data_16164_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16164
_Entry.PDB_ID 2KEP
_Entry.NMR_STAR_version 3.0.9.100
save_
save_delta_chem_shifts_single
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_single
_Entity_delta_chem_shifts.Conformer_type "single"
_Entity_delta_chem_shifts.Conformer_count 20
_Entity_delta_chem_shifts.Best_conformer 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 11 . 1 1 1 A 2 2 SER H H 40 8.461 8.908 -0.447 1
1 12 . 1 1 1 A 2 2 SER HA H 40 4.286 4.971 -0.685 1
1 15 . 1 1 1 A 2 2 SER C C 40 171.276 173.416 -2.140 1
1 16 . 1 1 1 A 2 2 SER CA C 40 55.249 57.812 -2.563 1
1 17 . 1 1 1 A 2 2 SER CB C 40 61.498 62.101 -0.603 1
1 18 . 1 1 1 A 2 2 SER N N 40 118.344 124.567 -6.223 1
1 19 . 1 1 1 A 3 3 ARG H H 41 8.469 8.329 0.140 1
1 20 . 1 1 1 A 3 3 ARG HA H 41 4.400 4.902 -0.502 1
1 25 . 1 1 1 A 3 3 ARG C C 41 172.251 173.663 -1.412 1
1 26 . 1 1 1 A 3 3 ARG CA C 41 52.749 52.891 -0.142 1
1 27 . 1 1 1 A 3 3 ARG CB C 41 27.126 34.114 -6.988 1
1 28 . 1 1 1 A 3 3 ARG N N 41 123.070 123.438 -0.368 1
1 33 . 1 1 1 A 4 4 PRO CA C 42 61.498 63.821 -2.323 1
1 34 . 1 1 1 A 4 4 PRO CB C 42 29.001 31.765 -2.764 1
1 37 . 1 1 1 A 5 5 ASP H H 43 8.246 8.945 -0.699 1
1 38 . 1 1 1 A 5 5 ASP HA H 43 4.329 4.449 -0.120 1
1 41 . 1 1 1 A 5 5 ASP C C 43 174.605 176.525 -1.920 1
1 42 . 1 1 1 A 5 5 ASP CA C 43 53.374 56.419 -3.045 1
1 43 . 1 1 1 A 5 5 ASP CB C 43 38.375 38.598 -0.223 1
1 44 . 1 1 1 A 5 5 ASP N N 43 119.409 117.282 2.127 1
1 45 . 1 1 1 A 6 6 GLN H H 44 8.309 8.392 -0.083 1
1 46 . 1 1 1 A 6 6 GLN HA H 44 4.393 4.185 0.208 1
1 53 . 1 1 1 A 6 6 GLN C C 44 175.053 178.146 -3.093 1
1 54 . 1 1 1 A 6 6 GLN CA C 44 55.874 58.418 -2.544 1
1 55 . 1 1 1 A 6 6 GLN CB C 44 25.876 28.022 -2.146 1
1 57 . 1 1 1 A 6 6 GLN N N 44 122.273 118.021 4.252 1
1 59 . 1 1 1 A 7 7 ALA H H 45 8.106 8.040 0.066 1
1 60 . 1 1 1 A 7 7 ALA HA H 45 3.993 4.105 -0.112 1
1 64 . 1 1 1 A 7 7 ALA C C 45 177.465 178.068 -0.603 1
1 65 . 1 1 1 A 7 7 ALA CA C 45 52.124 54.314 -2.190 1
1 66 . 1 1 1 A 7 7 ALA CB C 45 15.252 18.267 -3.015 1
1 67 . 1 1 1 A 7 7 ALA N N 45 122.204 122.072 0.132 1
1 68 . 1 1 1 A 8 8 LYS H H 46 7.527 7.551 -0.024 1
1 69 . 1 1 1 A 8 8 LYS HA H 46 3.539 4.090 -0.551 1
1 78 . 1 1 1 A 8 8 LYS C C 46 175.412 179.100 -3.688 1
1 79 . 1 1 1 A 8 8 LYS CA C 46 57.124 57.938 -0.814 1
1 80 . 1 1 1 A 8 8 LYS CB C 46 30.876 31.984 -1.108 1
1 83 . 1 1 1 A 8 8 LYS N N 46 117.358 116.558 0.800 1
1 84 . 1 1 1 A 9 9 VAL H H 47 7.709 8.082 -0.373 1
1 85 . 1 1 1 A 9 9 VAL HA H 47 3.578 3.747 -0.169 1
1 93 . 1 1 1 A 9 9 VAL C C 47 175.005 178.294 -3.289 1
1 94 . 1 1 1 A 9 9 VAL CA C 47 64.623 66.172 -1.549 1
1 95 . 1 1 1 A 9 9 VAL CB C 47 29.001 31.792 -2.791 1
1 98 . 1 1 1 A 9 9 VAL N N 47 119.115 120.262 -1.147 1
1 99 . 1 1 1 A 10 10 THR H H 48 7.767 8.132 -0.365 1
1 100 . 1 1 1 A 10 10 THR HA H 48 3.668 4.046 -0.378 1
1 105 . 1 1 1 A 10 10 THR CA C 48 63.998 65.462 -1.464 1
1 106 . 1 1 1 A 10 10 THR CB C 48 67.123 68.776 -1.653 1
1 108 . 1 1 1 A 10 10 THR N N 48 115.112 113.806 1.306 1
1 109 . 1 1 1 A 11 11 VAL H H 49 7.598 7.996 -0.398 1
1 110 . 1 1 1 A 11 11 VAL HA H 49 3.457 3.538 -0.081 1
1 118 . 1 1 1 A 11 11 VAL C C 49 175.412 178.298 -2.886 1
1 119 . 1 1 1 A 11 11 VAL CA C 49 63.998 66.500 -2.502 1
1 120 . 1 1 1 A 11 11 VAL CB C 49 29.001 31.342 -2.341 1
1 123 . 1 1 1 A 11 11 VAL N N 49 123.694 120.589 3.105 1
1 124 . 1 1 1 A 12 12 ALA H H 50 8.176 7.843 0.333 1
1 125 . 1 1 1 A 12 12 ALA HA H 50 4.742 4.287 0.455 1
1 129 . 1 1 1 A 12 12 ALA C C 50 177.074 179.734 -2.660 1
1 130 . 1 1 1 A 12 12 ALA CA C 50 52.124 54.923 -2.799 1
1 131 . 1 1 1 A 12 12 ALA CB C 50 15.252 18.224 -2.972 1
1 132 . 1 1 1 A 12 12 ALA N N 50 122.348 121.601 0.747 1
1 133 . 1 1 1 A 13 13 LYS H H 51 8.499 7.829 0.670 1
1 134 . 1 1 1 A 13 13 LYS HA H 51 3.648 4.065 -0.417 1
1 143 . 1 1 1 A 13 13 LYS C C 51 177.252 179.787 -2.535 1
1 144 . 1 1 1 A 13 13 LYS CA C 51 58.072 59.497 -1.425 1
1 145 . 1 1 1 A 13 13 LYS CB C 51 30.251 32.216 -1.965 1
1 146 . 1 1 1 A 13 13 LYS N N 51 115.402 117.194 -1.792 1
1 147 . 1 1 1 A 14 14 GLY H H 52 7.858 8.140 -0.282 1
1 148 . 1 1 1 A 14 14 GLY HA2 H 52 3.823 3.875 -0.052 1
1 149 . 1 1 1 A 14 14 GLY HA3 H 52 3.676 3.878 -0.202 1
1 150 . 1 1 1 A 14 14 GLY C C 52 174.090 175.611 -1.521 1
1 151 . 1 1 1 A 14 14 GLY CA C 52 44.625 46.548 -1.923 1
1 152 . 1 1 1 A 14 14 GLY N N 52 107.466 108.754 -1.288 1
1 153 . 1 1 1 A 15 15 ASP H H 53 8.403 7.609 0.794 1
1 154 . 1 1 1 A 15 15 ASP HA H 53 4.191 4.384 -0.193 1
1 157 . 1 1 1 A 15 15 ASP C C 53 175.316 178.931 -3.615 1
1 158 . 1 1 1 A 15 15 ASP CA C 53 54.624 56.621 -1.997 1
1 159 . 1 1 1 A 15 15 ASP CB C 53 35.875 41.044 -5.169 1
1 160 . 1 1 1 A 15 15 ASP N N 53 125.929 121.068 4.861 1
1 161 . 1 1 1 A 16 16 ILE H H 54 8.245 8.382 -0.137 1
1 162 . 1 1 1 A 16 16 ILE HA H 54 3.034 3.791 -0.757 1
1 172 . 1 1 1 A 16 16 ILE C C 54 174.499 178.018 -3.519 1
1 173 . 1 1 1 A 16 16 ILE CA C 54 62.748 64.189 -1.441 1
1 174 . 1 1 1 A 16 16 ILE CB C 54 34.625 37.590 -2.965 1
1 178 . 1 1 1 A 16 16 ILE N N 54 119.456 116.665 2.791 1
1 179 . 1 1 1 A 17 17 LYS H H 55 7.547 7.582 -0.035 1
1 180 . 1 1 1 A 17 17 LYS HA H 55 3.843 4.103 -0.260 1
1 187 . 1 1 1 A 17 17 LYS C C 55 176.651 178.841 -2.190 1
1 188 . 1 1 1 A 17 17 LYS CA C 55 57.124 58.591 -1.467 1
1 189 . 1 1 1 A 17 17 LYS CB C 55 30.251 32.073 -1.822 1
1 190 . 1 1 1 A 17 17 LYS N N 55 118.505 121.639 -3.134 1
1 191 . 1 1 1 A 18 18 ALA H H 56 7.680 7.866 -0.186 1
1 192 . 1 1 1 A 18 18 ALA HA H 56 4.029 4.048 -0.019 1
1 196 . 1 1 1 A 18 18 ALA C C 56 176.638 179.872 -3.234 1
1 197 . 1 1 1 A 18 18 ALA CA C 56 52.749 54.737 -1.988 1
1 198 . 1 1 1 A 18 18 ALA CB C 56 15.877 18.396 -2.519 1
1 199 . 1 1 1 A 18 18 ALA N N 56 122.477 122.173 0.304 1
1 200 . 1 1 1 A 19 19 ILE H H 57 8.853 7.807 1.046 1
1 201 . 1 1 1 A 19 19 ILE HA H 57 3.304 3.489 -0.185 1
1 211 . 1 1 1 A 19 19 ILE C C 57 174.710 177.648 -2.938 1
1 212 . 1 1 1 A 19 19 ILE CA C 57 63.373 65.516 -2.143 1
1 213 . 1 1 1 A 19 19 ILE CB C 57 35.250 37.938 -2.688 1
1 217 . 1 1 1 A 19 19 ILE N N 57 120.901 118.248 2.653 1
1 218 . 1 1 1 A 20 20 ALA H H 58 8.702 8.238 0.464 1
1 219 . 1 1 1 A 20 20 ALA HA H 58 3.900 3.867 0.033 1
1 223 . 1 1 1 A 20 20 ALA C C 58 176.512 179.761 -3.249 1
1 224 . 1 1 1 A 20 20 ALA CA C 58 52.749 55.209 -2.460 1
1 225 . 1 1 1 A 20 20 ALA CB C 58 15.252 18.228 -2.976 1
1 226 . 1 1 1 A 20 20 ALA N N 58 121.763 122.307 -0.544 1
1 227 . 1 1 1 A 21 21 ALA H H 59 7.662 7.856 -0.194 1
1 228 . 1 1 1 A 21 21 ALA HA H 59 4.136 4.216 -0.080 1
1 232 . 1 1 1 A 21 21 ALA C C 59 177.949 179.584 -1.635 1
1 233 . 1 1 1 A 21 21 ALA CA C 59 52.749 54.815 -2.066 1
1 234 . 1 1 1 A 21 21 ALA CB C 59 15.252 18.543 -3.291 1
1 235 . 1 1 1 A 21 21 ALA N N 59 119.079 119.230 -0.151 1
1 236 . 1 1 1 A 22 22 ALA H H 60 7.403 7.483 -0.080 1
1 237 . 1 1 1 A 22 22 ALA HA H 60 4.318 4.198 0.120 1
1 241 . 1 1 1 A 22 22 ALA C C 60 176.730 180.452 -3.722 1
1 242 . 1 1 1 A 22 22 ALA CA C 60 52.749 54.433 -1.684 1
1 243 . 1 1 1 A 22 22 ALA CB C 60 17.126 18.761 -1.635 1
1 244 . 1 1 1 A 22 22 ALA N N 60 122.616 120.214 2.402 1
1 245 . 1 1 1 A 23 23 LEU H H 61 8.410 8.566 -0.156 1
1 246 . 1 1 1 A 23 23 LEU HA H 61 3.527 3.954 -0.427 1
1 256 . 1 1 1 A 23 23 LEU C C 61 176.057 178.281 -2.224 1
1 257 . 1 1 1 A 23 23 LEU CA C 61 55.249 57.255 -2.006 1
1 258 . 1 1 1 A 23 23 LEU CB C 61 39.000 40.741 -1.741 1
1 262 . 1 1 1 A 23 23 LEU N N 61 120.761 121.239 -0.478 1
1 263 . 1 1 1 A 24 24 ASP H H 62 8.227 7.717 0.510 1
1 264 . 1 1 1 A 24 24 ASP HA H 62 4.581 4.510 0.071 1
1 267 . 1 1 1 A 24 24 ASP C C 62 176.968 177.655 -0.687 1
1 268 . 1 1 1 A 24 24 ASP CA C 62 55.874 56.646 -0.772 1
1 269 . 1 1 1 A 24 24 ASP CB C 62 37.750 40.904 -3.154 1
1 270 . 1 1 1 A 24 24 ASP N N 62 119.068 118.917 0.151 1
1 271 . 1 1 1 A 25 25 MET H H 63 7.718 7.843 -0.125 1
1 272 . 1 1 1 A 25 25 MET HA H 63 4.196 4.309 -0.113 1
1 277 . 1 1 1 A 25 25 MET C C 63 174.968 177.748 -2.780 1
1 278 . 1 1 1 A 25 25 MET CA C 63 55.249 57.999 -2.750 1
1 279 . 1 1 1 A 25 25 MET CB C 63 29.626 32.270 -2.644 1
1 281 . 1 1 1 A 25 25 MET N N 63 121.365 117.274 4.091 1
1 282 . 1 1 1 A 26 26 TYR H H 64 8.401 7.648 0.753 1
1 283 . 1 1 1 A 26 26 TYR HA H 64 4.400 3.532 0.868 1
1 291 . 1 1 1 A 26 26 TYR C C 64 176.098 177.339 -1.241 1
1 292 . 1 1 1 A 26 26 TYR CA C 64 58.999 60.829 -1.830 1
1 293 . 1 1 1 A 26 26 TYR CB C 64 35.250 38.290 -3.040 1
1 294 . 1 1 1 A 26 26 TYR N N 64 122.575 122.006 0.569 1
1 295 . 1 1 1 A 27 27 LYS H H 65 8.330 8.270 0.060 1
1 296 . 1 1 1 A 27 27 LYS HA H 65 3.568 4.298 -0.730 1
1 302 . 1 1 1 A 27 27 LYS C C 65 176.156 178.659 -2.503 1
1 303 . 1 1 1 A 27 27 LYS CA C 65 56.499 59.397 -2.898 1
1 304 . 1 1 1 A 27 27 LYS CB C 65 29.626 32.031 -2.405 1
1 306 . 1 1 1 A 27 27 LYS N N 65 121.390 118.805 2.585 1
1 307 . 1 1 1 A 28 28 LEU H H 66 7.833 7.468 0.365 1
1 308 . 1 1 1 A 28 28 LEU HA H 66 3.769 4.053 -0.284 1
1 318 . 1 1 1 A 28 28 LEU C C 66 175.925 178.002 -2.077 1
1 319 . 1 1 1 A 28 28 LEU CA C 66 55.874 57.122 -1.248 1
1 320 . 1 1 1 A 28 28 LEU CB C 66 38.375 42.138 -3.763 1
1 324 . 1 1 1 A 28 28 LEU N N 66 123.068 120.624 2.444 1
1 325 . 1 1 1 A 29 29 ASP H H 67 7.292 7.548 -0.256 1
1 326 . 1 1 1 A 29 29 ASP HA H 67 4.096 4.293 -0.197 1
1 329 . 1 1 1 A 29 29 ASP C C 67 174.618 176.820 -2.202 1
1 330 . 1 1 1 A 29 29 ASP CA C 67 53.999 56.275 -2.276 1
1 331 . 1 1 1 A 29 29 ASP CB C 67 38.375 40.700 -2.325 1
1 332 . 1 1 1 A 29 29 ASP N N 67 114.729 118.445 -3.716 1
1 333 . 1 1 1 A 30 30 ASN H H 68 8.097 7.532 0.565 1
1 334 . 1 1 1 A 30 30 ASN HA H 68 4.337 4.405 -0.068 1
1 339 . 1 1 1 A 30 30 ASN C C 68 172.822 174.517 -1.695 1
1 340 . 1 1 1 A 30 30 ASN CA C 68 52.124 51.464 0.660 1
1 341 . 1 1 1 A 30 30 ASN CB C 68 37.750 38.351 -0.601 1
1 342 . 1 1 1 A 30 30 ASN N N 68 111.054 116.028 -4.974 1
1 344 . 1 1 1 A 31 31 PHE H H 69 8.249 7.935 0.314 1
1 345 . 1 1 1 A 31 31 PHE HA H 69 4.135 4.269 -0.134 1
1 353 . 1 1 1 A 31 31 PHE C C 69 170.485 174.239 -3.754 1
1 354 . 1 1 1 A 31 31 PHE CA C 69 57.749 58.731 -0.982 1
1 355 . 1 1 1 A 31 31 PHE CB C 69 33.375 36.572 -3.197 1
1 356 . 1 1 1 A 31 31 PHE N N 69 116.277 118.935 -2.658 1
1 357 . 1 1 1 A 32 32 ALA H H 70 7.224 6.968 0.256 1
1 358 . 1 1 1 A 32 32 ALA HA H 70 4.194 4.535 -0.341 1
1 362 . 1 1 1 A 32 32 ALA C C 70 173.337 175.050 -1.713 1
1 363 . 1 1 1 A 32 32 ALA CA C 70 48.374 51.542 -3.168 1
1 364 . 1 1 1 A 32 32 ALA CB C 70 19.626 22.320 -2.694 1
1 365 . 1 1 1 A 32 32 ALA N N 70 119.914 120.338 -0.424 1
1 366 . 1 1 1 A 33 33 TYR H H 71 7.948 8.417 -0.469 1
1 367 . 1 1 1 A 33 33 TYR HA H 71 4.209 4.987 -0.778 1
1 374 . 1 1 1 A 33 33 TYR C C 71 170.591 174.270 -3.679 1
1 375 . 1 1 1 A 33 33 TYR CA C 71 54.624 56.453 -1.829 1
1 376 . 1 1 1 A 33 33 TYR CB C 71 34.000 38.047 -4.047 1
1 377 . 1 1 1 A 33 33 TYR N N 71 116.929 118.062 -1.133 1
1 378 . 1 1 1 A 34 34 PRO HA H 72 4.444 4.742 -0.298 1
1 381 . 1 1 1 A 34 34 PRO C C 72 174.775 176.399 -1.624 1
1 382 . 1 1 1 A 34 34 PRO CA C 72 59.624 62.643 -3.019 1
1 383 . 1 1 1 A 34 34 PRO CB C 72 28.376 32.184 -3.808 1
1 384 . 1 1 1 A 35 35 SER H H 73 8.721 8.440 0.281 1
1 385 . 1 1 1 A 35 35 SER HA H 73 4.467 4.758 -0.291 1
1 388 . 1 1 1 A 35 35 SER C C 73 173.271 175.587 -2.316 1
1 389 . 1 1 1 A 35 35 SER CA C 73 55.249 56.653 -1.404 1
1 390 . 1 1 1 A 35 35 SER CB C 73 63.373 65.864 -2.491 1
1 391 . 1 1 1 A 35 35 SER N N 73 118.284 114.490 3.794 1
1 392 . 1 1 1 A 36 36 THR H H 74 8.591 8.765 -0.174 1
1 393 . 1 1 1 A 36 36 THR HA H 74 3.649 4.192 -0.543 1
1 398 . 1 1 1 A 36 36 THR CA C 74 64.623 64.174 0.449 1
1 399 . 1 1 1 A 36 36 THR CB C 74 66.498 69.066 -2.568 1
1 401 . 1 1 1 A 36 36 THR N N 74 117.769 117.088 0.681 1
1 402 . 1 1 1 A 37 37 GLN H H 75 8.210 7.897 0.313 1
1 403 . 1 1 1 A 37 37 GLN HA H 75 3.860 4.433 -0.573 1
1 410 . 1 1 1 A 37 37 GLN C C 75 175.349 177.640 -2.291 1
1 411 . 1 1 1 A 37 37 GLN CA C 75 56.499 57.630 -1.131 1
1 412 . 1 1 1 A 37 37 GLN CB C 75 25.876 29.524 -3.648 1
1 414 . 1 1 1 A 37 37 GLN N N 75 117.931 119.660 -1.729 1
1 416 . 1 1 1 A 38 38 GLN H H 76 7.667 8.207 -0.540 1
1 417 . 1 1 1 A 38 38 GLN HA H 76 3.810 4.125 -0.315 1
1 424 . 1 1 1 A 38 38 GLN C C 76 175.805 179.507 -3.702 1
1 425 . 1 1 1 A 38 38 GLN CA C 76 55.874 58.683 -2.809 1
1 426 . 1 1 1 A 38 38 GLN CB C 76 25.876 28.348 -2.472 1
1 428 . 1 1 1 A 38 38 GLN N N 76 120.607 118.369 2.238 1
1 430 . 1 1 1 A 39 39 GLY H H 77 8.470 8.141 0.329 1
1 431 . 1 1 1 A 39 39 GLY HA2 H 77 3.920 3.763 0.157 1
1 432 . 1 1 1 A 39 39 GLY HA3 H 77 3.603 3.778 -0.175 1
1 433 . 1 1 1 A 39 39 GLY C C 77 169.006 175.453 -6.447 1
1 434 . 1 1 1 A 39 39 GLY CA C 77 42.125 46.556 -4.431 1
1 435 . 1 1 1 A 39 39 GLY N N 77 103.281 109.312 -6.031 1
1 436 . 1 1 1 A 40 40 LEU H H 78 8.135 7.837 0.298 1
1 437 . 1 1 1 A 40 40 LEU HA H 78 3.237 4.212 -0.975 1
1 447 . 1 1 1 A 40 40 LEU C C 78 176.383 178.691 -2.308 1
1 448 . 1 1 1 A 40 40 LEU CA C 78 52.749 57.193 -4.444 1
1 449 . 1 1 1 A 40 40 LEU CB C 78 39.000 41.554 -2.554 1
1 453 . 1 1 1 A 40 40 LEU N N 78 114.444 123.394 -8.950 1
1 454 . 1 1 1 A 41 41 GLU H H 79 8.578 8.084 0.494 1
1 455 . 1 1 1 A 41 41 GLU HA H 79 3.720 4.071 -0.351 1
1 460 . 1 1 1 A 41 41 GLU C C 79 175.093 178.674 -3.581 1
1 461 . 1 1 1 A 41 41 GLU CA C 79 57.124 59.606 -2.482 1
1 462 . 1 1 1 A 41 41 GLU CB C 79 26.501 29.199 -2.698 1
1 464 . 1 1 1 A 41 41 GLU N N 79 118.295 118.505 -0.210 1
1 465 . 1 1 1 A 42 42 ALA H H 80 7.227 7.886 -0.659 1
1 466 . 1 1 1 A 42 42 ALA HA H 80 4.437 4.595 -0.158 1
1 470 . 1 1 1 A 42 42 ALA C C 80 173.745 178.221 -4.476 1
1 471 . 1 1 1 A 42 42 ALA CA C 80 51.499 53.911 -2.412 1
1 472 . 1 1 1 A 42 42 ALA CB C 80 15.877 18.538 -2.661 1
1 473 . 1 1 1 A 42 42 ALA N N 80 119.751 121.426 -1.675 1
1 474 . 1 1 1 A 43 43 LEU H H 81 7.932 7.603 0.329 1
1 475 . 1 1 1 A 43 43 LEU HA H 81 4.369 4.462 -0.093 1
1 485 . 1 1 1 A 43 43 LEU C C 81 174.788 178.124 -3.336 1
1 486 . 1 1 1 A 43 43 LEU CA C 81 53.374 55.475 -2.101 1
1 487 . 1 1 1 A 43 43 LEU CB C 81 39.625 42.486 -2.861 1
1 491 . 1 1 1 A 43 43 LEU N N 81 111.742 116.258 -4.516 1
1 492 . 1 1 1 A 44 44 VAL H H 82 7.886 7.628 0.258 1
1 493 . 1 1 1 A 44 44 VAL HA H 82 4.700 4.393 0.307 1
1 501 . 1 1 1 A 44 44 VAL C C 82 172.875 176.476 -3.601 1
1 502 . 1 1 1 A 44 44 VAL CA C 82 59.624 63.838 -4.214 1
1 503 . 1 1 1 A 44 44 VAL CB C 82 31.501 33.705 -2.204 1
1 506 . 1 1 1 A 44 44 VAL N N 82 113.604 115.684 -2.080 1
1 507 . 1 1 1 A 45 45 LYS H H 83 8.361 8.265 0.096 1
1 508 . 1 1 1 A 45 45 LYS HA H 83 4.251 5.048 -0.797 1
1 515 . 1 1 1 A 45 45 LYS C C 83 171.053 175.491 -4.438 1
1 516 . 1 1 1 A 45 45 LYS CA C 83 52.749 54.451 -1.702 1
1 517 . 1 1 1 A 45 45 LYS CB C 83 33.375 35.594 -2.219 1
1 521 . 1 1 1 A 45 45 LYS N N 83 123.860 117.150 6.710 1
1 522 . 1 1 1 A 46 46 LYS H H 84 7.243 7.886 -0.643 1
1 523 . 1 1 1 A 46 46 LYS HA H 84 2.175 2.930 -0.755 1
1 532 . 1 1 1 A 46 46 LYS C C 84 172.123 174.553 -2.430 1
1 533 . 1 1 1 A 46 46 LYS CA C 84 52.749 54.312 -1.563 1
1 534 . 1 1 1 A 46 46 LYS CB C 84 29.626 31.722 -2.096 1
1 537 . 1 1 1 A 46 46 LYS N N 84 128.615 120.875 7.740 1
1 538 . 1 1 1 A 47 47 PRO HA H 85 4.470 4.441 0.029 1
1 541 . 1 1 1 A 47 47 PRO C C 85 173.754 176.345 -2.591 1
1 542 . 1 1 1 A 47 47 PRO CA C 85 60.874 63.187 -2.313 1
1 543 . 1 1 1 A 47 47 PRO CB C 85 30.876 32.120 -1.244 1
1 546 . 1 1 1 A 48 48 THR H H 86 8.306 8.389 -0.083 1
1 547 . 1 1 1 A 48 48 THR HA H 86 4.287 4.425 -0.138 1
1 552 . 1 1 1 A 48 48 THR C C 86 173.070 174.065 -0.995 1
1 553 . 1 1 1 A 48 48 THR CA C 86 57.749 62.904 -5.155 1
1 554 . 1 1 1 A 48 48 THR CB C 86 67.748 69.203 -1.455 1
1 556 . 1 1 1 A 48 48 THR N N 86 109.564 117.488 -7.924 1
1 557 . 1 1 1 A 49 49 GLY H H 87 8.317 8.396 -0.079 1
1 558 . 1 1 1 A 49 49 GLY HA2 H 87 3.851 4.090 -0.239 1
1 559 . 1 1 1 A 49 49 GLY HA3 H 87 3.678 4.103 -0.425 1
1 560 . 1 1 1 A 49 49 GLY C C 87 169.693 172.642 -2.949 1
1 561 . 1 1 1 A 49 49 GLY CA C 87 42.125 44.484 -2.359 1
1 562 . 1 1 1 A 49 49 GLY N N 87 109.071 113.727 -4.656 1
1 563 . 1 1 1 A 50 50 ASN H H 88 8.301 8.351 -0.050 1
1 564 . 1 1 1 A 50 50 ASN HA H 88 4.780 5.484 -0.704 1
1 569 . 1 1 1 A 50 50 ASN C C 88 171.370 173.209 -1.839 1
1 570 . 1 1 1 A 50 50 ASN CA C 88 47.749 50.337 -2.588 1
1 571 . 1 1 1 A 50 50 ASN CB C 88 37.125 40.016 -2.891 1
1 572 . 1 1 1 A 50 50 ASN N N 88 115.631 121.893 -6.262 1
1 574 . 1 1 1 A 51 51 PRO HA H 89 4.782 4.914 -0.132 1
1 577 . 1 1 1 A 51 51 PRO C C 89 173.656 176.336 -2.680 1
1 578 . 1 1 1 A 51 51 PRO CA C 89 59.624 62.020 -2.396 1
1 579 . 1 1 1 A 51 51 PRO CB C 89 31.501 32.335 -0.834 1
1 582 . 1 1 1 A 52 52 GLN H H 90 9.076 9.110 -0.034 1
1 583 . 1 1 1 A 52 52 GLN HA H 90 4.469 4.738 -0.269 1
1 590 . 1 1 1 A 52 52 GLN C C 90 172.386 174.253 -1.867 1
1 591 . 1 1 1 A 52 52 GLN CA C 90 50.874 54.123 -3.249 1
1 592 . 1 1 1 A 52 52 GLN CB C 90 26.501 27.642 -1.141 1
1 594 . 1 1 1 A 52 52 GLN N N 90 126.827 120.162 6.665 1
1 596 . 1 1 1 A 53 53 PRO HA H 91 4.384 4.660 -0.276 1
1 599 . 1 1 1 A 53 53 PRO C C 91 174.274 175.243 -0.969 1
1 600 . 1 1 1 A 53 53 PRO CB C 91 28.113 31.202 -3.089 1
1 601 . 1 1 1 A 54 54 LYS H H 92 8.401 8.416 -0.015 1
1 602 . 1 1 1 A 54 54 LYS HA H 92 3.984 4.778 -0.794 1
1 611 . 1 1 1 A 54 54 LYS C C 92 173.516 174.475 -0.959 1
1 612 . 1 1 1 A 54 54 LYS CA C 92 55.249 55.518 -0.269 1
1 613 . 1 1 1 A 54 54 LYS CB C 92 30.876 36.073 -5.197 1
1 615 . 1 1 1 A 54 54 LYS N N 92 124.538 124.303 0.235 1
1 616 . 1 1 1 A 55 55 ASN H H 93 8.183 8.794 -0.611 1
1 617 . 1 1 1 A 55 55 ASN HA H 93 4.716 5.037 -0.321 1
1 622 . 1 1 1 A 55 55 ASN CA C 93 48.999 52.024 -3.025 1
1 623 . 1 1 1 A 55 55 ASN CB C 93 35.875 38.219 -2.344 1
1 624 . 1 1 1 A 55 55 ASN N N 93 118.677 124.329 -5.652 1
1 626 . 1 1 1 A 56 56 TRP H H 94 8.007 8.764 -0.757 1
1 627 . 1 1 1 A 56 56 TRP HA H 94 3.827 5.437 -1.610 1
1 635 . 1 1 1 A 56 56 TRP C C 94 173.760 175.446 -1.686 1
1 636 . 1 1 1 A 56 56 TRP CA C 94 59.624 59.334 0.290 1
1 637 . 1 1 1 A 56 56 TRP CB C 94 27.126 30.439 -3.313 1
1 638 . 1 1 1 A 56 56 TRP N N 94 122.195 129.959 -7.764 1
1 640 . 1 1 1 A 57 57 ASN H H 95 7.563 7.720 -0.157 1
1 641 . 1 1 1 A 57 57 ASN HA H 95 3.735 4.833 -1.098 1
1 646 . 1 1 1 A 57 57 ASN C C 95 171.952 173.875 -1.923 1
1 647 . 1 1 1 A 57 57 ASN CA C 95 51.499 50.867 0.632 1
1 648 . 1 1 1 A 57 57 ASN CB C 95 35.250 41.045 -5.795 1
1 649 . 1 1 1 A 57 57 ASN N N 95 129.659 125.298 4.361 1
1 651 . 1 1 1 A 58 58 LYS H H 96 8.110 8.091 0.019 1
1 652 . 1 1 1 A 58 58 LYS HA H 96 4.035 4.276 -0.241 1
1 659 . 1 1 1 A 58 58 LYS C C 96 174.530 175.391 -0.861 1
1 660 . 1 1 1 A 58 58 LYS CA C 96 56.499 54.479 2.020 1
1 661 . 1 1 1 A 58 58 LYS CB C 96 29.626 32.881 -3.255 1
1 665 . 1 1 1 A 58 58 LYS N N 96 123.913 122.841 1.072 1
1 666 . 1 1 1 A 59 59 ASP H H 97 7.903 9.110 -1.207 1
1 667 . 1 1 1 A 59 59 ASP HA H 97 4.393 4.237 0.156 1
1 670 . 1 1 1 A 59 59 ASP C C 97 173.724 174.635 -0.911 1
1 671 . 1 1 1 A 59 59 ASP CA C 97 52.124 54.842 -2.718 1
1 672 . 1 1 1 A 59 59 ASP CB C 97 38.375 39.581 -1.206 1
1 673 . 1 1 1 A 59 59 ASP N N 97 118.773 119.253 -0.480 1
1 674 . 1 1 1 A 60 60 GLY H H 98 7.819 7.708 0.111 1
1 675 . 1 1 1 A 60 60 GLY HA2 H 98 3.917 3.007 0.910 1
1 676 . 1 1 1 A 60 60 GLY HA3 H 98 3.917 3.601 0.316 1
1 677 . 1 1 1 A 60 60 GLY C C 98 168.652 174.227 -5.575 1
1 678 . 1 1 1 A 60 60 GLY CA C 98 41.500 44.632 -3.132 1
1 679 . 1 1 1 A 60 60 GLY N N 98 108.742 104.583 4.159 1
1 680 . 1 1 1 A 61 61 TYR H H 99 8.105 7.771 0.334 1
1 681 . 1 1 1 A 61 61 TYR HA H 99 3.927 4.005 -0.078 1
1 689 . 1 1 1 A 61 61 TYR C C 99 172.831 173.981 -1.150 1
1 690 . 1 1 1 A 61 61 TYR CA C 99 57.124 58.248 -1.124 1
1 691 . 1 1 1 A 61 61 TYR CB C 99 37.125 36.542 0.583 1
1 692 . 1 1 1 A 61 61 TYR N N 99 113.836 115.253 -1.417 1
1 693 . 1 1 1 A 62 62 LEU H H 100 7.352 8.140 -0.788 1
1 694 . 1 1 1 A 62 62 LEU HA H 100 4.343 4.894 -0.551 1
1 704 . 1 1 1 A 62 62 LEU C C 100 173.430 175.207 -1.777 1
1 705 . 1 1 1 A 62 62 LEU CA C 100 50.874 53.349 -2.475 1
1 706 . 1 1 1 A 62 62 LEU CB C 100 44.000 45.757 -1.757 1
1 710 . 1 1 1 A 62 62 LEU N N 100 117.112 123.158 -6.046 1
1 711 . 1 1 1 A 63 63 LYS H H 101 8.626 8.441 0.185 1
1 712 . 1 1 1 A 63 63 LYS HA H 101 3.986 4.542 -0.556 1
1 721 . 1 1 1 A 63 63 LYS C C 101 173.851 176.913 -3.062 1
1 722 . 1 1 1 A 63 63 LYS CA C 101 55.249 54.715 0.534 1
1 723 . 1 1 1 A 63 63 LYS CB C 101 29.626 34.047 -4.421 1
1 724 . 1 1 1 A 63 63 LYS N N 101 129.991 121.549 8.442 1
1 725 . 1 1 1 A 64 64 LYS H H 102 7.059 8.477 -1.418 1
1 726 . 1 1 1 A 64 64 LYS HA H 102 4.138 4.219 -0.081 1
1 735 . 1 1 1 A 64 64 LYS C C 102 171.120 175.766 -4.646 1
1 736 . 1 1 1 A 64 64 LYS CA C 102 52.749 56.382 -3.633 1
1 737 . 1 1 1 A 64 64 LYS CB C 102 32.750 31.337 1.413 1
1 740 . 1 1 1 A 64 64 LYS N N 102 113.255 120.854 -7.599 1
1 741 . 1 1 1 A 65 65 LEU H H 103 8.883 7.908 0.975 1
1 742 . 1 1 1 A 65 65 LEU HA H 103 4.475 4.740 -0.265 1
1 752 . 1 1 1 A 65 65 LEU C C 103 171.487 174.463 -2.976 1
1 753 . 1 1 1 A 65 65 LEU CA C 103 48.999 51.057 -2.058 1
1 754 . 1 1 1 A 65 65 LEU CB C 103 39.625 45.084 -5.459 1
1 758 . 1 1 1 A 65 65 LEU N N 103 126.355 122.976 3.379 1
1 759 . 1 1 1 A 66 66 PRO HA H 104 4.449 4.625 -0.176 1
1 764 . 1 1 1 A 66 66 PRO C C 104 173.363 176.104 -2.741 1
1 765 . 1 1 1 A 66 66 PRO CA C 104 60.249 62.223 -1.974 1
1 766 . 1 1 1 A 66 66 PRO CB C 104 29.626 32.911 -3.285 1
1 769 . 1 1 1 A 67 67 VAL H H 105 7.682 8.369 -0.687 1
1 770 . 1 1 1 A 67 67 VAL HA H 105 4.121 4.455 -0.334 1
1 778 . 1 1 1 A 67 67 VAL C C 105 171.667 174.855 -3.188 1
1 779 . 1 1 1 A 67 67 VAL CA C 105 58.374 61.399 -3.025 1
1 780 . 1 1 1 A 67 67 VAL CB C 105 30.251 33.330 -3.079 1
1 783 . 1 1 1 A 67 67 VAL N N 105 114.671 121.052 -6.381 1
1 784 . 1 1 1 A 68 68 ASP H H 106 8.216 7.937 0.279 1
1 785 . 1 1 1 A 68 68 ASP HA H 106 4.474 4.656 -0.182 1
1 788 . 1 1 1 A 68 68 ASP C C 106 172.452 175.032 -2.580 1
1 789 . 1 1 1 A 68 68 ASP CA C 106 50.249 52.309 -2.060 1
1 790 . 1 1 1 A 68 68 ASP CB C 106 37.750 39.832 -2.082 1
1 791 . 1 1 1 A 68 68 ASP N N 106 123.825 124.700 -0.875 1
1 792 . 1 1 1 A 69 69 PRO HA H 107 3.920 4.004 -0.084 1
1 797 . 1 1 1 A 69 69 PRO CA C 107 62.123 62.965 -0.842 1
1 798 . 1 1 1 A 69 69 PRO CB C 107 27.751 31.532 -3.781 1
1 801 . 1 1 1 A 70 70 TRP H H 108 8.156 8.506 -0.350 1
1 802 . 1 1 1 A 70 70 TRP HA H 108 4.274 4.303 -0.029 1
1 811 . 1 1 1 A 70 70 TRP CA C 108 57.124 58.475 -1.351 1
1 812 . 1 1 1 A 70 70 TRP CB C 108 25.251 27.210 -1.959 1
1 813 . 1 1 1 A 70 70 TRP N N 108 118.137 117.466 0.671 1
1 815 . 1 1 1 A 71 71 GLY H H 109 8.209 8.764 -0.555 1
1 816 . 1 1 1 A 71 71 GLY HA2 H 109 4.030 3.850 0.180 1
1 817 . 1 1 1 A 71 71 GLY HA3 H 109 3.303 3.882 -0.579 1
1 818 . 1 1 1 A 71 71 GLY CA C 109 42.750 45.868 -3.118 1
1 819 . 1 1 1 A 71 71 GLY N N 109 107.495 105.453 2.042 1
1 820 . 1 1 1 A 72 72 ASN H H 110 8.116 7.858 0.258 1
1 821 . 1 1 1 A 72 72 ASN HA H 110 5.103 4.961 0.142 1
1 826 . 1 1 1 A 72 72 ASN CA C 110 48.374 51.027 -2.653 1
1 827 . 1 1 1 A 72 72 ASN CB C 110 36.500 39.594 -3.094 1
1 828 . 1 1 1 A 72 72 ASN N N 110 120.108 119.998 0.110 1
1 830 . 1 1 1 A 73 73 PRO HA H 111 4.397 4.620 -0.223 1
1 835 . 1 1 1 A 73 73 PRO C C 111 176.229 176.295 -0.066 1
1 836 . 1 1 1 A 73 73 PRO CA C 111 60.249 62.360 -2.111 1
1 837 . 1 1 1 A 73 73 PRO CB C 111 29.001 32.399 -3.398 1
1 840 . 1 1 1 A 74 74 TYR H H 112 8.893 8.618 0.275 1
1 841 . 1 1 1 A 74 74 TYR HA H 112 4.064 4.831 -0.767 1
1 849 . 1 1 1 A 74 74 TYR C C 112 171.951 176.277 -4.326 1
1 850 . 1 1 1 A 74 74 TYR CA C 112 60.249 58.663 1.586 1
1 851 . 1 1 1 A 74 74 TYR CB C 112 36.500 39.660 -3.160 1
1 852 . 1 1 1 A 74 74 TYR N N 112 124.595 121.487 3.108 1
1 853 . 1 1 1 A 75 75 GLN H H 113 9.127 9.009 0.118 1
1 854 . 1 1 1 A 75 75 GLN HA H 113 4.019 4.697 -0.678 1
1 861 . 1 1 1 A 75 75 GLN C C 113 171.436 174.640 -3.204 1
1 862 . 1 1 1 A 75 75 GLN CA C 113 50.874 54.513 -3.639 1
1 863 . 1 1 1 A 75 75 GLN CB C 113 29.469 29.826 -0.357 1
1 865 . 1 1 1 A 75 75 GLN N N 113 120.777 122.498 -1.721 1
1 867 . 1 1 1 A 76 76 TYR H H 114 7.906 8.387 -0.481 1
1 868 . 1 1 1 A 76 76 TYR HA H 114 5.586 5.735 -0.149 1
1 875 . 1 1 1 A 76 76 TYR C C 114 171.343 174.904 -3.561 1
1 876 . 1 1 1 A 76 76 TYR CA C 114 53.999 55.662 -1.663 1
1 877 . 1 1 1 A 76 76 TYR CB C 114 40.250 41.197 -0.947 1
1 878 . 1 1 1 A 76 76 TYR N N 114 120.757 122.109 -1.352 1
1 879 . 1 1 1 A 77 77 LEU H H 115 8.261 9.369 -1.108 1
1 880 . 1 1 1 A 77 77 LEU HA H 115 4.280 5.130 -0.850 1
1 890 . 1 1 1 A 77 77 LEU C C 115 170.921 176.169 -5.248 1
1 891 . 1 1 1 A 77 77 LEU CA C 115 51.499 53.614 -2.115 1
1 892 . 1 1 1 A 77 77 LEU CB C 115 44.625 45.448 -0.823 1
1 896 . 1 1 1 A 77 77 LEU N N 115 130.662 126.002 4.660 1
1 897 . 1 1 1 A 78 78 ALA H H 116 7.973 8.296 -0.323 1
1 898 . 1 1 1 A 78 78 ALA HA H 116 4.292 4.731 -0.439 1
1 902 . 1 1 1 A 78 78 ALA C C 116 172.093 175.280 -3.187 1
1 903 . 1 1 1 A 78 78 ALA CA C 116 47.749 50.189 -2.440 1
1 904 . 1 1 1 A 78 78 ALA CB C 116 19.626 20.178 -0.552 1
1 905 . 1 1 1 A 78 78 ALA N N 116 125.564 125.688 -0.124 1
1 906 . 1 1 1 A 79 79 PRO HA H 117 4.698 5.099 -0.401 1
1 911 . 1 1 1 A 79 79 PRO C C 117 173.994 176.906 -2.912 1
1 912 . 1 1 1 A 79 79 PRO CA C 117 60.249 63.445 -3.196 1
1 913 . 1 1 1 A 79 79 PRO CB C 117 31.501 31.882 -0.381 1
1 916 . 1 1 1 A 80 80 GLY H H 118 7.096 7.991 -0.895 1
1 917 . 1 1 1 A 80 80 GLY HA2 H 118 3.797 3.893 -0.096 1
1 918 . 1 1 1 A 80 80 GLY HA3 H 118 3.517 3.953 -0.436 1
1 919 . 1 1 1 A 80 80 GLY C C 118 171.404 174.039 -2.635 1
1 920 . 1 1 1 A 80 80 GLY CA C 118 41.500 46.082 -4.582 1
1 921 . 1 1 1 A 80 80 GLY N N 118 108.306 108.337 -0.031 1
1 922 . 1 1 1 A 81 81 THR H H 119 9.810 8.181 1.629 1
1 923 . 1 1 1 A 81 81 THR HA H 119 4.091 4.607 -0.516 1
1 928 . 1 1 1 A 81 81 THR C C 119 174.242 174.706 -0.464 1
1 929 . 1 1 1 A 81 81 THR CA C 119 60.874 60.759 0.115 1
1 930 . 1 1 1 A 81 81 THR CB C 119 66.498 69.844 -3.346 1
1 932 . 1 1 1 A 81 81 THR N N 119 112.813 113.581 -0.768 1
1 933 . 1 1 1 A 82 82 LYS H H 120 8.964 8.719 0.245 1
1 934 . 1 1 1 A 82 82 LYS HA H 120 4.150 3.906 0.244 1
1 941 . 1 1 1 A 82 82 LYS C C 120 172.886 175.912 -3.026 1
1 942 . 1 1 1 A 82 82 LYS CA C 120 53.999 58.106 -4.107 1
1 943 . 1 1 1 A 82 82 LYS CB C 120 30.876 30.225 0.651 1
1 944 . 1 1 1 A 82 82 LYS N N 120 123.569 124.032 -0.463 1
1 945 . 1 1 1 A 83 83 GLY H H 121 7.125 7.950 -0.825 1
1 946 . 1 1 1 A 83 83 GLY HA2 H 121 3.814 3.885 -0.071 1
1 947 . 1 1 1 A 83 83 GLY HA3 H 121 3.814 3.962 -0.148 1
1 948 . 1 1 1 A 83 83 GLY C C 121 167.671 174.398 -6.727 1
1 949 . 1 1 1 A 83 83 GLY CA C 121 42.125 44.395 -2.270 1
1 950 . 1 1 1 A 83 83 GLY N N 121 107.253 107.370 -0.117 1
1 951 . 1 1 1 A 84 84 PRO HA H 122 4.077 4.330 -0.253 1
1 958 . 1 1 1 A 84 84 PRO C C 122 175.199 176.633 -1.434 1
1 959 . 1 1 1 A 84 84 PRO CA C 122 63.373 64.356 -0.983 1
1 960 . 1 1 1 A 84 84 PRO CB C 122 30.251 31.813 -1.562 1
1 962 . 1 1 1 A 85 85 PHE H H 123 6.652 6.661 -0.009 1
1 963 . 1 1 1 A 85 85 PHE HA H 123 4.744 4.829 -0.085 1
1 971 . 1 1 1 A 85 85 PHE C C 123 170.340 172.500 -2.160 1
1 972 . 1 1 1 A 85 85 PHE CA C 123 53.999 56.165 -2.166 1
1 973 . 1 1 1 A 85 85 PHE CB C 123 39.000 40.783 -1.783 1
1 974 . 1 1 1 A 85 85 PHE N N 123 108.468 112.649 -4.181 1
1 975 . 1 1 1 A 86 86 ASP H H 124 9.268 9.194 0.074 1
1 976 . 1 1 1 A 86 86 ASP HA H 124 5.108 5.437 -0.329 1
1 979 . 1 1 1 A 86 86 ASP C C 124 171.180 174.887 -3.707 1
1 980 . 1 1 1 A 86 86 ASP CA C 124 50.249 53.538 -3.289 1
1 981 . 1 1 1 A 86 86 ASP CB C 124 40.250 43.213 -2.963 1
1 982 . 1 1 1 A 86 86 ASP N N 124 121.741 119.254 2.487 1
1 983 . 1 1 1 A 87 87 LEU H H 125 8.018 8.855 -0.837 1
1 984 . 1 1 1 A 87 87 LEU HA H 125 5.809 5.734 0.075 1
1 994 . 1 1 1 A 87 87 LEU C C 125 171.350 175.331 -3.981 1
1 995 . 1 1 1 A 87 87 LEU CA C 125 50.874 53.440 -2.566 1
1 996 . 1 1 1 A 87 87 LEU CB C 125 44.318 46.203 -1.885 1
1 999 . 1 1 1 A 87 87 LEU N N 125 123.629 120.741 2.888 1
1 1000 . 1 1 1 A 88 88 TYR H H 126 8.912 9.259 -0.347 1
1 1001 . 1 1 1 A 88 88 TYR HA H 126 5.630 5.388 0.242 1
1 1008 . 1 1 1 A 88 88 TYR C C 126 171.410 172.778 -1.368 1
1 1009 . 1 1 1 A 88 88 TYR CA C 126 52.749 56.599 -3.850 1
1 1010 . 1 1 1 A 88 88 TYR CB C 126 37.750 40.477 -2.727 1
1 1011 . 1 1 1 A 88 88 TYR N N 126 119.697 117.164 2.533 1
1 1012 . 1 1 1 A 89 89 SER H H 127 9.319 9.391 -0.072 1
1 1013 . 1 1 1 A 89 89 SER HA H 127 5.429 5.577 -0.148 1
1 1016 . 1 1 1 A 89 89 SER CA C 127 52.124 57.417 -5.293 1
1 1017 . 1 1 1 A 89 89 SER CB C 127 62.748 66.269 -3.521 1
1 1018 . 1 1 1 A 89 89 SER N N 127 112.637 116.630 -3.993 1
1 1019 . 1 1 1 A 90 90 LEU H H 128 8.759 8.446 0.313 1
1 1020 . 1 1 1 A 90 90 LEU HA H 128 4.186 4.515 -0.329 1
1 1030 . 1 1 1 A 90 90 LEU C C 128 175.121 178.005 -2.884 1
1 1031 . 1 1 1 A 90 90 LEU CA C 128 52.749 54.737 -1.988 1
1 1032 . 1 1 1 A 90 90 LEU CB C 128 35.875 42.469 -6.594 1
1 1033 . 1 1 1 A 90 90 LEU N N 128 126.728 124.827 1.901 1
1 1034 . 1 1 1 A 91 91 GLY H H 129 8.356 8.176 0.180 1
1 1035 . 1 1 1 A 91 91 GLY HA2 H 129 3.373 3.760 -0.387 1
1 1036 . 1 1 1 A 91 91 GLY HA3 H 129 3.373 3.905 -0.532 1
1 1037 . 1 1 1 A 91 91 GLY C C 129 172.013 174.490 -2.477 1
1 1038 . 1 1 1 A 91 91 GLY CA C 129 41.500 43.750 -2.250 1
1 1039 . 1 1 1 A 91 91 GLY N N 129 108.559 108.522 0.037 1
1 1040 . 1 1 1 A 92 92 ALA H H 130 7.047 8.509 -1.462 1
1 1041 . 1 1 1 A 92 92 ALA HA H 130 4.037 2.833 1.204 1
1 1045 . 1 1 1 A 92 92 ALA C C 130 174.890 177.765 -2.875 1
1 1046 . 1 1 1 A 92 92 ALA CA C 130 52.100 53.753 -1.653 1
1 1047 . 1 1 1 A 92 92 ALA CB C 130 16.502 17.796 -1.294 1
1 1048 . 1 1 1 A 92 92 ALA N N 130 118.393 121.792 -3.399 1
1 1049 . 1 1 1 A 93 93 ASP H H 131 7.222 7.544 -0.322 1
1 1050 . 1 1 1 A 93 93 ASP HA H 131 4.122 4.697 -0.575 1
1 1053 . 1 1 1 A 93 93 ASP C C 131 174.890 176.255 -1.365 1
1 1054 . 1 1 1 A 93 93 ASP CA C 131 50.249 53.684 -3.435 1
1 1055 . 1 1 1 A 93 93 ASP CB C 131 37.750 40.878 -3.128 1
1 1056 . 1 1 1 A 93 93 ASP N N 131 111.487 116.510 -5.023 1
1 1057 . 1 1 1 A 94 94 GLY H H 132 7.199 8.915 -1.716 1
1 1058 . 1 1 1 A 94 94 GLY HA2 H 132 3.951 3.919 0.032 1
1 1059 . 1 1 1 A 94 94 GLY HA3 H 132 3.324 3.924 -0.600 1
1 1060 . 1 1 1 A 94 94 GLY C C 132 169.773 173.694 -3.921 1
1 1061 . 1 1 1 A 94 94 GLY CA C 132 44.625 46.241 -1.616 1
1 1062 . 1 1 1 A 94 94 GLY N N 132 106.932 108.721 -1.789 1
1 1063 . 1 1 1 A 95 95 LYS H H 133 7.215 7.514 -0.299 1
1 1064 . 1 1 1 A 95 95 LYS HA H 133 4.513 4.955 -0.442 1
1 1073 . 1 1 1 A 95 95 LYS C C 133 172.108 174.703 -2.595 1
1 1074 . 1 1 1 A 95 95 LYS CA C 133 51.512 54.705 -3.193 1
1 1075 . 1 1 1 A 95 95 LYS CB C 133 34.000 35.817 -1.817 1
1 1076 . 1 1 1 A 95 95 LYS N N 133 115.749 119.540 -3.791 1
1 1077 . 1 1 1 A 96 96 GLU H H 134 9.230 8.803 0.427 1
1 1078 . 1 1 1 A 96 96 GLU HA H 134 4.352 4.822 -0.470 1
1 1083 . 1 1 1 A 96 96 GLU C C 134 175.219 175.763 -0.544 1
1 1084 . 1 1 1 A 96 96 GLU CA C 134 55.874 55.646 0.228 1
1 1085 . 1 1 1 A 96 96 GLU CB C 134 27.126 30.644 -3.518 1
1 1087 . 1 1 1 A 96 96 GLU N N 134 128.571 122.803 5.768 1
1 1088 . 1 1 1 A 97 97 GLY H H 135 10.677 8.443 2.234 1
1 1089 . 1 1 1 A 97 97 GLY HA2 H 135 4.037 4.337 -0.300 1
1 1090 . 1 1 1 A 97 97 GLY HA3 H 135 3.717 4.342 -0.625 1
1 1091 . 1 1 1 A 97 97 GLY C C 135 171.567 172.296 -0.729 1
1 1092 . 1 1 1 A 97 97 GLY CA C 135 41.500 45.781 -4.281 1
1 1093 . 1 1 1 A 97 97 GLY N N 135 117.011 110.635 6.376 1
1 1094 . 1 1 1 A 98 98 GLY H H 136 8.442 8.669 -0.227 1
1 1095 . 1 1 1 A 98 98 GLY HA2 H 136 4.195 4.233 -0.038 1
1 1096 . 1 1 1 A 98 98 GLY HA3 H 136 4.195 4.235 -0.040 1
1 1097 . 1 1 1 A 98 98 GLY C C 136 170.299 173.289 -2.990 1
1 1098 . 1 1 1 A 98 98 GLY CA C 136 40.875 44.777 -3.902 1
1 1099 . 1 1 1 A 98 98 GLY N N 136 109.494 109.231 0.263 1
1 1100 . 1 1 1 A 99 99 SER H H 137 8.701 8.792 -0.091 1
1 1101 . 1 1 1 A 99 99 SER HA H 137 4.639 4.919 -0.280 1
1 1104 . 1 1 1 A 99 99 SER C C 137 170.630 173.401 -2.771 1
1 1105 . 1 1 1 A 99 99 SER CA C 137 54.624 57.543 -2.919 1
1 1106 . 1 1 1 A 99 99 SER CB C 137 62.748 66.559 -3.811 1
1 1107 . 1 1 1 A 99 99 SER N N 137 114.685 118.794 -4.109 1
1 1108 . 1 1 1 A 100 100 ASP H H 138 9.117 8.914 0.203 1
1 1109 . 1 1 1 A 100 100 ASP HA H 138 3.965 4.516 -0.551 1
1 1112 . 1 1 1 A 100 100 ASP C C 138 175.540 177.834 -2.294 1
1 1113 . 1 1 1 A 100 100 ASP CA C 138 54.624 56.769 -2.145 1
1 1114 . 1 1 1 A 100 100 ASP CB C 138 36.500 40.862 -4.362 1
1 1115 . 1 1 1 A 100 100 ASP N N 138 120.777 122.716 -1.939 1
1 1116 . 1 1 1 A 101 101 ASN H H 139 8.667 8.391 0.276 1
1 1117 . 1 1 1 A 101 101 ASN HA H 139 4.333 4.725 -0.392 1
1 1122 . 1 1 1 A 101 101 ASN CA C 139 53.999 53.038 0.961 1
1 1123 . 1 1 1 A 101 101 ASN CB C 139 34.625 38.207 -3.582 1
1 1124 . 1 1 1 A 101 101 ASN N N 139 121.930 115.400 6.530 1
1 1126 . 1 1 1 A 102 102 ASP H H 140 7.714 7.938 -0.224 1
1 1127 . 1 1 1 A 102 102 ASP HA H 140 4.037 4.554 -0.517 1
1 1130 . 1 1 1 A 102 102 ASP C C 140 172.807 175.871 -3.064 1
1 1131 . 1 1 1 A 102 102 ASP CA C 140 53.374 53.988 -0.614 1
1 1132 . 1 1 1 A 102 102 ASP CB C 140 37.125 41.497 -4.372 1
1 1133 . 1 1 1 A 102 102 ASP N N 140 118.011 118.146 -0.135 1
1 1134 . 1 1 1 A 103 103 ALA H H 141 7.060 7.320 -0.260 1
1 1135 . 1 1 1 A 103 103 ALA HA H 141 3.353 4.721 -1.368 1
1 1139 . 1 1 1 A 103 103 ALA C C 141 172.233 176.776 -4.543 1
1 1140 . 1 1 1 A 103 103 ALA CA C 141 49.624 51.663 -2.039 1
1 1141 . 1 1 1 A 103 103 ALA CB C 141 16.502 20.632 -4.130 1
1 1142 . 1 1 1 A 103 103 ALA N N 141 125.777 122.958 2.819 1
1 1143 . 1 1 1 A 104 104 ASP H H 142 7.973 8.415 -0.442 1
1 1144 . 1 1 1 A 104 104 ASP HA H 142 4.420 5.038 -0.618 1
1 1147 . 1 1 1 A 104 104 ASP C C 142 174.188 176.019 -1.831 1
1 1148 . 1 1 1 A 104 104 ASP CA C 142 52.124 53.847 -1.723 1
1 1149 . 1 1 1 A 104 104 ASP CB C 142 37.125 41.413 -4.288 1
1 1150 . 1 1 1 A 104 104 ASP N N 142 122.965 120.040 2.925 1
1 1151 . 1 1 1 A 105 105 ILE H H 143 8.534 9.059 -0.525 1
1 1152 . 1 1 1 A 105 105 ILE HA H 143 4.060 5.093 -1.033 1
1 1162 . 1 1 1 A 105 105 ILE C C 143 173.235 175.393 -2.158 1
1 1163 . 1 1 1 A 105 105 ILE CA C 143 58.374 59.676 -1.302 1
1 1164 . 1 1 1 A 105 105 ILE CB C 143 39.123 40.119 -0.996 1
1 1167 . 1 1 1 A 105 105 ILE N N 143 124.757 120.385 4.372 1
1 1168 . 1 1 1 A 106 106 GLY H H 144 8.288 8.375 -0.087 1
1 1169 . 1 1 1 A 106 106 GLY HA2 H 144 4.764 4.409 0.355 1
1 1170 . 1 1 1 A 106 106 GLY HA3 H 144 4.764 4.485 0.279 1
1 1171 . 1 1 1 A 106 106 GLY C C 144 171.321 171.862 -0.541 1
1 1172 . 1 1 1 A 106 106 GLY CA C 144 40.250 45.860 -5.610 1
1 1173 . 1 1 1 A 106 106 GLY N N 144 110.895 111.606 -0.711 1
1 1174 . 1 1 1 A 107 107 ASN H H 145 8.577 8.890 -0.313 1
1 1175 . 1 1 1 A 107 107 ASN HA H 145 4.268 5.323 -1.055 1
1 1180 . 1 1 1 A 107 107 ASN C C 145 171.757 173.674 -1.917 1
1 1181 . 1 1 1 A 107 107 ASN CA C 145 52.124 51.557 0.567 1
1 1182 . 1 1 1 A 107 107 ASN CB C 145 34.625 42.215 -7.590 1
1 1183 . 1 1 1 A 107 107 ASN N N 145 118.042 115.984 2.058 1
1 1185 . 1 1 1 A 108 108 TRP H H 146 6.822 8.477 -1.655 1
1 1186 . 1 1 1 A 108 108 TRP HA H 146 4.513 5.152 -0.639 1
1 1195 . 1 1 1 A 108 108 TRP C C 146 172.665 172.700 -0.035 1
1 1196 . 1 1 1 A 108 108 TRP CA C 146 54.624 55.578 -0.954 1
1 1197 . 1 1 1 A 108 108 TRP CB C 146 25.876 31.362 -5.486 1
1 1198 . 1 1 1 A 108 108 TRP N N 146 116.756 117.806 -1.050 1
1 1200 . 1 1 1 A 109 109 ASP H H 147 7.344 7.893 -0.549 1
1 1201 . 1 1 1 A 109 109 ASP HA H 147 4.655 5.348 -0.693 1
1 1204 . 1 1 1 A 109 109 ASP C C 147 172.193 174.902 -2.709 1
1 1205 . 1 1 1 A 109 109 ASP CA C 147 51.499 53.178 -1.679 1
1 1206 . 1 1 1 A 109 109 ASP CB C 147 39.000 44.284 -5.284 1
1 1207 . 1 1 1 A 109 109 ASP N N 147 121.461 118.947 2.514 1
1 11 . 2 1 1 A 2 2 SER H H 40 8.461 8.992 -0.531 1
1 12 . 2 1 1 A 2 2 SER HA H 40 4.286 4.751 -0.465 1
1 15 . 2 1 1 A 2 2 SER C C 40 171.276 172.863 -1.587 1
1 16 . 2 1 1 A 2 2 SER CA C 40 55.249 57.242 -1.993 1
1 17 . 2 1 1 A 2 2 SER CB C 40 61.498 62.299 -0.801 1
1 18 . 2 1 1 A 2 2 SER N N 40 118.344 120.516 -2.172 1
1 19 . 2 1 1 A 3 3 ARG H H 41 8.469 8.294 0.175 1
1 20 . 2 1 1 A 3 3 ARG HA H 41 4.400 4.839 -0.439 1
1 25 . 2 1 1 A 3 3 ARG C C 41 172.251 173.741 -1.490 1
1 26 . 2 1 1 A 3 3 ARG CA C 41 52.749 52.835 -0.086 1
1 27 . 2 1 1 A 3 3 ARG CB C 41 27.126 33.060 -5.934 1
1 28 . 2 1 1 A 3 3 ARG N N 41 123.070 126.519 -3.449 1
1 33 . 2 1 1 A 4 4 PRO CA C 42 61.498 63.828 -2.330 1
1 34 . 2 1 1 A 4 4 PRO CB C 42 29.001 31.679 -2.678 1
1 37 . 2 1 1 A 5 5 ASP H H 43 8.246 8.909 -0.663 1
1 38 . 2 1 1 A 5 5 ASP HA H 43 4.329 4.575 -0.246 1
1 41 . 2 1 1 A 5 5 ASP C C 43 174.605 177.352 -2.747 1
1 42 . 2 1 1 A 5 5 ASP CA C 43 53.374 55.849 -2.475 1
1 43 . 2 1 1 A 5 5 ASP CB C 43 38.375 40.614 -2.239 1
1 44 . 2 1 1 A 5 5 ASP N N 43 119.409 121.342 -1.933 1
1 45 . 2 1 1 A 6 6 GLN H H 44 8.309 8.296 0.013 1
1 46 . 2 1 1 A 6 6 GLN HA H 44 4.393 4.290 0.103 1
1 53 . 2 1 1 A 6 6 GLN C C 44 175.053 178.493 -3.440 1
1 54 . 2 1 1 A 6 6 GLN CA C 44 55.874 57.977 -2.103 1
1 55 . 2 1 1 A 6 6 GLN CB C 44 25.876 28.114 -2.238 1
1 57 . 2 1 1 A 6 6 GLN N N 44 122.273 117.983 4.290 1
1 59 . 2 1 1 A 7 7 ALA H H 45 8.106 8.067 0.039 1
1 60 . 2 1 1 A 7 7 ALA HA H 45 3.993 4.003 -0.010 1
1 64 . 2 1 1 A 7 7 ALA C C 45 177.465 178.425 -0.960 1
1 65 . 2 1 1 A 7 7 ALA CA C 45 52.124 54.845 -2.721 1
1 66 . 2 1 1 A 7 7 ALA CB C 45 15.252 18.173 -2.921 1
1 67 . 2 1 1 A 7 7 ALA N N 45 122.204 121.776 0.428 1
1 68 . 2 1 1 A 8 8 LYS H H 46 7.527 7.842 -0.315 1
1 69 . 2 1 1 A 8 8 LYS HA H 46 3.539 4.049 -0.510 1
1 78 . 2 1 1 A 8 8 LYS C C 46 175.412 179.126 -3.714 1
1 79 . 2 1 1 A 8 8 LYS CA C 46 57.124 58.507 -1.383 1
1 80 . 2 1 1 A 8 8 LYS CB C 46 30.876 31.893 -1.017 1
1 83 . 2 1 1 A 8 8 LYS N N 46 117.358 116.924 0.434 1
1 84 . 2 1 1 A 9 9 VAL H H 47 7.709 7.637 0.072 1
1 85 . 2 1 1 A 9 9 VAL HA H 47 3.578 3.853 -0.275 1
1 93 . 2 1 1 A 9 9 VAL C C 47 175.005 178.346 -3.341 1
1 94 . 2 1 1 A 9 9 VAL CA C 47 64.623 66.215 -1.592 1
1 95 . 2 1 1 A 9 9 VAL CB C 47 29.001 31.793 -2.792 1
1 98 . 2 1 1 A 9 9 VAL N N 47 119.115 120.416 -1.301 1
1 99 . 2 1 1 A 10 10 THR H H 48 7.767 8.377 -0.610 1
1 100 . 2 1 1 A 10 10 THR HA H 48 3.668 3.984 -0.316 1
1 105 . 2 1 1 A 10 10 THR CA C 48 63.998 66.236 -2.238 1
1 106 . 2 1 1 A 10 10 THR CB C 48 67.123 68.563 -1.440 1
1 108 . 2 1 1 A 10 10 THR N N 48 115.112 113.754 1.358 1
1 109 . 2 1 1 A 11 11 VAL H H 49 7.598 7.526 0.072 1
1 110 . 2 1 1 A 11 11 VAL HA H 49 3.457 3.872 -0.415 1
1 118 . 2 1 1 A 11 11 VAL C C 49 175.412 178.012 -2.600 1
1 119 . 2 1 1 A 11 11 VAL CA C 49 63.998 64.895 -0.897 1
1 120 . 2 1 1 A 11 11 VAL CB C 49 29.001 31.550 -2.549 1
1 123 . 2 1 1 A 11 11 VAL N N 49 123.694 117.570 6.124 1
1 124 . 2 1 1 A 12 12 ALA H H 50 8.176 8.041 0.135 1
1 125 . 2 1 1 A 12 12 ALA HA H 50 4.742 3.968 0.774 1
1 129 . 2 1 1 A 12 12 ALA C C 50 177.074 179.719 -2.645 1
1 130 . 2 1 1 A 12 12 ALA CA C 50 52.124 55.562 -3.438 1
1 131 . 2 1 1 A 12 12 ALA CB C 50 15.252 18.348 -3.096 1
1 132 . 2 1 1 A 12 12 ALA N N 50 122.348 124.241 -1.893 1
1 133 . 2 1 1 A 13 13 LYS H H 51 8.499 8.036 0.463 1
1 134 . 2 1 1 A 13 13 LYS HA H 51 3.648 4.053 -0.405 1
1 143 . 2 1 1 A 13 13 LYS C C 51 177.252 179.924 -2.672 1
1 144 . 2 1 1 A 13 13 LYS CA C 51 58.072 59.484 -1.412 1
1 145 . 2 1 1 A 13 13 LYS CB C 51 30.251 32.313 -2.062 1
1 146 . 2 1 1 A 13 13 LYS N N 51 115.402 116.211 -0.809 1
1 147 . 2 1 1 A 14 14 GLY H H 52 7.858 8.082 -0.224 1
1 148 . 2 1 1 A 14 14 GLY HA2 H 52 3.823 3.716 0.107 1
1 149 . 2 1 1 A 14 14 GLY HA3 H 52 3.676 3.717 -0.041 1
1 150 . 2 1 1 A 14 14 GLY C C 52 174.090 175.662 -1.572 1
1 151 . 2 1 1 A 14 14 GLY CA C 52 44.625 46.968 -2.343 1
1 152 . 2 1 1 A 14 14 GLY N N 52 107.466 108.951 -1.485 1
1 153 . 2 1 1 A 15 15 ASP H H 53 8.403 7.843 0.560 1
1 154 . 2 1 1 A 15 15 ASP HA H 53 4.191 4.410 -0.219 1
1 157 . 2 1 1 A 15 15 ASP C C 53 175.316 178.988 -3.672 1
1 158 . 2 1 1 A 15 15 ASP CA C 53 54.624 56.619 -1.995 1
1 159 . 2 1 1 A 15 15 ASP CB C 53 35.875 40.989 -5.114 1
1 160 . 2 1 1 A 15 15 ASP N N 53 125.929 121.657 4.272 1
1 161 . 2 1 1 A 16 16 ILE H H 54 8.245 8.296 -0.051 1
1 162 . 2 1 1 A 16 16 ILE HA H 54 3.034 3.834 -0.800 1
1 172 . 2 1 1 A 16 16 ILE C C 54 174.499 178.323 -3.824 1
1 173 . 2 1 1 A 16 16 ILE CA C 54 62.748 63.974 -1.226 1
1 174 . 2 1 1 A 16 16 ILE CB C 54 34.625 37.375 -2.750 1
1 178 . 2 1 1 A 16 16 ILE N N 54 119.456 116.900 2.556 1
1 179 . 2 1 1 A 17 17 LYS H H 55 7.547 7.583 -0.036 1
1 180 . 2 1 1 A 17 17 LYS HA H 55 3.843 4.119 -0.276 1
1 187 . 2 1 1 A 17 17 LYS C C 55 176.651 179.401 -2.750 1
1 188 . 2 1 1 A 17 17 LYS CA C 55 57.124 59.418 -2.294 1
1 189 . 2 1 1 A 17 17 LYS CB C 55 30.251 31.876 -1.625 1
1 190 . 2 1 1 A 17 17 LYS N N 55 118.505 121.417 -2.912 1
1 191 . 2 1 1 A 18 18 ALA H H 56 7.680 7.973 -0.293 1
1 192 . 2 1 1 A 18 18 ALA HA H 56 4.029 4.043 -0.014 1
1 196 . 2 1 1 A 18 18 ALA C C 56 176.638 179.952 -3.314 1
1 197 . 2 1 1 A 18 18 ALA CA C 56 52.749 54.941 -2.192 1
1 198 . 2 1 1 A 18 18 ALA CB C 56 15.877 18.329 -2.452 1
1 199 . 2 1 1 A 18 18 ALA N N 56 122.477 121.956 0.521 1
1 200 . 2 1 1 A 19 19 ILE H H 57 8.853 7.759 1.094 1
1 201 . 2 1 1 A 19 19 ILE HA H 57 3.304 3.638 -0.334 1
1 211 . 2 1 1 A 19 19 ILE C C 57 174.710 177.764 -3.054 1
1 212 . 2 1 1 A 19 19 ILE CA C 57 63.373 65.462 -2.089 1
1 213 . 2 1 1 A 19 19 ILE CB C 57 35.250 37.553 -2.303 1
1 217 . 2 1 1 A 19 19 ILE N N 57 120.901 118.599 2.302 1
1 218 . 2 1 1 A 20 20 ALA H H 58 8.702 8.059 0.643 1
1 219 . 2 1 1 A 20 20 ALA HA H 58 3.900 3.893 0.007 1
1 223 . 2 1 1 A 20 20 ALA C C 58 176.512 180.209 -3.697 1
1 224 . 2 1 1 A 20 20 ALA CA C 58 52.749 55.524 -2.775 1
1 225 . 2 1 1 A 20 20 ALA CB C 58 15.252 17.984 -2.732 1
1 226 . 2 1 1 A 20 20 ALA N N 58 121.763 122.551 -0.788 1
1 227 . 2 1 1 A 21 21 ALA H H 59 7.662 7.806 -0.144 1
1 228 . 2 1 1 A 21 21 ALA HA H 59 4.136 4.237 -0.101 1
1 232 . 2 1 1 A 21 21 ALA C C 59 177.949 180.022 -2.073 1
1 233 . 2 1 1 A 21 21 ALA CA C 59 52.749 54.892 -2.143 1
1 234 . 2 1 1 A 21 21 ALA CB C 59 15.252 18.429 -3.177 1
1 235 . 2 1 1 A 21 21 ALA N N 59 119.079 120.033 -0.954 1
1 236 . 2 1 1 A 22 22 ALA H H 60 7.403 7.608 -0.205 1
1 237 . 2 1 1 A 22 22 ALA HA H 60 4.318 4.127 0.191 1
1 241 . 2 1 1 A 22 22 ALA C C 60 176.730 180.481 -3.751 1
1 242 . 2 1 1 A 22 22 ALA CA C 60 52.749 54.862 -2.113 1
1 243 . 2 1 1 A 22 22 ALA CB C 60 17.126 18.485 -1.359 1
1 244 . 2 1 1 A 22 22 ALA N N 60 122.616 120.725 1.891 1
1 245 . 2 1 1 A 23 23 LEU H H 61 8.410 8.564 -0.154 1
1 246 . 2 1 1 A 23 23 LEU HA H 61 3.527 3.982 -0.455 1
1 256 . 2 1 1 A 23 23 LEU C C 61 176.057 178.718 -2.661 1
1 257 . 2 1 1 A 23 23 LEU CA C 61 55.249 57.194 -1.945 1
1 258 . 2 1 1 A 23 23 LEU CB C 61 39.000 40.936 -1.936 1
1 262 . 2 1 1 A 23 23 LEU N N 61 120.761 120.878 -0.117 1
1 263 . 2 1 1 A 24 24 ASP H H 62 8.227 8.335 -0.108 1
1 264 . 2 1 1 A 24 24 ASP HA H 62 4.581 4.633 -0.052 1
1 267 . 2 1 1 A 24 24 ASP C C 62 176.968 178.554 -1.586 1
1 268 . 2 1 1 A 24 24 ASP CA C 62 55.874 56.969 -1.095 1
1 269 . 2 1 1 A 24 24 ASP CB C 62 37.750 40.525 -2.775 1
1 270 . 2 1 1 A 24 24 ASP N N 62 119.068 119.435 -0.367 1
1 271 . 2 1 1 A 25 25 MET H H 63 7.718 8.001 -0.283 1
1 272 . 2 1 1 A 25 25 MET HA H 63 4.196 4.287 -0.091 1
1 277 . 2 1 1 A 25 25 MET C C 63 174.968 177.971 -3.003 1
1 278 . 2 1 1 A 25 25 MET CA C 63 55.249 58.325 -3.076 1
1 279 . 2 1 1 A 25 25 MET CB C 63 29.626 32.317 -2.691 1
1 281 . 2 1 1 A 25 25 MET N N 63 121.365 118.985 2.380 1
1 282 . 2 1 1 A 26 26 TYR H H 64 8.401 7.686 0.715 1
1 283 . 2 1 1 A 26 26 TYR HA H 64 4.400 3.504 0.896 1
1 291 . 2 1 1 A 26 26 TYR C C 64 176.098 177.296 -1.198 1
1 292 . 2 1 1 A 26 26 TYR CA C 64 58.999 60.959 -1.960 1
1 293 . 2 1 1 A 26 26 TYR CB C 64 35.250 37.868 -2.618 1
1 294 . 2 1 1 A 26 26 TYR N N 64 122.575 122.015 0.560 1
1 295 . 2 1 1 A 27 27 LYS H H 65 8.330 8.254 0.076 1
1 296 . 2 1 1 A 27 27 LYS HA H 65 3.568 4.237 -0.669 1
1 302 . 2 1 1 A 27 27 LYS C C 65 176.156 178.164 -2.008 1
1 303 . 2 1 1 A 27 27 LYS CA C 65 56.499 59.386 -2.887 1
1 304 . 2 1 1 A 27 27 LYS CB C 65 29.626 31.912 -2.286 1
1 306 . 2 1 1 A 27 27 LYS N N 65 121.390 118.557 2.833 1
1 307 . 2 1 1 A 28 28 LEU H H 66 7.833 7.591 0.242 1
1 308 . 2 1 1 A 28 28 LEU HA H 66 3.769 4.137 -0.368 1
1 318 . 2 1 1 A 28 28 LEU C C 66 175.925 178.367 -2.442 1
1 319 . 2 1 1 A 28 28 LEU CA C 66 55.874 56.188 -0.314 1
1 320 . 2 1 1 A 28 28 LEU CB C 66 38.375 41.767 -3.392 1
1 324 . 2 1 1 A 28 28 LEU N N 66 123.068 119.315 3.753 1
1 325 . 2 1 1 A 29 29 ASP H H 67 7.292 7.924 -0.632 1
1 326 . 2 1 1 A 29 29 ASP HA H 67 4.096 5.016 -0.920 1
1 329 . 2 1 1 A 29 29 ASP C C 67 174.618 176.735 -2.117 1
1 330 . 2 1 1 A 29 29 ASP CA C 67 53.999 56.399 -2.400 1
1 331 . 2 1 1 A 29 29 ASP CB C 67 38.375 40.901 -2.526 1
1 332 . 2 1 1 A 29 29 ASP N N 67 114.729 119.375 -4.646 1
1 333 . 2 1 1 A 30 30 ASN H H 68 8.097 7.712 0.385 1
1 334 . 2 1 1 A 30 30 ASN HA H 68 4.337 4.278 0.059 1
1 339 . 2 1 1 A 30 30 ASN C C 68 172.822 174.054 -1.232 1
1 340 . 2 1 1 A 30 30 ASN CA C 68 52.124 51.887 0.237 1
1 341 . 2 1 1 A 30 30 ASN CB C 68 37.750 37.745 0.005 1
1 342 . 2 1 1 A 30 30 ASN N N 68 111.054 114.965 -3.911 1
1 344 . 2 1 1 A 31 31 PHE H H 69 8.249 7.884 0.365 1
1 345 . 2 1 1 A 31 31 PHE HA H 69 4.135 4.241 -0.106 1
1 353 . 2 1 1 A 31 31 PHE C C 69 170.485 174.222 -3.737 1
1 354 . 2 1 1 A 31 31 PHE CA C 69 57.749 58.717 -0.968 1
1 355 . 2 1 1 A 31 31 PHE CB C 69 33.375 36.561 -3.186 1
1 356 . 2 1 1 A 31 31 PHE N N 69 116.277 117.210 -0.933 1
1 357 . 2 1 1 A 32 32 ALA H H 70 7.224 6.912 0.312 1
1 358 . 2 1 1 A 32 32 ALA HA H 70 4.194 4.543 -0.349 1
1 362 . 2 1 1 A 32 32 ALA C C 70 173.337 175.033 -1.696 1
1 363 . 2 1 1 A 32 32 ALA CA C 70 48.374 51.596 -3.222 1
1 364 . 2 1 1 A 32 32 ALA CB C 70 19.626 22.374 -2.748 1
1 365 . 2 1 1 A 32 32 ALA N N 70 119.914 120.282 -0.368 1
1 366 . 2 1 1 A 33 33 TYR H H 71 7.948 8.423 -0.475 1
1 367 . 2 1 1 A 33 33 TYR HA H 71 4.209 4.957 -0.748 1
1 374 . 2 1 1 A 33 33 TYR C C 71 170.591 174.163 -3.572 1
1 375 . 2 1 1 A 33 33 TYR CA C 71 54.624 56.529 -1.905 1
1 376 . 2 1 1 A 33 33 TYR CB C 71 34.000 37.628 -3.628 1
1 377 . 2 1 1 A 33 33 TYR N N 71 116.929 118.197 -1.268 1
1 378 . 2 1 1 A 34 34 PRO HA H 72 4.444 4.849 -0.405 1
1 381 . 2 1 1 A 34 34 PRO C C 72 174.775 176.382 -1.607 1
1 382 . 2 1 1 A 34 34 PRO CA C 72 59.624 62.822 -3.198 1
1 383 . 2 1 1 A 34 34 PRO CB C 72 28.376 31.933 -3.557 1
1 384 . 2 1 1 A 35 35 SER H H 73 8.721 8.428 0.293 1
1 385 . 2 1 1 A 35 35 SER HA H 73 4.467 4.740 -0.273 1
1 388 . 2 1 1 A 35 35 SER C C 73 173.271 175.381 -2.110 1
1 389 . 2 1 1 A 35 35 SER CA C 73 55.249 56.815 -1.566 1
1 390 . 2 1 1 A 35 35 SER CB C 73 63.373 65.692 -2.319 1
1 391 . 2 1 1 A 35 35 SER N N 73 118.284 114.798 3.486 1
1 392 . 2 1 1 A 36 36 THR H H 74 8.591 8.859 -0.268 1
1 393 . 2 1 1 A 36 36 THR HA H 74 3.649 4.191 -0.542 1
1 398 . 2 1 1 A 36 36 THR CA C 74 64.623 63.752 0.871 1
1 399 . 2 1 1 A 36 36 THR CB C 74 66.498 69.061 -2.563 1
1 401 . 2 1 1 A 36 36 THR N N 74 117.769 117.063 0.706 1
1 402 . 2 1 1 A 37 37 GLN H H 75 8.210 7.925 0.285 1
1 403 . 2 1 1 A 37 37 GLN HA H 75 3.860 4.454 -0.594 1
1 410 . 2 1 1 A 37 37 GLN C C 75 175.349 177.595 -2.246 1
1 411 . 2 1 1 A 37 37 GLN CA C 75 56.499 57.575 -1.076 1
1 412 . 2 1 1 A 37 37 GLN CB C 75 25.876 29.712 -3.836 1
1 414 . 2 1 1 A 37 37 GLN N N 75 117.931 119.870 -1.939 1
1 416 . 2 1 1 A 38 38 GLN H H 76 7.667 8.195 -0.528 1
1 417 . 2 1 1 A 38 38 GLN HA H 76 3.810 4.128 -0.318 1
1 424 . 2 1 1 A 38 38 GLN C C 76 175.805 179.578 -3.773 1
1 425 . 2 1 1 A 38 38 GLN CA C 76 55.874 58.456 -2.582 1
1 426 . 2 1 1 A 38 38 GLN CB C 76 25.876 28.258 -2.382 1
1 428 . 2 1 1 A 38 38 GLN N N 76 120.607 117.997 2.610 1
1 430 . 2 1 1 A 39 39 GLY H H 77 8.470 8.427 0.043 1
1 431 . 2 1 1 A 39 39 GLY HA2 H 77 3.920 3.805 0.115 1
1 432 . 2 1 1 A 39 39 GLY HA3 H 77 3.603 3.841 -0.238 1
1 433 . 2 1 1 A 39 39 GLY C C 77 169.006 175.435 -6.429 1
1 434 . 2 1 1 A 39 39 GLY CA C 77 42.125 46.682 -4.557 1
1 435 . 2 1 1 A 39 39 GLY N N 77 103.281 109.222 -5.941 1
1 436 . 2 1 1 A 40 40 LEU H H 78 8.135 7.889 0.246 1
1 437 . 2 1 1 A 40 40 LEU HA H 78 3.237 4.089 -0.852 1
1 447 . 2 1 1 A 40 40 LEU C C 78 176.383 178.729 -2.346 1
1 448 . 2 1 1 A 40 40 LEU CA C 78 52.749 57.057 -4.308 1
1 449 . 2 1 1 A 40 40 LEU CB C 78 39.000 41.475 -2.475 1
1 453 . 2 1 1 A 40 40 LEU N N 78 114.444 123.526 -9.082 1
1 454 . 2 1 1 A 41 41 GLU H H 79 8.578 8.358 0.220 1
1 455 . 2 1 1 A 41 41 GLU HA H 79 3.720 4.005 -0.285 1
1 460 . 2 1 1 A 41 41 GLU C C 79 175.093 178.334 -3.241 1
1 461 . 2 1 1 A 41 41 GLU CA C 79 57.124 59.596 -2.472 1
1 462 . 2 1 1 A 41 41 GLU CB C 79 26.501 29.140 -2.639 1
1 464 . 2 1 1 A 41 41 GLU N N 79 118.295 119.023 -0.728 1
1 465 . 2 1 1 A 42 42 ALA H H 80 7.227 8.198 -0.971 1
1 466 . 2 1 1 A 42 42 ALA HA H 80 4.437 4.764 -0.327 1
1 470 . 2 1 1 A 42 42 ALA C C 80 173.745 178.516 -4.771 1
1 471 . 2 1 1 A 42 42 ALA CA C 80 51.499 53.369 -1.870 1
1 472 . 2 1 1 A 42 42 ALA CB C 80 15.877 18.883 -3.006 1
1 473 . 2 1 1 A 42 42 ALA N N 80 119.751 120.931 -1.180 1
1 474 . 2 1 1 A 43 43 LEU H H 81 7.932 7.352 0.580 1
1 475 . 2 1 1 A 43 43 LEU HA H 81 4.369 4.182 0.187 1
1 485 . 2 1 1 A 43 43 LEU C C 81 174.788 177.930 -3.142 1
1 486 . 2 1 1 A 43 43 LEU CA C 81 53.374 56.208 -2.834 1
1 487 . 2 1 1 A 43 43 LEU CB C 81 39.625 42.218 -2.593 1
1 491 . 2 1 1 A 43 43 LEU N N 81 111.742 116.693 -4.951 1
1 492 . 2 1 1 A 44 44 VAL H H 82 7.886 7.385 0.501 1
1 493 . 2 1 1 A 44 44 VAL HA H 82 4.700 4.162 0.538 1
1 501 . 2 1 1 A 44 44 VAL C C 82 172.875 175.769 -2.894 1
1 502 . 2 1 1 A 44 44 VAL CA C 82 59.624 63.733 -4.109 1
1 503 . 2 1 1 A 44 44 VAL CB C 82 31.501 33.492 -1.991 1
1 506 . 2 1 1 A 44 44 VAL N N 82 113.604 115.439 -1.835 1
1 507 . 2 1 1 A 45 45 LYS H H 83 8.361 8.354 0.007 1
1 508 . 2 1 1 A 45 45 LYS HA H 83 4.251 4.980 -0.729 1
1 515 . 2 1 1 A 45 45 LYS C C 83 171.053 175.148 -4.095 1
1 516 . 2 1 1 A 45 45 LYS CA C 83 52.749 54.267 -1.518 1
1 517 . 2 1 1 A 45 45 LYS CB C 83 33.375 35.798 -2.423 1
1 521 . 2 1 1 A 45 45 LYS N N 83 123.860 121.211 2.649 1
1 522 . 2 1 1 A 46 46 LYS H H 84 7.243 7.894 -0.651 1
1 523 . 2 1 1 A 46 46 LYS HA H 84 2.175 2.921 -0.746 1
1 532 . 2 1 1 A 46 46 LYS C C 84 172.123 174.441 -2.318 1
1 533 . 2 1 1 A 46 46 LYS CA C 84 52.749 54.305 -1.556 1
1 534 . 2 1 1 A 46 46 LYS CB C 84 29.626 31.717 -2.091 1
1 537 . 2 1 1 A 46 46 LYS N N 84 128.615 123.951 4.664 1
1 538 . 2 1 1 A 47 47 PRO HA H 85 4.470 4.461 0.009 1
1 541 . 2 1 1 A 47 47 PRO C C 85 173.754 176.237 -2.483 1
1 542 . 2 1 1 A 47 47 PRO CA C 85 60.874 62.709 -1.835 1
1 543 . 2 1 1 A 47 47 PRO CB C 85 30.876 31.931 -1.055 1
1 546 . 2 1 1 A 48 48 THR H H 86 8.306 8.281 0.025 1
1 547 . 2 1 1 A 48 48 THR HA H 86 4.287 4.592 -0.305 1
1 552 . 2 1 1 A 48 48 THR C C 86 173.070 174.189 -1.119 1
1 553 . 2 1 1 A 48 48 THR CA C 86 57.749 61.073 -3.324 1
1 554 . 2 1 1 A 48 48 THR CB C 86 67.748 70.251 -2.503 1
1 556 . 2 1 1 A 48 48 THR N N 86 109.564 112.457 -2.893 1
1 557 . 2 1 1 A 49 49 GLY H H 87 8.317 8.385 -0.068 1
1 558 . 2 1 1 A 49 49 GLY HA2 H 87 3.851 4.112 -0.261 1
1 559 . 2 1 1 A 49 49 GLY HA3 H 87 3.678 4.126 -0.448 1
1 560 . 2 1 1 A 49 49 GLY C C 87 169.693 172.579 -2.886 1
1 561 . 2 1 1 A 49 49 GLY CA C 87 42.125 44.086 -1.961 1
1 562 . 2 1 1 A 49 49 GLY N N 87 109.071 109.602 -0.531 1
1 563 . 2 1 1 A 50 50 ASN H H 88 8.301 8.618 -0.317 1
1 564 . 2 1 1 A 50 50 ASN HA H 88 4.780 5.360 -0.580 1
1 569 . 2 1 1 A 50 50 ASN C C 88 171.370 174.154 -2.784 1
1 570 . 2 1 1 A 50 50 ASN CA C 88 47.749 49.414 -1.665 1
1 571 . 2 1 1 A 50 50 ASN CB C 88 37.125 39.924 -2.799 1
1 572 . 2 1 1 A 50 50 ASN N N 88 115.631 119.328 -3.697 1
1 574 . 2 1 1 A 51 51 PRO HA H 89 4.782 4.724 0.058 1
1 577 . 2 1 1 A 51 51 PRO C C 89 173.656 175.522 -1.866 1
