124 124 C 20 GLU O C 24 LYS N 1.0 2.5 3.5 125 125 C 25 LYS H C 21 GLU O 1.0 1.5 2.5 126 126 C 21 GLU O C 25 LYS N 1.0 2.5 3.5 127 127 C 26 ALA H C 22 ALA O 1.0 1.5 2.5 128 128 C 22 ALA O C 26 ALA N 1.0 2.5 3.5 129 129 C 47 TRP H C 43 ASP O 1.0 1.5 2.5 130 130 C 43 ASP O C 47 TRP N 1.0 2.5 3.5 131 131 C 48 SER H C 44 ALA O 1.0 1.5 2.5 132 132 C 44 ALA O C 48 SER N 1.0 2.5 3.5 133 133 C 70 VAL H C 66 GLU O 1.0 1.5 2.5 134 134 C 66 GLU O C 70 VAL N 1.0 2.5 3.5 135 135 C 73 GLN H C 69 LYS O 1.0 1.5 2.5 136 136 C 69 LYS O C 73 GLN N 1.0 2.5 3.5 137 137 C 74 VAL H C 70 VAL O 1.0 1.5 2.5 138 138 C 70 VAL O C 74 VAL N 1.0 2.5 3.5 139 139 C 82 PHE H C 78 GLY O 1.0 1.5 2.5 140 140 C 78 GLY O C 82 PHE N 1.0 2.5 3.5 141 141 C 84 LEU H C 80 GLU O 1.0 1.5 2.5 142 142 C 80 GLU O C 84 LEU N 1.0 2.5 3.5 143 143 C 85 VAL H C 81 VAL O 1.0 1.5 2.5 144 144 C 81 VAL O C 85 VAL N 1.0 2.5 3.5 145 145 D 9 GLN H D 5 GLU O 1.0 1.5 2.5 146 146 D 5 GLU O D 9 GLN N 1.0 2.5 3.5 147 147 D 10 LYS H D 6 ARG O 1.0 1.5 2.5 148 148 D 6 ARG O D 10 LYS N 1.0 2.5 3.5 149 149 D 11 ALA H D 7 GLU O 1.0 1.5 2.5 150 150 D 7 GLU O D 11 ALA N 1.0 2.5 3.5 151 151 D 14 GLU H D 10 LYS O 1.0 1.5 2.5 152 152 D 10 LYS O D 14 GLU N 1.0 2.5 3.5 153 153 D 15 LEU H D 11 ALA O 1.0 1.5 2.5 154 154 D 11 ALA O D 15 LEU N 1.0 2.5 3.5 155 155 D 16 GLN H D 12 GLU O 1.0 1.5 2.5 156 156 D 12 GLU O D 16 GLN N 1.0 2.5 3.5 157 157 D 17 LYS H D 13 GLU O 1.0 1.5 2.5 158 158 D 13 GLU O D 17 LYS N 1.0 2.5 3.5 159 159 D 18 VAL H D 14 GLU O 1.0 1.5 2.5 160 160 D 14 GLU O D 18 VAL N 1.0 2.5 3.5 161 161 D 19 LEU H D 15 LEU O 1.0 1.5 2.5 162 162 D 15 LEU O D 19 LEU N 1.0 2.5 3.5 163 163 D 20 GLU H D 16 GLN O 1.0 1.5 2.5 164 164 D 16 GLN O D 20 GLU N 1.0 2.5 3.5 165 165 D 21 GLU H D 17 LYS O 1.0 1.5 2.5 166 166 D 17 LYS O D 21 GLU N 1.0 2.5 3.5 167 167 D 22 ALA H D 18 VAL O 1.0 1.5 2.5 168 168 D 18 VAL O D 22 ALA N 1.0 2.5 3.5 169 169 D 23 SER H D 19 LEU O 1.0 1.5 2.5 170 170 D 19 LEU O D 23 SER N 1.0 2.5 3.5 171 171 D 24 LYS H D 20 GLU O 1.0 1.5 2.5 172 172 D 20 GLU O D 24 LYS N 1.0 2.5 3.5 173 173 D 25 LYS H D 21 GLU O 1.0 1.5 2.5 174 174 D 21 GLU O D 25 LYS N 1.0 2.5 3.5 175 175 D 26 ALA H D 22 ALA O 1.0 1.5 2.5 176 176 D 22 ALA O D 26 ALA N 1.0 2.5 3.5 177 177 D 47 TRP H D 43 ASP O 1.0 1.5 2.5 178 178 D 43 ASP O D 47 TRP N 1.0 2.5 3.5 179 179 D 48 SER H D 44 ALA O 1.0 1.5 2.5 180 180 D 44 ALA O D 48 SER N 1.0 2.5 3.5 181 181 D 70 VAL H D 66 GLU O 1.0 1.5 2.5 182 182 D 66 GLU O D 70 VAL N 1.0 2.5 3.5 183 183 D 73 GLN H D 69 LYS O 1.0 1.5 2.5 184 184 D 69 LYS O D 73 GLN N 1.0 2.5 3.5 185 185 D 74 VAL H D 70 VAL O 1.0 1.5 2.5 186 186 D 70 VAL O D 74 VAL N 1.0 2.5 3.5 187 187 D 82 PHE H D 78 GLY O 1.0 1.5 2.5 188 188 D 78 GLY O D 82 PHE N 1.0 2.5 3.5 189 189 D 84 LEU H D 80 GLU O 1.0 1.5 2.5 190 190 D 80 GLU O D 84 LEU N 1.0 2.5 3.5 191 191 D 85 VAL H D 81 VAL O 1.0 1.5 2.5 192 192 D 81 VAL O D 85 VAL N 1.0 2.5 3.5 stop_ save_ save_CNS/XPLOR_dihedral_4 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_4 _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 4 HIS C A 5 GLU N A 5 GLU CA A 5 GLU C 1.0 -98.0 -38.0 PHI 2 2 A 5 GLU N A 5 GLU CA A 5 GLU C A 6 ARG N 1.0 -63.0 -23.0 PSI 3 3 A 5 GLU C A 6 ARG N A 6 ARG CA A 6 ARG C 1.0 -94.0 -34.0 PHI 4 4 A 6 ARG N A 6 ARG CA A 6 ARG C A 7 GLU N 1.0 -61.0 -21.0 PSI 5 5 A 6 ARG C A 7 GLU N A 7 GLU CA A 7 GLU C 1.0 -97.0 -37.0 PHI 6 6 A 7 GLU N A 7 GLU CA A 7 GLU C A 8 ALA N 1.0 -66.0 -6.0 PSI 7 7 A 7 GLU C A 8 ALA N A 8 ALA CA A 8 ALA C 1.0 -97.0 -37.0 PHI 8 8 A 8 ALA N A 8 ALA CA A 8 ALA C A 9 GLN N 1.0 -67.0 -7.0 PSI 9 9 A 8 ALA C A 9 GLN N A 9 GLN CA A 9 GLN C 1.0 -81.0 -41.0 PHI 10 10 A 9 GLN N A 9 GLN CA A 9 GLN C A 10 LYS N 1.0 -60.0 -20.0 PSI 11 