1 578 . 2 1 1 A 51 51 PRO CA C 89 59.624 62.283 -2.659 1
1 579 . 2 1 1 A 51 51 PRO CB C 89 31.501 32.333 -0.832 1
1 582 . 2 1 1 A 52 52 GLN H H 90 9.076 8.836 0.240 1
1 583 . 2 1 1 A 52 52 GLN HA H 90 4.469 4.911 -0.442 1
1 590 . 2 1 1 A 52 52 GLN C C 90 172.386 174.263 -1.877 1
1 591 . 2 1 1 A 52 52 GLN CA C 90 50.874 52.491 -1.617 1
1 592 . 2 1 1 A 52 52 GLN CB C 90 26.501 29.401 -2.900 1
1 594 . 2 1 1 A 52 52 GLN N N 90 126.827 120.109 6.718 1
1 596 . 2 1 1 A 53 53 PRO HA H 91 4.384 4.481 -0.097 1
1 599 . 2 1 1 A 53 53 PRO C C 91 174.274 175.918 -1.644 1
1 600 . 2 1 1 A 53 53 PRO CB C 91 28.113 31.773 -3.660 1
1 601 . 2 1 1 A 54 54 LYS H H 92 8.401 9.121 -0.720 1
1 602 . 2 1 1 A 54 54 LYS HA H 92 3.984 4.742 -0.758 1
1 611 . 2 1 1 A 54 54 LYS C C 92 173.516 176.636 -3.120 1
1 612 . 2 1 1 A 54 54 LYS CA C 92 55.249 55.144 0.105 1
1 613 . 2 1 1 A 54 54 LYS CB C 92 30.876 33.452 -2.576 1
1 615 . 2 1 1 A 54 54 LYS N N 92 124.538 123.278 1.260 1
1 616 . 2 1 1 A 55 55 ASN H H 93 8.183 8.849 -0.666 1
1 617 . 2 1 1 A 55 55 ASN HA H 93 4.716 4.468 0.248 1
1 622 . 2 1 1 A 55 55 ASN CA C 93 48.999 53.926 -4.927 1
1 623 . 2 1 1 A 55 55 ASN CB C 93 35.875 37.041 -1.166 1
1 624 . 2 1 1 A 55 55 ASN N N 93 118.677 121.556 -2.879 1
1 626 . 2 1 1 A 56 56 TRP H H 94 8.007 8.309 -0.302 1
1 627 . 2 1 1 A 56 56 TRP HA H 94 3.827 5.524 -1.697 1
1 635 . 2 1 1 A 56 56 TRP C C 94 173.760 175.379 -1.619 1
1 636 . 2 1 1 A 56 56 TRP CA C 94 59.624 59.130 0.494 1
1 637 . 2 1 1 A 56 56 TRP CB C 94 27.126 30.330 -3.204 1
1 638 . 2 1 1 A 56 56 TRP N N 94 122.195 127.844 -5.649 1
1 640 . 2 1 1 A 57 57 ASN H H 95 7.563 7.380 0.183 1
1 641 . 2 1 1 A 57 57 ASN HA H 95 3.735 4.756 -1.021 1
1 646 . 2 1 1 A 57 57 ASN C C 95 171.952 173.940 -1.988 1
1 647 . 2 1 1 A 57 57 ASN CA C 95 51.499 51.249 0.250 1
1 648 . 2 1 1 A 57 57 ASN CB C 95 35.250 41.418 -6.168 1
1 649 . 2 1 1 A 57 57 ASN N N 95 129.659 125.387 4.272 1
1 651 . 2 1 1 A 58 58 LYS H H 96 8.110 8.055 0.055 1
1 652 . 2 1 1 A 58 58 LYS HA H 96 4.035 4.049 -0.014 1
1 659 . 2 1 1 A 58 58 LYS C C 96 174.530 175.678 -1.148 1
1 660 . 2 1 1 A 58 58 LYS CA C 96 56.499 55.377 1.122 1
1 661 . 2 1 1 A 58 58 LYS CB C 96 29.626 33.132 -3.506 1
1 665 . 2 1 1 A 58 58 LYS N N 96 123.913 123.029 0.884 1
1 666 . 2 1 1 A 59 59 ASP H H 97 7.903 8.943 -1.040 1
1 667 . 2 1 1 A 59 59 ASP HA H 97 4.393 4.336 0.057 1
1 670 . 2 1 1 A 59 59 ASP C C 97 173.724 175.348 -1.624 1
1 671 . 2 1 1 A 59 59 ASP CA C 97 52.124 55.035 -2.911 1
1 672 . 2 1 1 A 59 59 ASP CB C 97 38.375 39.828 -1.453 1
1 673 . 2 1 1 A 59 59 ASP N N 97 118.773 119.901 -1.128 1
1 674 . 2 1 1 A 60 60 GLY H H 98 7.819 7.857 -0.038 1
1 675 . 2 1 1 A 60 60 GLY HA2 H 98 3.917 3.631 0.286 1
1 676 . 2 1 1 A 60 60 GLY HA3 H 98 3.917 3.937 -0.020 1
1 677 . 2 1 1 A 60 60 GLY C C 98 168.652 174.357 -5.705 1
1 678 . 2 1 1 A 60 60 GLY CA C 98 41.500 45.112 -3.612 1
1 679 . 2 1 1 A 60 60 GLY N N 98 108.742 104.827 3.915 1
1 680 . 2 1 1 A 61 61 TYR H H 99 8.105 8.083 0.022 1
1 681 . 2 1 1 A 61 61 TYR HA H 99 3.927 4.074 -0.147 1
1 689 . 2 1 1 A 61 61 TYR C C 99 172.831 174.501 -1.670 1
1 690 . 2 1 1 A 61 61 TYR CA C 99 57.124 57.858 -0.734 1
1 691 . 2 1 1 A 61 61 TYR CB C 99 37.125 36.594 0.531 1
1 692 . 2 1 1 A 61 61 TYR N N 99 113.836 113.440 0.396 1
1 693 . 2 1 1 A 62 62 LEU H H 100 7.352 8.441 -1.089 1
1 694 . 2 1 1 A 62 62 LEU HA H 100 4.343 4.801 -0.458 1
1 704 . 2 1 1 A 62 62 LEU C C 100 173.430 176.202 -2.772 1
1 705 . 2 1 1 A 62 62 LEU CA C 100 50.874 53.343 -2.469 1
1 706 . 2 1 1 A 62 62 LEU CB C 100 44.000 44.476 -0.476 1
1 710 . 2 1 1 A 62 62 LEU N N 100 117.112 120.013 -2.901 1
1 711 . 2 1 1 A 63 63 LYS H H 101 8.626 8.539 0.087 1
1 712 . 2 1 1 A 63 63 LYS HA H 101 3.986 4.594 -0.608 1
1 721 . 2 1 1 A 63 63 LYS C C 101 173.851 177.810 -3.959 1
1 722 . 2 1 1 A 63 63 LYS CA C 101 55.249 54.885 0.364 1
1 723 . 2 1 1 A 63 63 LYS CB C 101 29.626 34.160 -4.534 1
1 724 . 2 1 1 A 63 63 LYS N N 101 129.991 120.170 9.821 1
1 725 . 2 1 1 A 64 64 LYS H H 102 7.059 8.718 -1.659 1
1 726 . 2 1 1 A 64 64 LYS HA H 102 4.138 4.178 -0.040 1
1 735 . 2 1 1 A 64 64 LYS C C 102 171.120 176.263 -5.143 1
1 736 . 2 1 1 A 64 64 LYS CA C 102 52.749 56.998 -4.249 1
1 737 . 2 1 1 A 64 64 LYS CB C 102 32.750 31.870 0.880 1
1 740 . 2 1 1 A 64 64 LYS N N 102 113.255 120.914 -7.659 1
1 741 . 2 1 1 A 65 65 LEU H H 103 8.883 7.285 1.598 1
1 742 . 2 1 1 A 65 65 LEU HA H 103 4.475 4.941 -0.466 1
1 752 . 2 1 1 A 65 65 LEU C C 103 171.487 175.497 -4.010 1
1 753 . 2 1 1 A 65 65 LEU CA C 103 48.999 51.448 -2.449 1
1 754 . 2 1 1 A 65 65 LEU CB C 103 39.625 43.154 -3.529 1
1 758 . 2 1 1 A 65 65 LEU N N 103 126.355 116.638 9.717 1
1 759 . 2 1 1 A 66 66 PRO HA H 104 4.449 4.636 -0.187 1
1 764 . 2 1 1 A 66 66 PRO C C 104 173.363 176.130 -2.767 1
1 765 . 2 1 1 A 66 66 PRO CA C 104 60.249 62.186 -1.937 1
1 766 . 2 1 1 A 66 66 PRO CB C 104 29.626 32.924 -3.298 1
1 769 . 2 1 1 A 67 67 VAL H H 105 7.682 8.371 -0.689 1
1 770 . 2 1 1 A 67 67 VAL HA H 105 4.121 4.258 -0.137 1
1 778 . 2 1 1 A 67 67 VAL C C 105 171.667 175.083 -3.416 1
1 779 . 2 1 1 A 67 67 VAL CA C 105 58.374 61.770 -3.396 1
1 780 . 2 1 1 A 67 67 VAL CB C 105 30.251 32.582 -2.331 1
1 783 . 2 1 1 A 67 67 VAL N N 105 114.671 121.066 -6.395 1
1 784 . 2 1 1 A 68 68 ASP H H 106 8.216 7.646 0.570 1
1 785 . 2 1 1 A 68 68 ASP HA H 106 4.474 4.549 -0.075 1
1 788 . 2 1 1 A 68 68 ASP C C 106 172.452 174.918 -2.466 1
1 789 . 2 1 1 A 68 68 ASP CA C 106 50.249 51.932 -1.683 1
1 790 . 2 1 1 A 68 68 ASP CB C 106 37.750 40.750 -3.000 1
1 791 . 2 1 1 A 68 68 ASP N N 106 123.825 126.381 -2.556 1
1 792 . 2 1 1 A 69 69 PRO HA H 107 3.920 4.001 -0.081 1
1 797 . 2 1 1 A 69 69 PRO CA C 107 62.123 63.089 -0.966 1
1 798 . 2 1 1 A 69 69 PRO CB C 107 27.751 31.367 -3.616 1
1 801 . 2 1 1 A 70 70 TRP H H 108 8.156 8.372 -0.216 1
1 802 . 2 1 1 A 70 70 TRP HA H 108 4.274 4.280 -0.006 1
1 811 . 2 1 1 A 70 70 TRP CA C 108 57.124 58.491 -1.367 1
1 812 . 2 1 1 A 70 70 TRP CB C 108 25.251 27.140 -1.889 1
1 813 . 2 1 1 A 70 70 TRP N N 108 118.137 118.035 0.102 1
1 815 . 2 1 1 A 71 71 GLY H H 109 8.209 8.735 -0.526 1
1 816 . 2 1 1 A 71 71 GLY HA2 H 109 4.030 3.848 0.182 1
1 817 . 2 1 1 A 71 71 GLY HA3 H 109 3.303 3.881 -0.578 1
1 818 . 2 1 1 A 71 71 GLY CA C 109 42.750 46.169 -3.419 1
1 819 . 2 1 1 A 71 71 GLY N N 109 107.495 105.415 2.080 1
1 820 . 2 1 1 A 72 72 ASN H H 110 8.116 7.918 0.198 1
1 821 . 2 1 1 A 72 72 ASN HA H 110 5.103 4.998 0.105 1
1 826 . 2 1 1 A 72 72 ASN CA C 110 48.374 50.058 -1.684 1
1 827 . 2 1 1 A 72 72 ASN CB C 110 36.500 39.135 -2.635 1
1 828 . 2 1 1 A 72 72 ASN N N 110 120.108 120.227 -0.119 1
1 830 . 2 1 1 A 73 73 PRO HA H 111 4.397 4.402 -0.005 1
1 835 . 2 1 1 A 73 73 PRO C C 111 176.229 176.856 -0.627 1
1 836 . 2 1 1 A 73 73 PRO CA C 111 60.249 62.883 -2.634 1
1 837 . 2 1 1 A 73 73 PRO CB C 111 29.001 31.709 -2.708 1
1 840 . 2 1 1 A 74 74 TYR H H 112 8.893 8.486 0.407 1
1 841 . 2 1 1 A 74 74 TYR HA H 112 4.064 4.772 -0.708 1
1 849 . 2 1 1 A 74 74 TYR C C 112 171.951 176.182 -4.231 1
1 850 . 2 1 1 A 74 74 TYR CA C 112 60.249 58.348 1.901 1
1 851 . 2 1 1 A 74 74 TYR CB C 112 36.500 39.422 -2.922 1
1 852 . 2 1 1 A 74 74 TYR N N 112 124.595 121.465 3.130 1
1 853 . 2 1 1 A 75 75 GLN H H 113 9.127 8.946 0.181 1
1 854 . 2 1 1 A 75 75 GLN HA H 113 4.019 4.386 -0.367 1
1 861 . 2 1 1 A 75 75 GLN C C 113 171.436 174.386 -2.950 1
1 862 . 2 1 1 A 75 75 GLN CA C 113 50.874 54.632 -3.758 1
1 863 . 2 1 1 A 75 75 GLN CB C 113 29.469 29.773 -0.304 1
1 865 . 2 1 1 A 75 75 GLN N N 113 120.777 121.951 -1.174 1
1 867 . 2 1 1 A 76 76 TYR H H 114 7.906 8.317 -0.411 1
1 868 . 2 1 1 A 76 76 TYR HA H 114 5.586 5.634 -0.048 1
1 875 . 2 1 1 A 76 76 TYR C C 114 171.343 175.172 -3.829 1
1 876 . 2 1 1 A 76 76 TYR CA C 114 53.999 55.868 -1.869 1
1 877 . 2 1 1 A 76 76 TYR CB C 114 40.250 40.629 -0.379 1
1 878 . 2 1 1 A 76 76 TYR N N 114 120.757 121.804 -1.047 1
1 879 . 2 1 1 A 77 77 LEU H H 115 8.261 9.137 -0.876 1
1 880 . 2 1 1 A 77 77 LEU HA H 115 4.280 5.252 -0.972 1
1 890 . 2 1 1 A 77 77 LEU C C 115 170.921 175.912 -4.991 1
1 891 . 2 1 1 A 77 77 LEU CA C 115 51.499 53.618 -2.119 1
1 892 . 2 1 1 A 77 77 LEU CB C 115 44.625 45.639 -1.014 1
1 896 . 2 1 1 A 77 77 LEU N N 115 130.662 125.938 4.724 1
1 897 . 2 1 1 A 78 78 ALA H H 116 7.973 8.617 -0.644 1
1 898 . 2 1 1 A 78 78 ALA HA H 116 4.292 4.791 -0.499 1
1 902 . 2 1 1 A 78 78 ALA C C 116 172.093 174.978 -2.885 1
1 903 . 2 1 1 A 78 78 ALA CA C 116 47.749 49.920 -2.171 1
1 904 . 2 1 1 A 78 78 ALA CB C 116 19.626 20.789 -1.163 1
1 905 . 2 1 1 A 78 78 ALA N N 116 125.564 124.888 0.676 1
1 906 . 2 1 1 A 79 79 PRO HA H 117 4.698 5.279 -0.581 1
1 911 . 2 1 1 A 79 79 PRO C C 117 173.994 176.643 -2.649 1
1 912 . 2 1 1 A 79 79 PRO CA C 117 60.249 63.567 -3.318 1
1 913 . 2 1 1 A 79 79 PRO CB C 117 31.501 32.026 -0.525 1
1 916 . 2 1 1 A 80 80 GLY H H 118 7.096 8.392 -1.296 1
1 917 . 2 1 1 A 80 80 GLY HA2 H 118 3.797 3.995 -0.198 1
1 918 . 2 1 1 A 80 80 GLY HA3 H 118 3.517 4.012 -0.495 1
1 919 . 2 1 1 A 80 80 GLY C C 118 171.404 174.189 -2.785 1
1 920 . 2 1 1 A 80 80 GLY CA C 118 41.500 46.047 -4.547 1
1 921 . 2 1 1 A 80 80 GLY N N 118 108.306 107.120 1.186 1
1 922 . 2 1 1 A 81 81 THR H H 119 9.810 8.297 1.513 1
1 923 . 2 1 1 A 81 81 THR HA H 119 4.091 4.451 -0.360 1
1 928 . 2 1 1 A 81 81 THR C C 119 174.242 175.320 -1.078 1
1 929 . 2 1 1 A 81 81 THR CA C 119 60.874 61.428 -0.554 1
1 930 . 2 1 1 A 81 81 THR CB C 119 66.498 67.950 -1.452 1
1 932 . 2 1 1 A 81 81 THR N N 119 112.813 114.740 -1.927 1
1 933 . 2 1 1 A 82 82 LYS H H 120 8.964 7.988 0.976 1
1 934 . 2 1 1 A 82 82 LYS HA H 120 4.150 3.976 0.174 1
1 941 . 2 1 1 A 82 82 LYS C C 120 172.886 175.719 -2.833 1
1 942 . 2 1 1 A 82 82 LYS CA C 120 53.999 57.209 -3.210 1
1 943 . 2 1 1 A 82 82 LYS CB C 120 30.876 30.171 0.705 1
1 944 . 2 1 1 A 82 82 LYS N N 120 123.569 123.743 -0.174 1
1 945 . 2 1 1 A 83 83 GLY H H 121 7.125 7.841 -0.716 1
1 946 . 2 1 1 A 83 83 GLY HA2 H 121 3.814 4.274 -0.460 1
1 947 . 2 1 1 A 83 83 GLY HA3 H 121 3.814 4.338 -0.524 1
1 948 . 2 1 1 A 83 83 GLY C C 121 167.671 174.082 -6.411 1
1 949 . 2 1 1 A 83 83 GLY CA C 121 42.125 44.486 -2.361 1
1 950 . 2 1 1 A 83 83 GLY N N 121 107.253 108.620 -1.367 1
1 951 . 2 1 1 A 84 84 PRO HA H 122 4.077 4.493 -0.416 1
1 958 . 2 1 1 A 84 84 PRO C C 122 175.199 176.718 -1.519 1
1 959 . 2 1 1 A 84 84 PRO CA C 122 63.373 64.400 -1.027 1
1 960 . 2 1 1 A 84 84 PRO CB C 122 30.251 32.027 -1.776 1
1 962 . 2 1 1 A 85 85 PHE H H 123 6.652 6.796 -0.144 1
1 963 . 2 1 1 A 85 85 PHE HA H 123 4.744 4.729 0.015 1
1 971 . 2 1 1 A 85 85 PHE C C 123 170.340 172.575 -2.235 1
1 972 . 2 1 1 A 85 85 PHE CA C 123 53.999 56.348 -2.349 1
1 973 . 2 1 1 A 85 85 PHE CB C 123 39.000 40.307 -1.307 1
1 974 . 2 1 1 A 85 85 PHE N N 123 108.468 112.466 -3.998 1
1 975 . 2 1 1 A 86 86 ASP H H 124 9.268 9.232 0.036 1
1 976 . 2 1 1 A 86 86 ASP HA H 124 5.108 5.365 -0.257 1
1 979 . 2 1 1 A 86 86 ASP C C 124 171.180 174.671 -3.491 1
1 980 . 2 1 1 A 86 86 ASP CA C 124 50.249 53.657 -3.408 1
1 981 . 2 1 1 A 86 86 ASP CB C 124 40.250 43.286 -3.036 1
1 982 . 2 1 1 A 86 86 ASP N N 124 121.741 119.228 2.513 1
1 983 . 2 1 1 A 87 87 LEU H H 125 8.018 9.781 -1.763 1
1 984 . 2 1 1 A 87 87 LEU HA H 125 5.809 5.585 0.224 1
1 994 . 2 1 1 A 87 87 LEU C C 125 171.350 175.102 -3.752 1
1 995 . 2 1 1 A 87 87 LEU CA C 125 50.874 53.719 -2.845 1
1 996 . 2 1 1 A 87 87 LEU CB C 125 44.318 45.000 -0.682 1
1 999 . 2 1 1 A 87 87 LEU N N 125 123.629 127.486 -3.857 1
1 1000 . 2 1 1 A 88 88 TYR H H 126 8.912 8.500 0.412 1
1 1001 . 2 1 1 A 88 88 TYR HA H 126 5.630 5.710 -0.080 1
1 1008 . 2 1 1 A 88 88 TYR C C 126 171.410 172.254 -0.844 1
1 1009 . 2 1 1 A 88 88 TYR CA C 126 52.749 56.626 -3.877 1
1 1010 . 2 1 1 A 88 88 TYR CB C 126 37.750 40.474 -2.724 1
1 1011 . 2 1 1 A 88 88 TYR N N 126 119.697 121.776 -2.079 1
1 1012 . 2 1 1 A 89 89 SER H H 127 9.319 9.144 0.175 1
1 1013 . 2 1 1 A 89 89 SER HA H 127 5.429 5.298 0.131 1
1 1016 . 2 1 1 A 89 89 SER CA C 127 52.124 56.393 -4.269 1
1 1017 . 2 1 1 A 89 89 SER CB C 127 62.748 66.085 -3.337 1
1 1018 . 2 1 1 A 89 89 SER N N 127 112.637 115.732 -3.095 1
1 1019 . 2 1 1 A 90 90 LEU H H 128 8.759 8.630 0.129 1
1 1020 . 2 1 1 A 90 90 LEU HA H 128 4.186 4.313 -0.127 1
1 1030 . 2 1 1 A 90 90 LEU C C 128 175.121 177.960 -2.839 1
1 1031 . 2 1 1 A 90 90 LEU CA C 128 52.749 55.397 -2.648 1
1 1032 . 2 1 1 A 90 90 LEU CB C 128 35.875 41.860 -5.985 1
1 1033 . 2 1 1 A 90 90 LEU N N 128 126.728 126.729 -0.001 1
1 1034 . 2 1 1 A 91 91 GLY H H 129 8.356 7.950 0.406 1
1 1035 . 2 1 1 A 91 91 GLY HA2 H 129 3.373 3.215 0.158 1
1 1036 . 2 1 1 A 91 91 GLY HA3 H 129 3.373 3.682 -0.309 1
1 1037 . 2 1 1 A 91 91 GLY C C 129 172.013 174.033 -2.020 1
1 1038 . 2 1 1 A 91 91 GLY CA C 129 41.500 43.856 -2.356 1
1 1039 . 2 1 1 A 91 91 GLY N N 129 108.559 109.595 -1.036 1
1 1040 . 2 1 1 A 92 92 ALA H H 130 7.047 7.839 -0.792 1
1 1041 . 2 1 1 A 92 92 ALA HA H 130 4.037 2.715 1.322 1
1 1045 . 2 1 1 A 92 92 ALA C C 130 174.890 178.256 -3.366 1
1 1046 . 2 1 1 A 92 92 ALA CA C 130 52.100 53.760 -1.660 1
1 1047 . 2 1 1 A 92 92 ALA CB C 130 16.502 18.148 -1.646 1
1 1048 . 2 1 1 A 92 92 ALA N N 130 118.393 121.474 -3.081 1
1 1049 . 2 1 1 A 93 93 ASP H H 131 7.222 7.658 -0.436 1
1 1050 . 2 1 1 A 93 93 ASP HA H 131 4.122 4.691 -0.569 1
1 1053 . 2 1 1 A 93 93 ASP C C 131 174.890 176.314 -1.424 1
1 1054 . 2 1 1 A 93 93 ASP CA C 131 50.249 53.755 -3.506 1
1 1055 . 2 1 1 A 93 93 ASP CB C 131 37.750 41.281 -3.531 1
1 1056 . 2 1 1 A 93 93 ASP N N 131 111.487 115.685 -4.198 1
1 1057 . 2 1 1 A 94 94 GLY H H 132 7.199 8.322 -1.123 1
1 1058 . 2 1 1 A 94 94 GLY HA2 H 132 3.951 3.836 0.115 1
1 1059 . 2 1 1 A 94 94 GLY HA3 H 132 3.324 3.864 -0.540 1
1 1060 . 2 1 1 A 94 94 GLY C C 132 169.773 174.152 -4.379 1
1 1061 . 2 1 1 A 94 94 GLY CA C 132 44.625 45.879 -1.254 1
1 1062 . 2 1 1 A 94 94 GLY N N 132 106.932 108.544 -1.612 1
1 1063 . 2 1 1 A 95 95 LYS H H 133 7.215 7.694 -0.479 1
1 1064 . 2 1 1 A 95 95 LYS HA H 133 4.513 4.577 -0.064 1
1 1073 . 2 1 1 A 95 95 LYS C C 133 172.108 175.115 -3.007 1
1 1074 . 2 1 1 A 95 95 LYS CA C 133 51.512 54.473 -2.961 1
1 1075 . 2 1 1 A 95 95 LYS CB C 133 34.000 34.049 -0.049 1
1 1076 . 2 1 1 A 95 95 LYS N N 133 115.749 119.802 -4.053 1
1 1077 . 2 1 1 A 96 96 GLU H H 134 9.230 8.684 0.546 1
1 1078 . 2 1 1 A 96 96 GLU HA H 134 4.352 4.781 -0.429 1
1 1083 . 2 1 1 A 96 96 GLU C C 134 175.219 175.332 -0.113 1
1 1084 . 2 1 1 A 96 96 GLU CA C 134 55.874 55.268 0.606 1
1 1085 . 2 1 1 A 96 96 GLU CB C 134 27.126 30.788 -3.662 1
1 1087 . 2 1 1 A 96 96 GLU N N 134 128.571 123.903 4.668 1
1 1088 . 2 1 1 A 97 97 GLY H H 135 10.677 8.191 2.486 1
1 1089 . 2 1 1 A 97 97 GLY HA2 H 135 4.037 4.308 -0.271 1
1 1090 . 2 1 1 A 97 97 GLY HA3 H 135 3.717 4.312 -0.595 1
1 1091 . 2 1 1 A 97 97 GLY C C 135 171.567 172.242 -0.675 1
1 1092 . 2 1 1 A 97 97 GLY CA C 135 41.500 45.873 -4.373 1
1 1093 . 2 1 1 A 97 97 GLY N N 135 117.011 113.147 3.864 1
1 1094 . 2 1 1 A 98 98 GLY H H 136 8.442 8.666 -0.224 1
1 1095 . 2 1 1 A 98 98 GLY HA2 H 136 4.195 4.233 -0.038 1
1 1096 . 2 1 1 A 98 98 GLY HA3 H 136 4.195 4.236 -0.041 1
1 1097 . 2 1 1 A 98 98 GLY C C 136 170.299 173.300 -3.001 1
1 1098 . 2 1 1 A 98 98 GLY CA C 136 40.875 44.808 -3.933 1
1 1099 . 2 1 1 A 98 98 GLY N N 136 109.494 109.170 0.324 1
1 1100 . 2 1 1 A 99 99 SER H H 137 8.701 8.707 -0.006 1
1 1101 . 2 1 1 A 99 99 SER HA H 137 4.639 4.921 -0.282 1
1 1104 . 2 1 1 A 99 99 SER C C 137 170.630 173.832 -3.202 1
1 1105 . 2 1 1 A 99 99 SER CA C 137 54.624 57.551 -2.927 1
1 1106 . 2 1 1 A 99 99 SER CB C 137 62.748 66.641 -3.893 1
1 1107 . 2 1 1 A 99 99 SER N N 137 114.685 118.241 -3.556 1
1 1108 . 2 1 1 A 100 100 ASP H H 138 9.117 8.727 0.390 1
1 1109 . 2 1 1 A 100 100 ASP HA H 138 3.965 4.587 -0.622 1
1 1112 . 2 1 1 A 100 100 ASP C C 138 175.540 177.358 -1.818 1
1 1113 . 2 1 1 A 100 100 ASP CA C 138 54.624 56.094 -1.470 1
1 1114 . 2 1 1 A 100 100 ASP CB C 138 36.500 41.666 -5.166 1
1 1115 . 2 1 1 A 100 100 ASP N N 138 120.777 123.515 -2.738 1
1 1116 . 2 1 1 A 101 101 ASN H H 139 8.667 7.892 0.775 1
1 1117 . 2 1 1 A 101 101 ASN HA H 139 4.333 4.637 -0.304 1
1 1122 . 2 1 1 A 101 101 ASN CA C 139 53.999 55.500 -1.501 1
1 1123 . 2 1 1 A 101 101 ASN CB C 139 34.625 38.991 -4.366 1
1 1124 . 2 1 1 A 101 101 ASN N N 139 121.930 117.569 4.361 1
1 1126 . 2 1 1 A 102 102 ASP H H 140 7.714 7.658 0.056 1
1 1127 . 2 1 1 A 102 102 ASP HA H 140 4.037 4.576 -0.539 1
1 1130 . 2 1 1 A 102 102 ASP C C 140 172.807 175.596 -2.789 1
1 1131 . 2 1 1 A 102 102 ASP CA C 140 53.374 54.385 -1.011 1
1 1132 . 2 1 1 A 102 102 ASP CB C 140 37.125 41.426 -4.301 1
1 1133 . 2 1 1 A 102 102 ASP N N 140 118.011 116.592 1.419 1
1 1134 . 2 1 1 A 103 103 ALA H H 141 7.060 7.286 -0.226 1
1 1135 . 2 1 1 A 103 103 ALA HA H 141 3.353 4.536 -1.183 1
1 1139 . 2 1 1 A 103 103 ALA C C 141 172.233 176.351 -4.118 1
1 1140 . 2 1 1 A 103 103 ALA CA C 141 49.624 50.609 -0.985 1
1 1141 . 2 1 1 A 103 103 ALA CB C 141 16.502 21.948 -5.446 1
1 1142 . 2 1 1 A 103 103 ALA N N 141 125.777 122.115 3.662 1
1 1143 . 2 1 1 A 104 104 ASP H H 142 7.973 8.495 -0.522 1
1 1144 . 2 1 1 A 104 104 ASP HA H 142 4.420 4.846 -0.426 1
1 1147 . 2 1 1 A 104 104 ASP C C 142 174.188 176.014 -1.826 1
1 1148 . 2 1 1 A 104 104 ASP CA C 142 52.124 54.008 -1.884 1
1 1149 . 2 1 1 A 104 104 ASP CB C 142 37.125 41.218 -4.093 1
1 1150 . 2 1 1 A 104 104 ASP N N 142 122.965 119.953 3.012 1
1 1151 . 2 1 1 A 105 105 ILE H H 143 8.534 8.675 -0.141 1
1 1152 . 2 1 1 A 105 105 ILE HA H 143 4.060 4.791 -0.731 1
1 1162 . 2 1 1 A 105 105 ILE C C 143 173.235 175.482 -2.247 1
1 1163 . 2 1 1 A 105 105 ILE CA C 143 58.374 60.200 -1.826 1
1 1164 . 2 1 1 A 105 105 ILE CB C 143 39.123 39.437 -0.314 1
1 1167 . 2 1 1 A 105 105 ILE N N 143 124.757 120.636 4.121 1
1 1168 . 2 1 1 A 106 106 GLY H H 144 8.288 8.554 -0.266 1
1 1169 . 2 1 1 A 106 106 GLY HA2 H 144 4.764 4.463 0.301 1
1 1170 . 2 1 1 A 106 106 GLY HA3 H 144 4.764 4.599 0.165 1
1 1171 . 2 1 1 A 106 106 GLY C C 144 171.321 172.074 -0.753 1
1 1172 . 2 1 1 A 106 106 GLY CA C 144 40.250 44.835 -4.585 1
1 1173 . 2 1 1 A 106 106 GLY N N 144 110.895 112.450 -1.555 1
1 1174 . 2 1 1 A 107 107 ASN H H 145 8.577 9.292 -0.715 1
1 1175 . 2 1 1 A 107 107 ASN HA H 145 4.268 5.188 -0.920 1
1 1180 . 2 1 1 A 107 107 ASN C C 145 171.757 173.542 -1.785 1
1 1181 . 2 1 1 A 107 107 ASN CA C 145 52.124 52.282 -0.158 1
1 1182 . 2 1 1 A 107 107 ASN CB C 145 34.625 41.779 -7.154 1
1 1183 . 2 1 1 A 107 107 ASN N N 145 118.042 118.546 -0.504 1
1 1185 . 2 1 1 A 108 108 TRP H H 146 6.822 8.359 -1.537 1
1 1186 . 2 1 1 A 108 108 TRP HA H 146 4.513 5.013 -0.500 1
1 1195 . 2 1 1 A 108 108 TRP C C 146 172.665 172.290 0.375 1
1 1196 . 2 1 1 A 108 108 TRP CA C 146 54.624 55.604 -0.980 1
1 1197 . 2 1 1 A 108 108 TRP CB C 146 25.876 31.224 -5.348 1
1 1198 . 2 1 1 A 108 108 TRP N N 146 116.756 121.707 -4.951 1
1 1200 . 2 1 1 A 109 109 ASP H H 147 7.344 7.766 -0.422 1
1 1201 . 2 1 1 A 109 109 ASP HA H 147 4.655 5.463 -0.808 1
1 1204 . 2 1 1 A 109 109 ASP C C 147 172.193 175.141 -2.948 1
1 1205 . 2 1 1 A 109 109 ASP CA C 147 51.499 52.743 -1.244 1
1 1206 . 2 1 1 A 109 109 ASP CB C 147 39.000 43.441 -4.441 1
1 1207 . 2 1 1 A 109 109 ASP N N 147 121.461 119.317 2.144 1
1 11 . 3 1 1 A 2 2 SER H H 40 8.461 8.974 -0.513 1
1 12 . 3 1 1 A 2 2 SER HA H 40 4.286 4.790 -0.504 1
1 15 . 3 1 1 A 2 2 SER C C 40 171.276 173.622 -2.346 1
1 16 . 3 1 1 A 2 2 SER CA C 40 55.249 57.899 -2.650 1
1 17 . 3 1 1 A 2 2 SER CB C 40 61.498 61.303 0.195 1
1 18 . 3 1 1 A 2 2 SER N N 40 118.344 123.867 -5.523 1
1 19 . 3 1 1 A 3 3 ARG H H 41 8.469 7.764 0.705 1
1 20 . 3 1 1 A 3 3 ARG HA H 41 4.400 4.830 -0.430 1
1 25 . 3 1 1 A 3 3 ARG C C 41 172.251 173.742 -1.491 1
1 26 . 3 1 1 A 3 3 ARG CA C 41 52.749 52.910 -0.161 1
1 27 . 3 1 1 A 3 3 ARG CB C 41 27.126 33.391 -6.265 1
1 28 . 3 1 1 A 3 3 ARG N N 41 123.070 123.049 0.021 1
1 33 . 3 1 1 A 4 4 PRO CA C 42 61.498 63.823 -2.325 1
1 34 . 3 1 1 A 4 4 PRO CB C 42 29.001 31.659 -2.658 1
1 37 . 3 1 1 A 5 5 ASP H H 43 8.246 8.913 -0.667 1
1 38 . 3 1 1 A 5 5 ASP HA H 43 4.329 4.590 -0.261 1
1 41 . 3 1 1 A 5 5 ASP C C 43 174.605 177.346 -2.741 1
1 42 . 3 1 1 A 5 5 ASP CA C 43 53.374 55.815 -2.441 1
1 43 . 3 1 1 A 5 5 ASP CB C 43 38.375 40.595 -2.220 1
1 44 . 3 1 1 A 5 5 ASP N N 43 119.409 121.165 -1.756 1
1 45 . 3 1 1 A 6 6 GLN H H 44 8.309 8.262 0.047 1
1 46 . 3 1 1 A 6 6 GLN HA H 44 4.393 4.282 0.111 1
1 53 . 3 1 1 A 6 6 GLN C C 44 175.053 178.592 -3.539 1
1 54 . 3 1 1 A 6 6 GLN CA C 44 55.874 58.109 -2.235 1
1 55 . 3 1 1 A 6 6 GLN CB C 44 25.876 28.254 -2.378 1
1 57 . 3 1 1 A 6 6 GLN N N 44 122.273 118.090 4.183 1
1 59 . 3 1 1 A 7 7 ALA H H 45 8.106 7.952 0.154 1
1 60 . 3 1 1 A 7 7 ALA HA H 45 3.993 4.011 -0.018 1
1 64 . 3 1 1 A 7 7 ALA C C 45 177.465 178.174 -0.709 1
1 65 . 3 1 1 A 7 7 ALA CA C 45 52.124 54.770 -2.646 1
1 66 . 3 1 1 A 7 7 ALA CB C 45 15.252 18.172 -2.920 1
1 67 . 3 1 1 A 7 7 ALA N N 45 122.204 121.840 0.364 1
1 68 . 3 1 1 A 8 8 LYS H H 46 7.527 7.757 -0.230 1
1 69 . 3 1 1 A 8 8 LYS HA H 46 3.539 4.093 -0.554 1
1 78 . 3 1 1 A 8 8 LYS C C 46 175.412 179.077 -3.665 1
1 79 . 3 1 1 A 8 8 LYS CA C 46 57.124 58.317 -1.193 1
1 80 . 3 1 1 A 8 8 LYS CB C 46 30.876 31.994 -1.118 1
1 83 . 3 1 1 A 8 8 LYS N N 46 117.358 116.696 0.662 1
1 84 . 3 1 1 A 9 9 VAL H H 47 7.709 7.639 0.070 1
1 85 . 3 1 1 A 9 9 VAL HA H 47 3.578 3.835 -0.257 1
1 93 . 3 1 1 A 9 9 VAL C C 47 175.005 178.343 -3.338 1
1 94 . 3 1 1 A 9 9 VAL CA C 47 64.623 66.155 -1.532 1
1 95 . 3 1 1 A 9 9 VAL CB C 47 29.001 31.823 -2.822 1
1 98 . 3 1 1 A 9 9 VAL N N 47 119.115 120.417 -1.302 1
1 99 . 3 1 1 A 10 10 THR H H 48 7.767 8.368 -0.601 1
1 100 . 3 1 1 A 10 10 THR HA H 48 3.668 4.002 -0.334 1
1 105 . 3 1 1 A 10 10 THR CA C 48 63.998 65.967 -1.969 1
1 106 . 3 1 1 A 10 10 THR CB C 48 67.123 68.765 -1.642 1
1 108 . 3 1 1 A 10 10 THR N N 48 115.112 113.775 1.337 1
1 109 . 3 1 1 A 11 11 VAL H H 49 7.598 7.842 -0.244 1
1 110 . 3 1 1 A 11 11 VAL HA H 49 3.457 3.836 -0.379 1
1 118 . 3 1 1 A 11 11 VAL C C 49 175.412 177.982 -2.570 1
1 119 . 3 1 1 A 11 11 VAL CA C 49 63.998 64.786 -0.788 1
1 120 . 3 1 1 A 11 11 VAL CB C 49 29.001 31.646 -2.645 1
1 123 . 3 1 1 A 11 11 VAL N N 49 123.694 117.414 6.280 1
1 124 . 3 1 1 A 12 12 ALA H H 50 8.176 8.017 0.159 1
1 125 . 3 1 1 A 12 12 ALA HA H 50 4.742 3.943 0.799 1
1 129 . 3 1 1 A 12 12 ALA C C 50 177.074 179.672 -2.598 1
1 130 . 3 1 1 A 12 12 ALA CA C 50 52.124 55.530 -3.406 1
1 131 . 3 1 1 A 12 12 ALA CB C 50 15.252 18.284 -3.032 1
1 132 . 3 1 1 A 12 12 ALA N N 50 122.348 124.416 -2.068 1
1 133 . 3 1 1 A 13 13 LYS H H 51 8.499 8.132 0.367 1
1 134 . 3 1 1 A 13 13 LYS HA H 51 3.648 4.064 -0.416 1
1 143 . 3 1 1 A 13 13 LYS C C 51 177.252 179.604 -2.352 1
1 144 . 3 1 1 A 13 13 LYS CA C 51 58.072 59.395 -1.323 1
1 145 . 3 1 1 A 13 13 LYS CB C 51 30.251 32.250 -1.999 1
1 146 . 3 1 1 A 13 13 LYS N N 51 115.402 116.048 -0.646 1
1 147 . 3 1 1 A 14 14 GLY H H 52 7.858 8.061 -0.203 1
1 148 . 3 1 1 A 14 14 GLY HA2 H 52 3.823 3.903 -0.080 1
1 149 . 3 1 1 A 14 14 GLY HA3 H 52 3.676 3.904 -0.228 1
1 150 . 3 1 1 A 14 14 GLY C C 52 174.090 175.636 -1.546 1
1 151 . 3 1 1 A 14 14 GLY CA C 52 44.625 46.602 -1.977 1
1 152 . 3 1 1 A 14 14 GLY N N 52 107.466 108.556 -1.090 1
1 153 . 3 1 1 A 15 15 ASP H H 53 8.403 7.726 0.677 1
1 154 . 3 1 1 A 15 15 ASP HA H 53 4.191 4.395 -0.204 1
1 157 . 3 1 1 A 15 15 ASP C C 53 175.316 179.091 -3.775 1
1 158 . 3 1 1 A 15 15 ASP CA C 53 54.624 56.640 -2.016 1
1 159 . 3 1 1 A 15 15 ASP CB C 53 35.875 40.997 -5.122 1
1 160 . 3 1 1 A 15 15 ASP N N 53 125.929 121.288 4.641 1
1 161 . 3 1 1 A 16 16 ILE H H 54 8.245 8.258 -0.013 1
1 162 . 3 1 1 A 16 16 ILE HA H 54 3.034 3.860 -0.826 1
1 172 . 3 1 1 A 16 16 ILE C C 54 174.499 177.762 -3.263 1
1 173 . 3 1 1 A 16 16 ILE CA C 54 62.748 64.114 -1.366 1
1 174 . 3 1 1 A 16 16 ILE CB C 54 34.625 37.449 -2.824 1
1 178 . 3 1 1 A 16 16 ILE N N 54 119.456 116.594 2.862 1
1 179 . 3 1 1 A 17 17 LYS H H 55 7.547 8.022 -0.475 1
1 180 . 3 1 1 A 17 17 LYS HA H 55 3.843 4.411 -0.568 1
1 187 . 3 1 1 A 17 17 LYS C C 55 176.651 178.728 -2.077 1
1 188 . 3 1 1 A 17 17 LYS CA C 55 57.124 58.713 -1.589 1
1 189 . 3 1 1 A 17 17 LYS CB C 55 30.251 32.107 -1.856 1
1 190 . 3 1 1 A 17 17 LYS N N 55 118.505 120.643 -2.138 1
1 191 . 3 1 1 A 18 18 ALA H H 56 7.680 8.059 -0.379 1
1 192 . 3 1 1 A 18 18 ALA HA H 56 4.029 4.039 -0.010 1
1 196 . 3 1 1 A 18 18 ALA C C 56 176.638 180.011 -3.373 1
1 197 . 3 1 1 A 18 18 ALA CA C 56 52.749 55.096 -2.347 1
1 198 . 3 1 1 A 18 18 ALA CB C 56 15.877 18.162 -2.285 1
1 199 . 3 1 1 A 18 18 ALA N N 56 122.477 121.724 0.753 1
1 200 . 3 1 1 A 19 19 ILE H H 57 8.853 7.588 1.265 1
1 201 . 3 1 1 A 19 19 ILE HA H 57 3.304 3.626 -0.322 1
1 211 . 3 1 1 A 19 19 ILE C C 57 174.710 178.001 -3.291 1
1 212 . 3 1 1 A 19 19 ILE CA C 57 63.373 65.362 -1.989 1
1 213 . 3 1 1 A 19 19 ILE CB C 57 35.250 37.556 -2.306 1
1 217 . 3 1 1 A 19 19 ILE N N 57 120.901 118.934 1.967 1
1 218 . 3 1 1 A 20 20 ALA H H 58 8.702 8.178 0.524 1
1 219 . 3 1 1 A 20 20 ALA HA H 58 3.900 4.151 -0.251 1
1 223 . 3 1 1 A 20 20 ALA C C 58 176.512 179.902 -3.390 1
1 224 . 3 1 1 A 20 20 ALA CA C 58 52.749 55.316 -2.567 1
1 225 . 3 1 1 A 20 20 ALA CB C 58 15.252 18.127 -2.875 1
1 226 . 3 1 1 A 20 20 ALA N N 58 121.763 122.660 -0.897 1
1 227 . 3 1 1 A 21 21 ALA H H 59 7.662 7.434 0.228 1
1 228 . 3 1 1 A 21 21 ALA HA H 59 4.136 4.258 -0.122 1
1 232 . 3 1 1 A 21 21 ALA C C 59 177.949 179.627 -1.678 1
1 233 . 3 1 1 A 21 21 ALA CA C 59 52.749 54.898 -2.149 1
1 234 . 3 1 1 A 21 21 ALA CB C 59 15.252 18.516 -3.264 1
1 235 . 3 1 1 A 21 21 ALA N N 59 119.079 119.493 -0.414 1
1 236 . 3 1 1 A 22 22 ALA H H 60 7.403 7.793 -0.390 1
1 237 . 3 1 1 A 22 22 ALA HA H 60 4.318 4.143 0.175 1
1 241 . 3 1 1 A 22 22 ALA C C 60 176.730 180.193 -3.463 1
1 242 . 3 1 1 A 22 22 ALA CA C 60 52.749 54.871 -2.122 1
1 243 . 3 1 1 A 22 22 ALA CB C 60 17.126 18.523 -1.397 1
1 244 . 3 1 1 A 22 22 ALA N N 60 122.616 120.784 1.832 1
1 245 . 3 1 1 A 23 23 LEU H H 61 8.410 8.695 -0.285 1
1 246 . 3 1 1 A 23 23 LEU HA H 61 3.527 3.906 -0.379 1
1 256 . 3 1 1 A 23 23 LEU C C 61 176.057 178.469 -2.412 1
1 257 . 3 1 1 A 23 23 LEU CA C 61 55.249 57.332 -2.083 1
1 258 . 3 1 1 A 23 23 LEU CB C 61 39.000 40.782 -1.782 1
1 262 . 3 1 1 A 23 23 LEU N N 61 120.761 121.449 -0.688 1
1 263 . 3 1 1 A 24 24 ASP H H 62 8.227 8.291 -0.064 1
1 264 . 3 1 1 A 24 24 ASP HA H 62 4.581 4.438 0.143 1
1 267 . 3 1 1 A 24 24 ASP C C 62 176.968 178.445 -1.477 1
1 268 . 3 1 1 A 24 24 ASP CA C 62 55.874 57.242 -1.368 1
1 269 . 3 1 1 A 24 24 ASP CB C 62 37.750 41.434 -3.684 1
1 270 . 3 1 1 A 24 24 ASP N N 62 119.068 119.012 0.056 1
1 271 . 3 1 1 A 25 25 MET H H 63 7.718 7.961 -0.243 1
1 272 . 3 1 1 A 25 25 MET HA H 63 4.196 4.181 0.015 1
1 277 . 3 1 1 A 25 25 MET C C 63 174.968 177.901 -2.933 1
1 278 . 3 1 1 A 25 25 MET CA C 63 55.249 58.391 -3.142 1
1 279 . 3 1 1 A 25 25 MET CB C 63 29.626 32.292 -2.666 1
1 281 . 3 1 1 A 25 25 MET N N 63 121.365 117.177 4.188 1
1 282 . 3 1 1 A 26 26 TYR H H 64 8.401 7.511 0.890 1
1 283 . 3 1 1 A 26 26 TYR HA H 64 4.400 3.660 0.740 1
1 291 . 3 1 1 A 26 26 TYR C C 64 176.098 177.820 -1.722 1
1 292 . 3 1 1 A 26 26 TYR CA C 64 58.999 60.910 -1.911 1
1 293 . 3 1 1 A 26 26 TYR CB C 64 35.250 38.118 -2.868 1
1 294 . 3 1 1 A 26 26 TYR N N 64 122.575 121.599 0.976 1
1 295 . 3 1 1 A 27 27 LYS H H 65 8.330 8.499 -0.169 1
1 296 . 3 1 1 A 27 27 LYS HA H 65 3.568 4.484 -0.916 1
1 302 . 3 1 1 A 27 27 LYS C C 65 176.156 178.131 -1.975 1
1 303 . 3 1 1 A 27 27 LYS CA C 65 56.499 58.356 -1.857 1
1 304 . 3 1 1 A 27 27 LYS CB C 65 29.626 30.827 -1.201 1
1 306 . 3 1 1 A 27 27 LYS N N 65 121.390 118.125 3.265 1
1 307 . 3 1 1 A 28 28 LEU H H 66 7.833 7.352 0.481 1
1 308 . 3 1 1 A 28 28 LEU HA H 66 3.769 4.066 -0.297 1
1 318 . 3 1 1 A 28 28 LEU C C 66 175.925 177.916 -1.991 1
1 319 . 3 1 1 A 28 28 LEU CA C 66 55.874 56.847 -0.973 1
1 320 . 3 1 1 A 28 28 LEU CB C 66 38.375 42.601 -4.226 1
1 324 . 3 1 1 A 28 28 LEU N N 66 123.068 121.127 1.941 1
1 325 . 3 1 1 A 29 29 ASP H H 67 7.292 7.790 -0.498 1
1 326 . 3 1 1 A 29 29 ASP HA H 67 4.096 4.307 -0.211 1
1 329 . 3 1 1 A 29 29 ASP C C 67 174.618 176.857 -2.239 1
1 330 . 3 1 1 A 29 29 ASP CA C 67 53.999 56.351 -2.352 1
1 331 . 3 1 1 A 29 29 ASP CB C 67 38.375 40.809 -2.434 1
1 332 . 3 1 1 A 29 29 ASP N N 67 114.729 118.682 -3.953 1
1 333 . 3 1 1 A 30 30 ASN H H 68 8.097 7.621 0.476 1
1 334 . 3 1 1 A 30 30 ASN HA H 68 4.337 4.353 -0.016 1
1 339 . 3 1 1 A 30 30 ASN C C 68 172.822 174.417 -1.595 1
1 340 . 3 1 1 A 30 30 ASN CA C 68 52.124 51.783 0.341 1
1 341 . 3 1 1 A 30 30 ASN CB C 68 37.750 38.236 -0.486 1
1 342 . 3 1 1 A 30 30 ASN N N 68 111.054 115.807 -4.753 1
1 344 . 3 1 1 A 31 31 PHE H H 69 8.249 7.911 0.338 1
1 345 . 3 1 1 A 31 31 PHE HA H 69 4.135 4.342 -0.207 1
1 353 . 3 1 1 A 31 31 PHE C C 69 170.485 174.230 -3.745 1
1 354 . 3 1 1 A 31 31 PHE CA C 69 57.749 58.726 -0.977 1
1 355 . 3 1 1 A 31 31 PHE CB C 69 33.375 36.569 -3.194 1
1 356 . 3 1 1 A 31 31 PHE N N 69 116.277 119.050 -2.773 1
1 357 . 3 1 1 A 32 32 ALA H H 70 7.224 7.064 0.160 1
1 358 . 3 1 1 A 32 32 ALA HA H 70 4.194 4.524 -0.330 1
1 362 . 3 1 1 A 32 32 ALA C C 70 173.337 175.028 -1.691 1
1 363 . 3 1 1 A 32 32 ALA CA C 70 48.374 51.577 -3.203 1
1 364 . 3 1 1 A 32 32 ALA CB C 70 19.626 22.331 -2.705 1
1 365 . 3 1 1 A 32 32 ALA N N 70 119.914 120.298 -0.384 1
1 366 . 3 1 1 A 33 33 TYR H H 71 7.948 8.412 -0.464 1
1 367 . 3 1 1 A 33 33 TYR HA H 71 4.209 4.989 -0.780 1
1 374 . 3 1 1 A 33 33 TYR C C 71 170.591 174.149 -3.558 1
1 375 . 3 1 1 A 33 33 TYR CA C 71 54.624 56.504 -1.880 1
1 376 . 3 1 1 A 33 33 TYR CB C 71 34.000 37.742 -3.742 1
1 377 . 3 1 1 A 33 33 TYR N N 71 116.929 118.073 -1.144 1
1 378 . 3 1 1 A 34 34 PRO HA H 72 4.444 4.812 -0.368 1
1 381 . 3 1 1 A 34 34 PRO C C 72 174.775 176.349 -1.574 1
1 382 . 3 1 1 A 34 34 PRO CA C 72 59.624 62.675 -3.051 1
1 383 . 3 1 1 A 34 34 PRO CB C 72 28.376 32.026 -3.650 1
1 384 . 3 1 1 A 35 35 SER H H 73 8.721 8.437 0.284 1
1 385 . 3 1 1 A 35 35 SER HA H 73 4.467 4.758 -0.291 1
1 388 . 3 1 1 A 35 35 SER C C 73 173.271 175.482 -2.211 1
1 389 . 3 1 1 A 35 35 SER CA C 73 55.249 56.641 -1.392 1
1 390 . 3 1 1 A 35 35 SER CB C 73 63.373 65.806 -2.433 1
1 391 . 3 1 1 A 35 35 SER N N 73 118.284 114.536 3.748 1
1 392 . 3 1 1 A 36 36 THR H H 74 8.591 8.910 -0.319 1
1 393 . 3 1 1 A 36 36 THR HA H 74 3.649 4.198 -0.549 1
1 398 . 3 1 1 A 36 36 THR CA C 74 64.623 64.063 0.560 1
1 399 . 3 1 1 A 36 36 THR CB C 74 66.498 69.118 -2.620 1
1 401 . 3 1 1 A 36 36 THR N N 74 117.769 117.189 0.580 1
1 402 . 3 1 1 A 37 37 GLN H H 75 8.210 7.869 0.341 1
1 403 . 3 1 1 A 37 37 GLN HA H 75 3.860 4.466 -0.606 1
1 410 . 3 1 1 A 37 37 GLN C C 75 175.349 177.631 -2.282 1
1 411 . 3 1 1 A 37 37 GLN CA C 75 56.499 57.576 -1.077 1
1 412 . 3 1 1 A 37 37 GLN CB C 75 25.876 29.572 -3.696 1
1 414 . 3 1 1 A 37 37 GLN N N 75 117.931 119.966 -2.035 1
1 416 . 3 1 1 A 38 38 GLN H H 76 7.667 8.127 -0.460 1
1 417 . 3 1 1 A 38 38 GLN HA H 76 3.810 4.093 -0.283 1
1 424 . 3 1 1 A 38 38 GLN C C 76 175.805 179.379 -3.574 1
1 425 . 3 1 1 A 38 38 GLN CA C 76 55.874 58.586 -2.712 1
1 426 . 3 1 1 A 38 38 GLN CB C 76 25.876 28.317 -2.441 1
1 428 . 3 1 1 A 38 38 GLN N N 76 120.607 118.259 2.348 1
1 430 . 3 1 1 A 39 39 GLY H H 77 8.470 8.133 0.337 1
1 431 . 3 1 1 A 39 39 GLY HA2 H 77 3.920 3.770 0.150 1
1 432 . 3 1 1 A 39 39 GLY HA3 H 77 3.603 3.798 -0.195 1
1 433 . 3 1 1 A 39 39 GLY C C 77 169.006 175.611 -6.605 1
1 434 . 3 1 1 A 39 39 GLY CA C 77 42.125 46.504 -4.379 1
1 435 . 3 1 1 A 39 39 GLY N N 77 103.281 109.110 -5.829 1
1 436 . 3 1 1 A 40 40 LEU H H 78 8.135 7.817 0.318 1
1 437 . 3 1 1 A 40 40 LEU HA H 78 3.237 4.067 -0.830 1
1 447 . 3 1 1 A 40 40 LEU C C 78 176.383 178.237 -1.854 1
1 448 . 3 1 1 A 40 40 LEU CA C 78 52.749 57.154 -4.405 1
1 449 . 3 1 1 A 40 40 LEU CB C 78 39.000 41.593 -2.593 1
1 453 . 3 1 1 A 40 40 LEU N N 78 114.444 123.302 -8.858 1
1 454 . 3 1 1 A 41 41 GLU H H 79 8.578 8.322 0.256 1
1 455 . 3 1 1 A 41 41 GLU HA H 79 3.720 4.038 -0.318 1
1 460 . 3 1 1 A 41 41 GLU C C 79 175.093 177.604 -2.511 1
1 461 . 3 1 1 A 41 41 GLU CA C 79 57.124 58.622 -1.498 1
1 462 . 3 1 1 A 41 41 GLU CB C 79 26.501 27.989 -1.488 1
1 464 . 3 1 1 A 41 41 GLU N N 79 118.295 116.994 1.301 1
1 465 . 3 1 1 A 42 42 ALA H H 80 7.227 7.585 -0.358 1
1 466 . 3 1 1 A 42 42 ALA HA H 80 4.437 4.632 -0.195 1
1 470 . 3 1 1 A 42 42 ALA C C 80 173.745 178.201 -4.456 1
1 471 . 3 1 1 A 42 42 ALA CA C 80 51.499 53.705 -2.206 1
1 472 . 3 1 1 A 42 42 ALA CB C 80 15.877 18.622 -2.745 1
1 473 . 3 1 1 A 42 42 ALA N N 80 119.751 122.233 -2.482 1
1 474 . 3 1 1 A 43 43 LEU H H 81 7.932 7.462 0.470 1
1 475 . 3 1 1 A 43 43 LEU HA H 81 4.369 4.255 0.114 1
1 485 . 3 1 1 A 43 43 LEU C C 81 174.788 178.258 -3.470 1
1 486 . 3 1 1 A 43 43 LEU CA C 81 53.374 56.246 -2.872 1
1 487 . 3 1 1 A 43 43 LEU CB C 81 39.625 42.040 -2.415 1
1 491 . 3 1 1 A 43 43 LEU N N 81 111.742 116.475 -4.733 1
1 492 . 3 1 1 A 44 44 VAL H H 82 7.886 7.146 0.740 1
1 493 . 3 1 1 A 44 44 VAL HA H 82 4.700 3.952 0.748 1
1 501 . 3 1 1 A 44 44 VAL C C 82 172.875 175.794 -2.919 1
1 502 . 3 1 1 A 44 44 VAL CA C 82 59.624 64.187 -4.563 1
1 503 . 3 1 1 A 44 44 VAL CB C 82 31.501 33.142 -1.641 1
1 506 . 3 1 1 A 44 44 VAL N N 82 113.604 115.927 -2.323 1
1 507 . 3 1 1 A 45 45 LYS H H 83 8.361 8.447 -0.086 1
1 508 . 3 1 1 A 45 45 LYS HA H 83 4.251 4.913 -0.662 1
1 515 . 3 1 1 A 45 45 LYS C C 83 171.053 175.077 -4.024 1
1 516 . 3 1 1 A 45 45 LYS CA C 83 52.749 54.250 -1.501 1
1 517 . 3 1 1 A 45 45 LYS CB C 83 33.375 35.707 -2.332 1
1 521 . 3 1 1 A 45 45 LYS N N 83 123.860 120.290 3.570 1
1 522 . 3 1 1 A 46 46 LYS H H 84 7.243 8.037 -0.794 1
1 523 . 3 1 1 A 46 46 LYS HA H 84 2.175 2.713 -0.538 1
1 532 . 3 1 1 A 46 46 LYS C C 84 172.123 174.751 -2.628 1
1 533 . 3 1 1 A 46 46 LYS CA C 84 52.749 53.803 -1.054 1
1 534 . 3 1 1 A 46 46 LYS CB C 84 29.626 32.435 -2.809 1
1 537 . 3 1 1 A 46 46 LYS N N 84 128.615 126.217 2.398 1
1 538 . 3 1 1 A 47 47 PRO HA H 85 4.470 4.332 0.138 1
1 541 . 3 1 1 A 47 47 PRO C C 85 173.754 176.257 -2.503 1
1 542 . 3 1 1 A 47 47 PRO CA C 85 60.874 63.240 -2.366 1
1 543 . 3 1 1 A 47 47 PRO CB C 85 30.876 32.095 -1.219 1
1 546 . 3 1 1 A 48 48 THR H H 86 8.306 8.292 0.014 1
1 547 . 3 1 1 A 48 48 THR HA H 86 4.287 4.856 -0.569 1
1 552 . 3 1 1 A 48 48 THR C C 86 173.070 173.990 -0.920 1
1 553 . 3 1 1 A 48 48 THR CA C 86 57.749 60.953 -3.204 1
1 554 . 3 1 1 A 48 48 THR CB C 86 67.748 69.701 -1.953 1
1 556 . 3 1 1 A 48 48 THR N N 86 109.564 112.637 -3.073 1
1 557 . 3 1 1 A 49 49 GLY H H 87 8.317 8.353 -0.036 1
1 558 . 3 1 1 A 49 49 GLY HA2 H 87 3.851 4.180 -0.329 1
1 559 . 3 1 1 A 49 49 GLY HA3 H 87 3.678 4.184 -0.506 1
1 560 . 3 1 1 A 49 49 GLY C C 87 169.693 172.284 -2.591 1
1 561 . 3 1 1 A 49 49 GLY CA C 87 42.125 45.395 -3.270 1
1 562 . 3 1 1 A 49 49 GLY N N 87 109.071 109.624 -0.553 1
1 563 . 3 1 1 A 50 50 ASN H H 88 8.301 8.625 -0.324 1
1 564 . 3 1 1 A 50 50 ASN HA H 88 4.780 5.414 -0.634 1
1 569 . 3 1 1 A 50 50 ASN C C 88 171.370 173.996 -2.626 1
1 570 . 3 1 1 A 50 50 ASN CA C 88 47.749 50.796 -3.047 1
1 571 . 3 1 1 A 50 50 ASN CB C 88 37.125 38.971 -1.846 1
1 572 . 3 1 1 A 50 50 ASN N N 88 115.631 120.751 -5.120 1
1 574 . 3 1 1 A 51 51 PRO HA H 89 4.782 4.683 0.099 1
1 577 . 3 1 1 A 51 51 PRO C C 89 173.656 175.397 -1.741 1
1 578 . 3 1 1 A 51 51 PRO CA C 89 59.624 62.237 -2.613 1
1 579 . 3 1 1 A 51 51 PRO CB C 89 31.501 32.484 -0.983 1
1 582 . 3 1 1 A 52 52 GLN H H 90 9.076 8.676 0.400 1
1 583 . 3 1 1 A 52 52 GLN HA H 90 4.469 4.886 -0.417 1
1 590 . 3 1 1 A 52 52 GLN C C 90 172.386 173.654 -1.268 1
1 591 . 3 1 1 A 52 52 GLN CA C 90 50.874 52.320 -1.446 1
1 592 . 3 1 1 A 52 52 GLN CB C 90 26.501 29.940 -3.439 1
1 594 . 3 1 1 A 52 52 GLN N N 90 126.827 119.261 7.566 1
1 596 . 3 1 1 A 53 53 PRO HA H 91 4.384 4.509 -0.125 1
1 599 . 3 1 1 A 53 53 PRO C C 91 174.274 176.193 -1.919 1
1 600 . 3 1 1 A 53 53 PRO CB C 91 28.113 31.634 -3.521 1
1 601 . 3 1 1 A 54 54 LYS H H 92 8.401 8.632 -0.231 1
1 602 . 3 1 1 A 54 54 LYS HA H 92 3.984 4.758 -0.774 1
1 611 . 3 1 1 A 54 54 LYS C C 92 173.516 176.053 -2.537 1
1 612 . 3 1 1 A 54 54 LYS CA C 92 55.249 54.751 0.498 1
1 613 . 3 1 1 A 54 54 LYS CB C 92 30.876 36.828 -5.952 1
1 615 . 3 1 1 A 54 54 LYS N N 92 124.538 123.921 0.617 1
1 616 . 3 1 1 A 55 55 ASN H H 93 8.183 8.726 -0.543 1
1 617 . 3 1 1 A 55 55 ASN HA H 93 4.716 4.909 -0.193 1
1 622 . 3 1 1 A 55 55 ASN CA C 93 48.999 53.032 -4.033 1
1 623 . 3 1 1 A 55 55 ASN CB C 93 35.875 37.492 -1.617 1
1 624 . 3 1 1 A 55 55 ASN N N 93 118.677 121.226 -2.549 1
1 626 . 3 1 1 A 56 56 TRP H H 94 8.007 8.829 -0.822 1
1 627 . 3 1 1 A 56 56 TRP HA H 94 3.827 5.667 -1.840 1
1 635 . 3 1 1 A 56 56 TRP C C 94 173.760 175.389 -1.629 1
1 636 . 3 1 1 A 56 56 TRP CA C 94 59.624 59.310 0.314 1
1 637 . 3 1 1 A 56 56 TRP CB C 94 27.126 30.349 -3.223 1
1 638 . 3 1 1 A 56 56 TRP N N 94 122.195 127.445 -5.250 1
1 640 . 3 1 1 A 57 57 ASN H H 95 7.563 7.452 0.111 1
1 641 . 3 1 1 A 57 57 ASN HA H 95 3.735 4.860 -1.125 1
1 646 . 3 1 1 A 57 57 ASN C C 95 171.952 173.785 -1.833 1
1 647 . 3 1 1 A 57 57 ASN CA C 95 51.499 50.878 0.621 1
1 648 . 3 1 1 A 57 57 ASN CB C 95 35.250 41.118 -5.868 1
1 649 . 3 1 1 A 57 57 ASN N N 95 129.659 125.185 4.474 1
1 651 . 3 1 1 A 58 58 LYS H H 96 8.110 8.139 -0.029 1
1 652 . 3 1 1 A 58 58 LYS HA H 96 4.035 4.036 -0.001 1
1 659 . 3 1 1 A 58 58 LYS C C 96 174.530 175.611 -1.081 1
1 660 . 3 1 1 A 58 58 LYS CA C 96 56.499 55.074 1.425 1
1 661 . 3 1 1 A 58 58 LYS CB C 96 29.626 33.152 -3.526 1
1 665 . 3 1 1 A 58 58 LYS N N 96 123.913 122.959 0.954 1
1 666 . 3 1 1 A 59 59 ASP H H 97 7.903 9.251 -1.348 1
1 667 . 3 1 1 A 59 59 ASP HA H 97 4.393 4.492 -0.099 1
1 670 . 3 1 1 A 59 59 ASP C C 97 173.724 175.507 -1.783 1
1 671 . 3 1 1 A 59 59 ASP CA C 97 52.124 55.188 -3.064 1
1 672 . 3 1 1 A 59 59 ASP CB C 97 38.375 40.009 -1.634 1
1 673 . 3 1 1 A 59 59 ASP N N 97 118.773 119.822 -1.049 1
1 674 . 3 1 1 A 60 60 GLY H H 98 7.819 8.046 -0.227 1
1 675 . 3 1 1 A 60 60 GLY HA2 H 98 3.917 3.956 -0.039 1
1 676 . 3 1 1 A 60 60 GLY HA3 H 98 3.917 4.211 -0.294 1
1 677 . 3 1 1 A 60 60 GLY C C 98 168.652 174.475 -5.823 1
1 678 . 3 1 1 A 60 60 GLY CA C 98 41.500 44.963 -3.463 1
1 679 . 3 1 1 A 60 60 GLY N N 98 108.742 105.308 3.434 1
1 680 . 3 1 1 A 61 61 TYR H H 99 8.105 8.083 0.022 1
1 681 . 3 1 1 A 61 61 TYR HA H 99 3.927 4.640 -0.713 1
1 689 . 3 1 1 A 61 61 TYR C C 99 172.831 174.072 -1.241 1
1 690 . 3 1 1 A 61 61 TYR CA C 99 57.124 58.355 -1.231 1
1 691 . 3 1 1 A 61 61 TYR CB C 99 37.125 36.028 1.097 1
1 692 . 3 1 1 A 61 61 TYR N N 99 113.836 116.908 -3.072 1
1 693 . 3 1 1 A 62 62 LEU H H 100 7.352 8.044 -0.692 1
1 694 . 3 1 1 A 62 62 LEU HA H 100 4.343 4.900 -0.557 1
1 704 . 3 1 1 A 62 62 LEU C C 100 173.430 175.697 -2.267 1
1 705 . 3 1 1 A 62 62 LEU CA C 100 50.874 53.452 -2.578 1
1 706 . 3 1 1 A 62 62 LEU CB C 100 44.000 45.609 -1.609 1
1 710 . 3 1 1 A 62 62 LEU N N 100 117.112 119.118 -2.006 1
1 711 . 3 1 1 A 63 63 LYS H H 101 8.626 8.289 0.337 1
1 712 . 3 1 1 A 63 63 LYS HA H 101 3.986 4.489 -0.503 1
1 721 . 3 1 1 A 63 63 LYS C C 101 173.851 176.918 -3.067 1
1 722 . 3 1 1 A 63 63 LYS CA C 101 55.249 55.224 0.025 1
1 723 . 3 1 1 A 63 63 LYS CB C 101 29.626 33.664 -4.038 1
1 724 . 3 1 1 A 63 63 LYS N N 101 129.991 121.785 8.206 1
1 725 . 3 1 1 A 64 64 LYS H H 102 7.059 8.510 -1.451 1
1 726 . 3 1 1 A 64 64 LYS HA H 102 4.138 4.191 -0.053 1
1 735 . 3 1 1 A 64 64 LYS C C 102 171.120 175.812 -4.692 1
1 736 . 3 1 1 A 64 64 LYS CA C 102 52.749 56.322 -3.573 1
1 737 . 3 1 1 A 64 64 LYS CB C 102 32.750 31.393 1.357 1
1 740 . 3 1 1 A 64 64 LYS N N 102 113.255 121.040 -7.785 1
1 741 . 3 1 1 A 65 65 LEU H H 103 8.883 7.957 0.926 1
1 742 . 3 1 1 A 65 65 LEU HA H 103 4.475 4.755 -0.280 1
1 752 . 3 1 1 A 65 65 LEU C C 103 171.487 174.534 -3.047 1
1 753 . 3 1 1 A 65 65 LEU CA C 103 48.999 51.159 -2.160 1
1 754 . 3 1 1 A 65 65 LEU CB C 103 39.625 45.170 -5.545 1
1 758 . 3 1 1 A 65 65 LEU N N 103 126.355 121.473 4.882 1
1 759 . 3 1 1 A 66 66 PRO HA H 104 4.449 4.645 -0.196 1
1 764 . 3 1 1 A 66 66 PRO C C 104 173.363 176.160 -2.797 1
1 765 . 3 1 1 A 66 66 PRO CA C 104 60.249 62.209 -1.960 1
1 766 . 3 1 1 A 66 66 PRO CB C 104 29.626 32.921 -3.295 1
1 769 . 3 1 1 A 67 67 VAL H H 105 7.682 8.385 -0.703 1
1 770 . 3 1 1 A 67 67 VAL HA H 105 4.121 4.353 -0.232 1
1 778 . 3 1 1 A 67 67 VAL C C 105 171.667 175.104 -3.437 1
1 779 . 3 1 1 A 67 67 VAL CA C 105 58.374 61.797 -3.423 1
1 780 . 3 1 1 A 67 67 VAL CB C 105 30.251 32.593 -2.342 1
1 783 . 3 1 1 A 67 67 VAL N N 105 114.671 121.085 -6.414 1
1 784 . 3 1 1 A 68 68 ASP H H 106 8.216 8.155 0.061 1
1 785 . 3 1 1 A 68 68 ASP HA H 106 4.474 4.569 -0.095 1
1 788 . 3 1 1 A 68 68 ASP C C 106 172.452 174.800 -2.348 1
1 789 . 3 1 1 A 68 68 ASP CA C 106 50.249 51.899 -1.650 1
1 790 . 3 1 1 A 68 68 ASP CB C 106 37.750 40.327 -2.577 1
1 791 . 3 1 1 A 68 68 ASP N N 106 123.825 126.318 -2.493 1
1 792 . 3 1 1 A 69 69 PRO HA H 107 3.920 3.989 -0.069 1
1 797 . 3 1 1 A 69 69 PRO CA C 107 62.123 63.228 -1.105 1
1 798 . 3 1 1 A 69 69 PRO CB C 107 27.751 31.543 -3.792 1
1 801 . 3 1 1 A 70 70 TRP H H 108 8.156 8.416 -0.260 1
1 802 . 3 1 1 A 70 70 TRP HA H 108 4.274 4.296 -0.022 1
1 811 . 3 1 1 A 70 70 TRP CA C 108 57.124 58.457 -1.333 1
1 812 . 3 1 1 A 70 70 TRP CB C 108 25.251 27.206 -1.955 1
1 813 . 3 1 1 A 70 70 TRP N N 108 118.137 117.742 0.395 1
1 815 . 3 1 1 A 71 71 GLY H H 109 8.209 8.739 -0.530 1
1 816 . 3 1 1 A 71 71 GLY HA2 H 109 4.030 3.831 0.199 1
1 817 . 3 1 1 A 71 71 GLY HA3 H 109 3.303 3.865 -0.562 1
1 818 . 3 1 1 A 71 71 GLY CA C 109 42.750 46.002 -3.252 1
1 819 . 3 1 1 A 71 71 GLY N N 109 107.495 105.441 2.054 1
1 820 . 3 1 1 A 72 72 ASN H H 110 8.116 7.848 0.268 1
1 821 . 3 1 1 A 72 72 ASN HA H 110 5.103 5.009 0.094 1
1 826 . 3 1 1 A 72 72 ASN CA C 110 48.374 50.384 -2.010 1
1 827 . 3 1 1 A 72 72 ASN CB C 110 36.500 38.997 -2.497 1
1 828 . 3 1 1 A 72 72 ASN N N 110 120.108 119.788 0.320 1
1 830 . 3 1 1 A 73 73 PRO HA H 111 4.397 4.400 -0.003 1
1 835 . 3 1 1 A 73 73 PRO C C 111 176.229 176.176 0.053 1
1 836 . 3 1 1 A 73 73 PRO CA C 111 60.249 62.353 -2.104 1
1 837 . 3 1 1 A 73 73 PRO CB C 111 29.001 31.948 -2.947 1
1 840 . 3 1 1 A 74 74 TYR H H 112 8.893 8.494 0.399 1
1 841 . 3 1 1 A 74 74 TYR HA H 112 4.064 4.671 -0.607 1
1 849 . 3 1 1 A 74 74 TYR C C 112 171.951 175.730 -3.779 1
1 850 . 3 1 1 A 74 74 TYR CA C 112 60.249 58.332 1.917 1
1 851 . 3 1 1 A 74 74 TYR CB C 112 36.500 39.189 -2.689 1
1 852 . 3 1 1 A 74 74 TYR N N 112 124.595 121.058 3.537 1
1 853 . 3 1 1 A 75 75 GLN H H 113 9.127 9.008 0.119 1
1 854 . 3 1 1 A 75 75 GLN HA H 113 4.019 4.382 -0.363 1
1 861 . 3 1 1 A 75 75 GLN C C 113 171.436 174.321 -2.885 1
1 862 . 3 1 1 A 75 75 GLN CA C 113 50.874 54.706 -3.832 1
1 863 . 3 1 1 A 75 75 GLN CB C 113 29.469 29.271 0.198 1
1 865 . 3 1 1 A 75 75 GLN N N 113 120.777 121.978 -1.201 1
1 867 . 3 1 1 A 76 76 TYR H H 114 7.906 8.332 -0.426 1
1 868 . 3 1 1 A 76 76 TYR HA H 114 5.586 5.604 -0.018 1
1 875 . 3 1 1 A 76 76 TYR C C 114 171.343 175.410 -4.067 1
1 876 . 3 1 1 A 76 76 TYR CA C 114 53.999 55.979 -1.980 1
1 877 . 3 1 1 A 76 76 TYR CB C 114 40.250 40.437 -0.187 1
1 878 . 3 1 1 A 76 76 TYR N N 114 120.757 122.223 -1.466 1
1 879 . 3 1 1 A 77 77 LEU H H 115 8.261 9.089 -0.828 1
1 880 . 3 1 1 A 77 77 LEU HA H 115 4.280 5.222 -0.942 1
1 890 . 3 1 1 A 77 77 LEU C C 115 170.921 175.978 -5.057 1
1 891 . 3 1 1 A 77 77 LEU CA C 115 51.499 53.651 -2.152 1
1 892 . 3 1 1 A 77 77 LEU CB C 115 44.625 45.577 -0.952 1
1 896 . 3 1 1 A 77 77 LEU N N 115 130.662 126.108 4.554 1
1 897 . 3 1 1 A 78 78 ALA H H 116 7.973 8.474 -0.501 1
1 898 . 3 1 1 A 78 78 ALA HA H 116 4.292 4.701 -0.409 1
1 902 . 3 1 1 A 78 78 ALA C C 116 172.093 175.055 -2.962 1
1 903 . 3 1 1 A 78 78 ALA CA C 116 47.749 50.066 -2.317 1
1 904 . 3 1 1 A 78 78 ALA CB C 116 19.626 20.346 -0.720 1
1 905 . 3 1 1 A 78 78 ALA N N 116 125.564 125.394 0.170 1
1 906 . 3 1 1 A 79 79 PRO HA H 117 4.698 5.330 -0.632 1
1 911 . 3 1 1 A 79 79 PRO C C 117 173.994 176.729 -2.735 1
1 912 . 3 1 1 A 79 79 PRO CA C 117 60.249 63.425 -3.176 1
1 913 . 3 1 1 A 79 79 PRO CB C 117 31.501 31.888 -0.387 1
1 916 . 3 1 1 A 80 80 GLY H H 118 7.096 7.924 -0.828 1
1 917 . 3 1 1 A 80 80 GLY HA2 H 118 3.797 3.971 -0.174 1
1 918 . 3 1 1 A 80 80 GLY HA3 H 118 3.517 4.012 -0.495 1
1 919 . 3 1 1 A 80 80 GLY C C 118 171.404 174.245 -2.841 1
1 920 . 3 1 1 A 80 80 GLY CA C 118 41.500 46.257 -4.757 1
1 921 . 3 1 1 A 80 80 GLY N N 118 108.306 108.150 0.156 1
1 922 . 3 1 1 A 81 81 THR H H 119 9.810 8.146 1.664 1
1 923 . 3 1 1 A 81 81 THR HA H 119 4.091 4.477 -0.386 1
1 928 . 3 1 1 A 81 81 THR C C 119 174.242 174.689 -0.447 1
1 929 . 3 1 1 A 81 81 THR CA C 119 60.874 60.743 0.131 1
1 930 . 3 1 1 A 81 81 THR CB C 119 66.498 68.948 -2.450 1
1 932 . 3 1 1 A 81 81 THR N N 119 112.813 113.992 -1.179 1
1 933 . 3 1 1 A 82 82 LYS H H 120 8.964 8.653 0.311 1
1 934 . 3 1 1 A 82 82 LYS HA H 120 4.150 3.870 0.280 1
1 941 . 3 1 1 A 82 82 LYS C C 120 172.886 175.608 -2.722 1
1 942 . 3 1 1 A 82 82 LYS CA C 120 53.999 57.716 -3.717 1
1 943 . 3 1 1 A 82 82 LYS CB C 120 30.876 29.853 1.023 1
1 944 . 3 1 1 A 82 82 LYS N N 120 123.569 125.727 -2.158 1
1 945 . 3 1 1 A 83 83 GLY H H 121 7.125 7.820 -0.695 1
1 946 . 3 1 1 A 83 83 GLY HA2 H 121 3.814 4.245 -0.431 1
1 947 . 3 1 1 A 83 83 GLY HA3 H 121 3.814 4.327 -0.513 1
1 948 . 3 1 1 A 83 83 GLY C C 121 167.671 174.186 -6.515 1
1 949 . 3 1 1 A 83 83 GLY CA C 121 42.125 44.423 -2.298 1
1 950 . 3 1 1 A 83 83 GLY N N 121 107.253 107.501 -0.248 1
1 951 . 3 1 1 A 84 84 PRO HA H 122 4.077 4.437 -0.360 1
1 958 . 3 1 1 A 84 84 PRO C C 122 175.199 176.767 -1.568 1
1 959 . 3 1 1 A 84 84 PRO CA C 122 63.373 64.386 -1.013 1
1 960 . 3 1 1 A 84 84 PRO CB C 122 30.251 31.993 -1.742 1
1 962 . 3 1 1 A 85 85 PHE H H 123 6.652 6.720 -0.068 1
1 963 . 3 1 1 A 85 85 PHE HA H 123 4.744 4.779 -0.035 1
1 971 . 3 1 1 A 85 85 PHE C C 123 170.340 172.470 -2.130 1
1 972 . 3 1 1 A 85 85 PHE CA C 123 53.999 56.301 -2.302 1
1 973 . 3 1 1 A 85 85 PHE CB C 123 39.000 40.372 -1.372 1
1 974 . 3 1 1 A 85 85 PHE N N 123 108.468 112.737 -4.269 1
1 975 . 3 1 1 A 86 86 ASP H H 124 9.268 9.202 0.066 1
1 976 . 3 1 1 A 86 86 ASP HA H 124 5.108 5.250 -0.142 1
1 979 . 3 1 1 A 86 86 ASP C C 124 171.180 174.585 -3.405 1
1 980 . 3 1 1 A 86 86 ASP CA C 124 50.249 53.402 -3.153 1
1 981 . 3 1 1 A 86 86 ASP CB C 124 40.250 43.357 -3.107 1
1 982 . 3 1 1 A 86 86 ASP N N 124 121.741 119.209 2.532 1
1 983 . 3 1 1 A 87 87 LEU H H 125 8.018 9.291 -1.273 1
1 984 . 3 1 1 A 87 87 LEU HA H 125 5.809 5.625 0.184 1
1 994 . 3 1 1 A 87 87 LEU C C 125 171.350 175.112 -3.762 1
1 995 . 3 1 1 A 87 87 LEU CA C 125 50.874 53.545 -2.671 1
1 996 . 3 1 1 A 87 87 LEU CB C 125 44.318 44.916 -0.598 1
1 999 . 3 1 1 A 87 87 LEU N N 125 123.629 127.614 -3.985 1
1 1000 . 3 1 1 A 88 88 TYR H H 126 8.912 8.463 0.449 1
1 1001 . 3 1 1 A 88 88 TYR HA H 126 5.630 5.668 -0.038 1
1 1008 . 3 1 1 A 88 88 TYR C C 126 171.410 172.769 -1.359 1
1 1009 . 3 1 1 A 88 88 TYR CA C 126 52.749 56.595 -3.846 1
1 1010 . 3 1 1 A 88 88 TYR CB C 126 37.750 40.473 -2.723 1
1 1011 . 3 1 1 A 88 88 TYR N N 126 119.697 121.747 -2.050 1
1 1012 . 3 1 1 A 89 89 SER H H 127 9.319 9.239 0.080 1
1 1013 . 3 1 1 A 89 89 SER HA H 127 5.429 5.004 0.425 1
1 1016 . 3 1 1 A 89 89 SER CA C 127 52.124 57.489 -5.365 1
1 1017 . 3 1 1 A 89 89 SER CB C 127 62.748 65.837 -3.089 1
1 1018 . 3 1 1 A 89 89 SER N N 127 112.637 116.840 -4.203 1
1 1019 . 3 1 1 A 90 90 LEU H H 128 8.759 8.445 0.314 1
1 1020 . 3 1 1 A 90 90 LEU HA H 128 4.186 4.692 -0.506 1
1 1030 . 3 1 1 A 90 90 LEU C C 128 175.121 178.299 -3.178 1
1 1031 . 3 1 1 A 90 90 LEU CA C 128 52.749 55.443 -2.694 1
1 1032 . 3 1 1 A 90 90 LEU CB C 128 35.875 42.028 -6.153 1
1 1033 . 3 1 1 A 90 90 LEU N N 128 126.728 126.069 0.659 1
1 1034 . 3 1 1 A 91 91 GLY H H 129 8.356 8.509 -0.153 1
1 1035 . 3 1 1 A 91 91 GLY HA2 H 129 3.373 3.647 -0.274 1
1 1036 . 3 1 1 A 91 91 GLY HA3 H 129 3.373 3.844 -0.471 1
1 1037 . 3 1 1 A 91 91 GLY C C 129 172.013 174.413 -2.400 1
1 1038 . 3 1 1 A 91 91 GLY CA C 129 41.500 44.294 -2.794 1
1 1039 . 3 1 1 A 91 91 GLY N N 129 108.559 109.285 -0.726 1
1 1040 . 3 1 1 A 92 92 ALA H H 130 7.047 8.097 -1.050 1
1 1041 . 3 1 1 A 92 92 ALA HA H 130 4.037 3.368 0.669 1
1 1045 . 3 1 1 A 92 92 ALA C C 130 174.890 177.357 -2.467 1
1 1046 . 3 1 1 A 92 92 ALA CA C 130 52.100 52.889 -0.789 1
1 1047 . 3 1 1 A 92 92 ALA CB C 130 16.502 17.655 -1.153 1
1 1048 . 3 1 1 A 92 92 ALA N N 130 118.393 122.141 -3.748 1
1 1049 . 3 1 1 A 93 93 ASP H H 131 7.222 7.652 -0.430 1
1 1050 . 3 1 1 A 93 93 ASP HA H 131 4.122 4.681 -0.559 1
1 1053 . 3 1 1 A 93 93 ASP C C 131 174.890 176.249 -1.359 1
1 1054 . 3 1 1 A 93 93 ASP CA C 131 50.249 53.935 -3.686 1
1 1055 . 3 1 1 A 93 93 ASP CB C 131 37.750 41.398 -3.648 1
1 1056 . 3 1 1 A 93 93 ASP N N 131 111.487 117.421 -5.934 1
1 1057 . 3 1 1 A 94 94 GLY H H 132 7.199 9.724 -2.525 1
1 1058 . 3 1 1 A 94 94 GLY HA2 H 132 3.951 3.834 0.117 1
1 1059 . 3 1 1 A 94 94 GLY HA3 H 132 3.324 3.838 -0.514 1
1 1060 . 3 1 1 A 94 94 GLY C C 132 169.773 173.546 -3.773 1
1 1061 . 3 1 1 A 94 94 GLY CA C 132 44.625 45.652 -1.027 1
1 1062 . 3 1 1 A 94 94 GLY N N 132 106.932 108.076 -1.144 1
1 1063 . 3 1 1 A 95 95 LYS H H 133 7.215 7.636 -0.421 1
1 1064 . 3 1 1 A 95 95 LYS HA H 133 4.513 4.882 -0.369 1
1 1073 . 3 1 1 A 95 95 LYS C C 133 172.108 174.725 -2.617 1
1 1074 . 3 1 1 A 95 95 LYS CA C 133 51.512 54.650 -3.138 1
1 1075 . 3 1 1 A 95 95 LYS CB C 133 34.000 36.116 -2.116 1
1 1076 . 3 1 1 A 95 95 LYS N N 133 115.749 120.825 -5.076 1
1 1077 . 3 1 1 A 96 96 GLU H H 134 9.230 8.442 0.788 1
1 1078 . 3 1 1 A 96 96 GLU HA H 134 4.352 5.304 -0.952 1
1 1083 . 3 1 1 A 96 96 GLU C C 134 175.219 177.007 -1.788 1
1 1084 . 3 1 1 A 96 96 GLU CA C 134 55.874 56.486 -0.612 1
1 1085 . 3 1 1 A 96 96 GLU CB C 134 27.126 30.061 -2.935 1
1 1087 . 3 1 1 A 96 96 GLU N N 134 128.571 124.883 3.688 1
1 1088 . 3 1 1 A 97 97 GLY H H 135 10.677 8.037 2.640 1
1 1089 . 3 1 1 A 97 97 GLY HA2 H 135 4.037 4.322 -0.285 1
1 1090 . 3 1 1 A 97 97 GLY HA3 H 135 3.717 4.337 -0.620 1
1 1091 . 3 1 1 A 97 97 GLY C C 135 171.567 173.009 -1.442 1
1 1092 . 3 1 1 A 97 97 GLY CA C 135 41.500 45.141 -3.641 1
1 1093 . 3 1 1 A 97 97 GLY N N 135 117.011 111.808 5.203 1
1 1094 . 3 1 1 A 98 98 GLY H H 136 8.442 8.366 0.076 1
1 1095 . 3 1 1 A 98 98 GLY HA2 H 136 4.195 4.294 -0.099 1
1 1096 . 3 1 1 A 98 98 GLY HA3 H 136 4.195 4.303 -0.108 1
1 1097 . 3 1 1 A 98 98 GLY C C 136 170.299 172.379 -2.080 1
1 1098 . 3 1 1 A 98 98 GLY CA C 136 40.875 44.685 -3.810 1
1 1099 . 3 1 1 A 98 98 GLY N N 136 109.494 109.712 -0.218 1
1 1100 . 3 1 1 A 99 99 SER H H 137 8.701 8.775 -0.074 1
1 1101 . 3 1 1 A 99 99 SER HA H 137 4.639 4.902 -0.263 1
1 1104 . 3 1 1 A 99 99 SER C C 137 170.630 173.342 -2.712 1
1 1105 . 3 1 1 A 99 99 SER CA C 137 54.624 57.338 -2.714 1
1 1106 . 3 1 1 A 99 99 SER CB C 137 62.748 66.483 -3.735 1
1 1107 . 3 1 1 A 99 99 SER N N 137 114.685 118.006 -3.321 1
1 1108 . 3 1 1 A 100 100 ASP H H 138 9.117 8.866 0.251 1
1 1109 . 3 1 1 A 100 100 ASP HA H 138 3.965 4.389 -0.424 1
1 1112 . 3 1 1 A 100 100 ASP C C 138 175.540 177.320 -1.780 1
1 1113 . 3 1 1 A 100 100 ASP CA C 138 54.624 58.226 -3.602 1
1 1114 . 3 1 1 A 100 100 ASP CB C 138 36.500 40.610 -4.110 1
1 1115 . 3 1 1 A 100 100 ASP N N 138 120.777 122.582 -1.805 1
1 1116 . 3 1 1 A 101 101 ASN H H 139 8.667 8.193 0.474 1
1 1117 . 3 1 1 A 101 101 ASN HA H 139 4.333 4.781 -0.448 1
1 1122 . 3 1 1 A 101 101 ASN CA C 139 53.999 53.142 0.857 1
1 1123 . 3 1 1 A 101 101 ASN CB C 139 34.625 39.035 -4.410 1
1 1124 . 3 1 1 A 101 101 ASN N N 139 121.930 114.653 7.277 1
1 1126 . 3 1 1 A 102 102 ASP H H 140 7.714 7.877 -0.163 1
1 1127 . 3 1 1 A 102 102 ASP HA H 140 4.037 4.469 -0.432 1
1 1130 . 3 1 1 A 102 102 ASP C C 140 172.807 175.948 -3.141 1
1 1131 . 3 1 1 A 102 102 ASP CA C 140 53.374 54.092 -0.718 1
1 1132 . 3 1 1 A 102 102 ASP CB C 140 37.125 41.384 -4.259 1
1 1133 . 3 1 1 A 102 102 ASP N N 140 118.011 118.303 -0.292 1
1 1134 . 3 1 1 A 103 103 ALA H H 141 7.060 7.275 -0.215 1
1 1135 . 3 1 1 A 103 103 ALA HA H 141 3.353 4.814 -1.461 1
1 1139 . 3 1 1 A 103 103 ALA C C 141 172.233 176.954 -4.721 1
1 1140 . 3 1 1 A 103 103 ALA CA C 141 49.624 51.642 -2.018 1
1 1141 . 3 1 1 A 103 103 ALA CB C 141 16.502 20.300 -3.798 1
1 1142 . 3 1 1 A 103 103 ALA N N 141 125.777 123.007 2.770 1
1 1143 . 3 1 1 A 104 104 ASP H H 142 7.973 8.171 -0.198 1
1 1144 . 3 1 1 A 104 104 ASP HA H 142 4.420 5.071 -0.651 1
1 1147 . 3 1 1 A 104 104 ASP C C 142 174.188 176.166 -1.978 1
1 1148 . 3 1 1 A 104 104 ASP CA C 142 52.124 54.225 -2.101 1
1 1149 . 3 1 1 A 104 104 ASP CB C 142 37.125 41.384 -4.259 1
1 1150 . 3 1 1 A 104 104 ASP N N 142 122.965 120.259 2.706 1
1 1151 . 3 1 1 A 105 105 ILE H H 143 8.534 8.588 -0.054 1
1 1152 . 3 1 1 A 105 105 ILE HA H 143 4.060 4.893 -0.833 1
1 1162 . 3 1 1 A 105 105 ILE C C 143 173.235 176.036 -2.801 1
1 1163 . 3 1 1 A 105 105 ILE CA C 143 58.374 60.030 -1.656 1
1 1164 . 3 1 1 A 105 105 ILE CB C 143 39.123 39.449 -0.326 1
1 1167 . 3 1 1 A 105 105 ILE N N 143 124.757 121.117 3.640 1
1 1168 . 3 1 1 A 106 106 GLY H H 144 8.288 8.349 -0.061 1
1 1169 . 3 1 1 A 106 106 GLY HA2 H 144 4.764 4.466 0.298 1
1 1170 . 3 1 1 A 106 106 GLY HA3 H 144 4.764 4.531 0.233 1
1 1171 . 3 1 1 A 106 106 GLY C C 144 171.321 171.744 -0.423 1
1 1172 . 3 1 1 A 106 106 GLY CA C 144 40.250 45.740 -5.490 1
1 1173 . 3 1 1 A 106 106 GLY N N 144 110.895 111.379 -0.484 1
1 1174 . 3 1 1 A 107 107 ASN H H 145 8.577 9.072 -0.495 1
1 1175 . 3 1 1 A 107 107 ASN HA H 145 4.268 5.014 -0.746 1
1 1180 . 3 1 1 A 107 107 ASN C C 145 171.757 173.678 -1.921 1
1 1181 . 3 1 1 A 107 107 ASN CA C 145 52.124 51.841 0.283 1
1 1182 . 3 1 1 A 107 107 ASN CB C 145 34.625 42.072 -7.447 1
1 1183 . 3 1 1 A 107 107 ASN N N 145 118.042 115.951 2.091 1
1 1185 . 3 1 1 A 108 108 TRP H H 146 6.822 8.436 -1.614 1
1 1186 . 3 1 1 A 108 108 TRP HA H 146 4.513 4.930 -0.417 1
1 1195 . 3 1 1 A 108 108 TRP C C 146 172.665 171.931 0.734 1
1 1196 . 3 1 1 A 108 108 TRP CA C 146 54.624 55.633 -1.009 1
1 1197 . 3 1 1 A 108 108 TRP CB C 146 25.876 30.790 -4.914 1
1 1198 . 3 1 1 A 108 108 TRP N N 146 116.756 117.521 -0.765 1
1 1200 . 3 1 1 A 109 109 ASP H H 147 7.344 7.452 -0.108 1
1 1201 . 3 1 1 A 109 109 ASP HA H 147 4.655 5.287 -0.632 1
1 1204 . 3 1 1 A 109 109 ASP C C 147 172.193 174.932 -2.739 1
1 1205 . 3 1 1 A 109 109 ASP CA C 147 51.499 52.477 -0.978 1
1 1206 . 3 1 1 A 109 109 ASP CB C 147 39.000 44.008 -5.008 1
1 1207 . 3 1 1 A 109 109 ASP N N 147 121.461 120.616 0.845 1
1 11 . 4 1 1 A 2 2 SER H H 40 8.461 8.873 -0.412 1
1 12 . 4 1 1 A 2 2 SER HA H 40 4.286 5.232 -0.946 1
1 15 . 4 1 1 A 2 2 SER C C 40 171.276 173.676 -2.400 1
1 16 . 4 1 1 A 2 2 SER CA C 40 55.249 56.760 -1.511 1
1 17 . 4 1 1 A 2 2 SER CB C 40 61.498 64.053 -2.555 1
1 18 . 4 1 1 A 2 2 SER N N 40 118.344 121.593 -3.249 1
1 19 . 4 1 1 A 3 3 ARG H H 41 8.469 8.343 0.126 1
1 20 . 4 1 1 A 3 3 ARG HA H 41 4.400 4.871 -0.471 1
1 25 . 4 1 1 A 3 3 ARG C C 41 172.251 173.362 -1.111 1
1 26 . 4 1 1 A 3 3 ARG CA C 41 52.749 53.040 -0.291 1
1 27 . 4 1 1 A 3 3 ARG CB C 41 27.126 33.670 -6.544 1
1 28 . 4 1 1 A 3 3 ARG N N 41 123.070 125.122 -2.052 1
1 33 . 4 1 1 A 4 4 PRO CA C 42 61.498 63.830 -2.332 1
1 34 . 4 1 1 A 4 4 PRO CB C 42 29.001 31.727 -2.726 1
1 37 . 4 1 1 A 5 5 ASP H H 43 8.246 8.916 -0.670 1
1 38 . 4 1 1 A 5 5 ASP HA H 43 4.329 4.378 -0.049 1
1 41 . 4 1 1 A 5 5 ASP C C 43 174.605 177.025 -2.420 1
1 42 . 4 1 1 A 5 5 ASP CA C 43 53.374 56.590 -3.216 1
1 43 . 4 1 1 A 5 5 ASP CB C 43 38.375 38.535 -0.160 1
1 44 . 4 1 1 A 5 5 ASP N N 43 119.409 116.747 2.662 1
1 45 . 4 1 1 A 6 6 GLN H H 44 8.309 8.628 -0.319 1
1 46 . 4 1 1 A 6 6 GLN HA H 44 4.393 4.202 0.191 1
1 53 . 4 1 1 A 6 6 GLN C C 44 175.053 178.373 -3.320 1
1 54 . 4 1 1 A 6 6 GLN CA C 44 55.874 58.256 -2.382 1
1 55 . 4 1 1 A 6 6 GLN CB C 44 25.876 28.224 -2.348 1
1 57 . 4 1 1 A 6 6 GLN N N 44 122.273 117.939 4.334 1
1 59 . 4 1 1 A 7 7 ALA H H 45 8.106 8.233 -0.127 1
1 60 . 4 1 1 A 7 7 ALA HA H 45 3.993 4.048 -0.055 1
1 64 . 4 1 1 A 7 7 ALA C C 45 177.465 178.206 -0.741 1
1 65 . 4 1 1 A 7 7 ALA CA C 45 52.124 54.664 -2.540 1
1 66 . 4 1 1 A 7 7 ALA CB C 45 15.252 18.243 -2.991 1
1 67 . 4 1 1 A 7 7 ALA N N 45 122.204 121.998 0.206 1
1 68 . 4 1 1 A 8 8 LYS H H 46 7.527 7.633 -0.106 1
1 69 . 4 1 1 A 8 8 LYS HA H 46 3.539 4.166 -0.627 1
1 78 . 4 1 1 A 8 8 LYS C C 46 175.412 179.127 -3.715 1
1 79 . 4 1 1 A 8 8 LYS CA C 46 57.124 58.079 -0.955 1
1 80 . 4 1 1 A 8 8 LYS CB C 46 30.876 32.220 -1.344 1
1 83 . 4 1 1 A 8 8 LYS N N 46 117.358 116.695 0.663 1
1 84 . 4 1 1 A 9 9 VAL H H 47 7.709 7.680 0.029 1
1 85 . 4 1 1 A 9 9 VAL HA H 47 3.578 3.871 -0.293 1
1 93 . 4 1 1 A 9 9 VAL C C 47 175.005 178.288 -3.283 1
1 94 . 4 1 1 A 9 9 VAL CA C 47 64.623 66.193 -1.570 1
1 95 . 4 1 1 A 9 9 VAL CB C 47 29.001 31.897 -2.896 1
1 98 . 4 1 1 A 9 9 VAL N N 47 119.115 120.378 -1.263 1
1 99 . 4 1 1 A 10 10 THR H H 48 7.767 8.272 -0.505 1
1 100 . 4 1 1 A 10 10 THR HA H 48 3.668 4.052 -0.384 1
1 105 . 4 1 1 A 10 10 THR CA C 48 63.998 65.331 -1.333 1
1 106 . 4 1 1 A 10 10 THR CB C 48 67.123 68.865 -1.742 1
1 108 . 4 1 1 A 10 10 THR N N 48 115.112 113.923 1.189 1
1 109 . 4 1 1 A 11 11 VAL H H 49 7.598 7.809 -0.211 1
1 110 . 4 1 1 A 11 11 VAL HA H 49 3.457 3.853 -0.396 1
1 118 . 4 1 1 A 11 11 VAL C C 49 175.412 178.025 -2.613 1
1 119 . 4 1 1 A 11 11 VAL CA C 49 63.998 64.728 -0.730 1
1 120 . 4 1 1 A 11 11 VAL CB C 49 29.001 31.651 -2.650 1
1 123 . 4 1 1 A 11 11 VAL N N 49 123.694 117.930 5.764 1
1 124 . 4 1 1 A 12 12 ALA H H 50 8.176 8.026 0.150 1
1 125 . 4 1 1 A 12 12 ALA HA H 50 4.742 3.963 0.779 1
1 129 . 4 1 1 A 12 12 ALA C C 50 177.074 179.824 -2.750 1
1 130 . 4 1 1 A 12 12 ALA CA C 50 52.124 55.213 -3.089 1
1 131 . 4 1 1 A 12 12 ALA CB C 50 15.252 18.388 -3.136 1
1 132 . 4 1 1 A 12 12 ALA N N 50 122.348 124.421 -2.073 1
1 133 . 4 1 1 A 13 13 LYS H H 51 8.499 7.965 0.534 1
1 134 . 4 1 1 A 13 13 LYS HA H 51 3.648 4.104 -0.456 1
1 143 . 4 1 1 A 13 13 LYS C C 51 177.252 179.846 -2.594 1
1 144 . 4 1 1 A 13 13 LYS CA C 51 58.072 59.522 -1.450 1
1 145 . 4 1 1 A 13 13 LYS CB C 51 30.251 32.253 -2.002 1
1 146 . 4 1 1 A 13 13 LYS N N 51 115.402 116.879 -1.477 1
1 147 . 4 1 1 A 14 14 GLY H H 52 7.858 8.341 -0.483 1
1 148 . 4 1 1 A 14 14 GLY HA2 H 52 3.823 3.850 -0.027 1
1 149 . 4 1 1 A 14 14 GLY HA3 H 52 3.676 3.856 -0.180 1
1 150 . 4 1 1 A 14 14 GLY C C 52 174.090 175.515 -1.425 1
1 151 . 4 1 1 A 14 14 GLY CA C 52 44.625 46.893 -2.268 1
1 152 . 4 1 1 A 14 14 GLY N N 52 107.466 108.928 -1.462 1
1 153 . 4 1 1 A 15 15 ASP H H 53 8.403 7.797 0.606 1
1 154 . 4 1 1 A 15 15 ASP HA H 53 4.191 4.376 -0.185 1
1 157 . 4 1 1 A 15 15 ASP C C 53 175.316 179.041 -3.725 1
1 158 . 4 1 1 A 15 15 ASP CA C 53 54.624 56.586 -1.962 1
1 159 . 4 1 1 A 15 15 ASP CB C 53 35.875 40.822 -4.947 1
1 160 . 4 1 1 A 15 15 ASP N N 53 125.929 121.740 4.189 1
1 161 . 4 1 1 A 16 16 ILE H H 54 8.245 8.098 0.147 1
1 162 . 4 1 1 A 16 16 ILE HA H 54 3.034 3.767 -0.733 1
1 172 . 4 1 1 A 16 16 ILE C C 54 174.499 178.204 -3.705 1
1 173 . 4 1 1 A 16 16 ILE CA C 54 62.748 64.001 -1.253 1
1 174 . 4 1 1 A 16 16 ILE CB C 54 34.625 37.346 -2.721 1
1 178 . 4 1 1 A 16 16 ILE N N 54 119.456 116.752 2.704 1
1 179 . 4 1 1 A 17 17 LYS H H 55 7.547 8.011 -0.464 1
1 180 . 4 1 1 A 17 17 LYS HA H 55 3.843 4.178 -0.335 1
1 187 . 4 1 1 A 17 17 LYS C C 55 176.651 179.409 -2.758 1
1 188 . 4 1 1 A 17 17 LYS CA C 55 57.124 59.213 -2.089 1
1 189 . 4 1 1 A 17 17 LYS CB C 55 30.251 32.124 -1.873 1
1 190 . 4 1 1 A 17 17 LYS N N 55 118.505 121.278 -2.773 1
1 191 . 4 1 1 A 18 18 ALA H H 56 7.680 7.885 -0.205 1
1 192 . 4 1 1 A 18 18 ALA HA H 56 4.029 4.037 -0.008 1
1 196 . 4 1 1 A 18 18 ALA C C 56 176.638 180.349 -3.711 1
1 197 . 4 1 1 A 18 18 ALA CA C 56 52.749 55.005 -2.256 1
1 198 . 4 1 1 A 18 18 ALA CB C 56 15.877 18.282 -2.405 1
1 199 . 4 1 1 A 18 18 ALA N N 56 122.477 121.711 0.766 1
1 200 . 4 1 1 A 19 19 ILE H H 57 8.853 7.529 1.324 1
1 201 . 4 1 1 A 19 19 ILE HA H 57 3.304 3.563 -0.259 1
1 211 . 4 1 1 A 19 19 ILE C C 57 174.710 177.776 -3.066 1
1 212 . 4 1 1 A 19 19 ILE CA C 57 63.373 65.135 -1.762 1
1 213 . 4 1 1 A 19 19 ILE CB C 57 35.250 37.364 -2.114 1
1 217 . 4 1 1 A 19 19 ILE N N 57 120.901 118.922 1.979 1
1 218 . 4 1 1 A 20 20 ALA H H 58 8.702 8.156 0.546 1
1 219 . 4 1 1 A 20 20 ALA HA H 58 3.900 3.732 0.168 1
1 223 . 4 1 1 A 20 20 ALA C C 58 176.512 180.258 -3.746 1
1 224 . 4 1 1 A 20 20 ALA CA C 58 52.749 55.489 -2.740 1
1 225 . 4 1 1 A 20 20 ALA CB C 58 15.252 17.853 -2.601 1
1 226 . 4 1 1 A 20 20 ALA N N 58 121.763 123.178 -1.415 1
1 227 . 4 1 1 A 21 21 ALA H H 59 7.662 7.492 0.170 1
1 228 . 4 1 1 A 21 21 ALA HA H 59 4.136 4.191 -0.055 1
1 232 . 4 1 1 A 21 21 ALA C C 59 177.949 179.836 -1.887 1
1 233 . 4 1 1 A 21 21 ALA CA C 59 52.749 54.923 -2.174 1
1 234 . 4 1 1 A 21 21 ALA CB C 59 15.252 18.333 -3.081 1
1 235 . 4 1 1 A 21 21 ALA N N 59 119.079 119.927 -0.848 1
1 236 . 4 1 1 A 22 22 ALA H H 60 7.403 7.626 -0.223 1
1 237 . 4 1 1 A 22 22 ALA HA H 60 4.318 4.151 0.167 1
1 241 . 4 1 1 A 22 22 ALA C C 60 176.730 180.407 -3.677 1
1 242 . 4 1 1 A 22 22 ALA CA C 60 52.749 54.620 -1.871 1
1 243 . 4 1 1 A 22 22 ALA CB C 60 17.126 18.490 -1.364 1
1 244 . 4 1 1 A 22 22 ALA N N 60 122.616 120.428 2.188 1
1 245 . 4 1 1 A 23 23 LEU H H 61 8.410 8.448 -0.038 1
1 246 . 4 1 1 A 23 23 LEU HA H 61 3.527 3.908 -0.381 1
1 256 . 4 1 1 A 23 23 LEU C C 61 176.057 178.573 -2.516 1
1 257 . 4 1 1 A 23 23 LEU CA C 61 55.249 57.297 -2.048 1
1 258 . 4 1 1 A 23 23 LEU CB C 61 39.000 40.792 -1.792 1
1 262 . 4 1 1 A 23 23 LEU N N 61 120.761 120.912 -0.151 1
1 263 . 4 1 1 A 24 24 ASP H H 62 8.227 8.099 0.128 1
1 264 . 4 1 1 A 24 24 ASP HA H 62 4.581 4.625 -0.044 1
1 267 . 4 1 1 A 24 24 ASP C C 62 176.968 177.655 -0.687 1
1 268 . 4 1 1 A 24 24 ASP CA C 62 55.874 56.566 -0.692 1
1 269 . 4 1 1 A 24 24 ASP CB C 62 37.750 40.619 -2.869 1
1 270 . 4 1 1 A 24 24 ASP N N 62 119.068 119.391 -0.323 1
1 271 . 4 1 1 A 25 25 MET H H 63 7.718 7.844 -0.126 1
1 272 . 4 1 1 A 25 25 MET HA H 63 4.196 4.305 -0.109 1
1 277 . 4 1 1 A 25 25 MET C C 63 174.968 177.823 -2.855 1
1 278 . 4 1 1 A 25 25 MET CA C 63 55.249 58.105 -2.856 1
1 279 . 4 1 1 A 25 25 MET CB C 63 29.626 32.496 -2.870 1
1 281 . 4 1 1 A 25 25 MET N N 63 121.365 118.534 2.831 1
1 282 . 4 1 1 A 26 26 TYR H H 64 8.401 7.541 0.860 1
1 283 . 4 1 1 A 26 26 TYR HA H 64 4.400 3.598 0.802 1
1 291 . 4 1 1 A 26 26 TYR C C 64 176.098 177.378 -1.280 1
1 292 . 4 1 1 A 26 26 TYR CA C 64 58.999 60.874 -1.875 1
1 293 . 4 1 1 A 26 26 TYR CB C 64 35.250 38.155 -2.905 1
1 294 . 4 1 1 A 26 26 TYR N N 64 122.575 121.940 0.635 1
1 295 . 4 1 1 A 27 27 LYS H H 65 8.330 8.156 0.174 1
1 296 . 4 1 1 A 27 27 LYS HA H 65 3.568 4.358 -0.790 1
1 302 . 4 1 1 A 27 27 LYS C C 65 176.156 178.329 -2.173 1
1 303 . 4 1 1 A 27 27 LYS CA C 65 56.499 59.280 -2.781 1
1 304 . 4 1 1 A 27 27 LYS CB C 65 29.626 32.082 -2.456 1
1 306 . 4 1 1 A 27 27 LYS N N 65 121.390 119.135 2.255 1
1 307 . 4 1 1 A 28 28 LEU H H 66 7.833 7.304 0.529 1
1 308 . 4 1 1 A 28 28 LEU HA H 66 3.769 4.068 -0.299 1
1 318 . 4 1 1 A 28 28 LEU C C 66 175.925 178.002 -2.077 1
1 319 . 4 1 1 A 28 28 LEU CA C 66 55.874 56.930 -1.056 1
1 320 . 4 1 1 A 28 28 LEU CB C 66 38.375 42.471 -4.096 1
1 324 . 4 1 1 A 28 28 LEU N N 66 123.068 120.473 2.595 1
1 325 . 4 1 1 A 29 29 ASP H H 67 7.292 7.689 -0.397 1
1 326 . 4 1 1 A 29 29 ASP HA H 67 4.096 4.351 -0.255 1
1 329 . 4 1 1 A 29 29 ASP C C 67 174.618 176.680 -2.062 1
1 330 . 4 1 1 A 29 29 ASP CA C 67 53.999 56.307 -2.308 1
1 331 . 4 1 1 A 29 29 ASP CB C 67 38.375 40.972 -2.597 1
1 332 . 4 1 1 A 29 29 ASP N N 67 114.729 118.306 -3.577 1
1 333 . 4 1 1 A 30 30 ASN H H 68 8.097 7.683 0.414 1
1 334 . 4 1 1 A 30 30 ASN HA H 68 4.337 4.363 -0.026 1
1 339 . 4 1 1 A 30 30 ASN C C 68 172.822 174.184 -1.362 1
1 340 . 4 1 1 A 30 30 ASN CA C 68 52.124 51.904 0.220 1
1 341 . 4 1 1 A 30 30 ASN CB C 68 37.750 38.147 -0.397 1
1 342 . 4 1 1 A 30 30 ASN N N 68 111.054 115.061 -4.007 1
1 344 . 4 1 1 A 31 31 PHE H H 69 8.249 7.928 0.321 1
1 345 . 4 1 1 A 31 31 PHE HA H 69 4.135 4.366 -0.231 1
1 353 . 4 1 1 A 31 31 PHE C C 69 170.485 174.232 -3.747 1
1 354 . 4 1 1 A 31 31 PHE CA C 69 57.749 58.721 -0.972 1
1 355 . 4 1 1 A 31 31 PHE CB C 69 33.375 36.557 -3.182 1
1 356 . 4 1 1 A 31 31 PHE N N 69 116.277 117.233 -0.956 1
1 357 . 4 1 1 A 32 32 ALA H H 70 7.224 7.135 0.089 1
1 358 . 4 1 1 A 32 32 ALA HA H 70 4.194 4.488 -0.294 1
1 362 . 4 1 1 A 32 32 ALA C C 70 173.337 175.063 -1.726 1
1 363 . 4 1 1 A 32 32 ALA CA C 70 48.374 51.521 -3.147 1
1 364 . 4 1 1 A 32 32 ALA CB C 70 19.626 22.313 -2.687 1
1 365 . 4 1 1 A 32 32 ALA N N 70 119.914 120.316 -0.402 1
1 366 . 4 1 1 A 33 33 TYR H H 71 7.948 8.357 -0.409 1
1 367 . 4 1 1 A 33 33 TYR HA H 71 4.209 4.962 -0.753 1
1 374 . 4 1 1 A 33 33 TYR C C 71 170.591 174.206 -3.615 1
1 375 . 4 1 1 A 33 33 TYR CA C 71 54.624 56.505 -1.881 1
1 376 . 4 1 1 A 33 33 TYR CB C 71 34.000 37.580 -3.580 1
1 377 . 4 1 1 A 33 33 TYR N N 71 116.929 118.179 -1.250 1
1 378 . 4 1 1 A 34 34 PRO HA H 72 4.444 4.724 -0.280 1
1 381 . 4 1 1 A 34 34 PRO C C 72 174.775 176.355 -1.580 1
1 382 . 4 1 1 A 34 34 PRO CA C 72 59.624 62.435 -2.811 1
1 383 . 4 1 1 A 34 34 PRO CB C 72 28.376 32.451 -4.075 1
1 384 . 4 1 1 A 35 35 SER H H 73 8.721 8.415 0.306 1
1 385 . 4 1 1 A 35 35 SER HA H 73 4.467 4.746 -0.279 1
1 388 . 4 1 1 A 35 35 SER C C 73 173.271 175.469 -2.198 1
1 389 . 4 1 1 A 35 35 SER CA C 73 55.249 56.682 -1.433 1
1 390 . 4 1 1 A 35 35 SER CB C 73 63.373 65.829 -2.456 1
1 391 . 4 1 1 A 35 35 SER N N 73 118.284 114.604 3.680 1
1 392 . 4 1 1 A 36 36 THR H H 74 8.591 8.885 -0.294 1
1 393 . 4 1 1 A 36 36 THR HA H 74 3.649 4.258 -0.609 1
1 398 . 4 1 1 A 36 36 THR CA C 74 64.623 63.698 0.925 1
1 399 . 4 1 1 A 36 36 THR CB C 74 66.498 68.962 -2.464 1
1 401 . 4 1 1 A 36 36 THR N N 74 117.769 117.743 0.026 1
1 402 . 4 1 1 A 37 37 GLN H H 75 8.210 8.099 0.111 1
1 403 . 4 1 1 A 37 37 GLN HA H 75 3.860 4.360 -0.500 1
1 410 . 4 1 1 A 37 37 GLN C C 75 175.349 178.200 -2.851 1
1 411 . 4 1 1 A 37 37 GLN CA C 75 56.499 57.492 -0.993 1
1 412 . 4 1 1 A 37 37 GLN CB C 75 25.876 29.912 -4.036 1
1 414 . 4 1 1 A 37 37 GLN N N 75 117.931 121.582 -3.651 1
1 416 . 4 1 1 A 38 38 GLN H H 76 7.667 8.250 -0.583 1
1 417 . 4 1 1 A 38 38 GLN HA H 76 3.810 4.117 -0.307 1
1 424 . 4 1 1 A 38 38 GLN C C 76 175.805 179.362 -3.557 1
1 425 . 4 1 1 A 38 38 GLN CA C 76 55.874 58.454 -2.580 1
1 426 . 4 1 1 A 38 38 GLN CB C 76 25.876 28.300 -2.424 1
1 428 . 4 1 1 A 38 38 GLN N N 76 120.607 117.792 2.815 1
1 430 . 4 1 1 A 39 39 GLY H H 77 8.470 8.232 0.238 1
1 431 . 4 1 1 A 39 39 GLY HA2 H 77 3.920 3.718 0.202 1
1 432 . 4 1 1 A 39 39 GLY HA3 H 77 3.603 3.749 -0.146 1
1 433 . 4 1 1 A 39 39 GLY C C 77 169.006 175.374 -6.368 1
1 434 . 4 1 1 A 39 39 GLY CA C 77 42.125 46.489 -4.364 1
1 435 . 4 1 1 A 39 39 GLY N N 77 103.281 109.552 -6.271 1
1 436 . 4 1 1 A 40 40 LEU H H 78 8.135 7.753 0.382 1
1 437 . 4 1 1 A 40 40 LEU HA H 78 3.237 4.091 -0.854 1
1 447 . 4 1 1 A 40 40 LEU C C 78 176.383 178.384 -2.001 1
1 448 . 4 1 1 A 40 40 LEU CA C 78 52.749 57.206 -4.457 1
1 449 . 4 1 1 A 40 40 LEU CB C 78 39.000 41.663 -2.663 1
1 453 . 4 1 1 A 40 40 LEU N N 78 114.444 123.255 -8.811 1
1 454 . 4 1 1 A 41 41 GLU H H 79 8.578 8.242 0.336 1
1 455 . 4 1 1 A 41 41 GLU HA H 79 3.720 4.059 -0.339 1
1 460 . 4 1 1 A 41 41 GLU C C 79 175.093 177.810 -2.717 1
1 461 . 4 1 1 A 41 41 GLU CA C 79 57.124 58.718 -1.594 1
1 462 . 4 1 1 A 41 41 GLU CB C 79 26.501 28.651 -2.150 1
1 464 . 4 1 1 A 41 41 GLU N N 79 118.295 117.165 1.130 1
1 465 . 4 1 1 A 42 42 ALA H H 80 7.227 7.596 -0.369 1
1 466 . 4 1 1 A 42 42 ALA HA H 80 4.437 4.745 -0.308 1
1 470 . 4 1 1 A 42 42 ALA C C 80 173.745 178.073 -4.328 1
1 471 . 4 1 1 A 42 42 ALA CA C 80 51.499 53.908 -2.409 1
1 472 . 4 1 1 A 42 42 ALA CB C 80 15.877 18.530 -2.653 1
1 473 . 4 1 1 A 42 42 ALA N N 80 119.751 121.704 -1.953 1
1 474 . 4 1 1 A 43 43 LEU H H 81 7.932 7.507 0.425 1
1 475 . 4 1 1 A 43 43 LEU HA H 81 4.369 4.302 0.067 1
1 485 . 4 1 1 A 43 43 LEU C C 81 174.788 177.960 -3.172 1
1 486 . 4 1 1 A 43 43 LEU CA C 81 53.374 55.474 -2.100 1
1 487 . 4 1 1 A 43 43 LEU CB C 81 39.625 42.197 -2.572 1
1 491 . 4 1 1 A 43 43 LEU N N 81 111.742 115.971 -4.229 1
1 492 . 4 1 1 A 44 44 VAL H H 82 7.886 7.251 0.635 1
1 493 . 4 1 1 A 44 44 VAL HA H 82 4.700 4.027 0.673 1
1 501 . 4 1 1 A 44 44 VAL C C 82 172.875 175.944 -3.069 1
1 502 . 4 1 1 A 44 44 VAL CA C 82 59.624 63.783 -4.159 1
1 503 . 4 1 1 A 44 44 VAL CB C 82 31.501 33.257 -1.756 1
1 506 . 4 1 1 A 44 44 VAL N N 82 113.604 115.460 -1.856 1
1 507 . 4 1 1 A 45 45 LYS H H 83 8.361 8.389 -0.028 1
1 508 . 4 1 1 A 45 45 LYS HA H 83 4.251 4.971 -0.720 1
1 515 . 4 1 1 A 45 45 LYS C C 83 171.053 175.064 -4.011 1
1 516 . 4 1 1 A 45 45 LYS CA C 83 52.749 54.347 -1.598 1
1 517 . 4 1 1 A 45 45 LYS CB C 83 33.375 35.835 -2.460 1
1 521 . 4 1 1 A 45 45 LYS N N 83 123.860 120.868 2.992 1
1 522 . 4 1 1 A 46 46 LYS H H 84 7.243 7.941 -0.698 1
1 523 . 4 1 1 A 46 46 LYS HA H 84 2.175 3.236 -1.061 1
1 532 . 4 1 1 A 46 46 LYS C C 84 172.123 174.642 -2.519 1
1 533 . 4 1 1 A 46 46 LYS CA C 84 52.749 54.425 -1.676 1
1 534 . 4 1 1 A 46 46 LYS CB C 84 29.626 31.769 -2.143 1
1 537 . 4 1 1 A 46 46 LYS N N 84 128.615 124.359 4.256 1
1 538 . 4 1 1 A 47 47 PRO HA H 85 4.470 4.476 -0.006 1
1 541 . 4 1 1 A 47 47 PRO C C 85 173.754 176.437 -2.683 1
1 542 . 4 1 1 A 47 47 PRO CA C 85 60.874 63.135 -2.261 1
1 543 . 4 1 1 A 47 47 PRO CB C 85 30.876 32.232 -1.356 1
1 546 . 4 1 1 A 48 48 THR H H 86 8.306 8.283 0.023 1
1 547 . 4 1 1 A 48 48 THR HA H 86 4.287 4.708 -0.421 1
1 552 . 4 1 1 A 48 48 THR C C 86 173.070 174.125 -1.055 1
1 553 . 4 1 1 A 48 48 THR CA C 86 57.749 61.008 -3.259 1
1 554 . 4 1 1 A 48 48 THR CB C 86 67.748 69.722 -1.974 1
1 556 . 4 1 1 A 48 48 THR N N 86 109.564 112.653 -3.089 1
1 557 . 4 1 1 A 49 49 GLY H H 87 8.317 8.324 -0.007 1
1 558 . 4 1 1 A 49 49 GLY HA2 H 87 3.851 4.192 -0.341 1
1 559 . 4 1 1 A 49 49 GLY HA3 H 87 3.678 4.202 -0.524 1
1 560 . 4 1 1 A 49 49 GLY C C 87 169.693 172.132 -2.439 1
1 561 . 4 1 1 A 49 49 GLY CA C 87 42.125 45.478 -3.353 1
1 562 . 4 1 1 A 49 49 GLY N N 87 109.071 109.941 -0.870 1
1 563 . 4 1 1 A 50 50 ASN H H 88 8.301 8.411 -0.110 1
1 564 . 4 1 1 A 50 50 ASN HA H 88 4.780 5.441 -0.661 1
1 569 . 4 1 1 A 50 50 ASN C C 88 171.370 172.882 -1.512 1
1 570 . 4 1 1 A 50 50 ASN CA C 88 47.749 50.421 -2.672 1
1 571 . 4 1 1 A 50 50 ASN CB C 88 37.125 39.427 -2.302 1
1 572 . 4 1 1 A 50 50 ASN N N 88 115.631 120.635 -5.004 1
1 574 . 4 1 1 A 51 51 PRO HA H 89 4.782 4.648 0.134 1
1 577 . 4 1 1 A 51 51 PRO C C 89 173.656 175.939 -2.283 1
1 578 . 4 1 1 A 51 51 PRO CA C 89 59.624 62.046 -2.422 1
1 579 . 4 1 1 A 51 51 PRO CB C 89 31.501 32.364 -0.863 1
1 582 . 4 1 1 A 52 52 GLN H H 90 9.076 8.781 0.295 1
1 583 . 4 1 1 A 52 52 GLN HA H 90 4.469 4.830 -0.361 1
1 590 . 4 1 1 A 52 52 GLN C C 90 172.386 173.986 -1.600 1
1 591 . 4 1 1 A 52 52 GLN CA C 90 50.874 53.589 -2.715 1
1 592 . 4 1 1 A 52 52 GLN CB C 90 26.501 27.930 -1.429 1
1 594 . 4 1 1 A 52 52 GLN N N 90 126.827 119.828 6.999 1
1 596 . 4 1 1 A 53 53 PRO HA H 91 4.384 4.642 -0.258 1
1 599 . 4 1 1 A 53 53 PRO C C 91 174.274 175.259 -0.985 1
1 600 . 4 1 1 A 53 53 PRO CB C 91 28.113 31.396 -3.283 1
1 601 . 4 1 1 A 54 54 LYS H H 92 8.401 8.770 -0.369 1
1 602 . 4 1 1 A 54 54 LYS HA H 92 3.984 4.746 -0.762 1
1 611 . 4 1 1 A 54 54 LYS C C 92 173.516 174.874 -1.358 1
1 612 . 4 1 1 A 54 54 LYS CA C 92 55.249 55.336 -0.087 1
1 613 . 4 1 1 A 54 54 LYS CB C 92 30.876 36.097 -5.221 1
1 615 . 4 1 1 A 54 54 LYS N N 92 124.538 124.217 0.321 1
1 616 . 4 1 1 A 55 55 ASN H H 93 8.183 8.829 -0.646 1
1 617 . 4 1 1 A 55 55 ASN HA H 93 4.716 4.884 -0.168 1
1 622 . 4 1 1 A 55 55 ASN CA C 93 48.999 53.177 -4.178 1
1 623 . 4 1 1 A 55 55 ASN CB C 93 35.875 37.434 -1.559 1
1 624 . 4 1 1 A 55 55 ASN N N 93 118.677 122.370 -3.693 1
1 626 . 4 1 1 A 56 56 TRP H H 94 8.007 8.783 -0.776 1
1 627 . 4 1 1 A 56 56 TRP HA H 94 3.827 5.496 -1.669 1
1 635 . 4 1 1 A 56 56 TRP C C 94 173.760 175.346 -1.586 1
1 636 . 4 1 1 A 56 56 TRP CA C 94 59.624 58.812 0.812 1
1 637 . 4 1 1 A 56 56 TRP CB C 94 27.126 30.365 -3.239 1
1 638 . 4 1 1 A 56 56 TRP N N 94 122.195 127.580 -5.385 1
1 640 . 4 1 1 A 57 57 ASN H H 95 7.563 7.374 0.189 1
1 641 . 4 1 1 A 57 57 ASN HA H 95 3.735 4.928 -1.193 1
1 646 . 4 1 1 A 57 57 ASN C C 95 171.952 173.936 -1.984 1
1 647 . 4 1 1 A 57 57 ASN CA C 95 51.499 51.026 0.473 1
1 648 . 4 1 1 A 57 57 ASN CB C 95 35.250 41.128 -5.878 1
1 649 . 4 1 1 A 57 57 ASN N N 95 129.659 125.312 4.347 1
1 651 . 4 1 1 A 58 58 LYS H H 96 8.110 8.047 0.063 1
1 652 . 4 1 1 A 58 58 LYS HA H 96 4.035 4.176 -0.141 1
1 659 . 4 1 1 A 58 58 LYS C C 96 174.530 175.552 -1.022 1
1 660 . 4 1 1 A 58 58 LYS CA C 96 56.499 54.764 1.735 1
1 661 . 4 1 1 A 58 58 LYS CB C 96 29.626 32.844 -3.218 1
1 665 . 4 1 1 A 58 58 LYS N N 96 123.913 122.704 1.209 1
1 666 . 4 1 1 A 59 59 ASP H H 97 7.903 9.103 -1.200 1
1 667 . 4 1 1 A 59 59 ASP HA H 97 4.393 4.357 0.036 1
1 670 . 4 1 1 A 59 59 ASP C C 97 173.724 175.338 -1.614 1
1 671 . 4 1 1 A 59 59 ASP CA C 97 52.124 55.075 -2.951 1
1 672 . 4 1 1 A 59 59 ASP CB C 97 38.375 39.798 -1.423 1
1 673 . 4 1 1 A 59 59 ASP N N 97 118.773 119.651 -0.878 1
1 674 . 4 1 1 A 60 60 GLY H H 98 7.819 7.810 0.009 1
1 675 . 4 1 1 A 60 60 GLY HA2 H 98 3.917 3.583 0.334 1
1 676 . 4 1 1 A 60 60 GLY HA3 H 98 3.917 3.969 -0.052 1
1 677 . 4 1 1 A 60 60 GLY C C 98 168.652 174.334 -5.682 1
1 678 . 4 1 1 A 60 60 GLY CA C 98 41.500 44.963 -3.463 1
1 679 . 4 1 1 A 60 60 GLY N N 98 108.742 104.972 3.770 1
1 680 . 4 1 1 A 61 61 TYR H H 99 8.105 7.882 0.223 1
1 681 . 4 1 1 A 61 61 TYR HA H 99 3.927 4.007 -0.080 1
1 689 . 4 1 1 A 61 61 TYR C C 99 172.831 174.047 -1.216 1
1 690 . 4 1 1 A 61 61 TYR CA C 99 57.124 58.304 -1.180 1
1 691 . 4 1 1 A 61 61 TYR CB C 99 37.125 36.514 0.611 1
1 692 . 4 1 1 A 61 61 TYR N N 99 113.836 116.140 -2.304 1
1 693 . 4 1 1 A 62 62 LEU H H 100 7.352 8.032 -0.680 1
1 694 . 4 1 1 A 62 62 LEU HA H 100 4.343 4.955 -0.612 1
1 704 . 4 1 1 A 62 62 LEU C C 100 173.430 175.588 -2.158 1
1 705 . 4 1 1 A 62 62 LEU CA C 100 50.874 53.414 -2.540 1
1 706 . 4 1 1 A 62 62 LEU CB C 100 44.000 46.185 -2.185 1
1 710 . 4 1 1 A 62 62 LEU N N 100 117.112 123.325 -6.213 1
1 711 . 4 1 1 A 63 63 LYS H H 101 8.626 8.479 0.147 1
1 712 . 4 1 1 A 63 63 LYS HA H 101 3.986 4.361 -0.375 1
1 721 . 4 1 1 A 63 63 LYS C C 101 173.851 177.679 -3.828 1
1 722 . 4 1 1 A 63 63 LYS CA C 101 55.249 55.785 -0.536 1
1 723 . 4 1 1 A 63 63 LYS CB C 101 29.626 33.530 -3.904 1
1 724 . 4 1 1 A 63 63 LYS N N 101 129.991 123.293 6.698 1
1 725 . 4 1 1 A 64 64 LYS H H 102 7.059 8.737 -1.678 1
1 726 . 4 1 1 A 64 64 LYS HA H 102 4.138 4.150 -0.012 1
1 735 . 4 1 1 A 64 64 LYS C C 102 171.120 175.773 -4.653 1
1 736 . 4 1 1 A 64 64 LYS CA C 102 52.749 57.094 -4.345 1
1 737 . 4 1 1 A 64 64 LYS CB C 102 32.750 31.555 1.195 1
1 740 . 4 1 1 A 64 64 LYS N N 102 113.255 120.894 -7.639 1
1 741 . 4 1 1 A 65 65 LEU H H 103 8.883 7.636 1.247 1
1 742 . 4 1 1 A 65 65 LEU HA H 103 4.475 4.630 -0.155 1
1 752 . 4 1 1 A 65 65 LEU C C 103 171.487 174.857 -3.370 1
1 753 . 4 1 1 A 65 65 LEU CA C 103 48.999 51.834 -2.835 1
1 754 . 4 1 1 A 65 65 LEU CB C 103 39.625 43.125 -3.500 1
1 758 . 4 1 1 A 65 65 LEU N N 103 126.355 121.529 4.826 1
1 759 . 4 1 1 A 66 66 PRO HA H 104 4.449 4.593 -0.144 1
1 764 . 4 1 1 A 66 66 PRO C C 104 173.363 176.290 -2.927 1
1 765 . 4 1 1 A 66 66 PRO CA C 104 60.249 62.158 -1.909 1
1 766 . 4 1 1 A 66 66 PRO CB C 104 29.626 32.999 -3.373 1
1 769 . 4 1 1 A 67 67 VAL H H 105 7.682 8.349 -0.667 1
1 770 . 4 1 1 A 67 67 VAL HA H 105 4.121 4.399 -0.278 1
1 778 . 4 1 1 A 67 67 VAL C C 105 171.667 175.091 -3.424 1
1 779 . 4 1 1 A 67 67 VAL CA C 105 58.374 61.745 -3.371 1
1 780 . 4 1 1 A 67 67 VAL CB C 105 30.251 32.576 -2.325 1
1 783 . 4 1 1 A 67 67 VAL N N 105 114.671 121.094 -6.423 1
1 784 . 4 1 1 A 68 68 ASP H H 106 8.216 7.919 0.297 1
1 785 . 4 1 1 A 68 68 ASP HA H 106 4.474 4.563 -0.089 1
1 788 . 4 1 1 A 68 68 ASP C C 106 172.452 174.650 -2.198 1
1 789 . 4 1 1 A 68 68 ASP CA C 106 50.249 52.031 -1.782 1
1 790 . 4 1 1 A 68 68 ASP CB C 106 37.750 40.307 -2.557 1
1 791 . 4 1 1 A 68 68 ASP N N 106 123.825 125.446 -1.621 1
1 792 . 4 1 1 A 69 69 PRO HA H 107 3.920 3.962 -0.042 1
1 797 . 4 1 1 A 69 69 PRO CA C 107 62.123 63.175 -1.052 1
1 798 . 4 1 1 A 69 69 PRO CB C 107 27.751 31.363 -3.612 1
1 801 . 4 1 1 A 70 70 TRP H H 108 8.156 8.523 -0.367 1
1 802 . 4 1 1 A 70 70 TRP HA H 108 4.274 4.298 -0.024 1
1 811 . 4 1 1 A 70 70 TRP CA C 108 57.124 58.494 -1.370 1
1 812 . 4 1 1 A 70 70 TRP CB C 108 25.251 27.202 -1.951 1
1 813 . 4 1 1 A 70 70 TRP N N 108 118.137 117.490 0.647 1
1 815 . 4 1 1 A 71 71 GLY H H 109 8.209 8.707 -0.498 1
1 816 . 4 1 1 A 71 71 GLY HA2 H 109 4.030 3.847 0.183 1
1 817 . 4 1 1 A 71 71 GLY HA3 H 109 3.303 3.883 -0.580 1
1 818 . 4 1 1 A 71 71 GLY CA C 109 42.750 45.625 -2.875 1
1 819 . 4 1 1 A 71 71 GLY N N 109 107.495 105.463 2.032 1
1 820 . 4 1 1 A 72 72 ASN H H 110 8.116 7.542 0.574 1
1 821 . 4 1 1 A 72 72 ASN HA H 110 5.103 4.869 0.234 1
1 826 . 4 1 1 A 72 72 ASN CA C 110 48.374 51.156 -2.782 1
1 827 . 4 1 1 A 72 72 ASN CB C 110 36.500 38.852 -2.352 1
1 828 . 4 1 1 A 72 72 ASN N N 110 120.108 120.289 -0.181 1
1 830 . 4 1 1 A 73 73 PRO HA H 111 4.397 4.452 -0.055 1
1 835 . 4 1 1 A 73 73 PRO C C 111 176.229 175.911 0.318 1
1 836 . 4 1 1 A 73 73 PRO CA C 111 60.249 62.435 -2.186 1
1 837 . 4 1 1 A 73 73 PRO CB C 111 29.001 32.003 -3.002 1
1 840 . 4 1 1 A 74 74 TYR H H 112 8.893 8.554 0.339 1
1 841 . 4 1 1 A 74 74 TYR HA H 112 4.064 4.817 -0.753 1
1 849 . 4 1 1 A 74 74 TYR C C 112 171.951 175.848 -3.897 1
1 850 . 4 1 1 A 74 74 TYR CA C 112 60.249 58.299 1.950 1
1 851 . 4 1 1 A 74 74 TYR CB C 112 36.500 39.281 -2.781 1
1 852 . 4 1 1 A 74 74 TYR N N 112 124.595 120.156 4.439 1
1 853 . 4 1 1 A 75 75 GLN H H 113 9.127 8.970 0.157 1
1 854 . 4 1 1 A 75 75 GLN HA H 113 4.019 4.296 -0.277 1
1 861 . 4 1 1 A 75 75 GLN C C 113 171.436 174.164 -2.728 1
1 862 . 4 1 1 A 75 75 GLN CA C 113 50.874 54.676 -3.802 1
1 863 . 4 1 1 A 75 75 GLN CB C 113 29.469 29.121 0.348 1
1 865 . 4 1 1 A 75 75 GLN N N 113 120.777 121.988 -1.211 1
1 867 . 4 1 1 A 76 76 TYR H H 114 7.906 8.149 -0.243 1
1 868 . 4 1 1 A 76 76 TYR HA H 114 5.586 5.436 0.150 1
1 875 . 4 1 1 A 76 76 TYR C C 114 171.343 175.336 -3.993 1
1 876 . 4 1 1 A 76 76 TYR CA C 114 53.999 55.919 -1.920 1
1 877 . 4 1 1 A 76 76 TYR CB C 114 40.250 40.237 0.013 1
1 878 . 4 1 1 A 76 76 TYR N N 114 120.757 122.847 -2.090 1
1 879 . 4 1 1 A 77 77 LEU H H 115 8.261 8.752 -0.491 1
1 880 . 4 1 1 A 77 77 LEU HA H 115 4.280 5.105 -0.825 1
1 890 . 4 1 1 A 77 77 LEU C C 115 170.921 176.032 -5.111 1
1 891 . 4 1 1 A 77 77 LEU CA C 115 51.499 53.543 -2.044 1
1 892 . 4 1 1 A 77 77 LEU CB C 115 44.625 45.211 -0.586 1
1 896 . 4 1 1 A 77 77 LEU N N 115 130.662 126.377 4.285 1
1 897 . 4 1 1 A 78 78 ALA H H 116 7.973 8.272 -0.299 1
1 898 . 4 1 1 A 78 78 ALA HA H 116 4.292 4.596 -0.304 1
1 902 . 4 1 1 A 78 78 ALA C C 116 172.093 175.350 -3.257 1
1 903 . 4 1 1 A 78 78 ALA CA C 116 47.749 50.192 -2.443 1
1 904 . 4 1 1 A 78 78 ALA CB C 116 19.626 19.757 -0.131 1
1 905 . 4 1 1 A 78 78 ALA N N 116 125.564 126.682 -1.118 1
1 906 . 4 1 1 A 79 79 PRO HA H 117 4.698 5.074 -0.376 1
1 911 . 4 1 1 A 79 79 PRO C C 117 173.994 176.604 -2.610 1
1 912 . 4 1 1 A 79 79 PRO CA C 117 60.249 63.343 -3.094 1
1 913 . 4 1 1 A 79 79 PRO CB C 117 31.501 31.758 -0.257 1
1 916 . 4 1 1 A 80 80 GLY H H 118 7.096 8.581 -1.485 1
1 917 . 4 1 1 A 80 80 GLY HA2 H 118 3.797 4.075 -0.278 1
1 918 . 4 1 1 A 80 80 GLY HA3 H 118 3.517 4.086 -0.569 1
1 919 . 4 1 1 A 80 80 GLY C C 118 171.404 174.562 -3.158 1
1 920 . 4 1 1 A 80 80 GLY CA C 118 41.500 46.479 -4.979 1
1 921 . 4 1 1 A 80 80 GLY N N 118 108.306 107.934 0.372 1
1 922 . 4 1 1 A 81 81 THR H H 119 9.810 8.403 1.407 1
1 923 . 4 1 1 A 81 81 THR HA H 119 4.091 4.549 -0.458 1
1 928 . 4 1 1 A 81 81 THR C C 119 174.242 174.865 -0.623 1
1 929 . 4 1 1 A 81 81 THR CA C 119 60.874 61.124 -0.250 1
1 930 . 4 1 1 A 81 81 THR CB C 119 66.498 68.390 -1.892 1
1 932 . 4 1 1 A 81 81 THR N N 119 112.813 114.629 -1.816 1
1 933 . 4 1 1 A 82 82 LYS H H 120 8.964 8.429 0.535 1
1 934 . 4 1 1 A 82 82 LYS HA H 120 4.150 3.915 0.235 1
1 941 . 4 1 1 A 82 82 LYS C C 120 172.886 175.765 -2.879 1
1 942 . 4 1 1 A 82 82 LYS CA C 120 53.999 57.776 -3.777 1
1 943 . 4 1 1 A 82 82 LYS CB C 120 30.876 30.087 0.789 1
1 944 . 4 1 1 A 82 82 LYS N N 120 123.569 125.143 -1.574 1
1 945 . 4 1 1 A 83 83 GLY H H 121 7.125 7.977 -0.852 1
1 946 . 4 1 1 A 83 83 GLY HA2 H 121 3.814 4.281 -0.467 1
1 947 . 4 1 1 A 83 83 GLY HA3 H 121 3.814 4.296 -0.482 1
1 948 . 4 1 1 A 83 83 GLY C C 121 167.671 174.349 -6.678 1
1 949 . 4 1 1 A 83 83 GLY CA C 121 42.125 44.252 -2.127 1
1 950 . 4 1 1 A 83 83 GLY N N 121 107.253 107.551 -0.298 1
1 951 . 4 1 1 A 84 84 PRO HA H 122 4.077 4.343 -0.266 1
1 958 . 4 1 1 A 84 84 PRO C C 122 175.199 176.751 -1.552 1
1 959 . 4 1 1 A 84 84 PRO CA C 122 63.373 64.463 -1.090 1
1 960 . 4 1 1 A 84 84 PRO CB C 122 30.251 31.805 -1.554 1
1 962 . 4 1 1 A 85 85 PHE H H 123 6.652 6.640 0.012 1
1 963 . 4 1 1 A 85 85 PHE HA H 123 4.744 4.653 0.091 1
1 971 . 4 1 1 A 85 85 PHE C C 123 170.340 171.947 -1.607 1
1 972 . 4 1 1 A 85 85 PHE CA C 123 53.999 56.463 -2.464 1
1 973 . 4 1 1 A 85 85 PHE CB C 123 39.000 40.408 -1.408 1
1 974 . 4 1 1 A 85 85 PHE N N 123 108.468 111.805 -3.337 1
1 975 . 4 1 1 A 86 86 ASP H H 124 9.268 8.400 0.868 1
1 976 . 4 1 1 A 86 86 ASP HA H 124 5.108 3.935 1.173 1
1 979 . 4 1 1 A 86 86 ASP C C 124 171.180 174.311 -3.131 1
1 980 . 4 1 1 A 86 86 ASP CA C 124 50.249 52.864 -2.615 1
1 981 . 4 1 1 A 86 86 ASP CB C 124 40.250 42.360 -2.110 1
1 982 . 4 1 1 A 86 86 ASP N N 124 121.741 119.397 2.344 1
1 983 . 4 1 1 A 87 87 LEU H H 125 8.018 8.136 -0.118 1
1 984 . 4 1 1 A 87 87 LEU HA H 125 5.809 5.318 0.491 1
1 994 . 4 1 1 A 87 87 LEU C C 125 171.350 174.754 -3.404 1
1 995 . 4 1 1 A 87 87 LEU CA C 125 50.874 53.395 -2.521 1
1 996 . 4 1 1 A 87 87 LEU CB C 125 44.318 45.893 -1.575 1
1 999 . 4 1 1 A 87 87 LEU N N 125 123.629 127.203 -3.574 1
1 1000 . 4 1 1 A 88 88 TYR H H 126 8.912 8.442 0.470 1
1 1001 . 4 1 1 A 88 88 TYR HA H 126 5.630 5.579 0.051 1
1 1008 . 4 1 1 A 88 88 TYR C C 126 171.410 172.218 -0.808 1
1 1009 . 4 1 1 A 88 88 TYR CA C 126 52.749 56.556 -3.807 1
1 1010 . 4 1 1 A 88 88 TYR CB C 126 37.750 40.644 -2.894 1
1 1011 . 4 1 1 A 88 88 TYR N N 126 119.697 121.372 -1.675 1
1 1012 . 4 1 1 A 89 89 SER H H 127 9.319 9.517 -0.198 1
1 1013 . 4 1 1 A 89 89 SER HA H 127 5.429 5.234 0.195 1
1 1016 . 4 1 1 A 89 89 SER CA C 127 52.124 56.325 -4.201 1
1 1017 . 4 1 1 A 89 89 SER CB C 127 62.748 66.037 -3.289 1
1 1018 . 4 1 1 A 89 89 SER N N 127 112.637 115.756 -3.119 1
1 1019 . 4 1 1 A 90 90 LEU H H 128 8.759 8.540 0.219 1
1 1020 . 4 1 1 A 90 90 LEU HA H 128 4.186 4.454 -0.268 1
1 1030 . 4 1 1 A 90 90 LEU C C 128 175.121 178.384 -3.263 1
1 1031 . 4 1 1 A 90 90 LEU CA C 128 52.749 55.319 -2.570 1
1 1032 . 4 1 1 A 90 90 LEU CB C 128 35.875 42.166 -6.291 1
1 1033 . 4 1 1 A 90 90 LEU N N 128 126.728 126.945 -0.217 1
1 1034 . 4 1 1 A 91 91 GLY H H 129 8.356 8.557 -0.201 1
1 1035 . 4 1 1 A 91 91 GLY HA2 H 129 3.373 3.769 -0.396 1
1 1036 . 4 1 1 A 91 91 GLY HA3 H 129 3.373 3.910 -0.537 1
1 1037 . 4 1 1 A 91 91 GLY C C 129 172.013 174.514 -2.501 1
1 1038 . 4 1 1 A 91 91 GLY CA C 129 41.500 44.458 -2.958 1
1 1039 . 4 1 1 A 91 91 GLY N N 129 108.559 108.984 -0.425 1
1 1040 . 4 1 1 A 92 92 ALA H H 130 7.047 8.038 -0.991 1
1 1041 . 4 1 1 A 92 92 ALA HA H 130 4.037 3.214 0.823 1
1 1045 . 4 1 1 A 92 92 ALA C C 130 174.890 177.636 -2.746 1
1 1046 . 4 1 1 A 92 92 ALA CA C 130 52.100 53.977 -1.877 1
1 1047 . 4 1 1 A 92 92 ALA CB C 130 16.502 17.492 -0.990 1
1 1048 . 4 1 1 A 92 92 ALA N N 130 118.393 122.518 -4.125 1
1 1049 . 4 1 1 A 93 93 ASP H H 131 7.222 7.824 -0.602 1
1 1050 . 4 1 1 A 93 93 ASP HA H 131 4.122 4.521 -0.399 1
1 1053 . 4 1 1 A 93 93 ASP C C 131 174.890 176.532 -1.642 1
1 1054 . 4 1 1 A 93 93 ASP CA C 131 50.249 52.945 -2.696 1
1 1055 . 4 1 1 A 93 93 ASP CB C 131 37.750 40.313 -2.563 1
1 1056 . 4 1 1 A 93 93 ASP N N 131 111.487 113.417 -1.930 1
1 1057 . 4 1 1 A 94 94 GLY H H 132 7.199 9.102 -1.903 1
1 1058 . 4 1 1 A 94 94 GLY HA2 H 132 3.951 3.900 0.051 1
1 1059 . 4 1 1 A 94 94 GLY HA3 H 132 3.324 3.902 -0.578 1
1 1060 . 4 1 1 A 94 94 GLY C C 132 169.773 173.859 -4.086 1
1 1061 . 4 1 1 A 94 94 GLY CA C 132 44.625 46.194 -1.569 1
1 1062 . 4 1 1 A 94 94 GLY N N 132 106.932 111.040 -4.108 1
1 1063 . 4 1 1 A 95 95 LYS H H 133 7.215 7.728 -0.513 1
1 1064 . 4 1 1 A 95 95 LYS HA H 133 4.513 4.820 -0.307 1
1 1073 . 4 1 1 A 95 95 LYS C C 133 172.108 175.134 -3.026 1
1 1074 . 4 1 1 A 95 95 LYS CA C 133 51.512 54.105 -2.593 1
1 1075 . 4 1 1 A 95 95 LYS CB C 133 34.000 35.773 -1.773 1
1 1076 . 4 1 1 A 95 95 LYS N N 133 115.749 119.182 -3.433 1
1 1077 . 4 1 1 A 96 96 GLU H H 134 9.230 8.655 0.575 1
1 1078 . 4 1 1 A 96 96 GLU HA H 134 4.352 5.014 -0.662 1
1 1083 . 4 1 1 A 96 96 GLU C C 134 175.219 175.339 -0.120 1
1 1084 . 4 1 1 A 96 96 GLU CA C 134 55.874 55.362 0.512 1
1 1085 . 4 1 1 A 96 96 GLU CB C 134 27.126 30.624 -3.498 1
1 1087 . 4 1 1 A 96 96 GLU N N 134 128.571 119.894 8.677 1
1 1088 . 4 1 1 A 97 97 GLY H H 135 10.677 8.463 2.214 1
1 1089 . 4 1 1 A 97 97 GLY HA2 H 135 4.037 4.290 -0.253 1
1 1090 . 4 1 1 A 97 97 GLY HA3 H 135 3.717 4.300 -0.583 1
1 1091 . 4 1 1 A 97 97 GLY C C 135 171.567 172.077 -0.510 1
1 1092 . 4 1 1 A 97 97 GLY CA C 135 41.500 45.749 -4.249 1
1 1093 . 4 1 1 A 97 97 GLY N N 135 117.011 110.562 6.449 1
1 1094 . 4 1 1 A 98 98 GLY H H 136 8.442 8.693 -0.251 1
1 1095 . 4 1 1 A 98 98 GLY HA2 H 136 4.195 4.195 0.000 1
1 1096 . 4 1 1 A 98 98 GLY HA3 H 136 4.195 4.195 0.000 1
1 1097 . 4 1 1 A 98 98 GLY C C 136 170.299 173.012 -2.713 1
1 1098 . 4 1 1 A 98 98 GLY CA C 136 40.875 44.840 -3.965 1
1 1099 . 4 1 1 A 98 98 GLY N N 136 109.494 108.930 0.564 1
1 1100 . 4 1 1 A 99 99 SER H H 137 8.701 8.516 0.185 1
1 1101 . 4 1 1 A 99 99 SER HA H 137 4.639 4.875 -0.236 1
1 1104 . 4 1 1 A 99 99 SER C C 137 170.630 173.150 -2.520 1
1 1105 . 4 1 1 A 99 99 SER CA C 137 54.624 56.673 -2.049 1
1 1106 . 4 1 1 A 99 99 SER CB C 137 62.748 64.558 -1.810 1
1 1107 . 4 1 1 A 99 99 SER N N 137 114.685 116.944 -2.259 1
1 1108 . 4 1 1 A 100 100 ASP H H 138 9.117 8.909 0.208 1
1 1109 . 4 1 1 A 100 100 ASP HA H 138 3.965 4.471 -0.506 1
1 1112 . 4 1 1 A 100 100 ASP C C 138 175.540 178.180 -2.640 1
1 1113 . 4 1 1 A 100 100 ASP CA C 138 54.624 56.459 -1.835 1
1 1114 . 4 1 1 A 100 100 ASP CB C 138 36.500 40.982 -4.482 1
1 1115 . 4 1 1 A 100 100 ASP N N 138 120.777 123.755 -2.978 1
1 1116 . 4 1 1 A 101 101 ASN H H 139 8.667 7.888 0.779 1
1 1117 . 4 1 1 A 101 101 ASN HA H 139 4.333 4.608 -0.275 1
1 1122 . 4 1 1 A 101 101 ASN CA C 139 53.999 55.285 -1.286 1
1 1123 . 4 1 1 A 101 101 ASN CB C 139 34.625 38.760 -4.135 1
1 1124 . 4 1 1 A 101 101 ASN N N 139 121.930 117.448 4.482 1
1 1126 . 4 1 1 A 102 102 ASP H H 140 7.714 7.327 0.387 1
1 1127 . 4 1 1 A 102 102 ASP HA H 140 4.037 4.575 -0.538 1
1 1130 . 4 1 1 A 102 102 ASP C C 140 172.807 175.472 -2.665 1
1 1131 . 4 1 1 A 102 102 ASP CA C 140 53.374 54.023 -0.649 1
1 1132 . 4 1 1 A 102 102 ASP CB C 140 37.125 41.069 -3.944 1
1 1133 . 4 1 1 A 102 102 ASP N N 140 118.011 116.612 1.399 1
1 1134 . 4 1 1 A 103 103 ALA H H 141 7.060 7.187 -0.127 1
1 1135 . 4 1 1 A 103 103 ALA HA H 141 3.353 4.446 -1.093 1
1 1139 . 4 1 1 A 103 103 ALA C C 141 172.233 176.498 -4.265 1
1 1140 . 4 1 1 A 103 103 ALA CA C 141 49.624 50.851 -1.227 1
1 1141 . 4 1 1 A 103 103 ALA CB C 141 16.502 21.585 -5.083 1
1 1142 . 4 1 1 A 103 103 ALA N N 141 125.777 122.839 2.938 1
1 1143 . 4 1 1 A 104 104 ASP H H 142 7.973 8.157 -0.184 1
1 1144 . 4 1 1 A 104 104 ASP HA H 142 4.420 5.024 -0.604 1
1 1147 . 4 1 1 A 104 104 ASP C C 142 174.188 176.145 -1.957 1
1 1148 . 4 1 1 A 104 104 ASP CA C 142 52.124 53.968 -1.844 1
1 1149 . 4 1 1 A 104 104 ASP CB C 142 37.125 41.322 -4.197 1
1 1150 . 4 1 1 A 104 104 ASP N N 142 122.965 120.143 2.822 1
1 1151 . 4 1 1 A 105 105 ILE H H 143 8.534 9.113 -0.579 1
1 1152 . 4 1 1 A 105 105 ILE HA H 143 4.060 5.123 -1.063 1
1 1162 . 4 1 1 A 105 105 ILE C C 143 173.235 175.627 -2.392 1
1 1163 . 4 1 1 A 105 105 ILE CA C 143 58.374 59.830 -1.456 1
1 1164 . 4 1 1 A 105 105 ILE CB C 143 39.123 39.818 -0.695 1
1 1167 . 4 1 1 A 105 105 ILE N N 143 124.757 120.377 4.380 1
1 1168 . 4 1 1 A 106 106 GLY H H 144 8.288 8.495 -0.207 1
1 1169 . 4 1 1 A 106 106 GLY HA2 H 144 4.764 4.526 0.238 1
1 1170 . 4 1 1 A 106 106 GLY HA3 H 144 4.764 4.640 0.124 1
1 1171 . 4 1 1 A 106 106 GLY C C 144 171.321 172.763 -1.442 1
1 1172 . 4 1 1 A 106 106 GLY CA C 144 40.250 45.761 -5.511 1
1 1173 . 4 1 1 A 106 106 GLY N N 144 110.895 111.528 -0.633 1
1 1174 . 4 1 1 A 107 107 ASN H H 145 8.577 9.053 -0.476 1
1 1175 . 4 1 1 A 107 107 ASN HA H 145 4.268 5.849 -1.581 1
1 1180 . 4 1 1 A 107 107 ASN C C 145 171.757 173.669 -1.912 1
1 1181 . 4 1 1 A 107 107 ASN CA C 145 52.124 51.673 0.451 1
1 1182 . 4 1 1 A 107 107 ASN CB C 145 34.625 42.990 -8.365 1
1 1183 . 4 1 1 A 107 107 ASN N N 145 118.042 116.174 1.868 1
1 1185 . 4 1 1 A 108 108 TRP H H 146 6.822 8.753 -1.931 1
1 1186 . 4 1 1 A 108 108 TRP HA H 146 4.513 5.316 -0.803 1
1 1195 . 4 1 1 A 108 108 TRP C C 146 172.665 173.701 -1.036 1
1 1196 . 4 1 1 A 108 108 TRP CA C 146 54.624 56.435 -1.811 1
1 1197 . 4 1 1 A 108 108 TRP CB C 146 25.876 33.547 -7.671 1
1 1198 . 4 1 1 A 108 108 TRP N N 146 116.756 122.242 -5.486 1
1 1200 . 4 1 1 A 109 109 ASP H H 147 7.344 7.951 -0.607 1
1 1201 . 4 1 1 A 109 109 ASP HA H 147 4.655 5.000 -0.345 1
1 1204 . 4 1 1 A 109 109 ASP C C 147 172.193 174.396 -2.203 1
1 1205 . 4 1 1 A 109 109 ASP CA C 147 51.499 52.586 -1.087 1
1 1206 . 4 1 1 A 109 109 ASP CB C 147 39.000 41.772 -2.772 1
1 1207 . 4 1 1 A 109 109 ASP N N 147 121.461 126.969 -5.508 1
1 11 . 5 1 1 A 2 2 SER H H 40 8.461 8.901 -0.440 1
1 12 . 5 1 1 A 2 2 SER HA H 40 4.286 5.014 -0.728 1
1 15 . 5 1 1 A 2 2 SER C C 40 171.276 173.688 -2.412 1
1 16 . 5 1 1 A 2 2 SER CA C 40 55.249 57.949 -2.700 1
1 17 . 5 1 1 A 2 2 SER CB C 40 61.498 62.547 -1.049 1
1 18 . 5 1 1 A 2 2 SER N N 40 118.344 123.414 -5.070 1
1 19 . 5 1 1 A 3 3 ARG H H 41 8.469 8.377 0.092 1
1 20 . 5 1 1 A 3 3 ARG HA H 41 4.400 4.886 -0.486 1
1 25 . 5 1 1 A 3 3 ARG C C 41 172.251 173.702 -1.451 1
1 26 . 5 1 1 A 3 3 ARG CA C 41 52.749 52.926 -0.177 1
1 27 . 5 1 1 A 3 3 ARG CB C 41 27.126 33.781 -6.655 1
1 28 . 5 1 1 A 3 3 ARG N N 41 123.070 124.437 -1.367 1
1 33 . 5 1 1 A 4 4 PRO CA C 42 61.498 63.829 -2.331 1
1 34 . 5 1 1 A 4 4 PRO CB C 42 29.001 31.729 -2.728 1
1 37 . 5 1 1 A 5 5 ASP H H 43 8.246 8.906 -0.660 1
1 38 . 5 1 1 A 5 5 ASP HA H 43 4.329 4.559 -0.230 1
1 41 . 5 1 1 A 5 5 ASP C C 43 174.605 177.322 -2.717 1
1 42 . 5 1 1 A 5 5 ASP CA C 43 53.374 55.849 -2.475 1
1 43 . 5 1 1 A 5 5 ASP CB C 43 38.375 40.623 -2.248 1
1 44 . 5 1 1 A 5 5 ASP N N 43 119.409 121.345 -1.936 1
1 45 . 5 1 1 A 6 6 GLN H H 44 8.309 8.335 -0.026 1
1 46 . 5 1 1 A 6 6 GLN HA H 44 4.393 4.263 0.130 1
1 53 . 5 1 1 A 6 6 GLN C C 44 175.053 178.163 -3.110 1
1 54 . 5 1 1 A 6 6 GLN CA C 44 55.874 58.134 -2.260 1
1 55 . 5 1 1 A 6 6 GLN CB C 44 25.876 28.157 -2.281 1
1 57 . 5 1 1 A 6 6 GLN N N 44 122.273 117.993 4.280 1
1 59 . 5 1 1 A 7 7 ALA H H 45 8.106 7.993 0.113 1
1 60 . 5 1 1 A 7 7 ALA HA H 45 3.993 4.170 -0.177 1
1 64 . 5 1 1 A 7 7 ALA C C 45 177.465 177.859 -0.394 1
1 65 . 5 1 1 A 7 7 ALA CA C 45 52.124 54.208 -2.084 1
1 66 . 5 1 1 A 7 7 ALA CB C 45 15.252 18.328 -3.076 1
1 67 . 5 1 1 A 7 7 ALA N N 45 122.204 122.008 0.196 1
1 68 . 5 1 1 A 8 8 LYS H H 46 7.527 7.764 -0.237 1
1 69 . 5 1 1 A 8 8 LYS HA H 46 3.539 4.076 -0.537 1
1 78 . 5 1 1 A 8 8 LYS C C 46 175.412 179.072 -3.660 1
1 79 . 5 1 1 A 8 8 LYS CA C 46 57.124 57.635 -0.511 1
1 80 . 5 1 1 A 8 8 LYS CB C 46 30.876 32.202 -1.326 1
1 83 . 5 1 1 A 8 8 LYS N N 46 117.358 116.315 1.043 1
1 84 . 5 1 1 A 9 9 VAL H H 47 7.709 8.011 -0.302 1
1 85 . 5 1 1 A 9 9 VAL HA H 47 3.578 3.759 -0.181 1
1 93 . 5 1 1 A 9 9 VAL C C 47 175.005 178.348 -3.343 1
1 94 . 5 1 1 A 9 9 VAL CA C 47 64.623 66.121 -1.498 1
1 95 . 5 1 1 A 9 9 VAL CB C 47 29.001 31.795 -2.794 1
1 98 . 5 1 1 A 9 9 VAL N N 47 119.115 120.091 -0.976 1
1 99 . 5 1 1 A 10 10 THR H H 48 7.767 7.984 -0.217 1
1 100 . 5 1 1 A 10 10 THR HA H 48 3.668 4.008 -0.340 1
1 105 . 5 1 1 A 10 10 THR CA C 48 63.998 65.636 -1.638 1
1 106 . 5 1 1 A 10 10 THR CB C 48 67.123 68.809 -1.686 1
1 108 . 5 1 1 A 10 10 THR N N 48 115.112 113.504 1.608 1
1 109 . 5 1 1 A 11 11 VAL H H 49 7.598 7.743 -0.145 1
1 110 . 5 1 1 A 11 11 VAL HA H 49 3.457 3.905 -0.448 1
1 118 . 5 1 1 A 11 11 VAL C C 49 175.412 178.112 -2.700 1
1 119 . 5 1 1 A 11 11 VAL CA C 49 63.998 64.769 -0.771 1
1 120 . 5 1 1 A 11 11 VAL CB C 49 29.001 31.575 -2.574 1
1 123 . 5 1 1 A 11 11 VAL N N 49 123.694 117.353 6.341 1
1 124 . 5 1 1 A 12 12 ALA H H 50 8.176 7.806 0.370 1
1 125 . 5 1 1 A 12 12 ALA HA H 50 4.742 4.182 0.560 1
1 129 . 5 1 1 A 12 12 ALA C C 50 177.074 179.793 -2.719 1
1 130 . 5 1 1 A 12 12 ALA CA C 50 52.124 55.270 -3.146 1
1 131 . 5 1 1 A 12 12 ALA CB C 50 15.252 18.153 -2.901 1
1 132 . 5 1 1 A 12 12 ALA N N 50 122.348 124.331 -1.983 1
1 133 . 5 1 1 A 13 13 LYS H H 51 8.499 8.043 0.456 1
1 134 . 5 1 1 A 13 13 LYS HA H 51 3.648 4.099 -0.451 1
1 143 . 5 1 1 A 13 13 LYS C C 51 177.252 179.829 -2.577 1
1 144 . 5 1 1 A 13 13 LYS CA C 51 58.072 59.351 -1.279 1
1 145 . 5 1 1 A 13 13 LYS CB C 51 30.251 32.336 -2.085 1
1 146 . 5 1 1 A 13 13 LYS N N 51 115.402 117.221 -1.819 1
1 147 . 5 1 1 A 14 14 GLY H H 52 7.858 8.225 -0.367 1
1 148 . 5 1 1 A 14 14 GLY HA2 H 52 3.823 3.778 0.045 1
1 149 . 5 1 1 A 14 14 GLY HA3 H 52 3.676 3.780 -0.104 1
1 150 . 5 1 1 A 14 14 GLY C C 52 174.090 175.455 -1.365 1
1 151 . 5 1 1 A 14 14 GLY CA C 52 44.625 46.693 -2.068 1
1 152 . 5 1 1 A 14 14 GLY N N 52 107.466 108.639 -1.173 1
1 153 . 5 1 1 A 15 15 ASP H H 53 8.403 7.796 0.607 1
1 154 . 5 1 1 A 15 15 ASP HA H 53 4.191 4.436 -0.245 1
1 157 . 5 1 1 A 15 15 ASP C C 53 175.316 178.263 -2.947 1
1 158 . 5 1 1 A 15 15 ASP CA C 53 54.624 56.938 -2.314 1
1 159 . 5 1 1 A 15 15 ASP CB C 53 35.875 41.151 -5.276 1
1 160 . 5 1 1 A 15 15 ASP N N 53 125.929 121.312 4.617 1
1 161 . 5 1 1 A 16 16 ILE H H 54 8.245 8.285 -0.040 1
1 162 . 5 1 1 A 16 16 ILE HA H 54 3.034 3.743 -0.709 1
1 172 . 5 1 1 A 16 16 ILE C C 54 174.499 177.903 -3.404 1
1 173 . 5 1 1 A 16 16 ILE CA C 54 62.748 63.983 -1.235 1
1 174 . 5 1 1 A 16 16 ILE CB C 54 34.625 37.318 -2.693 1
1 178 . 5 1 1 A 16 16 ILE N N 54 119.456 118.090 1.366 1
1 179 . 5 1 1 A 17 17 LYS H H 55 7.547 8.066 -0.519 1
1 180 . 5 1 1 A 17 17 LYS HA H 55 3.843 4.148 -0.305 1
1 187 . 5 1 1 A 17 17 LYS C C 55 176.651 179.223 -2.572 1
1 188 . 5 1 1 A 17 17 LYS CA C 55 57.124 59.224 -2.100 1
1 189 . 5 1 1 A 17 17 LYS CB C 55 30.251 31.834 -1.583 1
1 190 . 5 1 1 A 17 17 LYS N N 55 118.505 121.360 -2.855 1
1 191 . 5 1 1 A 18 18 ALA H H 56 7.680 7.759 -0.079 1
1 192 . 5 1 1 A 18 18 ALA HA H 56 4.029 3.990 0.039 1
1 196 . 5 1 1 A 18 18 ALA C C 56 176.638 179.756 -3.118 1
1 197 . 5 1 1 A 18 18 ALA CA C 56 52.749 54.972 -2.223 1
1 198 . 5 1 1 A 18 18 ALA CB C 56 15.877 18.400 -2.523 1
1 199 . 5 1 1 A 18 18 ALA N N 56 122.477 122.220 0.257 1
1 200 . 5 1 1 A 19 19 ILE H H 57 8.853 7.935 0.918 1
1 201 . 5 1 1 A 19 19 ILE HA H 57 3.304 3.573 -0.269 1
1 211 . 5 1 1 A 19 19 ILE C C 57 174.710 177.808 -3.098 1
1 212 . 5 1 1 A 19 19 ILE CA C 57 63.373 65.375 -2.002 1
1 213 . 5 1 1 A 19 19 ILE CB C 57 35.250 37.761 -2.511 1
1 217 . 5 1 1 A 19 19 ILE N N 57 120.901 117.977 2.924 1
1 218 . 5 1 1 A 20 20 ALA H H 58 8.702 8.277 0.425 1
1 219 . 5 1 1 A 20 20 ALA HA H 58 3.900 3.947 -0.047 1
1 223 . 5 1 1 A 20 20 ALA C C 58 176.512 179.964 -3.452 1
1 224 . 5 1 1 A 20 20 ALA CA C 58 52.749 55.312 -2.563 1
1 225 . 5 1 1 A 20 20 ALA CB C 58 15.252 18.118 -2.866 1
1 226 . 5 1 1 A 20 20 ALA N N 58 121.763 122.341 -0.578 1
1 227 . 5 1 1 A 21 21 ALA H H 59 7.662 7.633 0.029 1
1 228 . 5 1 1 A 21 21 ALA HA H 59 4.136 4.184 -0.048 1
1 232 . 5 1 1 A 21 21 ALA C C 59 177.949 179.126 -1.177 1
1 233 . 5 1 1 A 21 21 ALA CA C 59 52.749 54.069 -1.320 1
1 234 . 5 1 1 A 21 21 ALA CB C 59 15.252 18.585 -3.333 1
1 235 . 5 1 1 A 21 21 ALA N N 59 119.079 119.480 -0.401 1
1 236 . 5 1 1 A 22 22 ALA H H 60 7.403 7.628 -0.225 1
1 237 . 5 1 1 A 22 22 ALA HA H 60 4.318 4.216 0.102 1
1 241 . 5 1 1 A 22 22 ALA C C 60 176.730 180.438 -3.708 1
1 242 . 5 1 1 A 22 22 ALA CA C 60 52.749 54.262 -1.513 1
1 243 . 5 1 1 A 22 22 ALA CB C 60 17.126 18.729 -1.603 1
1 244 . 5 1 1 A 22 22 ALA N N 60 122.616 120.052 2.564 1
1 245 . 5 1 1 A 23 23 LEU H H 61 8.410 8.560 -0.150 1
1 246 . 5 1 1 A 23 23 LEU HA H 61 3.527 3.974 -0.447 1
1 256 . 5 1 1 A 23 23 LEU C C 61 176.057 178.688 -2.631 1
1 257 . 5 1 1 A 23 23 LEU CA C 61 55.249 57.282 -2.033 1
1 258 . 5 1 1 A 23 23 LEU CB C 61 39.000 40.940 -1.940 1
1 262 . 5 1 1 A 23 23 LEU N N 61 120.761 121.165 -0.404 1
1 263 . 5 1 1 A 24 24 ASP H H 62 8.227 8.099 0.128 1
1 264 . 5 1 1 A 24 24 ASP HA H 62 4.581 4.609 -0.028 1
1 267 . 5 1 1 A 24 24 ASP C C 62 176.968 178.859 -1.891 1
1 268 . 5 1 1 A 24 24 ASP CA C 62 55.874 56.940 -1.066 1
1 269 . 5 1 1 A 24 24 ASP CB C 62 37.750 40.563 -2.813 1
1 270 . 5 1 1 A 24 24 ASP N N 62 119.068 118.931 0.137 1
1 271 . 5 1 1 A 25 25 MET H H 63 7.718 7.972 -0.254 1
1 272 . 5 1 1 A 25 25 MET HA H 63 4.196 4.190 0.006 1
1 277 . 5 1 1 A 25 25 MET C C 63 174.968 177.822 -2.854 1
1 278 . 5 1 1 A 25 25 MET CA C 63 55.249 58.260 -3.011 1
1 279 . 5 1 1 A 25 25 MET CB C 63 29.626 32.271 -2.645 1
1 281 . 5 1 1 A 25 25 MET N N 63 121.365 118.937 2.428 1
1 282 . 5 1 1 A 26 26 TYR H H 64 8.401 7.640 0.761 1
1 283 . 5 1 1 A 26 26 TYR HA H 64 4.400 3.562 0.838 1
1 291 . 5 1 1 A 26 26 TYR C C 64 176.098 177.349 -1.251 1
1 292 . 5 1 1 A 26 26 TYR CA C 64 58.999 60.963 -1.964 1
1 293 . 5 1 1 A 26 26 TYR CB C 64 35.250 38.344 -3.094 1
1 294 . 5 1 1 A 26 26 TYR N N 64 122.575 121.631 0.944 1
1 295 . 5 1 1 A 27 27 LYS H H 65 8.330 8.263 0.067 1
1 296 . 5 1 1 A 27 27 LYS HA H 65 3.568 4.358 -0.790 1
1 302 . 5 1 1 A 27 27 LYS C C 65 176.156 178.351 -2.195 1
1 303 . 5 1 1 A 27 27 LYS CA C 65 56.499 59.310 -2.811 1
1 304 . 5 1 1 A 27 27 LYS CB C 65 29.626 32.017 -2.391 1
1 306 . 5 1 1 A 27 27 LYS N N 65 121.390 118.643 2.747 1
1 307 . 5 1 1 A 28 28 LEU H H 66 7.833 7.563 0.270 1
1 308 . 5 1 1 A 28 28 LEU HA H 66 3.769 4.144 -0.375 1
1 318 . 5 1 1 A 28 28 LEU C C 66 175.925 178.213 -2.288 1
1 319 . 5 1 1 A 28 28 LEU CA C 66 55.874 56.331 -0.457 1
1 320 . 5 1 1 A 28 28 LEU CB C 66 38.375 41.797 -3.422 1
1 324 . 5 1 1 A 28 28 LEU N N 66 123.068 118.934 4.134 1
1 325 . 5 1 1 A 29 29 ASP H H 67 7.292 7.774 -0.482 1
1 326 . 5 1 1 A 29 29 ASP HA H 67 4.096 4.304 -0.208 1
1 329 . 5 1 1 A 29 29 ASP C C 67 174.618 176.810 -2.192 1
1 330 . 5 1 1 A 29 29 ASP CA C 67 53.999 56.268 -2.269 1
1 331 . 5 1 1 A 29 29 ASP CB C 67 38.375 40.854 -2.479 1
1 332 . 5 1 1 A 29 29 ASP N N 67 114.729 119.279 -4.550 1
1 333 . 5 1 1 A 30 30 ASN H H 68 8.097 7.733 0.364 1
1 334 . 5 1 1 A 30 30 ASN HA H 68 4.337 4.359 -0.022 1
1 339 . 5 1 1 A 30 30 ASN C C 68 172.822 174.440 -1.618 1
1 340 . 5 1 1 A 30 30 ASN CA C 68 52.124 51.395 0.729 1
1 341 . 5 1 1 A 30 30 ASN CB C 68 37.750 38.331 -0.581 1
1 342 . 5 1 1 A 30 30 ASN N N 68 111.054 115.619 -4.565 1
1 344 . 5 1 1 A 31 31 PHE H H 69 8.249 7.912 0.337 1
1 345 . 5 1 1 A 31 31 PHE HA H 69 4.135 4.230 -0.095 1
1 353 . 5 1 1 A 31 31 PHE C C 69 170.485 174.227 -3.742 1
1 354 . 5 1 1 A 31 31 PHE CA C 69 57.749 58.740 -0.991 1
1 355 . 5 1 1 A 31 31 PHE CB C 69 33.375 36.581 -3.206 1
1 356 . 5 1 1 A 31 31 PHE N N 69 116.277 119.065 -2.788 1
1 357 . 5 1 1 A 32 32 ALA H H 70 7.224 6.876 0.348 1
1 358 . 5 1 1 A 32 32 ALA HA H 70 4.194 4.500 -0.306 1
1 362 . 5 1 1 A 32 32 ALA C C 70 173.337 175.032 -1.695 1
1 363 . 5 1 1 A 32 32 ALA CA C 70 48.374 51.502 -3.128 1
1 364 . 5 1 1 A 32 32 ALA CB C 70 19.626 22.154 -2.528 1
1 365 . 5 1 1 A 32 32 ALA N N 70 119.914 120.311 -0.397 1
1 366 . 5 1 1 A 33 33 TYR H H 71 7.948 8.377 -0.429 1
1 367 . 5 1 1 A 33 33 TYR HA H 71 4.209 4.945 -0.736 1
1 374 . 5 1 1 A 33 33 TYR C C 71 170.591 174.248 -3.657 1
1 375 . 5 1 1 A 33 33 TYR CA C 71 54.624 56.518 -1.894 1
1 376 . 5 1 1 A 33 33 TYR CB C 71 34.000 37.868 -3.868 1
1 377 . 5 1 1 A 33 33 TYR N N 71 116.929 118.056 -1.127 1
1 378 . 5 1 1 A 34 34 PRO HA H 72 4.444 4.791 -0.347 1
1 381 . 5 1 1 A 34 34 PRO C C 72 174.775 176.348 -1.573 1
1 382 . 5 1 1 A 34 34 PRO CA C 72 59.624 62.609 -2.985 1
1 383 . 5 1 1 A 34 34 PRO CB C 72 28.376 32.057 -3.681 1
1 384 . 5 1 1 A 35 35 SER H H 73 8.721 8.417 0.304 1
1 385 . 5 1 1 A 35 35 SER HA H 73 4.467 4.756 -0.289 1
1 388 . 5 1 1 A 35 35 SER C C 73 173.271 175.367 -2.096 1
1 389 . 5 1 1 A 35 35 SER CA C 73 55.249 56.760 -1.511 1
1 390 . 5 1 1 A 35 35 SER CB C 73 63.373 65.724 -2.351 1
1 391 . 5 1 1 A 35 35 SER N N 73 118.284 114.659 3.625 1
1 392 . 5 1 1 A 36 36 THR H H 74 8.591 8.870 -0.279 1
1 393 . 5 1 1 A 36 36 THR HA H 74 3.649 4.193 -0.544 1
1 398 . 5 1 1 A 36 36 THR CA C 74 64.623 64.182 0.441 1
1 399 . 5 1 1 A 36 36 THR CB C 74 66.498 69.107 -2.609 1
1 401 . 5 1 1 A 36 36 THR N N 74 117.769 117.176 0.593 1
1 402 . 5 1 1 A 37 37 GLN H H 75 8.210 8.029 0.181 1
1 403 . 5 1 1 A 37 37 GLN HA H 75 3.860 4.358 -0.498 1
1 410 . 5 1 1 A 37 37 GLN C C 75 175.349 178.034 -2.685 1
1 411 . 5 1 1 A 37 37 GLN CA C 75 56.499 57.596 -1.097 1
1 412 . 5 1 1 A 37 37 GLN CB C 75 25.876 29.898 -4.022 1
1 414 . 5 1 1 A 37 37 GLN N N 75 117.931 121.499 -3.568 1
1 416 . 5 1 1 A 38 38 GLN H H 76 7.667 8.122 -0.455 1
1 417 . 5 1 1 A 38 38 GLN HA H 76 3.810 4.106 -0.296 1
1 424 . 5 1 1 A 38 38 GLN C C 76 175.805 179.199 -3.394 1
1 425 . 5 1 1 A 38 38 GLN CA C 76 55.874 57.930 -2.056 1
1 426 . 5 1 1 A 38 38 GLN CB C 76 25.876 28.392 -2.516 1
1 428 . 5 1 1 A 38 38 GLN N N 76 120.607 118.022 2.585 1
1 430 . 5 1 1 A 39 39 GLY H H 77 8.470 8.380 0.090 1
1 431 . 5 1 1 A 39 39 GLY HA2 H 77 3.920 3.769 0.151 1
1 432 . 5 1 1 A 39 39 GLY HA3 H 77 3.603 3.781 -0.178 1
1 433 . 5 1 1 A 39 39 GLY C C 77 169.006 175.480 -6.474 1
1 434 . 5 1 1 A 39 39 GLY CA C 77 42.125 46.551 -4.426 1
1 435 . 5 1 1 A 39 39 GLY N N 77 103.281 109.590 -6.309 1
1 436 . 5 1 1 A 40 40 LEU H H 78 8.135 7.800 0.335 1
1 437 . 5 1 1 A 40 40 LEU HA H 78 3.237 4.193 -0.956 1
1 447 . 5 1 1 A 40 40 LEU C C 78 176.383 178.944 -2.561 1
1 448 . 5 1 1 A 40 40 LEU CA C 78 52.749 57.168 -4.419 1
1 449 . 5 1 1 A 40 40 LEU CB C 78 39.000 41.464 -2.464 1
1 453 . 5 1 1 A 40 40 LEU N N 78 114.444 123.357 -8.913 1
1 454 . 5 1 1 A 41 41 GLU H H 79 8.578 7.963 0.615 1
1 455 . 5 1 1 A 41 41 GLU HA H 79 3.720 4.203 -0.483 1
1 460 . 5 1 1 A 41 41 GLU C C 79 175.093 177.363 -2.270 1
1 461 . 5 1 1 A 41 41 GLU CA C 79 57.124 58.929 -1.805 1
1 462 . 5 1 1 A 41 41 GLU CB C 79 26.501 29.350 -2.849 1
1 464 . 5 1 1 A 41 41 GLU N N 79 118.295 118.154 0.141 1
1 465 . 5 1 1 A 42 42 ALA H H 80 7.227 7.649 -0.422 1
1 466 . 5 1 1 A 42 42 ALA HA H 80 4.437 4.789 -0.352 1
1 470 . 5 1 1 A 42 42 ALA C C 80 173.745 178.215 -4.470 1
1 471 . 5 1 1 A 42 42 ALA CA C 80 51.499 52.903 -1.404 1
1 472 . 5 1 1 A 42 42 ALA CB C 80 15.877 19.373 -3.496 1
1 473 . 5 1 1 A 42 42 ALA N N 80 119.751 122.066 -2.315 1
1 474 . 5 1 1 A 43 43 LEU H H 81 7.932 7.489 0.443 1
1 475 . 5 1 1 A 43 43 LEU HA H 81 4.369 4.437 -0.068 1
1 485 . 5 1 1 A 43 43 LEU C C 81 174.788 178.097 -3.309 1
1 486 . 5 1 1 A 43 43 LEU CA C 81 53.374 55.568 -2.194 1
1 487 . 5 1 1 A 43 43 LEU CB C 81 39.625 42.423 -2.798 1
1 491 . 5 1 1 A 43 43 LEU N N 81 111.742 116.460 -4.718 1
1 492 . 5 1 1 A 44 44 VAL H H 82 7.886 7.518 0.368 1