11 A 9 GLN C A 10 LYS N A 10 LYS CA A 10 LYS C 1.0 -98.0 -38.0 PHI 12 12 A 10 LYS N A 10 LYS CA A 10 LYS C A 11 ALA N 1.0 -68.0 -8.0 PSI 13 13 A 10 LYS C A 11 ALA N A 11 ALA CA A 11 ALA C 1.0 -81.0 -41.0 PHI 14 14 A 11 ALA N A 11 ALA CA A 11 ALA C A 12 GLU N 1.0 -66.0 -6.0 PSI 15 15 A 12 GLU C A 13 GLU N A 13 GLU CA A 13 GLU C 1.0 -85.0 -45.0 PHI 16 16 A 13 GLU N A 13 GLU CA A 13 GLU C A 14 GLU N 1.0 -63.0 -3.0 PSI 17 17 A 13 GLU C A 14 GLU N A 14 GLU CA A 14 GLU C 1.0 -87.0 -47.0 PHI 18 18 A 14 GLU N A 14 GLU CA A 14 GLU C A 15 LEU N 1.0 -61.0 -1.0 PSI 19 19 A 14 GLU C A 15 LEU N A 15 LEU CA A 15 LEU C 1.0 -101.0 -41.0 PHI 20 20 A 15 LEU N A 15 LEU CA A 15 LEU C A 16 GLN N 1.0 -60.0 -20.0 PSI 21 21 A 15 LEU C A 16 GLN N A 16 GLN CA A 16 GLN C 1.0 -93.0 -33.0 PHI 22 22 A 16 GLN N A 16 GLN CA A 16 GLN C A 17 LYS N 1.0 -71.0 -11.0 PSI 23 23 A 16 GLN C A 17 LYS N A 17 LYS CA A 17 LYS C 1.0 -94.0 -34.0 PHI 24 24 A 17 LYS N A 17 LYS CA A 17 LYS C A 18 VAL N 1.0 -67.0 -7.0 PSI 25 25 A 17 LYS C A 18 VAL N A 18 VAL CA A 18 VAL C 1.0 -85.0 -45.0 PHI 26 26 A 18 VAL N A 18 VAL CA A 18 VAL C A 19 LEU N 1.0 -65.0 -25.0 PSI 27 27 A 18 VAL C A 19 LEU N A 19 LEU CA A 19 LEU C 1.0 -79.0 -39.0 PHI 28 28 A 19 LEU N A 19 LEU CA A 19 LEU C A 20 GLU N 1.0 -60.0 -20.0 PSI 29 29 A 19 LEU C A 20 GLU N A 20 GLU CA A 20 GLU C 1.0 -95.0 -35.0 PHI 30 30 A 20 GLU N A 20 GLU CA A 20 GLU C A 21 GLU N 1.0 -71.0 -11.0 PSI 31 31 A 20 GLU C A 21 GLU N A 21 GLU CA A 21 GLU C 1.0 -81.0 -41.0 PHI 32 32 A 21 GLU N A 21 GLU CA A 21 GLU C A 22 ALA N 1.0 -63.0 -23.0 PSI 33 33 A 21 GLU C A 22 ALA N A 22 ALA CA A 22 ALA C 1.0 -97.0 -37.0 PHI 34 34 A 22 ALA N A 22 ALA CA A 22 ALA C A 23 SER N 1.0 -66.0 -6.0 PSI 35 35 A 25 LYS C A 26 ALA N A 26 ALA CA A 26 ALA C 1.0 -96.0 -36.0 PHI 36 36 A 26 ALA N A 26 ALA CA A 26 ALA C A 27 VAL N 1.0 -63.0 -23.0 PSI 37 37 A 26 ALA C A 27 VAL N A 27 VAL CA A 27 VAL C 1.0 -100.0 -40.0 PHI 38 38 A 27 VAL N A 27 VAL CA A 27 VAL C A 28 GLU N 1.0 -71.0 -11.0 PSI 39 39 A 27 VAL C A 28 GLU N A 28 GLU CA A 28 GLU C 1.0 -112.0 -52.0 PHI 40 40 A 28 GLU N A 28 GLU CA A 28 GLU C A 29 ALA N 1.0 -43.0 17.0 PSI 41 41 A 31 ARG C A 32 GLY N A 32 GLY CA A 32 GLY C 1.0 66.0 126.0 PHI 42 42 A 32 GLY N A 32 GLY CA A 32 GLY C A 33 ALA N 1.0 -30.0 30.0 PSI 43 43 A 32 GLY C A 33 ALA N A 33 ALA CA A 33 ALA C 1.0 -105.0 -45.0 PHI 44 44 A 33 ALA N A 33 ALA CA A 33 ALA C A 34 PRO N 1.0 113.0 173.0 PSI 45 45 A 33 ALA C A 34 PRO N A 34 PRO CA A 34 PRO C 1.0 -79.0 -39.0 PHI 46 46 A 34 PRO N A 34 PRO CA A 34 PRO C A 35 GLY N 1.0 117.0 177.0 PSI 47 47 A 34 PRO C A 35 GLY N A 35 GLY CA A 35 GLY C 1.0 60.0 120.0 PHI 48 48 A 35 GLY N A 35 GLY CA A 35 GLY C A 36 ALA N 1.0 -23.0 37.0 PSI 49 49 A 41 TYR C A 42 PRO N A 42 PRO CA A 42 PRO C 1.0 -78.0 -38.0 PHI 50 50 A 42 PRO N A 42 PRO CA A 42 PRO C A 43 ASP N 1.0 -58.0 2.0 PSI 51 51 A 43 ASP C A 44 ALA N A 44 ALA CA A 44 ALA C 1.0 -97.0 -57.0 PHI 52 52 A 44 ALA N A 44 ALA CA A 44 ALA C A 45 ILE N 1.0 -44.0 16.0 PSI 53 53 A 59 ASP C A 60 ARG N A 60 ARG CA A 60 ARG C 1.0 -175.0 -115.0 PHI 54 54 A 60 ARG N A 60 ARG CA A 60 ARG C A 61 TYR N 1.0 98.0 198.0 PSI 55 55 A 61 TYR C A 62 PRO N A 62 PRO CA A 62 PRO C 1.0 -86.0 -46.0 PHI 56 56 A 62 PRO N A 62 PRO CA A 62 PRO C A 63 VAL N 1.0 108.0 188.0 PSI 57 57 A 63 VAL C A 64 THR N A 64 THR CA A 64 THR C 1.0 -113.0 -13.0 PHI 58 58 A 64 THR N A 64 THR CA A 64 THR C A 65 GLU N 1.0 -84.0 16.0 PSI 59 59 A 66 GLU C A 67 GLY N A 67 GLY CA A 67 GLY C 1.0 -13.0 87.0 PHI 60 60 A 67 GLY C A 68 ARG N A 68 ARG CA A 68 ARG C 1.0 -128.0 -28.0 PHI 61 61 A 68 ARG N A 68 ARG CA A 68 ARG C A 69 LYS N 1.0 -79.0 21.0 PSI 62 62 A 68 ARG C A 69 LYS N A 69 LYS CA A 69 LYS C 1.0 -81.0 -41.0 PHI 63 63 A 