1 493 . 5 1 1 A 44 44 VAL HA H 82 4.700 4.392 0.308 1
1 501 . 5 1 1 A 44 44 VAL C C 82 172.875 175.689 -2.814 1
1 502 . 5 1 1 A 44 44 VAL CA C 82 59.624 63.573 -3.949 1
1 503 . 5 1 1 A 44 44 VAL CB C 82 31.501 33.529 -2.028 1
1 506 . 5 1 1 A 44 44 VAL N N 82 113.604 115.498 -1.894 1
1 507 . 5 1 1 A 45 45 LYS H H 83 8.361 8.245 0.116 1
1 508 . 5 1 1 A 45 45 LYS HA H 83 4.251 4.828 -0.577 1
1 515 . 5 1 1 A 45 45 LYS C C 83 171.053 175.767 -4.714 1
1 516 . 5 1 1 A 45 45 LYS CA C 83 52.749 54.347 -1.598 1
1 517 . 5 1 1 A 45 45 LYS CB C 83 33.375 36.056 -2.681 1
1 521 . 5 1 1 A 45 45 LYS N N 83 123.860 118.761 5.099 1
1 522 . 5 1 1 A 46 46 LYS H H 84 7.243 7.861 -0.618 1
1 523 . 5 1 1 A 46 46 LYS HA H 84 2.175 2.827 -0.652 1
1 532 . 5 1 1 A 46 46 LYS C C 84 172.123 174.472 -2.349 1
1 533 . 5 1 1 A 46 46 LYS CA C 84 52.749 54.267 -1.518 1
1 534 . 5 1 1 A 46 46 LYS CB C 84 29.626 31.750 -2.124 1
1 537 . 5 1 1 A 46 46 LYS N N 84 128.615 121.985 6.630 1
1 538 . 5 1 1 A 47 47 PRO HA H 85 4.470 4.455 0.015 1
1 541 . 5 1 1 A 47 47 PRO C C 85 173.754 176.070 -2.316 1
1 542 . 5 1 1 A 47 47 PRO CA C 85 60.874 62.845 -1.971 1
1 543 . 5 1 1 A 47 47 PRO CB C 85 30.876 32.227 -1.351 1
1 546 . 5 1 1 A 48 48 THR H H 86 8.306 8.330 -0.024 1
1 547 . 5 1 1 A 48 48 THR HA H 86 4.287 4.709 -0.422 1
1 552 . 5 1 1 A 48 48 THR C C 86 173.070 173.862 -0.792 1
1 553 . 5 1 1 A 48 48 THR CA C 86 57.749 60.555 -2.806 1
1 554 . 5 1 1 A 48 48 THR CB C 86 67.748 70.622 -2.874 1
1 556 . 5 1 1 A 48 48 THR N N 86 109.564 112.070 -2.506 1
1 557 . 5 1 1 A 49 49 GLY H H 87 8.317 8.290 0.027 1
1 558 . 5 1 1 A 49 49 GLY HA2 H 87 3.851 4.070 -0.219 1
1 559 . 5 1 1 A 49 49 GLY HA3 H 87 3.678 4.078 -0.400 1
1 560 . 5 1 1 A 49 49 GLY C C 87 169.693 173.049 -3.356 1
1 561 . 5 1 1 A 49 49 GLY CA C 87 42.125 44.293 -2.168 1
1 562 . 5 1 1 A 49 49 GLY N N 87 109.071 109.627 -0.556 1
1 563 . 5 1 1 A 50 50 ASN H H 88 8.301 8.501 -0.200 1
1 564 . 5 1 1 A 50 50 ASN HA H 88 4.780 5.559 -0.779 1
1 569 . 5 1 1 A 50 50 ASN C C 88 171.370 174.266 -2.896 1
1 570 . 5 1 1 A 50 50 ASN CA C 88 47.749 50.636 -2.887 1
1 571 . 5 1 1 A 50 50 ASN CB C 88 37.125 40.136 -3.011 1
1 572 . 5 1 1 A 50 50 ASN N N 88 115.631 120.050 -4.419 1
1 574 . 5 1 1 A 51 51 PRO HA H 89 4.782 4.647 0.135 1
1 577 . 5 1 1 A 51 51 PRO C C 89 173.656 175.975 -2.319 1
1 578 . 5 1 1 A 51 51 PRO CA C 89 59.624 62.340 -2.716 1
1 579 . 5 1 1 A 51 51 PRO CB C 89 31.501 32.305 -0.804 1
1 582 . 5 1 1 A 52 52 GLN H H 90 9.076 8.891 0.185 1
1 583 . 5 1 1 A 52 52 GLN HA H 90 4.469 4.827 -0.358 1
1 590 . 5 1 1 A 52 52 GLN C C 90 172.386 173.984 -1.598 1
1 591 . 5 1 1 A 52 52 GLN CA C 90 50.874 53.241 -2.367 1
1 592 . 5 1 1 A 52 52 GLN CB C 90 26.501 28.108 -1.607 1
1 594 . 5 1 1 A 52 52 GLN N N 90 126.827 119.346 7.481 1
1 596 . 5 1 1 A 53 53 PRO HA H 91 4.384 4.569 -0.185 1
1 599 . 5 1 1 A 53 53 PRO C C 91 174.274 176.158 -1.884 1
1 600 . 5 1 1 A 53 53 PRO CB C 91 28.113 31.355 -3.242 1
1 601 . 5 1 1 A 54 54 LYS H H 92 8.401 8.604 -0.203 1
1 602 . 5 1 1 A 54 54 LYS HA H 92 3.984 4.731 -0.747 1
1 611 . 5 1 1 A 54 54 LYS C C 92 173.516 175.882 -2.366 1
1 612 . 5 1 1 A 54 54 LYS CA C 92 55.249 55.002 0.247 1
1 613 . 5 1 1 A 54 54 LYS CB C 92 30.876 36.621 -5.745 1
1 615 . 5 1 1 A 54 54 LYS N N 92 124.538 123.729 0.809 1
1 616 . 5 1 1 A 55 55 ASN H H 93 8.183 8.741 -0.558 1
1 617 . 5 1 1 A 55 55 ASN HA H 93 4.716 5.099 -0.383 1
1 622 . 5 1 1 A 55 55 ASN CA C 93 48.999 53.267 -4.268 1
1 623 . 5 1 1 A 55 55 ASN CB C 93 35.875 38.663 -2.788 1
1 624 . 5 1 1 A 55 55 ASN N N 93 118.677 121.052 -2.375 1
1 626 . 5 1 1 A 56 56 TRP H H 94 8.007 8.594 -0.587 1
1 627 . 5 1 1 A 56 56 TRP HA H 94 3.827 5.457 -1.630 1
1 635 . 5 1 1 A 56 56 TRP C C 94 173.760 175.385 -1.625 1
1 636 . 5 1 1 A 56 56 TRP CA C 94 59.624 59.331 0.293 1
1 637 . 5 1 1 A 56 56 TRP CB C 94 27.126 30.381 -3.255 1
1 638 . 5 1 1 A 56 56 TRP N N 94 122.195 127.793 -5.598 1
1 640 . 5 1 1 A 57 57 ASN H H 95 7.563 7.636 -0.073 1
1 641 . 5 1 1 A 57 57 ASN HA H 95 3.735 4.870 -1.135 1
1 646 . 5 1 1 A 57 57 ASN C C 95 171.952 173.913 -1.961 1
1 647 . 5 1 1 A 57 57 ASN CA C 95 51.499 50.950 0.549 1
1 648 . 5 1 1 A 57 57 ASN CB C 95 35.250 41.004 -5.754 1
1 649 . 5 1 1 A 57 57 ASN N N 95 129.659 125.304 4.355 1
1 651 . 5 1 1 A 58 58 LYS H H 96 8.110 8.083 0.027 1
1 652 . 5 1 1 A 58 58 LYS HA H 96 4.035 4.113 -0.078 1
1 659 . 5 1 1 A 58 58 LYS C C 96 174.530 175.349 -0.819 1
1 660 . 5 1 1 A 58 58 LYS CA C 96 56.499 54.451 2.048 1
1 661 . 5 1 1 A 58 58 LYS CB C 96 29.626 32.810 -3.184 1
1 665 . 5 1 1 A 58 58 LYS N N 96 123.913 122.938 0.975 1
1 666 . 5 1 1 A 59 59 ASP H H 97 7.903 9.223 -1.320 1
1 667 . 5 1 1 A 59 59 ASP HA H 97 4.393 4.421 -0.028 1
1 670 . 5 1 1 A 59 59 ASP C C 97 173.724 175.910 -2.186 1
1 671 . 5 1 1 A 59 59 ASP CA C 97 52.124 55.227 -3.103 1
1 672 . 5 1 1 A 59 59 ASP CB C 97 38.375 39.324 -0.949 1
1 673 . 5 1 1 A 59 59 ASP N N 97 118.773 117.173 1.600 1
1 674 . 5 1 1 A 60 60 GLY H H 98 7.819 8.150 -0.331 1
1 675 . 5 1 1 A 60 60 GLY HA2 H 98 3.917 2.798 1.119 1
1 676 . 5 1 1 A 60 60 GLY HA3 H 98 3.917 3.556 0.361 1
1 677 . 5 1 1 A 60 60 GLY C C 98 168.652 174.114 -5.462 1
1 678 . 5 1 1 A 60 60 GLY CA C 98 41.500 45.420 -3.920 1
1 679 . 5 1 1 A 60 60 GLY N N 98 108.742 104.471 4.271 1
1 680 . 5 1 1 A 61 61 TYR H H 99 8.105 7.619 0.486 1
1 681 . 5 1 1 A 61 61 TYR HA H 99 3.927 3.948 -0.021 1
1 689 . 5 1 1 A 61 61 TYR C C 99 172.831 173.949 -1.118 1
1 690 . 5 1 1 A 61 61 TYR CA C 99 57.124 57.793 -0.669 1
1 691 . 5 1 1 A 61 61 TYR CB C 99 37.125 36.184 0.941 1
1 692 . 5 1 1 A 61 61 TYR N N 99 113.836 112.013 1.823 1
1 693 . 5 1 1 A 62 62 LEU H H 100 7.352 7.585 -0.233 1
1 694 . 5 1 1 A 62 62 LEU HA H 100 4.343 4.881 -0.538 1
1 704 . 5 1 1 A 62 62 LEU C C 100 173.430 175.557 -2.127 1
1 705 . 5 1 1 A 62 62 LEU CA C 100 50.874 53.325 -2.451 1
1 706 . 5 1 1 A 62 62 LEU CB C 100 44.000 45.530 -1.530 1
1 710 . 5 1 1 A 62 62 LEU N N 100 117.112 119.660 -2.548 1
1 711 . 5 1 1 A 63 63 LYS H H 101 8.626 8.540 0.086 1
1 712 . 5 1 1 A 63 63 LYS HA H 101 3.986 4.466 -0.480 1
1 721 . 5 1 1 A 63 63 LYS C C 101 173.851 177.071 -3.220 1
1 722 . 5 1 1 A 63 63 LYS CA C 101 55.249 55.202 0.047 1
1 723 . 5 1 1 A 63 63 LYS CB C 101 29.626 33.830 -4.204 1
1 724 . 5 1 1 A 63 63 LYS N N 101 129.991 122.547 7.444 1
1 725 . 5 1 1 A 64 64 LYS H H 102 7.059 8.425 -1.366 1
1 726 . 5 1 1 A 64 64 LYS HA H 102 4.138 4.430 -0.292 1
1 735 . 5 1 1 A 64 64 LYS C C 102 171.120 175.133 -4.013 1
1 736 . 5 1 1 A 64 64 LYS CA C 102 52.749 56.039 -3.290 1
1 737 . 5 1 1 A 64 64 LYS CB C 102 32.750 32.359 0.391 1
1 740 . 5 1 1 A 64 64 LYS N N 102 113.255 119.293 -6.038 1
1 741 . 5 1 1 A 65 65 LEU H H 103 8.883 7.382 1.501 1
1 742 . 5 1 1 A 65 65 LEU HA H 103 4.475 4.688 -0.213 1
1 752 . 5 1 1 A 65 65 LEU C C 103 171.487 174.578 -3.091 1
1 753 . 5 1 1 A 65 65 LEU CA C 103 48.999 51.436 -2.437 1
1 754 . 5 1 1 A 65 65 LEU CB C 103 39.625 44.211 -4.586 1
1 758 . 5 1 1 A 65 65 LEU N N 103 126.355 122.046 4.309 1
1 759 . 5 1 1 A 66 66 PRO HA H 104 4.449 4.585 -0.136 1
1 764 . 5 1 1 A 66 66 PRO C C 104 173.363 176.183 -2.820 1
1 765 . 5 1 1 A 66 66 PRO CA C 104 60.249 62.276 -2.027 1
1 766 . 5 1 1 A 66 66 PRO CB C 104 29.626 32.782 -3.156 1
1 769 . 5 1 1 A 67 67 VAL H H 105 7.682 8.378 -0.696 1
1 770 . 5 1 1 A 67 67 VAL HA H 105 4.121 4.411 -0.290 1
1 778 . 5 1 1 A 67 67 VAL C C 105 171.667 175.007 -3.340 1
1 779 . 5 1 1 A 67 67 VAL CA C 105 58.374 61.799 -3.425 1
1 780 . 5 1 1 A 67 67 VAL CB C 105 30.251 32.939 -2.688 1
1 783 . 5 1 1 A 67 67 VAL N N 105 114.671 121.486 -6.815 1
1 784 . 5 1 1 A 68 68 ASP H H 106 8.216 8.188 0.028 1
1 785 . 5 1 1 A 68 68 ASP HA H 106 4.474 4.744 -0.270 1
1 788 . 5 1 1 A 68 68 ASP C C 106 172.452 175.245 -2.793 1
1 789 . 5 1 1 A 68 68 ASP CA C 106 50.249 52.459 -2.210 1
1 790 . 5 1 1 A 68 68 ASP CB C 106 37.750 39.748 -1.998 1
1 791 . 5 1 1 A 68 68 ASP N N 106 123.825 124.881 -1.056 1
1 792 . 5 1 1 A 69 69 PRO HA H 107 3.920 4.075 -0.155 1
1 797 . 5 1 1 A 69 69 PRO CA C 107 62.123 62.950 -0.827 1
1 798 . 5 1 1 A 69 69 PRO CB C 107 27.751 31.679 -3.928 1
1 801 . 5 1 1 A 70 70 TRP H H 108 8.156 8.394 -0.238 1
1 802 . 5 1 1 A 70 70 TRP HA H 108 4.274 4.286 -0.012 1
1 811 . 5 1 1 A 70 70 TRP CA C 108 57.124 58.492 -1.368 1
1 812 . 5 1 1 A 70 70 TRP CB C 108 25.251 27.034 -1.783 1
1 813 . 5 1 1 A 70 70 TRP N N 108 118.137 117.719 0.418 1
1 815 . 5 1 1 A 71 71 GLY H H 109 8.209 8.736 -0.527 1
1 816 . 5 1 1 A 71 71 GLY HA2 H 109 4.030 3.892 0.138 1
1 817 . 5 1 1 A 71 71 GLY HA3 H 109 3.303 3.918 -0.615 1
1 818 . 5 1 1 A 71 71 GLY CA C 109 42.750 46.717 -3.967 1
1 819 . 5 1 1 A 71 71 GLY N N 109 107.495 105.376 2.119 1
1 820 . 5 1 1 A 72 72 ASN H H 110 8.116 7.796 0.320 1
1 821 . 5 1 1 A 72 72 ASN HA H 110 5.103 5.086 0.017 1
1 826 . 5 1 1 A 72 72 ASN CA C 110 48.374 50.433 -2.059 1
1 827 . 5 1 1 A 72 72 ASN CB C 110 36.500 38.810 -2.310 1
1 828 . 5 1 1 A 72 72 ASN N N 110 120.108 119.250 0.858 1
1 830 . 5 1 1 A 73 73 PRO HA H 111 4.397 4.565 -0.168 1
1 835 . 5 1 1 A 73 73 PRO C C 111 176.229 176.392 -0.163 1
1 836 . 5 1 1 A 73 73 PRO CA C 111 60.249 62.448 -2.199 1
1 837 . 5 1 1 A 73 73 PRO CB C 111 29.001 32.507 -3.506 1
1 840 . 5 1 1 A 74 74 TYR H H 112 8.893 8.560 0.333 1
1 841 . 5 1 1 A 74 74 TYR HA H 112 4.064 4.801 -0.737 1
1 849 . 5 1 1 A 74 74 TYR C C 112 171.951 176.125 -4.174 1
1 850 . 5 1 1 A 74 74 TYR CA C 112 60.249 58.398 1.851 1
1 851 . 5 1 1 A 74 74 TYR CB C 112 36.500 39.545 -3.045 1
1 852 . 5 1 1 A 74 74 TYR N N 112 124.595 121.556 3.039 1
1 853 . 5 1 1 A 75 75 GLN H H 113 9.127 8.927 0.200 1
1 854 . 5 1 1 A 75 75 GLN HA H 113 4.019 4.397 -0.378 1
1 861 . 5 1 1 A 75 75 GLN C C 113 171.436 174.331 -2.895 1
1 862 . 5 1 1 A 75 75 GLN CA C 113 50.874 54.652 -3.778 1
1 863 . 5 1 1 A 75 75 GLN CB C 113 29.469 29.699 -0.230 1
1 865 . 5 1 1 A 75 75 GLN N N 113 120.777 122.127 -1.350 1
1 867 . 5 1 1 A 76 76 TYR H H 114 7.906 8.656 -0.750 1
1 868 . 5 1 1 A 76 76 TYR HA H 114 5.586 5.193 0.393 1
1 875 . 5 1 1 A 76 76 TYR C C 114 171.343 175.231 -3.888 1
1 876 . 5 1 1 A 76 76 TYR CA C 114 53.999 56.548 -2.549 1
1 877 . 5 1 1 A 76 76 TYR CB C 114 40.250 40.166 0.084 1
1 878 . 5 1 1 A 76 76 TYR N N 114 120.757 123.188 -2.431 1
1 879 . 5 1 1 A 77 77 LEU H H 115 8.261 9.107 -0.846 1
1 880 . 5 1 1 A 77 77 LEU HA H 115 4.280 5.228 -0.948 1
1 890 . 5 1 1 A 77 77 LEU C C 115 170.921 175.816 -4.895 1
1 891 . 5 1 1 A 77 77 LEU CA C 115 51.499 53.637 -2.138 1
1 892 . 5 1 1 A 77 77 LEU CB C 115 44.625 45.727 -1.102 1
1 896 . 5 1 1 A 77 77 LEU N N 115 130.662 124.782 5.880 1
1 897 . 5 1 1 A 78 78 ALA H H 116 7.973 8.569 -0.596 1
1 898 . 5 1 1 A 78 78 ALA HA H 116 4.292 4.835 -0.543 1
1 902 . 5 1 1 A 78 78 ALA C C 116 172.093 174.760 -2.667 1
1 903 . 5 1 1 A 78 78 ALA CA C 116 47.749 49.961 -2.212 1
1 904 . 5 1 1 A 78 78 ALA CB C 116 19.626 21.278 -1.652 1
1 905 . 5 1 1 A 78 78 ALA N N 116 125.564 124.795 0.769 1
1 906 . 5 1 1 A 79 79 PRO HA H 117 4.698 5.495 -0.797 1
1 911 . 5 1 1 A 79 79 PRO C C 117 173.994 176.652 -2.658 1
1 912 . 5 1 1 A 79 79 PRO CA C 117 60.249 63.494 -3.245 1
1 913 . 5 1 1 A 79 79 PRO CB C 117 31.501 31.925 -0.424 1
1 916 . 5 1 1 A 80 80 GLY H H 118 7.096 8.450 -1.354 1
1 917 . 5 1 1 A 80 80 GLY HA2 H 118 3.797 4.058 -0.261 1
1 918 . 5 1 1 A 80 80 GLY HA3 H 118 3.517 4.080 -0.563 1
1 919 . 5 1 1 A 80 80 GLY C C 118 171.404 173.918 -2.514 1
1 920 . 5 1 1 A 80 80 GLY CA C 118 41.500 46.239 -4.739 1
1 921 . 5 1 1 A 80 80 GLY N N 118 108.306 107.712 0.594 1
1 922 . 5 1 1 A 81 81 THR H H 119 9.810 8.201 1.609 1
1 923 . 5 1 1 A 81 81 THR HA H 119 4.091 4.554 -0.463 1
1 928 . 5 1 1 A 81 81 THR C C 119 174.242 174.664 -0.422 1
1 929 . 5 1 1 A 81 81 THR CA C 119 60.874 60.802 0.072 1
1 930 . 5 1 1 A 81 81 THR CB C 119 66.498 69.997 -3.499 1
1 932 . 5 1 1 A 81 81 THR N N 119 112.813 113.411 -0.598 1
1 933 . 5 1 1 A 82 82 LYS H H 120 8.964 8.772 0.192 1
1 934 . 5 1 1 A 82 82 LYS HA H 120 4.150 3.917 0.233 1
1 941 . 5 1 1 A 82 82 LYS C C 120 172.886 175.515 -2.629 1
1 942 . 5 1 1 A 82 82 LYS CA C 120 53.999 57.733 -3.734 1
1 943 . 5 1 1 A 82 82 LYS CB C 120 30.876 30.423 0.453 1
1 944 . 5 1 1 A 82 82 LYS N N 120 123.569 125.506 -1.937 1
1 945 . 5 1 1 A 83 83 GLY H H 121 7.125 7.944 -0.819 1
1 946 . 5 1 1 A 83 83 GLY HA2 H 121 3.814 4.255 -0.441 1
1 947 . 5 1 1 A 83 83 GLY HA3 H 121 3.814 4.331 -0.517 1
1 948 . 5 1 1 A 83 83 GLY C C 121 167.671 174.266 -6.595 1
1 949 . 5 1 1 A 83 83 GLY CA C 121 42.125 44.318 -2.193 1
1 950 . 5 1 1 A 83 83 GLY N N 121 107.253 107.662 -0.409 1
1 951 . 5 1 1 A 84 84 PRO HA H 122 4.077 4.507 -0.430 1
1 958 . 5 1 1 A 84 84 PRO C C 122 175.199 176.742 -1.543 1
1 959 . 5 1 1 A 84 84 PRO CA C 122 63.373 64.466 -1.093 1
1 960 . 5 1 1 A 84 84 PRO CB C 122 30.251 32.032 -1.781 1
1 962 . 5 1 1 A 85 85 PHE H H 123 6.652 6.791 -0.139 1
1 963 . 5 1 1 A 85 85 PHE HA H 123 4.744 4.819 -0.075 1
1 971 . 5 1 1 A 85 85 PHE C C 123 170.340 172.561 -2.221 1
1 972 . 5 1 1 A 85 85 PHE CA C 123 53.999 56.329 -2.330 1
1 973 . 5 1 1 A 85 85 PHE CB C 123 39.000 40.337 -1.337 1
1 974 . 5 1 1 A 85 85 PHE N N 123 108.468 112.641 -4.173 1
1 975 . 5 1 1 A 86 86 ASP H H 124 9.268 9.132 0.136 1
1 976 . 5 1 1 A 86 86 ASP HA H 124 5.108 5.272 -0.164 1
1 979 . 5 1 1 A 86 86 ASP C C 124 171.180 174.674 -3.494 1
1 980 . 5 1 1 A 86 86 ASP CA C 124 50.249 53.417 -3.168 1
1 981 . 5 1 1 A 86 86 ASP CB C 124 40.250 43.541 -3.291 1
1 982 . 5 1 1 A 86 86 ASP N N 124 121.741 119.143 2.598 1
1 983 . 5 1 1 A 87 87 LEU H H 125 8.018 9.758 -1.740 1
1 984 . 5 1 1 A 87 87 LEU HA H 125 5.809 5.695 0.114 1
1 994 . 5 1 1 A 87 87 LEU C C 125 171.350 175.121 -3.771 1
1 995 . 5 1 1 A 87 87 LEU CA C 125 50.874 53.511 -2.637 1
1 996 . 5 1 1 A 87 87 LEU CB C 125 44.318 45.692 -1.374 1
1 999 . 5 1 1 A 87 87 LEU N N 125 123.629 127.891 -4.262 1
1 1000 . 5 1 1 A 88 88 TYR H H 126 8.912 8.535 0.377 1
1 1001 . 5 1 1 A 88 88 TYR HA H 126 5.630 5.429 0.201 1
1 1008 . 5 1 1 A 88 88 TYR C C 126 171.410 173.205 -1.795 1
1 1009 . 5 1 1 A 88 88 TYR CA C 126 52.749 56.656 -3.907 1
1 1010 . 5 1 1 A 88 88 TYR CB C 126 37.750 40.515 -2.765 1
1 1011 . 5 1 1 A 88 88 TYR N N 126 119.697 121.804 -2.107 1
1 1012 . 5 1 1 A 89 89 SER H H 127 9.319 9.517 -0.198 1
1 1013 . 5 1 1 A 89 89 SER HA H 127 5.429 5.126 0.303 1
1 1016 . 5 1 1 A 89 89 SER CA C 127 52.124 56.181 -4.057 1
1 1017 . 5 1 1 A 89 89 SER CB C 127 62.748 65.711 -2.963 1
1 1018 . 5 1 1 A 89 89 SER N N 127 112.637 114.714 -2.077 1
1 1019 . 5 1 1 A 90 90 LEU H H 128 8.759 8.508 0.251 1
1 1020 . 5 1 1 A 90 90 LEU HA H 128 4.186 4.406 -0.220 1
1 1030 . 5 1 1 A 90 90 LEU C C 128 175.121 178.206 -3.085 1
1 1031 . 5 1 1 A 90 90 LEU CA C 128 52.749 55.095 -2.346 1
1 1032 . 5 1 1 A 90 90 LEU CB C 128 35.875 42.071 -6.196 1
1 1033 . 5 1 1 A 90 90 LEU N N 128 126.728 124.292 2.436 1
1 1034 . 5 1 1 A 91 91 GLY H H 129 8.356 8.374 -0.018 1
1 1035 . 5 1 1 A 91 91 GLY HA2 H 129 3.373 3.305 0.068 1
1 1036 . 5 1 1 A 91 91 GLY HA3 H 129 3.373 3.747 -0.374 1
1 1037 . 5 1 1 A 91 91 GLY C C 129 172.013 174.252 -2.239 1
1 1038 . 5 1 1 A 91 91 GLY CA C 129 41.500 43.762 -2.262 1
1 1039 . 5 1 1 A 91 91 GLY N N 129 108.559 109.080 -0.521 1
1 1040 . 5 1 1 A 92 92 ALA H H 130 7.047 8.140 -1.093 1
1 1041 . 5 1 1 A 92 92 ALA HA H 130 4.037 3.258 0.779 1
1 1045 . 5 1 1 A 92 92 ALA C C 130 174.890 177.504 -2.614 1
1 1046 . 5 1 1 A 92 92 ALA CA C 130 52.100 53.280 -1.180 1
1 1047 . 5 1 1 A 92 92 ALA CB C 130 16.502 18.208 -1.706 1
1 1048 . 5 1 1 A 92 92 ALA N N 130 118.393 121.376 -2.983 1
1 1049 . 5 1 1 A 93 93 ASP H H 131 7.222 7.591 -0.369 1
1 1050 . 5 1 1 A 93 93 ASP HA H 131 4.122 4.677 -0.555 1
1 1053 . 5 1 1 A 93 93 ASP C C 131 174.890 176.330 -1.440 1
1 1054 . 5 1 1 A 93 93 ASP CA C 131 50.249 53.922 -3.673 1
1 1055 . 5 1 1 A 93 93 ASP CB C 131 37.750 41.408 -3.658 1
1 1056 . 5 1 1 A 93 93 ASP N N 131 111.487 116.832 -5.345 1
1 1057 . 5 1 1 A 94 94 GLY H H 132 7.199 9.497 -2.298 1
1 1058 . 5 1 1 A 94 94 GLY HA2 H 132 3.951 3.796 0.155 1
1 1059 . 5 1 1 A 94 94 GLY HA3 H 132 3.324 3.809 -0.485 1
1 1060 . 5 1 1 A 94 94 GLY C C 132 169.773 173.679 -3.906 1
1 1061 . 5 1 1 A 94 94 GLY CA C 132 44.625 45.640 -1.015 1
1 1062 . 5 1 1 A 94 94 GLY N N 132 106.932 108.386 -1.454 1
1 1063 . 5 1 1 A 95 95 LYS H H 133 7.215 7.555 -0.340 1
1 1064 . 5 1 1 A 95 95 LYS HA H 133 4.513 4.882 -0.369 1
1 1073 . 5 1 1 A 95 95 LYS C C 133 172.108 174.682 -2.574 1
1 1074 . 5 1 1 A 95 95 LYS CA C 133 51.512 54.717 -3.205 1
1 1075 . 5 1 1 A 95 95 LYS CB C 133 34.000 35.869 -1.869 1
1 1076 . 5 1 1 A 95 95 LYS N N 133 115.749 120.361 -4.612 1
1 1077 . 5 1 1 A 96 96 GLU H H 134 9.230 8.657 0.573 1
1 1078 . 5 1 1 A 96 96 GLU HA H 134 4.352 4.636 -0.284 1
1 1083 . 5 1 1 A 96 96 GLU C C 134 175.219 176.233 -1.014 1
1 1084 . 5 1 1 A 96 96 GLU CA C 134 55.874 56.087 -0.213 1
1 1085 . 5 1 1 A 96 96 GLU CB C 134 27.126 30.156 -3.030 1
1 1087 . 5 1 1 A 96 96 GLU N N 134 128.571 123.049 5.522 1
1 1088 . 5 1 1 A 97 97 GLY H H 135 10.677 8.517 2.160 1
1 1089 . 5 1 1 A 97 97 GLY HA2 H 135 4.037 4.352 -0.315 1
1 1090 . 5 1 1 A 97 97 GLY HA3 H 135 3.717 4.359 -0.642 1
1 1091 . 5 1 1 A 97 97 GLY C C 135 171.567 172.290 -0.723 1
1 1092 . 5 1 1 A 97 97 GLY CA C 135 41.500 45.771 -4.271 1
1 1093 . 5 1 1 A 97 97 GLY N N 135 117.011 110.503 6.508 1
1 1094 . 5 1 1 A 98 98 GLY H H 136 8.442 8.668 -0.226 1
1 1095 . 5 1 1 A 98 98 GLY HA2 H 136 4.195 4.232 -0.037 1
1 1096 . 5 1 1 A 98 98 GLY HA3 H 136 4.195 4.235 -0.040 1
1 1097 . 5 1 1 A 98 98 GLY C C 136 170.299 173.291 -2.992 1
1 1098 . 5 1 1 A 98 98 GLY CA C 136 40.875 44.764 -3.889 1
1 1099 . 5 1 1 A 98 98 GLY N N 136 109.494 109.237 0.257 1
1 1100 . 5 1 1 A 99 99 SER H H 137 8.701 8.730 -0.029 1
1 1101 . 5 1 1 A 99 99 SER HA H 137 4.639 4.919 -0.280 1
1 1104 . 5 1 1 A 99 99 SER C C 137 170.630 173.328 -2.698 1
1 1105 . 5 1 1 A 99 99 SER CA C 137 54.624 57.641 -3.017 1
1 1106 . 5 1 1 A 99 99 SER CB C 137 62.748 66.564 -3.816 1
1 1107 . 5 1 1 A 99 99 SER N N 137 114.685 118.401 -3.716 1
1 1108 . 5 1 1 A 100 100 ASP H H 138 9.117 8.931 0.186 1
1 1109 . 5 1 1 A 100 100 ASP HA H 138 3.965 4.493 -0.528 1
1 1112 . 5 1 1 A 100 100 ASP C C 138 175.540 178.192 -2.652 1
1 1113 . 5 1 1 A 100 100 ASP CA C 138 54.624 56.431 -1.807 1
1 1114 . 5 1 1 A 100 100 ASP CB C 138 36.500 40.773 -4.273 1
1 1115 . 5 1 1 A 100 100 ASP N N 138 120.777 122.722 -1.945 1
1 1116 . 5 1 1 A 101 101 ASN H H 139 8.667 8.439 0.228 1
1 1117 . 5 1 1 A 101 101 ASN HA H 139 4.333 4.748 -0.415 1
1 1122 . 5 1 1 A 101 101 ASN CA C 139 53.999 54.758 -0.759 1
1 1123 . 5 1 1 A 101 101 ASN CB C 139 34.625 38.831 -4.206 1
1 1124 . 5 1 1 A 101 101 ASN N N 139 121.930 115.552 6.378 1
1 1126 . 5 1 1 A 102 102 ASP H H 140 7.714 7.833 -0.119 1
1 1127 . 5 1 1 A 102 102 ASP HA H 140 4.037 4.461 -0.424 1
1 1130 . 5 1 1 A 102 102 ASP C C 140 172.807 176.104 -3.297 1
1 1131 . 5 1 1 A 102 102 ASP CA C 140 53.374 54.447 -1.073 1
1 1132 . 5 1 1 A 102 102 ASP CB C 140 37.125 41.307 -4.182 1
1 1133 . 5 1 1 A 102 102 ASP N N 140 118.011 117.969 0.042 1
1 1134 . 5 1 1 A 103 103 ALA H H 141 7.060 7.394 -0.334 1
1 1135 . 5 1 1 A 103 103 ALA HA H 141 3.353 4.285 -0.932 1
1 1139 . 5 1 1 A 103 103 ALA C C 141 172.233 176.619 -4.386 1
1 1140 . 5 1 1 A 103 103 ALA CA C 141 49.624 51.532 -1.908 1
1 1141 . 5 1 1 A 103 103 ALA CB C 141 16.502 20.806 -4.304 1
1 1142 . 5 1 1 A 103 103 ALA N N 141 125.777 121.613 4.164 1
1 1143 . 5 1 1 A 104 104 ASP H H 142 7.973 8.023 -0.050 1
1 1144 . 5 1 1 A 104 104 ASP HA H 142 4.420 5.129 -0.709 1
1 1147 . 5 1 1 A 104 104 ASP C C 142 174.188 176.114 -1.926 1
1 1148 . 5 1 1 A 104 104 ASP CA C 142 52.124 53.651 -1.527 1
1 1149 . 5 1 1 A 104 104 ASP CB C 142 37.125 41.344 -4.219 1
1 1150 . 5 1 1 A 104 104 ASP N N 142 122.965 119.957 3.008 1
1 1151 . 5 1 1 A 105 105 ILE H H 143 8.534 8.467 0.067 1
1 1152 . 5 1 1 A 105 105 ILE HA H 143 4.060 4.946 -0.886 1
1 1162 . 5 1 1 A 105 105 ILE C C 143 173.235 176.033 -2.798 1
1 1163 . 5 1 1 A 105 105 ILE CA C 143 58.374 59.710 -1.336 1
1 1164 . 5 1 1 A 105 105 ILE CB C 143 39.123 39.580 -0.457 1
1 1167 . 5 1 1 A 105 105 ILE N N 143 124.757 121.115 3.642 1
1 1168 . 5 1 1 A 106 106 GLY H H 144 8.288 8.212 0.076 1
1 1169 . 5 1 1 A 106 106 GLY HA2 H 144 4.764 4.450 0.314 1
1 1170 . 5 1 1 A 106 106 GLY HA3 H 144 4.764 4.509 0.255 1
1 1171 . 5 1 1 A 106 106 GLY C C 144 171.321 172.099 -0.778 1
1 1172 . 5 1 1 A 106 106 GLY CA C 144 40.250 45.726 -5.476 1
1 1173 . 5 1 1 A 106 106 GLY N N 144 110.895 110.162 0.733 1
1 1174 . 5 1 1 A 107 107 ASN H H 145 8.577 9.156 -0.579 1
1 1175 . 5 1 1 A 107 107 ASN HA H 145 4.268 5.227 -0.959 1
1 1180 . 5 1 1 A 107 107 ASN C C 145 171.757 173.577 -1.820 1
1 1181 . 5 1 1 A 107 107 ASN CA C 145 52.124 51.585 0.539 1
1 1182 . 5 1 1 A 107 107 ASN CB C 145 34.625 42.229 -7.604 1
1 1183 . 5 1 1 A 107 107 ASN N N 145 118.042 115.925 2.117 1
1 1185 . 5 1 1 A 108 108 TRP H H 146 6.822 8.345 -1.523 1
1 1186 . 5 1 1 A 108 108 TRP HA H 146 4.513 4.851 -0.338 1
1 1195 . 5 1 1 A 108 108 TRP C C 146 172.665 171.964 0.701 1
1 1196 . 5 1 1 A 108 108 TRP CA C 146 54.624 55.557 -0.933 1
1 1197 . 5 1 1 A 108 108 TRP CB C 146 25.876 31.131 -5.255 1
1 1198 . 5 1 1 A 108 108 TRP N N 146 116.756 118.111 -1.355 1
1 1200 . 5 1 1 A 109 109 ASP H H 147 7.344 7.569 -0.225 1
1 1201 . 5 1 1 A 109 109 ASP HA H 147 4.655 5.375 -0.720 1
1 1204 . 5 1 1 A 109 109 ASP C C 147 172.193 174.336 -2.143 1
1 1205 . 5 1 1 A 109 109 ASP CA C 147 51.499 52.354 -0.855 1
1 1206 . 5 1 1 A 109 109 ASP CB C 147 39.000 43.736 -4.736 1
1 1207 . 5 1 1 A 109 109 ASP N N 147 121.461 120.687 0.774 1
1 11 . 6 1 1 A 2 2 SER H H 40 8.461 8.904 -0.443 1
1 12 . 6 1 1 A 2 2 SER HA H 40 4.286 4.952 -0.666 1
1 15 . 6 1 1 A 2 2 SER C C 40 171.276 173.412 -2.136 1
1 16 . 6 1 1 A 2 2 SER CA C 40 55.249 57.492 -2.243 1
1 17 . 6 1 1 A 2 2 SER CB C 40 61.498 61.863 -0.365 1
1 18 . 6 1 1 A 2 2 SER N N 40 118.344 123.805 -5.461 1
1 19 . 6 1 1 A 3 3 ARG H H 41 8.469 8.033 0.436 1
1 20 . 6 1 1 A 3 3 ARG HA H 41 4.400 4.858 -0.458 1
1 25 . 6 1 1 A 3 3 ARG C C 41 172.251 173.746 -1.495 1
1 26 . 6 1 1 A 3 3 ARG CA C 41 52.749 52.870 -0.121 1
1 27 . 6 1 1 A 3 3 ARG CB C 41 27.126 33.200 -6.074 1
1 28 . 6 1 1 A 3 3 ARG N N 41 123.070 122.832 0.238 1
1 33 . 6 1 1 A 4 4 PRO CA C 42 61.498 63.823 -2.325 1
1 34 . 6 1 1 A 4 4 PRO CB C 42 29.001 31.747 -2.746 1
1 37 . 6 1 1 A 5 5 ASP H H 43 8.246 8.929 -0.683 1
1 38 . 6 1 1 A 5 5 ASP HA H 43 4.329 4.644 -0.315 1
1 41 . 6 1 1 A 5 5 ASP C C 43 174.605 177.351 -2.746 1
1 42 . 6 1 1 A 5 5 ASP CA C 43 53.374 55.887 -2.513 1
1 43 . 6 1 1 A 5 5 ASP CB C 43 38.375 40.608 -2.233 1
1 44 . 6 1 1 A 5 5 ASP N N 43 119.409 121.231 -1.822 1
1 45 . 6 1 1 A 6 6 GLN H H 44 8.309 8.248 0.061 1
1 46 . 6 1 1 A 6 6 GLN HA H 44 4.393 4.207 0.186 1
1 53 . 6 1 1 A 6 6 GLN C C 44 175.053 178.386 -3.333 1
1 54 . 6 1 1 A 6 6 GLN CA C 44 55.874 58.240 -2.366 1
1 55 . 6 1 1 A 6 6 GLN CB C 44 25.876 28.242 -2.366 1
1 57 . 6 1 1 A 6 6 GLN N N 44 122.273 118.180 4.093 1
1 59 . 6 1 1 A 7 7 ALA H H 45 8.106 8.200 -0.094 1
1 60 . 6 1 1 A 7 7 ALA HA H 45 3.993 4.040 -0.047 1
1 64 . 6 1 1 A 7 7 ALA C C 45 177.465 178.556 -1.091 1
1 65 . 6 1 1 A 7 7 ALA CA C 45 52.124 54.711 -2.587 1
1 66 . 6 1 1 A 7 7 ALA CB C 45 15.252 18.288 -3.036 1
1 67 . 6 1 1 A 7 7 ALA N N 45 122.204 122.336 -0.132 1
1 68 . 6 1 1 A 8 8 LYS H H 46 7.527 7.606 -0.079 1
1 69 . 6 1 1 A 8 8 LYS HA H 46 3.539 4.010 -0.471 1
1 78 . 6 1 1 A 8 8 LYS C C 46 175.412 179.082 -3.670 1
1 79 . 6 1 1 A 8 8 LYS CA C 46 57.124 58.421 -1.297 1
1 80 . 6 1 1 A 8 8 LYS CB C 46 30.876 31.939 -1.063 1
1 83 . 6 1 1 A 8 8 LYS N N 46 117.358 117.102 0.256 1
1 84 . 6 1 1 A 9 9 VAL H H 47 7.709 7.622 0.087 1
1 85 . 6 1 1 A 9 9 VAL HA H 47 3.578 3.817 -0.239 1
1 93 . 6 1 1 A 9 9 VAL C C 47 175.005 178.494 -3.489 1
1 94 . 6 1 1 A 9 9 VAL CA C 47 64.623 66.140 -1.517 1
1 95 . 6 1 1 A 9 9 VAL CB C 47 29.001 31.833 -2.832 1
1 98 . 6 1 1 A 9 9 VAL N N 47 119.115 120.362 -1.247 1
1 99 . 6 1 1 A 10 10 THR H H 48 7.767 8.070 -0.303 1
1 100 . 6 1 1 A 10 10 THR HA H 48 3.668 3.980 -0.312 1
1 105 . 6 1 1 A 10 10 THR CA C 48 63.998 66.025 -2.027 1
1 106 . 6 1 1 A 10 10 THR CB C 48 67.123 68.659 -1.536 1
1 108 . 6 1 1 A 10 10 THR N N 48 115.112 114.022 1.090 1
1 109 . 6 1 1 A 11 11 VAL H H 49 7.598 7.541 0.057 1
1 110 . 6 1 1 A 11 11 VAL HA H 49 3.457 3.899 -0.442 1
1 118 . 6 1 1 A 11 11 VAL C C 49 175.412 178.051 -2.639 1
1 119 . 6 1 1 A 11 11 VAL CA C 49 63.998 64.894 -0.896 1
1 120 . 6 1 1 A 11 11 VAL CB C 49 29.001 31.591 -2.590 1
1 123 . 6 1 1 A 11 11 VAL N N 49 123.694 117.386 6.308 1
1 124 . 6 1 1 A 12 12 ALA H H 50 8.176 7.799 0.377 1
1 125 . 6 1 1 A 12 12 ALA HA H 50 4.742 4.071 0.671 1
1 129 . 6 1 1 A 12 12 ALA C C 50 177.074 179.863 -2.789 1
1 130 . 6 1 1 A 12 12 ALA CA C 50 52.124 55.441 -3.317 1
1 131 . 6 1 1 A 12 12 ALA CB C 50 15.252 18.061 -2.809 1
1 132 . 6 1 1 A 12 12 ALA N N 50 122.348 124.170 -1.822 1
1 133 . 6 1 1 A 13 13 LYS H H 51 8.499 8.144 0.355 1
1 134 . 6 1 1 A 13 13 LYS HA H 51 3.648 4.074 -0.426 1
1 143 . 6 1 1 A 13 13 LYS C C 51 177.252 179.852 -2.600 1
1 144 . 6 1 1 A 13 13 LYS CA C 51 58.072 59.355 -1.283 1
1 145 . 6 1 1 A 13 13 LYS CB C 51 30.251 32.325 -2.074 1
1 146 . 6 1 1 A 13 13 LYS N N 51 115.402 116.377 -0.975 1
1 147 . 6 1 1 A 14 14 GLY H H 52 7.858 7.840 0.018 1
1 148 . 6 1 1 A 14 14 GLY HA2 H 52 3.823 3.760 0.063 1
1 149 . 6 1 1 A 14 14 GLY HA3 H 52 3.676 3.760 -0.084 1
1 150 . 6 1 1 A 14 14 GLY C C 52 174.090 175.474 -1.384 1
1 151 . 6 1 1 A 14 14 GLY CA C 52 44.625 46.795 -2.170 1
1 152 . 6 1 1 A 14 14 GLY N N 52 107.466 108.623 -1.157 1
1 153 . 6 1 1 A 15 15 ASP H H 53 8.403 8.039 0.364 1
1 154 . 6 1 1 A 15 15 ASP HA H 53 4.191 4.427 -0.236 1
1 157 . 6 1 1 A 15 15 ASP C C 53 175.316 178.293 -2.977 1
1 158 . 6 1 1 A 15 15 ASP CA C 53 54.624 56.982 -2.358 1
1 159 . 6 1 1 A 15 15 ASP CB C 53 35.875 41.215 -5.340 1
1 160 . 6 1 1 A 15 15 ASP N N 53 125.929 121.343 4.586 1
1 161 . 6 1 1 A 16 16 ILE H H 54 8.245 8.202 0.043 1
1 162 . 6 1 1 A 16 16 ILE HA H 54 3.034 3.716 -0.682 1
1 172 . 6 1 1 A 16 16 ILE C C 54 174.499 177.945 -3.446 1
1 173 . 6 1 1 A 16 16 ILE CA C 54 62.748 63.997 -1.249 1
1 174 . 6 1 1 A 16 16 ILE CB C 54 34.625 37.333 -2.708 1
1 178 . 6 1 1 A 16 16 ILE N N 54 119.456 117.780 1.676 1
1 179 . 6 1 1 A 17 17 LYS H H 55 7.547 8.083 -0.536 1
1 180 . 6 1 1 A 17 17 LYS HA H 55 3.843 4.111 -0.268 1
1 187 . 6 1 1 A 17 17 LYS C C 55 176.651 179.312 -2.661 1
1 188 . 6 1 1 A 17 17 LYS CA C 55 57.124 59.355 -2.231 1
1 189 . 6 1 1 A 17 17 LYS CB C 55 30.251 31.979 -1.728 1
1 190 . 6 1 1 A 17 17 LYS N N 55 118.505 121.311 -2.806 1
1 191 . 6 1 1 A 18 18 ALA H H 56 7.680 7.712 -0.032 1
1 192 . 6 1 1 A 18 18 ALA HA H 56 4.029 4.041 -0.012 1
1 196 . 6 1 1 A 18 18 ALA C C 56 176.638 179.926 -3.288 1
1 197 . 6 1 1 A 18 18 ALA CA C 56 52.749 54.841 -2.092 1
1 198 . 6 1 1 A 18 18 ALA CB C 56 15.877 18.076 -2.199 1
1 199 . 6 1 1 A 18 18 ALA N N 56 122.477 122.354 0.123 1
1 200 . 6 1 1 A 19 19 ILE H H 57 8.853 8.027 0.826 1
1 201 . 6 1 1 A 19 19 ILE HA H 57 3.304 3.570 -0.266 1
1 211 . 6 1 1 A 19 19 ILE C C 57 174.710 177.792 -3.082 1
1 212 . 6 1 1 A 19 19 ILE CA C 57 63.373 65.419 -2.046 1
1 213 . 6 1 1 A 19 19 ILE CB C 57 35.250 37.869 -2.619 1
1 217 . 6 1 1 A 19 19 ILE N N 57 120.901 118.663 2.238 1
1 218 . 6 1 1 A 20 20 ALA H H 58 8.702 8.436 0.266 1
1 219 . 6 1 1 A 20 20 ALA HA H 58 3.900 4.052 -0.152 1
1 223 . 6 1 1 A 20 20 ALA C C 58 176.512 179.989 -3.477 1
1 224 . 6 1 1 A 20 20 ALA CA C 58 52.749 55.495 -2.746 1
1 225 . 6 1 1 A 20 20 ALA CB C 58 15.252 18.041 -2.789 1
1 226 . 6 1 1 A 20 20 ALA N N 58 121.763 122.478 -0.715 1
1 227 . 6 1 1 A 21 21 ALA H H 59 7.662 7.923 -0.261 1
1 228 . 6 1 1 A 21 21 ALA HA H 59 4.136 4.229 -0.093 1
1 232 . 6 1 1 A 21 21 ALA C C 59 177.949 179.858 -1.909 1
1 233 . 6 1 1 A 21 21 ALA CA C 59 52.749 54.897 -2.148 1
1 234 . 6 1 1 A 21 21 ALA CB C 59 15.252 18.502 -3.250 1
1 235 . 6 1 1 A 21 21 ALA N N 59 119.079 119.531 -0.452 1
1 236 . 6 1 1 A 22 22 ALA H H 60 7.403 7.604 -0.201 1
1 237 . 6 1 1 A 22 22 ALA HA H 60 4.318 4.172 0.146 1
1 241 . 6 1 1 A 22 22 ALA C C 60 176.730 180.075 -3.345 1
1 242 . 6 1 1 A 22 22 ALA CA C 60 52.749 54.569 -1.820 1
1 243 . 6 1 1 A 22 22 ALA CB C 60 17.126 18.522 -1.396 1
1 244 . 6 1 1 A 22 22 ALA N N 60 122.616 120.243 2.373 1
1 245 . 6 1 1 A 23 23 LEU H H 61 8.410 8.607 -0.197 1
1 246 . 6 1 1 A 23 23 LEU HA H 61 3.527 3.952 -0.425 1
1 256 . 6 1 1 A 23 23 LEU C C 61 176.057 178.643 -2.586 1
1 257 . 6 1 1 A 23 23 LEU CA C 61 55.249 57.290 -2.041 1
1 258 . 6 1 1 A 23 23 LEU CB C 61 39.000 40.737 -1.737 1
1 262 . 6 1 1 A 23 23 LEU N N 61 120.761 121.157 -0.396 1
1 263 . 6 1 1 A 24 24 ASP H H 62 8.227 8.077 0.150 1
1 264 . 6 1 1 A 24 24 ASP HA H 62 4.581 4.587 -0.006 1
1 267 . 6 1 1 A 24 24 ASP C C 62 176.968 177.774 -0.806 1
1 268 . 6 1 1 A 24 24 ASP CA C 62 55.874 56.646 -0.772 1
1 269 . 6 1 1 A 24 24 ASP CB C 62 37.750 40.635 -2.885 1
1 270 . 6 1 1 A 24 24 ASP N N 62 119.068 119.615 -0.547 1
1 271 . 6 1 1 A 25 25 MET H H 63 7.718 7.908 -0.190 1
1 272 . 6 1 1 A 25 25 MET HA H 63 4.196 4.246 -0.050 1
1 277 . 6 1 1 A 25 25 MET C C 63 174.968 177.685 -2.717 1
1 278 . 6 1 1 A 25 25 MET CA C 63 55.249 58.173 -2.924 1
1 279 . 6 1 1 A 25 25 MET CB C 63 29.626 32.486 -2.860 1
1 281 . 6 1 1 A 25 25 MET N N 63 121.365 118.542 2.823 1
1 282 . 6 1 1 A 26 26 TYR H H 64 8.401 7.544 0.857 1
1 283 . 6 1 1 A 26 26 TYR HA H 64 4.400 3.438 0.962 1
1 291 . 6 1 1 A 26 26 TYR C C 64 176.098 177.383 -1.285 1
1 292 . 6 1 1 A 26 26 TYR CA C 64 58.999 60.815 -1.816 1
1 293 . 6 1 1 A 26 26 TYR CB C 64 35.250 38.157 -2.907 1
1 294 . 6 1 1 A 26 26 TYR N N 64 122.575 121.476 1.099 1
1 295 . 6 1 1 A 27 27 LYS H H 65 8.330 8.174 0.156 1
1 296 . 6 1 1 A 27 27 LYS HA H 65 3.568 4.127 -0.559 1
1 302 . 6 1 1 A 27 27 LYS C C 65 176.156 178.309 -2.153 1
1 303 . 6 1 1 A 27 27 LYS CA C 65 56.499 59.032 -2.533 1
1 304 . 6 1 1 A 27 27 LYS CB C 65 29.626 31.817 -2.191 1
1 306 . 6 1 1 A 27 27 LYS N N 65 121.390 118.713 2.677 1
1 307 . 6 1 1 A 28 28 LEU H H 66 7.833 7.381 0.452 1
1 308 . 6 1 1 A 28 28 LEU HA H 66 3.769 4.158 -0.389 1
1 318 . 6 1 1 A 28 28 LEU C C 66 175.925 178.344 -2.419 1
1 319 . 6 1 1 A 28 28 LEU CA C 66 55.874 56.555 -0.681 1
1 320 . 6 1 1 A 28 28 LEU CB C 66 38.375 41.673 -3.298 1
1 324 . 6 1 1 A 28 28 LEU N N 66 123.068 119.164 3.904 1
1 325 . 6 1 1 A 29 29 ASP H H 67 7.292 7.873 -0.581 1
1 326 . 6 1 1 A 29 29 ASP HA H 67 4.096 4.356 -0.260 1
1 329 . 6 1 1 A 29 29 ASP C C 67 174.618 176.663 -2.045 1
1 330 . 6 1 1 A 29 29 ASP CA C 67 53.999 56.312 -2.313 1
1 331 . 6 1 1 A 29 29 ASP CB C 67 38.375 40.808 -2.433 1
1 332 . 6 1 1 A 29 29 ASP N N 67 114.729 119.282 -4.553 1
1 333 . 6 1 1 A 30 30 ASN H H 68 8.097 7.481 0.616 1
1 334 . 6 1 1 A 30 30 ASN HA H 68 4.337 4.346 -0.009 1
1 339 . 6 1 1 A 30 30 ASN C C 68 172.822 174.218 -1.396 1
1 340 . 6 1 1 A 30 30 ASN CA C 68 52.124 52.012 0.112 1
1 341 . 6 1 1 A 30 30 ASN CB C 68 37.750 38.268 -0.518 1
1 342 . 6 1 1 A 30 30 ASN N N 68 111.054 115.069 -4.015 1
1 344 . 6 1 1 A 31 31 PHE H H 69 8.249 7.919 0.330 1
1 345 . 6 1 1 A 31 31 PHE HA H 69 4.135 4.454 -0.319 1
1 353 . 6 1 1 A 31 31 PHE C C 69 170.485 174.217 -3.732 1
1 354 . 6 1 1 A 31 31 PHE CA C 69 57.749 58.712 -0.963 1
1 355 . 6 1 1 A 31 31 PHE CB C 69 33.375 36.562 -3.187 1
1 356 . 6 1 1 A 31 31 PHE N N 69 116.277 117.230 -0.953 1
1 357 . 6 1 1 A 32 32 ALA H H 70 7.224 7.063 0.161 1
1 358 . 6 1 1 A 32 32 ALA HA H 70 4.194 4.511 -0.317 1
1 362 . 6 1 1 A 32 32 ALA C C 70 173.337 175.023 -1.686 1
1 363 . 6 1 1 A 32 32 ALA CA C 70 48.374 51.520 -3.146 1
1 364 . 6 1 1 A 32 32 ALA CB C 70 19.626 22.271 -2.645 1
1 365 . 6 1 1 A 32 32 ALA N N 70 119.914 120.309 -0.395 1
1 366 . 6 1 1 A 33 33 TYR H H 71 7.948 8.427 -0.479 1
1 367 . 6 1 1 A 33 33 TYR HA H 71 4.209 4.992 -0.783 1
1 374 . 6 1 1 A 33 33 TYR C C 71 170.591 174.208 -3.617 1
1 375 . 6 1 1 A 33 33 TYR CA C 71 54.624 56.319 -1.695 1
1 376 . 6 1 1 A 33 33 TYR CB C 71 34.000 37.764 -3.764 1
1 377 . 6 1 1 A 33 33 TYR N N 71 116.929 118.038 -1.109 1
1 378 . 6 1 1 A 34 34 PRO HA H 72 4.444 4.771 -0.327 1
1 381 . 6 1 1 A 34 34 PRO C C 72 174.775 176.354 -1.579 1
1 382 . 6 1 1 A 34 34 PRO CA C 72 59.624 62.522 -2.898 1
1 383 . 6 1 1 A 34 34 PRO CB C 72 28.376 32.206 -3.830 1
1 384 . 6 1 1 A 35 35 SER H H 73 8.721 8.433 0.288 1
1 385 . 6 1 1 A 35 35 SER HA H 73 4.467 4.758 -0.291 1
1 388 . 6 1 1 A 35 35 SER C C 73 173.271 175.551 -2.280 1
1 389 . 6 1 1 A 35 35 SER CA C 73 55.249 56.733 -1.484 1
1 390 . 6 1 1 A 35 35 SER CB C 73 63.373 65.766 -2.393 1
1 391 . 6 1 1 A 35 35 SER N N 73 118.284 114.618 3.666 1
1 392 . 6 1 1 A 36 36 THR H H 74 8.591 8.947 -0.356 1
1 393 . 6 1 1 A 36 36 THR HA H 74 3.649 4.135 -0.486 1
1 398 . 6 1 1 A 36 36 THR CA C 74 64.623 64.112 0.511 1
1 399 . 6 1 1 A 36 36 THR CB C 74 66.498 68.884 -2.386 1
1 401 . 6 1 1 A 36 36 THR N N 74 117.769 116.985 0.784 1
1 402 . 6 1 1 A 37 37 GLN H H 75 8.210 7.873 0.337 1
1 403 . 6 1 1 A 37 37 GLN HA H 75 3.860 4.439 -0.579 1
1 410 . 6 1 1 A 37 37 GLN C C 75 175.349 177.472 -2.123 1
1 411 . 6 1 1 A 37 37 GLN CA C 75 56.499 57.564 -1.065 1
1 412 . 6 1 1 A 37 37 GLN CB C 75 25.876 29.684 -3.808 1
1 414 . 6 1 1 A 37 37 GLN N N 75 117.931 119.869 -1.938 1
1 416 . 6 1 1 A 38 38 GLN H H 76 7.667 8.201 -0.534 1
1 417 . 6 1 1 A 38 38 GLN HA H 76 3.810 4.122 -0.312 1
1 424 . 6 1 1 A 38 38 GLN C C 76 175.805 179.552 -3.747 1
1 425 . 6 1 1 A 38 38 GLN CA C 76 55.874 58.560 -2.686 1
1 426 . 6 1 1 A 38 38 GLN CB C 76 25.876 28.233 -2.357 1
1 428 . 6 1 1 A 38 38 GLN N N 76 120.607 118.004 2.603 1
1 430 . 6 1 1 A 39 39 GLY H H 77 8.470 8.358 0.112 1
1 431 . 6 1 1 A 39 39 GLY HA2 H 77 3.920 3.776 0.144 1
1 432 . 6 1 1 A 39 39 GLY HA3 H 77 3.603 3.803 -0.200 1
1 433 . 6 1 1 A 39 39 GLY C C 77 169.006 175.405 -6.399 1
1 434 . 6 1 1 A 39 39 GLY CA C 77 42.125 46.556 -4.431 1
1 435 . 6 1 1 A 39 39 GLY N N 77 103.281 109.311 -6.030 1
1 436 . 6 1 1 A 40 40 LEU H H 78 8.135 7.837 0.298 1
1 437 . 6 1 1 A 40 40 LEU HA H 78 3.237 4.062 -0.825 1
1 447 . 6 1 1 A 40 40 LEU C C 78 176.383 178.721 -2.338 1
1 448 . 6 1 1 A 40 40 LEU CA C 78 52.749 57.095 -4.346 1
1 449 . 6 1 1 A 40 40 LEU CB C 78 39.000 41.632 -2.632 1
1 453 . 6 1 1 A 40 40 LEU N N 78 114.444 123.378 -8.934 1
1 454 . 6 1 1 A 41 41 GLU H H 79 8.578 8.079 0.499 1
1 455 . 6 1 1 A 41 41 GLU HA H 79 3.720 4.016 -0.296 1
1 460 . 6 1 1 A 41 41 GLU C C 79 175.093 178.059 -2.966 1
1 461 . 6 1 1 A 41 41 GLU CA C 79 57.124 59.301 -2.177 1
1 462 . 6 1 1 A 41 41 GLU CB C 79 26.501 29.093 -2.592 1
1 464 . 6 1 1 A 41 41 GLU N N 79 118.295 118.266 0.029 1
1 465 . 6 1 1 A 42 42 ALA H H 80 7.227 7.871 -0.644 1
1 466 . 6 1 1 A 42 42 ALA HA H 80 4.437 4.795 -0.358 1
1 470 . 6 1 1 A 42 42 ALA C C 80 173.745 178.858 -5.113 1
1 471 . 6 1 1 A 42 42 ALA CA C 80 51.499 53.537 -2.038 1
1 472 . 6 1 1 A 42 42 ALA CB C 80 15.877 18.733 -2.856 1
1 473 . 6 1 1 A 42 42 ALA N N 80 119.751 121.719 -1.968 1
1 474 . 6 1 1 A 43 43 LEU H H 81 7.932 7.848 0.084 1
1 475 . 6 1 1 A 43 43 LEU HA H 81 4.369 4.212 0.157 1
1 485 . 6 1 1 A 43 43 LEU C C 81 174.788 178.017 -3.229 1
1 486 . 6 1 1 A 43 43 LEU CA C 81 53.374 56.887 -3.513 1
1 487 . 6 1 1 A 43 43 LEU CB C 81 39.625 42.571 -2.946 1
1 491 . 6 1 1 A 43 43 LEU N N 81 111.742 119.415 -7.673 1
1 492 . 6 1 1 A 44 44 VAL H H 82 7.886 7.394 0.492 1
1 493 . 6 1 1 A 44 44 VAL HA H 82 4.700 4.075 0.625 1
1 501 . 6 1 1 A 44 44 VAL C C 82 172.875 175.621 -2.746 1
1 502 . 6 1 1 A 44 44 VAL CA C 82 59.624 63.684 -4.060 1
1 503 . 6 1 1 A 44 44 VAL CB C 82 31.501 33.341 -1.840 1
1 506 . 6 1 1 A 44 44 VAL N N 82 113.604 117.110 -3.506 1
1 507 . 6 1 1 A 45 45 LYS H H 83 8.361 8.129 0.232 1
1 508 . 6 1 1 A 45 45 LYS HA H 83 4.251 4.842 -0.591 1
1 515 . 6 1 1 A 45 45 LYS C C 83 171.053 175.929 -4.876 1
1 516 . 6 1 1 A 45 45 LYS CA C 83 52.749 54.372 -1.623 1
1 517 . 6 1 1 A 45 45 LYS CB C 83 33.375 36.521 -3.146 1
1 521 . 6 1 1 A 45 45 LYS N N 83 123.860 118.316 5.544 1
1 522 . 6 1 1 A 46 46 LYS H H 84 7.243 7.879 -0.636 1
1 523 . 6 1 1 A 46 46 LYS HA H 84 2.175 2.827 -0.652 1
1 532 . 6 1 1 A 46 46 LYS C C 84 172.123 174.555 -2.432 1
1 533 . 6 1 1 A 46 46 LYS CA C 84 52.749 54.281 -1.532 1
1 534 . 6 1 1 A 46 46 LYS CB C 84 29.626 31.762 -2.136 1
1 537 . 6 1 1 A 46 46 LYS N N 84 128.615 122.078 6.537 1
1 538 . 6 1 1 A 47 47 PRO HA H 85 4.470 4.321 0.149 1
1 541 . 6 1 1 A 47 47 PRO C C 85 173.754 176.180 -2.426 1
1 542 . 6 1 1 A 47 47 PRO CA C 85 60.874 63.193 -2.319 1
1 543 . 6 1 1 A 47 47 PRO CB C 85 30.876 31.840 -0.964 1
1 546 . 6 1 1 A 48 48 THR H H 86 8.306 8.371 -0.065 1
1 547 . 6 1 1 A 48 48 THR HA H 86 4.287 4.958 -0.671 1
1 552 . 6 1 1 A 48 48 THR C C 86 173.070 173.753 -0.683 1
1 553 . 6 1 1 A 48 48 THR CA C 86 57.749 60.536 -2.787 1
1 554 . 6 1 1 A 48 48 THR CB C 86 67.748 70.105 -2.357 1
1 556 . 6 1 1 A 48 48 THR N N 86 109.564 112.532 -2.968 1
1 557 . 6 1 1 A 49 49 GLY H H 87 8.317 8.309 0.008 1
1 558 . 6 1 1 A 49 49 GLY HA2 H 87 3.851 4.190 -0.339 1
1 559 . 6 1 1 A 49 49 GLY HA3 H 87 3.678 4.204 -0.526 1
1 560 . 6 1 1 A 49 49 GLY C C 87 169.693 172.181 -2.488 1
1 561 . 6 1 1 A 49 49 GLY CA C 87 42.125 45.674 -3.549 1
1 562 . 6 1 1 A 49 49 GLY N N 87 109.071 109.719 -0.648 1
1 563 . 6 1 1 A 50 50 ASN H H 88 8.301 8.413 -0.112 1
1 564 . 6 1 1 A 50 50 ASN HA H 88 4.780 5.393 -0.613 1
1 569 . 6 1 1 A 50 50 ASN C C 88 171.370 172.526 -1.156 1
1 570 . 6 1 1 A 50 50 ASN CA C 88 47.749 50.408 -2.659 1
1 571 . 6 1 1 A 50 50 ASN CB C 88 37.125 39.583 -2.458 1
1 572 . 6 1 1 A 50 50 ASN N N 88 115.631 122.515 -6.884 1
1 574 . 6 1 1 A 51 51 PRO HA H 89 4.782 4.584 0.198 1
1 577 . 6 1 1 A 51 51 PRO C C 89 173.656 175.561 -1.905 1
1 578 . 6 1 1 A 51 51 PRO CA C 89 59.624 62.060 -2.436 1
1 579 . 6 1 1 A 51 51 PRO CB C 89 31.501 32.709 -1.208 1
1 582 . 6 1 1 A 52 52 GLN H H 90 9.076 9.316 -0.240 1
1 583 . 6 1 1 A 52 52 GLN HA H 90 4.469 4.823 -0.354 1
1 590 . 6 1 1 A 52 52 GLN C C 90 172.386 174.188 -1.802 1
1 591 . 6 1 1 A 52 52 GLN CA C 90 50.874 52.974 -2.100 1
1 592 . 6 1 1 A 52 52 GLN CB C 90 26.501 31.866 -5.365 1
1 594 . 6 1 1 A 52 52 GLN N N 90 126.827 120.574 6.253 1
1 596 . 6 1 1 A 53 53 PRO HA H 91 4.384 4.479 -0.095 1
1 599 . 6 1 1 A 53 53 PRO C C 91 174.274 175.408 -1.134 1
1 600 . 6 1 1 A 53 53 PRO CB C 91 28.113 31.702 -3.589 1
1 601 . 6 1 1 A 54 54 LYS H H 92 8.401 8.779 -0.378 1
1 602 . 6 1 1 A 54 54 LYS HA H 92 3.984 4.786 -0.802 1
1 611 . 6 1 1 A 54 54 LYS C C 92 173.516 174.606 -1.090 1
1 612 . 6 1 1 A 54 54 LYS CA C 92 55.249 55.449 -0.200 1
1 613 . 6 1 1 A 54 54 LYS CB C 92 30.876 36.171 -5.295 1
1 615 . 6 1 1 A 54 54 LYS N N 92 124.538 124.242 0.296 1
1 616 . 6 1 1 A 55 55 ASN H H 93 8.183 8.659 -0.476 1
1 617 . 6 1 1 A 55 55 ASN HA H 93 4.716 4.934 -0.218 1
1 622 . 6 1 1 A 55 55 ASN CA C 93 48.999 52.581 -3.582 1
1 623 . 6 1 1 A 55 55 ASN CB C 93 35.875 38.574 -2.699 1
1 624 . 6 1 1 A 55 55 ASN N N 93 118.677 124.247 -5.570 1
1 626 . 6 1 1 A 56 56 TRP H H 94 8.007 8.589 -0.582 1
1 627 . 6 1 1 A 56 56 TRP HA H 94 3.827 5.450 -1.623 1
1 635 . 6 1 1 A 56 56 TRP C C 94 173.760 175.182 -1.422 1
1 636 . 6 1 1 A 56 56 TRP CA C 94 59.624 59.110 0.514 1
1 637 . 6 1 1 A 56 56 TRP CB C 94 27.126 30.392 -3.266 1
1 638 . 6 1 1 A 56 56 TRP N N 94 122.195 129.517 -7.322 1
1 640 . 6 1 1 A 57 57 ASN H H 95 7.563 7.316 0.247 1
1 641 . 6 1 1 A 57 57 ASN HA H 95 3.735 4.851 -1.116 1
1 646 . 6 1 1 A 57 57 ASN C C 95 171.952 173.991 -2.039 1
1 647 . 6 1 1 A 57 57 ASN CA C 95 51.499 50.793 0.706 1
1 648 . 6 1 1 A 57 57 ASN CB C 95 35.250 41.196 -5.946 1
1 649 . 6 1 1 A 57 57 ASN N N 95 129.659 125.110 4.549 1
1 651 . 6 1 1 A 58 58 LYS H H 96 8.110 8.053 0.057 1
1 652 . 6 1 1 A 58 58 LYS HA H 96 4.035 3.643 0.392 1
1 659 . 6 1 1 A 58 58 LYS C C 96 174.530 175.670 -1.140 1
1 660 . 6 1 1 A 58 58 LYS CA C 96 56.499 55.183 1.316 1
1 661 . 6 1 1 A 58 58 LYS CB C 96 29.626 33.120 -3.494 1
1 665 . 6 1 1 A 58 58 LYS N N 96 123.913 123.377 0.536 1
1 666 . 6 1 1 A 59 59 ASP H H 97 7.903 9.227 -1.324 1
1 667 . 6 1 1 A 59 59 ASP HA H 97 4.393 4.356 0.037 1
1 670 . 6 1 1 A 59 59 ASP C C 97 173.724 175.340 -1.616 1
1 671 . 6 1 1 A 59 59 ASP CA C 97 52.124 55.062 -2.938 1
1 672 . 6 1 1 A 59 59 ASP CB C 97 38.375 39.916 -1.541 1
1 673 . 6 1 1 A 59 59 ASP N N 97 118.773 120.037 -1.264 1
1 674 . 6 1 1 A 60 60 GLY H H 98 7.819 8.121 -0.302 1
1 675 . 6 1 1 A 60 60 GLY HA2 H 98 3.917 3.952 -0.035 1
1 676 . 6 1 1 A 60 60 GLY HA3 H 98 3.917 4.206 -0.289 1
1 677 . 6 1 1 A 60 60 GLY C C 98 168.652 174.410 -5.758 1
1 678 . 6 1 1 A 60 60 GLY CA C 98 41.500 45.180 -3.680 1
1 679 . 6 1 1 A 60 60 GLY N N 98 108.742 104.939 3.803 1
1 680 . 6 1 1 A 61 61 TYR H H 99 8.105 7.724 0.381 1
1 681 . 6 1 1 A 61 61 TYR HA H 99 3.927 4.059 -0.132 1
1 689 . 6 1 1 A 61 61 TYR C C 99 172.831 174.430 -1.599 1
1 690 . 6 1 1 A 61 61 TYR CA C 99 57.124 58.247 -1.123 1
1 691 . 6 1 1 A 61 61 TYR CB C 99 37.125 36.660 0.465 1
1 692 . 6 1 1 A 61 61 TYR N N 99 113.836 117.935 -4.099 1
1 693 . 6 1 1 A 62 62 LEU H H 100 7.352 8.263 -0.911 1
1 694 . 6 1 1 A 62 62 LEU HA H 100 4.343 4.964 -0.621 1
1 704 . 6 1 1 A 62 62 LEU C C 100 173.430 175.250 -1.820 1
1 705 . 6 1 1 A 62 62 LEU CA C 100 50.874 53.195 -2.321 1
1 706 . 6 1 1 A 62 62 LEU CB C 100 44.000 45.332 -1.332 1
1 710 . 6 1 1 A 62 62 LEU N N 100 117.112 122.949 -5.837 1
1 711 . 6 1 1 A 63 63 LYS H H 101 8.626 8.501 0.125 1
1 712 . 6 1 1 A 63 63 LYS HA H 101 3.986 4.579 -0.593 1
1 721 . 6 1 1 A 63 63 LYS C C 101 173.851 177.769 -3.918 1
1 722 . 6 1 1 A 63 63 LYS CA C 101 55.249 55.059 0.190 1
1 723 . 6 1 1 A 63 63 LYS CB C 101 29.626 33.959 -4.333 1
1 724 . 6 1 1 A 63 63 LYS N N 101 129.991 121.251 8.740 1
1 725 . 6 1 1 A 64 64 LYS H H 102 7.059 8.661 -1.602 1
1 726 . 6 1 1 A 64 64 LYS HA H 102 4.138 4.258 -0.120 1
1 735 . 6 1 1 A 64 64 LYS C C 102 171.120 175.931 -4.811 1
1 736 . 6 1 1 A 64 64 LYS CA C 102 52.749 56.642 -3.893 1
1 737 . 6 1 1 A 64 64 LYS CB C 102 32.750 31.861 0.889 1
1 740 . 6 1 1 A 64 64 LYS N N 102 113.255 120.702 -7.447 1
1 741 . 6 1 1 A 65 65 LEU H H 103 8.883 7.285 1.598 1
1 742 . 6 1 1 A 65 65 LEU HA H 103 4.475 4.552 -0.077 1
1 752 . 6 1 1 A 65 65 LEU C C 103 171.487 174.848 -3.361 1
1 753 . 6 1 1 A 65 65 LEU CA C 103 48.999 52.478 -3.479 1
1 754 . 6 1 1 A 65 65 LEU CB C 103 39.625 41.858 -2.233 1
1 758 . 6 1 1 A 65 65 LEU N N 103 126.355 122.221 4.134 1
1 759 . 6 1 1 A 66 66 PRO HA H 104 4.449 4.567 -0.118 1
1 764 . 6 1 1 A 66 66 PRO C C 104 173.363 176.063 -2.700 1
1 765 . 6 1 1 A 66 66 PRO CA C 104 60.249 62.152 -1.903 1
1 766 . 6 1 1 A 66 66 PRO CB C 104 29.626 33.164 -3.538 1
1 769 . 6 1 1 A 67 67 VAL H H 105 7.682 8.360 -0.678 1
1 770 . 6 1 1 A 67 67 VAL HA H 105 4.121 4.580 -0.459 1
1 778 . 6 1 1 A 67 67 VAL C C 105 171.667 174.436 -2.769 1
1 779 . 6 1 1 A 67 67 VAL CA C 105 58.374 60.268 -1.894 1
1 780 . 6 1 1 A 67 67 VAL CB C 105 30.251 33.749 -3.498 1
1 783 . 6 1 1 A 67 67 VAL N N 105 114.671 121.094 -6.423 1
1 784 . 6 1 1 A 68 68 ASP H H 106 8.216 8.043 0.173 1
1 785 . 6 1 1 A 68 68 ASP HA H 106 4.474 4.647 -0.173 1
1 788 . 6 1 1 A 68 68 ASP C C 106 172.452 174.743 -2.291 1
1 789 . 6 1 1 A 68 68 ASP CA C 106 50.249 51.979 -1.730 1
1 790 . 6 1 1 A 68 68 ASP CB C 106 37.750 40.442 -2.692 1
1 791 . 6 1 1 A 68 68 ASP N N 106 123.825 125.916 -2.091 1
1 792 . 6 1 1 A 69 69 PRO HA H 107 3.920 3.982 -0.062 1
1 797 . 6 1 1 A 69 69 PRO CA C 107 62.123 63.083 -0.960 1
1 798 . 6 1 1 A 69 69 PRO CB C 107 27.751 31.508 -3.757 1
1 801 . 6 1 1 A 70 70 TRP H H 108 8.156 8.458 -0.302 1
1 802 . 6 1 1 A 70 70 TRP HA H 108 4.274 4.302 -0.028 1
1 811 . 6 1 1 A 70 70 TRP CA C 108 57.124 58.347 -1.223 1
1 812 . 6 1 1 A 70 70 TRP CB C 108 25.251 27.207 -1.956 1
1 813 . 6 1 1 A 70 70 TRP N N 108 118.137 117.489 0.648 1
1 815 . 6 1 1 A 71 71 GLY H H 109 8.209 8.708 -0.499 1
1 816 . 6 1 1 A 71 71 GLY HA2 H 109 4.030 3.822 0.208 1
1 817 . 6 1 1 A 71 71 GLY HA3 H 109 3.303 3.860 -0.557 1
1 818 . 6 1 1 A 71 71 GLY CA C 109 42.750 45.753 -3.003 1
1 819 . 6 1 1 A 71 71 GLY N N 109 107.495 105.457 2.038 1
1 820 . 6 1 1 A 72 72 ASN H H 110 8.116 7.694 0.422 1
1 821 . 6 1 1 A 72 72 ASN HA H 110 5.103 4.876 0.227 1
1 826 . 6 1 1 A 72 72 ASN CA C 110 48.374 50.409 -2.035 1
1 827 . 6 1 1 A 72 72 ASN CB C 110 36.500 38.920 -2.420 1
1 828 . 6 1 1 A 72 72 ASN N N 110 120.108 119.805 0.303 1
1 830 . 6 1 1 A 73 73 PRO HA H 111 4.397 4.385 0.012 1
1 835 . 6 1 1 A 73 73 PRO C C 111 176.229 176.519 -0.290 1
1 836 . 6 1 1 A 73 73 PRO CA C 111 60.249 62.616 -2.367 1
1 837 . 6 1 1 A 73 73 PRO CB C 111 29.001 31.760 -2.759 1
1 840 . 6 1 1 A 74 74 TYR H H 112 8.893 8.502 0.391 1
1 841 . 6 1 1 A 74 74 TYR HA H 112 4.064 4.783 -0.719 1
1 849 . 6 1 1 A 74 74 TYR C C 112 171.951 176.058 -4.107 1
1 850 . 6 1 1 A 74 74 TYR CA C 112 60.249 58.304 1.945 1
1 851 . 6 1 1 A 74 74 TYR CB C 112 36.500 39.295 -2.795 1
1 852 . 6 1 1 A 74 74 TYR N N 112 124.595 121.272 3.323 1
1 853 . 6 1 1 A 75 75 GLN H H 113 9.127 8.989 0.138 1
1 854 . 6 1 1 A 75 75 GLN HA H 113 4.019 4.365 -0.346 1
1 861 . 6 1 1 A 75 75 GLN C C 113 171.436 174.517 -3.081 1
1 862 . 6 1 1 A 75 75 GLN CA C 113 50.874 54.633 -3.759 1
1 863 . 6 1 1 A 75 75 GLN CB C 113 29.469 29.561 -0.092 1
1 865 . 6 1 1 A 75 75 GLN N N 113 120.777 122.020 -1.243 1
1 867 . 6 1 1 A 76 76 TYR H H 114 7.906 8.492 -0.586 1
1 868 . 6 1 1 A 76 76 TYR HA H 114 5.586 5.673 -0.087 1
1 875 . 6 1 1 A 76 76 TYR C C 114 171.343 175.069 -3.726 1
1 876 . 6 1 1 A 76 76 TYR CA C 114 53.999 55.870 -1.871 1
1 877 . 6 1 1 A 76 76 TYR CB C 114 40.250 40.764 -0.514 1
1 878 . 6 1 1 A 76 76 TYR N N 114 120.757 122.082 -1.325 1
1 879 . 6 1 1 A 77 77 LEU H H 115 8.261 9.160 -0.899 1
1 880 . 6 1 1 A 77 77 LEU HA H 115 4.280 5.162 -0.882 1
1 890 . 6 1 1 A 77 77 LEU C C 115 170.921 176.186 -5.265 1
1 891 . 6 1 1 A 77 77 LEU CA C 115 51.499 53.603 -2.104 1
1 892 . 6 1 1 A 77 77 LEU CB C 115 44.625 45.607 -0.982 1
1 896 . 6 1 1 A 77 77 LEU N N 115 130.662 125.911 4.751 1
1 897 . 6 1 1 A 78 78 ALA H H 116 7.973 8.287 -0.314 1
1 898 . 6 1 1 A 78 78 ALA HA H 116 4.292 4.681 -0.389 1
1 902 . 6 1 1 A 78 78 ALA C C 116 172.093 175.323 -3.230 1
1 903 . 6 1 1 A 78 78 ALA CA C 116 47.749 50.254 -2.505 1
1 904 . 6 1 1 A 78 78 ALA CB C 116 19.626 19.770 -0.144 1
1 905 . 6 1 1 A 78 78 ALA N N 116 125.564 125.720 -0.156 1
1 906 . 6 1 1 A 79 79 PRO HA H 117 4.698 5.163 -0.465 1
1 911 . 6 1 1 A 79 79 PRO C C 117 173.994 176.970 -2.976 1
1 912 . 6 1 1 A 79 79 PRO CA C 117 60.249 63.538 -3.289 1
1 913 . 6 1 1 A 79 79 PRO CB C 117 31.501 31.890 -0.389 1
1 916 . 6 1 1 A 80 80 GLY H H 118 7.096 8.351 -1.255 1
1 917 . 6 1 1 A 80 80 GLY HA2 H 118 3.797 3.785 0.012 1
1 918 . 6 1 1 A 80 80 GLY HA3 H 118 3.517 3.867 -0.350 1
1 919 . 6 1 1 A 80 80 GLY C C 118 171.404 174.240 -2.836 1
1 920 . 6 1 1 A 80 80 GLY CA C 118 41.500 46.677 -5.177 1
1 921 . 6 1 1 A 80 80 GLY N N 118 108.306 108.573 -0.267 1
1 922 . 6 1 1 A 81 81 THR H H 119 9.810 8.019 1.791 1
1 923 . 6 1 1 A 81 81 THR HA H 119 4.091 4.513 -0.422 1
1 928 . 6 1 1 A 81 81 THR C C 119 174.242 174.582 -0.340 1
1 929 . 6 1 1 A 81 81 THR CA C 119 60.874 60.531 0.343 1
1 930 . 6 1 1 A 81 81 THR CB C 119 66.498 69.005 -2.507 1
1 932 . 6 1 1 A 81 81 THR N N 119 112.813 113.662 -0.849 1
1 933 . 6 1 1 A 82 82 LYS H H 120 8.964 8.662 0.302 1
1 934 . 6 1 1 A 82 82 LYS HA H 120 4.150 3.879 0.271 1
1 941 . 6 1 1 A 82 82 LYS C C 120 172.886 175.870 -2.984 1
1 942 . 6 1 1 A 82 82 LYS CA C 120 53.999 57.637 -3.638 1
1 943 . 6 1 1 A 82 82 LYS CB C 120 30.876 30.364 0.512 1
1 944 . 6 1 1 A 82 82 LYS N N 120 123.569 124.782 -1.213 1
1 945 . 6 1 1 A 83 83 GLY H H 121 7.125 8.005 -0.880 1
1 946 . 6 1 1 A 83 83 GLY HA2 H 121 3.814 4.052 -0.238 1
1 947 . 6 1 1 A 83 83 GLY HA3 H 121 3.814 4.110 -0.296 1
1 948 . 6 1 1 A 83 83 GLY C C 121 167.671 174.500 -6.829 1
1 949 . 6 1 1 A 83 83 GLY CA C 121 42.125 44.303 -2.178 1
1 950 . 6 1 1 A 83 83 GLY N N 121 107.253 107.740 -0.487 1
1 951 . 6 1 1 A 84 84 PRO HA H 122 4.077 4.330 -0.253 1
1 958 . 6 1 1 A 84 84 PRO C C 122 175.199 176.725 -1.526 1
1 959 . 6 1 1 A 84 84 PRO CA C 122 63.373 64.537 -1.164 1
1 960 . 6 1 1 A 84 84 PRO CB C 122 30.251 31.814 -1.563 1
1 962 . 6 1 1 A 85 85 PHE H H 123 6.652 6.666 -0.014 1
1 963 . 6 1 1 A 85 85 PHE HA H 123 4.744 4.804 -0.060 1
1 971 . 6 1 1 A 85 85 PHE C C 123 170.340 172.374 -2.034 1
1 972 . 6 1 1 A 85 85 PHE CA C 123 53.999 56.160 -2.161 1
1 973 . 6 1 1 A 85 85 PHE CB C 123 39.000 40.674 -1.674 1
1 974 . 6 1 1 A 85 85 PHE N N 123 108.468 112.173 -3.705 1
1 975 . 6 1 1 A 86 86 ASP H H 124 9.268 9.185 0.083 1
1 976 . 6 1 1 A 86 86 ASP HA H 124 5.108 5.182 -0.074 1
1 979 . 6 1 1 A 86 86 ASP C C 124 171.180 174.709 -3.529 1
1 980 . 6 1 1 A 86 86 ASP CA C 124 50.249 53.568 -3.319 1
1 981 . 6 1 1 A 86 86 ASP CB C 124 40.250 43.065 -2.815 1
1 982 . 6 1 1 A 86 86 ASP N N 124 121.741 119.227 2.514 1
1 983 . 6 1 1 A 87 87 LEU H H 125 8.018 9.330 -1.312 1
1 984 . 6 1 1 A 87 87 LEU HA H 125 5.809 5.603 0.206 1
1 994 . 6 1 1 A 87 87 LEU C C 125 171.350 175.083 -3.733 1
1 995 . 6 1 1 A 87 87 LEU CA C 125 50.874 53.573 -2.699 1
1 996 . 6 1 1 A 87 87 LEU CB C 125 44.318 45.271 -0.953 1
1 999 . 6 1 1 A 87 87 LEU N N 125 123.629 127.441 -3.812 1
1 1000 . 6 1 1 A 88 88 TYR H H 126 8.912 8.553 0.359 1
1 1001 . 6 1 1 A 88 88 TYR HA H 126 5.630 5.620 0.010 1
1 1008 . 6 1 1 A 88 88 TYR C C 126 171.410 172.423 -1.013 1
1 1009 . 6 1 1 A 88 88 TYR CA C 126 52.749 56.630 -3.881 1
1 1010 . 6 1 1 A 88 88 TYR CB C 126 37.750 40.493 -2.743 1
1 1011 . 6 1 1 A 88 88 TYR N N 126 119.697 121.750 -2.053 1
1 1012 . 6 1 1 A 89 89 SER H H 127 9.319 9.518 -0.199 1
1 1013 . 6 1 1 A 89 89 SER HA H 127 5.429 5.347 0.082 1
1 1016 . 6 1 1 A 89 89 SER CA C 127 52.124 56.536 -4.412 1
1 1017 . 6 1 1 A 89 89 SER CB C 127 62.748 66.457 -3.709 1
1 1018 . 6 1 1 A 89 89 SER N N 127 112.637 115.681 -3.044 1
1 1019 . 6 1 1 A 90 90 LEU H H 128 8.759 8.431 0.328 1
1 1020 . 6 1 1 A 90 90 LEU HA H 128 4.186 4.463 -0.277 1
1 1030 . 6 1 1 A 90 90 LEU C C 128 175.121 178.128 -3.007 1
1 1031 . 6 1 1 A 90 90 LEU CA C 128 52.749 54.865 -2.116 1
1 1032 . 6 1 1 A 90 90 LEU CB C 128 35.875 42.502 -6.627 1
1 1033 . 6 1 1 A 90 90 LEU N N 128 126.728 125.539 1.189 1
1 1034 . 6 1 1 A 91 91 GLY H H 129 8.356 8.312 0.044 1
1 1035 . 6 1 1 A 91 91 GLY HA2 H 129 3.373 3.862 -0.489 1
1 1036 . 6 1 1 A 91 91 GLY HA3 H 129 3.373 3.890 -0.517 1
1 1037 . 6 1 1 A 91 91 GLY C C 129 172.013 174.466 -2.453 1
1 1038 . 6 1 1 A 91 91 GLY CA C 129 41.500 44.097 -2.597 1
1 1039 . 6 1 1 A 91 91 GLY N N 129 108.559 108.716 -0.157 1
1 1040 . 6 1 1 A 92 92 ALA H H 130 7.047 8.188 -1.141 1
1 1041 . 6 1 1 A 92 92 ALA HA H 130 4.037 3.359 0.678 1
1 1045 . 6 1 1 A 92 92 ALA C C 130 174.890 177.955 -3.065 1
1 1046 . 6 1 1 A 92 92 ALA CA C 130 52.100 53.730 -1.630 1
1 1047 . 6 1 1 A 92 92 ALA CB C 130 16.502 17.611 -1.109 1
1 1048 . 6 1 1 A 92 92 ALA N N 130 118.393 121.652 -3.259 1
1 1049 . 6 1 1 A 93 93 ASP H H 131 7.222 7.578 -0.356 1
1 1050 . 6 1 1 A 93 93 ASP HA H 131 4.122 4.684 -0.562 1
1 1053 . 6 1 1 A 93 93 ASP C C 131 174.890 176.324 -1.434 1
1 1054 . 6 1 1 A 93 93 ASP CA C 131 50.249 53.779 -3.530 1
1 1055 . 6 1 1 A 93 93 ASP CB C 131 37.750 41.349 -3.599 1
1 1056 . 6 1 1 A 93 93 ASP N N 131 111.487 116.511 -5.024 1
1 1057 . 6 1 1 A 94 94 GLY H H 132 7.199 8.451 -1.252 1
1 1058 . 6 1 1 A 94 94 GLY HA2 H 132 3.951 3.924 0.027 1
1 1059 . 6 1 1 A 94 94 GLY HA3 H 132 3.324 3.927 -0.603 1
1 1060 . 6 1 1 A 94 94 GLY C C 132 169.773 173.930 -4.157 1
1 1061 . 6 1 1 A 94 94 GLY CA C 132 44.625 46.502 -1.877 1
1 1062 . 6 1 1 A 94 94 GLY N N 132 106.932 108.612 -1.680 1
1 1063 . 6 1 1 A 95 95 LYS H H 133 7.215 7.569 -0.354 1
1 1064 . 6 1 1 A 95 95 LYS HA H 133 4.513 4.956 -0.443 1
1 1073 . 6 1 1 A 95 95 LYS C C 133 172.108 174.706 -2.598 1
1 1074 . 6 1 1 A 95 95 LYS CA C 133 51.512 54.812 -3.300 1
1 1075 . 6 1 1 A 95 95 LYS CB C 133 34.000 35.693 -1.693 1