69 LYS N A 69 LYS CA A 69 LYS C A 70 VAL N 1.0 -70.0 -10.0 PSI 64 64 A 69 LYS C A 70 VAL N A 70 VAL CA A 70 VAL C 1.0 -85.0 -45.0 PHI 65 65 A 70 VAL N A 70 VAL CA A 70 VAL C A 71 ALA N 1.0 -75.0 -15.0 PSI 66 66 A 70 VAL C A 71 ALA N A 71 ALA CA A 71 ALA C 1.0 -83.0 -43.0 PHI 67 67 A 71 ALA N A 71 ALA CA A 71 ALA C A 72 GLU N 1.0 -54.0 -14.0 PSI 68 68 A 71 ALA C A 72 GLU N A 72 GLU CA A 72 GLU C 1.0 -103.0 -43.0 PHI 69 69 A 72 GLU N A 72 GLU CA A 72 GLU C A 73 GLN N 1.0 -66.0 -6.0 PSI 70 70 A 74 VAL C A 75 MET N A 75 MET CA A 75 MET C 1.0 -94.0 -54.0 PHI 71 71 A 75 MET N A 75 MET CA A 75 MET C A 76 LYS N 1.0 -56.0 4.0 PSI 72 72 A 85 VAL C A 86 THR N A 86 THR CA A 86 THR C 1.0 -97.0 -37.0 PHI 73 73 A 86 THR N A 86 THR CA A 86 THR C A 87 ALA N 1.0 -65.0 -5.0 PSI 74 74 A 86 THR C A 87 ALA N A 87 ALA CA A 87 ALA C 1.0 -100.0 -40.0 PHI 75 75 A 87 ALA N A 87 ALA CA A 87 ALA C A 88 ALA N 1.0 -64.0 -4.0 PSI 76 76 A 87 ALA C A 88 ALA N A 88 ALA CA A 88 ALA C 1.0 -110.0 -40.0 PHI 77 77 A 88 ALA N A 88 ALA CA A 88 ALA C A 89 LEU N 1.0 -51.0 -11.0 PSI 78 78 A 88 ALA C A 89 LEU N A 89 LEU CA A 89 LEU C 1.0 -102.0 -42.0 PHI 79 79 A 89 LEU N A 89 LEU CA A 89 LEU C A 90 ALA N 1.0 -66.0 -6.0 PSI 80 80 A 89 LEU C A 90 ALA N A 90 ALA CA A 90 ALA C 1.0 -100.0 -40.0 PHI 81 81 A 90 ALA N A 90 ALA CA A 90 ALA C A 91 THR N 1.0 -71.0 -1.0 PSI 82 82 A 90 ALA C A 91 THR N A 91 THR CA A 91 THR C 1.0 -100.0 -40.0 PHI 83 83 A 91 THR N A 91 THR CA A 91 THR C A 92 ASP N 1.0 -66.0 -6.0 PSI 84 84 A 93 PHE N A 93 PHE CA A 93 PHE C A 94 VAL N 1.0 -68.0 -8.0 PSI 85 85 A 93 PHE C A 94 VAL N A 94 VAL CA A 94 VAL C 1.0 -90.0 -30.0 PHI 86 86 A 94 VAL N A 94 VAL CA A 94 VAL C A 95 ARG N 1.0 -68.0 -28.0 PSI 87 87 A 94 VAL C A 95 ARG N A 95 ARG CA A 95 ARG C 1.0 -81.0 -41.0 PHI 88 88 A 95 ARG N A 95 ARG CA A 95 ARG C A 96 ARG N 1.0 -63.0 -23.0 PSI 89 89 A 95 ARG C A 96 ARG N A 96 ARG CA A 96 ARG C 1.0 -81.0 -41.0 PHI 90 90 A 96 ARG N A 96 ARG CA A 96 ARG C A 97 GLU N 1.0 -67.0 -7.0 PSI 91 91 A 101 ARG C A 102 GLY N A 102 GLY CA A 102 GLY C 1.0 54.0 114.0 PHI 92 92 A 102 GLY N A 102 GLY CA A 102 GLY C A 103 HIS N 1.0 -22.0 38.0 PSI 93 93 B 4 HIS C B 5 GLU N B 5 GLU CA B 5 GLU C 1.0 -98.0 -38.0 PHI 94 94 B 5 GLU N B 5 GLU CA B 5 GLU C B 6 ARG N 1.0 -63.0 -23.0 PSI 95 95 B 5 GLU C B 6 ARG N B 6 ARG CA B 6 ARG C 1.0 -94.0 -34.0 PHI 96 96 B 6 ARG N B 6 ARG CA B 6 ARG C B 7 GLU N 1.0 -61.0 -21.0 PSI 97 97 B 6 ARG C B 7 GLU N B 7 GLU CA B 7 GLU C 1.0 -97.0 -37.0 PHI 98 98 B 7 GLU N B 7 GLU CA B 7 GLU C B 8 ALA N 1.0 -66.0 -6.0 PSI 99 99 B 7 GLU C B 8 ALA N B 8 ALA CA B 8 ALA C 1.0 -97.0 -37.0 PHI 100 100 B 8 ALA N B 8 ALA CA B 8 ALA C B 9 GLN N 1.0 -67.0 -7.0 PSI 101 101 B 8 ALA C B 9 GLN N B 9 GLN CA B 9 GLN C 1.0 -81.0 -41.0 PHI 102 102 B 9 GLN N B 9 GLN CA B 9 GLN C B 10 LYS N 1.0 -60.0 -20.0 PSI 103 103 B 9 GLN C B 10 LYS N B 10 LYS CA B 10 LYS C 1.0 -98.0 -38.0 PHI 104 104 B 10 LYS N B 10 LYS CA B 10 LYS C B 11 ALA N 1.0 -68.0 -8.0 PSI 105 105 B 10 LYS C B 11 ALA N B 11 ALA CA B 11 ALA C 1.0 -81.0 -41.0 PHI 106 106 B 11 ALA N B 11 ALA CA B 11 ALA C B 12 GLU N 1.0 -66.0 -6.0 PSI 107 107 B 12 GLU C B 13 GLU N B 13 GLU CA B 13 GLU C 1.0 -85.0 -45.0 PHI 108 108 B 13 GLU N B 13 GLU CA B 13 GLU C B 14 GLU N 1.0 -63.0 -3.0 PSI 109 109 B 13 GLU C B 14 GLU N B 14 GLU CA B 14 GLU C 1.0 -87.0 -47.0 PHI 110 110 B 14 GLU N B 14 GLU CA B 14 GLU C B 15 LEU N 1.0 -61.0 -1.0 PSI 111 111 B 14 GLU C B 15 LEU N B 15 LEU CA B 15 LEU C 1.0 -101.0 -41.0 PHI 112 112 B 15 LEU N B 15 LEU CA B 15 LEU C B 16 GLN N 1.0 -60.0 -20.0 PSI 113 113 B 15 LEU C B 16 GLN N B 16 GLN CA B 16 GLN C 1.0 -93.0 -33.0 PHI 114 114 B 16 GLN N B 16 GLN CA B 16 GLN C B 17 LYS N 1.0 -71.0 -11.0 PSI 115 115 B 16 GLN C B 17 LYS N B 17 LYS CA B 17 LYS C 1.0 -94.0 -34.0 PHI 116 116 B 17 LYS N B 17 LYS CA B 17 LYS C B 18 VAL N 1.0 -67.0 -7.0 PSI 117 117 B 17 LYS C B 18 VAL N B 18 VAL CA B 18 VAL C 1.0 -85.0 -45.0 PHI 118 118 B 18 VAL N B 18 VAL CA B 18 VAL C B 19 LEU N 1.0 -65.0 -25.0 PSI 119 119 B 18 VAL C B 19 LEU N B 19 LEU CA B 19 LEU C 1.0 -79.0 -39.0 PHI 120 120 B 19 LEU N B 19 LEU CA B 19 LEU C B 20 GLU N 1.0 -60.0 -20.0 PSI 121 121 B 19 LEU C B 20 GLU N B 20 GLU CA B 20 GLU C 1.0 -95.0 -35.0 PHI 122 122 B 20 GLU N B 20 GLU CA B 20 GLU C B 21 GLU N 1.0 -71.0 -11.0 PSI 123 123 B 20 GLU C B 21 GLU N B 21 GLU CA B 21 GLU C 1.0 -81.0 -41.0 PHI 124 124 B 21 GLU N B 21 GLU CA B 21 GLU C B 22 ALA N 1.0 -63.0 -23.0 PSI 125 125 B 21 GLU C B 22 ALA N B 22 ALA CA B 22 ALA C 1.0 -97.0 -37.0 PHI 126 126 B 22 ALA N B 22 ALA CA B 22 ALA C B 23 SER N 1.0 -66.0 -6.0 PSI 127 127 B 25 LYS C B 26 ALA N B 26 ALA CA B 26 ALA C 1.0 -96.0 -36.0 PHI 128 128 B 26 ALA N B 26 ALA CA B 26 ALA C B 27 VAL N 1.0 -63.0 -23.0 PSI 129 129 B 26 ALA C B 27 VAL N B 27 VAL CA B 27 VAL C 1.0 -100.0 -40.0 PHI 130 130 B 27 VAL N B 27 VAL CA B 27 VAL C B 28 GLU N 1.0 -71.0 -11.0 PSI 131 131 B 27 VAL C B 28 GLU N B 28 GLU CA B 28 GLU C 1.0 -112.0 -52.0 PHI 132 132 B 28 GLU N B 28 GLU CA B 28 GLU C B 29 ALA N 1.0 -43.0 17.0 PSI 133 133 B 31 ARG C B 32 GLY N B 32 GLY CA B 32 GLY C 1.0 66.0 126.0 PHI 134 134 B 32 GLY N B 32 GLY CA B 32 GLY C B 33 ALA N 1.0 -30.0 30.0 PSI 135 135 B 32 GLY C B 33 ALA N B 33 ALA CA B 33 ALA C 1.0 -105.0 -45.0 PHI 136 136 B 33 ALA N B 33 ALA CA B 33 ALA C B 34 PRO N 1.0 113.0 173.0 PSI 137 137 B 33 ALA C B 34 PRO N B 34 PRO CA B 34 PRO C 1.0 -79.0 -39.0 PHI 138 138 B 34 PRO N B 34 PRO CA B 34 PRO C B 35 GLY N 1.0 117.0 177.0 PSI 139 139 B 34 PRO C B 35 GLY N B 35 GLY CA B 35 GLY C 1.0 60.0 120.0 PHI 140 140 B 35 GLY N B 35 GLY CA B 35 GLY C B 36 ALA N 1.0 -23.0 37.0 PSI 141 141 B 41 TYR C B 42 PRO N B 42 PRO CA B 42 PRO C 1.0 -78.0 -38.0 PHI 142 142 B 42 PRO N B 42 PRO CA B 42 PRO C B 43 ASP N 1.0 -58.0 2.0 PSI 143 143 B 43 ASP C B 44 ALA N B 44 ALA CA B 44 ALA C 1.0 -97.0 -57.0 PHI 144 144 B 44 ALA N B 44 ALA CA B 44 ALA C B 45 ILE N 1.0 -44.0 16.0 PSI 145 145 B 59 ASP C B 60 ARG N B 60 ARG CA B 60 ARG C 1.0 -175.0 -115.0 PHI 146 146 B 60 ARG N B 60 ARG CA B 60 ARG C B 61 TYR N 1.0 98.0 198.0 PSI 147 147 B 61 TYR C B 62 PRO N B 62 PRO CA B 62 PRO C 1.0 -86.0 -46.0 PHI 148 148 B 62 PRO N B 62 PRO CA B 62 PRO C B 63 VAL N 1.0 108.0 188.0 PSI 149 149 B 63 VAL C B 64 THR N B 64 THR CA B 64 THR C 1.0 -113.0 -13.0 PHI 150 150 B 64 THR N B 64 THR CA B 64 THR C B 65 GLU N 1.0 -84.0 16.0 PSI 151 151 B 66 GLU C B 67 GLY N B 67 GLY CA B 67 GLY C 1.0 -13.0 87.0 PHI 152 152 B 67 GLY C B 68 ARG N B 68 ARG CA B 68 ARG C 1.0 -128.0 -28.0 PHI 153 153 B 68 ARG N B 68 ARG CA B 68 ARG C B 69 LYS N 1.0 -79.0 21.0 PSI 154 154 B 68 ARG C B 69 LYS N B 69 LYS CA B 69 LYS C 1.0 -81.0 -41.0 PHI 155 155 B 69 LYS N B 69 LYS CA B 69 LYS C B 70 VAL N 1.0 -70.0 -10.0 PSI 156 156 B 69 LYS C B 70 VAL N B 70 VAL CA B 70 VAL C 1.0 -85.0 -45.0 PHI 157 157 B 70 VAL N B 70 VAL CA B 70 VAL C B 71 ALA N 1.0 -75.0 -15.0 PSI 158 158 B 70 VAL C B 71 ALA N B 71 ALA CA B 71 ALA C 1.0 -83.0 -43.0 PHI 159 159 B 71 ALA N B 71 ALA CA B 71 ALA C B 72 GLU N 1.0 -54.0 -14.0 PSI 160 160 B 71 ALA C B 72 GLU N B 72 GLU CA B 72 GLU C 1.0 -103.0 -43.0 PHI 161 161 B 72 GLU N B 72 GLU CA B 72 GLU C B 73 GLN N 1.0 -66.0 -6.0 PSI 162 162 B 74 VAL C B 75 MET N B 75 MET CA B 75 MET C 1.0 -94.0 -54.0 PHI 163 163 B 75 MET N B 75 MET CA B 75 MET C B 76 LYS N 1.0 -56.0 4.0 PSI 164 164 B 85 VAL C B 86 THR N B 86 THR CA B 86 THR C 1.0 -97.0 -37.0 PHI 165 165 B 86 THR N B 86 THR CA B 86 THR C B 87 ALA N 1.0 -65.0 -5.0 PSI 166 166 B 86 THR C B 87 ALA N B 87 ALA CA B 87 ALA C 1.0 -100.0 -40.0 PHI 167 167 B 87 ALA N B 87 ALA CA B 87 ALA C B 88 ALA N 1.0 -64.0 -4.0 PSI 168 168 B 87 ALA C B 88 ALA N B 88 ALA CA B 88 ALA C 1.0 -110.0 -40.0 PHI 169 169 B 88 ALA N B 88 ALA CA B 88 ALA C B 89 LEU N 1.0 -51.0 -11.0 PSI 170 170 B 88 ALA C B 89 LEU N B 89 LEU CA B 89 LEU C 1.0 -102.0 -42.0 PHI 171 171 B 89 LEU N B 89 LEU CA B 89 LEU C B 90 ALA N 1.0 -66.0 -6.0 PSI 172 172 B 89 LEU C B 90 ALA N B 90 ALA CA B 90 ALA C 1.0 -100.0 -40.0 PHI 173 173 B 90 ALA N B 90 ALA CA B 90 ALA C B 91 THR N 1.0 -71.0 -1.0 PSI 174 174 B 90 ALA C B 91 THR N B 91 THR CA B 91 THR C 1.0 -100.0 -40.0 PHI 175 175 B 91 THR N B 91 THR CA B 91 THR C B 92 ASP N 1.0 -66.0 -6.0 PSI 176 176 B 93 PHE N B 93 PHE CA B 93 PHE C B 94 VAL N 1.0 -68.0 -8.0 PSI 177 177 B 93 PHE C B 94 VAL N B 94 VAL CA B 94 VAL C 1.0 -90.0 -30.0 PHI 178 178 B 94 VAL N B 94 VAL CA B 94 VAL C B 95 ARG N 1.0 -68.0 -28.0 PSI 179 179 B 94 VAL C B 95 ARG N B 95 ARG CA B 95 ARG C 1.0 -81.0 -41.0 PHI 180 180 B 95 ARG N B 95 ARG CA B 95 ARG C B 96 ARG N 1.0 -63.0 -23.0 PSI 181 181 B 95 ARG C B 96 ARG N B 96 ARG CA B 96 ARG C 1.0 -81.0 -41.0 PHI 182 182 B 96 ARG N B 96 ARG CA B 96 ARG C B 97 GLU N 1.0 -67.0 -7.0 PSI 183 183 B 101 ARG C B 102 GLY N B 102 GLY CA B 102 GLY C 1.0 54.0 114.0 PHI 184 184 B 102 GLY N B 102 GLY CA B 102 GLY C B 103 HIS N 1.0 -22.0 38.0 PSI 185 185 C 4 HIS C C 5 GLU N C 5 GLU CA C 5 GLU C 1.0 -98.0 -38.0 PHI 186 186 C 5 GLU N C 5 GLU CA C 5 GLU C C 6 ARG N 1.0 -63.0 -23.0 PSI 187 187 C 5 GLU C C 6 ARG N C 6 ARG CA C 6 ARG C 1.0 -94.0 -34.0 PHI 188 188 C 6 ARG N C 6 ARG CA C 6 ARG C C 7 GLU N 1.0 -61.0 -21.0 PSI 189 189 C 6 ARG C C 7 GLU N C 7 GLU CA C 7 GLU C 1.0 -97.0 -37.0 PHI 190 190 C 7 GLU N C 7 GLU CA C 7 GLU C C 8 ALA N 1.0 -66.0 -6.0 PSI 191 191 C 7 GLU C C 8 ALA N C 8 ALA CA C 8 ALA C 1.0 -97.0 -37.0 PHI 192 192 C 8 ALA N C 8 ALA CA C 8 ALA C C 9 GLN N 1.0 -67.0 -7.0 PSI 193 193 C 8 ALA C C 9 GLN N C 9 GLN CA C 9 GLN C 1.0 -81.0 -41.0 PHI 194 194 C 9 GLN N C 9 GLN CA C 9 GLN C C 10 LYS N 1.0 -60.0 -20.0 PSI 195 195 C 9 GLN C C 10 LYS N C 10 LYS CA C 10 LYS C 1.0 -98.0 -38.0 PHI 196 196 C 10 LYS N C 10 LYS CA C 10 LYS C C 11 ALA N 1.0 -68.0 -8.0 PSI 197 197 C 10 LYS C C 11 ALA N C 11 ALA CA C 11 ALA C 1.0 -81.0 -41.0 PHI 198 198 C 11 ALA N C 11 ALA CA C 11 ALA C C 12 GLU N 1.0 -66.0 -6.0 PSI 199 199 C 12 GLU C C 13 GLU N C 13 GLU CA C 13 GLU C 1.0 -85.0 -45.0 PHI 200 200 C 13 GLU N C 13 GLU CA C 13 GLU C C 14 GLU N 1.0 -63.0 -3.0 PSI 201 201 C 13 GLU C C 14 GLU N C 14 GLU CA C 14 GLU C 1.0 -87.0 -47.0 PHI 202 202 C 14 GLU N C 14 GLU CA C 14 GLU C C 15 LEU N 1.0 -61.0 -1.0 PSI 203 203 C 14 GLU C C 15 LEU N C 15 LEU CA C 15 LEU C 1.0 -101.0 -41.0 PHI 204 204 C 15 LEU N C 15 LEU CA C 15 LEU C C 16 GLN N 1.0 -60.0 -20.0 PSI 205 205 C 15 LEU C C 16 GLN N C 16 GLN CA C 16 GLN C 1.0 -93.0 -33.0 PHI 206 206 C 16 GLN N C 16 GLN CA C 16 GLN C C 17 LYS N 1.0 -71.0 -11.0 PSI 207 207 C 16 GLN C C 17 LYS N C 17 LYS CA C 17 LYS C 1.0 -94.0 -34.0 PHI 208 208 C 17 LYS N C 17 LYS CA C 17 LYS C C 18 VAL N 1.0 -67.0 -7.0 PSI 209 209 C 17 LYS C C 18 VAL N C 18 VAL CA C 18 VAL C 1.0 -85.0 -45.0 PHI 210 210 C 18 VAL N C 18 VAL CA C 18 VAL C C 19 LEU N 1.0 -65.0 -25.0 PSI 211 211 C 18 VAL C C 19 LEU N C 19 LEU CA C 19 LEU C 1.0 -79.0 -39.0 PHI 212 212 C 19 LEU N C 19 LEU CA C 19 LEU C C 20 GLU N 1.0 -60.0 -20.0 PSI 213 213 C 19 LEU C C 20 GLU N C 20 GLU CA C 20 GLU C 1.0 -95.0 -35.0 PHI 214 214 C 20 GLU N C 20 GLU CA C 20 GLU C C 21 GLU N 1.0 -71.0 -11.0 PSI 215 215 C 20 GLU C C 21 GLU N C 21 GLU CA C 21 GLU C 1.0 -81.0 -41.0 PHI 216 216 C 21 GLU N C 21 GLU CA C 21 GLU C C 22 ALA N 1.0 -63.0 -23.0 