1 1076 . 6 1 1 A 95 95 LYS N N 133 115.749 119.444 -3.695 1
1 1077 . 6 1 1 A 96 96 GLU H H 134 9.230 8.706 0.524 1
1 1078 . 6 1 1 A 96 96 GLU HA H 134 4.352 5.101 -0.749 1
1 1083 . 6 1 1 A 96 96 GLU C C 134 175.219 175.332 -0.113 1
1 1084 . 6 1 1 A 96 96 GLU CA C 134 55.874 55.357 0.517 1
1 1085 . 6 1 1 A 96 96 GLU CB C 134 27.126 30.791 -3.665 1
1 1087 . 6 1 1 A 96 96 GLU N N 134 128.571 123.536 5.035 1
1 1088 . 6 1 1 A 97 97 GLY H H 135 10.677 8.462 2.215 1
1 1089 . 6 1 1 A 97 97 GLY HA2 H 135 4.037 4.358 -0.321 1
1 1090 . 6 1 1 A 97 97 GLY HA3 H 135 3.717 4.360 -0.643 1
1 1091 . 6 1 1 A 97 97 GLY C C 135 171.567 172.371 -0.804 1
1 1092 . 6 1 1 A 97 97 GLY CA C 135 41.500 45.774 -4.274 1
1 1093 . 6 1 1 A 97 97 GLY N N 135 117.011 110.607 6.404 1
1 1094 . 6 1 1 A 98 98 GLY H H 136 8.442 8.663 -0.221 1
1 1095 . 6 1 1 A 98 98 GLY HA2 H 136 4.195 4.232 -0.037 1
1 1096 . 6 1 1 A 98 98 GLY HA3 H 136 4.195 4.233 -0.038 1
1 1097 . 6 1 1 A 98 98 GLY C C 136 170.299 173.289 -2.990 1
1 1098 . 6 1 1 A 98 98 GLY CA C 136 40.875 44.769 -3.894 1
1 1099 . 6 1 1 A 98 98 GLY N N 136 109.494 109.239 0.255 1
1 1100 . 6 1 1 A 99 99 SER H H 137 8.701 8.835 -0.134 1
1 1101 . 6 1 1 A 99 99 SER HA H 137 4.639 4.915 -0.276 1
1 1104 . 6 1 1 A 99 99 SER C C 137 170.630 173.398 -2.768 1
1 1105 . 6 1 1 A 99 99 SER CA C 137 54.624 57.535 -2.911 1
1 1106 . 6 1 1 A 99 99 SER CB C 137 62.748 66.544 -3.796 1
1 1107 . 6 1 1 A 99 99 SER N N 137 114.685 118.877 -4.192 1
1 1108 . 6 1 1 A 100 100 ASP H H 138 9.117 8.896 0.221 1
1 1109 . 6 1 1 A 100 100 ASP HA H 138 3.965 4.406 -0.441 1
1 1112 . 6 1 1 A 100 100 ASP C C 138 175.540 177.834 -2.294 1
1 1113 . 6 1 1 A 100 100 ASP CA C 138 54.624 57.094 -2.470 1
1 1114 . 6 1 1 A 100 100 ASP CB C 138 36.500 40.641 -4.141 1
1 1115 . 6 1 1 A 100 100 ASP N N 138 120.777 122.673 -1.896 1
1 1116 . 6 1 1 A 101 101 ASN H H 139 8.667 8.246 0.421 1
1 1117 . 6 1 1 A 101 101 ASN HA H 139 4.333 4.743 -0.410 1
1 1122 . 6 1 1 A 101 101 ASN CA C 139 53.999 52.534 1.465 1
1 1123 . 6 1 1 A 101 101 ASN CB C 139 34.625 38.524 -3.899 1
1 1124 . 6 1 1 A 101 101 ASN N N 139 121.930 115.282 6.648 1
1 1126 . 6 1 1 A 102 102 ASP H H 140 7.714 7.902 -0.188 1
1 1127 . 6 1 1 A 102 102 ASP HA H 140 4.037 4.495 -0.458 1
1 1130 . 6 1 1 A 102 102 ASP C C 140 172.807 175.873 -3.066 1
1 1131 . 6 1 1 A 102 102 ASP CA C 140 53.374 53.403 -0.029 1
1 1132 . 6 1 1 A 102 102 ASP CB C 140 37.125 40.693 -3.568 1
1 1133 . 6 1 1 A 102 102 ASP N N 140 118.011 118.534 -0.523 1
1 1134 . 6 1 1 A 103 103 ALA H H 141 7.060 7.326 -0.266 1
1 1135 . 6 1 1 A 103 103 ALA HA H 141 3.353 4.824 -1.471 1
1 1139 . 6 1 1 A 103 103 ALA C C 141 172.233 176.712 -4.479 1
1 1140 . 6 1 1 A 103 103 ALA CA C 141 49.624 51.472 -1.848 1
1 1141 . 6 1 1 A 103 103 ALA CB C 141 16.502 20.760 -4.258 1
1 1142 . 6 1 1 A 103 103 ALA N N 141 125.777 121.509 4.268 1
1 1143 . 6 1 1 A 104 104 ASP H H 142 7.973 8.439 -0.466 1
1 1144 . 6 1 1 A 104 104 ASP HA H 142 4.420 5.170 -0.750 1
1 1147 . 6 1 1 A 104 104 ASP C C 142 174.188 175.868 -1.680 1
1 1148 . 6 1 1 A 104 104 ASP CA C 142 52.124 53.557 -1.433 1
1 1149 . 6 1 1 A 104 104 ASP CB C 142 37.125 41.642 -4.517 1
1 1150 . 6 1 1 A 104 104 ASP N N 142 122.965 120.091 2.874 1
1 1151 . 6 1 1 A 105 105 ILE H H 143 8.534 8.790 -0.256 1
1 1152 . 6 1 1 A 105 105 ILE HA H 143 4.060 4.868 -0.808 1
1 1162 . 6 1 1 A 105 105 ILE C C 143 173.235 175.867 -2.632 1
1 1163 . 6 1 1 A 105 105 ILE CA C 143 58.374 60.283 -1.909 1
1 1164 . 6 1 1 A 105 105 ILE CB C 143 39.123 39.492 -0.369 1
1 1167 . 6 1 1 A 105 105 ILE N N 143 124.757 121.316 3.441 1
1 1168 . 6 1 1 A 106 106 GLY H H 144 8.288 8.391 -0.103 1
1 1169 . 6 1 1 A 106 106 GLY HA2 H 144 4.764 4.467 0.297 1
1 1170 . 6 1 1 A 106 106 GLY HA3 H 144 4.764 4.554 0.210 1
1 1171 . 6 1 1 A 106 106 GLY C C 144 171.321 171.803 -0.482 1
1 1172 . 6 1 1 A 106 106 GLY CA C 144 40.250 45.764 -5.514 1
1 1173 . 6 1 1 A 106 106 GLY N N 144 110.895 111.751 -0.856 1
1 1174 . 6 1 1 A 107 107 ASN H H 145 8.577 9.221 -0.644 1
1 1175 . 6 1 1 A 107 107 ASN HA H 145 4.268 4.952 -0.684 1
1 1180 . 6 1 1 A 107 107 ASN C C 145 171.757 173.608 -1.851 1
1 1181 . 6 1 1 A 107 107 ASN CA C 145 52.124 51.861 0.263 1
1 1182 . 6 1 1 A 107 107 ASN CB C 145 34.625 42.024 -7.399 1
1 1183 . 6 1 1 A 107 107 ASN N N 145 118.042 115.966 2.076 1
1 1185 . 6 1 1 A 108 108 TRP H H 146 6.822 8.383 -1.561 1
1 1186 . 6 1 1 A 108 108 TRP HA H 146 4.513 4.842 -0.329 1
1 1195 . 6 1 1 A 108 108 TRP C C 146 172.665 171.924 0.741 1
1 1196 . 6 1 1 A 108 108 TRP CA C 146 54.624 55.545 -0.921 1
1 1197 . 6 1 1 A 108 108 TRP CB C 146 25.876 30.754 -4.878 1
1 1198 . 6 1 1 A 108 108 TRP N N 146 116.756 117.764 -1.008 1
1 1200 . 6 1 1 A 109 109 ASP H H 147 7.344 7.466 -0.122 1
1 1201 . 6 1 1 A 109 109 ASP HA H 147 4.655 5.233 -0.578 1
1 1204 . 6 1 1 A 109 109 ASP C C 147 172.193 174.872 -2.679 1
1 1205 . 6 1 1 A 109 109 ASP CA C 147 51.499 52.561 -1.062 1
1 1206 . 6 1 1 A 109 109 ASP CB C 147 39.000 43.336 -4.336 1
1 1207 . 6 1 1 A 109 109 ASP N N 147 121.461 120.167 1.294 1
1 11 . 7 1 1 A 2 2 SER H H 40 8.461 8.937 -0.476 1
1 12 . 7 1 1 A 2 2 SER HA H 40 4.286 4.762 -0.476 1
1 15 . 7 1 1 A 2 2 SER C C 40 171.276 172.896 -1.620 1
1 16 . 7 1 1 A 2 2 SER CA C 40 55.249 56.991 -1.742 1
1 17 . 7 1 1 A 2 2 SER CB C 40 61.498 62.712 -1.214 1
1 18 . 7 1 1 A 2 2 SER N N 40 118.344 124.491 -6.147 1
1 19 . 7 1 1 A 3 3 ARG H H 41 8.469 7.965 0.504 1
1 20 . 7 1 1 A 3 3 ARG HA H 41 4.400 4.921 -0.521 1
1 25 . 7 1 1 A 3 3 ARG C C 41 172.251 173.625 -1.374 1
1 26 . 7 1 1 A 3 3 ARG CA C 41 52.749 54.041 -1.292 1
1 27 . 7 1 1 A 3 3 ARG CB C 41 27.126 33.104 -5.978 1
1 28 . 7 1 1 A 3 3 ARG N N 41 123.070 119.826 3.244 1
1 33 . 7 1 1 A 4 4 PRO CA C 42 61.498 63.837 -2.339 1
1 34 . 7 1 1 A 4 4 PRO CB C 42 29.001 31.687 -2.686 1
1 37 . 7 1 1 A 5 5 ASP H H 43 8.246 8.918 -0.672 1
1 38 . 7 1 1 A 5 5 ASP HA H 43 4.329 4.528 -0.199 1
1 41 . 7 1 1 A 5 5 ASP C C 43 174.605 177.278 -2.673 1
1 42 . 7 1 1 A 5 5 ASP CA C 43 53.374 56.055 -2.681 1
1 43 . 7 1 1 A 5 5 ASP CB C 43 38.375 40.707 -2.332 1
1 44 . 7 1 1 A 5 5 ASP N N 43 119.409 122.130 -2.721 1
1 45 . 7 1 1 A 6 6 GLN H H 44 8.309 8.773 -0.464 1
1 46 . 7 1 1 A 6 6 GLN HA H 44 4.393 4.274 0.119 1
1 53 . 7 1 1 A 6 6 GLN C C 44 175.053 178.545 -3.492 1
1 54 . 7 1 1 A 6 6 GLN CA C 44 55.874 58.188 -2.314 1
1 55 . 7 1 1 A 6 6 GLN CB C 44 25.876 28.318 -2.442 1
1 57 . 7 1 1 A 6 6 GLN N N 44 122.273 117.811 4.462 1
1 59 . 7 1 1 A 7 7 ALA H H 45 8.106 8.091 0.015 1
1 60 . 7 1 1 A 7 7 ALA HA H 45 3.993 4.570 -0.577 1
1 64 . 7 1 1 A 7 7 ALA C C 45 177.465 178.238 -0.773 1
1 65 . 7 1 1 A 7 7 ALA CA C 45 52.124 54.538 -2.414 1
1 66 . 7 1 1 A 7 7 ALA CB C 45 15.252 18.104 -2.852 1
1 67 . 7 1 1 A 7 7 ALA N N 45 122.204 121.888 0.316 1
1 68 . 7 1 1 A 8 8 LYS H H 46 7.527 7.712 -0.185 1
1 69 . 7 1 1 A 8 8 LYS HA H 46 3.539 4.091 -0.552 1
1 78 . 7 1 1 A 8 8 LYS C C 46 175.412 179.096 -3.684 1
1 79 . 7 1 1 A 8 8 LYS CA C 46 57.124 57.734 -0.610 1
1 80 . 7 1 1 A 8 8 LYS CB C 46 30.876 31.985 -1.109 1
1 83 . 7 1 1 A 8 8 LYS N N 46 117.358 116.794 0.564 1
1 84 . 7 1 1 A 9 9 VAL H H 47 7.709 8.071 -0.362 1
1 85 . 7 1 1 A 9 9 VAL HA H 47 3.578 3.801 -0.223 1
1 93 . 7 1 1 A 9 9 VAL C C 47 175.005 178.289 -3.284 1
1 94 . 7 1 1 A 9 9 VAL CA C 47 64.623 66.150 -1.527 1
1 95 . 7 1 1 A 9 9 VAL CB C 47 29.001 31.808 -2.807 1
1 98 . 7 1 1 A 9 9 VAL N N 47 119.115 120.266 -1.151 1
1 99 . 7 1 1 A 10 10 THR H H 48 7.767 7.995 -0.228 1
1 100 . 7 1 1 A 10 10 THR HA H 48 3.668 3.996 -0.328 1
1 105 . 7 1 1 A 10 10 THR CA C 48 63.998 66.218 -2.220 1
1 106 . 7 1 1 A 10 10 THR CB C 48 67.123 68.538 -1.415 1
1 108 . 7 1 1 A 10 10 THR N N 48 115.112 113.818 1.294 1
1 109 . 7 1 1 A 11 11 VAL H H 49 7.598 7.874 -0.276 1
1 110 . 7 1 1 A 11 11 VAL HA H 49 3.457 3.892 -0.435 1
1 118 . 7 1 1 A 11 11 VAL C C 49 175.412 178.103 -2.691 1
1 119 . 7 1 1 A 11 11 VAL CA C 49 63.998 64.876 -0.878 1
1 120 . 7 1 1 A 11 11 VAL CB C 49 29.001 31.773 -2.772 1
1 123 . 7 1 1 A 11 11 VAL N N 49 123.694 117.330 6.364 1
1 124 . 7 1 1 A 12 12 ALA H H 50 8.176 7.887 0.289 1
1 125 . 7 1 1 A 12 12 ALA HA H 50 4.742 4.065 0.677 1
1 129 . 7 1 1 A 12 12 ALA C C 50 177.074 179.595 -2.521 1
1 130 . 7 1 1 A 12 12 ALA CA C 50 52.124 55.276 -3.152 1
1 131 . 7 1 1 A 12 12 ALA CB C 50 15.252 18.235 -2.983 1
1 132 . 7 1 1 A 12 12 ALA N N 50 122.348 124.253 -1.905 1
1 133 . 7 1 1 A 13 13 LYS H H 51 8.499 8.071 0.428 1
1 134 . 7 1 1 A 13 13 LYS HA H 51 3.648 4.077 -0.429 1
1 143 . 7 1 1 A 13 13 LYS C C 51 177.252 179.848 -2.596 1
1 144 . 7 1 1 A 13 13 LYS CA C 51 58.072 59.489 -1.417 1
1 145 . 7 1 1 A 13 13 LYS CB C 51 30.251 32.257 -2.006 1
1 146 . 7 1 1 A 13 13 LYS N N 51 115.402 117.146 -1.744 1
1 147 . 7 1 1 A 14 14 GLY H H 52 7.858 8.095 -0.237 1
1 148 . 7 1 1 A 14 14 GLY HA2 H 52 3.823 3.817 0.006 1
1 149 . 7 1 1 A 14 14 GLY HA3 H 52 3.676 3.817 -0.141 1
1 150 . 7 1 1 A 14 14 GLY C C 52 174.090 175.636 -1.546 1
1 151 . 7 1 1 A 14 14 GLY CA C 52 44.625 46.933 -2.308 1
1 152 . 7 1 1 A 14 14 GLY N N 52 107.466 108.859 -1.393 1
1 153 . 7 1 1 A 15 15 ASP H H 53 8.403 7.844 0.559 1
1 154 . 7 1 1 A 15 15 ASP HA H 53 4.191 4.386 -0.195 1
1 157 . 7 1 1 A 15 15 ASP C C 53 175.316 178.967 -3.651 1
1 158 . 7 1 1 A 15 15 ASP CA C 53 54.624 56.597 -1.973 1
1 159 . 7 1 1 A 15 15 ASP CB C 53 35.875 40.992 -5.117 1
1 160 . 7 1 1 A 15 15 ASP N N 53 125.929 121.368 4.561 1
1 161 . 7 1 1 A 16 16 ILE H H 54 8.245 8.247 -0.002 1
1 162 . 7 1 1 A 16 16 ILE HA H 54 3.034 3.810 -0.776 1
1 172 . 7 1 1 A 16 16 ILE C C 54 174.499 178.277 -3.778 1
1 173 . 7 1 1 A 16 16 ILE CA C 54 62.748 64.117 -1.369 1
1 174 . 7 1 1 A 16 16 ILE CB C 54 34.625 37.443 -2.818 1
1 178 . 7 1 1 A 16 16 ILE N N 54 119.456 116.836 2.620 1
1 179 . 7 1 1 A 17 17 LYS H H 55 7.547 7.561 -0.014 1
1 180 . 7 1 1 A 17 17 LYS HA H 55 3.843 4.348 -0.505 1
1 187 . 7 1 1 A 17 17 LYS C C 55 176.651 179.367 -2.716 1
1 188 . 7 1 1 A 17 17 LYS CA C 55 57.124 59.248 -2.124 1
1 189 . 7 1 1 A 17 17 LYS CB C 55 30.251 32.079 -1.828 1
1 190 . 7 1 1 A 17 17 LYS N N 55 118.505 121.512 -3.007 1
1 191 . 7 1 1 A 18 18 ALA H H 56 7.680 7.889 -0.209 1
1 192 . 7 1 1 A 18 18 ALA HA H 56 4.029 4.029 0.000 1
1 196 . 7 1 1 A 18 18 ALA C C 56 176.638 179.909 -3.271 1
1 197 . 7 1 1 A 18 18 ALA CA C 56 52.749 54.937 -2.188 1
1 198 . 7 1 1 A 18 18 ALA CB C 56 15.877 18.354 -2.477 1
1 199 . 7 1 1 A 18 18 ALA N N 56 122.477 121.925 0.552 1
1 200 . 7 1 1 A 19 19 ILE H H 57 8.853 7.744 1.109 1
1 201 . 7 1 1 A 19 19 ILE HA H 57 3.304 3.568 -0.264 1
1 211 . 7 1 1 A 19 19 ILE C C 57 174.710 177.788 -3.078 1
1 212 . 7 1 1 A 19 19 ILE CA C 57 63.373 65.374 -2.001 1
1 213 . 7 1 1 A 19 19 ILE CB C 57 35.250 37.914 -2.664 1
1 217 . 7 1 1 A 19 19 ILE N N 57 120.901 118.081 2.820 1
1 218 . 7 1 1 A 20 20 ALA H H 58 8.702 8.247 0.455 1
1 219 . 7 1 1 A 20 20 ALA HA H 58 3.900 3.959 -0.059 1
1 223 . 7 1 1 A 20 20 ALA C C 58 176.512 179.708 -3.196 1
1 224 . 7 1 1 A 20 20 ALA CA C 58 52.749 55.152 -2.403 1
1 225 . 7 1 1 A 20 20 ALA CB C 58 15.252 18.134 -2.882 1
1 226 . 7 1 1 A 20 20 ALA N N 58 121.763 122.519 -0.756 1
1 227 . 7 1 1 A 21 21 ALA H H 59 7.662 7.567 0.095 1
1 228 . 7 1 1 A 21 21 ALA HA H 59 4.136 4.226 -0.090 1
1 232 . 7 1 1 A 21 21 ALA C C 59 177.949 179.637 -1.688 1
1 233 . 7 1 1 A 21 21 ALA CA C 59 52.749 54.844 -2.095 1
1 234 . 7 1 1 A 21 21 ALA CB C 59 15.252 18.551 -3.299 1
1 235 . 7 1 1 A 21 21 ALA N N 59 119.079 119.274 -0.195 1
1 236 . 7 1 1 A 22 22 ALA H H 60 7.403 7.563 -0.160 1
1 237 . 7 1 1 A 22 22 ALA HA H 60 4.318 4.184 0.134 1
1 241 . 7 1 1 A 22 22 ALA C C 60 176.730 180.414 -3.684 1
1 242 . 7 1 1 A 22 22 ALA CA C 60 52.749 54.483 -1.734 1
1 243 . 7 1 1 A 22 22 ALA CB C 60 17.126 18.725 -1.599 1
1 244 . 7 1 1 A 22 22 ALA N N 60 122.616 120.492 2.124 1
1 245 . 7 1 1 A 23 23 LEU H H 61 8.410 8.537 -0.127 1
1 246 . 7 1 1 A 23 23 LEU HA H 61 3.527 3.921 -0.394 1
1 256 . 7 1 1 A 23 23 LEU C C 61 176.057 178.218 -2.161 1
1 257 . 7 1 1 A 23 23 LEU CA C 61 55.249 57.397 -2.148 1
1 258 . 7 1 1 A 23 23 LEU CB C 61 39.000 40.829 -1.829 1
1 262 . 7 1 1 A 23 23 LEU N N 61 120.761 121.192 -0.431 1
1 263 . 7 1 1 A 24 24 ASP H H 62 8.227 8.162 0.065 1
1 264 . 7 1 1 A 24 24 ASP HA H 62 4.581 4.433 0.148 1
1 267 . 7 1 1 A 24 24 ASP C C 62 176.968 178.029 -1.061 1
1 268 . 7 1 1 A 24 24 ASP CA C 62 55.874 56.692 -0.818 1
1 269 . 7 1 1 A 24 24 ASP CB C 62 37.750 40.793 -3.043 1
1 270 . 7 1 1 A 24 24 ASP N N 62 119.068 118.824 0.244 1
1 271 . 7 1 1 A 25 25 MET H H 63 7.718 8.019 -0.301 1
1 272 . 7 1 1 A 25 25 MET HA H 63 4.196 4.276 -0.080 1
1 277 . 7 1 1 A 25 25 MET C C 63 174.968 177.826 -2.858 1
1 278 . 7 1 1 A 25 25 MET CA C 63 55.249 58.046 -2.797 1
1 279 . 7 1 1 A 25 25 MET CB C 63 29.626 31.791 -2.165 1
1 281 . 7 1 1 A 25 25 MET N N 63 121.365 117.170 4.195 1
1 282 . 7 1 1 A 26 26 TYR H H 64 8.401 7.534 0.867 1
1 283 . 7 1 1 A 26 26 TYR HA H 64 4.400 3.592 0.808 1
1 291 . 7 1 1 A 26 26 TYR C C 64 176.098 177.303 -1.205 1
1 292 . 7 1 1 A 26 26 TYR CA C 64 58.999 60.998 -1.999 1
1 293 . 7 1 1 A 26 26 TYR CB C 64 35.250 38.228 -2.978 1
1 294 . 7 1 1 A 26 26 TYR N N 64 122.575 122.340 0.235 1
1 295 . 7 1 1 A 27 27 LYS H H 65 8.330 8.237 0.093 1
1 296 . 7 1 1 A 27 27 LYS HA H 65 3.568 4.530 -0.962 1
1 302 . 7 1 1 A 27 27 LYS C C 65 176.156 178.860 -2.704 1
1 303 . 7 1 1 A 27 27 LYS CA C 65 56.499 59.541 -3.042 1
1 304 . 7 1 1 A 27 27 LYS CB C 65 29.626 32.019 -2.393 1
1 306 . 7 1 1 A 27 27 LYS N N 65 121.390 118.619 2.771 1
1 307 . 7 1 1 A 28 28 LEU H H 66 7.833 7.807 0.026 1
1 308 . 7 1 1 A 28 28 LEU HA H 66 3.769 4.090 -0.321 1
1 318 . 7 1 1 A 28 28 LEU C C 66 175.925 178.106 -2.181 1
1 319 . 7 1 1 A 28 28 LEU CA C 66 55.874 57.400 -1.526 1
1 320 . 7 1 1 A 28 28 LEU CB C 66 38.375 41.902 -3.527 1
1 324 . 7 1 1 A 28 28 LEU N N 66 123.068 120.641 2.427 1
1 325 . 7 1 1 A 29 29 ASP H H 67 7.292 7.595 -0.303 1
1 326 . 7 1 1 A 29 29 ASP HA H 67 4.096 4.327 -0.231 1
1 329 . 7 1 1 A 29 29 ASP C C 67 174.618 176.751 -2.133 1
1 330 . 7 1 1 A 29 29 ASP CA C 67 53.999 56.298 -2.299 1
1 331 . 7 1 1 A 29 29 ASP CB C 67 38.375 40.656 -2.281 1
1 332 . 7 1 1 A 29 29 ASP N N 67 114.729 118.410 -3.681 1
1 333 . 7 1 1 A 30 30 ASN H H 68 8.097 7.410 0.687 1
1 334 . 7 1 1 A 30 30 ASN HA H 68 4.337 4.429 -0.092 1
1 339 . 7 1 1 A 30 30 ASN C C 68 172.822 174.307 -1.485 1
1 340 . 7 1 1 A 30 30 ASN CA C 68 52.124 52.131 -0.007 1
1 341 . 7 1 1 A 30 30 ASN CB C 68 37.750 38.472 -0.722 1
1 342 . 7 1 1 A 30 30 ASN N N 68 111.054 115.199 -4.145 1
1 344 . 7 1 1 A 31 31 PHE H H 69 8.249 7.991 0.258 1
1 345 . 7 1 1 A 31 31 PHE HA H 69 4.135 4.128 0.007 1
1 353 . 7 1 1 A 31 31 PHE C C 69 170.485 174.259 -3.774 1
1 354 . 7 1 1 A 31 31 PHE CA C 69 57.749 58.776 -1.027 1
1 355 . 7 1 1 A 31 31 PHE CB C 69 33.375 36.603 -3.228 1
1 356 . 7 1 1 A 31 31 PHE N N 69 116.277 117.320 -1.043 1
1 357 . 7 1 1 A 32 32 ALA H H 70 7.224 7.152 0.072 1
1 358 . 7 1 1 A 32 32 ALA HA H 70 4.194 4.525 -0.331 1
1 362 . 7 1 1 A 32 32 ALA C C 70 173.337 175.095 -1.758 1
1 363 . 7 1 1 A 32 32 ALA CA C 70 48.374 51.523 -3.149 1
1 364 . 7 1 1 A 32 32 ALA CB C 70 19.626 22.142 -2.516 1
1 365 . 7 1 1 A 32 32 ALA N N 70 119.914 120.355 -0.441 1
1 366 . 7 1 1 A 33 33 TYR H H 71 7.948 8.368 -0.420 1
1 367 . 7 1 1 A 33 33 TYR HA H 71 4.209 4.915 -0.706 1
1 374 . 7 1 1 A 33 33 TYR C C 71 170.591 174.276 -3.685 1
1 375 . 7 1 1 A 33 33 TYR CA C 71 54.624 56.532 -1.908 1
1 376 . 7 1 1 A 33 33 TYR CB C 71 34.000 37.412 -3.412 1
1 377 . 7 1 1 A 33 33 TYR N N 71 116.929 118.167 -1.238 1
1 378 . 7 1 1 A 34 34 PRO HA H 72 4.444 4.627 -0.183 1
1 381 . 7 1 1 A 34 34 PRO C C 72 174.775 176.341 -1.566 1
1 382 . 7 1 1 A 34 34 PRO CA C 72 59.624 62.369 -2.745 1
1 383 . 7 1 1 A 34 34 PRO CB C 72 28.376 31.998 -3.622 1
1 384 . 7 1 1 A 35 35 SER H H 73 8.721 8.356 0.365 1
1 385 . 7 1 1 A 35 35 SER HA H 73 4.467 4.728 -0.261 1
1 388 . 7 1 1 A 35 35 SER C C 73 173.271 175.250 -1.979 1
1 389 . 7 1 1 A 35 35 SER CA C 73 55.249 56.791 -1.542 1
1 390 . 7 1 1 A 35 35 SER CB C 73 63.373 65.534 -2.161 1
1 391 . 7 1 1 A 35 35 SER N N 73 118.284 114.746 3.538 1
1 392 . 7 1 1 A 36 36 THR H H 74 8.591 8.539 0.052 1
1 393 . 7 1 1 A 36 36 THR HA H 74 3.649 4.160 -0.511 1
1 398 . 7 1 1 A 36 36 THR CA C 74 64.623 64.596 0.027 1
1 399 . 7 1 1 A 36 36 THR CB C 74 66.498 68.999 -2.501 1
1 401 . 7 1 1 A 36 36 THR N N 74 117.769 116.678 1.091 1
1 402 . 7 1 1 A 37 37 GLN H H 75 8.210 7.785 0.425 1
1 403 . 7 1 1 A 37 37 GLN HA H 75 3.860 4.366 -0.506 1
1 410 . 7 1 1 A 37 37 GLN C C 75 175.349 177.601 -2.252 1
1 411 . 7 1 1 A 37 37 GLN CA C 75 56.499 57.810 -1.311 1
1 412 . 7 1 1 A 37 37 GLN CB C 75 25.876 29.444 -3.568 1
1 414 . 7 1 1 A 37 37 GLN N N 75 117.931 120.170 -2.239 1
1 416 . 7 1 1 A 38 38 GLN H H 76 7.667 8.113 -0.446 1
1 417 . 7 1 1 A 38 38 GLN HA H 76 3.810 4.124 -0.314 1
1 424 . 7 1 1 A 38 38 GLN C C 76 175.805 179.349 -3.544 1
1 425 . 7 1 1 A 38 38 GLN CA C 76 55.874 58.230 -2.356 1
1 426 . 7 1 1 A 38 38 GLN CB C 76 25.876 28.365 -2.489 1
1 428 . 7 1 1 A 38 38 GLN N N 76 120.607 118.072 2.535 1
1 430 . 7 1 1 A 39 39 GLY H H 77 8.470 8.312 0.158 1
1 431 . 7 1 1 A 39 39 GLY HA2 H 77 3.920 3.720 0.200 1
1 432 . 7 1 1 A 39 39 GLY HA3 H 77 3.603 3.764 -0.161 1
1 433 . 7 1 1 A 39 39 GLY C C 77 169.006 175.455 -6.449 1
1 434 . 7 1 1 A 39 39 GLY CA C 77 42.125 46.542 -4.417 1
1 435 . 7 1 1 A 39 39 GLY N N 77 103.281 109.575 -6.294 1
1 436 . 7 1 1 A 40 40 LEU H H 78 8.135 7.780 0.355 1
1 437 . 7 1 1 A 40 40 LEU HA H 78 3.237 4.160 -0.923 1
1 447 . 7 1 1 A 40 40 LEU C C 78 176.383 178.785 -2.402 1
1 448 . 7 1 1 A 40 40 LEU CA C 78 52.749 57.162 -4.413 1
1 449 . 7 1 1 A 40 40 LEU CB C 78 39.000 41.467 -2.467 1
1 453 . 7 1 1 A 40 40 LEU N N 78 114.444 123.293 -8.849 1
1 454 . 7 1 1 A 41 41 GLU H H 79 8.578 8.109 0.469 1
1 455 . 7 1 1 A 41 41 GLU HA H 79 3.720 4.305 -0.585 1
1 460 . 7 1 1 A 41 41 GLU C C 79 175.093 177.269 -2.176 1
1 461 . 7 1 1 A 41 41 GLU CA C 79 57.124 58.661 -1.537 1
1 462 . 7 1 1 A 41 41 GLU CB C 79 26.501 29.424 -2.923 1
1 464 . 7 1 1 A 41 41 GLU N N 79 118.295 118.178 0.117 1
1 465 . 7 1 1 A 42 42 ALA H H 80 7.227 7.535 -0.308 1
1 466 . 7 1 1 A 42 42 ALA HA H 80 4.437 4.712 -0.275 1
1 470 . 7 1 1 A 42 42 ALA C C 80 173.745 178.510 -4.765 1
1 471 . 7 1 1 A 42 42 ALA CA C 80 51.499 52.979 -1.480 1
1 472 . 7 1 1 A 42 42 ALA CB C 80 15.877 19.414 -3.537 1
1 473 . 7 1 1 A 42 42 ALA N N 80 119.751 122.237 -2.486 1
1 474 . 7 1 1 A 43 43 LEU H H 81 7.932 7.609 0.323 1
1 475 . 7 1 1 A 43 43 LEU HA H 81 4.369 4.489 -0.120 1
1 485 . 7 1 1 A 43 43 LEU C C 81 174.788 178.228 -3.440 1
1 486 . 7 1 1 A 43 43 LEU CA C 81 53.374 56.083 -2.709 1
1 487 . 7 1 1 A 43 43 LEU CB C 81 39.625 42.379 -2.754 1
1 491 . 7 1 1 A 43 43 LEU N N 81 111.742 116.433 -4.691 1
1 492 . 7 1 1 A 44 44 VAL H H 82 7.886 7.524 0.362 1
1 493 . 7 1 1 A 44 44 VAL HA H 82 4.700 4.340 0.360 1
1 501 . 7 1 1 A 44 44 VAL C C 82 172.875 176.000 -3.125 1
1 502 . 7 1 1 A 44 44 VAL CA C 82 59.624 63.831 -4.207 1
1 503 . 7 1 1 A 44 44 VAL CB C 82 31.501 33.579 -2.078 1
1 506 . 7 1 1 A 44 44 VAL N N 82 113.604 115.716 -2.112 1
1 507 . 7 1 1 A 45 45 LYS H H 83 8.361 8.130 0.231 1
1 508 . 7 1 1 A 45 45 LYS HA H 83 4.251 5.012 -0.761 1
1 515 . 7 1 1 A 45 45 LYS C C 83 171.053 175.015 -3.962 1
1 516 . 7 1 1 A 45 45 LYS CA C 83 52.749 54.367 -1.618 1
1 517 . 7 1 1 A 45 45 LYS CB C 83 33.375 35.945 -2.570 1
1 521 . 7 1 1 A 45 45 LYS N N 83 123.860 121.458 2.402 1
1 522 . 7 1 1 A 46 46 LYS H H 84 7.243 7.916 -0.673 1
1 523 . 7 1 1 A 46 46 LYS HA H 84 2.175 2.762 -0.587 1
1 532 . 7 1 1 A 46 46 LYS C C 84 172.123 174.474 -2.351 1
1 533 . 7 1 1 A 46 46 LYS CA C 84 52.749 54.361 -1.612 1
1 534 . 7 1 1 A 46 46 LYS CB C 84 29.626 31.447 -1.821 1
1 537 . 7 1 1 A 46 46 LYS N N 84 128.615 124.110 4.505 1
1 538 . 7 1 1 A 47 47 PRO HA H 85 4.470 4.404 0.066 1
1 541 . 7 1 1 A 47 47 PRO C C 85 173.754 176.554 -2.800 1
1 542 . 7 1 1 A 47 47 PRO CA C 85 60.874 63.334 -2.460 1
1 543 . 7 1 1 A 47 47 PRO CB C 85 30.876 32.098 -1.222 1
1 546 . 7 1 1 A 48 48 THR H H 86 8.306 8.323 -0.017 1
1 547 . 7 1 1 A 48 48 THR HA H 86 4.287 4.497 -0.210 1
1 552 . 7 1 1 A 48 48 THR C C 86 173.070 174.773 -1.703 1
1 553 . 7 1 1 A 48 48 THR CA C 86 57.749 60.835 -3.086 1
1 554 . 7 1 1 A 48 48 THR CB C 86 67.748 70.624 -2.876 1
1 556 . 7 1 1 A 48 48 THR N N 86 109.564 112.713 -3.149 1
1 557 . 7 1 1 A 49 49 GLY H H 87 8.317 8.657 -0.340 1
1 558 . 7 1 1 A 49 49 GLY HA2 H 87 3.851 3.914 -0.063 1
1 559 . 7 1 1 A 49 49 GLY HA3 H 87 3.678 3.923 -0.245 1
1 560 . 7 1 1 A 49 49 GLY C C 87 169.693 173.627 -3.934 1
1 561 . 7 1 1 A 49 49 GLY CA C 87 42.125 46.899 -4.774 1
1 562 . 7 1 1 A 49 49 GLY N N 87 109.071 109.847 -0.776 1
1 563 . 7 1 1 A 50 50 ASN H H 88 8.301 8.431 -0.130 1
1 564 . 7 1 1 A 50 50 ASN HA H 88 4.780 5.369 -0.589 1
1 569 . 7 1 1 A 50 50 ASN C C 88 171.370 172.714 -1.344 1
1 570 . 7 1 1 A 50 50 ASN CA C 88 47.749 50.403 -2.654 1
1 571 . 7 1 1 A 50 50 ASN CB C 88 37.125 39.594 -2.469 1
1 572 . 7 1 1 A 50 50 ASN N N 88 115.631 122.564 -6.933 1
1 574 . 7 1 1 A 51 51 PRO HA H 89 4.782 4.616 0.166 1
1 577 . 7 1 1 A 51 51 PRO C C 89 173.656 175.756 -2.100 1
1 578 . 7 1 1 A 51 51 PRO CA C 89 59.624 62.232 -2.608 1
1 579 . 7 1 1 A 51 51 PRO CB C 89 31.501 32.401 -0.900 1
1 582 . 7 1 1 A 52 52 GLN H H 90 9.076 8.686 0.390 1
1 583 . 7 1 1 A 52 52 GLN HA H 90 4.469 4.927 -0.458 1
1 590 . 7 1 1 A 52 52 GLN C C 90 172.386 174.005 -1.619 1
1 591 . 7 1 1 A 52 52 GLN CA C 90 50.874 52.733 -1.859 1
1 592 . 7 1 1 A 52 52 GLN CB C 90 26.501 29.056 -2.555 1
1 594 . 7 1 1 A 52 52 GLN N N 90 126.827 119.299 7.528 1
1 596 . 7 1 1 A 53 53 PRO HA H 91 4.384 4.630 -0.246 1
1 599 . 7 1 1 A 53 53 PRO C C 91 174.274 175.240 -0.966 1
1 600 . 7 1 1 A 53 53 PRO CB C 91 28.113 31.395 -3.282 1
1 601 . 7 1 1 A 54 54 LYS H H 92 8.401 8.749 -0.348 1
1 602 . 7 1 1 A 54 54 LYS HA H 92 3.984 4.721 -0.737 1
1 611 . 7 1 1 A 54 54 LYS C C 92 173.516 174.831 -1.315 1
1 612 . 7 1 1 A 54 54 LYS CA C 92 55.249 55.326 -0.077 1
1 613 . 7 1 1 A 54 54 LYS CB C 92 30.876 36.100 -5.224 1
1 615 . 7 1 1 A 54 54 LYS N N 92 124.538 124.205 0.333 1
1 616 . 7 1 1 A 55 55 ASN H H 93 8.183 8.806 -0.623 1
1 617 . 7 1 1 A 55 55 ASN HA H 93 4.716 4.871 -0.155 1
1 622 . 7 1 1 A 55 55 ASN CA C 93 48.999 53.151 -4.152 1
1 623 . 7 1 1 A 55 55 ASN CB C 93 35.875 37.134 -1.259 1
1 624 . 7 1 1 A 55 55 ASN N N 93 118.677 122.542 -3.865 1
1 626 . 7 1 1 A 56 56 TRP H H 94 8.007 8.754 -0.747 1
1 627 . 7 1 1 A 56 56 TRP HA H 94 3.827 5.447 -1.620 1
1 635 . 7 1 1 A 56 56 TRP C C 94 173.760 175.379 -1.619 1
1 636 . 7 1 1 A 56 56 TRP CA C 94 59.624 58.862 0.762 1
1 637 . 7 1 1 A 56 56 TRP CB C 94 27.126 30.353 -3.227 1
1 638 . 7 1 1 A 56 56 TRP N N 94 122.195 127.686 -5.491 1
1 640 . 7 1 1 A 57 57 ASN H H 95 7.563 7.633 -0.070 1
1 641 . 7 1 1 A 57 57 ASN HA H 95 3.735 4.841 -1.106 1
1 646 . 7 1 1 A 57 57 ASN C C 95 171.952 173.958 -2.006 1
1 647 . 7 1 1 A 57 57 ASN CA C 95 51.499 50.776 0.723 1
1 648 . 7 1 1 A 57 57 ASN CB C 95 35.250 40.991 -5.741 1
1 649 . 7 1 1 A 57 57 ASN N N 95 129.659 125.382 4.277 1
1 651 . 7 1 1 A 58 58 LYS H H 96 8.110 8.071 0.039 1
1 652 . 7 1 1 A 58 58 LYS HA H 96 4.035 4.272 -0.237 1
1 659 . 7 1 1 A 58 58 LYS C C 96 174.530 175.544 -1.014 1
1 660 . 7 1 1 A 58 58 LYS CA C 96 56.499 54.658 1.841 1
1 661 . 7 1 1 A 58 58 LYS CB C 96 29.626 32.831 -3.205 1
1 665 . 7 1 1 A 58 58 LYS N N 96 123.913 123.525 0.388 1
1 666 . 7 1 1 A 59 59 ASP H H 97 7.903 9.262 -1.359 1
1 667 . 7 1 1 A 59 59 ASP HA H 97 4.393 4.389 0.004 1
1 670 . 7 1 1 A 59 59 ASP C C 97 173.724 175.094 -1.370 1
1 671 . 7 1 1 A 59 59 ASP CA C 97 52.124 54.982 -2.858 1
1 672 . 7 1 1 A 59 59 ASP CB C 97 38.375 39.776 -1.401 1
1 673 . 7 1 1 A 59 59 ASP N N 97 118.773 119.719 -0.946 1
1 674 . 7 1 1 A 60 60 GLY H H 98 7.819 7.888 -0.069 1
1 675 . 7 1 1 A 60 60 GLY HA2 H 98 3.917 2.304 1.613 1
1 676 . 7 1 1 A 60 60 GLY HA3 H 98 3.917 3.317 0.600 1
1 677 . 7 1 1 A 60 60 GLY C C 98 168.652 174.094 -5.442 1
1 678 . 7 1 1 A 60 60 GLY CA C 98 41.500 44.797 -3.297 1
1 679 . 7 1 1 A 60 60 GLY N N 98 108.742 104.584 4.158 1
1 680 . 7 1 1 A 61 61 TYR H H 99 8.105 7.620 0.485 1
1 681 . 7 1 1 A 61 61 TYR HA H 99 3.927 4.219 -0.292 1
1 689 . 7 1 1 A 61 61 TYR C C 99 172.831 174.004 -1.173 1
1 690 . 7 1 1 A 61 61 TYR CA C 99 57.124 57.954 -0.830 1
1 691 . 7 1 1 A 61 61 TYR CB C 99 37.125 36.398 0.727 1
1 692 . 7 1 1 A 61 61 TYR N N 99 113.836 114.079 -0.243 1
1 693 . 7 1 1 A 62 62 LEU H H 100 7.352 7.611 -0.259 1
1 694 . 7 1 1 A 62 62 LEU HA H 100 4.343 4.899 -0.556 1
1 704 . 7 1 1 A 62 62 LEU C C 100 173.430 175.598 -2.168 1
1 705 . 7 1 1 A 62 62 LEU CA C 100 50.874 53.234 -2.360 1
1 706 . 7 1 1 A 62 62 LEU CB C 100 44.000 45.892 -1.892 1
1 710 . 7 1 1 A 62 62 LEU N N 100 117.112 119.929 -2.817 1
1 711 . 7 1 1 A 63 63 LYS H H 101 8.626 8.271 0.355 1
1 712 . 7 1 1 A 63 63 LYS HA H 101 3.986 4.346 -0.360 1
1 721 . 7 1 1 A 63 63 LYS C C 101 173.851 176.809 -2.958 1
1 722 . 7 1 1 A 63 63 LYS CA C 101 55.249 55.726 -0.477 1
1 723 . 7 1 1 A 63 63 LYS CB C 101 29.626 33.289 -3.663 1
1 724 . 7 1 1 A 63 63 LYS N N 101 129.991 123.116 6.875 1
1 725 . 7 1 1 A 64 64 LYS H H 102 7.059 8.528 -1.469 1
1 726 . 7 1 1 A 64 64 LYS HA H 102 4.138 4.351 -0.213 1
1 735 . 7 1 1 A 64 64 LYS C C 102 171.120 174.542 -3.422 1
1 736 . 7 1 1 A 64 64 LYS CA C 102 52.749 55.936 -3.187 1
1 737 . 7 1 1 A 64 64 LYS CB C 102 32.750 30.607 2.143 1
1 740 . 7 1 1 A 64 64 LYS N N 102 113.255 121.393 -8.138 1
1 741 . 7 1 1 A 65 65 LEU H H 103 8.883 8.077 0.806 1
1 742 . 7 1 1 A 65 65 LEU HA H 103 4.475 4.743 -0.268 1
1 752 . 7 1 1 A 65 65 LEU C C 103 171.487 174.424 -2.937 1
1 753 . 7 1 1 A 65 65 LEU CA C 103 48.999 51.057 -2.058 1
1 754 . 7 1 1 A 65 65 LEU CB C 103 39.625 45.130 -5.505 1
1 758 . 7 1 1 A 65 65 LEU N N 103 126.355 125.685 0.670 1
1 759 . 7 1 1 A 66 66 PRO HA H 104 4.449 4.655 -0.206 1
1 764 . 7 1 1 A 66 66 PRO C C 104 173.363 176.340 -2.977 1
1 765 . 7 1 1 A 66 66 PRO CA C 104 60.249 62.217 -1.968 1
1 766 . 7 1 1 A 66 66 PRO CB C 104 29.626 32.988 -3.362 1
1 769 . 7 1 1 A 67 67 VAL H H 105 7.682 8.429 -0.747 1
1 770 . 7 1 1 A 67 67 VAL HA H 105 4.121 4.526 -0.405 1
1 778 . 7 1 1 A 67 67 VAL C C 105 171.667 174.962 -3.295 1
1 779 . 7 1 1 A 67 67 VAL CA C 105 58.374 61.839 -3.465 1
1 780 . 7 1 1 A 67 67 VAL CB C 105 30.251 32.598 -2.347 1
1 783 . 7 1 1 A 67 67 VAL N N 105 114.671 121.152 -6.481 1
1 784 . 7 1 1 A 68 68 ASP H H 106 8.216 8.168 0.048 1
1 785 . 7 1 1 A 68 68 ASP HA H 106 4.474 4.793 -0.319 1
1 788 . 7 1 1 A 68 68 ASP C C 106 172.452 174.929 -2.477 1
1 789 . 7 1 1 A 68 68 ASP CA C 106 50.249 52.278 -2.029 1
1 790 . 7 1 1 A 68 68 ASP CB C 106 37.750 40.450 -2.700 1
1 791 . 7 1 1 A 68 68 ASP N N 106 123.825 125.038 -1.213 1
1 792 . 7 1 1 A 69 69 PRO HA H 107 3.920 4.043 -0.123 1
1 797 . 7 1 1 A 69 69 PRO CA C 107 62.123 63.075 -0.952 1
1 798 . 7 1 1 A 69 69 PRO CB C 107 27.751 31.593 -3.842 1
1 801 . 7 1 1 A 70 70 TRP H H 108 8.156 8.393 -0.237 1
1 802 . 7 1 1 A 70 70 TRP HA H 108 4.274 4.299 -0.025 1
1 811 . 7 1 1 A 70 70 TRP CA C 108 57.124 58.343 -1.219 1
1 812 . 7 1 1 A 70 70 TRP CB C 108 25.251 27.191 -1.940 1
1 813 . 7 1 1 A 70 70 TRP N N 108 118.137 117.430 0.707 1
1 815 . 7 1 1 A 71 71 GLY H H 109 8.209 8.751 -0.542 1
1 816 . 7 1 1 A 71 71 GLY HA2 H 109 4.030 3.882 0.148 1
1 817 . 7 1 1 A 71 71 GLY HA3 H 109 3.303 3.909 -0.606 1
1 818 . 7 1 1 A 71 71 GLY CA C 109 42.750 46.447 -3.697 1
1 819 . 7 1 1 A 71 71 GLY N N 109 107.495 105.409 2.086 1
1 820 . 7 1 1 A 72 72 ASN H H 110 8.116 7.856 0.260 1
1 821 . 7 1 1 A 72 72 ASN HA H 110 5.103 5.055 0.048 1
1 826 . 7 1 1 A 72 72 ASN CA C 110 48.374 50.593 -2.219 1
1 827 . 7 1 1 A 72 72 ASN CB C 110 36.500 38.765 -2.265 1
1 828 . 7 1 1 A 72 72 ASN N N 110 120.108 119.551 0.557 1
1 830 . 7 1 1 A 73 73 PRO HA H 111 4.397 4.521 -0.124 1
1 835 . 7 1 1 A 73 73 PRO C C 111 176.229 176.368 -0.139 1
1 836 . 7 1 1 A 73 73 PRO CA C 111 60.249 62.337 -2.088 1
1 837 . 7 1 1 A 73 73 PRO CB C 111 29.001 32.405 -3.404 1
1 840 . 7 1 1 A 74 74 TYR H H 112 8.893 8.549 0.344 1
1 841 . 7 1 1 A 74 74 TYR HA H 112 4.064 5.069 -1.005 1
1 849 . 7 1 1 A 74 74 TYR C C 112 171.951 175.946 -3.995 1
1 850 . 7 1 1 A 74 74 TYR CA C 112 60.249 58.423 1.826 1
1 851 . 7 1 1 A 74 74 TYR CB C 112 36.500 39.562 -3.062 1
1 852 . 7 1 1 A 74 74 TYR N N 112 124.595 121.448 3.147 1
1 853 . 7 1 1 A 75 75 GLN H H 113 9.127 8.956 0.171 1
1 854 . 7 1 1 A 75 75 GLN HA H 113 4.019 4.379 -0.360 1
1 861 . 7 1 1 A 75 75 GLN C C 113 171.436 174.181 -2.745 1
1 862 . 7 1 1 A 75 75 GLN CA C 113 50.874 54.753 -3.879 1
1 863 . 7 1 1 A 75 75 GLN CB C 113 29.469 29.236 0.233 1
1 865 . 7 1 1 A 75 75 GLN N N 113 120.777 122.130 -1.353 1
1 867 . 7 1 1 A 76 76 TYR H H 114 7.906 8.641 -0.735 1
1 868 . 7 1 1 A 76 76 TYR HA H 114 5.586 5.135 0.451 1
1 875 . 7 1 1 A 76 76 TYR C C 114 171.343 175.622 -4.279 1
1 876 . 7 1 1 A 76 76 TYR CA C 114 53.999 57.514 -3.515 1
1 877 . 7 1 1 A 76 76 TYR CB C 114 40.250 40.108 0.142 1
1 878 . 7 1 1 A 76 76 TYR N N 114 120.757 123.365 -2.608 1
1 879 . 7 1 1 A 77 77 LEU H H 115 8.261 9.118 -0.857 1
1 880 . 7 1 1 A 77 77 LEU HA H 115 4.280 5.233 -0.953 1
1 890 . 7 1 1 A 77 77 LEU C C 115 170.921 175.676 -4.755 1
1 891 . 7 1 1 A 77 77 LEU CA C 115 51.499 53.538 -2.039 1
1 892 . 7 1 1 A 77 77 LEU CB C 115 44.625 45.650 -1.025 1
1 896 . 7 1 1 A 77 77 LEU N N 115 130.662 124.751 5.911 1
1 897 . 7 1 1 A 78 78 ALA H H 116 7.973 8.543 -0.570 1
1 898 . 7 1 1 A 78 78 ALA HA H 116 4.292 4.823 -0.531 1
1 902 . 7 1 1 A 78 78 ALA C C 116 172.093 174.630 -2.537 1
1 903 . 7 1 1 A 78 78 ALA CA C 116 47.749 50.008 -2.259 1
1 904 . 7 1 1 A 78 78 ALA CB C 116 19.626 21.422 -1.796 1
1 905 . 7 1 1 A 78 78 ALA N N 116 125.564 124.468 1.096 1
1 906 . 7 1 1 A 79 79 PRO HA H 117 4.698 4.907 -0.209 1
1 911 . 7 1 1 A 79 79 PRO C C 117 173.994 176.320 -2.326 1
1 912 . 7 1 1 A 79 79 PRO CA C 117 60.249 63.570 -3.321 1
1 913 . 7 1 1 A 79 79 PRO CB C 117 31.501 31.876 -0.375 1
1 916 . 7 1 1 A 80 80 GLY H H 118 7.096 8.191 -1.095 1
1 917 . 7 1 1 A 80 80 GLY HA2 H 118 3.797 4.016 -0.219 1
1 918 . 7 1 1 A 80 80 GLY HA3 H 118 3.517 4.025 -0.508 1
1 919 . 7 1 1 A 80 80 GLY C C 118 171.404 173.713 -2.309 1
1 920 . 7 1 1 A 80 80 GLY CA C 118 41.500 46.128 -4.628 1
1 921 . 7 1 1 A 80 80 GLY N N 118 108.306 109.124 -0.818 1
1 922 . 7 1 1 A 81 81 THR H H 119 9.810 7.946 1.864 1
1 923 . 7 1 1 A 81 81 THR HA H 119 4.091 4.407 -0.316 1
1 928 . 7 1 1 A 81 81 THR C C 119 174.242 174.697 -0.455 1
1 929 . 7 1 1 A 81 81 THR CA C 119 60.874 60.750 0.124 1
1 930 . 7 1 1 A 81 81 THR CB C 119 66.498 68.762 -2.264 1
1 932 . 7 1 1 A 81 81 THR N N 119 112.813 112.140 0.673 1
1 933 . 7 1 1 A 82 82 LYS H H 120 8.964 8.427 0.537 1
1 934 . 7 1 1 A 82 82 LYS HA H 120 4.150 3.968 0.182 1
1 941 . 7 1 1 A 82 82 LYS C C 120 172.886 175.667 -2.781 1
1 942 . 7 1 1 A 82 82 LYS CA C 120 53.999 57.369 -3.370 1
1 943 . 7 1 1 A 82 82 LYS CB C 120 30.876 30.108 0.768 1
1 944 . 7 1 1 A 82 82 LYS N N 120 123.569 121.901 1.668 1
1 945 . 7 1 1 A 83 83 GLY H H 121 7.125 7.928 -0.803 1
1 946 . 7 1 1 A 83 83 GLY HA2 H 121 3.814 4.243 -0.429 1
1 947 . 7 1 1 A 83 83 GLY HA3 H 121 3.814 4.272 -0.458 1
1 948 . 7 1 1 A 83 83 GLY C C 121 167.671 174.178 -6.507 1
1 949 . 7 1 1 A 83 83 GLY CA C 121 42.125 44.246 -2.121 1
1 950 . 7 1 1 A 83 83 GLY N N 121 107.253 109.204 -1.951 1
1 951 . 7 1 1 A 84 84 PRO HA H 122 4.077 4.516 -0.439 1
1 958 . 7 1 1 A 84 84 PRO C C 122 175.199 176.022 -0.823 1
1 959 . 7 1 1 A 84 84 PRO CA C 122 63.373 64.421 -1.048 1
1 960 . 7 1 1 A 84 84 PRO CB C 122 30.251 32.161 -1.910 1
1 962 . 7 1 1 A 85 85 PHE H H 123 6.652 6.899 -0.247 1
1 963 . 7 1 1 A 85 85 PHE HA H 123 4.744 4.720 0.024 1
1 971 . 7 1 1 A 85 85 PHE C C 123 170.340 172.631 -2.291 1
1 972 . 7 1 1 A 85 85 PHE CA C 123 53.999 56.518 -2.519 1
1 973 . 7 1 1 A 85 85 PHE CB C 123 39.000 40.171 -1.171 1
1 974 . 7 1 1 A 85 85 PHE N N 123 108.468 112.056 -3.588 1
1 975 . 7 1 1 A 86 86 ASP H H 124 9.268 8.991 0.277 1
1 976 . 7 1 1 A 86 86 ASP HA H 124 5.108 5.483 -0.375 1
1 979 . 7 1 1 A 86 86 ASP C C 124 171.180 174.755 -3.575 1
1 980 . 7 1 1 A 86 86 ASP CA C 124 50.249 53.723 -3.474 1
1 981 . 7 1 1 A 86 86 ASP CB C 124 40.250 44.425 -4.175 1
1 982 . 7 1 1 A 86 86 ASP N N 124 121.741 119.018 2.723 1
1 983 . 7 1 1 A 87 87 LEU H H 125 8.018 9.623 -1.605 1
1 984 . 7 1 1 A 87 87 LEU HA H 125 5.809 5.568 0.241 1
1 994 . 7 1 1 A 87 87 LEU C C 125 171.350 175.011 -3.661 1
1 995 . 7 1 1 A 87 87 LEU CA C 125 50.874 53.841 -2.967 1
1 996 . 7 1 1 A 87 87 LEU CB C 125 44.318 45.843 -1.525 1
1 999 . 7 1 1 A 87 87 LEU N N 125 123.629 127.302 -3.673 1
1 1000 . 7 1 1 A 88 88 TYR H H 126 8.912 8.566 0.346 1
1 1001 . 7 1 1 A 88 88 TYR HA H 126 5.630 5.642 -0.012 1
1 1008 . 7 1 1 A 88 88 TYR C C 126 171.410 172.836 -1.426 1
1 1009 . 7 1 1 A 88 88 TYR CA C 126 52.749 56.640 -3.891 1
1 1010 . 7 1 1 A 88 88 TYR CB C 126 37.750 40.518 -2.768 1
1 1011 . 7 1 1 A 88 88 TYR N N 126 119.697 121.950 -2.253 1
1 1012 . 7 1 1 A 89 89 SER H H 127 9.319 9.395 -0.076 1
1 1013 . 7 1 1 A 89 89 SER HA H 127 5.429 5.367 0.062 1
1 1016 . 7 1 1 A 89 89 SER CA C 127 52.124 57.396 -5.272 1
1 1017 . 7 1 1 A 89 89 SER CB C 127 62.748 66.517 -3.769 1
1 1018 . 7 1 1 A 89 89 SER N N 127 112.637 116.593 -3.956 1
1 1019 . 7 1 1 A 90 90 LEU H H 128 8.759 8.527 0.232 1
1 1020 . 7 1 1 A 90 90 LEU HA H 128 4.186 4.404 -0.218 1
1 1030 . 7 1 1 A 90 90 LEU C C 128 175.121 178.185 -3.064 1
1 1031 . 7 1 1 A 90 90 LEU CA C 128 52.749 55.083 -2.334 1
1 1032 . 7 1 1 A 90 90 LEU CB C 128 35.875 42.253 -6.378 1
1 1033 . 7 1 1 A 90 90 LEU N N 128 126.728 124.212 2.516 1
1 1034 . 7 1 1 A 91 91 GLY H H 129 8.356 8.204 0.152 1
1 1035 . 7 1 1 A 91 91 GLY HA2 H 129 3.373 3.564 -0.191 1
1 1036 . 7 1 1 A 91 91 GLY HA3 H 129 3.373 3.829 -0.456 1
1 1037 . 7 1 1 A 91 91 GLY C C 129 172.013 174.401 -2.388 1
1 1038 . 7 1 1 A 91 91 GLY CA C 129 41.500 43.718 -2.218 1
1 1039 . 7 1 1 A 91 91 GLY N N 129 108.559 108.754 -0.195 1
1 1040 . 7 1 1 A 92 92 ALA H H 130 7.047 8.338 -1.291 1
1 1041 . 7 1 1 A 92 92 ALA HA H 130 4.037 3.064 0.973 1
1 1045 . 7 1 1 A 92 92 ALA C C 130 174.890 178.003 -3.113 1
1 1046 . 7 1 1 A 92 92 ALA CA C 130 52.100 53.931 -1.831 1
1 1047 . 7 1 1 A 92 92 ALA CB C 130 16.502 17.954 -1.452 1
1 1048 . 7 1 1 A 92 92 ALA N N 130 118.393 121.773 -3.380 1
1 1049 . 7 1 1 A 93 93 ASP H H 131 7.222 7.649 -0.427 1
1 1050 . 7 1 1 A 93 93 ASP HA H 131 4.122 4.682 -0.560 1
1 1053 . 7 1 1 A 93 93 ASP C C 131 174.890 176.213 -1.323 1
1 1054 . 7 1 1 A 93 93 ASP CA C 131 50.249 53.943 -3.694 1
1 1055 . 7 1 1 A 93 93 ASP CB C 131 37.750 41.394 -3.644 1
1 1056 . 7 1 1 A 93 93 ASP N N 131 111.487 116.472 -4.985 1
1 1057 . 7 1 1 A 94 94 GLY H H 132 7.199 8.199 -1.000 1
1 1058 . 7 1 1 A 94 94 GLY HA2 H 132 3.951 3.851 0.100 1
1 1059 . 7 1 1 A 94 94 GLY HA3 H 132 3.324 3.863 -0.539 1
1 1060 . 7 1 1 A 94 94 GLY C C 132 169.773 173.811 -4.038 1
1 1061 . 7 1 1 A 94 94 GLY CA C 132 44.625 45.551 -0.926 1
1 1062 . 7 1 1 A 94 94 GLY N N 132 106.932 108.175 -1.243 1
1 1063 . 7 1 1 A 95 95 LYS H H 133 7.215 7.710 -0.495 1
1 1064 . 7 1 1 A 95 95 LYS HA H 133 4.513 4.576 -0.063 1
1 1073 . 7 1 1 A 95 95 LYS C C 133 172.108 175.496 -3.388 1
1 1074 . 7 1 1 A 95 95 LYS CA C 133 51.512 54.873 -3.361 1
1 1075 . 7 1 1 A 95 95 LYS CB C 133 34.000 34.413 -0.413 1
1 1076 . 7 1 1 A 95 95 LYS N N 133 115.749 121.698 -5.949 1
1 1077 . 7 1 1 A 96 96 GLU H H 134 9.230 8.678 0.552 1
1 1078 . 7 1 1 A 96 96 GLU HA H 134 4.352 4.987 -0.635 1
1 1083 . 7 1 1 A 96 96 GLU C C 134 175.219 175.425 -0.206 1
1 1084 . 7 1 1 A 96 96 GLU CA C 134 55.874 55.474 0.400 1
1 1085 . 7 1 1 A 96 96 GLU CB C 134 27.126 30.527 -3.401 1
1 1087 . 7 1 1 A 96 96 GLU N N 134 128.571 123.693 4.878 1
1 1088 . 7 1 1 A 97 97 GLY H H 135 10.677 8.467 2.210 1
1 1089 . 7 1 1 A 97 97 GLY HA2 H 135 4.037 4.353 -0.316 1
1 1090 . 7 1 1 A 97 97 GLY HA3 H 135 3.717 4.356 -0.639 1
1 1091 . 7 1 1 A 97 97 GLY C C 135 171.567 172.105 -0.538 1
1 1092 . 7 1 1 A 97 97 GLY CA C 135 41.500 45.765 -4.265 1
1 1093 . 7 1 1 A 97 97 GLY N N 135 117.011 110.598 6.413 1
1 1094 . 7 1 1 A 98 98 GLY H H 136 8.442 8.718 -0.276 1
1 1095 . 7 1 1 A 98 98 GLY HA2 H 136 4.195 4.221 -0.026 1
1 1096 . 7 1 1 A 98 98 GLY HA3 H 136 4.195 4.225 -0.030 1
1 1097 . 7 1 1 A 98 98 GLY C C 136 170.299 173.449 -3.150 1
1 1098 . 7 1 1 A 98 98 GLY CA C 136 40.875 44.880 -4.005 1
1 1099 . 7 1 1 A 98 98 GLY N N 136 109.494 108.976 0.518 1
1 1100 . 7 1 1 A 99 99 SER H H 137 8.701 8.742 -0.041 1
1 1101 . 7 1 1 A 99 99 SER HA H 137 4.639 4.917 -0.278 1
1 1104 . 7 1 1 A 99 99 SER C C 137 170.630 173.502 -2.872 1
1 1105 . 7 1 1 A 99 99 SER CA C 137 54.624 57.538 -2.914 1
1 1106 . 7 1 1 A 99 99 SER CB C 137 62.748 66.625 -3.877 1
1 1107 . 7 1 1 A 99 99 SER N N 137 114.685 118.719 -4.034 1
1 1108 . 7 1 1 A 100 100 ASP H H 138 9.117 9.197 -0.080 1
1 1109 . 7 1 1 A 100 100 ASP HA H 138 3.965 4.459 -0.494 1
1 1112 . 7 1 1 A 100 100 ASP C C 138 175.540 177.991 -2.451 1
1 1113 . 7 1 1 A 100 100 ASP CA C 138 54.624 56.873 -2.249 1
1 1114 . 7 1 1 A 100 100 ASP CB C 138 36.500 40.629 -4.129 1
1 1115 . 7 1 1 A 100 100 ASP N N 138 120.777 122.697 -1.920 1
1 1116 . 7 1 1 A 101 101 ASN H H 139 8.667 8.404 0.263 1
1 1117 . 7 1 1 A 101 101 ASN HA H 139 4.333 4.759 -0.426 1
1 1122 . 7 1 1 A 101 101 ASN CA C 139 53.999 53.780 0.219 1
1 1123 . 7 1 1 A 101 101 ASN CB C 139 34.625 38.532 -3.907 1
1 1124 . 7 1 1 A 101 101 ASN N N 139 121.930 116.327 5.603 1
1 1126 . 7 1 1 A 102 102 ASP H H 140 7.714 7.866 -0.152 1
1 1127 . 7 1 1 A 102 102 ASP HA H 140 4.037 4.497 -0.460 1
1 1130 . 7 1 1 A 102 102 ASP C C 140 172.807 175.888 -3.081 1
1 1131 . 7 1 1 A 102 102 ASP CA C 140 53.374 54.032 -0.658 1
1 1132 . 7 1 1 A 102 102 ASP CB C 140 37.125 41.684 -4.559 1
1 1133 . 7 1 1 A 102 102 ASP N N 140 118.011 118.339 -0.328 1
1 1134 . 7 1 1 A 103 103 ALA H H 141 7.060 7.262 -0.202 1
1 1135 . 7 1 1 A 103 103 ALA HA H 141 3.353 4.591 -1.238 1
1 1139 . 7 1 1 A 103 103 ALA C C 141 172.233 176.578 -4.345 1
1 1140 . 7 1 1 A 103 103 ALA CA C 141 49.624 51.647 -2.023 1
1 1141 . 7 1 1 A 103 103 ALA CB C 141 16.502 20.679 -4.177 1
1 1142 . 7 1 1 A 103 103 ALA N N 141 125.777 122.838 2.939 1
1 1143 . 7 1 1 A 104 104 ASP H H 142 7.973 8.528 -0.555 1
1 1144 . 7 1 1 A 104 104 ASP HA H 142 4.420 5.160 -0.740 1
1 1147 . 7 1 1 A 104 104 ASP C C 142 174.188 176.029 -1.841 1
1 1148 . 7 1 1 A 104 104 ASP CA C 142 52.124 53.614 -1.490 1
1 1149 . 7 1 1 A 104 104 ASP CB C 142 37.125 41.193 -4.068 1
1 1150 . 7 1 1 A 104 104 ASP N N 142 122.965 119.821 3.144 1
1 1151 . 7 1 1 A 105 105 ILE H H 143 8.534 8.668 -0.134 1
1 1152 . 7 1 1 A 105 105 ILE HA H 143 4.060 4.881 -0.821 1
1 1162 . 7 1 1 A 105 105 ILE C C 143 173.235 176.038 -2.803 1
1 1163 . 7 1 1 A 105 105 ILE CA C 143 58.374 59.935 -1.561 1
1 1164 . 7 1 1 A 105 105 ILE CB C 143 39.123 39.462 -0.339 1
1 1167 . 7 1 1 A 105 105 ILE N N 143 124.757 121.266 3.491 1
1 1168 . 7 1 1 A 106 106 GLY H H 144 8.288 8.317 -0.029 1
1 1169 . 7 1 1 A 106 106 GLY HA2 H 144 4.764 4.407 0.357 1
1 1170 . 7 1 1 A 106 106 GLY HA3 H 144 4.764 4.484 0.280 1
1 1171 . 7 1 1 A 106 106 GLY C C 144 171.321 171.839 -0.518 1
1 1172 . 7 1 1 A 106 106 GLY CA C 144 40.250 45.815 -5.565 1
1 1173 . 7 1 1 A 106 106 GLY N N 144 110.895 111.306 -0.411 1
1 1174 . 7 1 1 A 107 107 ASN H H 145 8.577 9.001 -0.424 1
1 1175 . 7 1 1 A 107 107 ASN HA H 145 4.268 5.181 -0.913 1
1 1180 . 7 1 1 A 107 107 ASN C C 145 171.757 173.602 -1.845 1
1 1181 . 7 1 1 A 107 107 ASN CA C 145 52.124 51.555 0.569 1
1 1182 . 7 1 1 A 107 107 ASN CB C 145 34.625 42.363 -7.738 1
1 1183 . 7 1 1 A 107 107 ASN N N 145 118.042 115.904 2.138 1
1 1185 . 7 1 1 A 108 108 TRP H H 146 6.822 8.349 -1.527 1
1 1186 . 7 1 1 A 108 108 TRP HA H 146 4.513 4.949 -0.436 1
1 1195 . 7 1 1 A 108 108 TRP C C 146 172.665 172.076 0.589 1
1 1196 . 7 1 1 A 108 108 TRP CA C 146 54.624 55.712 -1.088 1
1 1197 . 7 1 1 A 108 108 TRP CB C 146 25.876 30.909 -5.033 1
1 1198 . 7 1 1 A 108 108 TRP N N 146 116.756 117.818 -1.062 1
1 1200 . 7 1 1 A 109 109 ASP H H 147 7.344 7.799 -0.455 1
1 1201 . 7 1 1 A 109 109 ASP HA H 147 4.655 5.456 -0.801 1
1 1204 . 7 1 1 A 109 109 ASP C C 147 172.193 174.720 -2.527 1
1 1205 . 7 1 1 A 109 109 ASP CA C 147 51.499 52.538 -1.039 1
1 1206 . 7 1 1 A 109 109 ASP CB C 147 39.000 44.331 -5.331 1
1 1207 . 7 1 1 A 109 109 ASP N N 147 121.461 120.414 1.047 1
1 11 . 8 1 1 A 2 2 SER H H 40 8.461 8.929 -0.468 1
1 12 . 8 1 1 A 2 2 SER HA H 40 4.286 5.146 -0.860 1
1 15 . 8 1 1 A 2 2 SER C C 40 171.276 173.106 -1.830 1
1 16 . 8 1 1 A 2 2 SER CA C 40 55.249 57.858 -2.609 1
1 17 . 8 1 1 A 2 2 SER CB C 40 61.498 64.090 -2.592 1
1 18 . 8 1 1 A 2 2 SER N N 40 118.344 123.605 -5.261 1
1 19 . 8 1 1 A 3 3 ARG H H 41 8.469 8.633 -0.164 1
1 20 . 8 1 1 A 3 3 ARG HA H 41 4.400 4.929 -0.529 1
1 25 . 8 1 1 A 3 3 ARG C C 41 172.251 174.105 -1.854 1
1 26 . 8 1 1 A 3 3 ARG CA C 41 52.749 53.933 -1.184 1
1 27 . 8 1 1 A 3 3 ARG CB C 41 27.126 33.097 -5.971 1
1 28 . 8 1 1 A 3 3 ARG N N 41 123.070 121.909 1.161 1
1 33 . 8 1 1 A 4 4 PRO CA C 42 61.498 63.793 -2.295 1
1 34 . 8 1 1 A 4 4 PRO CB C 42 29.001 31.648 -2.647 1
1 37 . 8 1 1 A 5 5 ASP H H 43 8.246 8.942 -0.696 1
1 38 . 8 1 1 A 5 5 ASP HA H 43 4.329 4.404 -0.075 1
1 41 . 8 1 1 A 5 5 ASP C C 43 174.605 176.489 -1.884 1
1 42 . 8 1 1 A 5 5 ASP CA C 43 53.374 56.375 -3.001 1
1 43 . 8 1 1 A 5 5 ASP CB C 43 38.375 38.640 -0.265 1
1 44 . 8 1 1 A 5 5 ASP N N 43 119.409 117.651 1.758 1
1 45 . 8 1 1 A 6 6 GLN H H 44 8.309 8.350 -0.041 1
1 46 . 8 1 1 A 6 6 GLN HA H 44 4.393 4.152 0.241 1
1 53 . 8 1 1 A 6 6 GLN C C 44 175.053 178.530 -3.477 1
1 54 . 8 1 1 A 6 6 GLN CA C 44 55.874 58.593 -2.719 1
1 55 . 8 1 1 A 6 6 GLN CB C 44 25.876 28.000 -2.124 1
1 57 . 8 1 1 A 6 6 GLN N N 44 122.273 118.062 4.211 1
1 59 . 8 1 1 A 7 7 ALA H H 45 8.106 8.675 -0.569 1
1 60 . 8 1 1 A 7 7 ALA HA H 45 3.993 4.033 -0.040 1
1 64 . 8 1 1 A 7 7 ALA C C 45 177.465 179.611 -2.146 1
1 65 . 8 1 1 A 7 7 ALA CA C 45 52.124 55.128 -3.004 1
1 66 . 8 1 1 A 7 7 ALA CB C 45 15.252 18.273 -3.021 1
1 67 . 8 1 1 A 7 7 ALA N N 45 122.204 122.439 -0.235 1
1 68 . 8 1 1 A 8 8 LYS H H 46 7.527 7.835 -0.308 1
1 69 . 8 1 1 A 8 8 LYS HA H 46 3.539 4.014 -0.475 1
1 78 . 8 1 1 A 8 8 LYS C C 46 175.412 179.103 -3.691 1
1 79 . 8 1 1 A 8 8 LYS CA C 46 57.124 58.417 -1.293 1
1 80 . 8 1 1 A 8 8 LYS CB C 46 30.876 32.006 -1.130 1
1 83 . 8 1 1 A 8 8 LYS N N 46 117.358 116.804 0.554 1
1 84 . 8 1 1 A 9 9 VAL H H 47 7.709 7.901 -0.192 1
1 85 . 8 1 1 A 9 9 VAL HA H 47 3.578 3.803 -0.225 1
1 93 . 8 1 1 A 9 9 VAL C C 47 175.005 178.478 -3.473 1
1 94 . 8 1 1 A 9 9 VAL CA C 47 64.623 66.203 -1.580 1
1 95 . 8 1 1 A 9 9 VAL CB C 47 29.001 31.787 -2.786 1
1 98 . 8 1 1 A 9 9 VAL N N 47 119.115 120.357 -1.242 1
1 99 . 8 1 1 A 10 10 THR H H 48 7.767 8.116 -0.349 1
1 100 . 8 1 1 A 10 10 THR HA H 48 3.668 4.022 -0.354 1
1 105 . 8 1 1 A 10 10 THR CA C 48 63.998 65.694 -1.696 1
1 106 . 8 1 1 A 10 10 THR CB C 48 67.123 68.675 -1.552 1
1 108 . 8 1 1 A 10 10 THR N N 48 115.112 113.926 1.186 1
1 109 . 8 1 1 A 11 11 VAL H H 49 7.598 7.815 -0.217 1
1 110 . 8 1 1 A 11 11 VAL HA H 49 3.457 3.885 -0.428 1
1 118 . 8 1 1 A 11 11 VAL C C 49 175.412 178.085 -2.673 1
1 119 . 8 1 1 A 11 11 VAL CA C 49 63.998 64.960 -0.962 1
1 120 . 8 1 1 A 11 11 VAL CB C 49 29.001 31.715 -2.714 1
1 123 . 8 1 1 A 11 11 VAL N N 49 123.694 117.430 6.264 1
1 124 . 8 1 1 A 12 12 ALA H H 50 8.176 7.864 0.312 1
1 125 . 8 1 1 A 12 12 ALA HA H 50 4.742 4.047 0.695 1
1 129 . 8 1 1 A 12 12 ALA C C 50 177.074 179.647 -2.573 1
1 130 . 8 1 1 A 12 12 ALA CA C 50 52.124 55.196 -3.072 1
1 131 . 8 1 1 A 12 12 ALA CB C 50 15.252 18.091 -2.839 1
1 132 . 8 1 1 A 12 12 ALA N N 50 122.348 124.223 -1.875 1
1 133 . 8 1 1 A 13 13 LYS H H 51 8.499 7.982 0.517 1
1 134 . 8 1 1 A 13 13 LYS HA H 51 3.648 4.104 -0.456 1
1 143 . 8 1 1 A 13 13 LYS C C 51 177.252 179.850 -2.598 1
1 144 . 8 1 1 A 13 13 LYS CA C 51 58.072 59.496 -1.424 1
1 145 . 8 1 1 A 13 13 LYS CB C 51 30.251 32.283 -2.032 1
1 146 . 8 1 1 A 13 13 LYS N N 51 115.402 117.220 -1.818 1
1 147 . 8 1 1 A 14 14 GLY H H 52 7.858 7.939 -0.081 1
1 148 . 8 1 1 A 14 14 GLY HA2 H 52 3.823 3.848 -0.025 1
1 149 . 8 1 1 A 14 14 GLY HA3 H 52 3.676 3.853 -0.177 1
1 150 . 8 1 1 A 14 14 GLY C C 52 174.090 175.648 -1.558 1
1 151 . 8 1 1 A 14 14 GLY CA C 52 44.625 46.964 -2.339 1
1 152 . 8 1 1 A 14 14 GLY N N 52 107.466 108.900 -1.434 1
1 153 . 8 1 1 A 15 15 ASP H H 53 8.403 7.714 0.689 1
1 154 . 8 1 1 A 15 15 ASP HA H 53 4.191 4.510 -0.319 1
1 157 . 8 1 1 A 15 15 ASP C C 53 175.316 178.651 -3.335 1
1 158 . 8 1 1 A 15 15 ASP CA C 53 54.624 56.175 -1.551 1
1 159 . 8 1 1 A 15 15 ASP CB C 53 35.875 40.660 -4.785 1
1 160 . 8 1 1 A 15 15 ASP N N 53 125.929 121.077 4.852 1
1 161 . 8 1 1 A 16 16 ILE H H 54 8.245 8.248 -0.003 1
1 162 . 8 1 1 A 16 16 ILE HA H 54 3.034 3.854 -0.820 1
1 172 . 8 1 1 A 16 16 ILE C C 54 174.499 177.814 -3.315 1
1 173 . 8 1 1 A 16 16 ILE CA C 54 62.748 64.112 -1.364 1
1 174 . 8 1 1 A 16 16 ILE CB C 54 34.625 37.336 -2.711 1
1 178 . 8 1 1 A 16 16 ILE N N 54 119.456 115.516 3.940 1
1 179 . 8 1 1 A 17 17 LYS H H 55 7.547 8.148 -0.601 1
1 180 . 8 1 1 A 17 17 LYS HA H 55 3.843 4.131 -0.288 1
1 187 . 8 1 1 A 17 17 LYS C C 55 176.651 179.015 -2.364 1
1 188 . 8 1 1 A 17 17 LYS CA C 55 57.124 58.947 -1.823 1
1 189 . 8 1 1 A 17 17 LYS CB C 55 30.251 31.823 -1.572 1
1 190 . 8 1 1 A 17 17 LYS N N 55 118.505 121.097 -2.592 1
1 191 . 8 1 1 A 18 18 ALA H H 56 7.680 7.955 -0.275 1
1 192 . 8 1 1 A 18 18 ALA HA H 56 4.029 4.036 -0.007 1
1 196 . 8 1 1 A 18 18 ALA C C 56 176.638 179.644 -3.006 1
1 197 . 8 1 1 A 18 18 ALA CA C 56 52.749 54.909 -2.160 1
1 198 . 8 1 1 A 18 18 ALA CB C 56 15.877 18.472 -2.595 1
1 199 . 8 1 1 A 18 18 ALA N N 56 122.477 121.818 0.659 1
1 200 . 8 1 1 A 19 19 ILE H H 57 8.853 7.631 1.222 1
1 201 . 8 1 1 A 19 19 ILE HA H 57 3.304 3.549 -0.245 1
1 211 . 8 1 1 A 19 19 ILE C C 57 174.710 177.771 -3.061 1
1 212 . 8 1 1 A 19 19 ILE CA C 57 63.373 65.432 -2.059 1
1 213 . 8 1 1 A 19 19 ILE CB C 57 35.250 38.029 -2.779 1
1 217 . 8 1 1 A 19 19 ILE N N 57 120.901 118.240 2.661 1
1 218 . 8 1 1 A 20 20 ALA H H 58 8.702 8.112 0.590 1
1 219 . 8 1 1 A 20 20 ALA HA H 58 3.900 4.175 -0.275 1
1 223 . 8 1 1 A 20 20 ALA C C 58 176.512 179.414 -2.902 1
1 224 . 8 1 1 A 20 20 ALA CA C 58 52.749 55.282 -2.533 1
1 225 . 8 1 1 A 20 20 ALA CB C 58 15.252 18.091 -2.839 1
1 226 . 8 1 1 A 20 20 ALA N N 58 121.763 122.256 -0.493 1
1 227 . 8 1 1 A 21 21 ALA H H 59 7.662 7.581 0.081 1
1 228 . 8 1 1 A 21 21 ALA HA H 59 4.136 4.310 -0.174 1
1 232 . 8 1 1 A 21 21 ALA C C 59 177.949 179.616 -1.667 1
1 233 . 8 1 1 A 21 21 ALA CA C 59 52.749 54.829 -2.080 1
1 234 . 8 1 1 A 21 21 ALA CB C 59 15.252 18.770 -3.518 1
1 235 . 8 1 1 A 21 21 ALA N N 59 119.079 119.135 -0.056 1
1 236 . 8 1 1 A 22 22 ALA H H 60 7.403 7.935 -0.532 1
1 237 . 8 1 1 A 22 22 ALA HA H 60 4.318 4.144 0.174 1
1 241 . 8 1 1 A 22 22 ALA C C 60 176.730 180.416 -3.686 1
1 242 . 8 1 1 A 22 22 ALA CA C 60 52.749 54.800 -2.051 1
1 243 . 8 1 1 A 22 22 ALA CB C 60 17.126 18.368 -1.242 1
1 244 . 8 1 1 A 22 22 ALA N N 60 122.616 121.076 1.540 1
1 245 . 8 1 1 A 23 23 LEU H H 61 8.410 8.583 -0.173 1
1 246 . 8 1 1 A 23 23 LEU HA H 61 3.527 3.862 -0.335 1
1 256 . 8 1 1 A 23 23 LEU C C 61 176.057 178.266 -2.209 1
1 257 . 8 1 1 A 23 23 LEU CA C 61 55.249 57.099 -1.850 1
1 258 . 8 1 1 A 23 23 LEU CB C 61 39.000 40.740 -1.740 1
1 262 . 8 1 1 A 23 23 LEU N N 61 120.761 120.941 -0.180 1
1 263 . 8 1 1 A 24 24 ASP H H 62 8.227 8.147 0.080 1
1 264 . 8 1 1 A 24 24 ASP HA H 62 4.581 4.517 0.064 1
1 267 . 8 1 1 A 24 24 ASP C C 62 176.968 178.400 -1.432 1
1 268 . 8 1 1 A 24 24 ASP CA C 62 55.874 56.529 -0.655 1
1 269 . 8 1 1 A 24 24 ASP CB C 62 37.750 40.666 -2.916 1
1 270 . 8 1 1 A 24 24 ASP N N 62 119.068 119.063 0.005 1
1 271 . 8 1 1 A 25 25 MET H H 63 7.718 8.080 -0.362 1
1 272 . 8 1 1 A 25 25 MET HA H 63 4.196 4.217 -0.021 1
1 277 . 8 1 1 A 25 25 MET C C 63 174.968 177.915 -2.947 1
1 278 . 8 1 1 A 25 25 MET CA C 63 55.249 58.570 -3.321 1
1 279 . 8 1 1 A 25 25 MET CB C 63 29.626 32.708 -3.082 1
1 281 . 8 1 1 A 25 25 MET N N 63 121.365 117.476 3.889 1
1 282 . 8 1 1 A 26 26 TYR H H 64 8.401 7.577 0.824 1
1 283 . 8 1 1 A 26 26 TYR HA H 64 4.400 3.521 0.879 1
1 291 . 8 1 1 A 26 26 TYR C C 64 176.098 177.326 -1.228 1
1 292 . 8 1 1 A 26 26 TYR CA C 64 58.999 61.016 -2.017 1
1 293 . 8 1 1 A 26 26 TYR CB C 64 35.250 37.769 -2.519 1
1 294 . 8 1 1 A 26 26 TYR N N 64 122.575 121.750 0.825 1
1 295 . 8 1 1 A 27 27 LYS H H 65 8.330 8.103 0.227 1
1 296 . 8 1 1 A 27 27 LYS HA H 65 3.568 4.045 -0.477 1
1 302 . 8 1 1 A 27 27 LYS C C 65 176.156 178.692 -2.536 1
1 303 . 8 1 1 A 27 27 LYS CA C 65 56.499 59.434 -2.935 1
1 304 . 8 1 1 A 27 27 LYS CB C 65 29.626 31.631 -2.005 1
1 306 . 8 1 1 A 27 27 LYS N N 65 121.390 118.529 2.861 1
1 307 . 8 1 1 A 28 28 LEU H H 66 7.833 7.619 0.214 1
1 308 . 8 1 1 A 28 28 LEU HA H 66 3.769 4.090 -0.321 1
1 318 . 8 1 1 A 28 28 LEU C C 66 175.925 178.355 -2.430 1
1 319 . 8 1 1 A 28 28 LEU CA C 66 55.874 56.690 -0.816 1
1 320 . 8 1 1 A 28 28 LEU CB C 66 38.375 41.596 -3.221 1
1 324 . 8 1 1 A 28 28 LEU N N 66 123.068 119.331 3.737 1
1 325 . 8 1 1 A 29 29 ASP H H 67 7.292 7.802 -0.510 1
1 326 . 8 1 1 A 29 29 ASP HA H 67 4.096 4.346 -0.250 1
1 329 . 8 1 1 A 29 29 ASP C C 67 174.618 176.794 -2.176 1
1 330 . 8 1 1 A 29 29 ASP CA C 67 53.999 56.317 -2.318 1
1 331 . 8 1 1 A 29 29 ASP CB C 67 38.375 40.737 -2.362 1
1 332 . 8 1 1 A 29 29 ASP N N 67 114.729 119.232 -4.503 1
1 333 . 8 1 1 A 30 30 ASN H H 68 8.097 7.511 0.586 1
1 334 . 8 1 1 A 30 30 ASN HA H 68 4.337 4.349 -0.012 1
1 339 . 8 1 1 A 30 30 ASN C C 68 172.822 174.158 -1.336 1
1 340 . 8 1 1 A 30 30 ASN CA C 68 52.124 51.949 0.175 1
1 341 . 8 1 1 A 30 30 ASN CB C 68 37.750 38.337 -0.587 1
1 342 . 8 1 1 A 30 30 ASN N N 68 111.054 115.101 -4.047 1
1 344 . 8 1 1 A 31 31 PHE H H 69 8.249 7.909 0.340 1
1 345 . 8 1 1 A 31 31 PHE HA H 69 4.135 4.254 -0.119 1
1 353 . 8 1 1 A 31 31 PHE C C 69 170.485 174.164 -3.679 1
1 354 . 8 1 1 A 31 31 PHE CA C 69 57.749 58.717 -0.968 1
1 355 . 8 1 1 A 31 31 PHE CB C 69 33.375 36.564 -3.189 1
1 356 . 8 1 1 A 31 31 PHE N N 69 116.277 117.210 -0.933 1
1 357 . 8 1 1 A 32 32 ALA H H 70 7.224 7.027 0.197 1
1 358 . 8 1 1 A 32 32 ALA HA H 70 4.194 4.522 -0.328 1
1 362 . 8 1 1 A 32 32 ALA C C 70 173.337 175.051 -1.714 1
1 363 . 8 1 1 A 32 32 ALA CA C 70 48.374 51.611 -3.237 1
1 364 . 8 1 1 A 32 32 ALA CB C 70 19.626 22.340 -2.714 1
1 365 . 8 1 1 A 32 32 ALA N N 70 119.914 120.304 -0.390 1
1 366 . 8 1 1 A 33 33 TYR H H 71 7.948 8.378 -0.430 1
1 367 . 8 1 1 A 33 33 TYR HA H 71 4.209 4.901 -0.692 1
1 374 . 8 1 1 A 33 33 TYR C C 71 170.591 174.280 -3.689 1
1 375 . 8 1 1 A 33 33 TYR CA C 71 54.624 56.547 -1.923 1
1 376 . 8 1 1 A 33 33 TYR CB C 71 34.000 37.865 -3.865 1
1 377 . 8 1 1 A 33 33 TYR N N 71 116.929 118.409 -1.480 1
1 378 . 8 1 1 A 34 34 PRO HA H 72 4.444 4.773 -0.329 1
1 381 . 8 1 1 A 34 34 PRO C C 72 174.775 176.338 -1.563 1
1 382 . 8 1 1 A 34 34 PRO CA C 72 59.624 62.577 -2.953 1
1 383 . 8 1 1 A 34 34 PRO CB C 72 28.376 32.037 -3.661 1
1 384 . 8 1 1 A 35 35 SER H H 73 8.721 8.419 0.302 1
1 385 . 8 1 1 A 35 35 SER HA H 73 4.467 4.792 -0.325 1
1 388 . 8 1 1 A 35 35 SER C C 73 173.271 175.623 -2.352 1
1 389 . 8 1 1 A 35 35 SER CA C 73 55.249 56.581 -1.332 1
1 390 . 8 1 1 A 35 35 SER CB C 73 63.373 65.997 -2.624 1
1 391 . 8 1 1 A 35 35 SER N N 73 118.284 114.330 3.954 1
1 392 . 8 1 1 A 36 36 THR H H 74 8.591 8.870 -0.279 1
1 393 . 8 1 1 A 36 36 THR HA H 74 3.649 4.130 -0.481 1
1 398 . 8 1 1 A 36 36 THR CA C 74 64.623 63.914 0.709 1
1 399 . 8 1 1 A 36 36 THR CB C 74 66.498 69.053 -2.555 1
1 401 . 8 1 1 A 36 36 THR N N 74 117.769 117.117 0.652 1
1 402 . 8 1 1 A 37 37 GLN H H 75 8.210 7.865 0.345 1
1 403 . 8 1 1 A 37 37 GLN HA H 75 3.860 4.471 -0.611 1
1 410 . 8 1 1 A 37 37 GLN C C 75 175.349 177.536 -2.187 1