PSI 217 217 C 21 GLU C C 22 ALA N C 22 ALA CA C 22 ALA C 1.0 -97.0 -37.0 PHI 218 218 C 22 ALA N C 22 ALA CA C 22 ALA C C 23 SER N 1.0 -66.0 -6.0 PSI 219 219 C 25 LYS C C 26 ALA N C 26 ALA CA C 26 ALA C 1.0 -96.0 -36.0 PHI 220 220 C 26 ALA N C 26 ALA CA C 26 ALA C C 27 VAL N 1.0 -63.0 -23.0 PSI 221 221 C 26 ALA C C 27 VAL N C 27 VAL CA C 27 VAL C 1.0 -100.0 -40.0 PHI 222 222 C 27 VAL N C 27 VAL CA C 27 VAL C C 28 GLU N 1.0 -71.0 -11.0 PSI 223 223 C 27 VAL C C 28 GLU N C 28 GLU CA C 28 GLU C 1.0 -112.0 -52.0 PHI 224 224 C 28 GLU N C 28 GLU CA C 28 GLU C C 29 ALA N 1.0 -43.0 17.0 PSI 225 225 C 31 ARG C C 32 GLY N C 32 GLY CA C 32 GLY C 1.0 66.0 126.0 PHI 226 226 C 32 GLY N C 32 GLY CA C 32 GLY C C 33 ALA N 1.0 -30.0 30.0 PSI 227 227 C 32 GLY C C 33 ALA N C 33 ALA CA C 33 ALA C 1.0 -105.0 -45.0 PHI 228 228 C 33 ALA N C 33 ALA CA C 33 ALA C C 34 PRO N 1.0 113.0 173.0 PSI 229 229 C 33 ALA C C 34 PRO N C 34 PRO CA C 34 PRO C 1.0 -79.0 -39.0 PHI 230 230 C 34 PRO N C 34 PRO CA C 34 PRO C C 35 GLY N 1.0 117.0 177.0 PSI 231 231 C 34 PRO C C 35 GLY N C 35 GLY CA C 35 GLY C 1.0 60.0 120.0 PHI 232 232 C 35 GLY N C 35 GLY CA C 35 GLY C C 36 ALA N 1.0 -23.0 37.0 PSI 233 233 C 41 TYR C C 42 PRO N C 42 PRO CA C 42 PRO C 1.0 -78.0 -38.0 PHI 234 234 C 42 PRO N C 42 PRO CA C 42 PRO C C 43 ASP N 1.0 -58.0 2.0 PSI 235 235 C 43 ASP C C 44 ALA N C 44 ALA CA C 44 ALA C 1.0 -97.0 -57.0 PHI 236 236 C 44 ALA N C 44 ALA CA C 44 ALA C C 45 ILE N 1.0 -44.0 16.0 PSI 237 237 C 59 ASP C C 60 ARG N C 60 ARG CA C 60 ARG C 1.0 -175.0 -115.0 PHI 238 238 C 60 ARG N C 60 ARG CA C 60 ARG C C 61 TYR N 1.0 98.0 198.0 PSI 239 239 C 61 TYR C C 62 PRO N C 62 PRO CA C 62 PRO C 1.0 -86.0 -46.0 PHI 240 240 C 62 PRO N C 62 PRO CA C 62 PRO C C 63 VAL N 1.0 108.0 188.0 PSI 241 241 C 63 VAL C C 64 THR N C 64 THR CA C 64 THR C 1.0 -113.0 -13.0 PHI 242 242 C 64 THR N C 64 THR CA C 64 THR C C 65 GLU N 1.0 -84.0 16.0 PSI 243 243 C 66 GLU C C 67 GLY N C 67 GLY CA C 67 GLY C 1.0 -13.0 87.0 PHI 244 244 C 67 GLY C C 68 ARG N C 68 ARG CA C 68 ARG C 1.0 -128.0 -28.0 PHI 245 245 C 68 ARG N C 68 ARG CA C 68 ARG C C 69 LYS N 1.0 -79.0 21.0 PSI 246 246 C 68 ARG C C 69 LYS N C 69 LYS CA C 69 LYS C 1.0 -81.0 -41.0 PHI 247 247 C 69 LYS N C 69 LYS CA C 69 LYS C C 70 VAL N 1.0 -70.0 -10.0 PSI 248 248 C 69 LYS C C 70 VAL N C 70 VAL CA C 70 VAL C 1.0 -85.0 -45.0 PHI 249 249 C 70 VAL N C 70 VAL CA C 70 VAL C C 71 ALA N 1.0 -75.0 -15.0 PSI 250 250 C 70 VAL C C 71 ALA N C 71 ALA CA C 71 ALA C 1.0 -83.0 -43.0 PHI 251 251 C 71 ALA N C 71 ALA CA C 71 ALA C C 72 GLU N 1.0 -54.0 -14.0 PSI 252 252 C 71 ALA C C 72 GLU N C 72 GLU CA C 72 GLU C 1.0 -103.0 -43.0 PHI 253 253 C 72 GLU N C 72 GLU CA C 72 GLU C C 73 GLN N 1.0 -66.0 -6.0 PSI 254 254 C 74 VAL C C 75 MET N C 75 MET CA C 75 MET C 1.0 -94.0 -54.0 PHI 255 255 C 75 MET N C 75 MET CA C 75 MET C C 76 LYS N 1.0 -56.0 4.0 PSI 256 256 C 85 VAL C C 86 THR N C 86 THR CA C 86 THR C 1.0 -97.0 -37.0 PHI 257 257 C 86 THR N C 86 THR CA C 86 THR C C 87 ALA N 1.0 -65.0 -5.0 PSI 258 258 C 86 THR C C 87 ALA N C 87 ALA CA C 87 ALA C 1.0 -100.0 -40.0 PHI 259 259 C 87 ALA N C 87 ALA CA C 87 ALA C C 88 ALA N 1.0 -64.0 -4.0 PSI 260 260 C 87 ALA C C 88 ALA N C 88 ALA CA C 88 ALA C 1.0 -110.0 -40.0 PHI 261 261 C 88 ALA N C 88 ALA CA C 88 ALA C C 89 LEU N 1.0 -51.0 -11.0 PSI 262 262 C 88 ALA C C 89 LEU N C 89 LEU CA C 89 LEU C 1.0 -102.0 -42.0 PHI 263 263 C 89 LEU N C 89 LEU CA C 89 LEU C C 90 ALA N 1.0 -66.0 -6.0 PSI 264 264 C 89 LEU C C 90 ALA N C 90 ALA CA C 90 ALA C 1.0 -100.0 -40.0 PHI 265 265 C 90 ALA N C 90 ALA CA C 90 ALA C C 91 THR N 1.0 -71.0 -1.0 PSI 266 266 C 90 ALA C C 91 THR N C 91 THR CA C 91 THR C 1.0 -100.0 -40.0 PHI 267 267 C 91 THR N C 91 THR CA C 91 THR C C 92 ASP N 1.0 -66.0 -6.0 PSI 268 268 C 93 PHE N C 93 PHE CA C 93 PHE C C 94 VAL N 1.0 -68.0 -8.0 PSI 269 269 C 93 PHE C C 94 VAL N C 94 VAL CA C 94 VAL C 1.0 -90.0 -30.0 PHI 270 270 C 94 VAL N C 94 VAL CA C 94 VAL C C 95 ARG N 1.0 -68.0 -28.0 PSI 271 271 C 94 VAL C C 95 ARG N C 95 ARG CA C 95 ARG C 1.0 -81.0 -41.0 PHI 272 272 C 95 ARG N C 95 ARG CA C 95 ARG C C 96 ARG N 1.0 -63.0 -23.0 PSI 273 273 C 95 ARG C C 96 ARG N C 96 ARG CA C 96 ARG C 1.0 -81.0 -41.0 PHI 274 274 C 96 ARG N C 96 ARG CA C 96 ARG C C 97 GLU N 1.0 -67.0 -7.0 PSI 275 275 C 101 ARG C C 102 GLY N C 102 GLY CA C 102 GLY C 1.0 54.0 114.0 PHI 276 276 C 102 GLY N C 102 GLY CA C 102 GLY C C 103 HIS N 1.0 -22.0 38.0 PSI 277 277 D 4 HIS C D 5 GLU N D 5 GLU CA D 5 GLU C 1.0 -98.0 -38.0 PHI 278 278 D 5 GLU N D 5 GLU CA D 5 GLU C D 6 ARG N 1.0 -63.0 -23.0 PSI 279 279 D 5 GLU C D 6 ARG N D 6 ARG CA D 6 ARG C 1.0 -94.0 -34.0 PHI 280 280 D 6 ARG N D 6 ARG CA D 6 ARG C D 7 GLU N 1.0 -61.0 -21.0 PSI 281 281 D 6 ARG C D 7 GLU N D 7 GLU CA D 7 GLU C 1.0 -97.0 -37.0 PHI 282 282 D 7 GLU N D 7 GLU CA D 7 GLU C D 8 ALA N 1.0 -66.0 -6.0 PSI 283 283 D 7 GLU C D 8 ALA N D 8 ALA CA D 8 ALA C 1.0 -97.0 -37.0 PHI 284 284 D 8 ALA N D 8 ALA CA D 8 ALA C D 9 GLN N 1.0 -67.0 -7.0 PSI 285 285 D 8 ALA C D 9 GLN N D 9 GLN CA D 9 GLN C 1.0 -81.0 -41.0 PHI 286 286 D 9 GLN N D 9 GLN CA D 9 GLN C D 10 LYS N 1.0 -60.0 -20.0 PSI 287 287 D 9 GLN C D 10 LYS N D 10 LYS CA D 10 LYS C 1.0 -98.0 -38.0 PHI 288 288 D 10 LYS N D 10 LYS CA D 10 LYS C D 11 ALA N 1.0 -68.0 -8.0 PSI 289 289 D 10 LYS C D 11 ALA N D 11 ALA CA D 11 ALA C 1.0 -81.0 -41.0 PHI 290 290 D 11 ALA N D 11 ALA CA D 11 ALA C D 12 GLU N 1.0 -66.0 -6.0 PSI 291 291 D 12 GLU C D 13 GLU N D 13 GLU CA D 13 GLU C 1.0 -85.0 -45.0 PHI 292 292 D 13 GLU N D 13 GLU CA D 13 GLU C D 14 GLU N 1.0 -63.0 -3.0 PSI 293 293 D 13 GLU C D 14 GLU N D 14 GLU CA D 14 GLU C 1.0 -87.0 -47.0 PHI 294 294 D 14 GLU N D 14 GLU CA D 14 GLU C D 15 LEU N 1.0 -61.0 -1.0 PSI 295 295 D 14 GLU C D 15 LEU N D 15 LEU CA D 15 LEU C 1.0 -101.0 -41.0 PHI 296 296 D 15 LEU N D 15 LEU CA D 15 LEU C D 16 GLN N 1.0 -60.0 -20.0 PSI 297 297 D 15 LEU C D 16 GLN N D 16 GLN CA D 16 GLN C 1.0 -93.0 -33.0 PHI 298 298 D 16 GLN N D 16 GLN CA D 16 GLN C D 17 LYS N 1.0 -71.0 -11.0 PSI 299 299 D 16 GLN C D 17 LYS N D 17 LYS CA D 17 LYS C 1.0 -94.0 -34.0 PHI 300 300 D 17 LYS N D 17 LYS CA D 17 LYS C D 18 VAL N 1.0 -67.0 -7.0 PSI 301 301 D 17 LYS C D 18 VAL N D 18 VAL CA D 18 VAL C 1.0 -85.0 -45.0 PHI 302 302 D 18 VAL N D 18 VAL CA D 18 VAL C D 19 LEU N 1.0 -65.0 -25.0 PSI 303 303 D 18 VAL C D 19 LEU N D 19 LEU CA D 19 LEU C 1.0 -79.0 -39.0 PHI 304 304 D 19 LEU N D 19 LEU CA D 19 LEU C D 20 GLU N 1.0 -60.0 -20.0 PSI 305 305 D 19 LEU C D 20 GLU N D 20 GLU CA D 20 GLU C 1.0 -95.0 -35.0 PHI 306 306 D 20 GLU N D 20 GLU CA D 20 GLU C D 21 GLU N 1.0 -71.0 -11.0 PSI 307 307 D 20 GLU C D 21 GLU N D 21 GLU CA D 21 GLU C 1.0 -81.0 -41.0 PHI 308 308 D 21 GLU N D 21 GLU CA D 21 GLU C D 22 ALA N 1.0 -63.0 -23.0 PSI 309 309 D 21 GLU C D 22 ALA N D 22 ALA CA D 22 ALA C 1.0 -97.0 -37.0 PHI 310 310 D 22 ALA N D 22 ALA CA D 22 ALA C D 23 SER N 1.0 -66.0 -6.0 PSI 311 311 D 25 LYS C D 26 ALA N D 26 ALA CA D 26 ALA C 1.0 -96.0 -36.0 PHI 312 312 D 26 ALA N D 26 ALA CA D 26 ALA C D 27 VAL N 1.0 -63.0 -23.0 PSI 313 313 D 26 ALA C D 27 VAL N D 27 VAL CA D 27 VAL C 1.0 -100.0 -40.0 PHI 314 314 D 27 VAL N D 27 VAL CA D 27 VAL C D 28 GLU N 1.0 -71.0 -11.0 PSI 315 315 D 27 VAL C D 28 GLU N D 28 GLU CA D 28 GLU C 1.0 -112.0 -52.0 PHI 316 316 D 28 GLU N D 28 GLU CA D 28 GLU C D 29 ALA N 1.0 -43.0 17.0 PSI 317 317 D 31 ARG C D 32 GLY N D 32 GLY CA D 32 GLY C 1.0 66.0 126.0 PHI 318 318 D 32 GLY N D 32 GLY CA D 32 GLY C D 