1 411 . 8 1 1 A 37 37 GLN CA C 75 56.499 57.579 -1.080 1
1 412 . 8 1 1 A 37 37 GLN CB C 75 25.876 29.657 -3.781 1
1 414 . 8 1 1 A 37 37 GLN N N 75 117.931 119.889 -1.958 1
1 416 . 8 1 1 A 38 38 GLN H H 76 7.667 8.301 -0.634 1
1 417 . 8 1 1 A 38 38 GLN HA H 76 3.810 4.113 -0.303 1
1 424 . 8 1 1 A 38 38 GLN C C 76 175.805 179.541 -3.736 1
1 425 . 8 1 1 A 38 38 GLN CA C 76 55.874 58.621 -2.747 1
1 426 . 8 1 1 A 38 38 GLN CB C 76 25.876 28.296 -2.420 1
1 428 . 8 1 1 A 38 38 GLN N N 76 120.607 118.091 2.516 1
1 430 . 8 1 1 A 39 39 GLY H H 77 8.470 8.084 0.386 1
1 431 . 8 1 1 A 39 39 GLY HA2 H 77 3.920 3.744 0.176 1
1 432 . 8 1 1 A 39 39 GLY HA3 H 77 3.603 3.784 -0.181 1
1 433 . 8 1 1 A 39 39 GLY C C 77 169.006 175.585 -6.579 1
1 434 . 8 1 1 A 39 39 GLY CA C 77 42.125 46.608 -4.483 1
1 435 . 8 1 1 A 39 39 GLY N N 77 103.281 109.141 -5.860 1
1 436 . 8 1 1 A 40 40 LEU H H 78 8.135 7.854 0.281 1
1 437 . 8 1 1 A 40 40 LEU HA H 78 3.237 4.115 -0.878 1
1 447 . 8 1 1 A 40 40 LEU C C 78 176.383 178.750 -2.367 1
1 448 . 8 1 1 A 40 40 LEU CA C 78 52.749 57.221 -4.472 1
1 449 . 8 1 1 A 40 40 LEU CB C 78 39.000 41.519 -2.519 1
1 453 . 8 1 1 A 40 40 LEU N N 78 114.444 123.301 -8.857 1
1 454 . 8 1 1 A 41 41 GLU H H 79 8.578 8.002 0.576 1
1 455 . 8 1 1 A 41 41 GLU HA H 79 3.720 4.191 -0.471 1
1 460 . 8 1 1 A 41 41 GLU C C 79 175.093 178.190 -3.097 1
1 461 . 8 1 1 A 41 41 GLU CA C 79 57.124 59.253 -2.129 1
1 462 . 8 1 1 A 41 41 GLU CB C 79 26.501 28.874 -2.373 1
1 464 . 8 1 1 A 41 41 GLU N N 79 118.295 118.014 0.281 1
1 465 . 8 1 1 A 42 42 ALA H H 80 7.227 7.755 -0.528 1
1 466 . 8 1 1 A 42 42 ALA HA H 80 4.437 4.574 -0.137 1
1 470 . 8 1 1 A 42 42 ALA C C 80 173.745 178.210 -4.465 1
1 471 . 8 1 1 A 42 42 ALA CA C 80 51.499 53.804 -2.305 1
1 472 . 8 1 1 A 42 42 ALA CB C 80 15.877 18.576 -2.699 1
1 473 . 8 1 1 A 42 42 ALA N N 80 119.751 122.505 -2.754 1
1 474 . 8 1 1 A 43 43 LEU H H 81 7.932 7.503 0.429 1
1 475 . 8 1 1 A 43 43 LEU HA H 81 4.369 4.309 0.060 1
1 485 . 8 1 1 A 43 43 LEU C C 81 174.788 178.141 -3.353 1
1 486 . 8 1 1 A 43 43 LEU CA C 81 53.374 55.968 -2.594 1
1 487 . 8 1 1 A 43 43 LEU CB C 81 39.625 42.293 -2.668 1
1 491 . 8 1 1 A 43 43 LEU N N 81 111.742 116.456 -4.714 1
1 492 . 8 1 1 A 44 44 VAL H H 82 7.886 7.446 0.440 1
1 493 . 8 1 1 A 44 44 VAL HA H 82 4.700 4.234 0.466 1
1 501 . 8 1 1 A 44 44 VAL C C 82 172.875 176.285 -3.410 1
1 502 . 8 1 1 A 44 44 VAL CA C 82 59.624 63.844 -4.220 1
1 503 . 8 1 1 A 44 44 VAL CB C 82 31.501 33.529 -2.028 1
1 506 . 8 1 1 A 44 44 VAL N N 82 113.604 115.617 -2.013 1
1 507 . 8 1 1 A 45 45 LYS H H 83 8.361 8.322 0.039 1
1 508 . 8 1 1 A 45 45 LYS HA H 83 4.251 5.098 -0.847 1
1 515 . 8 1 1 A 45 45 LYS C C 83 171.053 175.414 -4.361 1
1 516 . 8 1 1 A 45 45 LYS CA C 83 52.749 54.741 -1.992 1
1 517 . 8 1 1 A 45 45 LYS CB C 83 33.375 35.388 -2.013 1
1 521 . 8 1 1 A 45 45 LYS N N 83 123.860 117.780 6.080 1
1 522 . 8 1 1 A 46 46 LYS H H 84 7.243 8.180 -0.937 1
1 523 . 8 1 1 A 46 46 LYS HA H 84 2.175 2.609 -0.434 1
1 532 . 8 1 1 A 46 46 LYS C C 84 172.123 174.772 -2.649 1
1 533 . 8 1 1 A 46 46 LYS CA C 84 52.749 53.755 -1.006 1
1 534 . 8 1 1 A 46 46 LYS CB C 84 29.626 32.508 -2.882 1
1 537 . 8 1 1 A 46 46 LYS N N 84 128.615 123.294 5.321 1
1 538 . 8 1 1 A 47 47 PRO HA H 85 4.470 4.331 0.139 1
1 541 . 8 1 1 A 47 47 PRO C C 85 173.754 176.524 -2.770 1
1 542 . 8 1 1 A 47 47 PRO CA C 85 60.874 63.165 -2.291 1
1 543 . 8 1 1 A 47 47 PRO CB C 85 30.876 31.930 -1.054 1
1 546 . 8 1 1 A 48 48 THR H H 86 8.306 8.284 0.022 1
1 547 . 8 1 1 A 48 48 THR HA H 86 4.287 4.499 -0.212 1
1 552 . 8 1 1 A 48 48 THR C C 86 173.070 174.150 -1.080 1
1 553 . 8 1 1 A 48 48 THR CA C 86 57.749 62.028 -4.279 1
1 554 . 8 1 1 A 48 48 THR CB C 86 67.748 69.528 -1.780 1
1 556 . 8 1 1 A 48 48 THR N N 86 109.564 113.139 -3.575 1
1 557 . 8 1 1 A 49 49 GLY H H 87 8.317 8.406 -0.089 1
1 558 . 8 1 1 A 49 49 GLY HA2 H 87 3.851 4.201 -0.350 1
1 559 . 8 1 1 A 49 49 GLY HA3 H 87 3.678 4.206 -0.528 1
1 560 . 8 1 1 A 49 49 GLY C C 87 169.693 172.257 -2.564 1
1 561 . 8 1 1 A 49 49 GLY CA C 87 42.125 45.023 -2.898 1
1 562 . 8 1 1 A 49 49 GLY N N 87 109.071 109.595 -0.524 1
1 563 . 8 1 1 A 50 50 ASN H H 88 8.301 8.418 -0.117 1
1 564 . 8 1 1 A 50 50 ASN HA H 88 4.780 5.399 -0.619 1
1 569 . 8 1 1 A 50 50 ASN C C 88 171.370 172.774 -1.404 1
1 570 . 8 1 1 A 50 50 ASN CA C 88 47.749 50.286 -2.537 1
1 571 . 8 1 1 A 50 50 ASN CB C 88 37.125 39.745 -2.620 1
1 572 . 8 1 1 A 50 50 ASN N N 88 115.631 120.514 -4.883 1
1 574 . 8 1 1 A 51 51 PRO HA H 89 4.782 4.549 0.233 1
1 577 . 8 1 1 A 51 51 PRO C C 89 173.656 175.478 -1.822 1
1 578 . 8 1 1 A 51 51 PRO CA C 89 59.624 62.310 -2.686 1
1 579 . 8 1 1 A 51 51 PRO CB C 89 31.501 32.292 -0.791 1
1 582 . 8 1 1 A 52 52 GLN H H 90 9.076 8.864 0.212 1
1 583 . 8 1 1 A 52 52 GLN HA H 90 4.469 4.874 -0.405 1
1 590 . 8 1 1 A 52 52 GLN C C 90 172.386 174.174 -1.788 1
1 591 . 8 1 1 A 52 52 GLN CA C 90 50.874 52.474 -1.600 1
1 592 . 8 1 1 A 52 52 GLN CB C 90 26.501 29.313 -2.812 1
1 594 . 8 1 1 A 52 52 GLN N N 90 126.827 120.170 6.657 1
1 596 . 8 1 1 A 53 53 PRO HA H 91 4.384 4.424 -0.040 1
1 599 . 8 1 1 A 53 53 PRO C C 91 174.274 175.963 -1.689 1
1 600 . 8 1 1 A 53 53 PRO CB C 91 28.113 32.029 -3.916 1
1 601 . 8 1 1 A 54 54 LYS H H 92 8.401 8.377 0.024 1
1 602 . 8 1 1 A 54 54 LYS HA H 92 3.984 4.851 -0.867 1
1 611 . 8 1 1 A 54 54 LYS C C 92 173.516 176.184 -2.668 1
1 612 . 8 1 1 A 54 54 LYS CA C 92 55.249 54.700 0.549 1
1 613 . 8 1 1 A 54 54 LYS CB C 92 30.876 36.505 -5.629 1
1 615 . 8 1 1 A 54 54 LYS N N 92 124.538 123.691 0.847 1
1 616 . 8 1 1 A 55 55 ASN H H 93 8.183 8.754 -0.571 1
1 617 . 8 1 1 A 55 55 ASN HA H 93 4.716 4.814 -0.098 1
1 622 . 8 1 1 A 55 55 ASN CA C 93 48.999 53.330 -4.331 1
1 623 . 8 1 1 A 55 55 ASN CB C 93 35.875 37.473 -1.598 1
1 624 . 8 1 1 A 55 55 ASN N N 93 118.677 120.672 -1.995 1
1 626 . 8 1 1 A 56 56 TRP H H 94 8.007 8.783 -0.776 1
1 627 . 8 1 1 A 56 56 TRP HA H 94 3.827 5.522 -1.695 1
1 635 . 8 1 1 A 56 56 TRP C C 94 173.760 175.439 -1.679 1
1 636 . 8 1 1 A 56 56 TRP CA C 94 59.624 58.748 0.876 1
1 637 . 8 1 1 A 56 56 TRP CB C 94 27.126 30.365 -3.239 1
1 638 . 8 1 1 A 56 56 TRP N N 94 122.195 127.765 -5.570 1
1 640 . 8 1 1 A 57 57 ASN H H 95 7.563 7.367 0.196 1
1 641 . 8 1 1 A 57 57 ASN HA H 95 3.735 4.615 -0.880 1
1 646 . 8 1 1 A 57 57 ASN C C 95 171.952 173.789 -1.837 1
1 647 . 8 1 1 A 57 57 ASN CA C 95 51.499 51.188 0.311 1
1 648 . 8 1 1 A 57 57 ASN CB C 95 35.250 40.994 -5.744 1
1 649 . 8 1 1 A 57 57 ASN N N 95 129.659 125.063 4.596 1
1 651 . 8 1 1 A 58 58 LYS H H 96 8.110 7.920 0.190 1
1 652 . 8 1 1 A 58 58 LYS HA H 96 4.035 4.390 -0.355 1
1 659 . 8 1 1 A 58 58 LYS C C 96 174.530 175.538 -1.008 1
1 660 . 8 1 1 A 58 58 LYS CA C 96 56.499 54.731 1.768 1
1 661 . 8 1 1 A 58 58 LYS CB C 96 29.626 32.941 -3.315 1
1 665 . 8 1 1 A 58 58 LYS N N 96 123.913 122.863 1.050 1
1 666 . 8 1 1 A 59 59 ASP H H 97 7.903 9.199 -1.296 1
1 667 . 8 1 1 A 59 59 ASP HA H 97 4.393 4.302 0.091 1
1 670 . 8 1 1 A 59 59 ASP C C 97 173.724 174.871 -1.147 1
1 671 . 8 1 1 A 59 59 ASP CA C 97 52.124 54.882 -2.758 1
1 672 . 8 1 1 A 59 59 ASP CB C 97 38.375 39.690 -1.315 1
1 673 . 8 1 1 A 59 59 ASP N N 97 118.773 119.654 -0.881 1
1 674 . 8 1 1 A 60 60 GLY H H 98 7.819 7.811 0.008 1
1 675 . 8 1 1 A 60 60 GLY HA2 H 98 3.917 2.582 1.335 1
1 676 . 8 1 1 A 60 60 GLY HA3 H 98 3.917 3.373 0.544 1
1 677 . 8 1 1 A 60 60 GLY C C 98 168.652 174.080 -5.428 1
1 678 . 8 1 1 A 60 60 GLY CA C 98 41.500 44.807 -3.307 1
1 679 . 8 1 1 A 60 60 GLY N N 98 108.742 104.472 4.270 1
1 680 . 8 1 1 A 61 61 TYR H H 99 8.105 7.656 0.449 1
1 681 . 8 1 1 A 61 61 TYR HA H 99 3.927 3.978 -0.051 1
1 689 . 8 1 1 A 61 61 TYR C C 99 172.831 173.905 -1.074 1
1 690 . 8 1 1 A 61 61 TYR CA C 99 57.124 57.968 -0.844 1
1 691 . 8 1 1 A 61 61 TYR CB C 99 37.125 36.302 0.823 1
1 692 . 8 1 1 A 61 61 TYR N N 99 113.836 113.199 0.637 1
1 693 . 8 1 1 A 62 62 LEU H H 100 7.352 7.849 -0.497 1
1 694 . 8 1 1 A 62 62 LEU HA H 100 4.343 4.911 -0.568 1
1 704 . 8 1 1 A 62 62 LEU C C 100 173.430 175.714 -2.284 1
1 705 . 8 1 1 A 62 62 LEU CA C 100 50.874 53.144 -2.270 1
1 706 . 8 1 1 A 62 62 LEU CB C 100 44.000 45.415 -1.415 1
1 710 . 8 1 1 A 62 62 LEU N N 100 117.112 120.493 -3.381 1
1 711 . 8 1 1 A 63 63 LYS H H 101 8.626 8.275 0.351 1
1 712 . 8 1 1 A 63 63 LYS HA H 101 3.986 4.382 -0.396 1
1 721 . 8 1 1 A 63 63 LYS C C 101 173.851 177.202 -3.351 1
1 722 . 8 1 1 A 63 63 LYS CA C 101 55.249 55.656 -0.407 1
1 723 . 8 1 1 A 63 63 LYS CB C 101 29.626 33.602 -3.976 1
1 724 . 8 1 1 A 63 63 LYS N N 101 129.991 121.845 8.146 1
1 725 . 8 1 1 A 64 64 LYS H H 102 7.059 8.425 -1.366 1
1 726 . 8 1 1 A 64 64 LYS HA H 102 4.138 4.262 -0.124 1
1 735 . 8 1 1 A 64 64 LYS C C 102 171.120 175.437 -4.317 1
1 736 . 8 1 1 A 64 64 LYS CA C 102 52.749 56.200 -3.451 1
1 737 . 8 1 1 A 64 64 LYS CB C 102 32.750 31.376 1.374 1
1 740 . 8 1 1 A 64 64 LYS N N 102 113.255 120.026 -6.771 1
1 741 . 8 1 1 A 65 65 LEU H H 103 8.883 8.383 0.500 1
1 742 . 8 1 1 A 65 65 LEU HA H 103 4.475 5.098 -0.623 1
1 752 . 8 1 1 A 65 65 LEU C C 103 171.487 175.404 -3.917 1
1 753 . 8 1 1 A 65 65 LEU CA C 103 48.999 51.721 -2.722 1
1 754 . 8 1 1 A 65 65 LEU CB C 103 39.625 45.292 -5.667 1
1 758 . 8 1 1 A 65 65 LEU N N 103 126.355 123.279 3.076 1
1 759 . 8 1 1 A 66 66 PRO HA H 104 4.449 4.612 -0.163 1
1 764 . 8 1 1 A 66 66 PRO C C 104 173.363 176.301 -2.938 1
1 765 . 8 1 1 A 66 66 PRO CA C 104 60.249 62.172 -1.923 1
1 766 . 8 1 1 A 66 66 PRO CB C 104 29.626 32.974 -3.348 1
1 769 . 8 1 1 A 67 67 VAL H H 105 7.682 8.353 -0.671 1
1 770 . 8 1 1 A 67 67 VAL HA H 105 4.121 4.279 -0.158 1
1 778 . 8 1 1 A 67 67 VAL C C 105 171.667 174.865 -3.198 1
1 779 . 8 1 1 A 67 67 VAL CA C 105 58.374 61.712 -3.338 1
1 780 . 8 1 1 A 67 67 VAL CB C 105 30.251 32.551 -2.300 1
1 783 . 8 1 1 A 67 67 VAL N N 105 114.671 121.091 -6.420 1
1 784 . 8 1 1 A 68 68 ASP H H 106 8.216 7.743 0.473 1
1 785 . 8 1 1 A 68 68 ASP HA H 106 4.474 4.510 -0.036 1
1 788 . 8 1 1 A 68 68 ASP C C 106 172.452 175.413 -2.961 1
1 789 . 8 1 1 A 68 68 ASP CA C 106 50.249 52.023 -1.774 1
1 790 . 8 1 1 A 68 68 ASP CB C 106 37.750 40.340 -2.590 1
1 791 . 8 1 1 A 68 68 ASP N N 106 123.825 125.680 -1.855 1
1 792 . 8 1 1 A 69 69 PRO HA H 107 3.920 3.969 -0.049 1
1 797 . 8 1 1 A 69 69 PRO CA C 107 62.123 62.934 -0.811 1
1 798 . 8 1 1 A 69 69 PRO CB C 107 27.751 31.242 -3.491 1
1 801 . 8 1 1 A 70 70 TRP H H 108 8.156 8.425 -0.269 1
1 802 . 8 1 1 A 70 70 TRP HA H 108 4.274 4.302 -0.028 1
1 811 . 8 1 1 A 70 70 TRP CA C 108 57.124 58.500 -1.376 1
1 812 . 8 1 1 A 70 70 TRP CB C 108 25.251 27.242 -1.991 1
1 813 . 8 1 1 A 70 70 TRP N N 108 118.137 118.560 -0.423 1
1 815 . 8 1 1 A 71 71 GLY H H 109 8.209 8.719 -0.510 1
1 816 . 8 1 1 A 71 71 GLY HA2 H 109 4.030 3.851 0.179 1
1 817 . 8 1 1 A 71 71 GLY HA3 H 109 3.303 3.885 -0.582 1
1 818 . 8 1 1 A 71 71 GLY CA C 109 42.750 45.578 -2.828 1
1 819 . 8 1 1 A 71 71 GLY N N 109 107.495 105.492 2.003 1
1 820 . 8 1 1 A 72 72 ASN H H 110 8.116 7.562 0.554 1
1 821 . 8 1 1 A 72 72 ASN HA H 110 5.103 4.889 0.214 1
1 826 . 8 1 1 A 72 72 ASN CA C 110 48.374 51.018 -2.644 1
1 827 . 8 1 1 A 72 72 ASN CB C 110 36.500 38.925 -2.425 1
1 828 . 8 1 1 A 72 72 ASN N N 110 120.108 120.523 -0.415 1
1 830 . 8 1 1 A 73 73 PRO HA H 111 4.397 4.445 -0.048 1
1 835 . 8 1 1 A 73 73 PRO C C 111 176.229 176.462 -0.233 1
1 836 . 8 1 1 A 73 73 PRO CA C 111 60.249 62.486 -2.237 1
1 837 . 8 1 1 A 73 73 PRO CB C 111 29.001 32.272 -3.271 1
1 840 . 8 1 1 A 74 74 TYR H H 112 8.893 8.559 0.334 1
1 841 . 8 1 1 A 74 74 TYR HA H 112 4.064 4.679 -0.615 1
1 849 . 8 1 1 A 74 74 TYR C C 112 171.951 175.678 -3.727 1
1 850 . 8 1 1 A 74 74 TYR CA C 112 60.249 58.366 1.883 1
1 851 . 8 1 1 A 74 74 TYR CB C 112 36.500 39.200 -2.700 1
1 852 . 8 1 1 A 74 74 TYR N N 112 124.595 121.641 2.954 1
1 853 . 8 1 1 A 75 75 GLN H H 113 9.127 8.879 0.248 1
1 854 . 8 1 1 A 75 75 GLN HA H 113 4.019 4.367 -0.348 1
1 861 . 8 1 1 A 75 75 GLN C C 113 171.436 174.308 -2.872 1
1 862 . 8 1 1 A 75 75 GLN CA C 113 50.874 54.760 -3.886 1
1 863 . 8 1 1 A 75 75 GLN CB C 113 29.469 29.584 -0.115 1
1 865 . 8 1 1 A 75 75 GLN N N 113 120.777 121.977 -1.200 1
1 867 . 8 1 1 A 76 76 TYR H H 114 7.906 8.448 -0.542 1
1 868 . 8 1 1 A 76 76 TYR HA H 114 5.586 5.040 0.546 1
1 875 . 8 1 1 A 76 76 TYR C C 114 171.343 175.390 -4.047 1
1 876 . 8 1 1 A 76 76 TYR CA C 114 53.999 57.339 -3.340 1
1 877 . 8 1 1 A 76 76 TYR CB C 114 40.250 39.933 0.317 1
1 878 . 8 1 1 A 76 76 TYR N N 114 120.757 123.294 -2.537 1
1 879 . 8 1 1 A 77 77 LEU H H 115 8.261 8.865 -0.604 1
1 880 . 8 1 1 A 77 77 LEU HA H 115 4.280 5.157 -0.877 1
1 890 . 8 1 1 A 77 77 LEU C C 115 170.921 175.846 -4.925 1
1 891 . 8 1 1 A 77 77 LEU CA C 115 51.499 53.552 -2.053 1
1 892 . 8 1 1 A 77 77 LEU CB C 115 44.625 45.489 -0.864 1
1 896 . 8 1 1 A 77 77 LEU N N 115 130.662 124.780 5.882 1
1 897 . 8 1 1 A 78 78 ALA H H 116 7.973 8.418 -0.445 1
1 898 . 8 1 1 A 78 78 ALA HA H 116 4.292 4.643 -0.351 1
1 902 . 8 1 1 A 78 78 ALA C C 116 172.093 174.877 -2.784 1
1 903 . 8 1 1 A 78 78 ALA CA C 116 47.749 49.996 -2.247 1
1 904 . 8 1 1 A 78 78 ALA CB C 116 19.626 20.528 -0.902 1
1 905 . 8 1 1 A 78 78 ALA N N 116 125.564 125.441 0.123 1
1 906 . 8 1 1 A 79 79 PRO HA H 117 4.698 5.055 -0.357 1
1 911 . 8 1 1 A 79 79 PRO C C 117 173.994 177.195 -3.201 1
1 912 . 8 1 1 A 79 79 PRO CA C 117 60.249 63.347 -3.098 1
1 913 . 8 1 1 A 79 79 PRO CB C 117 31.501 31.930 -0.429 1
1 916 . 8 1 1 A 80 80 GLY H H 118 7.096 8.625 -1.529 1
1 917 . 8 1 1 A 80 80 GLY HA2 H 118 3.797 3.937 -0.140 1
1 918 . 8 1 1 A 80 80 GLY HA3 H 118 3.517 3.944 -0.427 1
1 919 . 8 1 1 A 80 80 GLY C C 118 171.404 174.339 -2.935 1
1 920 . 8 1 1 A 80 80 GLY CA C 118 41.500 46.808 -5.308 1
1 921 . 8 1 1 A 80 80 GLY N N 118 108.306 108.885 -0.579 1
1 922 . 8 1 1 A 81 81 THR H H 119 9.810 8.181 1.629 1
1 923 . 8 1 1 A 81 81 THR HA H 119 4.091 4.709 -0.618 1
1 928 . 8 1 1 A 81 81 THR C C 119 174.242 174.714 -0.472 1
1 929 . 8 1 1 A 81 81 THR CA C 119 60.874 60.784 0.090 1
1 930 . 8 1 1 A 81 81 THR CB C 119 66.498 69.454 -2.956 1
1 932 . 8 1 1 A 81 81 THR N N 119 112.813 113.156 -0.343 1
1 933 . 8 1 1 A 82 82 LYS H H 120 8.964 8.727 0.237 1
1 934 . 8 1 1 A 82 82 LYS HA H 120 4.150 3.923 0.227 1
1 941 . 8 1 1 A 82 82 LYS C C 120 172.886 175.632 -2.746 1
1 942 . 8 1 1 A 82 82 LYS CA C 120 53.999 57.792 -3.793 1
1 943 . 8 1 1 A 82 82 LYS CB C 120 30.876 30.291 0.585 1
1 944 . 8 1 1 A 82 82 LYS N N 120 123.569 124.963 -1.394 1
1 945 . 8 1 1 A 83 83 GLY H H 121 7.125 8.101 -0.976 1
1 946 . 8 1 1 A 83 83 GLY HA2 H 121 3.814 4.195 -0.381 1
1 947 . 8 1 1 A 83 83 GLY HA3 H 121 3.814 4.225 -0.411 1
1 948 . 8 1 1 A 83 83 GLY C C 121 167.671 174.249 -6.578 1
1 949 . 8 1 1 A 83 83 GLY CA C 121 42.125 44.245 -2.120 1
1 950 . 8 1 1 A 83 83 GLY N N 121 107.253 107.791 -0.538 1
1 951 . 8 1 1 A 84 84 PRO HA H 122 4.077 4.458 -0.381 1
1 958 . 8 1 1 A 84 84 PRO C C 122 175.199 176.841 -1.642 1
1 959 . 8 1 1 A 84 84 PRO CA C 122 63.373 64.552 -1.179 1
1 960 . 8 1 1 A 84 84 PRO CB C 122 30.251 31.905 -1.654 1
1 962 . 8 1 1 A 85 85 PHE H H 123 6.652 6.628 0.024 1
1 963 . 8 1 1 A 85 85 PHE HA H 123 4.744 4.637 0.107 1
1 971 . 8 1 1 A 85 85 PHE C C 123 170.340 171.964 -1.624 1
1 972 . 8 1 1 A 85 85 PHE CA C 123 53.999 56.310 -2.311 1
1 973 . 8 1 1 A 85 85 PHE CB C 123 39.000 40.386 -1.386 1
1 974 . 8 1 1 A 85 85 PHE N N 123 108.468 112.080 -3.612 1
1 975 . 8 1 1 A 86 86 ASP H H 124 9.268 8.379 0.889 1
1 976 . 8 1 1 A 86 86 ASP HA H 124 5.108 4.202 0.906 1
1 979 . 8 1 1 A 86 86 ASP C C 124 171.180 174.460 -3.280 1
1 980 . 8 1 1 A 86 86 ASP CA C 124 50.249 53.133 -2.884 1
1 981 . 8 1 1 A 86 86 ASP CB C 124 40.250 41.988 -1.738 1
1 982 . 8 1 1 A 86 86 ASP N N 124 121.741 119.435 2.306 1
1 983 . 8 1 1 A 87 87 LEU H H 125 8.018 8.454 -0.436 1
1 984 . 8 1 1 A 87 87 LEU HA H 125 5.809 5.468 0.341 1
1 994 . 8 1 1 A 87 87 LEU C C 125 171.350 174.839 -3.489 1
1 995 . 8 1 1 A 87 87 LEU CA C 125 50.874 53.125 -2.251 1
1 996 . 8 1 1 A 87 87 LEU CB C 125 44.318 45.644 -1.326 1
1 999 . 8 1 1 A 87 87 LEU N N 125 123.629 127.071 -3.442 1
1 1000 . 8 1 1 A 88 88 TYR H H 126 8.912 8.413 0.499 1
1 1001 . 8 1 1 A 88 88 TYR HA H 126 5.630 5.864 -0.234 1
1 1008 . 8 1 1 A 88 88 TYR C C 126 171.410 172.220 -0.810 1
1 1009 . 8 1 1 A 88 88 TYR CA C 126 52.749 56.583 -3.834 1
1 1010 . 8 1 1 A 88 88 TYR CB C 126 37.750 40.341 -2.591 1
1 1011 . 8 1 1 A 88 88 TYR N N 126 119.697 121.628 -1.931 1
1 1012 . 8 1 1 A 89 89 SER H H 127 9.319 9.316 0.003 1
1 1013 . 8 1 1 A 89 89 SER HA H 127 5.429 5.396 0.033 1
1 1016 . 8 1 1 A 89 89 SER CA C 127 52.124 56.431 -4.307 1
1 1017 . 8 1 1 A 89 89 SER CB C 127 62.748 66.084 -3.336 1
1 1018 . 8 1 1 A 89 89 SER N N 127 112.637 115.795 -3.158 1
1 1019 . 8 1 1 A 90 90 LEU H H 128 8.759 8.614 0.145 1
1 1020 . 8 1 1 A 90 90 LEU HA H 128 4.186 4.403 -0.217 1
1 1030 . 8 1 1 A 90 90 LEU C C 128 175.121 178.322 -3.201 1
1 1031 . 8 1 1 A 90 90 LEU CA C 128 52.749 55.512 -2.763 1
1 1032 . 8 1 1 A 90 90 LEU CB C 128 35.875 42.270 -6.395 1
1 1033 . 8 1 1 A 90 90 LEU N N 128 126.728 127.305 -0.577 1
1 1034 . 8 1 1 A 91 91 GLY H H 129 8.356 7.887 0.469 1
1 1035 . 8 1 1 A 91 91 GLY HA2 H 129 3.373 3.562 -0.189 1
1 1036 . 8 1 1 A 91 91 GLY HA3 H 129 3.373 3.813 -0.440 1
1 1037 . 8 1 1 A 91 91 GLY C C 129 172.013 174.387 -2.374 1
1 1038 . 8 1 1 A 91 91 GLY CA C 129 41.500 43.970 -2.470 1
1 1039 . 8 1 1 A 91 91 GLY N N 129 108.559 109.033 -0.474 1
1 1040 . 8 1 1 A 92 92 ALA H H 130 7.047 8.174 -1.127 1
1 1041 . 8 1 1 A 92 92 ALA HA H 130 4.037 2.760 1.277 1
1 1045 . 8 1 1 A 92 92 ALA C C 130 174.890 177.898 -3.008 1
1 1046 . 8 1 1 A 92 92 ALA CA C 130 52.100 53.865 -1.765 1
1 1047 . 8 1 1 A 92 92 ALA CB C 130 16.502 17.792 -1.290 1
1 1048 . 8 1 1 A 92 92 ALA N N 130 118.393 121.973 -3.580 1
1 1049 . 8 1 1 A 93 93 ASP H H 131 7.222 7.931 -0.709 1
1 1050 . 8 1 1 A 93 93 ASP HA H 131 4.122 4.454 -0.332 1
1 1053 . 8 1 1 A 93 93 ASP C C 131 174.890 176.533 -1.643 1
1 1054 . 8 1 1 A 93 93 ASP CA C 131 50.249 53.125 -2.876 1
1 1055 . 8 1 1 A 93 93 ASP CB C 131 37.750 40.211 -2.461 1
1 1056 . 8 1 1 A 93 93 ASP N N 131 111.487 111.774 -0.287 1
1 1057 . 8 1 1 A 94 94 GLY H H 132 7.199 8.894 -1.695 1
1 1058 . 8 1 1 A 94 94 GLY HA2 H 132 3.951 3.881 0.070 1
1 1059 . 8 1 1 A 94 94 GLY HA3 H 132 3.324 3.886 -0.562 1
1 1060 . 8 1 1 A 94 94 GLY C C 132 169.773 174.027 -4.254 1
1 1061 . 8 1 1 A 94 94 GLY CA C 132 44.625 45.882 -1.257 1
1 1062 . 8 1 1 A 94 94 GLY N N 132 106.932 110.929 -3.997 1
1 1063 . 8 1 1 A 95 95 LYS H H 133 7.215 7.266 -0.051 1
1 1064 . 8 1 1 A 95 95 LYS HA H 133 4.513 4.741 -0.228 1
1 1073 . 8 1 1 A 95 95 LYS C C 133 172.108 175.174 -3.066 1
1 1074 . 8 1 1 A 95 95 LYS CA C 133 51.512 54.626 -3.114 1
1 1075 . 8 1 1 A 95 95 LYS CB C 133 34.000 35.417 -1.417 1
1 1076 . 8 1 1 A 95 95 LYS N N 133 115.749 120.369 -4.620 1
1 1077 . 8 1 1 A 96 96 GLU H H 134 9.230 8.682 0.548 1
1 1078 . 8 1 1 A 96 96 GLU HA H 134 4.352 4.483 -0.131 1
1 1083 . 8 1 1 A 96 96 GLU C C 134 175.219 176.306 -1.087 1
1 1084 . 8 1 1 A 96 96 GLU CA C 134 55.874 56.194 -0.320 1
1 1085 . 8 1 1 A 96 96 GLU CB C 134 27.126 29.953 -2.827 1
1 1087 . 8 1 1 A 96 96 GLU N N 134 128.571 122.574 5.997 1
1 1088 . 8 1 1 A 97 97 GLY H H 135 10.677 8.294 2.383 1
1 1089 . 8 1 1 A 97 97 GLY HA2 H 135 4.037 4.267 -0.230 1
1 1090 . 8 1 1 A 97 97 GLY HA3 H 135 3.717 4.273 -0.556 1
1 1091 . 8 1 1 A 97 97 GLY C C 135 171.567 172.356 -0.789 1
1 1092 . 8 1 1 A 97 97 GLY CA C 135 41.500 45.755 -4.255 1
1 1093 . 8 1 1 A 97 97 GLY N N 135 117.011 110.605 6.406 1
1 1094 . 8 1 1 A 98 98 GLY H H 136 8.442 8.582 -0.140 1
1 1095 . 8 1 1 A 98 98 GLY HA2 H 136 4.195 4.184 0.011 1
1 1096 . 8 1 1 A 98 98 GLY HA3 H 136 4.195 4.189 0.006 1
1 1097 . 8 1 1 A 98 98 GLY C C 136 170.299 173.099 -2.800 1
1 1098 . 8 1 1 A 98 98 GLY CA C 136 40.875 44.634 -3.759 1
1 1099 . 8 1 1 A 98 98 GLY N N 136 109.494 109.312 0.182 1
1 1100 . 8 1 1 A 99 99 SER H H 137 8.701 8.785 -0.084 1
1 1101 . 8 1 1 A 99 99 SER HA H 137 4.639 4.894 -0.255 1
1 1104 . 8 1 1 A 99 99 SER C C 137 170.630 173.430 -2.800 1
1 1105 . 8 1 1 A 99 99 SER CA C 137 54.624 57.349 -2.725 1
1 1106 . 8 1 1 A 99 99 SER CB C 137 62.748 66.578 -3.830 1
1 1107 . 8 1 1 A 99 99 SER N N 137 114.685 118.453 -3.768 1
1 1108 . 8 1 1 A 100 100 ASP H H 138 9.117 8.903 0.214 1
1 1109 . 8 1 1 A 100 100 ASP HA H 138 3.965 4.414 -0.449 1
1 1112 . 8 1 1 A 100 100 ASP C C 138 175.540 177.937 -2.397 1
1 1113 . 8 1 1 A 100 100 ASP CA C 138 54.624 57.072 -2.448 1
1 1114 . 8 1 1 A 100 100 ASP CB C 138 36.500 40.672 -4.172 1
1 1115 . 8 1 1 A 100 100 ASP N N 138 120.777 122.657 -1.880 1
1 1116 . 8 1 1 A 101 101 ASN H H 139 8.667 8.385 0.282 1
1 1117 . 8 1 1 A 101 101 ASN HA H 139 4.333 4.702 -0.369 1
1 1122 . 8 1 1 A 101 101 ASN CA C 139 53.999 53.121 0.878 1
1 1123 . 8 1 1 A 101 101 ASN CB C 139 34.625 38.281 -3.656 1
1 1124 . 8 1 1 A 101 101 ASN N N 139 121.930 115.222 6.708 1
1 1126 . 8 1 1 A 102 102 ASP H H 140 7.714 7.888 -0.174 1
1 1127 . 8 1 1 A 102 102 ASP HA H 140 4.037 4.456 -0.419 1
1 1130 . 8 1 1 A 102 102 ASP C C 140 172.807 175.770 -2.963 1
1 1131 . 8 1 1 A 102 102 ASP CA C 140 53.374 53.933 -0.559 1
1 1132 . 8 1 1 A 102 102 ASP CB C 140 37.125 41.294 -4.169 1
1 1133 . 8 1 1 A 102 102 ASP N N 140 118.011 118.117 -0.106 1
1 1134 . 8 1 1 A 103 103 ALA H H 141 7.060 7.279 -0.219 1
1 1135 . 8 1 1 A 103 103 ALA HA H 141 3.353 4.627 -1.274 1
1 1139 . 8 1 1 A 103 103 ALA C C 141 172.233 176.991 -4.758 1
1 1140 . 8 1 1 A 103 103 ALA CA C 141 49.624 51.674 -2.050 1
1 1141 . 8 1 1 A 103 103 ALA CB C 141 16.502 20.375 -3.873 1
1 1142 . 8 1 1 A 103 103 ALA N N 141 125.777 122.918 2.859 1
1 1143 . 8 1 1 A 104 104 ASP H H 142 7.973 8.227 -0.254 1
1 1144 . 8 1 1 A 104 104 ASP HA H 142 4.420 5.222 -0.802 1
1 1147 . 8 1 1 A 104 104 ASP C C 142 174.188 176.103 -1.915 1
1 1148 . 8 1 1 A 104 104 ASP CA C 142 52.124 54.184 -2.060 1
1 1149 . 8 1 1 A 104 104 ASP CB C 142 37.125 41.113 -3.988 1
1 1150 . 8 1 1 A 104 104 ASP N N 142 122.965 120.297 2.668 1
1 1151 . 8 1 1 A 105 105 ILE H H 143 8.534 8.913 -0.379 1
1 1152 . 8 1 1 A 105 105 ILE HA H 143 4.060 4.922 -0.862 1
1 1162 . 8 1 1 A 105 105 ILE C C 143 173.235 176.170 -2.935 1
1 1163 . 8 1 1 A 105 105 ILE CA C 143 58.374 59.925 -1.551 1
1 1164 . 8 1 1 A 105 105 ILE CB C 143 39.123 39.608 -0.485 1
1 1167 . 8 1 1 A 105 105 ILE N N 143 124.757 120.678 4.079 1
1 1168 . 8 1 1 A 106 106 GLY H H 144 8.288 8.448 -0.160 1
1 1169 . 8 1 1 A 106 106 GLY HA2 H 144 4.764 4.392 0.372 1
1 1170 . 8 1 1 A 106 106 GLY HA3 H 144 4.764 4.453 0.311 1
1 1171 . 8 1 1 A 106 106 GLY C C 144 171.321 172.533 -1.212 1
1 1172 . 8 1 1 A 106 106 GLY CA C 144 40.250 45.798 -5.548 1
1 1173 . 8 1 1 A 106 106 GLY N N 144 110.895 110.800 0.095 1
1 1174 . 8 1 1 A 107 107 ASN H H 145 8.577 8.883 -0.306 1
1 1175 . 8 1 1 A 107 107 ASN HA H 145 4.268 5.809 -1.541 1
1 1180 . 8 1 1 A 107 107 ASN C C 145 171.757 173.761 -2.004 1
1 1181 . 8 1 1 A 107 107 ASN CA C 145 52.124 51.488 0.636 1
1 1182 . 8 1 1 A 107 107 ASN CB C 145 34.625 41.402 -6.777 1
1 1183 . 8 1 1 A 107 107 ASN N N 145 118.042 115.758 2.284 1
1 1185 . 8 1 1 A 108 108 TRP H H 146 6.822 8.730 -1.908 1
1 1186 . 8 1 1 A 108 108 TRP HA H 146 4.513 5.038 -0.525 1
1 1195 . 8 1 1 A 108 108 TRP C C 146 172.665 173.107 -0.442 1
1 1196 . 8 1 1 A 108 108 TRP CA C 146 54.624 56.786 -2.162 1
1 1197 . 8 1 1 A 108 108 TRP CB C 146 25.876 33.000 -7.124 1
1 1198 . 8 1 1 A 108 108 TRP N N 146 116.756 122.225 -5.469 1
1 1200 . 8 1 1 A 109 109 ASP H H 147 7.344 7.988 -0.644 1
1 1201 . 8 1 1 A 109 109 ASP HA H 147 4.655 5.151 -0.496 1
1 1204 . 8 1 1 A 109 109 ASP C C 147 172.193 174.876 -2.683 1
1 1205 . 8 1 1 A 109 109 ASP CA C 147 51.499 52.335 -0.836 1
1 1206 . 8 1 1 A 109 109 ASP CB C 147 39.000 42.160 -3.160 1
1 1207 . 8 1 1 A 109 109 ASP N N 147 121.461 129.029 -7.568 1
1 11 . 9 1 1 A 2 2 SER H H 40 8.461 9.003 -0.542 1
1 12 . 9 1 1 A 2 2 SER HA H 40 4.286 4.938 -0.652 1
1 15 . 9 1 1 A 2 2 SER C C 40 171.276 172.815 -1.539 1
1 16 . 9 1 1 A 2 2 SER CA C 40 55.249 56.813 -1.564 1
1 17 . 9 1 1 A 2 2 SER CB C 40 61.498 63.356 -1.858 1
1 18 . 9 1 1 A 2 2 SER N N 40 118.344 120.052 -1.708 1
1 19 . 9 1 1 A 3 3 ARG H H 41 8.469 8.349 0.120 1
1 20 . 9 1 1 A 3 3 ARG HA H 41 4.400 4.871 -0.471 1
1 25 . 9 1 1 A 3 3 ARG C C 41 172.251 173.691 -1.440 1
1 26 . 9 1 1 A 3 3 ARG CA C 41 52.749 53.041 -0.292 1
1 27 . 9 1 1 A 3 3 ARG CB C 41 27.126 33.663 -6.537 1
1 28 . 9 1 1 A 3 3 ARG N N 41 123.070 125.929 -2.859 1
1 33 . 9 1 1 A 4 4 PRO CA C 42 61.498 63.823 -2.325 1
1 34 . 9 1 1 A 4 4 PRO CB C 42 29.001 31.731 -2.730 1
1 37 . 9 1 1 A 5 5 ASP H H 43 8.246 8.939 -0.693 1
1 38 . 9 1 1 A 5 5 ASP HA H 43 4.329 4.440 -0.111 1
1 41 . 9 1 1 A 5 5 ASP C C 43 174.605 176.498 -1.893 1
1 42 . 9 1 1 A 5 5 ASP CA C 43 53.374 56.424 -3.050 1
1 43 . 9 1 1 A 5 5 ASP CB C 43 38.375 38.666 -0.291 1
1 44 . 9 1 1 A 5 5 ASP N N 43 119.409 117.281 2.128 1
1 45 . 9 1 1 A 6 6 GLN H H 44 8.309 8.357 -0.048 1
1 46 . 9 1 1 A 6 6 GLN HA H 44 4.393 4.151 0.242 1
1 53 . 9 1 1 A 6 6 GLN C C 44 175.053 178.442 -3.389 1
1 54 . 9 1 1 A 6 6 GLN CA C 44 55.874 58.721 -2.847 1
1 55 . 9 1 1 A 6 6 GLN CB C 44 25.876 28.581 -2.705 1
1 57 . 9 1 1 A 6 6 GLN N N 44 122.273 118.242 4.031 1
1 59 . 9 1 1 A 7 7 ALA H H 45 8.106 8.000 0.106 1
1 60 . 9 1 1 A 7 7 ALA HA H 45 3.993 4.147 -0.154 1
1 64 . 9 1 1 A 7 7 ALA C C 45 177.465 177.877 -0.412 1
1 65 . 9 1 1 A 7 7 ALA CA C 45 52.124 54.231 -2.107 1
1 66 . 9 1 1 A 7 7 ALA CB C 45 15.252 18.306 -3.054 1
1 67 . 9 1 1 A 7 7 ALA N N 45 122.204 122.025 0.179 1
1 68 . 9 1 1 A 8 8 LYS H H 46 7.527 7.520 0.007 1
1 69 . 9 1 1 A 8 8 LYS HA H 46 3.539 4.109 -0.570 1
1 78 . 9 1 1 A 8 8 LYS C C 46 175.412 179.075 -3.663 1
1 79 . 9 1 1 A 8 8 LYS CA C 46 57.124 57.456 -0.332 1
1 80 . 9 1 1 A 8 8 LYS CB C 46 30.876 32.164 -1.288 1
1 83 . 9 1 1 A 8 8 LYS N N 46 117.358 116.355 1.003 1
1 84 . 9 1 1 A 9 9 VAL H H 47 7.709 7.962 -0.253 1
1 85 . 9 1 1 A 9 9 VAL HA H 47 3.578 3.868 -0.290 1
1 93 . 9 1 1 A 9 9 VAL C C 47 175.005 178.361 -3.356 1
1 94 . 9 1 1 A 9 9 VAL CA C 47 64.623 66.225 -1.602 1
1 95 . 9 1 1 A 9 9 VAL CB C 47 29.001 31.814 -2.813 1
1 98 . 9 1 1 A 9 9 VAL N N 47 119.115 120.167 -1.052 1
1 99 . 9 1 1 A 10 10 THR H H 48 7.767 8.085 -0.318 1
1 100 . 9 1 1 A 10 10 THR HA H 48 3.668 4.026 -0.358 1
1 105 . 9 1 1 A 10 10 THR CA C 48 63.998 65.501 -1.503 1
1 106 . 9 1 1 A 10 10 THR CB C 48 67.123 68.832 -1.709 1
1 108 . 9 1 1 A 10 10 THR N N 48 115.112 113.626 1.486 1
1 109 . 9 1 1 A 11 11 VAL H H 49 7.598 7.757 -0.159 1
1 110 . 9 1 1 A 11 11 VAL HA H 49 3.457 3.872 -0.415 1
1 118 . 9 1 1 A 11 11 VAL C C 49 175.412 178.165 -2.753 1
1 119 . 9 1 1 A 11 11 VAL CA C 49 63.998 64.751 -0.753 1
1 120 . 9 1 1 A 11 11 VAL CB C 49 29.001 31.623 -2.622 1
1 123 . 9 1 1 A 11 11 VAL N N 49 123.694 117.484 6.210 1
1 124 . 9 1 1 A 12 12 ALA H H 50 8.176 7.981 0.195 1
1 125 . 9 1 1 A 12 12 ALA HA H 50 4.742 4.080 0.662 1
1 129 . 9 1 1 A 12 12 ALA C C 50 177.074 179.668 -2.594 1
1 130 . 9 1 1 A 12 12 ALA CA C 50 52.124 55.324 -3.200 1
1 131 . 9 1 1 A 12 12 ALA CB C 50 15.252 18.187 -2.935 1
1 132 . 9 1 1 A 12 12 ALA N N 50 122.348 124.609 -2.261 1
1 133 . 9 1 1 A 13 13 LYS H H 51 8.499 8.330 0.169 1
1 134 . 9 1 1 A 13 13 LYS HA H 51 3.648 4.100 -0.452 1
1 143 . 9 1 1 A 13 13 LYS C C 51 177.252 179.974 -2.722 1
1 144 . 9 1 1 A 13 13 LYS CA C 51 58.072 59.214 -1.142 1
1 145 . 9 1 1 A 13 13 LYS CB C 51 30.251 32.419 -2.168 1
1 146 . 9 1 1 A 13 13 LYS N N 51 115.402 116.345 -0.943 1
1 147 . 9 1 1 A 14 14 GLY H H 52 7.858 8.001 -0.143 1
1 148 . 9 1 1 A 14 14 GLY HA2 H 52 3.823 3.745 0.078 1
1 149 . 9 1 1 A 14 14 GLY HA3 H 52 3.676 3.746 -0.070 1
1 150 . 9 1 1 A 14 14 GLY C C 52 174.090 175.721 -1.631 1
1 151 . 9 1 1 A 14 14 GLY CA C 52 44.625 46.932 -2.307 1
1 152 . 9 1 1 A 14 14 GLY N N 52 107.466 108.790 -1.324 1
1 153 . 9 1 1 A 15 15 ASP H H 53 8.403 7.682 0.721 1
1 154 . 9 1 1 A 15 15 ASP HA H 53 4.191 4.352 -0.161 1
1 157 . 9 1 1 A 15 15 ASP C C 53 175.316 178.981 -3.665 1
1 158 . 9 1 1 A 15 15 ASP CA C 53 54.624 56.504 -1.880 1
1 159 . 9 1 1 A 15 15 ASP CB C 53 35.875 40.909 -5.034 1
1 160 . 9 1 1 A 15 15 ASP N N 53 125.929 121.281 4.648 1
1 161 . 9 1 1 A 16 16 ILE H H 54 8.245 7.993 0.252 1
1 162 . 9 1 1 A 16 16 ILE HA H 54 3.034 3.750 -0.716 1
1 172 . 9 1 1 A 16 16 ILE C C 54 174.499 178.198 -3.699 1
1 173 . 9 1 1 A 16 16 ILE CA C 54 62.748 63.924 -1.176 1
1 174 . 9 1 1 A 16 16 ILE CB C 54 34.625 37.249 -2.624 1
1 178 . 9 1 1 A 16 16 ILE N N 54 119.456 116.503 2.953 1
1 179 . 9 1 1 A 17 17 LYS H H 55 7.547 7.417 0.130 1
1 180 . 9 1 1 A 17 17 LYS HA H 55 3.843 4.126 -0.283 1
1 187 . 9 1 1 A 17 17 LYS C C 55 176.651 179.258 -2.607 1
1 188 . 9 1 1 A 17 17 LYS CA C 55 57.124 59.359 -2.235 1
1 189 . 9 1 1 A 17 17 LYS CB C 55 30.251 32.114 -1.863 1
1 190 . 9 1 1 A 17 17 LYS N N 55 118.505 121.244 -2.739 1
1 191 . 9 1 1 A 18 18 ALA H H 56 7.680 7.713 -0.033 1
1 192 . 9 1 1 A 18 18 ALA HA H 56 4.029 4.014 0.015 1
1 196 . 9 1 1 A 18 18 ALA C C 56 176.638 179.729 -3.091 1
1 197 . 9 1 1 A 18 18 ALA CA C 56 52.749 54.878 -2.129 1
1 198 . 9 1 1 A 18 18 ALA CB C 56 15.877 18.426 -2.549 1
1 199 . 9 1 1 A 18 18 ALA N N 56 122.477 122.147 0.330 1
1 200 . 9 1 1 A 19 19 ILE H H 57 8.853 7.924 0.929 1
1 201 . 9 1 1 A 19 19 ILE HA H 57 3.304 3.536 -0.232 1
1 211 . 9 1 1 A 19 19 ILE C C 57 174.710 177.916 -3.206 1
1 212 . 9 1 1 A 19 19 ILE CA C 57 63.373 65.379 -2.006 1
1 213 . 9 1 1 A 19 19 ILE CB C 57 35.250 37.932 -2.682 1
1 217 . 9 1 1 A 19 19 ILE N N 57 120.901 118.096 2.805 1
1 218 . 9 1 1 A 20 20 ALA H H 58 8.702 8.189 0.513 1
1 219 . 9 1 1 A 20 20 ALA HA H 58 3.900 3.909 -0.009 1
1 223 . 9 1 1 A 20 20 ALA C C 58 176.512 179.446 -2.934 1
1 224 . 9 1 1 A 20 20 ALA CA C 58 52.749 54.599 -1.850 1
1 225 . 9 1 1 A 20 20 ALA CB C 58 15.252 18.392 -3.140 1
1 226 . 9 1 1 A 20 20 ALA N N 58 121.763 121.794 -0.031 1
1 227 . 9 1 1 A 21 21 ALA H H 59 7.662 7.496 0.166 1
1 228 . 9 1 1 A 21 21 ALA HA H 59 4.136 4.269 -0.133 1
1 232 . 9 1 1 A 21 21 ALA C C 59 177.949 179.562 -1.613 1
1 233 . 9 1 1 A 21 21 ALA CA C 59 52.749 54.796 -2.047 1
1 234 . 9 1 1 A 21 21 ALA CB C 59 15.252 18.639 -3.387 1
1 235 . 9 1 1 A 21 21 ALA N N 59 119.079 119.367 -0.288 1
1 236 . 9 1 1 A 22 22 ALA H H 60 7.403 7.646 -0.243 1
1 237 . 9 1 1 A 22 22 ALA HA H 60 4.318 4.172 0.146 1
1 241 . 9 1 1 A 22 22 ALA C C 60 176.730 180.394 -3.664 1
1 242 . 9 1 1 A 22 22 ALA CA C 60 52.749 54.438 -1.689 1
1 243 . 9 1 1 A 22 22 ALA CB C 60 17.126 18.656 -1.530 1
1 244 . 9 1 1 A 22 22 ALA N N 60 122.616 120.542 2.074 1
1 245 . 9 1 1 A 23 23 LEU H H 61 8.410 8.537 -0.127 1
1 246 . 9 1 1 A 23 23 LEU HA H 61 3.527 3.963 -0.436 1
1 256 . 9 1 1 A 23 23 LEU C C 61 176.057 178.234 -2.177 1
1 257 . 9 1 1 A 23 23 LEU CA C 61 55.249 57.409 -2.160 1
1 258 . 9 1 1 A 23 23 LEU CB C 61 39.000 40.809 -1.809 1
1 262 . 9 1 1 A 23 23 LEU N N 61 120.761 121.214 -0.453 1
1 263 . 9 1 1 A 24 24 ASP H H 62 8.227 8.075 0.152 1
1 264 . 9 1 1 A 24 24 ASP HA H 62 4.581 4.566 0.015 1
1 267 . 9 1 1 A 24 24 ASP C C 62 176.968 177.930 -0.962 1
1 268 . 9 1 1 A 24 24 ASP CA C 62 55.874 56.336 -0.462 1
1 269 . 9 1 1 A 24 24 ASP CB C 62 37.750 40.885 -3.135 1
1 270 . 9 1 1 A 24 24 ASP N N 62 119.068 118.827 0.241 1
1 271 . 9 1 1 A 25 25 MET H H 63 7.718 7.939 -0.221 1
1 272 . 9 1 1 A 25 25 MET HA H 63 4.196 4.269 -0.073 1
1 277 . 9 1 1 A 25 25 MET C C 63 174.968 177.737 -2.769 1
1 278 . 9 1 1 A 25 25 MET CA C 63 55.249 58.167 -2.918 1
1 279 . 9 1 1 A 25 25 MET CB C 63 29.626 32.471 -2.845 1
1 281 . 9 1 1 A 25 25 MET N N 63 121.365 117.757 3.608 1
1 282 . 9 1 1 A 26 26 TYR H H 64 8.401 7.624 0.777 1
1 283 . 9 1 1 A 26 26 TYR HA H 64 4.400 3.533 0.867 1
1 291 . 9 1 1 A 26 26 TYR C C 64 176.098 177.316 -1.218 1
1 292 . 9 1 1 A 26 26 TYR CA C 64 58.999 61.000 -2.001 1
1 293 . 9 1 1 A 26 26 TYR CB C 64 35.250 38.175 -2.925 1
1 294 . 9 1 1 A 26 26 TYR N N 64 122.575 122.141 0.434 1
1 295 . 9 1 1 A 27 27 LYS H H 65 8.330 8.102 0.228 1
1 296 . 9 1 1 A 27 27 LYS HA H 65 3.568 4.589 -1.021 1
1 302 . 9 1 1 A 27 27 LYS C C 65 176.156 178.590 -2.434 1
1 303 . 9 1 1 A 27 27 LYS CA C 65 56.499 59.426 -2.927 1
1 304 . 9 1 1 A 27 27 LYS CB C 65 29.626 31.699 -2.073 1
1 306 . 9 1 1 A 27 27 LYS N N 65 121.390 118.923 2.467 1
1 307 . 9 1 1 A 28 28 LEU H H 66 7.833 7.532 0.301 1
1 308 . 9 1 1 A 28 28 LEU HA H 66 3.769 4.067 -0.298 1
1 318 . 9 1 1 A 28 28 LEU C C 66 175.925 177.936 -2.011 1
1 319 . 9 1 1 A 28 28 LEU CA C 66 55.874 57.270 -1.396 1
1 320 . 9 1 1 A 28 28 LEU CB C 66 38.375 41.967 -3.592 1
1 324 . 9 1 1 A 28 28 LEU N N 66 123.068 120.622 2.446 1
1 325 . 9 1 1 A 29 29 ASP H H 67 7.292 7.863 -0.571 1
1 326 . 9 1 1 A 29 29 ASP HA H 67 4.096 4.273 -0.177 1
1 329 . 9 1 1 A 29 29 ASP C C 67 174.618 176.751 -2.133 1
1 330 . 9 1 1 A 29 29 ASP CA C 67 53.999 56.388 -2.389 1
1 331 . 9 1 1 A 29 29 ASP CB C 67 38.375 40.696 -2.321 1
1 332 . 9 1 1 A 29 29 ASP N N 67 114.729 118.248 -3.519 1
1 333 . 9 1 1 A 30 30 ASN H H 68 8.097 7.553 0.544 1
1 334 . 9 1 1 A 30 30 ASN HA H 68 4.337 4.452 -0.115 1
1 339 . 9 1 1 A 30 30 ASN C C 68 172.822 174.254 -1.432 1
1 340 . 9 1 1 A 30 30 ASN CA C 68 52.124 52.083 0.041 1
1 341 . 9 1 1 A 30 30 ASN CB C 68 37.750 38.567 -0.817 1
1 342 . 9 1 1 A 30 30 ASN N N 68 111.054 115.161 -4.107 1
1 344 . 9 1 1 A 31 31 PHE H H 69 8.249 7.973 0.276 1
1 345 . 9 1 1 A 31 31 PHE HA H 69 4.135 4.251 -0.116 1
1 353 . 9 1 1 A 31 31 PHE C C 69 170.485 174.253 -3.768 1
1 354 . 9 1 1 A 31 31 PHE CA C 69 57.749 58.766 -1.017 1
1 355 . 9 1 1 A 31 31 PHE CB C 69 33.375 36.600 -3.225 1
1 356 . 9 1 1 A 31 31 PHE N N 69 116.277 117.277 -1.000 1
1 357 . 9 1 1 A 32 32 ALA H H 70 7.224 7.055 0.169 1
1 358 . 9 1 1 A 32 32 ALA HA H 70 4.194 4.533 -0.339 1
1 362 . 9 1 1 A 32 32 ALA C C 70 173.337 175.064 -1.727 1
1 363 . 9 1 1 A 32 32 ALA CA C 70 48.374 51.517 -3.143 1
1 364 . 9 1 1 A 32 32 ALA CB C 70 19.626 22.153 -2.527 1
1 365 . 9 1 1 A 32 32 ALA N N 70 119.914 120.341 -0.427 1
1 366 . 9 1 1 A 33 33 TYR H H 71 7.948 8.385 -0.437 1
1 367 . 9 1 1 A 33 33 TYR HA H 71 4.209 4.947 -0.738 1
1 374 . 9 1 1 A 33 33 TYR C C 71 170.591 174.191 -3.600 1
1 375 . 9 1 1 A 33 33 TYR CA C 71 54.624 56.528 -1.904 1
1 376 . 9 1 1 A 33 33 TYR CB C 71 34.000 37.635 -3.635 1
1 377 . 9 1 1 A 33 33 TYR N N 71 116.929 118.114 -1.185 1
1 378 . 9 1 1 A 34 34 PRO HA H 72 4.444 4.661 -0.217 1
1 381 . 9 1 1 A 34 34 PRO C C 72 174.775 176.295 -1.520 1
1 382 . 9 1 1 A 34 34 PRO CA C 72 59.624 62.639 -3.015 1
1 383 . 9 1 1 A 34 34 PRO CB C 72 28.376 31.762 -3.386 1
1 384 . 9 1 1 A 35 35 SER H H 73 8.721 8.388 0.333 1
1 385 . 9 1 1 A 35 35 SER HA H 73 4.467 4.720 -0.253 1
1 388 . 9 1 1 A 35 35 SER C C 73 173.271 175.301 -2.030 1
1 389 . 9 1 1 A 35 35 SER CA C 73 55.249 56.776 -1.527 1
1 390 . 9 1 1 A 35 35 SER CB C 73 63.373 65.666 -2.293 1
1 391 . 9 1 1 A 35 35 SER N N 73 118.284 114.797 3.487 1
1 392 . 9 1 1 A 36 36 THR H H 74 8.591 8.874 -0.283 1
1 393 . 9 1 1 A 36 36 THR HA H 74 3.649 4.253 -0.604 1
1 398 . 9 1 1 A 36 36 THR CA C 74 64.623 63.707 0.916 1
1 399 . 9 1 1 A 36 36 THR CB C 74 66.498 69.015 -2.517 1
1 401 . 9 1 1 A 36 36 THR N N 74 117.769 117.750 0.019 1
1 402 . 9 1 1 A 37 37 GLN H H 75 8.210 8.019 0.191 1
1 403 . 9 1 1 A 37 37 GLN HA H 75 3.860 4.354 -0.494 1
1 410 . 9 1 1 A 37 37 GLN C C 75 175.349 178.420 -3.071 1
1 411 . 9 1 1 A 37 37 GLN CA C 75 56.499 57.578 -1.079 1
1 412 . 9 1 1 A 37 37 GLN CB C 75 25.876 29.859 -3.983 1
1 414 . 9 1 1 A 37 37 GLN N N 75 117.931 121.321 -3.390 1
1 416 . 9 1 1 A 38 38 GLN H H 76 7.667 8.235 -0.568 1
1 417 . 9 1 1 A 38 38 GLN HA H 76 3.810 4.136 -0.326 1
1 424 . 9 1 1 A 38 38 GLN C C 76 175.805 179.473 -3.668 1
1 425 . 9 1 1 A 38 38 GLN CA C 76 55.874 58.651 -2.777 1
1 426 . 9 1 1 A 38 38 GLN CB C 76 25.876 28.339 -2.463 1
1 428 . 9 1 1 A 38 38 GLN N N 76 120.607 118.253 2.354 1
1 430 . 9 1 1 A 39 39 GLY H H 77 8.470 8.201 0.269 1
1 431 . 9 1 1 A 39 39 GLY HA2 H 77 3.920 3.704 0.216 1
1 432 . 9 1 1 A 39 39 GLY HA3 H 77 3.603 3.747 -0.144 1
1 433 . 9 1 1 A 39 39 GLY C C 77 169.006 175.409 -6.403 1
1 434 . 9 1 1 A 39 39 GLY CA C 77 42.125 46.449 -4.324 1
1 435 . 9 1 1 A 39 39 GLY N N 77 103.281 108.868 -5.587 1
1 436 . 9 1 1 A 40 40 LEU H H 78 8.135 7.908 0.227 1
1 437 . 9 1 1 A 40 40 LEU HA H 78 3.237 4.167 -0.930 1
1 447 . 9 1 1 A 40 40 LEU C C 78 176.383 178.298 -1.915 1
1 448 . 9 1 1 A 40 40 LEU CA C 78 52.749 57.203 -4.454 1
1 449 . 9 1 1 A 40 40 LEU CB C 78 39.000 41.679 -2.679 1
1 453 . 9 1 1 A 40 40 LEU N N 78 114.444 123.329 -8.885 1
1 454 . 9 1 1 A 41 41 GLU H H 79 8.578 8.392 0.186 1
1 455 . 9 1 1 A 41 41 GLU HA H 79 3.720 4.009 -0.289 1
1 460 . 9 1 1 A 41 41 GLU C C 79 175.093 178.653 -3.560 1
1 461 . 9 1 1 A 41 41 GLU CA C 79 57.124 59.848 -2.724 1
1 462 . 9 1 1 A 41 41 GLU CB C 79 26.501 29.324 -2.823 1
1 464 . 9 1 1 A 41 41 GLU N N 79 118.295 119.317 -1.022 1
1 465 . 9 1 1 A 42 42 ALA H H 80 7.227 7.860 -0.633 1
1 466 . 9 1 1 A 42 42 ALA HA H 80 4.437 4.953 -0.516 1
1 470 . 9 1 1 A 42 42 ALA C C 80 173.745 178.829 -5.084 1
1 471 . 9 1 1 A 42 42 ALA CA C 80 51.499 53.836 -2.337 1
1 472 . 9 1 1 A 42 42 ALA CB C 80 15.877 18.579 -2.702 1
1 473 . 9 1 1 A 42 42 ALA N N 80 119.751 121.107 -1.356 1
1 474 . 9 1 1 A 43 43 LEU H H 81 7.932 8.031 -0.099 1
1 475 . 9 1 1 A 43 43 LEU HA H 81 4.369 4.411 -0.042 1
1 485 . 9 1 1 A 43 43 LEU C C 81 174.788 178.227 -3.439 1
1 486 . 9 1 1 A 43 43 LEU CA C 81 53.374 57.056 -3.682 1
1 487 . 9 1 1 A 43 43 LEU CB C 81 39.625 42.711 -3.086 1
1 491 . 9 1 1 A 43 43 LEU N N 81 111.742 119.837 -8.095 1
1 492 . 9 1 1 A 44 44 VAL H H 82 7.886 7.533 0.353 1
1 493 . 9 1 1 A 44 44 VAL HA H 82 4.700 4.262 0.438 1
1 501 . 9 1 1 A 44 44 VAL C C 82 172.875 176.045 -3.170 1
1 502 . 9 1 1 A 44 44 VAL CA C 82 59.624 63.888 -4.264 1
1 503 . 9 1 1 A 44 44 VAL CB C 82 31.501 33.538 -2.037 1
1 506 . 9 1 1 A 44 44 VAL N N 82 113.604 117.324 -3.720 1
1 507 . 9 1 1 A 45 45 LYS H H 83 8.361 8.402 -0.041 1
1 508 . 9 1 1 A 45 45 LYS HA H 83 4.251 5.042 -0.791 1
1 515 . 9 1 1 A 45 45 LYS C C 83 171.053 175.046 -3.993 1
1 516 . 9 1 1 A 45 45 LYS CA C 83 52.749 54.353 -1.604 1
1 517 . 9 1 1 A 45 45 LYS CB C 83 33.375 35.922 -2.547 1
1 521 . 9 1 1 A 45 45 LYS N N 83 123.860 120.577 3.283 1
1 522 . 9 1 1 A 46 46 LYS H H 84 7.243 7.926 -0.683 1
1 523 . 9 1 1 A 46 46 LYS HA H 84 2.175 2.773 -0.598 1
1 532 . 9 1 1 A 46 46 LYS C C 84 172.123 174.453 -2.330 1
1 533 . 9 1 1 A 46 46 LYS CA C 84 52.749 54.304 -1.555 1
1 534 . 9 1 1 A 46 46 LYS CB C 84 29.626 31.327 -1.701 1
1 537 . 9 1 1 A 46 46 LYS N N 84 128.615 124.161 4.454 1
1 538 . 9 1 1 A 47 47 PRO HA H 85 4.470 4.445 0.025 1
1 541 . 9 1 1 A 47 47 PRO C C 85 173.754 176.881 -3.127 1
1 542 . 9 1 1 A 47 47 PRO CA C 85 60.874 63.142 -2.268 1
1 543 . 9 1 1 A 47 47 PRO CB C 85 30.876 32.427 -1.551 1
1 546 . 9 1 1 A 48 48 THR H H 86 8.306 8.472 -0.166 1
1 547 . 9 1 1 A 48 48 THR HA H 86 4.287 4.413 -0.126 1
1 552 . 9 1 1 A 48 48 THR C C 86 173.070 174.758 -1.688 1
1 553 . 9 1 1 A 48 48 THR CA C 86 57.749 62.430 -4.681 1
1 554 . 9 1 1 A 48 48 THR CB C 86 67.748 69.789 -2.041 1
1 556 . 9 1 1 A 48 48 THR N N 86 109.564 117.122 -7.558 1
1 557 . 9 1 1 A 49 49 GLY H H 87 8.317 7.804 0.513 1
1 558 . 9 1 1 A 49 49 GLY HA2 H 87 3.851 4.040 -0.189 1
1 559 . 9 1 1 A 49 49 GLY HA3 H 87 3.678 4.042 -0.364 1
1 560 . 9 1 1 A 49 49 GLY C C 87 169.693 172.787 -3.094 1
1 561 . 9 1 1 A 49 49 GLY CA C 87 42.125 44.261 -2.136 1
1 562 . 9 1 1 A 49 49 GLY N N 87 109.071 109.852 -0.781 1
1 563 . 9 1 1 A 50 50 ASN H H 88 8.301 8.669 -0.368 1
1 564 . 9 1 1 A 50 50 ASN HA H 88 4.780 5.545 -0.765 1
1 569 . 9 1 1 A 50 50 ASN C C 88 171.370 174.338 -2.968 1
1 570 . 9 1 1 A 50 50 ASN CA C 88 47.749 50.792 -3.043 1
1 571 . 9 1 1 A 50 50 ASN CB C 88 37.125 39.770 -2.645 1
1 572 . 9 1 1 A 50 50 ASN N N 88 115.631 117.417 -1.786 1
1 574 . 9 1 1 A 51 51 PRO HA H 89 4.782 4.628 0.154 1
1 577 . 9 1 1 A 51 51 PRO C C 89 173.656 175.967 -2.311 1
1 578 . 9 1 1 A 51 51 PRO CA C 89 59.624 62.066 -2.442 1
1 579 . 9 1 1 A 51 51 PRO CB C 89 31.501 32.632 -1.131 1
1 582 . 9 1 1 A 52 52 GLN H H 90 9.076 8.809 0.267 1
1 583 . 9 1 1 A 52 52 GLN HA H 90 4.469 4.841 -0.372 1
1 590 . 9 1 1 A 52 52 GLN C C 90 172.386 174.162 -1.776 1
1 591 . 9 1 1 A 52 52 GLN CA C 90 50.874 53.601 -2.727 1
1 592 . 9 1 1 A 52 52 GLN CB C 90 26.501 27.941 -1.440 1
1 594 . 9 1 1 A 52 52 GLN N N 90 126.827 119.717 7.110 1
1 596 . 9 1 1 A 53 53 PRO HA H 91 4.384 4.645 -0.261 1
1 599 . 9 1 1 A 53 53 PRO C C 91 174.274 176.165 -1.891 1
1 600 . 9 1 1 A 53 53 PRO CB C 91 28.113 31.367 -3.254 1
1 601 . 9 1 1 A 54 54 LYS H H 92 8.401 8.243 0.158 1
1 602 . 9 1 1 A 54 54 LYS HA H 92 3.984 4.740 -0.756 1
1 611 . 9 1 1 A 54 54 LYS C C 92 173.516 175.942 -2.426 1
1 612 . 9 1 1 A 54 54 LYS CA C 92 55.249 54.925 0.324 1
1 613 . 9 1 1 A 54 54 LYS CB C 92 30.876 36.598 -5.722 1
1 615 . 9 1 1 A 54 54 LYS N N 92 124.538 123.668 0.870 1
1 616 . 9 1 1 A 55 55 ASN H H 93 8.183 8.627 -0.444 1
1 617 . 9 1 1 A 55 55 ASN HA H 93 4.716 4.984 -0.268 1
1 622 . 9 1 1 A 55 55 ASN CA C 93 48.999 53.354 -4.355 1
1 623 . 9 1 1 A 55 55 ASN CB C 93 35.875 38.365 -2.490 1
1 624 . 9 1 1 A 55 55 ASN N N 93 118.677 121.046 -2.369 1
1 626 . 9 1 1 A 56 56 TRP H H 94 8.007 8.571 -0.564 1
1 627 . 9 1 1 A 56 56 TRP HA H 94 3.827 5.455 -1.628 1
1 635 . 9 1 1 A 56 56 TRP C C 94 173.760 175.217 -1.457 1
1 636 . 9 1 1 A 56 56 TRP CA C 94 59.624 59.183 0.441 1
1 637 . 9 1 1 A 56 56 TRP CB C 94 27.126 30.402 -3.276 1
1 638 . 9 1 1 A 56 56 TRP N N 94 122.195 127.855 -5.660 1
1 640 . 9 1 1 A 57 57 ASN H H 95 7.563 7.738 -0.175 1
1 641 . 9 1 1 A 57 57 ASN HA H 95 3.735 4.893 -1.158 1
1 646 . 9 1 1 A 57 57 ASN C C 95 171.952 174.021 -2.069 1
1 647 . 9 1 1 A 57 57 ASN CA C 95 51.499 50.632 0.867 1
1 648 . 9 1 1 A 57 57 ASN CB C 95 35.250 41.144 -5.894 1
1 649 . 9 1 1 A 57 57 ASN N N 95 129.659 125.178 4.481 1
1 651 . 9 1 1 A 58 58 LYS H H 96 8.110 8.029 0.081 1
1 652 . 9 1 1 A 58 58 LYS HA H 96 4.035 3.743 0.292 1
1 659 . 9 1 1 A 58 58 LYS C C 96 174.530 175.584 -1.054 1
1 660 . 9 1 1 A 58 58 LYS CA C 96 56.499 55.079 1.420 1
1 661 . 9 1 1 A 58 58 LYS CB C 96 29.626 33.015 -3.389 1
1 665 . 9 1 1 A 58 58 LYS N N 96 123.913 123.233 0.680 1
1 666 . 9 1 1 A 59 59 ASP H H 97 7.903 9.300 -1.397 1
1 667 . 9 1 1 A 59 59 ASP HA H 97 4.393 4.359 0.034 1
1 670 . 9 1 1 A 59 59 ASP C C 97 173.724 174.844 -1.120 1
1 671 . 9 1 1 A 59 59 ASP CA C 97 52.124 54.983 -2.859 1
1 672 . 9 1 1 A 59 59 ASP CB C 97 38.375 40.037 -1.662 1
1 673 . 9 1 1 A 59 59 ASP N N 97 118.773 120.254 -1.481 1
1 674 . 9 1 1 A 60 60 GLY H H 98 7.819 8.167 -0.348 1
1 675 . 9 1 1 A 60 60 GLY HA2 H 98 3.917 2.465 1.452 1
1 676 . 9 1 1 A 60 60 GLY HA3 H 98 3.917 3.379 0.538 1
1 677 . 9 1 1 A 60 60 GLY C C 98 168.652 174.020 -5.368 1
1 678 . 9 1 1 A 60 60 GLY CA C 98 41.500 44.340 -2.840 1
1 679 . 9 1 1 A 60 60 GLY N N 98 108.742 104.597 4.145 1
1 680 . 9 1 1 A 61 61 TYR H H 99 8.105 7.601 0.504 1
1 681 . 9 1 1 A 61 61 TYR HA H 99 3.927 4.414 -0.487 1
1 689 . 9 1 1 A 61 61 TYR C C 99 172.831 174.052 -1.221 1
1 690 . 9 1 1 A 61 61 TYR CA C 99 57.124 58.187 -1.063 1
1 691 . 9 1 1 A 61 61 TYR CB C 99 37.125 36.378 0.747 1
1 692 . 9 1 1 A 61 61 TYR N N 99 113.836 117.915 -4.079 1
1 693 . 9 1 1 A 62 62 LEU H H 100 7.352 7.986 -0.634 1
1 694 . 9 1 1 A 62 62 LEU HA H 100 4.343 4.835 -0.492 1
1 704 . 9 1 1 A 62 62 LEU C C 100 173.430 175.229 -1.799 1
1 705 . 9 1 1 A 62 62 LEU CA C 100 50.874 52.929 -2.055 1
1 706 . 9 1 1 A 62 62 LEU CB C 100 44.000 45.019 -1.019 1
1 710 . 9 1 1 A 62 62 LEU N N 100 117.112 123.065 -5.953 1
1 711 . 9 1 1 A 63 63 LYS H H 101 8.626 8.240 0.386 1
1 712 . 9 1 1 A 63 63 LYS HA H 101 3.986 4.487 -0.501 1
1 721 . 9 1 1 A 63 63 LYS C C 101 173.851 176.744 -2.893 1
1 722 . 9 1 1 A 63 63 LYS CA C 101 55.249 55.323 -0.074 1
1 723 . 9 1 1 A 63 63 LYS CB C 101 29.626 33.724 -4.098 1
1 724 . 9 1 1 A 63 63 LYS N N 101 129.991 121.513 8.478 1
1 725 . 9 1 1 A 64 64 LYS H H 102 7.059 8.524 -1.465 1
1 726 . 9 1 1 A 64 64 LYS HA H 102 4.138 4.327 -0.189 1
1 735 . 9 1 1 A 64 64 LYS C C 102 171.120 174.526 -3.406 1
1 736 . 9 1 1 A 64 64 LYS CA C 102 52.749 55.795 -3.046 1
1 737 . 9 1 1 A 64 64 LYS CB C 102 32.750 30.970 1.780 1
1 740 . 9 1 1 A 64 64 LYS N N 102 113.255 120.623 -7.368 1
1 741 . 9 1 1 A 65 65 LEU H H 103 8.883 7.800 1.083 1
1 742 . 9 1 1 A 65 65 LEU HA H 103 4.475 4.752 -0.277 1
1 752 . 9 1 1 A 65 65 LEU C C 103 171.487 174.347 -2.860 1
1 753 . 9 1 1 A 65 65 LEU CA C 103 48.999 51.067 -2.068 1
1 754 . 9 1 1 A 65 65 LEU CB C 103 39.625 45.102 -5.477 1
1 758 . 9 1 1 A 65 65 LEU N N 103 126.355 126.616 -0.261 1
1 759 . 9 1 1 A 66 66 PRO HA H 104 4.449 4.647 -0.198 1
1 764 . 9 1 1 A 66 66 PRO C C 104 173.363 176.297 -2.934 1
1 765 . 9 1 1 A 66 66 PRO CA C 104 60.249 62.127 -1.878 1
1 766 . 9 1 1 A 66 66 PRO CB C 104 29.626 32.700 -3.074 1
1 769 . 9 1 1 A 67 67 VAL H H 105 7.682 8.393 -0.711 1
1 770 . 9 1 1 A 67 67 VAL HA H 105 4.121 4.481 -0.360 1
1 778 . 9 1 1 A 67 67 VAL C C 105 171.667 174.964 -3.297 1
1 779 . 9 1 1 A 67 67 VAL CA C 105 58.374 61.481 -3.107 1
1 780 . 9 1 1 A 67 67 VAL CB C 105 30.251 33.253 -3.002 1
1 783 . 9 1 1 A 67 67 VAL N N 105 114.671 121.326 -6.655 1
1 784 . 9 1 1 A 68 68 ASP H H 106 8.216 8.306 -0.090 1
1 785 . 9 1 1 A 68 68 ASP HA H 106 4.474 4.904 -0.430 1
1 788 . 9 1 1 A 68 68 ASP C C 106 172.452 174.911 -2.459 1
1 789 . 9 1 1 A 68 68 ASP CA C 106 50.249 52.430 -2.181 1
1 790 . 9 1 1 A 68 68 ASP CB C 106 37.750 40.599 -2.849 1
1 791 . 9 1 1 A 68 68 ASP N N 106 123.825 124.951 -1.126 1
1 792 . 9 1 1 A 69 69 PRO HA H 107 3.920 4.075 -0.155 1
1 797 . 9 1 1 A 69 69 PRO CA C 107 62.123 63.062 -0.939 1
1 798 . 9 1 1 A 69 69 PRO CB C 107 27.751 31.671 -3.920 1
1 801 . 9 1 1 A 70 70 TRP H H 108 8.156 8.418 -0.262 1
1 802 . 9 1 1 A 70 70 TRP HA H 108 4.274 4.290 -0.016 1
1 811 . 9 1 1 A 70 70 TRP CA C 108 57.124 58.481 -1.357 1
1 812 . 9 1 1 A 70 70 TRP CB C 108 25.251 27.113 -1.862 1
1 813 . 9 1 1 A 70 70 TRP N N 108 118.137 117.419 0.718 1
1 815 . 9 1 1 A 71 71 GLY H H 109 8.209 8.741 -0.532 1
1 816 . 9 1 1 A 71 71 GLY HA2 H 109 4.030 3.911 0.119 1
1 817 . 9 1 1 A 71 71 GLY HA3 H 109 3.303 3.935 -0.632 1
1 818 . 9 1 1 A 71 71 GLY CA C 109 42.750 46.914 -4.164 1
1 819 . 9 1 1 A 71 71 GLY N N 109 107.495 105.390 2.105 1
1 820 . 9 1 1 A 72 72 ASN H H 110 8.116 7.870 0.246 1
1 821 . 9 1 1 A 72 72 ASN HA H 110 5.103 5.048 0.055 1
1 826 . 9 1 1 A 72 72 ASN CA C 110 48.374 50.398 -2.024 1
1 827 . 9 1 1 A 72 72 ASN CB C 110 36.500 39.091 -2.591 1
1 828 . 9 1 1 A 72 72 ASN N N 110 120.108 118.666 1.442 1
1 830 . 9 1 1 A 73 73 PRO HA H 111 4.397 4.711 -0.314 1
1 835 . 9 1 1 A 73 73 PRO C C 111 176.229 176.431 -0.202 1
1 836 . 9 1 1 A 73 73 PRO CA C 111 60.249 62.332 -2.083 1
1 837 . 9 1 1 A 73 73 PRO CB C 111 29.001 32.422 -3.421 1
1 840 . 9 1 1 A 74 74 TYR H H 112 8.893 8.529 0.364 1
1 841 . 9 1 1 A 74 74 TYR HA H 112 4.064 4.765 -0.701 1
1 849 . 9 1 1 A 74 74 TYR C C 112 171.951 176.043 -4.092 1
1 850 . 9 1 1 A 74 74 TYR CA C 112 60.249 58.462 1.787 1
1 851 . 9 1 1 A 74 74 TYR CB C 112 36.500 39.597 -3.097 1
1 852 . 9 1 1 A 74 74 TYR N N 112 124.595 121.661 2.934 1
1 853 . 9 1 1 A 75 75 GLN H H 113 9.127 8.859 0.268 1
1 854 . 9 1 1 A 75 75 GLN HA H 113 4.019 4.355 -0.336 1
1 861 . 9 1 1 A 75 75 GLN C C 113 171.436 174.272 -2.836 1
1 862 . 9 1 1 A 75 75 GLN CA C 113 50.874 54.643 -3.769 1
1 863 . 9 1 1 A 75 75 GLN CB C 113 29.469 29.691 -0.222 1
1 865 . 9 1 1 A 75 75 GLN N N 113 120.777 122.104 -1.327 1
1 867 . 9 1 1 A 76 76 TYR H H 114 7.906 8.616 -0.710 1
1 868 . 9 1 1 A 76 76 TYR HA H 114 5.586 5.123 0.463 1
1 875 . 9 1 1 A 76 76 TYR C C 114 171.343 175.357 -4.014 1
1 876 . 9 1 1 A 76 76 TYR CA C 114 53.999 56.666 -2.667 1
1 877 . 9 1 1 A 76 76 TYR CB C 114 40.250 40.093 0.157 1
1 878 . 9 1 1 A 76 76 TYR N N 114 120.757 123.130 -2.373 1
1 879 . 9 1 1 A 77 77 LEU H H 115 8.261 9.134 -0.873 1
1 880 . 9 1 1 A 77 77 LEU HA H 115 4.280 5.218 -0.938 1
1 890 . 9 1 1 A 77 77 LEU C C 115 170.921 175.858 -4.937 1
1 891 . 9 1 1 A 77 77 LEU CA C 115 51.499 53.572 -2.073 1
1 892 . 9 1 1 A 77 77 LEU CB C 115 44.625 45.403 -0.778 1
1 896 . 9 1 1 A 77 77 LEU N N 115 130.662 124.783 5.879 1
1 897 . 9 1 1 A 78 78 ALA H H 116 7.973 8.477 -0.504 1
1 898 . 9 1 1 A 78 78 ALA HA H 116 4.292 4.669 -0.377 1
1 902 . 9 1 1 A 78 78 ALA C C 116 172.093 175.020 -2.927 1
1 903 . 9 1 1 A 78 78 ALA CA C 116 47.749 50.056 -2.307 1
1 904 . 9 1 1 A 78 78 ALA CB C 116 19.626 20.336 -0.710 1
1 905 . 9 1 1 A 78 78 ALA N N 116 125.564 125.221 0.343 1
1 906 . 9 1 1 A 79 79 PRO HA H 117 4.698 5.312 -0.614 1
1 911 . 9 1 1 A 79 79 PRO C C 117 173.994 176.666 -2.672 1
1 912 . 9 1 1 A 79 79 PRO CA C 117 60.249 63.510 -3.261 1
1 913 . 9 1 1 A 79 79 PRO CB C 117 31.501 31.943 -0.442 1
1 916 . 9 1 1 A 80 80 GLY H H 118 7.096 8.438 -1.342 1
1 917 . 9 1 1 A 80 80 GLY HA2 H 118 3.797 3.992 -0.195 1
1 918 . 9 1 1 A 80 80 GLY HA3 H 118 3.517 4.023 -0.506 1
1 919 . 9 1 1 A 80 80 GLY C C 118 171.404 174.276 -2.872 1
1 920 . 9 1 1 A 80 80 GLY CA C 118 41.500 46.421 -4.921 1
1 921 . 9 1 1 A 80 80 GLY N N 118 108.306 108.060 0.246 1
1 922 . 9 1 1 A 81 81 THR H H 119 9.810 8.221 1.589 1
1 923 . 9 1 1 A 81 81 THR HA H 119 4.091 4.457 -0.366 1
1 928 . 9 1 1 A 81 81 THR C C 119 174.242 175.255 -1.013 1
1 929 . 9 1 1 A 81 81 THR CA C 119 60.874 60.675 0.199 1
1 930 . 9 1 1 A 81 81 THR CB C 119 66.498 68.775 -2.277 1
1 932 . 9 1 1 A 81 81 THR N N 119 112.813 114.132 -1.319 1
1 933 . 9 1 1 A 82 82 LYS H H 120 8.964 8.389 0.575 1
1 934 . 9 1 1 A 82 82 LYS HA H 120 4.150 3.951 0.199 1
1 941 . 9 1 1 A 82 82 LYS C C 120 172.886 175.592 -2.706 1
1 942 . 9 1 1 A 82 82 LYS CA C 120 53.999 57.445 -3.446 1
1 943 . 9 1 1 A 82 82 LYS CB C 120 30.876 30.190 0.686 1
1 944 . 9 1 1 A 82 82 LYS N N 120 123.569 123.926 -0.357 1
1 945 . 9 1 1 A 83 83 GLY H H 121 7.125 7.931 -0.806 1
1 946 . 9 1 1 A 83 83 GLY HA2 H 121 3.814 4.267 -0.453 1
1 947 . 9 1 1 A 83 83 GLY HA3 H 121 3.814 4.329 -0.515 1
1 948 . 9 1 1 A 83 83 GLY C C 121 167.671 174.317 -6.646 1
1 949 . 9 1 1 A 83 83 GLY CA C 121 42.125 44.240 -2.115 1
1 950 . 9 1 1 A 83 83 GLY N N 121 107.253 109.080 -1.827 1
1 951 . 9 1 1 A 84 84 PRO HA H 122 4.077 4.483 -0.406 1
1 958 . 9 1 1 A 84 84 PRO C C 122 175.199 176.760 -1.561 1
1 959 . 9 1 1 A 84 84 PRO CA C 122 63.373 64.551 -1.178 1
1 960 . 9 1 1 A 84 84 PRO CB C 122 30.251 32.031 -1.780 1
1 962 . 9 1 1 A 85 85 PHE H H 123 6.652 6.781 -0.129 1
1 963 . 9 1 1 A 85 85 PHE HA H 123 4.744 4.797 -0.053 1
1 971 . 9 1 1 A 85 85 PHE C C 123 170.340 172.661 -2.321 1
1 972 . 9 1 1 A 85 85 PHE CA C 123 53.999 56.342 -2.343 1
1 973 . 9 1 1 A 85 85 PHE CB C 123 39.000 40.301 -1.301 1
1 974 . 9 1 1 A 85 85 PHE N N 123 108.468 112.664 -4.196 1
1 975 . 9 1 1 A 86 86 ASP H H 124 9.268 9.088 0.180 1
1 976 . 9 1 1 A 86 86 ASP HA H 124 5.108 5.570 -0.462 1
1 979 . 9 1 1 A 86 86 ASP C C 124 171.180 175.015 -3.835 1
1 980 . 9 1 1 A 86 86 ASP CA C 124 50.249 53.722 -3.473 1
1 981 . 9 1 1 A 86 86 ASP CB C 124 40.250 43.830 -3.580 1
1 982 . 9 1 1 A 86 86 ASP N N 124 121.741 119.103 2.638 1
1 983 . 9 1 1 A 87 87 LEU H H 125 8.018 8.891 -0.873 1
1 984 . 9 1 1 A 87 87 LEU HA H 125 5.809 5.533 0.276 1
1 994 . 9 1 1 A 87 87 LEU C C 125 171.350 175.366 -4.016 1
1 995 . 9 1 1 A 87 87 LEU CA C 125 50.874 53.722 -2.848 1
1 996 . 9 1 1 A 87 87 LEU CB C 125 44.318 45.989 -1.671 1
1 999 . 9 1 1 A 87 87 LEU N N 125 123.629 121.250 2.379 1
1 1000 . 9 1 1 A 88 88 TYR H H 126 8.912 8.735 0.177 1
1 1001 . 9 1 1 A 88 88 TYR HA H 126 5.630 5.643 -0.013 1
1 1008 . 9 1 1 A 88 88 TYR C C 126 171.410 172.337 -0.927 1
1 1009 . 9 1 1 A 88 88 TYR CA C 126 52.749 56.621 -3.872 1
1 1010 . 9 1 1 A 88 88 TYR CB C 126 37.750 40.629 -2.879 1
1 1011 . 9 1 1 A 88 88 TYR N N 126 119.697 117.244 2.453 1
1 1012 . 9 1 1 A 89 89 SER H H 127 9.319 9.426 -0.107 1