33 ALA N 1.0 -30.0 30.0 PSI 319 319 D 32 GLY C D 33 ALA N D 33 ALA CA D 33 ALA C 1.0 -105.0 -45.0 PHI 320 320 D 33 ALA N D 33 ALA CA D 33 ALA C D 34 PRO N 1.0 113.0 173.0 PSI 321 321 D 33 ALA C D 34 PRO N D 34 PRO CA D 34 PRO C 1.0 -79.0 -39.0 PHI 322 322 D 34 PRO N D 34 PRO CA D 34 PRO C D 35 GLY N 1.0 117.0 177.0 PSI 323 323 D 34 PRO C D 35 GLY N D 35 GLY CA D 35 GLY C 1.0 60.0 120.0 PHI 324 324 D 35 GLY N D 35 GLY CA D 35 GLY C D 36 ALA N 1.0 -23.0 37.0 PSI 325 325 D 41 TYR C D 42 PRO N D 42 PRO CA D 42 PRO C 1.0 -78.0 -38.0 PHI 326 326 D 42 PRO N D 42 PRO CA D 42 PRO C D 43 ASP N 1.0 -58.0 2.0 PSI 327 327 D 43 ASP C D 44 ALA N D 44 ALA CA D 44 ALA C 1.0 -97.0 -57.0 PHI 328 328 D 44 ALA N D 44 ALA CA D 44 ALA C D 45 ILE N 1.0 -44.0 16.0 PSI 329 329 D 59 ASP C D 60 ARG N D 60 ARG CA D 60 ARG C 1.0 -175.0 -115.0 PHI 330 330 D 60 ARG N D 60 ARG CA D 60 ARG C D 61 TYR N 1.0 98.0 198.0 PSI 331 331 D 61 TYR C D 62 PRO N D 62 PRO CA D 62 PRO C 1.0 -86.0 -46.0 PHI 332 332 D 62 PRO N D 62 PRO CA D 62 PRO C D 63 VAL N 1.0 108.0 188.0 PSI 333 333 D 63 VAL C D 64 THR N D 64 THR CA D 64 THR C 1.0 -113.0 -13.0 PHI 334 334 D 64 THR N D 64 THR CA D 64 THR C D 65 GLU N 1.0 -84.0 16.0 PSI 335 335 D 66 GLU C D 67 GLY N D 67 GLY CA D 67 GLY C 1.0 -13.0 87.0 PHI 336 336 D 67 GLY C D 68 ARG N D 68 ARG CA D 68 ARG C 1.0 -128.0 -28.0 PHI 337 337 D 68 ARG N D 68 ARG CA D 68 ARG C D 69 LYS N 1.0 -79.0 21.0 PSI 338 338 D 68 ARG C D 69 LYS N D 69 LYS CA D 69 LYS C 1.0 -81.0 -41.0 PHI 339 339 D 69 LYS N D 69 LYS CA D 69 LYS C D 70 VAL N 1.0 -70.0 -10.0 PSI 340 340 D 69 LYS C D 70 VAL N D 70 VAL CA D 70 VAL C 1.0 -85.0 -45.0 PHI 341 341 D 70 VAL N D 70 VAL CA D 70 VAL C D 71 ALA N 1.0 -75.0 -15.0 PSI 342 342 D 70 VAL C D 71 ALA N D 71 ALA CA D 71 ALA C 1.0 -83.0 -43.0 PHI 343 343 D 71 ALA N D 71 ALA CA D 71 ALA C D 72 GLU N 1.0 -54.0 -14.0 PSI 344 344 D 71 ALA C D 72 GLU N D 72 GLU CA D 72 GLU C 1.0 -103.0 -43.0 PHI 345 345 D 72 GLU N D 72 GLU CA D 72 GLU C D 73 GLN N 1.0 -66.0 -6.0 PSI 346 346 D 74 VAL C D 75 MET N D 75 MET CA D 75 MET C 1.0 -94.0 -54.0 PHI 347 347 D 75 MET N D 75 MET CA D 75 MET C D 76 LYS N 1.0 -56.0 4.0 PSI 348 348 D 85 VAL C D 86 THR N D 86 THR CA D 86 THR C 1.0 -97.0 -37.0 PHI 349 349 D 86 THR N D 86 THR CA D 86 THR C D 87 ALA N 1.0 -65.0 -5.0 PSI 350 350 D 86 THR C D 87 ALA N D 87 ALA CA D 87 ALA C 1.0 -100.0 -40.0 PHI 351 351 D 87 ALA N D 87 ALA CA D 87 ALA C D 88 ALA N 1.0 -64.0 -4.0 PSI 352 352 D 87 ALA C D 88 ALA N D 88 ALA CA D 88 ALA C 1.0 -110.0 -40.0 PHI 353 353 D 88 ALA N D 88 ALA CA D 88 ALA C D 89 LEU N 1.0 -51.0 -11.0 PSI 354 354 D 88 ALA C D 89 LEU N D 89 LEU CA D 89 LEU C 1.0 -102.0 -42.0 PHI 355 355 D 89 LEU N D 89 LEU CA D 89 LEU C D 90 ALA N 1.0 -66.0 -6.0 PSI 356 356 D 89 LEU C D 90 ALA N D 90 ALA CA D 90 ALA C 1.0 -100.0 -40.0 PHI 357 357 D 90 ALA N D 90 ALA CA D 90 ALA C D 91 THR N 1.0 -71.0 -1.0 PSI 358 358 D 90 ALA C D 91 THR N D 91 THR CA D 91 THR C 1.0 -100.0 -40.0 PHI 359 359 D 91 THR N D 91 THR CA D 91 THR C D 92 ASP N 1.0 -66.0 -6.0 PSI 360 360 D 93 PHE N D 93 PHE CA D 93 PHE C D 94 VAL N 1.0 -68.0 -8.0 PSI 361 361 D 93 PHE C D 94 VAL N D 94 VAL CA D 94 VAL C 1.0 -90.0 -30.0 PHI 362 362 D 94 VAL N D 94 VAL CA D 94 VAL C D 95 ARG N 1.0 -68.0 -28.0 PSI 363 363 D 94 VAL C D 95 ARG N D 95 ARG CA D 95 ARG C 1.0 -81.0 -41.0 PHI 364 364 D 95 ARG N D 95 ARG CA D 95 ARG C D 96 ARG N 1.0 -63.0 -23.0 PSI 365 365 D 95 ARG C D 96 ARG N D 96 ARG CA D 96 ARG C 1.0 -81.0 -41.0 PHI 366 366 D 96 ARG N D 96 ARG CA D 96 ARG C D 97 GLU N 1.0 -67.0 -7.0 PSI 367 367 D 101 ARG C D 102 GLY N D 102 GLY CA D 102 GLY C 1.0 54.0 114.0 PHI 368 368 D 102 GLY N D 102 GLY CA D 102 GLY C D 103 HIS N 1.0 -22.0 38.0 PSI stop_ save_