1 1013 . 9 1 1 A 89 89 SER HA H 127 5.429 5.318 0.111 1
1 1016 . 9 1 1 A 89 89 SER CA C 127 52.124 56.494 -4.370 1
1 1017 . 9 1 1 A 89 89 SER CB C 127 62.748 66.187 -3.439 1
1 1018 . 9 1 1 A 89 89 SER N N 127 112.637 115.718 -3.081 1
1 1019 . 9 1 1 A 90 90 LEU H H 128 8.759 8.500 0.259 1
1 1020 . 9 1 1 A 90 90 LEU HA H 128 4.186 4.417 -0.231 1
1 1030 . 9 1 1 A 90 90 LEU C C 128 175.121 178.274 -3.153 1
1 1031 . 9 1 1 A 90 90 LEU CA C 128 52.749 55.104 -2.355 1
1 1032 . 9 1 1 A 90 90 LEU CB C 128 35.875 42.318 -6.443 1
1 1033 . 9 1 1 A 90 90 LEU N N 128 126.728 125.229 1.499 1
1 1034 . 9 1 1 A 91 91 GLY H H 129 8.356 8.097 0.259 1
1 1035 . 9 1 1 A 91 91 GLY HA2 H 129 3.373 3.828 -0.455 1
1 1036 . 9 1 1 A 91 91 GLY HA3 H 129 3.373 3.861 -0.488 1
1 1037 . 9 1 1 A 91 91 GLY C C 129 172.013 174.475 -2.462 1
1 1038 . 9 1 1 A 91 91 GLY CA C 129 41.500 44.194 -2.694 1
1 1039 . 9 1 1 A 91 91 GLY N N 129 108.559 108.864 -0.305 1
1 1040 . 9 1 1 A 92 92 ALA H H 130 7.047 8.296 -1.249 1
1 1041 . 9 1 1 A 92 92 ALA HA H 130 4.037 2.865 1.172 1
1 1045 . 9 1 1 A 92 92 ALA C C 130 174.890 177.487 -2.597 1
1 1046 . 9 1 1 A 92 92 ALA CA C 130 52.100 53.513 -1.413 1
1 1047 . 9 1 1 A 92 92 ALA CB C 130 16.502 17.680 -1.178 1
1 1048 . 9 1 1 A 92 92 ALA N N 130 118.393 121.596 -3.203 1
1 1049 . 9 1 1 A 93 93 ASP H H 131 7.222 7.665 -0.443 1
1 1050 . 9 1 1 A 93 93 ASP HA H 131 4.122 4.698 -0.576 1
1 1053 . 9 1 1 A 93 93 ASP C C 131 174.890 176.214 -1.324 1
1 1054 . 9 1 1 A 93 93 ASP CA C 131 50.249 53.657 -3.408 1
1 1055 . 9 1 1 A 93 93 ASP CB C 131 37.750 40.911 -3.161 1
1 1056 . 9 1 1 A 93 93 ASP N N 131 111.487 116.709 -5.222 1
1 1057 . 9 1 1 A 94 94 GLY H H 132 7.199 8.480 -1.281 1
1 1058 . 9 1 1 A 94 94 GLY HA2 H 132 3.951 3.904 0.047 1
1 1059 . 9 1 1 A 94 94 GLY HA3 H 132 3.324 3.911 -0.587 1
1 1060 . 9 1 1 A 94 94 GLY C C 132 169.773 173.717 -3.944 1
1 1061 . 9 1 1 A 94 94 GLY CA C 132 44.625 46.532 -1.907 1
1 1062 . 9 1 1 A 94 94 GLY N N 132 106.932 108.655 -1.723 1
1 1063 . 9 1 1 A 95 95 LYS H H 133 7.215 7.550 -0.335 1
1 1064 . 9 1 1 A 95 95 LYS HA H 133 4.513 4.943 -0.430 1
1 1073 . 9 1 1 A 95 95 LYS C C 133 172.108 174.787 -2.679 1
1 1074 . 9 1 1 A 95 95 LYS CA C 133 51.512 54.783 -3.271 1
1 1075 . 9 1 1 A 95 95 LYS CB C 133 34.000 35.847 -1.847 1
1 1076 . 9 1 1 A 95 95 LYS N N 133 115.749 119.352 -3.603 1
1 1077 . 9 1 1 A 96 96 GLU H H 134 9.230 8.821 0.409 1
1 1078 . 9 1 1 A 96 96 GLU HA H 134 4.352 4.841 -0.489 1
1 1083 . 9 1 1 A 96 96 GLU C C 134 175.219 175.825 -0.606 1
1 1084 . 9 1 1 A 96 96 GLU CA C 134 55.874 55.709 0.165 1
1 1085 . 9 1 1 A 96 96 GLU CB C 134 27.126 30.424 -3.298 1
1 1087 . 9 1 1 A 96 96 GLU N N 134 128.571 122.724 5.847 1
1 1088 . 9 1 1 A 97 97 GLY H H 135 10.677 8.469 2.208 1
1 1089 . 9 1 1 A 97 97 GLY HA2 H 135 4.037 4.341 -0.304 1
1 1090 . 9 1 1 A 97 97 GLY HA3 H 135 3.717 4.346 -0.629 1
1 1091 . 9 1 1 A 97 97 GLY C C 135 171.567 172.235 -0.668 1
1 1092 . 9 1 1 A 97 97 GLY CA C 135 41.500 45.538 -4.038 1
1 1093 . 9 1 1 A 97 97 GLY N N 135 117.011 110.655 6.356 1
1 1094 . 9 1 1 A 98 98 GLY H H 136 8.442 8.722 -0.280 1
1 1095 . 9 1 1 A 98 98 GLY HA2 H 136 4.195 4.231 -0.036 1
1 1096 . 9 1 1 A 98 98 GLY HA3 H 136 4.195 4.234 -0.039 1
1 1097 . 9 1 1 A 98 98 GLY C C 136 170.299 173.424 -3.125 1
1 1098 . 9 1 1 A 98 98 GLY CA C 136 40.875 44.868 -3.993 1
1 1099 . 9 1 1 A 98 98 GLY N N 136 109.494 109.026 0.468 1
1 1100 . 9 1 1 A 99 99 SER H H 137 8.701 8.800 -0.099 1
1 1101 . 9 1 1 A 99 99 SER HA H 137 4.639 4.914 -0.275 1
1 1104 . 9 1 1 A 99 99 SER C C 137 170.630 173.370 -2.740 1
1 1105 . 9 1 1 A 99 99 SER CA C 137 54.624 57.505 -2.881 1
1 1106 . 9 1 1 A 99 99 SER CB C 137 62.748 66.618 -3.870 1
1 1107 . 9 1 1 A 99 99 SER N N 137 114.685 118.786 -4.101 1
1 1108 . 9 1 1 A 100 100 ASP H H 138 9.117 8.870 0.247 1
1 1109 . 9 1 1 A 100 100 ASP HA H 138 3.965 4.492 -0.527 1
1 1112 . 9 1 1 A 100 100 ASP C C 138 175.540 178.224 -2.684 1
1 1113 . 9 1 1 A 100 100 ASP CA C 138 54.624 56.364 -1.740 1
1 1114 . 9 1 1 A 100 100 ASP CB C 138 36.500 40.709 -4.209 1
1 1115 . 9 1 1 A 100 100 ASP N N 138 120.777 122.567 -1.790 1
1 1116 . 9 1 1 A 101 101 ASN H H 139 8.667 8.386 0.281 1
1 1117 . 9 1 1 A 101 101 ASN HA H 139 4.333 4.630 -0.297 1
1 1122 . 9 1 1 A 101 101 ASN CA C 139 53.999 54.050 -0.051 1
1 1123 . 9 1 1 A 101 101 ASN CB C 139 34.625 38.459 -3.834 1
1 1124 . 9 1 1 A 101 101 ASN N N 139 121.930 115.508 6.422 1
1 1126 . 9 1 1 A 102 102 ASP H H 140 7.714 7.792 -0.078 1
1 1127 . 9 1 1 A 102 102 ASP HA H 140 4.037 4.534 -0.497 1
1 1130 . 9 1 1 A 102 102 ASP C C 140 172.807 175.960 -3.153 1
1 1131 . 9 1 1 A 102 102 ASP CA C 140 53.374 54.289 -0.915 1
1 1132 . 9 1 1 A 102 102 ASP CB C 140 37.125 41.241 -4.116 1
1 1133 . 9 1 1 A 102 102 ASP N N 140 118.011 118.187 -0.176 1
1 1134 . 9 1 1 A 103 103 ALA H H 141 7.060 7.294 -0.234 1
1 1135 . 9 1 1 A 103 103 ALA HA H 141 3.353 4.614 -1.261 1
1 1139 . 9 1 1 A 103 103 ALA C C 141 172.233 176.730 -4.497 1
1 1140 . 9 1 1 A 103 103 ALA CA C 141 49.624 51.063 -1.439 1
1 1141 . 9 1 1 A 103 103 ALA CB C 141 16.502 21.334 -4.832 1
1 1142 . 9 1 1 A 103 103 ALA N N 141 125.777 122.367 3.410 1
1 1143 . 9 1 1 A 104 104 ASP H H 142 7.973 8.077 -0.104 1
1 1144 . 9 1 1 A 104 104 ASP HA H 142 4.420 4.997 -0.577 1
1 1147 . 9 1 1 A 104 104 ASP C C 142 174.188 176.166 -1.978 1
1 1148 . 9 1 1 A 104 104 ASP CA C 142 52.124 54.067 -1.943 1
1 1149 . 9 1 1 A 104 104 ASP CB C 142 37.125 41.314 -4.189 1
1 1150 . 9 1 1 A 104 104 ASP N N 142 122.965 120.137 2.828 1
1 1151 . 9 1 1 A 105 105 ILE H H 143 8.534 8.990 -0.456 1
1 1152 . 9 1 1 A 105 105 ILE HA H 143 4.060 5.045 -0.985 1
1 1162 . 9 1 1 A 105 105 ILE C C 143 173.235 175.774 -2.539 1
1 1163 . 9 1 1 A 105 105 ILE CA C 143 58.374 59.747 -1.373 1
1 1164 . 9 1 1 A 105 105 ILE CB C 143 39.123 39.907 -0.784 1
1 1167 . 9 1 1 A 105 105 ILE N N 143 124.757 120.214 4.543 1
1 1168 . 9 1 1 A 106 106 GLY H H 144 8.288 8.373 -0.085 1
1 1169 . 9 1 1 A 106 106 GLY HA2 H 144 4.764 4.453 0.311 1
1 1170 . 9 1 1 A 106 106 GLY HA3 H 144 4.764 4.522 0.242 1
1 1171 . 9 1 1 A 106 106 GLY C C 144 171.321 171.772 -0.451 1
1 1172 . 9 1 1 A 106 106 GLY CA C 144 40.250 45.768 -5.518 1
1 1173 . 9 1 1 A 106 106 GLY N N 144 110.895 111.289 -0.394 1
1 1174 . 9 1 1 A 107 107 ASN H H 145 8.577 9.043 -0.466 1
1 1175 . 9 1 1 A 107 107 ASN HA H 145 4.268 4.957 -0.689 1
1 1180 . 9 1 1 A 107 107 ASN C C 145 171.757 173.683 -1.926 1
1 1181 . 9 1 1 A 107 107 ASN CA C 145 52.124 51.647 0.477 1
1 1182 . 9 1 1 A 107 107 ASN CB C 145 34.625 42.089 -7.464 1
1 1183 . 9 1 1 A 107 107 ASN N N 145 118.042 115.913 2.129 1
1 1185 . 9 1 1 A 108 108 TRP H H 146 6.822 8.413 -1.591 1
1 1186 . 9 1 1 A 108 108 TRP HA H 146 4.513 4.980 -0.467 1
1 1195 . 9 1 1 A 108 108 TRP C C 146 172.665 172.013 0.652 1
1 1196 . 9 1 1 A 108 108 TRP CA C 146 54.624 55.679 -1.055 1
1 1197 . 9 1 1 A 108 108 TRP CB C 146 25.876 31.097 -5.221 1
1 1198 . 9 1 1 A 108 108 TRP N N 146 116.756 117.805 -1.049 1
1 1200 . 9 1 1 A 109 109 ASP H H 147 7.344 7.721 -0.377 1
1 1201 . 9 1 1 A 109 109 ASP HA H 147 4.655 5.431 -0.776 1
1 1204 . 9 1 1 A 109 109 ASP C C 147 172.193 174.536 -2.343 1
1 1205 . 9 1 1 A 109 109 ASP CA C 147 51.499 52.519 -1.020 1
1 1206 . 9 1 1 A 109 109 ASP CB C 147 39.000 44.141 -5.141 1
1 1207 . 9 1 1 A 109 109 ASP N N 147 121.461 120.366 1.095 1
1 11 . 10 1 1 A 2 2 SER H H 40 8.461 8.883 -0.422 1
1 12 . 10 1 1 A 2 2 SER HA H 40 4.286 4.880 -0.594 1
1 15 . 10 1 1 A 2 2 SER C C 40 171.276 173.512 -2.236 1
1 16 . 10 1 1 A 2 2 SER CA C 40 55.249 57.727 -2.478 1
1 17 . 10 1 1 A 2 2 SER CB C 40 61.498 61.420 0.078 1
1 18 . 10 1 1 A 2 2 SER N N 40 118.344 124.121 -5.777 1
1 19 . 10 1 1 A 3 3 ARG H H 41 8.469 8.186 0.283 1
1 20 . 10 1 1 A 3 3 ARG HA H 41 4.400 4.884 -0.484 1
1 25 . 10 1 1 A 3 3 ARG C C 41 172.251 173.506 -1.255 1
1 26 . 10 1 1 A 3 3 ARG CA C 41 52.749 52.887 -0.138 1
1 27 . 10 1 1 A 3 3 ARG CB C 41 27.126 34.120 -6.994 1
1 28 . 10 1 1 A 3 3 ARG N N 41 123.070 123.119 -0.049 1
1 33 . 10 1 1 A 4 4 PRO CA C 42 61.498 63.793 -2.295 1
1 34 . 10 1 1 A 4 4 PRO CB C 42 29.001 31.831 -2.830 1
1 37 . 10 1 1 A 5 5 ASP H H 43 8.246 8.921 -0.675 1
1 38 . 10 1 1 A 5 5 ASP HA H 43 4.329 4.336 -0.007 1
1 41 . 10 1 1 A 5 5 ASP C C 43 174.605 177.046 -2.441 1
1 42 . 10 1 1 A 5 5 ASP CA C 43 53.374 56.718 -3.344 1
1 43 . 10 1 1 A 5 5 ASP CB C 43 38.375 38.570 -0.195 1
1 44 . 10 1 1 A 5 5 ASP N N 43 119.409 116.941 2.468 1
1 45 . 10 1 1 A 6 6 GLN H H 44 8.309 8.545 -0.236 1
1 46 . 10 1 1 A 6 6 GLN HA H 44 4.393 4.253 0.140 1
1 53 . 10 1 1 A 6 6 GLN C C 44 175.053 178.458 -3.405 1
1 54 . 10 1 1 A 6 6 GLN CA C 44 55.874 58.132 -2.258 1
1 55 . 10 1 1 A 6 6 GLN CB C 44 25.876 28.153 -2.277 1
1 57 . 10 1 1 A 6 6 GLN N N 44 122.273 117.804 4.469 1
1 59 . 10 1 1 A 7 7 ALA H H 45 8.106 8.130 -0.024 1
1 60 . 10 1 1 A 7 7 ALA HA H 45 3.993 4.054 -0.061 1
1 64 . 10 1 1 A 7 7 ALA C C 45 177.465 178.286 -0.821 1
1 65 . 10 1 1 A 7 7 ALA CA C 45 52.124 54.665 -2.541 1
1 66 . 10 1 1 A 7 7 ALA CB C 45 15.252 18.216 -2.964 1
1 67 . 10 1 1 A 7 7 ALA N N 45 122.204 121.781 0.423 1
1 68 . 10 1 1 A 8 8 LYS H H 46 7.527 7.816 -0.289 1
1 69 . 10 1 1 A 8 8 LYS HA H 46 3.539 4.110 -0.571 1
1 78 . 10 1 1 A 8 8 LYS C C 46 175.412 179.098 -3.686 1
1 79 . 10 1 1 A 8 8 LYS CA C 46 57.124 57.752 -0.628 1
1 80 . 10 1 1 A 8 8 LYS CB C 46 30.876 32.159 -1.283 1
1 83 . 10 1 1 A 8 8 LYS N N 46 117.358 116.536 0.822 1
1 84 . 10 1 1 A 9 9 VAL H H 47 7.709 7.603 0.106 1
1 85 . 10 1 1 A 9 9 VAL HA H 47 3.578 3.744 -0.166 1
1 93 . 10 1 1 A 9 9 VAL C C 47 175.005 178.440 -3.435 1
1 94 . 10 1 1 A 9 9 VAL CA C 47 64.623 66.136 -1.513 1
1 95 . 10 1 1 A 9 9 VAL CB C 47 29.001 31.807 -2.806 1
1 98 . 10 1 1 A 9 9 VAL N N 47 119.115 120.256 -1.141 1
1 99 . 10 1 1 A 10 10 THR H H 48 7.767 8.256 -0.489 1
1 100 . 10 1 1 A 10 10 THR HA H 48 3.668 4.029 -0.361 1
1 105 . 10 1 1 A 10 10 THR CA C 48 63.998 65.780 -1.782 1
1 106 . 10 1 1 A 10 10 THR CB C 48 67.123 68.767 -1.644 1
1 108 . 10 1 1 A 10 10 THR N N 48 115.112 114.049 1.063 1
1 109 . 10 1 1 A 11 11 VAL H H 49 7.598 7.955 -0.357 1
1 110 . 10 1 1 A 11 11 VAL HA H 49 3.457 3.631 -0.174 1
1 118 . 10 1 1 A 11 11 VAL C C 49 175.412 178.113 -2.701 1
1 119 . 10 1 1 A 11 11 VAL CA C 49 63.998 66.207 -2.209 1
1 120 . 10 1 1 A 11 11 VAL CB C 49 29.001 31.611 -2.610 1
1 123 . 10 1 1 A 11 11 VAL N N 49 123.694 121.254 2.440 1
1 124 . 10 1 1 A 12 12 ALA H H 50 8.176 8.014 0.162 1
1 125 . 10 1 1 A 12 12 ALA HA H 50 4.742 3.971 0.771 1
1 129 . 10 1 1 A 12 12 ALA C C 50 177.074 179.830 -2.756 1
1 130 . 10 1 1 A 12 12 ALA CA C 50 52.124 55.391 -3.267 1
1 131 . 10 1 1 A 12 12 ALA CB C 50 15.252 18.181 -2.929 1
1 132 . 10 1 1 A 12 12 ALA N N 50 122.348 122.286 0.062 1
1 133 . 10 1 1 A 13 13 LYS H H 51 8.499 8.126 0.373 1
1 134 . 10 1 1 A 13 13 LYS HA H 51 3.648 4.112 -0.464 1
1 143 . 10 1 1 A 13 13 LYS C C 51 177.252 179.988 -2.736 1
1 144 . 10 1 1 A 13 13 LYS CA C 51 58.072 59.388 -1.316 1
1 145 . 10 1 1 A 13 13 LYS CB C 51 30.251 32.412 -2.161 1
1 146 . 10 1 1 A 13 13 LYS N N 51 115.402 116.354 -0.952 1
1 147 . 10 1 1 A 14 14 GLY H H 52 7.858 8.090 -0.232 1
1 148 . 10 1 1 A 14 14 GLY HA2 H 52 3.823 3.671 0.152 1
1 149 . 10 1 1 A 14 14 GLY HA3 H 52 3.676 3.676 0.000 1
1 150 . 10 1 1 A 14 14 GLY C C 52 174.090 175.689 -1.599 1
1 151 . 10 1 1 A 14 14 GLY CA C 52 44.625 47.121 -2.496 1
1 152 . 10 1 1 A 14 14 GLY N N 52 107.466 108.825 -1.359 1
1 153 . 10 1 1 A 15 15 ASP H H 53 8.403 7.629 0.774 1
1 154 . 10 1 1 A 15 15 ASP HA H 53 4.191 4.397 -0.206 1
1 157 . 10 1 1 A 15 15 ASP C C 53 175.316 178.701 -3.385 1
1 158 . 10 1 1 A 15 15 ASP CA C 53 54.624 56.111 -1.487 1
1 159 . 10 1 1 A 15 15 ASP CB C 53 35.875 40.403 -4.528 1
1 160 . 10 1 1 A 15 15 ASP N N 53 125.929 121.513 4.416 1
1 161 . 10 1 1 A 16 16 ILE H H 54 8.245 7.651 0.594 1
1 162 . 10 1 1 A 16 16 ILE HA H 54 3.034 3.697 -0.663 1
1 172 . 10 1 1 A 16 16 ILE C C 54 174.499 177.967 -3.468 1
1 173 . 10 1 1 A 16 16 ILE CA C 54 62.748 64.051 -1.303 1
1 174 . 10 1 1 A 16 16 ILE CB C 54 34.625 37.150 -2.525 1
1 178 . 10 1 1 A 16 16 ILE N N 54 119.456 115.224 4.232 1
1 179 . 10 1 1 A 17 17 LYS H H 55 7.547 7.662 -0.115 1
1 180 . 10 1 1 A 17 17 LYS HA H 55 3.843 4.122 -0.279 1
1 187 . 10 1 1 A 17 17 LYS C C 55 176.651 179.450 -2.799 1
1 188 . 10 1 1 A 17 17 LYS CA C 55 57.124 59.423 -2.299 1
1 189 . 10 1 1 A 17 17 LYS CB C 55 30.251 31.906 -1.655 1
1 190 . 10 1 1 A 17 17 LYS N N 55 118.505 121.210 -2.705 1
1 191 . 10 1 1 A 18 18 ALA H H 56 7.680 7.814 -0.134 1
1 192 . 10 1 1 A 18 18 ALA HA H 56 4.029 4.030 -0.001 1
1 196 . 10 1 1 A 18 18 ALA C C 56 176.638 179.860 -3.222 1
1 197 . 10 1 1 A 18 18 ALA CA C 56 52.749 54.876 -2.127 1
1 198 . 10 1 1 A 18 18 ALA CB C 56 15.877 18.363 -2.486 1
1 199 . 10 1 1 A 18 18 ALA N N 56 122.477 121.821 0.656 1
1 200 . 10 1 1 A 19 19 ILE H H 57 8.853 7.851 1.002 1
1 201 . 10 1 1 A 19 19 ILE HA H 57 3.304 3.591 -0.287 1
1 211 . 10 1 1 A 19 19 ILE C C 57 174.710 177.837 -3.127 1
1 212 . 10 1 1 A 19 19 ILE CA C 57 63.373 65.421 -2.048 1
1 213 . 10 1 1 A 19 19 ILE CB C 57 35.250 37.442 -2.192 1
1 217 . 10 1 1 A 19 19 ILE N N 57 120.901 118.878 2.023 1
1 218 . 10 1 1 A 20 20 ALA H H 58 8.702 8.145 0.557 1
1 219 . 10 1 1 A 20 20 ALA HA H 58 3.900 3.809 0.091 1
1 223 . 10 1 1 A 20 20 ALA C C 58 176.512 180.024 -3.512 1
1 224 . 10 1 1 A 20 20 ALA CA C 58 52.749 55.490 -2.741 1
1 225 . 10 1 1 A 20 20 ALA CB C 58 15.252 18.007 -2.755 1
1 226 . 10 1 1 A 20 20 ALA N N 58 121.763 122.874 -1.111 1
1 227 . 10 1 1 A 21 21 ALA H H 59 7.662 7.700 -0.038 1
1 228 . 10 1 1 A 21 21 ALA HA H 59 4.136 4.193 -0.057 1
1 232 . 10 1 1 A 21 21 ALA C C 59 177.949 179.810 -1.861 1
1 233 . 10 1 1 A 21 21 ALA CA C 59 52.749 54.775 -2.026 1
1 234 . 10 1 1 A 21 21 ALA CB C 59 15.252 18.411 -3.159 1
1 235 . 10 1 1 A 21 21 ALA N N 59 119.079 119.440 -0.361 1
1 236 . 10 1 1 A 22 22 ALA H H 60 7.403 7.497 -0.094 1
1 237 . 10 1 1 A 22 22 ALA HA H 60 4.318 4.177 0.141 1
1 241 . 10 1 1 A 22 22 ALA C C 60 176.730 180.443 -3.713 1
1 242 . 10 1 1 A 22 22 ALA CA C 60 52.749 54.596 -1.847 1
1 243 . 10 1 1 A 22 22 ALA CB C 60 17.126 18.701 -1.575 1
1 244 . 10 1 1 A 22 22 ALA N N 60 122.616 120.186 2.430 1
1 245 . 10 1 1 A 23 23 LEU H H 61 8.410 8.500 -0.090 1
1 246 . 10 1 1 A 23 23 LEU HA H 61 3.527 3.943 -0.416 1
1 256 . 10 1 1 A 23 23 LEU C C 61 176.057 178.422 -2.365 1
1 257 . 10 1 1 A 23 23 LEU CA C 61 55.249 57.197 -1.948 1
1 258 . 10 1 1 A 23 23 LEU CB C 61 39.000 40.856 -1.856 1
1 262 . 10 1 1 A 23 23 LEU N N 61 120.761 120.841 -0.080 1
1 263 . 10 1 1 A 24 24 ASP H H 62 8.227 7.964 0.263 1
1 264 . 10 1 1 A 24 24 ASP HA H 62 4.581 4.370 0.211 1
1 267 . 10 1 1 A 24 24 ASP C C 62 176.968 178.502 -1.534 1
1 268 . 10 1 1 A 24 24 ASP CA C 62 55.874 57.164 -1.290 1
1 269 . 10 1 1 A 24 24 ASP CB C 62 37.750 41.038 -3.288 1
1 270 . 10 1 1 A 24 24 ASP N N 62 119.068 119.181 -0.113 1
1 271 . 10 1 1 A 25 25 MET H H 63 7.718 8.173 -0.455 1
1 272 . 10 1 1 A 25 25 MET HA H 63 4.196 4.083 0.113 1
1 277 . 10 1 1 A 25 25 MET C C 63 174.968 177.896 -2.928 1
1 278 . 10 1 1 A 25 25 MET CA C 63 55.249 58.649 -3.400 1
1 279 . 10 1 1 A 25 25 MET CB C 63 29.626 32.833 -3.207 1
1 281 . 10 1 1 A 25 25 MET N N 63 121.365 117.321 4.044 1
1 282 . 10 1 1 A 26 26 TYR H H 64 8.401 7.476 0.925 1
1 283 . 10 1 1 A 26 26 TYR HA H 64 4.400 3.654 0.746 1
1 291 . 10 1 1 A 26 26 TYR C C 64 176.098 177.363 -1.265 1
1 292 . 10 1 1 A 26 26 TYR CA C 64 58.999 61.070 -2.071 1
1 293 . 10 1 1 A 26 26 TYR CB C 64 35.250 38.275 -3.025 1
1 294 . 10 1 1 A 26 26 TYR N N 64 122.575 121.625 0.950 1
1 295 . 10 1 1 A 27 27 LYS H H 65 8.330 8.323 0.007 1
1 296 . 10 1 1 A 27 27 LYS HA H 65 3.568 4.293 -0.725 1
1 302 . 10 1 1 A 27 27 LYS C C 65 176.156 178.541 -2.385 1
1 303 . 10 1 1 A 27 27 LYS CA C 65 56.499 59.410 -2.911 1
1 304 . 10 1 1 A 27 27 LYS CB C 65 29.626 32.034 -2.408 1
1 306 . 10 1 1 A 27 27 LYS N N 65 121.390 118.883 2.507 1
1 307 . 10 1 1 A 28 28 LEU H H 66 7.833 7.951 -0.118 1
1 308 . 10 1 1 A 28 28 LEU HA H 66 3.769 4.135 -0.366 1
1 318 . 10 1 1 A 28 28 LEU C C 66 175.925 178.401 -2.476 1
1 319 . 10 1 1 A 28 28 LEU CA C 66 55.874 56.694 -0.820 1
1 320 . 10 1 1 A 28 28 LEU CB C 66 38.375 41.621 -3.246 1
1 324 . 10 1 1 A 28 28 LEU N N 66 123.068 119.456 3.612 1
1 325 . 10 1 1 A 29 29 ASP H H 67 7.292 7.917 -0.625 1
1 326 . 10 1 1 A 29 29 ASP HA H 67 4.096 4.311 -0.215 1
1 329 . 10 1 1 A 29 29 ASP C C 67 174.618 176.727 -2.109 1
1 330 . 10 1 1 A 29 29 ASP CA C 67 53.999 56.252 -2.253 1
1 331 . 10 1 1 A 29 29 ASP CB C 67 38.375 40.607 -2.232 1
1 332 . 10 1 1 A 29 29 ASP N N 67 114.729 119.322 -4.593 1
1 333 . 10 1 1 A 30 30 ASN H H 68 8.097 7.638 0.459 1
1 334 . 10 1 1 A 30 30 ASN HA H 68 4.337 4.377 -0.040 1
1 339 . 10 1 1 A 30 30 ASN C C 68 172.822 174.227 -1.405 1
1 340 . 10 1 1 A 30 30 ASN CA C 68 52.124 52.076 0.048 1
1 341 . 10 1 1 A 30 30 ASN CB C 68 37.750 38.404 -0.654 1
1 342 . 10 1 1 A 30 30 ASN N N 68 111.054 115.137 -4.083 1
1 344 . 10 1 1 A 31 31 PHE H H 69 8.249 7.963 0.286 1
1 345 . 10 1 1 A 31 31 PHE HA H 69 4.135 4.268 -0.133 1
1 353 . 10 1 1 A 31 31 PHE C C 69 170.485 174.258 -3.773 1
1 354 . 10 1 1 A 31 31 PHE CA C 69 57.749 58.755 -1.006 1
1 355 . 10 1 1 A 31 31 PHE CB C 69 33.375 36.586 -3.211 1
1 356 . 10 1 1 A 31 31 PHE N N 69 116.277 117.318 -1.041 1
1 357 . 10 1 1 A 32 32 ALA H H 70 7.224 6.933 0.291 1
1 358 . 10 1 1 A 32 32 ALA HA H 70 4.194 4.514 -0.320 1
1 362 . 10 1 1 A 32 32 ALA C C 70 173.337 175.031 -1.694 1
1 363 . 10 1 1 A 32 32 ALA CA C 70 48.374 51.507 -3.133 1
1 364 . 10 1 1 A 32 32 ALA CB C 70 19.626 22.136 -2.510 1
1 365 . 10 1 1 A 32 32 ALA N N 70 119.914 120.331 -0.417 1
1 366 . 10 1 1 A 33 33 TYR H H 71 7.948 8.456 -0.508 1
1 367 . 10 1 1 A 33 33 TYR HA H 71 4.209 4.947 -0.738 1
1 374 . 10 1 1 A 33 33 TYR C C 71 170.591 174.025 -3.434 1
1 375 . 10 1 1 A 33 33 TYR CA C 71 54.624 56.328 -1.704 1
1 376 . 10 1 1 A 33 33 TYR CB C 71 34.000 37.909 -3.909 1
1 377 . 10 1 1 A 33 33 TYR N N 71 116.929 117.912 -0.983 1
1 378 . 10 1 1 A 34 34 PRO HA H 72 4.444 4.642 -0.198 1
1 381 . 10 1 1 A 34 34 PRO C C 72 174.775 176.310 -1.535 1
1 382 . 10 1 1 A 34 34 PRO CA C 72 59.624 62.512 -2.888 1
1 383 . 10 1 1 A 34 34 PRO CB C 72 28.376 31.970 -3.594 1
1 384 . 10 1 1 A 35 35 SER H H 73 8.721 8.385 0.336 1
1 385 . 10 1 1 A 35 35 SER HA H 73 4.467 4.723 -0.256 1
1 388 . 10 1 1 A 35 35 SER C C 73 173.271 175.501 -2.230 1
1 389 . 10 1 1 A 35 35 SER CA C 73 55.249 56.652 -1.403 1
1 390 . 10 1 1 A 35 35 SER CB C 73 63.373 65.785 -2.412 1
1 391 . 10 1 1 A 35 35 SER N N 73 118.284 114.470 3.814 1
1 392 . 10 1 1 A 36 36 THR H H 74 8.591 8.760 -0.169 1
1 393 . 10 1 1 A 36 36 THR HA H 74 3.649 4.170 -0.521 1
1 398 . 10 1 1 A 36 36 THR CA C 74 64.623 64.185 0.438 1
1 399 . 10 1 1 A 36 36 THR CB C 74 66.498 69.038 -2.540 1
1 401 . 10 1 1 A 36 36 THR N N 74 117.769 116.576 1.193 1
1 402 . 10 1 1 A 37 37 GLN H H 75 8.210 7.870 0.340 1
1 403 . 10 1 1 A 37 37 GLN HA H 75 3.860 4.468 -0.608 1
1 410 . 10 1 1 A 37 37 GLN C C 75 175.349 177.639 -2.290 1
1 411 . 10 1 1 A 37 37 GLN CA C 75 56.499 57.563 -1.064 1
1 412 . 10 1 1 A 37 37 GLN CB C 75 25.876 29.722 -3.846 1
1 414 . 10 1 1 A 37 37 GLN N N 75 117.931 119.766 -1.835 1
1 416 . 10 1 1 A 38 38 GLN H H 76 7.667 8.191 -0.524 1
1 417 . 10 1 1 A 38 38 GLN HA H 76 3.810 4.091 -0.281 1
1 424 . 10 1 1 A 38 38 GLN C C 76 175.805 179.330 -3.525 1
1 425 . 10 1 1 A 38 38 GLN CA C 76 55.874 58.640 -2.766 1
1 426 . 10 1 1 A 38 38 GLN CB C 76 25.876 28.311 -2.435 1
1 428 . 10 1 1 A 38 38 GLN N N 76 120.607 118.267 2.340 1
1 430 . 10 1 1 A 39 39 GLY H H 77 8.470 8.157 0.313 1
1 431 . 10 1 1 A 39 39 GLY HA2 H 77 3.920 3.680 0.240 1
1 432 . 10 1 1 A 39 39 GLY HA3 H 77 3.603 3.715 -0.112 1
1 433 . 10 1 1 A 39 39 GLY C C 77 169.006 175.526 -6.520 1
1 434 . 10 1 1 A 39 39 GLY CA C 77 42.125 46.436 -4.311 1
1 435 . 10 1 1 A 39 39 GLY N N 77 103.281 109.492 -6.211 1
1 436 . 10 1 1 A 40 40 LEU H H 78 8.135 7.805 0.330 1
1 437 . 10 1 1 A 40 40 LEU HA H 78 3.237 4.022 -0.785 1
1 447 . 10 1 1 A 40 40 LEU C C 78 176.383 178.640 -2.257 1
1 448 . 10 1 1 A 40 40 LEU CA C 78 52.749 57.170 -4.421 1
1 449 . 10 1 1 A 40 40 LEU CB C 78 39.000 41.549 -2.549 1
1 453 . 10 1 1 A 40 40 LEU N N 78 114.444 123.219 -8.775 1
1 454 . 10 1 1 A 41 41 GLU H H 79 8.578 8.005 0.573 1
1 455 . 10 1 1 A 41 41 GLU HA H 79 3.720 4.012 -0.292 1
1 460 . 10 1 1 A 41 41 GLU C C 79 175.093 178.434 -3.341 1
1 461 . 10 1 1 A 41 41 GLU CA C 79 57.124 59.543 -2.419 1
1 462 . 10 1 1 A 41 41 GLU CB C 79 26.501 29.211 -2.710 1
1 464 . 10 1 1 A 41 41 GLU N N 79 118.295 118.313 -0.018 1
1 465 . 10 1 1 A 42 42 ALA H H 80 7.227 7.791 -0.564 1
1 466 . 10 1 1 A 42 42 ALA HA H 80 4.437 4.715 -0.278 1
1 470 . 10 1 1 A 42 42 ALA C C 80 173.745 178.114 -4.369 1
1 471 . 10 1 1 A 42 42 ALA CA C 80 51.499 53.667 -2.168 1
1 472 . 10 1 1 A 42 42 ALA CB C 80 15.877 18.619 -2.742 1
1 473 . 10 1 1 A 42 42 ALA N N 80 119.751 121.326 -1.575 1
1 474 . 10 1 1 A 43 43 LEU H H 81 7.932 7.475 0.457 1
1 475 . 10 1 1 A 43 43 LEU HA H 81 4.369 4.434 -0.065 1
1 485 . 10 1 1 A 43 43 LEU C C 81 174.788 177.774 -2.986 1
1 486 . 10 1 1 A 43 43 LEU CA C 81 53.374 55.292 -1.918 1
1 487 . 10 1 1 A 43 43 LEU CB C 81 39.625 42.199 -2.574 1
1 491 . 10 1 1 A 43 43 LEU N N 81 111.742 116.035 -4.293 1
1 492 . 10 1 1 A 44 44 VAL H H 82 7.886 7.336 0.550 1
1 493 . 10 1 1 A 44 44 VAL HA H 82 4.700 4.208 0.492 1
1 501 . 10 1 1 A 44 44 VAL C C 82 172.875 175.763 -2.888 1
1 502 . 10 1 1 A 44 44 VAL CA C 82 59.624 63.596 -3.972 1
1 503 . 10 1 1 A 44 44 VAL CB C 82 31.501 33.536 -2.035 1
1 506 . 10 1 1 A 44 44 VAL N N 82 113.604 115.417 -1.813 1
1 507 . 10 1 1 A 45 45 LYS H H 83 8.361 8.369 -0.008 1
1 508 . 10 1 1 A 45 45 LYS HA H 83 4.251 4.976 -0.725 1
1 515 . 10 1 1 A 45 45 LYS C C 83 171.053 174.909 -3.856 1
1 516 . 10 1 1 A 45 45 LYS CA C 83 52.749 54.285 -1.536 1
1 517 . 10 1 1 A 45 45 LYS CB C 83 33.375 35.818 -2.443 1
1 521 . 10 1 1 A 45 45 LYS N N 83 123.860 121.714 2.146 1
1 522 . 10 1 1 A 46 46 LYS H H 84 7.243 7.885 -0.642 1
1 523 . 10 1 1 A 46 46 LYS HA H 84 2.175 2.814 -0.639 1
1 532 . 10 1 1 A 46 46 LYS C C 84 172.123 174.399 -2.276 1
1 533 . 10 1 1 A 46 46 LYS CA C 84 52.749 54.207 -1.458 1
1 534 . 10 1 1 A 46 46 LYS CB C 84 29.626 31.692 -2.066 1
1 537 . 10 1 1 A 46 46 LYS N N 84 128.615 124.102 4.513 1
1 538 . 10 1 1 A 47 47 PRO HA H 85 4.470 4.506 -0.036 1
1 541 . 10 1 1 A 47 47 PRO C C 85 173.754 176.158 -2.404 1
1 542 . 10 1 1 A 47 47 PRO CA C 85 60.874 62.703 -1.829 1
1 543 . 10 1 1 A 47 47 PRO CB C 85 30.876 31.969 -1.093 1
1 546 . 10 1 1 A 48 48 THR H H 86 8.306 8.263 0.043 1
1 547 . 10 1 1 A 48 48 THR HA H 86 4.287 4.706 -0.419 1
1 552 . 10 1 1 A 48 48 THR C C 86 173.070 173.665 -0.595 1
1 553 . 10 1 1 A 48 48 THR CA C 86 57.749 60.623 -2.874 1
1 554 . 10 1 1 A 48 48 THR CB C 86 67.748 70.876 -3.128 1
1 556 . 10 1 1 A 48 48 THR N N 86 109.564 111.968 -2.404 1
1 557 . 10 1 1 A 49 49 GLY H H 87 8.317 8.334 -0.017 1
1 558 . 10 1 1 A 49 49 GLY HA2 H 87 3.851 4.069 -0.218 1
1 559 . 10 1 1 A 49 49 GLY HA3 H 87 3.678 4.074 -0.396 1
1 560 . 10 1 1 A 49 49 GLY C C 87 169.693 173.193 -3.500 1
1 561 . 10 1 1 A 49 49 GLY CA C 87 42.125 44.047 -1.922 1
1 562 . 10 1 1 A 49 49 GLY N N 87 109.071 109.031 0.040 1
1 563 . 10 1 1 A 50 50 ASN H H 88 8.301 8.533 -0.232 1
1 564 . 10 1 1 A 50 50 ASN HA H 88 4.780 5.444 -0.664 1
1 569 . 10 1 1 A 50 50 ASN C C 88 171.370 173.832 -2.462 1
1 570 . 10 1 1 A 50 50 ASN CA C 88 47.749 50.781 -3.032 1
1 571 . 10 1 1 A 50 50 ASN CB C 88 37.125 39.031 -1.906 1
1 572 . 10 1 1 A 50 50 ASN N N 88 115.631 118.708 -3.077 1
1 574 . 10 1 1 A 51 51 PRO HA H 89 4.782 4.607 0.175 1
1 577 . 10 1 1 A 51 51 PRO C C 89 173.656 176.442 -2.786 1
1 578 . 10 1 1 A 51 51 PRO CA C 89 59.624 62.290 -2.666 1
1 579 . 10 1 1 A 51 51 PRO CB C 89 31.501 31.968 -0.467 1
1 582 . 10 1 1 A 52 52 GLN H H 90 9.076 8.855 0.221 1
1 583 . 10 1 1 A 52 52 GLN HA H 90 4.469 4.640 -0.171 1
1 590 . 10 1 1 A 52 52 GLN C C 90 172.386 174.313 -1.927 1
1 591 . 10 1 1 A 52 52 GLN CA C 90 50.874 54.025 -3.151 1
1 592 . 10 1 1 A 52 52 GLN CB C 90 26.501 28.288 -1.787 1
1 594 . 10 1 1 A 52 52 GLN N N 90 126.827 120.458 6.369 1
1 596 . 10 1 1 A 53 53 PRO HA H 91 4.384 4.461 -0.077 1
1 599 . 10 1 1 A 53 53 PRO C C 91 174.274 176.153 -1.879 1
1 600 . 10 1 1 A 53 53 PRO CB C 91 28.113 31.745 -3.632 1
1 601 . 10 1 1 A 54 54 LYS H H 92 8.401 8.582 -0.181 1
1 602 . 10 1 1 A 54 54 LYS HA H 92 3.984 4.743 -0.759 1
1 611 . 10 1 1 A 54 54 LYS C C 92 173.516 175.927 -2.411 1
1 612 . 10 1 1 A 54 54 LYS CA C 92 55.249 54.824 0.425 1
1 613 . 10 1 1 A 54 54 LYS CB C 92 30.876 36.680 -5.804 1
1 615 . 10 1 1 A 54 54 LYS N N 92 124.538 123.765 0.773 1
1 616 . 10 1 1 A 55 55 ASN H H 93 8.183 8.665 -0.482 1
1 617 . 10 1 1 A 55 55 ASN HA H 93 4.716 4.933 -0.217 1
1 622 . 10 1 1 A 55 55 ASN CA C 93 48.999 53.169 -4.170 1
1 623 . 10 1 1 A 55 55 ASN CB C 93 35.875 37.874 -1.999 1
1 624 . 10 1 1 A 55 55 ASN N N 93 118.677 121.125 -2.448 1
1 626 . 10 1 1 A 56 56 TRP H H 94 8.007 8.705 -0.698 1
1 627 . 10 1 1 A 56 56 TRP HA H 94 3.827 5.603 -1.776 1
1 635 . 10 1 1 A 56 56 TRP C C 94 173.760 175.373 -1.613 1
1 636 . 10 1 1 A 56 56 TRP CA C 94 59.624 59.291 0.333 1
1 637 . 10 1 1 A 56 56 TRP CB C 94 27.126 30.341 -3.215 1
1 638 . 10 1 1 A 56 56 TRP N N 94 122.195 127.812 -5.617 1
1 640 . 10 1 1 A 57 57 ASN H H 95 7.563 7.546 0.017 1
1 641 . 10 1 1 A 57 57 ASN HA H 95 3.735 4.908 -1.173 1
1 646 . 10 1 1 A 57 57 ASN C C 95 171.952 173.906 -1.954 1
1 647 . 10 1 1 A 57 57 ASN CA C 95 51.499 50.936 0.563 1
1 648 . 10 1 1 A 57 57 ASN CB C 95 35.250 41.326 -6.076 1
1 649 . 10 1 1 A 57 57 ASN N N 95 129.659 125.286 4.373 1
1 651 . 10 1 1 A 58 58 LYS H H 96 8.110 8.103 0.007 1
1 652 . 10 1 1 A 58 58 LYS HA H 96 4.035 4.393 -0.358 1
1 659 . 10 1 1 A 58 58 LYS C C 96 174.530 175.602 -1.072 1
1 660 . 10 1 1 A 58 58 LYS CA C 96 56.499 54.304 2.195 1
1 661 . 10 1 1 A 58 58 LYS CB C 96 29.626 33.310 -3.684 1
1 665 . 10 1 1 A 58 58 LYS N N 96 123.913 123.359 0.554 1
1 666 . 10 1 1 A 59 59 ASP H H 97 7.903 8.855 -0.952 1
1 667 . 10 1 1 A 59 59 ASP HA H 97 4.393 4.400 -0.007 1
1 670 . 10 1 1 A 59 59 ASP C C 97 173.724 175.438 -1.714 1
1 671 . 10 1 1 A 59 59 ASP CA C 97 52.124 55.103 -2.979 1
1 672 . 10 1 1 A 59 59 ASP CB C 97 38.375 39.932 -1.557 1
1 673 . 10 1 1 A 59 59 ASP N N 97 118.773 119.651 -0.878 1
1 674 . 10 1 1 A 60 60 GLY H H 98 7.819 7.977 -0.158 1
1 675 . 10 1 1 A 60 60 GLY HA2 H 98 3.917 3.730 0.187 1
1 676 . 10 1 1 A 60 60 GLY HA3 H 98 3.917 4.109 -0.192 1
1 677 . 10 1 1 A 60 60 GLY C C 98 168.652 174.424 -5.772 1
1 678 . 10 1 1 A 60 60 GLY CA C 98 41.500 45.037 -3.537 1
1 679 . 10 1 1 A 60 60 GLY N N 98 108.742 105.143 3.599 1
1 680 . 10 1 1 A 61 61 TYR H H 99 8.105 8.176 -0.071 1
1 681 . 10 1 1 A 61 61 TYR HA H 99 3.927 4.254 -0.327 1
1 689 . 10 1 1 A 61 61 TYR C C 99 172.831 174.027 -1.196 1
1 690 . 10 1 1 A 61 61 TYR CA C 99 57.124 58.313 -1.189 1
1 691 . 10 1 1 A 61 61 TYR CB C 99 37.125 36.428 0.697 1
1 692 . 10 1 1 A 61 61 TYR N N 99 113.836 117.172 -3.336 1
1 693 . 10 1 1 A 62 62 LEU H H 100 7.352 8.136 -0.784 1
1 694 . 10 1 1 A 62 62 LEU HA H 100 4.343 4.986 -0.643 1
1 704 . 10 1 1 A 62 62 LEU C C 100 173.430 175.251 -1.821 1
1 705 . 10 1 1 A 62 62 LEU CA C 100 50.874 53.429 -2.555 1
1 706 . 10 1 1 A 62 62 LEU CB C 100 44.000 46.381 -2.381 1
1 710 . 10 1 1 A 62 62 LEU N N 100 117.112 122.861 -5.749 1
1 711 . 10 1 1 A 63 63 LYS H H 101 8.626 8.358 0.268 1
1 712 . 10 1 1 A 63 63 LYS HA H 101 3.986 4.528 -0.542 1
1 721 . 10 1 1 A 63 63 LYS C C 101 173.851 176.859 -3.008 1
1 722 . 10 1 1 A 63 63 LYS CA C 101 55.249 55.228 0.021 1
1 723 . 10 1 1 A 63 63 LYS CB C 101 29.626 33.807 -4.181 1
1 724 . 10 1 1 A 63 63 LYS N N 101 129.991 122.780 7.211 1
1 725 . 10 1 1 A 64 64 LYS H H 102 7.059 8.505 -1.446 1
1 726 . 10 1 1 A 64 64 LYS HA H 102 4.138 4.234 -0.096 1
1 735 . 10 1 1 A 64 64 LYS C C 102 171.120 175.867 -4.747 1
1 736 . 10 1 1 A 64 64 LYS CA C 102 52.749 56.408 -3.659 1
1 737 . 10 1 1 A 64 64 LYS CB C 102 32.750 31.305 1.445 1
1 740 . 10 1 1 A 64 64 LYS N N 102 113.255 120.468 -7.213 1
1 741 . 10 1 1 A 65 65 LEU H H 103 8.883 7.987 0.896 1
1 742 . 10 1 1 A 65 65 LEU HA H 103 4.475 4.754 -0.279 1
1 752 . 10 1 1 A 65 65 LEU C C 103 171.487 174.270 -2.783 1
1 753 . 10 1 1 A 65 65 LEU CA C 103 48.999 51.023 -2.024 1
1 754 . 10 1 1 A 65 65 LEU CB C 103 39.625 45.152 -5.527 1
1 758 . 10 1 1 A 65 65 LEU N N 103 126.355 123.164 3.191 1
1 759 . 10 1 1 A 66 66 PRO HA H 104 4.449 4.572 -0.123 1
1 764 . 10 1 1 A 66 66 PRO C C 104 173.363 176.306 -2.943 1
1 765 . 10 1 1 A 66 66 PRO CA C 104 60.249 62.444 -2.195 1
1 766 . 10 1 1 A 66 66 PRO CB C 104 29.626 32.219 -2.593 1
1 769 . 10 1 1 A 67 67 VAL H H 105 7.682 8.332 -0.650 1
1 770 . 10 1 1 A 67 67 VAL HA H 105 4.121 4.361 -0.240 1
1 778 . 10 1 1 A 67 67 VAL C C 105 171.667 174.902 -3.235 1
1 779 . 10 1 1 A 67 67 VAL CA C 105 58.374 61.706 -3.332 1
1 780 . 10 1 1 A 67 67 VAL CB C 105 30.251 32.813 -2.562 1
1 783 . 10 1 1 A 67 67 VAL N N 105 114.671 121.502 -6.831 1
1 784 . 10 1 1 A 68 68 ASP H H 106 8.216 7.949 0.267 1
1 785 . 10 1 1 A 68 68 ASP HA H 106 4.474 4.717 -0.243 1
1 788 . 10 1 1 A 68 68 ASP C C 106 172.452 174.962 -2.510 1
1 789 . 10 1 1 A 68 68 ASP CA C 106 50.249 52.398 -2.149 1
1 790 . 10 1 1 A 68 68 ASP CB C 106 37.750 39.867 -2.117 1
1 791 . 10 1 1 A 68 68 ASP N N 106 123.825 124.762 -0.937 1
1 792 . 10 1 1 A 69 69 PRO HA H 107 3.920 3.994 -0.074 1
1 797 . 10 1 1 A 69 69 PRO CA C 107 62.123 63.169 -1.046 1
1 798 . 10 1 1 A 69 69 PRO CB C 107 27.751 31.393 -3.642 1
1 801 . 10 1 1 A 70 70 TRP H H 108 8.156 8.381 -0.225 1
1 802 . 10 1 1 A 70 70 TRP HA H 108 4.274 4.284 -0.010 1
1 811 . 10 1 1 A 70 70 TRP CA C 108 57.124 58.471 -1.347 1
1 812 . 10 1 1 A 70 70 TRP CB C 108 25.251 27.187 -1.936 1
1 813 . 10 1 1 A 70 70 TRP N N 108 118.137 117.422 0.715 1
1 815 . 10 1 1 A 71 71 GLY H H 109 8.209 8.710 -0.501 1
1 816 . 10 1 1 A 71 71 GLY HA2 H 109 4.030 3.866 0.164 1
1 817 . 10 1 1 A 71 71 GLY HA3 H 109 3.303 3.903 -0.600 1
1 818 . 10 1 1 A 71 71 GLY CA C 109 42.750 46.676 -3.926 1
1 819 . 10 1 1 A 71 71 GLY N N 109 107.495 105.343 2.152 1
1 820 . 10 1 1 A 72 72 ASN H H 110 8.116 7.832 0.284 1
1 821 . 10 1 1 A 72 72 ASN HA H 110 5.103 5.043 0.060 1
1 826 . 10 1 1 A 72 72 ASN CA C 110 48.374 50.546 -2.172 1
1 827 . 10 1 1 A 72 72 ASN CB C 110 36.500 38.696 -2.196 1
1 828 . 10 1 1 A 72 72 ASN N N 110 120.108 119.154 0.954 1
1 830 . 10 1 1 A 73 73 PRO HA H 111 4.397 4.514 -0.117 1
1 835 . 10 1 1 A 73 73 PRO C C 111 176.229 176.075 0.154 1
1 836 . 10 1 1 A 73 73 PRO CA C 111 60.249 62.268 -2.019 1
1 837 . 10 1 1 A 73 73 PRO CB C 111 29.001 32.207 -3.206 1
1 840 . 10 1 1 A 74 74 TYR H H 112 8.893 8.453 0.440 1
1 841 . 10 1 1 A 74 74 TYR HA H 112 4.064 4.772 -0.708 1
1 849 . 10 1 1 A 74 74 TYR C C 112 171.951 176.186 -4.235 1
1 850 . 10 1 1 A 74 74 TYR CA C 112 60.249 58.353 1.896 1
1 851 . 10 1 1 A 74 74 TYR CB C 112 36.500 39.331 -2.831 1
1 852 . 10 1 1 A 74 74 TYR N N 112 124.595 121.062 3.533 1
1 853 . 10 1 1 A 75 75 GLN H H 113 9.127 8.801 0.326 1
1 854 . 10 1 1 A 75 75 GLN HA H 113 4.019 4.293 -0.274 1
1 861 . 10 1 1 A 75 75 GLN C C 113 171.436 174.648 -3.212 1
1 862 . 10 1 1 A 75 75 GLN CA C 113 50.874 54.569 -3.695 1
1 863 . 10 1 1 A 75 75 GLN CB C 113 29.469 29.623 -0.154 1
1 865 . 10 1 1 A 75 75 GLN N N 113 120.777 121.911 -1.134 1
1 867 . 10 1 1 A 76 76 TYR H H 114 7.906 8.171 -0.265 1
1 868 . 10 1 1 A 76 76 TYR HA H 114 5.586 5.619 -0.033 1
1 875 . 10 1 1 A 76 76 TYR C C 114 171.343 175.138 -3.795 1
1 876 . 10 1 1 A 76 76 TYR CA C 114 53.999 55.788 -1.789 1
1 877 . 10 1 1 A 76 76 TYR CB C 114 40.250 40.602 -0.352 1
1 878 . 10 1 1 A 76 76 TYR N N 114 120.757 122.012 -1.255 1
1 879 . 10 1 1 A 77 77 LEU H H 115 8.261 9.113 -0.852 1
1 880 . 10 1 1 A 77 77 LEU HA H 115 4.280 5.198 -0.918 1
1 890 . 10 1 1 A 77 77 LEU C C 115 170.921 175.812 -4.891 1
1 891 . 10 1 1 A 77 77 LEU CA C 115 51.499 53.532 -2.033 1
1 892 . 10 1 1 A 77 77 LEU CB C 115 44.625 45.623 -0.998 1
1 896 . 10 1 1 A 77 77 LEU N N 115 130.662 125.843 4.819 1
1 897 . 10 1 1 A 78 78 ALA H H 116 7.973 8.443 -0.470 1
1 898 . 10 1 1 A 78 78 ALA HA H 116 4.292 4.668 -0.376 1
1 902 . 10 1 1 A 78 78 ALA C C 116 172.093 174.766 -2.673 1
1 903 . 10 1 1 A 78 78 ALA CA C 116 47.749 49.890 -2.141 1
1 904 . 10 1 1 A 78 78 ALA CB C 116 19.626 20.850 -1.224 1
1 905 . 10 1 1 A 78 78 ALA N N 116 125.564 125.008 0.556 1
1 906 . 10 1 1 A 79 79 PRO HA H 117 4.698 5.208 -0.510 1
1 911 . 10 1 1 A 79 79 PRO C C 117 173.994 176.921 -2.927 1
1 912 . 10 1 1 A 79 79 PRO CA C 117 60.249 63.373 -3.124 1
1 913 . 10 1 1 A 79 79 PRO CB C 117 31.501 31.820 -0.319 1
1 916 . 10 1 1 A 80 80 GLY H H 118 7.096 8.491 -1.395 1
1 917 . 10 1 1 A 80 80 GLY HA2 H 118 3.797 3.961 -0.164 1
1 918 . 10 1 1 A 80 80 GLY HA3 H 118 3.517 3.977 -0.460 1
1 919 . 10 1 1 A 80 80 GLY C C 118 171.404 174.349 -2.945 1
1 920 . 10 1 1 A 80 80 GLY CA C 118 41.500 46.441 -4.941 1
1 921 . 10 1 1 A 80 80 GLY N N 118 108.306 108.659 -0.353 1
1 922 . 10 1 1 A 81 81 THR H H 119 9.810 8.332 1.478 1
1 923 . 10 1 1 A 81 81 THR HA H 119 4.091 4.606 -0.515 1
1 928 . 10 1 1 A 81 81 THR C C 119 174.242 174.787 -0.545 1
1 929 . 10 1 1 A 81 81 THR CA C 119 60.874 60.640 0.234 1
1 930 . 10 1 1 A 81 81 THR CB C 119 66.498 69.218 -2.720 1
1 932 . 10 1 1 A 81 81 THR N N 119 112.813 114.123 -1.310 1
1 933 . 10 1 1 A 82 82 LYS H H 120 8.964 8.756 0.208 1
1 934 . 10 1 1 A 82 82 LYS HA H 120 4.150 3.937 0.213 1
1 941 . 10 1 1 A 82 82 LYS C C 120 172.886 175.987 -3.101 1
1 942 . 10 1 1 A 82 82 LYS CA C 120 53.999 57.779 -3.780 1
1 943 . 10 1 1 A 82 82 LYS CB C 120 30.876 30.654 0.222 1
1 944 . 10 1 1 A 82 82 LYS N N 120 123.569 124.707 -1.138 1
1 945 . 10 1 1 A 83 83 GLY H H 121 7.125 8.081 -0.956 1
1 946 . 10 1 1 A 83 83 GLY HA2 H 121 3.814 4.109 -0.295 1
1 947 . 10 1 1 A 83 83 GLY HA3 H 121 3.814 4.178 -0.364 1
1 948 . 10 1 1 A 83 83 GLY C C 121 167.671 174.394 -6.723 1
1 949 . 10 1 1 A 83 83 GLY CA C 121 42.125 45.040 -2.915 1
1 950 . 10 1 1 A 83 83 GLY N N 121 107.253 107.539 -0.286 1
1 951 . 10 1 1 A 84 84 PRO HA H 122 4.077 4.360 -0.283 1
1 958 . 10 1 1 A 84 84 PRO C C 122 175.199 176.561 -1.362 1
1 959 . 10 1 1 A 84 84 PRO CA C 122 63.373 64.560 -1.187 1
1 960 . 10 1 1 A 84 84 PRO CB C 122 30.251 31.676 -1.425 1
1 962 . 10 1 1 A 85 85 PHE H H 123 6.652 6.518 0.134 1
1 963 . 10 1 1 A 85 85 PHE HA H 123 4.744 4.612 0.132 1
1 971 . 10 1 1 A 85 85 PHE C C 123 170.340 171.818 -1.478 1
1 972 . 10 1 1 A 85 85 PHE CA C 123 53.999 56.298 -2.299 1
1 973 . 10 1 1 A 85 85 PHE CB C 123 39.000 40.188 -1.188 1
1 974 . 10 1 1 A 85 85 PHE N N 123 108.468 111.458 -2.990 1
1 975 . 10 1 1 A 86 86 ASP H H 124 9.268 8.625 0.643 1
1 976 . 10 1 1 A 86 86 ASP HA H 124 5.108 4.261 0.847 1
1 979 . 10 1 1 A 86 86 ASP C C 124 171.180 174.576 -3.396 1
1 980 . 10 1 1 A 86 86 ASP CA C 124 50.249 53.134 -2.885 1
1 981 . 10 1 1 A 86 86 ASP CB C 124 40.250 41.855 -1.605 1
1 982 . 10 1 1 A 86 86 ASP N N 124 121.741 119.373 2.368 1
1 983 . 10 1 1 A 87 87 LEU H H 125 8.018 8.511 -0.493 1
1 984 . 10 1 1 A 87 87 LEU HA H 125 5.809 5.336 0.473 1
1 994 . 10 1 1 A 87 87 LEU C C 125 171.350 174.796 -3.446 1
1 995 . 10 1 1 A 87 87 LEU CA C 125 50.874 53.586 -2.712 1
1 996 . 10 1 1 A 87 87 LEU CB C 125 44.318 45.649 -1.331 1
1 999 . 10 1 1 A 87 87 LEU N N 125 123.629 127.408 -3.779 1
1 1000 . 10 1 1 A 88 88 TYR H H 126 8.912 8.395 0.517 1
1 1001 . 10 1 1 A 88 88 TYR HA H 126 5.630 5.580 0.050 1
1 1008 . 10 1 1 A 88 88 TYR C C 126 171.410 173.181 -1.771 1
1 1009 . 10 1 1 A 88 88 TYR CA C 126 52.749 56.536 -3.787 1
1 1010 . 10 1 1 A 88 88 TYR CB C 126 37.750 40.434 -2.684 1
1 1011 . 10 1 1 A 88 88 TYR N N 126 119.697 121.784 -2.087 1
1 1012 . 10 1 1 A 89 89 SER H H 127 9.319 9.241 0.078 1
1 1013 . 10 1 1 A 89 89 SER HA H 127 5.429 5.105 0.324 1
1 1016 . 10 1 1 A 89 89 SER CA C 127 52.124 56.097 -3.973 1
1 1017 . 10 1 1 A 89 89 SER CB C 127 62.748 65.775 -3.027 1
1 1018 . 10 1 1 A 89 89 SER N N 127 112.637 114.567 -1.930 1
1 1019 . 10 1 1 A 90 90 LEU H H 128 8.759 8.532 0.227 1
1 1020 . 10 1 1 A 90 90 LEU HA H 128 4.186 4.387 -0.201 1
1 1030 . 10 1 1 A 90 90 LEU C C 128 175.121 177.907 -2.786 1
1 1031 . 10 1 1 A 90 90 LEU CA C 128 52.749 55.126 -2.377 1
1 1032 . 10 1 1 A 90 90 LEU CB C 128 35.875 41.874 -5.999 1
1 1033 . 10 1 1 A 90 90 LEU N N 128 126.728 124.529 2.199 1
1 1034 . 10 1 1 A 91 91 GLY H H 129 8.356 8.096 0.260 1
1 1035 . 10 1 1 A 91 91 GLY HA2 H 129 3.373 3.421 -0.048 1
1 1036 . 10 1 1 A 91 91 GLY HA3 H 129 3.373 3.793 -0.420 1
1 1037 . 10 1 1 A 91 91 GLY C C 129 172.013 174.329 -2.316 1
1 1038 . 10 1 1 A 91 91 GLY CA C 129 41.500 44.035 -2.535 1
1 1039 . 10 1 1 A 91 91 GLY N N 129 108.559 109.847 -1.288 1
1 1040 . 10 1 1 A 92 92 ALA H H 130 7.047 7.996 -0.949 1
1 1041 . 10 1 1 A 92 92 ALA HA H 130 4.037 3.354 0.683 1
1 1045 . 10 1 1 A 92 92 ALA C C 130 174.890 177.724 -2.834 1
1 1046 . 10 1 1 A 92 92 ALA CA C 130 52.100 53.913 -1.813 1
1 1047 . 10 1 1 A 92 92 ALA CB C 130 16.502 17.843 -1.341 1
1 1048 . 10 1 1 A 92 92 ALA N N 130 118.393 121.997 -3.604 1
1 1049 . 10 1 1 A 93 93 ASP H H 131 7.222 7.599 -0.377 1
1 1050 . 10 1 1 A 93 93 ASP HA H 131 4.122 4.706 -0.584 1
1 1053 . 10 1 1 A 93 93 ASP C C 131 174.890 176.325 -1.435 1
1 1054 . 10 1 1 A 93 93 ASP CA C 131 50.249 53.755 -3.506 1
1 1055 . 10 1 1 A 93 93 ASP CB C 131 37.750 41.232 -3.482 1
1 1056 . 10 1 1 A 93 93 ASP N N 131 111.487 116.650 -5.163 1
1 1057 . 10 1 1 A 94 94 GLY H H 132 7.199 8.635 -1.436 1
1 1058 . 10 1 1 A 94 94 GLY HA2 H 132 3.951 3.842 0.109 1
1 1059 . 10 1 1 A 94 94 GLY HA3 H 132 3.324 3.856 -0.532 1
1 1060 . 10 1 1 A 94 94 GLY C C 132 169.773 173.897 -4.124 1
1 1061 . 10 1 1 A 94 94 GLY CA C 132 44.625 46.004 -1.379 1
1 1062 . 10 1 1 A 94 94 GLY N N 132 106.932 108.549 -1.617 1
1 1063 . 10 1 1 A 95 95 LYS H H 133 7.215 7.820 -0.605 1
1 1064 . 10 1 1 A 95 95 LYS HA H 133 4.513 4.708 -0.195 1
1 1073 . 10 1 1 A 95 95 LYS C C 133 172.108 174.799 -2.691 1
1 1074 . 10 1 1 A 95 95 LYS CA C 133 51.512 54.248 -2.736 1
1 1075 . 10 1 1 A 95 95 LYS CB C 133 34.000 34.684 -0.684 1
1 1076 . 10 1 1 A 95 95 LYS N N 133 115.749 119.308 -3.559 1
1 1077 . 10 1 1 A 96 96 GLU H H 134 9.230 8.682 0.548 1
1 1078 . 10 1 1 A 96 96 GLU HA H 134 4.352 4.811 -0.459 1
1 1083 . 10 1 1 A 96 96 GLU C C 134 175.219 175.545 -0.326 1
1 1084 . 10 1 1 A 96 96 GLU CA C 134 55.874 55.347 0.527 1
1 1085 . 10 1 1 A 96 96 GLU CB C 134 27.126 30.615 -3.489 1
1 1087 . 10 1 1 A 96 96 GLU N N 134 128.571 123.970 4.601 1
1 1088 . 10 1 1 A 97 97 GLY H H 135 10.677 8.236 2.441 1
1 1089 . 10 1 1 A 97 97 GLY HA2 H 135 4.037 4.305 -0.268 1
1 1090 . 10 1 1 A 97 97 GLY HA3 H 135 3.717 4.310 -0.593 1
1 1091 . 10 1 1 A 97 97 GLY C C 135 171.567 172.378 -0.811 1
1 1092 . 10 1 1 A 97 97 GLY CA C 135 41.500 45.864 -4.364 1
1 1093 . 10 1 1 A 97 97 GLY N N 135 117.011 113.152 3.859 1
1 1094 . 10 1 1 A 98 98 GLY H H 136 8.442 8.617 -0.175 1
1 1095 . 10 1 1 A 98 98 GLY HA2 H 136 4.195 4.225 -0.030 1
1 1096 . 10 1 1 A 98 98 GLY HA3 H 136 4.195 4.231 -0.036 1
1 1097 . 10 1 1 A 98 98 GLY C C 136 170.299 173.143 -2.844 1
1 1098 . 10 1 1 A 98 98 GLY CA C 136 40.875 44.710 -3.835 1
1 1099 . 10 1 1 A 98 98 GLY N N 136 109.494 109.230 0.264 1
1 1100 . 10 1 1 A 99 99 SER H H 137 8.701 8.807 -0.106 1
1 1101 . 10 1 1 A 99 99 SER HA H 137 4.639 4.925 -0.286 1
1 1104 . 10 1 1 A 99 99 SER C C 137 170.630 173.454 -2.824 1
1 1105 . 10 1 1 A 99 99 SER CA C 137 54.624 57.353 -2.729 1
1 1106 . 10 1 1 A 99 99 SER CB C 137 62.748 66.614 -3.866 1
1 1107 . 10 1 1 A 99 99 SER N N 137 114.685 118.428 -3.743 1
1 1108 . 10 1 1 A 100 100 ASP H H 138 9.117 8.898 0.219 1
1 1109 . 10 1 1 A 100 100 ASP HA H 138 3.965 4.446 -0.481 1
1 1112 . 10 1 1 A 100 100 ASP C C 138 175.540 177.325 -1.785 1
1 1113 . 10 1 1 A 100 100 ASP CA C 138 54.624 57.149 -2.525 1
1 1114 . 10 1 1 A 100 100 ASP CB C 138 36.500 41.158 -4.658 1
1 1115 . 10 1 1 A 100 100 ASP N N 138 120.777 122.704 -1.927 1
1 1116 . 10 1 1 A 101 101 ASN H H 139 8.667 7.998 0.669 1
1 1117 . 10 1 1 A 101 101 ASN HA H 139 4.333 5.089 -0.756 1
1 1122 . 10 1 1 A 101 101 ASN CA C 139 53.999 53.370 0.629 1
1 1123 . 10 1 1 A 101 101 ASN CB C 139 34.625 40.279 -5.654 1
1 1124 . 10 1 1 A 101 101 ASN N N 139 121.930 115.660 6.270 1
1 1126 . 10 1 1 A 102 102 ASP H H 140 7.714 7.925 -0.211 1
1 1127 . 10 1 1 A 102 102 ASP HA H 140 4.037 4.442 -0.405 1
1 1130 . 10 1 1 A 102 102 ASP C C 140 172.807 176.189 -3.382 1
1 1131 . 10 1 1 A 102 102 ASP CA C 140 53.374 54.805 -1.431 1
1 1132 . 10 1 1 A 102 102 ASP CB C 140 37.125 41.380 -4.255 1
1 1133 . 10 1 1 A 102 102 ASP N N 140 118.011 117.592 0.419 1
1 1134 . 10 1 1 A 103 103 ALA H H 141 7.060 7.425 -0.365 1
1 1135 . 10 1 1 A 103 103 ALA HA H 141 3.353 4.280 -0.927 1
1 1139 . 10 1 1 A 103 103 ALA C C 141 172.233 176.798 -4.565 1
1 1140 . 10 1 1 A 103 103 ALA CA C 141 49.624 51.680 -2.056 1
1 1141 . 10 1 1 A 103 103 ALA CB C 141 16.502 20.445 -3.943 1
1 1142 . 10 1 1 A 103 103 ALA N N 141 125.777 121.853 3.924 1
1 1143 . 10 1 1 A 104 104 ASP H H 142 7.973 8.551 -0.578 1
1 1144 . 10 1 1 A 104 104 ASP HA H 142 4.420 5.138 -0.718 1
1 1147 . 10 1 1 A 104 104 ASP C C 142 174.188 176.109 -1.921 1
1 1148 . 10 1 1 A 104 104 ASP CA C 142 52.124 53.904 -1.780 1
1 1149 . 10 1 1 A 104 104 ASP CB C 142 37.125 41.347 -4.222 1
1 1150 . 10 1 1 A 104 104 ASP N N 142 122.965 120.063 2.902 1
1 1151 . 10 1 1 A 105 105 ILE H H 143 8.534 8.485 0.049 1
1 1152 . 10 1 1 A 105 105 ILE HA H 143 4.060 4.997 -0.937 1
1 1162 . 10 1 1 A 105 105 ILE C C 143 173.235 175.463 -2.228 1
1 1163 . 10 1 1 A 105 105 ILE CA C 143 58.374 60.005 -1.631 1
1 1164 . 10 1 1 A 105 105 ILE CB C 143 39.123 39.671 -0.548 1
1 1167 . 10 1 1 A 105 105 ILE N N 143 124.757 120.408 4.349 1
1 1168 . 10 1 1 A 106 106 GLY H H 144 8.288 8.713 -0.425 1
1 1169 . 10 1 1 A 106 106 GLY HA2 H 144 4.764 4.670 0.094 1
1 1170 . 10 1 1 A 106 106 GLY HA3 H 144 4.764 4.675 0.089 1
1 1171 . 10 1 1 A 106 106 GLY C C 144 171.321 171.888 -0.567 1
1 1172 . 10 1 1 A 106 106 GLY CA C 144 40.250 44.943 -4.693 1
1 1173 . 10 1 1 A 106 106 GLY N N 144 110.895 111.967 -1.072 1
1 1174 . 10 1 1 A 107 107 ASN H H 145 8.577 9.519 -0.942 1
1 1175 . 10 1 1 A 107 107 ASN HA H 145 4.268 5.655 -1.387 1
1 1180 . 10 1 1 A 107 107 ASN C C 145 171.757 173.905 -2.148 1
1 1181 . 10 1 1 A 107 107 ASN CA C 145 52.124 52.444 -0.320 1
1 1182 . 10 1 1 A 107 107 ASN CB C 145 34.625 42.359 -7.734 1
1 1183 . 10 1 1 A 107 107 ASN N N 145 118.042 120.254 -2.212 1
1 1185 . 10 1 1 A 108 108 TRP H H 146 6.822 8.943 -2.121 1
1 1186 . 10 1 1 A 108 108 TRP HA H 146 4.513 5.234 -0.721 1
1 1195 . 10 1 1 A 108 108 TRP C C 146 172.665 173.415 -0.750 1
1 1196 . 10 1 1 A 108 108 TRP CA C 146 54.624 56.321 -1.697 1
1 1197 . 10 1 1 A 108 108 TRP CB C 146 25.876 33.401 -7.525 1
1 1198 . 10 1 1 A 108 108 TRP N N 146 116.756 127.199 -10.443 1
1 1200 . 10 1 1 A 109 109 ASP H H 147 7.344 7.736 -0.392 1
1 1201 . 10 1 1 A 109 109 ASP HA H 147 4.655 5.221 -0.566 1
1 1204 . 10 1 1 A 109 109 ASP C C 147 172.193 174.143 -1.950 1
1 1205 . 10 1 1 A 109 109 ASP CA C 147 51.499 52.534 -1.035 1
1 1206 . 10 1 1 A 109 109 ASP CB C 147 39.000 42.795 -3.795 1
1 1207 . 10 1 1 A 109 109 ASP N N 147 121.461 127.920 -6.459 1
1 11 . 11 1 1 A 2 2 SER H H 40 8.461 8.907 -0.446 1
1 12 . 11 1 1 A 2 2 SER HA H 40 4.286 4.613 -0.327 1
1 15 . 11 1 1 A 2 2 SER C C 40 171.276 173.115 -1.839 1
1 16 . 11 1 1 A 2 2 SER CA C 40 55.249 57.831 -2.582 1
1 17 . 11 1 1 A 2 2 SER CB C 40 61.498 61.198 0.300 1
1 18 . 11 1 1 A 2 2 SER N N 40 118.344 123.193 -4.849 1
1 19 . 11 1 1 A 3 3 ARG H H 41 8.469 7.488 0.981 1
1 20 . 11 1 1 A 3 3 ARG HA H 41 4.400 4.837 -0.437 1
1 25 . 11 1 1 A 3 3 ARG C C 41 172.251 173.681 -1.430 1
1 26 . 11 1 1 A 3 3 ARG CA C 41 52.749 52.822 -0.073 1
1 27 . 11 1 1 A 3 3 ARG CB C 41 27.126 32.861 -5.735 1
1 28 . 11 1 1 A 3 3 ARG N N 41 123.070 120.879 2.191 1
1 33 . 11 1 1 A 4 4 PRO CA C 42 61.498 63.806 -2.308 1
1 34 . 11 1 1 A 4 4 PRO CB C 42 29.001 31.971 -2.970 1
1 37 . 11 1 1 A 5 5 ASP H H 43 8.246 8.934 -0.688 1
1 38 . 11 1 1 A 5 5 ASP HA H 43 4.329 4.384 -0.055 1
1 41 . 11 1 1 A 5 5 ASP C C 43 174.605 177.202 -2.597 1
1 42 . 11 1 1 A 5 5 ASP CA C 43 53.374 56.822 -3.448 1
1 43 . 11 1 1 A 5 5 ASP CB C 43 38.375 38.745 -0.370 1
1 44 . 11 1 1 A 5 5 ASP N N 43 119.409 116.859 2.550 1
1 45 . 11 1 1 A 6 6 GLN H H 44 8.309 8.462 -0.153 1
1 46 . 11 1 1 A 6 6 GLN HA H 44 4.393 4.242 0.151 1
1 53 . 11 1 1 A 6 6 GLN C C 44 175.053 178.175 -3.122 1
1 54 . 11 1 1 A 6 6 GLN CA C 44 55.874 57.981 -2.107 1
1 55 . 11 1 1 A 6 6 GLN CB C 44 25.876 28.088 -2.212 1
1 57 . 11 1 1 A 6 6 GLN N N 44 122.273 118.001 4.272 1
1 59 . 11 1 1 A 7 7 ALA H H 45 8.106 8.084 0.022 1
1 60 . 11 1 1 A 7 7 ALA HA H 45 3.993 4.024 -0.031 1
1 64 . 11 1 1 A 7 7 ALA C C 45 177.465 178.198 -0.733 1
1 65 . 11 1 1 A 7 7 ALA CA C 45 52.124 54.640 -2.516 1
1 66 . 11 1 1 A 7 7 ALA CB C 45 15.252 18.268 -3.016 1
1 67 . 11 1 1 A 7 7 ALA N N 45 122.204 121.819 0.385 1
1 68 . 11 1 1 A 8 8 LYS H H 46 7.527 7.844 -0.317 1
1 69 . 11 1 1 A 8 8 LYS HA H 46 3.539 4.105 -0.566 1
1 78 . 11 1 1 A 8 8 LYS C C 46 175.412 179.071 -3.659 1
1 79 . 11 1 1 A 8 8 LYS CA C 46 57.124 58.392 -1.268 1
1 80 . 11 1 1 A 8 8 LYS CB C 46 30.876 32.088 -1.212 1
1 83 . 11 1 1 A 8 8 LYS N N 46 117.358 116.720 0.638 1
1 84 . 11 1 1 A 9 9 VAL H H 47 7.709 7.621 0.088 1
1 85 . 11 1 1 A 9 9 VAL HA H 47 3.578 3.769 -0.191 1
1 93 . 11 1 1 A 9 9 VAL C C 47 175.005 178.373 -3.368 1
1 94 . 11 1 1 A 9 9 VAL CA C 47 64.623 66.129 -1.506 1
1 95 . 11 1 1 A 9 9 VAL CB C 47 29.001 31.821 -2.820 1
1 98 . 11 1 1 A 9 9 VAL N N 47 119.115 120.385 -1.270 1
1 99 . 11 1 1 A 10 10 THR H H 48 7.767 8.126 -0.359 1
1 100 . 11 1 1 A 10 10 THR HA H 48 3.668 3.998 -0.330 1
1 105 . 11 1 1 A 10 10 THR CA C 48 63.998 66.230 -2.232 1
1 106 . 11 1 1 A 10 10 THR CB C 48 67.123 68.594 -1.471 1
1 108 . 11 1 1 A 10 10 THR N N 48 115.112 113.967 1.145 1
1 109 . 11 1 1 A 11 11 VAL H H 49 7.598 7.530 0.068 1
1 110 . 11 1 1 A 11 11 VAL HA H 49 3.457 3.840 -0.383 1
1 118 . 11 1 1 A 11 11 VAL C C 49 175.412 177.527 -2.115 1
1 119 . 11 1 1 A 11 11 VAL CA C 49 63.998 64.864 -0.866 1
1 120 . 11 1 1 A 11 11 VAL CB C 49 29.001 31.400 -2.399 1
1 123 . 11 1 1 A 11 11 VAL N N 49 123.694 120.371 3.323 1
1 124 . 11 1 1 A 12 12 ALA H H 50 8.176 7.852 0.324 1
1 125 . 11 1 1 A 12 12 ALA HA H 50 4.742 4.028 0.714 1
1 129 . 11 1 1 A 12 12 ALA C C 50 177.074 179.656 -2.582 1
1 130 . 11 1 1 A 12 12 ALA CA C 50 52.124 55.440 -3.316 1
1 131 . 11 1 1 A 12 12 ALA CB C 50 15.252 18.029 -2.777 1
1 132 . 11 1 1 A 12 12 ALA N N 50 122.348 123.791 -1.443 1
1 133 . 11 1 1 A 13 13 LYS H H 51 8.499 8.265 0.234 1
1 134 . 11 1 1 A 13 13 LYS HA H 51 3.648 4.102 -0.454 1
1 143 . 11 1 1 A 13 13 LYS C C 51 177.252 180.045 -2.793 1
1 144 . 11 1 1 A 13 13 LYS CA C 51 58.072 59.535 -1.463 1
1 145 . 11 1 1 A 13 13 LYS CB C 51 30.251 32.349 -2.098 1
1 146 . 11 1 1 A 13 13 LYS N N 51 115.402 116.211 -0.809 1
1 147 . 11 1 1 A 14 14 GLY H H 52 7.858 8.144 -0.286 1
1 148 . 11 1 1 A 14 14 GLY HA2 H 52 3.823 3.768 0.055 1
1 149 . 11 1 1 A 14 14 GLY HA3 H 52 3.676 3.774 -0.098 1
1 150 . 11 1 1 A 14 14 GLY C C 52 174.090 174.750 -0.660 1
1 151 . 11 1 1 A 14 14 GLY CA C 52 44.625 46.937 -2.312 1
1 152 . 11 1 1 A 14 14 GLY N N 52 107.466 108.686 -1.220 1
1 153 . 11 1 1 A 15 15 ASP H H 53 8.403 7.844 0.559 1
1 154 . 11 1 1 A 15 15 ASP HA H 53 4.191 4.579 -0.388 1
1 157 . 11 1 1 A 15 15 ASP C C 53 175.316 178.577 -3.261 1
1 158 . 11 1 1 A 15 15 ASP CA C 53 54.624 55.542 -0.918 1
1 159 . 11 1 1 A 15 15 ASP CB C 53 35.875 41.047 -5.172 1
1 160 . 11 1 1 A 15 15 ASP N N 53 125.929 120.304 5.625 1
1 161 . 11 1 1 A 16 16 ILE H H 54 8.245 8.185 0.060 1
1 162 . 11 1 1 A 16 16 ILE HA H 54 3.034 3.749 -0.715 1
1 172 . 11 1 1 A 16 16 ILE C C 54 174.499 177.951 -3.452 1
1 173 . 11 1 1 A 16 16 ILE CA C 54 62.748 64.108 -1.360 1
1 174 . 11 1 1 A 16 16 ILE CB C 54 34.625 37.206 -2.581 1
1 178 . 11 1 1 A 16 16 ILE N N 54 119.456 115.868 3.588 1
1 179 . 11 1 1 A 17 17 LYS H H 55 7.547 8.211 -0.664 1
1 180 . 11 1 1 A 17 17 LYS HA H 55 3.843 4.160 -0.317 1
1 187 . 11 1 1 A 17 17 LYS C C 55 176.651 179.417 -2.766 1
1 188 . 11 1 1 A 17 17 LYS CA C 55 57.124 59.258 -2.134 1
1 189 . 11 1 1 A 17 17 LYS CB C 55 30.251 31.779 -1.528 1
1 190 . 11 1 1 A 17 17 LYS N N 55 118.505 121.208 -2.703 1
1 191 . 11 1 1 A 18 18 ALA H H 56 7.680 7.949 -0.269 1
1 192 . 11 1 1 A 18 18 ALA HA H 56 4.029 4.058 -0.029 1
1 196 . 11 1 1 A 18 18 ALA C C 56 176.638 179.981 -3.343 1
1 197 . 11 1 1 A 18 18 ALA CA C 56 52.749 55.067 -2.318 1
1 198 . 11 1 1 A 18 18 ALA CB C 56 15.877 17.953 -2.076 1
1 199 . 11 1 1 A 18 18 ALA N N 56 122.477 121.886 0.591 1
1 200 . 11 1 1 A 19 19 ILE H H 57 8.853 7.516 1.337 1
1 201 . 11 1 1 A 19 19 ILE HA H 57 3.304 3.528 -0.224 1
1 211 . 11 1 1 A 19 19 ILE C C 57 174.710 177.775 -3.065 1
1 212 . 11 1 1 A 19 19 ILE CA C 57 63.373 65.418 -2.045 1
1 213 . 11 1 1 A 19 19 ILE CB C 57 35.250 37.856 -2.606 1
1 217 . 11 1 1 A 19 19 ILE N N 57 120.901 118.419 2.482 1
1 218 . 11 1 1 A 20 20 ALA H H 58 8.702 7.864 0.838 1
1 219 . 11 1 1 A 20 20 ALA HA H 58 3.900 3.975 -0.075 1
1 223 . 11 1 1 A 20 20 ALA C C 58 176.512 179.547 -3.035 1
1 224 . 11 1 1 A 20 20 ALA CA C 58 52.749 54.912 -2.163 1
1 225 . 11 1 1 A 20 20 ALA CB C 58 15.252 18.233 -2.981 1
1 226 . 11 1 1 A 20 20 ALA N N 58 121.763 122.250 -0.487 1
1 227 . 11 1 1 A 21 21 ALA H H 59 7.662 7.546 0.116 1
1 228 . 11 1 1 A 21 21 ALA HA H 59 4.136 4.306 -0.170 1
1 232 . 11 1 1 A 21 21 ALA C C 59 177.949 179.729 -1.780 1
1 233 . 11 1 1 A 21 21 ALA CA C 59 52.749 54.837 -2.088 1
1 234 . 11 1 1 A 21 21 ALA CB C 59 15.252 18.667 -3.415 1
1 235 . 11 1 1 A 21 21 ALA N N 59 119.079 119.304 -0.225 1
1 236 . 11 1 1 A 22 22 ALA H H 60 7.403 7.674 -0.271 1
1 237 . 11 1 1 A 22 22 ALA HA H 60 4.318 4.190 0.128 1
1 241 . 11 1 1 A 22 22 ALA C C 60 176.730 180.054 -3.324 1
1 242 . 11 1 1 A 22 22 ALA CA C 60 52.749 54.596 -1.847 1
1 243 . 11 1 1 A 22 22 ALA CB C 60 17.126 18.611 -1.485 1
1 244 . 11 1 1 A 22 22 ALA N N 60 122.616 120.516 2.100 1
1 245 . 11 1 1 A 23 23 LEU H H 61 8.410 8.583 -0.173 1
1 246 . 11 1 1 A 23 23 LEU HA H 61 3.527 3.945 -0.418 1
1 256 . 11 1 1 A 23 23 LEU C C 61 176.057 178.288 -2.231 1
1 257 . 11 1 1 A 23 23 LEU CA C 61 55.249 57.120 -1.871 1
1 258 . 11 1 1 A 23 23 LEU CB C 61 39.000 40.827 -1.827 1
1 262 . 11 1 1 A 23 23 LEU N N 61 120.761 121.004 -0.243 1
1 263 . 11 1 1 A 24 24 ASP H H 62 8.227 8.184 0.043 1
1 264 . 11 1 1 A 24 24 ASP HA H 62 4.581 4.495 0.086 1
1 267 . 11 1 1 A 24 24 ASP C C 62 176.968 178.233 -1.265 1
1 268 . 11 1 1 A 24 24 ASP CA C 62 55.874 56.859 -0.985 1
1 269 . 11 1 1 A 24 24 ASP CB C 62 37.750 41.261 -3.511 1
1 270 . 11 1 1 A 24 24 ASP N N 62 119.068 119.017 0.051 1
1 271 . 11 1 1 A 25 25 MET H H 63 7.718 7.894 -0.176 1
1 272 . 11 1 1 A 25 25 MET HA H 63 4.196 4.198 -0.002 1
1 277 . 11 1 1 A 25 25 MET C C 63 174.968 177.713 -2.745 1
1 278 . 11 1 1 A 25 25 MET CA C 63 55.249 58.281 -3.032 1
1 279 . 11 1 1 A 25 25 MET CB C 63 29.626 32.240 -2.614 1
1 281 . 11 1 1 A 25 25 MET N N 63 121.365 119.402 1.963 1
1 282 . 11 1 1 A 26 26 TYR H H 64 8.401 7.680 0.721 1
1 283 . 11 1 1 A 26 26 TYR HA H 64 4.400 3.503 0.897 1
1 291 . 11 1 1 A 26 26 TYR C C 64 176.098 177.284 -1.186 1
1 292 . 11 1 1 A 26 26 TYR CA C 64 58.999 61.092 -2.093 1
1 293 . 11 1 1 A 26 26 TYR CB C 64 35.250 37.945 -2.695 1
1 294 . 11 1 1 A 26 26 TYR N N 64 122.575 120.595 1.980 1
1 295 . 11 1 1 A 27 27 LYS H H 65 8.330 8.453 -0.123 1
1 296 . 11 1 1 A 27 27 LYS HA H 65 3.568 4.279 -0.711 1
1 302 . 11 1 1 A 27 27 LYS C C 65 176.156 178.461 -2.305 1
1 303 . 11 1 1 A 27 27 LYS CA C 65 56.499 59.249 -2.750 1
1 304 . 11 1 1 A 27 27 LYS CB C 65 29.626 32.011 -2.385 1
1 306 . 11 1 1 A 27 27 LYS N N 65 121.390 118.928 2.462 1
1 307 . 11 1 1 A 28 28 LEU H H 66 7.833 7.364 0.469 1
1 308 . 11 1 1 A 28 28 LEU HA H 66 3.769 4.075 -0.306 1
1 318 . 11 1 1 A 28 28 LEU C C 66 175.925 178.131 -2.206 1
1 319 . 11 1 1 A 28 28 LEU CA C 66 55.874 56.887 -1.013 1
1 320 . 11 1 1 A 28 28 LEU CB C 66 38.375 42.514 -4.139 1
1 324 . 11 1 1 A 28 28 LEU N N 66 123.068 120.475 2.593 1
1 325 . 11 1 1 A 29 29 ASP H H 67 7.292 7.878 -0.586 1
1 326 . 11 1 1 A 29 29 ASP HA H 67 4.096 4.360 -0.264 1
1 329 . 11 1 1 A 29 29 ASP C C 67 174.618 176.745 -2.127 1
1 330 . 11 1 1 A 29 29 ASP CA C 67 53.999 56.325 -2.326 1
1 331 . 11 1 1 A 29 29 ASP CB C 67 38.375 40.749 -2.374 1
1 332 . 11 1 1 A 29 29 ASP N N 67 114.729 118.745 -4.016 1
1 333 . 11 1 1 A 30 30 ASN H H 68 8.097 7.613 0.484 1
1 334 . 11 1 1 A 30 30 ASN HA H 68 4.337 4.342 -0.005 1
1 339 . 11 1 1 A 30 30 ASN C C 68 172.822 174.180 -1.358 1
1 340 . 11 1 1 A 30 30 ASN CA C 68 52.124 51.985 0.139 1
1 341 . 11 1 1 A 30 30 ASN CB C 68 37.750 38.200 -0.450 1
1 342 . 11 1 1 A 30 30 ASN N N 68 111.054 115.068 -4.014 1
1 344 . 11 1 1 A 31 31 PHE H H 69 8.249 7.927 0.322 1
1 345 . 11 1 1 A 31 31 PHE HA H 69 4.135 4.389 -0.254 1
1 353 . 11 1 1 A 31 31 PHE C C 69 170.485 174.217 -3.732 1
1 354 . 11 1 1 A 31 31 PHE CA C 69 57.749 58.711 -0.962 1
1 355 . 11 1 1 A 31 31 PHE CB C 69 33.375 36.550 -3.175 1
1 356 . 11 1 1 A 31 31 PHE N N 69 116.277 117.245 -0.968 1
1 357 . 11 1 1 A 32 32 ALA H H 70 7.224 6.820 0.404 1
1 358 . 11 1 1 A 32 32 ALA HA H 70 4.194 4.487 -0.293 1
1 362 . 11 1 1 A 32 32 ALA C C 70 173.337 174.983 -1.646 1
1 363 . 11 1 1 A 32 32 ALA CA C 70 48.374 51.496 -3.122 1
1 364 . 11 1 1 A 32 32 ALA CB C 70 19.626 22.257 -2.631 1
1 365 . 11 1 1 A 32 32 ALA N N 70 119.914 120.242 -0.328 1
1 366 . 11 1 1 A 33 33 TYR H H 71 7.948 8.426 -0.478 1
1 367 . 11 1 1 A 33 33 TYR HA H 71 4.209 4.961 -0.752 1
1 374 . 11 1 1 A 33 33 TYR C C 71 170.591 173.981 -3.390 1
1 375 . 11 1 1 A 33 33 TYR CA C 71 54.624 56.397 -1.773 1
1 376 . 11 1 1 A 33 33 TYR CB C 71 34.000 38.170 -4.170 1
1 377 . 11 1 1 A 33 33 TYR N N 71 116.929 117.818 -0.889 1
1 378 . 11 1 1 A 34 34 PRO HA H 72 4.444 4.774 -0.330 1
1 381 . 11 1 1 A 34 34 PRO C C 72 174.775 176.339 -1.564 1
1 382 . 11 1 1 A 34 34 PRO CA C 72 59.624 62.592 -2.968 1
1 383 . 11 1 1 A 34 34 PRO CB C 72 28.376 32.062 -3.686 1
1 384 . 11 1 1 A 35 35 SER H H 73 8.721 8.410 0.311 1
1 385 . 11 1 1 A 35 35 SER HA H 73 4.467 4.734 -0.267 1
1 388 . 11 1 1 A 35 35 SER C C 73 173.271 175.671 -2.400 1
1 389 . 11 1 1 A 35 35 SER CA C 73 55.249 56.626 -1.377 1
1 390 . 11 1 1 A 35 35 SER CB C 73 63.373 65.749 -2.376 1
1 391 . 11 1 1 A 35 35 SER N N 73 118.284 114.484 3.800 1
1 392 . 11 1 1 A 36 36 THR H H 74 8.591 8.933 -0.342 1
1 393 . 11 1 1 A 36 36 THR HA H 74 3.649 4.111 -0.462 1
1 398 . 11 1 1 A 36 36 THR CA C 74 64.623 64.726 -0.103 1
1 399 . 11 1 1 A 36 36 THR CB C 74 66.498 68.653 -2.155 1
1 401 . 11 1 1 A 36 36 THR N N 74 117.769 116.335 1.434 1
1 402 . 11 1 1 A 37 37 GLN H H 75 8.210 7.882 0.328 1
1 403 . 11 1 1 A 37 37 GLN HA H 75 3.860 4.462 -0.602 1
1 410 . 11 1 1 A 37 37 GLN C C 75 175.349 177.633 -2.284 1
1 411 . 11 1 1 A 37 37 GLN CA C 75 56.499 57.565 -1.066 1
1 412 . 11 1 1 A 37 37 GLN CB C 75 25.876 29.696 -3.820 1
1 414 . 11 1 1 A 37 37 GLN N N 75 117.931 120.327 -2.396 1
1 416 . 11 1 1 A 38 38 GLN H H 76 7.667 8.241 -0.574 1
1 417 . 11 1 1 A 38 38 GLN HA H 76 3.810 4.102 -0.292 1
1 424 . 11 1 1 A 38 38 GLN C C 76 175.805 179.466 -3.661 1
1 425 . 11 1 1 A 38 38 GLN CA C 76 55.874 58.515 -2.641 1
1 426 . 11 1 1 A 38 38 GLN CB C 76 25.876 28.271 -2.395 1
1 428 . 11 1 1 A 38 38 GLN N N 76 120.607 117.981 2.626 1
1 430 . 11 1 1 A 39 39 GLY H H 77 8.470 8.189 0.281 1
1 431 . 11 1 1 A 39 39 GLY HA2 H 77 3.920 3.742 0.178 1
1 432 . 11 1 1 A 39 39 GLY HA3 H 77 3.603 3.769 -0.166 1
1 433 . 11 1 1 A 39 39 GLY C C 77 169.006 175.388 -6.382 1
1 434 . 11 1 1 A 39 39 GLY CA C 77 42.125 46.483 -4.358 1
1 435 . 11 1 1 A 39 39 GLY N N 77 103.281 109.538 -6.257 1
1 436 . 11 1 1 A 40 40 LEU H H 78 8.135 7.876 0.259 1
1 437 . 11 1 1 A 40 40 LEU HA H 78 3.237 4.033 -0.796 1
1 447 . 11 1 1 A 40 40 LEU C C 78 176.383 178.588 -2.205 1
1 448 . 11 1 1 A 40 40 LEU CA C 78 52.749 57.071 -4.322 1
1 449 . 11 1 1 A 40 40 LEU CB C 78 39.000 41.516 -2.516 1
1 453 . 11 1 1 A 40 40 LEU N N 78 114.444 123.319 -8.875 1
1 454 . 11 1 1 A 41 41 GLU H H 79 8.578 8.079 0.499 1
1 455 . 11 1 1 A 41 41 GLU HA H 79 3.720 3.991 -0.271 1
1 460 . 11 1 1 A 41 41 GLU C C 79 175.093 178.752 -3.659 1
1 461 . 11 1 1 A 41 41 GLU CA C 79 57.124 59.578 -2.454 1
1 462 . 11 1 1 A 41 41 GLU CB C 79 26.501 29.221 -2.720 1
1 464 . 11 1 1 A 41 41 GLU N N 79 118.295 118.431 -0.136 1
1 465 . 11 1 1 A 42 42 ALA H H 80 7.227 7.856 -0.629 1
1 466 . 11 1 1 A 42 42 ALA HA H 80 4.437 4.712 -0.275 1
1 470 . 11 1 1 A 42 42 ALA C C 80 173.745 178.088 -4.343 1
1 471 . 11 1 1 A 42 42 ALA CA C 80 51.499 53.763 -2.264 1
1 472 . 11 1 1 A 42 42 ALA CB C 80 15.877 18.567 -2.690 1
1 473 . 11 1 1 A 42 42 ALA N N 80 119.751 120.975 -1.224 1
1 474 . 11 1 1 A 43 43 LEU H H 81 7.932 7.421 0.511 1
1 475 . 11 1 1 A 43 43 LEU HA H 81 4.369 4.265 0.104 1
1 485 . 11 1 1 A 43 43 LEU C C 81 174.788 178.005 -3.217 1
1 486 . 11 1 1 A 43 43 LEU CA C 81 53.374 55.816 -2.442 1
1 487 . 11 1 1 A 43 43 LEU CB C 81 39.625 42.068 -2.443 1
1 491 . 11 1 1 A 43 43 LEU N N 81 111.742 116.511 -4.769 1
1 492 . 11 1 1 A 44 44 VAL H H 82 7.886 7.432 0.454 1
1 493 . 11 1 1 A 44 44 VAL HA H 82 4.700 4.259 0.441 1
1 501 . 11 1 1 A 44 44 VAL C C 82 172.875 175.726 -2.851 1
1 502 . 11 1 1 A 44 44 VAL CA C 82 59.624 63.231 -3.607 1
1 503 . 11 1 1 A 44 44 VAL CB C 82 31.501 33.235 -1.734 1
1 506 . 11 1 1 A 44 44 VAL N N 82 113.604 115.257 -1.653 1
1 507 . 11 1 1 A 45 45 LYS H H 83 8.361 8.297 0.064 1
1 508 . 11 1 1 A 45 45 LYS HA H 83 4.251 4.861 -0.610 1
1 515 . 11 1 1 A 45 45 LYS C C 83 171.053 174.600 -3.547 1
1 516 . 11 1 1 A 45 45 LYS CA C 83 52.749 54.306 -1.557 1
1 517 . 11 1 1 A 45 45 LYS CB C 83 33.375 35.852 -2.477 1
1 521 . 11 1 1 A 45 45 LYS N N 83 123.860 122.626 1.234 1
1 522 . 11 1 1 A 46 46 LYS H H 84 7.243 8.099 -0.856 1
1 523 . 11 1 1 A 46 46 LYS HA H 84 2.175 2.854 -0.679 1
1 532 . 11 1 1 A 46 46 LYS C C 84 172.123 174.721 -2.598 1
1 533 . 11 1 1 A 46 46 LYS CA C 84 52.749 53.895 -1.146 1
1 534 . 11 1 1 A 46 46 LYS CB C 84 29.626 32.510 -2.884 1
1 537 . 11 1 1 A 46 46 LYS N N 84 128.615 126.682 1.933 1
1 538 . 11 1 1 A 47 47 PRO HA H 85 4.470 4.527 -0.057 1
1 541 . 11 1 1 A 47 47 PRO C C 85 173.754 176.237 -2.483 1
1 542 . 11 1 1 A 47 47 PRO CA C 85 60.874 63.007 -2.133 1
1 543 . 11 1 1 A 47 47 PRO CB C 85 30.876 32.116 -1.240 1
1 546 . 11 1 1 A 48 48 THR H H 86 8.306 8.331 -0.025 1
1 547 . 11 1 1 A 48 48 THR HA H 86 4.287 4.618 -0.331 1
1 552 . 11 1 1 A 48 48 THR C C 86 173.070 174.411 -1.341 1
1 553 . 11 1 1 A 48 48 THR CA C 86 57.749 61.395 -3.646 1
1 554 . 11 1 1 A 48 48 THR CB C 86 67.748 70.409 -2.661 1
1 556 . 11 1 1 A 48 48 THR N N 86 109.564 117.529 -7.965 1
1 557 . 11 1 1 A 49 49 GLY H H 87 8.317 8.454 -0.137 1
1 558 . 11 1 1 A 49 49 GLY HA2 H 87 3.851 3.957 -0.106 1
1 559 . 11 1 1 A 49 49 GLY HA3 H 87 3.678 3.969 -0.291 1
1 560 . 11 1 1 A 49 49 GLY C C 87 169.693 173.885 -4.192 1
1 561 . 11 1 1 A 49 49 GLY CA C 87 42.125 45.999 -3.874 1
1 562 . 11 1 1 A 49 49 GLY N N 87 109.071 112.588 -3.517 1
1 563 . 11 1 1 A 50 50 ASN H H 88 8.301 8.499 -0.198 1
1 564 . 11 1 1 A 50 50 ASN HA H 88 4.780 5.271 -0.491 1
1 569 . 11 1 1 A 50 50 ASN C C 88 171.370 173.818 -2.448 1
1 570 . 11 1 1 A 50 50 ASN CA C 88 47.749 50.674 -2.925 1
1 571 . 11 1 1 A 50 50 ASN CB C 88 37.125 38.620 -1.495 1
1 572 . 11 1 1 A 50 50 ASN N N 88 115.631 122.183 -6.552 1
1 574 . 11 1 1 A 51 51 PRO HA H 89 4.782 4.581 0.201 1
1 577 . 11 1 1 A 51 51 PRO C C 89 173.656 176.226 -2.570 1
1 578 . 11 1 1 A 51 51 PRO CA C 89 59.624 62.243 -2.619 1
1 579 . 11 1 1 A 51 51 PRO CB C 89 31.501 32.373 -0.872 1
1 582 . 11 1 1 A 52 52 GLN H H 90 9.076 8.696 0.380 1
1 583 . 11 1 1 A 52 52 GLN HA H 90 4.469 4.778 -0.309 1
1 590 . 11 1 1 A 52 52 GLN C C 90 172.386 174.102 -1.716 1
1 591 . 11 1 1 A 52 52 GLN CA C 90 50.874 53.053 -2.179 1
1 592 . 11 1 1 A 52 52 GLN CB C 90 26.501 29.135 -2.634 1
1 594 . 11 1 1 A 52 52 GLN N N 90 126.827 121.030 5.797 1
1 596 . 11 1 1 A 53 53 PRO HA H 91 4.384 4.454 -0.070 1
1 599 . 11 1 1 A 53 53 PRO C C 91 174.274 175.980 -1.706 1
1 600 . 11 1 1 A 53 53 PRO CB C 91 28.113 31.403 -3.290 1
1 601 . 11 1 1 A 54 54 LYS H H 92 8.401 8.956 -0.555 1
1 602 . 11 1 1 A 54 54 LYS HA H 92 3.984 4.905 -0.921 1
1 611 . 11 1 1 A 54 54 LYS C C 92 173.516 176.361 -2.845 1
1 612 . 11 1 1 A 54 54 LYS CA C 92 55.249 54.679 0.570 1
1 613 . 11 1 1 A 54 54 LYS CB C 92 30.876 35.276 -4.400 1
1 615 . 11 1 1 A 54 54 LYS N N 92 124.538 122.851 1.687 1
1 616 . 11 1 1 A 55 55 ASN H H 93 8.183 8.639 -0.456 1
1 617 . 11 1 1 A 55 55 ASN HA H 93 4.716 4.798 -0.082 1
1 622 . 11 1 1 A 55 55 ASN CA C 93 48.999 53.367 -4.368 1
1 623 . 11 1 1 A 55 55 ASN CB C 93 35.875 38.127 -2.252 1
1 624 . 11 1 1 A 55 55 ASN N N 93 118.677 120.794 -2.117 1
1 626 . 11 1 1 A 56 56 TRP H H 94 8.007 8.641 -0.634 1
1 627 . 11 1 1 A 56 56 TRP HA H 94 3.827 5.546 -1.719 1
1 635 . 11 1 1 A 56 56 TRP C C 94 173.760 175.304 -1.544 1
1 636 . 11 1 1 A 56 56 TRP CA C 94 59.624 58.995 0.629 1
1 637 . 11 1 1 A 56 56 TRP CB C 94 27.126 30.361 -3.235 1
1 638 . 11 1 1 A 56 56 TRP N N 94 122.195 127.843 -5.648 1
1 640 . 11 1 1 A 57 57 ASN H H 95 7.563 7.348 0.215 1
1 641 . 11 1 1 A 57 57 ASN HA H 95 3.735 4.826 -1.091 1
1 646 . 11 1 1 A 57 57 ASN C C 95 171.952 173.936 -1.984 1
1 647 . 11 1 1 A 57 57 ASN CA C 95 51.499 50.825 0.674 1
1 648 . 11 1 1 A 57 57 ASN CB C 95 35.250 41.279 -6.029 1
1 649 . 11 1 1 A 57 57 ASN N N 95 129.659 125.156 4.503 1
1 651 . 11 1 1 A 58 58 LYS H H 96 8.110 8.094 0.016 1
1 652 . 11 1 1 A 58 58 LYS HA H 96 4.035 4.183 -0.148 1
1 659 . 11 1 1 A 58 58 LYS C C 96 174.530 175.563 -1.033 1
1 660 . 11 1 1 A 58 58 LYS CA C 96 56.499 54.734 1.765 1
1 661 . 11 1 1 A 58 58 LYS CB C 96 29.626 32.995 -3.369 1
1 665 . 11 1 1 A 58 58 LYS N N 96 123.913 123.458 0.455 1
1 666 . 11 1 1 A 59 59 ASP H H 97 7.903 8.791 -0.888 1
1 667 . 11 1 1 A 59 59 ASP HA H 97 4.393 4.422 -0.029 1
1 670 . 11 1 1 A 59 59 ASP C C 97 173.724 175.411 -1.687 1
1 671 . 11 1 1 A 59 59 ASP CA C 97 52.124 55.098 -2.974 1
1 672 . 11 1 1 A 59 59 ASP CB C 97 38.375 39.927 -1.552 1
1 673 . 11 1 1 A 59 59 ASP N N 97 118.773 119.665 -0.892 1
1 674 . 11 1 1 A 60 60 GLY H H 98 7.819 7.955 -0.136 1
1 675 . 11 1 1 A 60 60 GLY HA2 H 98 3.917 3.687 0.230 1
1 676 . 11 1 1 A 60 60 GLY HA3 H 98 3.917 3.983 -0.066 1
1 677 . 11 1 1 A 60 60 GLY C C 98 168.652 174.362 -5.710 1
1 678 . 11 1 1 A 60 60 GLY CA C 98 41.500 44.953 -3.453 1
1 679 . 11 1 1 A 60 60 GLY N N 98 108.742 105.104 3.638 1
1 680 . 11 1 1 A 61 61 TYR H H 99 8.105 8.105 0.000 1
1 681 . 11 1 1 A 61 61 TYR HA H 99 3.927 4.009 -0.082 1
1 689 . 11 1 1 A 61 61 TYR C C 99 172.831 174.113 -1.282 1
1 690 . 11 1 1 A 61 61 TYR CA C 99 57.124 57.992 -0.868 1
1 691 . 11 1 1 A 61 61 TYR CB C 99 37.125 36.762 0.363 1
1 692 . 11 1 1 A 61 61 TYR N N 99 113.836 115.314 -1.478 1
1 693 . 11 1 1 A 62 62 LEU H H 100 7.352 8.013 -0.661 1
1 694 . 11 1 1 A 62 62 LEU HA H 100 4.343 4.861 -0.518 1
1 704 . 11 1 1 A 62 62 LEU C C 100 173.430 175.453 -2.023 1
1 705 . 11 1 1 A 62 62 LEU CA C 100 50.874 52.960 -2.086 1
1 706 . 11 1 1 A 62 62 LEU CB C 100 44.000 45.589 -1.589 1
1 710 . 11 1 1 A 62 62 LEU N N 100 117.112 123.057 -5.945 1
1 711 . 11 1 1 A 63 63 LYS H H 101 8.626 8.275 0.351 1
1 712 . 11 1 1 A 63 63 LYS HA H 101 3.986 4.330 -0.344 1
1 721 . 11 1 1 A 63 63 LYS C C 101 173.851 176.914 -3.063 1
1 722 . 11 1 1 A 63 63 LYS CA C 101 55.249 55.916 -0.667 1
1 723 . 11 1 1 A 63 63 LYS CB C 101 29.626 33.330 -3.704 1
1 724 . 11 1 1 A 63 63 LYS N N 101 129.991 122.203 7.788 1
1 725 . 11 1 1 A 64 64 LYS H H 102 7.059 8.457 -1.398 1
1 726 . 11 1 1 A 64 64 LYS HA H 102 4.138 4.334 -0.196 1
1 735 . 11 1 1 A 64 64 LYS C C 102 171.120 174.520 -3.400 1
1 736 . 11 1 1 A 64 64 LYS CA C 102 52.749 55.825 -3.076 1
1 737 . 11 1 1 A 64 64 LYS CB C 102 32.750 31.015 1.735 1
1 740 . 11 1 1 A 64 64 LYS N N 102 113.255 121.370 -8.115 1
1 741 . 11 1 1 A 65 65 LEU H H 103 8.883 7.818 1.065 1
1 742 . 11 1 1 A 65 65 LEU HA H 103 4.475 4.764 -0.289 1
1 752 . 11 1 1 A 65 65 LEU C C 103 171.487 174.234 -2.747 1
1 753 . 11 1 1 A 65 65 LEU CA C 103 48.999 51.245 -2.246 1
1 754 . 11 1 1 A 65 65 LEU CB C 103 39.625 45.160 -5.535 1
1 758 . 11 1 1 A 65 65 LEU N N 103 126.355 127.011 -0.656 1
1 759 . 11 1 1 A 66 66 PRO HA H 104 4.449 4.598 -0.149 1
1 764 . 11 1 1 A 66 66 PRO C C 104 173.363 176.260 -2.897 1
1 765 . 11 1 1 A 66 66 PRO CA C 104 60.249 62.150 -1.901 1
1 766 . 11 1 1 A 66 66 PRO CB C 104 29.626 32.935 -3.309 1
1 769 . 11 1 1 A 67 67 VAL H H 105 7.682 8.318 -0.636 1
1 770 . 11 1 1 A 67 67 VAL HA H 105 4.121 4.409 -0.288 1
1 778 . 11 1 1 A 67 67 VAL C C 105 171.667 175.024 -3.357 1
1 779 . 11 1 1 A 67 67 VAL CA C 105 58.374 61.095 -2.721 1
1 780 . 11 1 1 A 67 67 VAL CB C 105 30.251 33.101 -2.850 1
1 783 . 11 1 1 A 67 67 VAL N N 105 114.671 120.816 -6.145 1
1 784 . 11 1 1 A 68 68 ASP H H 106 8.216 8.107 0.109 1
1 785 . 11 1 1 A 68 68 ASP HA H 106 4.474 4.496 -0.022 1
1 788 . 11 1 1 A 68 68 ASP C C 106 172.452 174.583 -2.131 1
1 789 . 11 1 1 A 68 68 ASP CA C 106 50.249 52.324 -2.075 1
1 790 . 11 1 1 A 68 68 ASP CB C 106 37.750 40.045 -2.295 1
1 791 . 11 1 1 A 68 68 ASP N N 106 123.825 125.011 -1.186 1
1 792 . 11 1 1 A 69 69 PRO HA H 107 3.920 3.963 -0.043 1
1 797 . 11 1 1 A 69 69 PRO CA C 107 62.123 63.191 -1.068 1
1 798 . 11 1 1 A 69 69 PRO CB C 107 27.751 31.370 -3.619 1
1 801 . 11 1 1 A 70 70 TRP H H 108 8.156 8.508 -0.352 1
1 802 . 11 1 1 A 70 70 TRP HA H 108 4.274 4.297 -0.023 1
1 811 . 11 1 1 A 70 70 TRP CA C 108 57.124 58.494 -1.370 1
1 812 . 11 1 1 A 70 70 TRP CB C 108 25.251 27.234 -1.983 1
1 813 . 11 1 1 A 70 70 TRP N N 108 118.137 117.487 0.650 1
1 815 . 11 1 1 A 71 71 GLY H H 109 8.209 8.707 -0.498 1
1 816 . 11 1 1 A 71 71 GLY HA2 H 109 4.030 3.830 0.200 1
1 817 . 11 1 1 A 71 71 GLY HA3 H 109 3.303 3.867 -0.564 1
1 818 . 11 1 1 A 71 71 GLY CA C 109 42.750 45.514 -2.764 1
1 819 . 11 1 1 A 71 71 GLY N N 109 107.495 105.469 2.026 1
1 820 . 11 1 1 A 72 72 ASN H H 110 8.116 7.510 0.606 1
1 821 . 11 1 1 A 72 72 ASN HA H 110 5.103 4.873 0.230 1
1 826 . 11 1 1 A 72 72 ASN CA C 110 48.374 51.014 -2.640 1
1 827 . 11 1 1 A 72 72 ASN CB C 110 36.500 38.869 -2.369 1
1 828 . 11 1 1 A 72 72 ASN N N 110 120.108 120.359 -0.251 1
1 830 . 11 1 1 A 73 73 PRO HA H 111 4.397 4.384 0.013 1
1 835 . 11 1 1 A 73 73 PRO C C 111 176.229 176.406 -0.177 1
1 836 . 11 1 1 A 73 73 PRO CA C 111 60.249 62.423 -2.174 1
1 837 . 11 1 1 A 73 73 PRO CB C 111 29.001 31.890 -2.889 1
1 840 . 11 1 1 A 74 74 TYR H H 112 8.893 8.557 0.336 1
1 841 . 11 1 1 A 74 74 TYR HA H 112 4.064 4.802 -0.738 1
1 849 . 11 1 1 A 74 74 TYR C C 112 171.951 175.860 -3.909 1
1 850 . 11 1 1 A 74 74 TYR CA C 112 60.249 58.297 1.952 1
1 851 . 11 1 1 A 74 74 TYR CB C 112 36.500 39.380 -2.880 1
1 852 . 11 1 1 A 74 74 TYR N N 112 124.595 120.970 3.625 1
1 853 . 11 1 1 A 75 75 GLN H H 113 9.127 9.055 0.072 1
1 854 . 11 1 1 A 75 75 GLN HA H 113 4.019 4.366 -0.347 1
1 861 . 11 1 1 A 75 75 GLN C C 113 171.436 174.282 -2.846 1
1 862 . 11 1 1 A 75 75 GLN CA C 113 50.874 54.776 -3.902 1
1 863 . 11 1 1 A 75 75 GLN CB C 113 29.469 29.405 0.064 1
1 865 . 11 1 1 A 75 75 GLN N N 113 120.777 121.884 -1.107 1
1 867 . 11 1 1 A 76 76 TYR H H 114 7.906 8.212 -0.306 1
1 868 . 11 1 1 A 76 76 TYR HA H 114 5.586 5.546 0.040 1
1 875 . 11 1 1 A 76 76 TYR C C 114 171.343 175.274 -3.931 1
1 876 . 11 1 1 A 76 76 TYR CA C 114 53.999 55.904 -1.905 1
1 877 . 11 1 1 A 76 76 TYR CB C 114 40.250 40.385 -0.135 1
1 878 . 11 1 1 A 76 76 TYR N N 114 120.757 122.438 -1.681 1
1 879 . 11 1 1 A 77 77 LEU H H 115 8.261 9.217 -0.956 1
1 880 . 11 1 1 A 77 77 LEU HA H 115 4.280 5.161 -0.881 1
1 890 . 11 1 1 A 77 77 LEU C C 115 170.921 175.808 -4.887 1
1 891 . 11 1 1 A 77 77 LEU CA C 115 51.499 53.564 -2.065 1
1 892 . 11 1 1 A 77 77 LEU CB C 115 44.625 45.488 -0.863 1
1 896 . 11 1 1 A 77 77 LEU N N 115 130.662 125.704 4.958 1
1 897 . 11 1 1 A 78 78 ALA H H 116 7.973 8.387 -0.414 1
1 898 . 11 1 1 A 78 78 ALA HA H 116 4.292 4.631 -0.339 1
1 902 . 11 1 1 A 78 78 ALA C C 116 172.093 174.871 -2.778 1
1 903 . 11 1 1 A 78 78 ALA CA C 116 47.749 49.950 -2.201 1
1 904 . 11 1 1 A 78 78 ALA CB C 116 19.626 20.420 -0.794 1
1 905 . 11 1 1 A 78 78 ALA N N 116 125.564 125.155 0.409 1
1 906 . 11 1 1 A 79 79 PRO HA H 117 4.698 5.278 -0.580 1
1 911 . 11 1 1 A 79 79 PRO C C 117 173.994 176.760 -2.766 1
1 912 . 11 1 1 A 79 79 PRO CA C 117 60.249 63.445 -3.196 1
1 913 . 11 1 1 A 79 79 PRO CB C 117 31.501 31.871 -0.370 1
1 916 . 11 1 1 A 80 80 GLY H H 118 7.096 8.400 -1.304 1
1 917 . 11 1 1 A 80 80 GLY HA2 H 118 3.797 4.023 -0.226 1
1 918 . 11 1 1 A 80 80 GLY HA3 H 118 3.517 4.027 -0.510 1
1 919 . 11 1 1 A 80 80 GLY C C 118 171.404 174.129 -2.725 1
1 920 . 11 1 1 A 80 80 GLY CA C 118 41.500 46.153 -4.653 1
1 921 . 11 1 1 A 80 80 GLY N N 118 108.306 108.107 0.199 1
1 922 . 11 1 1 A 81 81 THR H H 119 9.810 7.949 1.861 1
1 923 . 11 1 1 A 81 81 THR HA H 119 4.091 4.628 -0.537 1
1 928 . 11 1 1 A 81 81 THR C C 119 174.242 174.490 -0.248 1
1 929 . 11 1 1 A 81 81 THR CA C 119 60.874 60.757 0.117 1
1 930 . 11 1 1 A 81 81 THR CB C 119 66.498 69.249 -2.751 1
1 932 . 11 1 1 A 81 81 THR N N 119 112.813 112.546 0.267 1
1 933 . 11 1 1 A 82 82 LYS H H 120 8.964 8.736 0.228 1
1 934 . 11 1 1 A 82 82 LYS HA H 120 4.150 3.911 0.239 1
1 941 . 11 1 1 A 82 82 LYS C C 120 172.886 175.293 -2.407 1
1 942 . 11 1 1 A 82 82 LYS CA C 120 53.999 57.809 -3.810 1
1 943 . 11 1 1 A 82 82 LYS CB C 120 30.876 29.506 1.370 1
1 944 . 11 1 1 A 82 82 LYS N N 120 123.569 119.690 3.879 1
1 945 . 11 1 1 A 83 83 GLY H H 121 7.125 7.949 -0.824 1
1 946 . 11 1 1 A 83 83 GLY HA2 H 121 3.814 4.368 -0.554 1
1 947 . 11 1 1 A 83 83 GLY HA3 H 121 3.814 4.376 -0.562 1
1 948 . 11 1 1 A 83 83 GLY C C 121 167.671 173.784 -6.113 1
1 949 . 11 1 1 A 83 83 GLY CA C 121 42.125 44.679 -2.554 1
1 950 . 11 1 1 A 83 83 GLY N N 121 107.253 107.494 -0.241 1
1 951 . 11 1 1 A 84 84 PRO HA H 122 4.077 4.459 -0.382 1
1 958 . 11 1 1 A 84 84 PRO C C 122 175.199 176.725 -1.526 1
1 959 . 11 1 1 A 84 84 PRO CA C 122 63.373 64.388 -1.015 1
1 960 . 11 1 1 A 84 84 PRO CB C 122 30.251 31.935 -1.684 1
1 962 . 11 1 1 A 85 85 PHE H H 123 6.652 6.556 0.096 1
1 963 . 11 1 1 A 85 85 PHE HA H 123 4.744 4.664 0.080 1
1 971 . 11 1 1 A 85 85 PHE C C 123 170.340 172.093 -1.753 1
1 972 . 11 1 1 A 85 85 PHE CA C 123 53.999 56.332 -2.333 1
1 973 . 11 1 1 A 85 85 PHE CB C 123 39.000 40.418 -1.418 1
1 974 . 11 1 1 A 85 85 PHE N N 123 108.468 112.058 -3.590 1
1 975 . 11 1 1 A 86 86 ASP H H 124 9.268 8.858 0.410 1
1 976 . 11 1 1 A 86 86 ASP HA H 124 5.108 4.784 0.324 1
1 979 . 11 1 1 A 86 86 ASP C C 124 171.180 175.028 -3.848 1
1 980 . 11 1 1 A 86 86 ASP CA C 124 50.249 52.837 -2.588 1
1 981 . 11 1 1 A 86 86 ASP CB C 124 40.250 42.809 -2.559 1
1 982 . 11 1 1 A 86 86 ASP N N 124 121.741 119.451 2.290 1
1 983 . 11 1 1 A 87 87 LEU H H 125 8.018 8.421 -0.403 1
1 984 . 11 1 1 A 87 87 LEU HA H 125 5.809 5.414 0.395 1
1 994 . 11 1 1 A 87 87 LEU C C 125 171.350 174.939 -3.589 1
1 995 . 11 1 1 A 87 87 LEU CA C 125 50.874 53.578 -2.704 1
1 996 . 11 1 1 A 87 87 LEU CB C 125 44.318 45.943 -1.625 1
1 999 . 11 1 1 A 87 87 LEU N N 125 123.629 120.780 2.849 1
1 1000 . 11 1 1 A 88 88 TYR H H 126 8.912 8.501 0.411 1
1 1001 . 11 1 1 A 88 88 TYR HA H 126 5.630 5.506 0.124 1
1 1008 . 11 1 1 A 88 88 TYR C C 126 171.410 173.093 -1.683 1
1 1009 . 11 1 1 A 88 88 TYR CA C 126 52.749 56.550 -3.801 1
1 1010 . 11 1 1 A 88 88 TYR CB C 126 37.750 40.509 -2.759 1
1 1011 . 11 1 1 A 88 88 TYR N N 126 119.697 117.078 2.619 1
1 1012 . 11 1 1 A 89 89 SER H H 127 9.319 9.620 -0.301 1
1 1013 . 11 1 1 A 89 89 SER HA H 127 5.429 5.322 0.107 1
1 1016 . 11 1 1 A 89 89 SER CA C 127 52.124 56.436 -4.312 1
1 1017 . 11 1 1 A 89 89 SER CB C 127 62.748 66.032 -3.284 1
1 1018 . 11 1 1 A 89 89 SER N N 127 112.637 114.698 -2.061 1
1 1019 . 11 1 1 A 90 90 LEU H H 128 8.759 8.615 0.144 1
1 1020 . 11 1 1 A 90 90 LEU HA H 128 4.186 4.372 -0.186 1
1 1030 . 11 1 1 A 90 90 LEU C C 128 175.121 178.108 -2.987 1
1 1031 . 11 1 1 A 90 90 LEU CA C 128 52.749 55.428 -2.679 1
1 1032 . 11 1 1 A 90 90 LEU CB C 128 35.875 41.830 -5.955 1
1 1033 . 11 1 1 A 90 90 LEU N N 128 126.728 125.233 1.495 1
1 1034 . 11 1 1 A 91 91 GLY H H 129 8.356 8.425 -0.069 1
1 1035 . 11 1 1 A 91 91 GLY HA2 H 129 3.373 3.211 0.162 1
1 1036 . 11 1 1 A 91 91 GLY HA3 H 129 3.373 3.678 -0.305 1
1 1037 . 11 1 1 A 91 91 GLY C C 129 172.013 174.143 -2.130 1
1 1038 . 11 1 1 A 91 91 GLY CA C 129 41.500 43.843 -2.343 1
1 1039 . 11 1 1 A 91 91 GLY N N 129 108.559 109.898 -1.339 1
1 1040 . 11 1 1 A 92 92 ALA H H 130 7.047 7.593 -0.546 1
1 1041 . 11 1 1 A 92 92 ALA HA H 130 4.037 3.397 0.640 1
1 1045 . 11 1 1 A 92 92 ALA C C 130 174.890 177.424 -2.534 1
1 1046 . 11 1 1 A 92 92 ALA CA C 130 52.100 53.136 -1.036 1
1 1047 . 11 1 1 A 92 92 ALA CB C 130 16.502 18.059 -1.557 1
1 1048 . 11 1 1 A 92 92 ALA N N 130 118.393 121.272 -2.879 1
1 1049 . 11 1 1 A 93 93 ASP H H 131 7.222 7.595 -0.373 1
1 1050 . 11 1 1 A 93 93 ASP HA H 131 4.122 4.675 -0.553 1
1 1053 . 11 1 1 A 93 93 ASP C C 131 174.890 176.350 -1.460 1
1 1054 . 11 1 1 A 93 93 ASP CA C 131 50.249 53.862 -3.613 1
1 1055 . 11 1 1 A 93 93 ASP CB C 131 37.750 41.406 -3.656 1
1 1056 . 11 1 1 A 93 93 ASP N N 131 111.487 116.870 -5.383 1
1 1057 . 11 1 1 A 94 94 GLY H H 132 7.199 9.073 -1.874 1
1 1058 . 11 1 1 A 94 94 GLY HA2 H 132 3.951 3.904 0.047 1
1 1059 . 11 1 1 A 94 94 GLY HA3 H 132 3.324 3.907 -0.583 1
1 1060 . 11 1 1 A 94 94 GLY C C 132 169.773 173.749 -3.976 1
1 1061 . 11 1 1 A 94 94 GLY CA C 132 44.625 46.128 -1.503 1
1 1062 . 11 1 1 A 94 94 GLY N N 132 106.932 108.561 -1.629 1
1 1063 . 11 1 1 A 95 95 LYS H H 133 7.215 7.522 -0.307 1
1 1064 . 11 1 1 A 95 95 LYS HA H 133 4.513 4.923 -0.410 1
1 1073 . 11 1 1 A 95 95 LYS C C 133 172.108 174.794 -2.686 1
1 1074 . 11 1 1 A 95 95 LYS CA C 133 51.512 54.805 -3.293 1
1 1075 . 11 1 1 A 95 95 LYS CB C 133 34.000 35.830 -1.830 1
1 1076 . 11 1 1 A 95 95 LYS N N 133 115.749 119.868 -4.119 1
1 1077 . 11 1 1 A 96 96 GLU H H 134 9.230 8.665 0.565 1
1 1078 . 11 1 1 A 96 96 GLU HA H 134 4.352 4.606 -0.254 1
1 1083 . 11 1 1 A 96 96 GLU C C 134 175.219 176.124 -0.905 1
1 1084 . 11 1 1 A 96 96 GLU CA C 134 55.874 55.958 -0.084 1
1 1085 . 11 1 1 A 96 96 GLU CB C 134 27.126 30.173 -3.047 1
1 1087 . 11 1 1 A 96 96 GLU N N 134 128.571 123.689 4.882 1
1 1088 . 11 1 1 A 97 97 GLY H H 135 10.677 8.356 2.321 1
1 1089 . 11 1 1 A 97 97 GLY HA2 H 135 4.037 4.302 -0.265 1
1 1090 . 11 1 1 A 97 97 GLY HA3 H 135 3.717 4.305 -0.588 1
1 1091 . 11 1 1 A 97 97 GLY C C 135 171.567 172.388 -0.821 1
1 1092 . 11 1 1 A 97 97 GLY CA C 135 41.500 45.738 -4.238 1
1 1093 . 11 1 1 A 97 97 GLY N N 135 117.011 110.656 6.355 1
1 1094 . 11 1 1 A 98 98 GLY H H 136 8.442 8.633 -0.191 1
1 1095 . 11 1 1 A 98 98 GLY HA2 H 136 4.195 4.207 -0.012 1
1 1096 . 11 1 1 A 98 98 GLY HA3 H 136 4.195 4.211 -0.016 1
1 1097 . 11 1 1 A 98 98 GLY C C 136 170.299 173.260 -2.961 1
1 1098 . 11 1 1 A 98 98 GLY CA C 136 40.875 44.726 -3.851 1
1 1099 . 11 1 1 A 98 98 GLY N N 136 109.494 109.213 0.281 1
1 1100 . 11 1 1 A 99 99 SER H H 137 8.701 8.739 -0.038 1
1 1101 . 11 1 1 A 99 99 SER HA H 137 4.639 4.906 -0.267 1
1 1104 . 11 1 1 A 99 99 SER C C 137 170.630 173.185 -2.555 1
1 1105 . 11 1 1 A 99 99 SER CA C 137 54.624 57.624 -3.000 1
1 1106 . 11 1 1 A 99 99 SER CB C 137 62.748 66.618 -3.870 1
1 1107 . 11 1 1 A 99 99 SER N N 137 114.685 118.214 -3.529 1
1 1108 . 11 1 1 A 100 100 ASP H H 138 9.117 8.909 0.208 1
1 1109 . 11 1 1 A 100 100 ASP HA H 138 3.965 4.475 -0.510 1
1 1112 . 11 1 1 A 100 100 ASP C C 138 175.540 177.877 -2.337 1
1 1113 . 11 1 1 A 100 100 ASP CA C 138 54.624 56.556 -1.932 1
1 1114 . 11 1 1 A 100 100 ASP CB C 138 36.500 41.848 -5.348 1
1 1115 . 11 1 1 A 100 100 ASP N N 138 120.777 122.566 -1.789 1
1 1116 . 11 1 1 A 101 101 ASN H H 139 8.667 7.896 0.771 1
1 1117 . 11 1 1 A 101 101 ASN HA H 139 4.333 4.825 -0.492 1
1 1122 . 11 1 1 A 101 101 ASN CA C 139 53.999 55.066 -1.067 1
1 1123 . 11 1 1 A 101 101 ASN CB C 139 34.625 38.898 -4.273 1
1 1124 . 11 1 1 A 101 101 ASN N N 139 121.930 116.831 5.099 1
1 1126 . 11 1 1 A 102 102 ASP H H 140 7.714 7.770 -0.056 1
1 1127 . 11 1 1 A 102 102 ASP HA H 140 4.037 4.466 -0.429 1
1 1130 . 11 1 1 A 102 102 ASP C C 140 172.807 175.800 -2.993 1
1 1131 . 11 1 1 A 102 102 ASP CA C 140 53.374 54.413 -1.039 1
1 1132 . 11 1 1 A 102 102 ASP CB C 140 37.125 41.282 -4.157 1
1 1133 . 11 1 1 A 102 102 ASP N N 140 118.011 117.054 0.957 1
1 1134 . 11 1 1 A 103 103 ALA H H 141 7.060 7.257 -0.197 1
1 1135 . 11 1 1 A 103 103 ALA HA H 141 3.353 4.599 -1.246 1
1 1139 . 11 1 1 A 103 103 ALA C C 141 172.233 176.298 -4.065 1
1 1140 . 11 1 1 A 103 103 ALA CA C 141 49.624 50.929 -1.305 1
1 1141 . 11 1 1 A 103 103 ALA CB C 141 16.502 21.526 -5.024 1
1 1142 . 11 1 1 A 103 103 ALA N N 141 125.777 122.241 3.536 1
1 1143 . 11 1 1 A 104 104 ASP H H 142 7.973 8.147 -0.174 1
1 1144 . 11 1 1 A 104 104 ASP HA H 142 4.420 5.182 -0.762 1
1 1147 . 11 1 1 A 104 104 ASP C C 142 174.188 176.167 -1.979 1
1 1148 . 11 1 1 A 104 104 ASP CA C 142 52.124 53.622 -1.498 1
1 1149 . 11 1 1 A 104 104 ASP CB C 142 37.125 41.583 -4.458 1
1 1150 . 11 1 1 A 104 104 ASP N N 142 122.965 120.155 2.810 1
1 1151 . 11 1 1 A 105 105 ILE H H 143 8.534 8.664 -0.130 1
1 1152 . 11 1 1 A 105 105 ILE HA H 143 4.060 5.096 -1.036 1
1 1162 . 11 1 1 A 105 105 ILE C C 143 173.235 175.954 -2.719 1
1 1163 . 11 1 1 A 105 105 ILE CA C 143 58.374 59.088 -0.714 1
1 1164 . 11 1 1 A 105 105 ILE CB C 143 39.123 40.135 -1.012 1
1 1167 . 11 1 1 A 105 105 ILE N N 143 124.757 120.330 4.427 1
1 1168 . 11 1 1 A 106 106 GLY H H 144 8.288 8.279 0.009 1
1 1169 . 11 1 1 A 106 106 GLY HA2 H 144 4.764 4.430 0.334 1
1 1170 . 11 1 1 A 106 106 GLY HA3 H 144 4.764 4.505 0.259 1
1 1171 . 11 1 1 A 106 106 GLY C C 144 171.321 171.680 -0.359 1
1 1172 . 11 1 1 A 106 106 GLY CA C 144 40.250 45.558 -5.308 1
1 1173 . 11 1 1 A 106 106 GLY N N 144 110.895 110.121 0.774 1
1 1174 . 11 1 1 A 107 107 ASN H H 145 8.577 8.618 -0.041 1
1 1175 . 11 1 1 A 107 107 ASN HA H 145 4.268 5.686 -1.418 1
1 1180 . 11 1 1 A 107 107 ASN C C 145 171.757 173.738 -1.981 1
1 1181 . 11 1 1 A 107 107 ASN CA C 145 52.124 52.471 -0.347 1
1 1182 . 11 1 1 A 107 107 ASN CB C 145 34.625 42.408 -7.783 1
1 1183 . 11 1 1 A 107 107 ASN N N 145 118.042 118.759 -0.717 1
1 1185 . 11 1 1 A 108 108 TRP H H 146 6.822 8.940 -2.118 1
1 1186 . 11 1 1 A 108 108 TRP HA H 146 4.513 5.178 -0.665 1
1 1195 . 11 1 1 A 108 108 TRP C C 146 172.665 173.308 -0.643 1
1 1196 . 11 1 1 A 108 108 TRP CA C 146 54.624 56.667 -2.043 1
1 1197 . 11 1 1 A 108 108 TRP CB C 146 25.876 32.933 -7.057 1
1 1198 . 11 1 1 A 108 108 TRP N N 146 116.756 127.318 -10.562 1
1 1200 . 11 1 1 A 109 109 ASP H H 147 7.344 8.174 -0.830 1
1 1201 . 11 1 1 A 109 109 ASP HA H 147 4.655 4.876 -0.221 1
1 1204 . 11 1 1 A 109 109 ASP C C 147 172.193 175.229 -3.036 1
1 1205 . 11 1 1 A 109 109 ASP CA C 147 51.499 52.429 -0.930 1
1 1206 . 11 1 1 A 109 109 ASP CB C 147 39.000 41.781 -2.781 1
1 1207 . 11 1 1 A 109 109 ASP N N 147 121.461 128.867 -7.406 1
1 11 . 12 1 1 A 2 2 SER H H 40 8.461 8.757 -0.296 1
1 12 . 12 1 1 A 2 2 SER HA H 40 4.286 5.057 -0.771 1
1 15 . 12 1 1 A 2 2 SER C C 40 171.276 173.742 -2.466 1
1 16 . 12 1 1 A 2 2 SER CA C 40 55.249 57.896 -2.647 1
1 17 . 12 1 1 A 2 2 SER CB C 40 61.498 62.085 -0.587 1
1 18 . 12 1 1 A 2 2 SER N N 40 118.344 123.188 -4.844 1
1 19 . 12 1 1 A 3 3 ARG H H 41 8.469 8.382 0.087 1
1 20 . 12 1 1 A 3 3 ARG HA H 41 4.400 4.871 -0.471 1
1 25 . 12 1 1 A 3 3 ARG C C 41 172.251 173.613 -1.362 1
1 26 . 12 1 1 A 3 3 ARG CA C 41 52.749 52.913 -0.164 1
1 27 . 12 1 1 A 3 3 ARG CB C 41 27.126 33.340 -6.214 1
1 28 . 12 1 1 A 3 3 ARG N N 41 123.070 124.438 -1.368 1
1 33 . 12 1 1 A 4 4 PRO CA C 42 61.498 63.819 -2.321 1
1 34 . 12 1 1 A 4 4 PRO CB C 42 29.001 31.714 -2.713 1
1 37 . 12 1 1 A 5 5 ASP H H 43 8.246 8.924 -0.678 1
1 38 . 12 1 1 A 5 5 ASP HA H 43 4.329 4.562 -0.233 1
1 41 . 12 1 1 A 5 5 ASP C C 43 174.605 177.241 -2.636 1
1 42 . 12 1 1 A 5 5 ASP CA C 43 53.374 55.873 -2.499 1
1 43 . 12 1 1 A 5 5 ASP CB C 43 38.375 40.623 -2.248 1
1 44 . 12 1 1 A 5 5 ASP N N 43 119.409 121.063 -1.654 1
1 45 . 12 1 1 A 6 6 GLN H H 44 8.309 8.456 -0.147 1
1 46 . 12 1 1 A 6 6 GLN HA H 44 4.393 4.268 0.125 1
1 53 . 12 1 1 A 6 6 GLN C C 44 175.053 178.566 -3.513 1
1 54 . 12 1 1 A 6 6 GLN CA C 44 55.874 58.159 -2.285 1
1 55 . 12 1 1 A 6 6 GLN CB C 44 25.876 28.284 -2.408 1
1 57 . 12 1 1 A 6 6 GLN N N 44 122.273 118.157 4.116 1
1 59 . 12 1 1 A 7 7 ALA H H 45 8.106 8.265 -0.159 1
1 60 . 12 1 1 A 7 7 ALA HA H 45 3.993 4.030 -0.037 1
1 64 . 12 1 1 A 7 7 ALA C C 45 177.465 178.674 -1.209 1
1 65 . 12 1 1 A 7 7 ALA CA C 45 52.124 54.956 -2.832 1
1 66 . 12 1 1 A 7 7 ALA CB C 45 15.252 18.196 -2.944 1
1 67 . 12 1 1 A 7 7 ALA N N 45 122.204 122.006 0.198 1
1 68 . 12 1 1 A 8 8 LYS H H 46 7.527 7.742 -0.215 1
1 69 . 12 1 1 A 8 8 LYS HA H 46 3.539 4.024 -0.485 1
1 78 . 12 1 1 A 8 8 LYS C C 46 175.412 179.137 -3.725 1
1 79 . 12 1 1 A 8 8 LYS CA C 46 57.124 58.541 -1.417 1
1 80 . 12 1 1 A 8 8 LYS CB C 46 30.876 31.743 -0.867 1
1 83 . 12 1 1 A 8 8 LYS N N 46 117.358 116.941 0.417 1
1 84 . 12 1 1 A 9 9 VAL H H 47 7.709 7.643 0.066 1
1 85 . 12 1 1 A 9 9 VAL HA H 47 3.578 3.888 -0.310 1
1 93 . 12 1 1 A 9 9 VAL C C 47 175.005 178.418 -3.413 1
1 94 . 12 1 1 A 9 9 VAL CA C 47 64.623 66.161 -1.538 1
1 95 . 12 1 1 A 9 9 VAL CB C 47 29.001 31.860 -2.859 1
1 98 . 12 1 1 A 9 9 VAL N N 47 119.115 120.420 -1.305 1
1 99 . 12 1 1 A 10 10 THR H H 48 7.767 8.312 -0.545 1
1 100 . 12 1 1 A 10 10 THR HA H 48 3.668 4.017 -0.349 1
1 105 . 12 1 1 A 10 10 THR CA C 48 63.998 66.296 -2.298 1
1 106 . 12 1 1 A 10 10 THR CB C 48 67.123 68.640 -1.517 1
1 108 . 12 1 1 A 10 10 THR N N 48 115.112 113.988 1.124 1
1 109 . 12 1 1 A 11 11 VAL H H 49 7.598 7.563 0.035 1
1 110 . 12 1 1 A 11 11 VAL HA H 49 3.457 3.894 -0.437 1
1 118 . 12 1 1 A 11 11 VAL C C 49 175.412 177.704 -2.292 1
1 119 . 12 1 1 A 11 11 VAL CA C 49 63.998 64.775 -0.777 1
1 120 . 12 1 1 A 11 11 VAL CB C 49 29.001 31.532 -2.531 1
1 123 . 12 1 1 A 11 11 VAL N N 49 123.694 120.152 3.542 1
1 124 . 12 1 1 A 12 12 ALA H H 50 8.176 7.991 0.185 1
1 125 . 12 1 1 A 12 12 ALA HA H 50 4.742 4.092 0.650 1
1 129 . 12 1 1 A 12 12 ALA C C 50 177.074 179.789 -2.715 1
1 130 . 12 1 1 A 12 12 ALA CA C 50 52.124 55.233 -3.109 1
1 131 . 12 1 1 A 12 12 ALA CB C 50 15.252 18.449 -3.197 1
1 132 . 12 1 1 A 12 12 ALA N N 50 122.348 123.643 -1.295 1
1 133 . 12 1 1 A 13 13 LYS H H 51 8.499 7.911 0.588 1
1 134 . 12 1 1 A 13 13 LYS HA H 51 3.648 4.117 -0.469 1
1 143 . 12 1 1 A 13 13 LYS C C 51 177.252 179.913 -2.661 1
1 144 . 12 1 1 A 13 13 LYS CA C 51 58.072 59.570 -1.498 1
1 145 . 12 1 1 A 13 13 LYS CB C 51 30.251 32.327 -2.076 1
1 146 . 12 1 1 A 13 13 LYS N N 51 115.402 116.994 -1.592 1
1 147 . 12 1 1 A 14 14 GLY H H 52 7.858 8.108 -0.250 1
1 148 . 12 1 1 A 14 14 GLY HA2 H 52 3.823 3.831 -0.008 1
1 149 . 12 1 1 A 14 14 GLY HA3 H 52 3.676 3.838 -0.162 1
1 150 . 12 1 1 A 14 14 GLY C C 52 174.090 175.634 -1.544 1
1 151 . 12 1 1 A 14 14 GLY CA C 52 44.625 46.944 -2.319 1
1 152 . 12 1 1 A 14 14 GLY N N 52 107.466 108.879 -1.413 1
1 153 . 12 1 1 A 15 15 ASP H H 53 8.403 7.708 0.695 1
1 154 . 12 1 1 A 15 15 ASP HA H 53 4.191 4.383 -0.192 1
1 157 . 12 1 1 A 15 15 ASP C C 53 175.316 178.982 -3.666 1
1 158 . 12 1 1 A 15 15 ASP CA C 53 54.624 56.599 -1.975 1
1 159 . 12 1 1 A 15 15 ASP CB C 53 35.875 40.903 -5.028 1
1 160 . 12 1 1 A 15 15 ASP N N 53 125.929 121.382 4.547 1
1 161 . 12 1 1 A 16 16 ILE H H 54 8.245 8.246 -0.001 1
1 162 . 12 1 1 A 16 16 ILE HA H 54 3.034 3.882 -0.848 1
1 172 . 12 1 1 A 16 16 ILE C C 54 174.499 177.838 -3.339 1
1 173 . 12 1 1 A 16 16 ILE CA C 54 62.748 63.983 -1.235 1
1 174 . 12 1 1 A 16 16 ILE CB C 54 34.625 37.371 -2.746 1
1 178 . 12 1 1 A 16 16 ILE N N 54 119.456 116.676 2.780 1
1 179 . 12 1 1 A 17 17 LYS H H 55 7.547 8.195 -0.648 1
1 180 . 12 1 1 A 17 17 LYS HA H 55 3.843 4.086 -0.243 1
1 187 . 12 1 1 A 17 17 LYS C C 55 176.651 178.830 -2.179 1
1 188 . 12 1 1 A 17 17 LYS CA C 55 57.124 58.943 -1.819 1
1 189 . 12 1 1 A 17 17 LYS CB C 55 30.251 32.047 -1.796 1
1 190 . 12 1 1 A 17 17 LYS N N 55 118.505 120.632 -2.127 1
1 191 . 12 1 1 A 18 18 ALA H H 56 7.680 8.049 -0.369 1
1 192 . 12 1 1 A 18 18 ALA HA H 56 4.029 4.059 -0.030 1
1 196 . 12 1 1 A 18 18 ALA C C 56 176.638 180.318 -3.680 1
1 197 . 12 1 1 A 18 18 ALA CA C 56 52.749 55.068 -2.319 1
1 198 . 12 1 1 A 18 18 ALA CB C 56 15.877 18.335 -2.458 1
1 199 . 12 1 1 A 18 18 ALA N N 56 122.477 121.826 0.651 1
1 200 . 12 1 1 A 19 19 ILE H H 57 8.853 7.649 1.204 1
1 201 . 12 1 1 A 19 19 ILE HA H 57 3.304 3.530 -0.226 1
1 211 . 12 1 1 A 19 19 ILE C C 57 174.710 177.756 -3.046 1
1 212 . 12 1 1 A 19 19 ILE CA C 57 63.373 65.318 -1.945 1
1 213 . 12 1 1 A 19 19 ILE CB C 57 35.250 37.897 -2.647 1
1 217 . 12 1 1 A 19 19 ILE N N 57 120.901 119.133 1.768 1
1 218 . 12 1 1 A 20 20 ALA H H 58 8.702 8.041 0.661 1
1 219 . 12 1 1 A 20 20 ALA HA H 58 3.900 3.975 -0.075 1
1 223 . 12 1 1 A 20 20 ALA C C 58 176.512 179.687 -3.175 1
1 224 . 12 1 1 A 20 20 ALA CA C 58 52.749 55.185 -2.436 1
1 225 . 12 1 1 A 20 20 ALA CB C 58 15.252 18.189 -2.937 1
1 226 . 12 1 1 A 20 20 ALA N N 58 121.763 122.479 -0.716 1
1 227 . 12 1 1 A 21 21 ALA H H 59 7.662 7.833 -0.171 1
1 228 . 12 1 1 A 21 21 ALA HA H 59 4.136 4.268 -0.132 1
1 232 . 12 1 1 A 21 21 ALA C C 59 177.949 179.257 -1.308 1
1 233 . 12 1 1 A 21 21 ALA CA C 59 52.749 54.641 -1.892 1
1 234 . 12 1 1 A 21 21 ALA CB C 59 15.252 18.628 -3.376 1
1 235 . 12 1 1 A 21 21 ALA N N 59 119.079 119.226 -0.147 1
1 236 . 12 1 1 A 22 22 ALA H H 60 7.403 7.460 -0.057 1
1 237 . 12 1 1 A 22 22 ALA HA H 60 4.318 4.260 0.058 1
1 241 . 12 1 1 A 22 22 ALA C C 60 176.730 180.555 -3.825 1
1 242 . 12 1 1 A 22 22 ALA CA C 60 52.749 54.161 -1.412 1
1 243 . 12 1 1 A 22 22 ALA CB C 60 17.126 18.835 -1.709 1
1 244 . 12 1 1 A 22 22 ALA N N 60 122.616 119.995 2.621 1
1 245 . 12 1 1 A 23 23 LEU H H 61 8.410 8.749 -0.339 1
1 246 . 12 1 1 A 23 23 LEU HA H 61 3.527 3.965 -0.438 1
1 256 . 12 1 1 A 23 23 LEU C C 61 176.057 178.376 -2.319 1
1 257 . 12 1 1 A 23 23 LEU CA C 61 55.249 57.135 -1.886 1
1 258 . 12 1 1 A 23 23 LEU CB C 61 39.000 40.850 -1.850 1
1 262 . 12 1 1 A 23 23 LEU N N 61 120.761 121.288 -0.527 1
1 263 . 12 1 1 A 24 24 ASP H H 62 8.227 8.169 0.058 1
1 264 . 12 1 1 A 24 24 ASP HA H 62 4.581 4.491 0.090 1
1 267 . 12 1 1 A 24 24 ASP C C 62 176.968 177.923 -0.955 1
1 268 . 12 1 1 A 24 24 ASP CA C 62 55.874 56.880 -1.006 1
1 269 . 12 1 1 A 24 24 ASP CB C 62 37.750 41.081 -3.331 1
1 270 . 12 1 1 A 24 24 ASP N N 62 119.068 119.186 -0.118 1
1 271 . 12 1 1 A 25 25 MET H H 63 7.718 7.966 -0.248 1
1 272 . 12 1 1 A 25 25 MET HA H 63 4.196 4.201 -0.005 1
1 277 . 12 1 1 A 25 25 MET C C 63 174.968 177.745 -2.777 1
1 278 . 12 1 1 A 25 25 MET CA C 63 55.249 58.123 -2.874 1
1 279 . 12 1 1 A 25 25 MET CB C 63 29.626 32.228 -2.602 1
1 281 . 12 1 1 A 25 25 MET N N 63 121.365 117.302 4.063 1
1 282 . 12 1 1 A 26 26 TYR H H 64 8.401 7.588 0.813 1
1 283 . 12 1 1 A 26 26 TYR HA H 64 4.400 3.495 0.905 1
1 291 . 12 1 1 A 26 26 TYR C C 64 176.098 177.353 -1.255 1
1 292 . 12 1 1 A 26 26 TYR CA C 64 58.999 60.367 -1.368 1
1 293 . 12 1 1 A 26 26 TYR CB C 64 35.250 38.213 -2.963 1
1 294 . 12 1 1 A 26 26 TYR N N 64 122.575 121.725 0.850 1
1 295 . 12 1 1 A 27 27 LYS H H 65 8.330 8.250 0.080 1
1 296 . 12 1 1 A 27 27 LYS HA H 65 3.568 4.267 -0.699 1
1 302 . 12 1 1 A 27 27 LYS C C 65 176.156 178.572 -2.416 1
1 303 . 12 1 1 A 27 27 LYS CA C 65 56.499 59.257 -2.758 1
1 304 . 12 1 1 A 27 27 LYS CB C 65 29.626 32.085 -2.459 1
1 306 . 12 1 1 A 27 27 LYS N N 65 121.390 118.993 2.397 1
1 307 . 12 1 1 A 28 28 LEU H H 66 7.833 7.638 0.195 1
1 308 . 12 1 1 A 28 28 LEU HA H 66 3.769 4.108 -0.339 1
1 318 . 12 1 1 A 28 28 LEU C C 66 175.925 178.376 -2.451 1
1 319 . 12 1 1 A 28 28 LEU CA C 66 55.874 56.799 -0.925 1
1 320 . 12 1 1 A 28 28 LEU CB C 66 38.375 41.515 -3.140 1
1 324 . 12 1 1 A 28 28 LEU N N 66 123.068 119.522 3.546 1
1 325 . 12 1 1 A 29 29 ASP H H 67 7.292 7.605 -0.313 1
1 326 . 12 1 1 A 29 29 ASP HA H 67 4.096 4.262 -0.166 1
1 329 . 12 1 1 A 29 29 ASP C C 67 174.618 176.781 -2.163 1
1 330 . 12 1 1 A 29 29 ASP CA C 67 53.999 56.194 -2.195 1
1 331 . 12 1 1 A 29 29 ASP CB C 67 38.375 40.532 -2.157 1
1 332 . 12 1 1 A 29 29 ASP N N 67 114.729 119.222 -4.493 1
1 333 . 12 1 1 A 30 30 ASN H H 68 8.097 7.622 0.475 1
1 334 . 12 1 1 A 30 30 ASN HA H 68 4.337 4.381 -0.044 1
1 339 . 12 1 1 A 30 30 ASN C C 68 172.822 174.499 -1.677 1
1 340 . 12 1 1 A 30 30 ASN CA C 68 52.124 51.615 0.509 1
1 341 . 12 1 1 A 30 30 ASN CB C 68 37.750 38.496 -0.746 1
1 342 . 12 1 1 A 30 30 ASN N N 68 111.054 115.651 -4.597 1
1 344 . 12 1 1 A 31 31 PHE H H 69 8.249 7.938 0.311 1
1 345 . 12 1 1 A 31 31 PHE HA H 69 4.135 4.326 -0.191 1
1 353 . 12 1 1 A 31 31 PHE C C 69 170.485 174.234 -3.749 1
1 354 . 12 1 1 A 31 31 PHE CA C 69 57.749 58.748 -0.999 1
1 355 . 12 1 1 A 31 31 PHE CB C 69 33.375 36.584 -3.209 1
1 356 . 12 1 1 A 31 31 PHE N N 69 116.277 119.175 -2.898 1
1 357 . 12 1 1 A 32 32 ALA H H 70 7.224 6.786 0.438 1
1 358 . 12 1 1 A 32 32 ALA HA H 70 4.194 4.494 -0.300 1
1 362 . 12 1 1 A 32 32 ALA C C 70 173.337 175.027 -1.690 1
1 363 . 12 1 1 A 32 32 ALA CA C 70 48.374 51.500 -3.126 1
1 364 . 12 1 1 A 32 32 ALA CB C 70 19.626 22.138 -2.512 1
1 365 . 12 1 1 A 32 32 ALA N N 70 119.914 120.318 -0.404 1
1 366 . 12 1 1 A 33 33 TYR H H 71 7.948 8.395 -0.447 1
1 367 . 12 1 1 A 33 33 TYR HA H 71 4.209 4.927 -0.718 1
1 374 . 12 1 1 A 33 33 TYR C C 71 170.591 174.342 -3.751 1
1 375 . 12 1 1 A 33 33 TYR CA C 71 54.624 56.446 -1.822 1
1 376 . 12 1 1 A 33 33 TYR CB C 71 34.000 37.924 -3.924 1
1 377 . 12 1 1 A 33 33 TYR N N 71 116.929 117.806 -0.877 1
1 378 . 12 1 1 A 34 34 PRO HA H 72 4.444 4.664 -0.220 1
1 381 . 12 1 1 A 34 34 PRO C C 72 174.775 176.375 -1.600 1
1 382 . 12 1 1 A 34 34 PRO CA C 72 59.624 62.629 -3.005 1
1 383 . 12 1 1 A 34 34 PRO CB C 72 28.376 32.205 -3.829 1
1 384 . 12 1 1 A 35 35 SER H H 73 8.721 8.407 0.314 1
1 385 . 12 1 1 A 35 35 SER HA H 73 4.467 4.799 -0.332 1
1 388 . 12 1 1 A 35 35 SER C C 73 173.271 175.606 -2.335 1
1 389 . 12 1 1 A 35 35 SER CA C 73 55.249 56.581 -1.332 1
1 390 . 12 1 1 A 35 35 SER CB C 73 63.373 65.982 -2.609 1
1 391 . 12 1 1 A 35 35 SER N N 73 118.284 114.371 3.913 1
1 392 . 12 1 1 A 36 36 THR H H 74 8.591 8.849 -0.258 1
1 393 . 12 1 1 A 36 36 THR HA H 74 3.649 4.172 -0.523 1
1 398 . 12 1 1 A 36 36 THR CA C 74 64.623 64.126 0.497 1
1 399 . 12 1 1 A 36 36 THR CB C 74 66.498 69.172 -2.674 1
1 401 . 12 1 1 A 36 36 THR N N 74 117.769 117.387 0.382 1
1 402 . 12 1 1 A 37 37 GLN H H 75 8.210 7.784 0.426 1
1 403 . 12 1 1 A 37 37 GLN HA H 75 3.860 4.400 -0.540 1
1 410 . 12 1 1 A 37 37 GLN C C 75 175.349 177.696 -2.347 1
1 411 . 12 1 1 A 37 37 GLN CA C 75 56.499 57.802 -1.303 1
1 412 . 12 1 1 A 37 37 GLN CB C 75 25.876 29.540 -3.664 1
1 414 . 12 1 1 A 37 37 GLN N N 75 117.931 119.644 -1.713 1
1 416 . 12 1 1 A 38 38 GLN H H 76 7.667 8.124 -0.457 1
1 417 . 12 1 1 A 38 38 GLN HA H 76 3.810 4.091 -0.281 1
1 424 . 12 1 1 A 38 38 GLN C C 76 175.805 179.573 -3.768 1
1 425 . 12 1 1 A 38 38 GLN CA C 76 55.874 58.580 -2.706 1
1 426 . 12 1 1 A 38 38 GLN CB C 76 25.876 28.319 -2.443 1
1 428 . 12 1 1 A 38 38 GLN N N 76 120.607 118.308 2.299 1
1 430 . 12 1 1 A 39 39 GLY H H 77 8.470 8.161 0.309 1
1 431 . 12 1 1 A 39 39 GLY HA2 H 77 3.920 3.699 0.221 1
1 432 . 12 1 1 A 39 39 GLY HA3 H 77 3.603 3.713 -0.110 1
1 433 . 12 1 1 A 39 39 GLY C C 77 169.006 175.380 -6.374 1
1 434 . 12 1 1 A 39 39 GLY CA C 77 42.125 46.600 -4.475 1
1 435 . 12 1 1 A 39 39 GLY N N 77 103.281 109.222 -5.941 1
1 436 . 12 1 1 A 40 40 LEU H H 78 8.135 7.754 0.381 1
1 437 . 12 1 1 A 40 40 LEU HA H 78 3.237 4.121 -0.884 1
1 447 . 12 1 1 A 40 40 LEU C C 78 176.383 178.654 -2.271 1
1 448 . 12 1 1 A 40 40 LEU CA C 78 52.749 57.138 -4.389 1
1 449 . 12 1 1 A 40 40 LEU CB C 78 39.000 41.465 -2.465 1
1 453 . 12 1 1 A 40 40 LEU N N 78 114.444 123.230 -8.786 1
1 454 . 12 1 1 A 41 41 GLU H H 79 8.578 7.972 0.606 1
1 455 . 12 1 1 A 41 41 GLU HA H 79 3.720 4.309 -0.589 1
1 460 . 12 1 1 A 41 41 GLU C C 79 175.093 177.361 -2.268 1
1 461 . 12 1 1 A 41 41 GLU CA C 79 57.124 58.227 -1.103 1
1 462 . 12 1 1 A 41 41 GLU CB C 79 26.501 29.318 -2.817 1
1 464 . 12 1 1 A 41 41 GLU N N 79 118.295 118.427 -0.132 1
1 465 . 12 1 1 A 42 42 ALA H H 80 7.227 7.487 -0.260 1
1 466 . 12 1 1 A 42 42 ALA HA H 80 4.437 4.635 -0.198 1
1 470 . 12 1 1 A 42 42 ALA C C 80 173.745 178.327 -4.582 1
1 471 . 12 1 1 A 42 42 ALA CA C 80 51.499 52.577 -1.078 1
1 472 . 12 1 1 A 42 42 ALA CB C 80 15.877 19.853 -3.976 1
1 473 . 12 1 1 A 42 42 ALA N N 80 119.751 121.198 -1.447 1
1 474 . 12 1 1 A 43 43 LEU H H 81 7.932 7.413 0.519 1
1 475 . 12 1 1 A 43 43 LEU HA H 81 4.369 4.478 -0.109 1
1 485 . 12 1 1 A 43 43 LEU C C 81 174.788 178.086 -3.298 1
1 486 . 12 1 1 A 43 43 LEU CA C 81 53.374 55.989 -2.615 1
1 487 . 12 1 1 A 43 43 LEU CB C 81 39.625 42.379 -2.754 1
1 491 . 12 1 1 A 43 43 LEU N N 81 111.742 116.059 -4.317 1
1 492 . 12 1 1 A 44 44 VAL H H 82 7.886 7.596 0.290 1
1 493 . 12 1 1 A 44 44 VAL HA H 82 4.700 4.370 0.330 1
1 501 . 12 1 1 A 44 44 VAL C C 82 172.875 175.782 -2.907 1
1 502 . 12 1 1 A 44 44 VAL CA C 82 59.624 63.774 -4.150 1
1 503 . 12 1 1 A 44 44 VAL CB C 82 31.501 33.044 -1.543 1
1 506 . 12 1 1 A 44 44 VAL N N 82 113.604 115.626 -2.022 1
1 507 . 12 1 1 A 45 45 LYS H H 83 8.361 7.610 0.751 1
1 508 . 12 1 1 A 45 45 LYS HA H 83 4.251 4.833 -0.582 1
1 515 . 12 1 1 A 45 45 LYS C C 83 171.053 174.677 -3.624 1
1 516 . 12 1 1 A 45 45 LYS CA C 83 52.749 54.378 -1.629 1
1 517 . 12 1 1 A 45 45 LYS CB C 83 33.375 36.055 -2.680 1
1 521 . 12 1 1 A 45 45 LYS N N 83 123.860 122.348 1.512 1
1 522 . 12 1 1 A 46 46 LYS H H 84 7.243 7.931 -0.688 1
1 523 . 12 1 1 A 46 46 LYS HA H 84 2.175 2.832 -0.657 1
1 532 . 12 1 1 A 46 46 LYS C C 84 172.123 174.510 -2.387 1
1 533 . 12 1 1 A 46 46 LYS CA C 84 52.749 54.323 -1.574 1
1 534 . 12 1 1 A 46 46 LYS CB C 84 29.626 31.711 -2.085 1
1 537 . 12 1 1 A 46 46 LYS N N 84 128.615 124.026 4.589 1
1 538 . 12 1 1 A 47 47 PRO HA H 85 4.470 4.320 0.150 1
1 541 . 12 1 1 A 47 47 PRO C C 85 173.754 176.280 -2.526 1
1 542 . 12 1 1 A 47 47 PRO CA C 85 60.874 63.246 -2.372 1
1 543 . 12 1 1 A 47 47 PRO CB C 85 30.876 31.962 -1.086 1
1 546 . 12 1 1 A 48 48 THR H H 86 8.306 8.378 -0.072 1
1 547 . 12 1 1 A 48 48 THR HA H 86 4.287 4.410 -0.123 1
1 552 . 12 1 1 A 48 48 THR C C 86 173.070 174.666 -1.596 1
1 553 . 12 1 1 A 48 48 THR CA C 86 57.749 63.472 -5.723 1
1 554 . 12 1 1 A 48 48 THR CB C 86 67.748 69.241 -1.493 1
1 556 . 12 1 1 A 48 48 THR N N 86 109.564 117.497 -7.933 1
1 557 . 12 1 1 A 49 49 GLY H H 87 8.317 8.421 -0.104 1
1 558 . 12 1 1 A 49 49 GLY HA2 H 87 3.851 4.077 -0.226 1
1 559 . 12 1 1 A 49 49 GLY HA3 H 87 3.678 4.083 -0.405 1
1 560 . 12 1 1 A 49 49 GLY C C 87 169.693 172.749 -3.056 1
1 561 . 12 1 1 A 49 49 GLY CA C 87 42.125 44.481 -2.356 1
1 562 . 12 1 1 A 49 49 GLY N N 87 109.071 114.684 -5.613 1
1 563 . 12 1 1 A 50 50 ASN H H 88 8.301 8.589 -0.288 1
1 564 . 12 1 1 A 50 50 ASN HA H 88 4.780 5.303 -0.523 1
1 569 . 12 1 1 A 50 50 ASN C C 88 171.370 174.322 -2.952 1
1 570 . 12 1 1 A 50 50 ASN CA C 88 47.749 49.528 -1.779 1
1 571 . 12 1 1 A 50 50 ASN CB C 88 37.125 39.693 -2.568 1
1 572 . 12 1 1 A 50 50 ASN N N 88 115.631 120.012 -4.381 1
1 574 . 12 1 1 A 51 51 PRO HA H 89 4.782 4.612 0.170 1
1 577 . 12 1 1 A 51 51 PRO C C 89 173.656 176.072 -2.416 1
1 578 . 12 1 1 A 51 51 PRO CA C 89 59.624 62.120 -2.496 1
1 579 . 12 1 1 A 51 51 PRO CB C 89 31.501 32.580 -1.079 1
1 582 . 12 1 1 A 52 52 GLN H H 90 9.076 8.984 0.092 1
1 583 . 12 1 1 A 52 52 GLN HA H 90 4.469 4.778 -0.309 1
1 590 . 12 1 1 A 52 52 GLN C C 90 172.386 174.179 -1.793 1
1 591 . 12 1 1 A 52 52 GLN CA C 90 50.874 54.060 -3.186 1
1 592 . 12 1 1 A 52 52 GLN CB C 90 26.501 27.656 -1.155 1
1 594 . 12 1 1 A 52 52 GLN N N 90 126.827 119.703 7.124 1
1 596 . 12 1 1 A 53 53 PRO HA H 91 4.384 4.658 -0.274 1
1 599 . 12 1 1 A 53 53 PRO C C 91 174.274 175.255 -0.981 1
1 600 . 12 1 1 A 53 53 PRO CB C 91 28.113 31.440 -3.327 1
1 601 . 12 1 1 A 54 54 LYS H H 92 8.401 8.352 0.049 1
1 602 . 12 1 1 A 54 54 LYS HA H 92 3.984 4.729 -0.745 1
1 611 . 12 1 1 A 54 54 LYS C C 92 173.516 174.772 -1.256 1
1 612 . 12 1 1 A 54 54 LYS CA C 92 55.249 55.345 -0.096 1
1 613 . 12 1 1 A 54 54 LYS CB C 92 30.876 35.886 -5.010 1
1 615 . 12 1 1 A 54 54 LYS N N 92 124.538 124.199 0.339 1
1 616 . 12 1 1 A 55 55 ASN H H 93 8.183 8.745 -0.562 1
1 617 . 12 1 1 A 55 55 ASN HA H 93 4.716 4.913 -0.197 1
1 622 . 12 1 1 A 55 55 ASN CA C 93 48.999 53.166 -4.167 1
1 623 . 12 1 1 A 55 55 ASN CB C 93 35.875 37.367 -1.492 1
1 624 . 12 1 1 A 55 55 ASN N N 93 118.677 122.863 -4.186 1
1 626 . 12 1 1 A 56 56 TRP H H 94 8.007 8.789 -0.782 1
1 627 . 12 1 1 A 56 56 TRP HA H 94 3.827 5.154 -1.327 1
1 635 . 12 1 1 A 56 56 TRP C C 94 173.760 175.148 -1.388 1
1 636 . 12 1 1 A 56 56 TRP CA C 94 59.624 59.304 0.320 1
1 637 . 12 1 1 A 56 56 TRP CB C 94 27.126 30.372 -3.246 1
1 638 . 12 1 1 A 56 56 TRP N N 94 122.195 127.541 -5.346 1
1 640 . 12 1 1 A 57 57 ASN H H 95 7.563 7.689 -0.126 1
1 641 . 12 1 1 A 57 57 ASN HA H 95 3.735 4.945 -1.210 1
1 646 . 12 1 1 A 57 57 ASN C C 95 171.952 173.852 -1.900 1
1 647 . 12 1 1 A 57 57 ASN CA C 95 51.499 50.636 0.863 1
1 648 . 12 1 1 A 57 57 ASN CB C 95 35.250 41.045 -5.795 1
1 649 . 12 1 1 A 57 57 ASN N N 95 129.659 125.366 4.293 1
1 651 . 12 1 1 A 58 58 LYS H H 96 8.110 8.057 0.053 1
1 652 . 12 1 1 A 58 58 LYS HA H 96 4.035 3.495 0.540 1
1 659 . 12 1 1 A 58 58 LYS C C 96 174.530 175.566 -1.036 1
1 660 . 12 1 1 A 58 58 LYS CA C 96 56.499 55.111 1.388 1
1 661 . 12 1 1 A 58 58 LYS CB C 96 29.626 33.099 -3.473 1
1 665 . 12 1 1 A 58 58 LYS N N 96 123.913 123.644 0.269 1
1 666 . 12 1 1 A 59 59 ASP H H 97 7.903 8.983 -1.080 1
1 667 . 12 1 1 A 59 59 ASP HA H 97 4.393 4.306 0.087 1
1 670 . 12 1 1 A 59 59 ASP C C 97 173.724 174.768 -1.044 1
1 671 . 12 1 1 A 59 59 ASP CA C 97 52.124 54.871 -2.747 1
1 672 . 12 1 1 A 59 59 ASP CB C 97 38.375 39.699 -1.324 1
1 673 . 12 1 1 A 59 59 ASP N N 97 118.773 119.883 -1.110 1
1 674 . 12 1 1 A 60 60 GLY H H 98 7.819 7.927 -0.108 1
1 675 . 12 1 1 A 60 60 GLY HA2 H 98 3.917 2.746 1.171 1
1 676 . 12 1 1 A 60 60 GLY HA3 H 98 3.917 3.543 0.374 1
1 677 . 12 1 1 A 60 60 GLY C C 98 168.652 174.058 -5.406 1
1 678 . 12 1 1 A 60 60 GLY CA C 98 41.500 44.837 -3.337 1
1 679 . 12 1 1 A 60 60 GLY N N 98 108.742 104.490 4.252 1
1 680 . 12 1 1 A 61 61 TYR H H 99 8.105 7.505 0.600 1
1 681 . 12 1 1 A 61 61 TYR HA H 99 3.927 4.348 -0.421 1
1 689 . 12 1 1 A 61 61 TYR C C 99 172.831 174.084 -1.253 1
1 690 . 12 1 1 A 61 61 TYR CA C 99 57.124 57.990 -0.866 1
1 691 . 12 1 1 A 61 61 TYR CB C 99 37.125 36.700 0.425 1
1 692 . 12 1 1 A 61 61 TYR N N 99 113.836 114.637 -0.801 1
1 693 . 12 1 1 A 62 62 LEU H H 100 7.352 7.795 -0.443 1
1 694 . 12 1 1 A 62 62 LEU HA H 100 4.343 4.753 -0.410 1
1 704 . 12 1 1 A 62 62 LEU C C 100 173.430 175.772 -2.342 1
1 705 . 12 1 1 A 62 62 LEU CA C 100 50.874 53.207 -2.333 1
1 706 . 12 1 1 A 62 62 LEU CB C 100 44.000 45.753 -1.753 1
1 710 . 12 1 1 A 62 62 LEU N N 100 117.112 121.492 -4.380 1
1 711 . 12 1 1 A 63 63 LYS H H 101 8.626 8.225 0.401 1
1 712 . 12 1 1 A 63 63 LYS HA H 101 3.986 4.111 -0.125 1
1 721 . 12 1 1 A 63 63 LYS C C 101 173.851 176.551 -2.700 1
1 722 . 12 1 1 A 63 63 LYS CA C 101 55.249 56.818 -1.569 1
1 723 . 12 1 1 A 63 63 LYS CB C 101 29.626 32.882 -3.256 1
1 724 . 12 1 1 A 63 63 LYS N N 101 129.991 122.789 7.202 1
1 725 . 12 1 1 A 64 64 LYS H H 102 7.059 8.505 -1.446 1
1 726 . 12 1 1 A 64 64 LYS HA H 102 4.138 4.340 -0.202 1
1 735 . 12 1 1 A 64 64 LYS C C 102 171.120 174.521 -3.401 1
1 736 . 12 1 1 A 64 64 LYS CA C 102 52.749 55.865 -3.116 1
1 737 . 12 1 1 A 64 64 LYS CB C 102 32.750 31.026 1.724 1
1 740 . 12 1 1 A 64 64 LYS N N 102 113.255 122.879 -9.624 1
1 741 . 12 1 1 A 65 65 LEU H H 103 8.883 8.039 0.844 1
1 742 . 12 1 1 A 65 65 LEU HA H 103 4.475 4.744 -0.269 1
1 752 . 12 1 1 A 65 65 LEU C C 103 171.487 174.099 -2.612 1
1 753 . 12 1 1 A 65 65 LEU CA C 103 48.999 51.144 -2.145 1
1 754 . 12 1 1 A 65 65 LEU CB C 103 39.625 45.035 -5.410 1
1 758 . 12 1 1 A 65 65 LEU N N 103 126.355 126.868 -0.513 1
1 759 . 12 1 1 A 66 66 PRO HA H 104 4.449 4.604 -0.155 1
1 764 . 12 1 1 A 66 66 PRO C C 104 173.363 176.275 -2.912 1
1 765 . 12 1 1 A 66 66 PRO CA C 104 60.249 62.355 -2.106 1
1 766 . 12 1 1 A 66 66 PRO CB C 104 29.626 32.702 -3.076 1
1 769 . 12 1 1 A 67 67 VAL H H 105 7.682 8.388 -0.706 1
1 770 . 12 1 1 A 67 67 VAL HA H 105 4.121 4.370 -0.249 1
1 778 . 12 1 1 A 67 67 VAL C C 105 171.667 174.906 -3.239 1
1 779 . 12 1 1 A 67 67 VAL CA C 105 58.374 61.256 -2.882 1
1 780 . 12 1 1 A 67 67 VAL CB C 105 30.251 32.873 -2.622 1
1 783 . 12 1 1 A 67 67 VAL N N 105 114.671 121.211 -6.540 1
1 784 . 12 1 1 A 68 68 ASP H H 106 8.216 8.514 -0.298 1
1 785 . 12 1 1 A 68 68 ASP HA H 106 4.474 4.710 -0.236 1
1 788 . 12 1 1 A 68 68 ASP C C 106 172.452 175.418 -2.966 1
1 789 . 12 1 1 A 68 68 ASP CA C 106 50.249 52.135 -1.886 1
1 790 . 12 1 1 A 68 68 ASP CB C 106 37.750 41.016 -3.266 1
1 791 . 12 1 1 A 68 68 ASP N N 106 123.825 125.506 -1.681 1
1 792 . 12 1 1 A 69 69 PRO HA H 107 3.920 4.064 -0.144 1
1 797 . 12 1 1 A 69 69 PRO CA C 107 62.123 63.218 -1.095 1
1 798 . 12 1 1 A 69 69 PRO CB C 107 27.751 31.473 -3.722 1
1 801 . 12 1 1 A 70 70 TRP H H 108 8.156 8.431 -0.275 1
1 802 . 12 1 1 A 70 70 TRP HA H 108 4.274 4.293 -0.019 1
1 811 . 12 1 1 A 70 70 TRP CA C 108 57.124 58.508 -1.384 1
1 812 . 12 1 1 A 70 70 TRP CB C 108 25.251 27.151 -1.900 1
1 813 . 12 1 1 A 70 70 TRP N N 108 118.137 118.057 0.080 1
1 815 . 12 1 1 A 71 71 GLY H H 109 8.209 8.755 -0.546 1
1 816 . 12 1 1 A 71 71 GLY HA2 H 109 4.030 3.868 0.162 1
1 817 . 12 1 1 A 71 71 GLY HA3 H 109 3.303 3.889 -0.586 1
1 818 . 12 1 1 A 71 71 GLY CA C 109 42.750 46.120 -3.370 1
1 819 . 12 1 1 A 71 71 GLY N N 109 107.495 105.490 2.005 1
1 820 . 12 1 1 A 72 72 ASN H H 110 8.116 7.867 0.249 1
1 821 . 12 1 1 A 72 72 ASN HA H 110 5.103 4.956 0.147 1
1 826 . 12 1 1 A 72 72 ASN CA C 110 48.374 50.399 -2.025 1
1 827 . 12 1 1 A 72 72 ASN CB C 110 36.500 38.768 -2.268 1
1 828 . 12 1 1 A 72 72 ASN N N 110 120.108 119.982 0.126 1
1 830 . 12 1 1 A 73 73 PRO HA H 111 4.397 4.556 -0.159 1
1 835 . 12 1 1 A 73 73 PRO C C 111 176.229 176.049 0.180 1
1 836 . 12 1 1 A 73 73 PRO CA C 111 60.249 62.389 -2.140 1
1 837 . 12 1 1 A 73 73 PRO CB C 111 29.001 32.150 -3.149 1
1 840 . 12 1 1 A 74 74 TYR H H 112 8.893 8.531 0.362 1
1 841 . 12 1 1 A 74 74 TYR HA H 112 4.064 4.720 -0.656 1
1 849 . 12 1 1 A 74 74 TYR C C 112 171.951 175.694 -3.743 1
1 850 . 12 1 1 A 74 74 TYR CA C 112 60.249 58.225 2.024 1
1 851 . 12 1 1 A 74 74 TYR CB C 112 36.500 39.408 -2.908 1
1 852 . 12 1 1 A 74 74 TYR N N 112 124.595 120.880 3.715 1
1 853 . 12 1 1 A 75 75 GLN H H 113 9.127 8.943 0.184 1
1 854 . 12 1 1 A 75 75 GLN HA H 113 4.019 4.333 -0.314 1
1 861 . 12 1 1 A 75 75 GLN C C 113 171.436 174.130 -2.694 1
1 862 . 12 1 1 A 75 75 GLN CA C 113 50.874 54.535 -3.661 1
1 863 . 12 1 1 A 75 75 GLN CB C 113 29.469 29.763 -0.294 1
1 865 . 12 1 1 A 75 75 GLN N N 113 120.777 121.836 -1.059 1
1 867 . 12 1 1 A 76 76 TYR H H 114 7.906 8.532 -0.626 1
1 868 . 12 1 1 A 76 76 TYR HA H 114 5.586 5.102 0.484 1
1 875 . 12 1 1 A 76 76 TYR C C 114 171.343 175.326 -3.983 1
1 876 . 12 1 1 A 76 76 TYR CA C 114 53.999 56.783 -2.784 1
1 877 . 12 1 1 A 76 76 TYR CB C 114 40.250 39.804 0.446 1
1 878 . 12 1 1 A 76 76 TYR N N 114 120.757 122.865 -2.108 1
1 879 . 12 1 1 A 77 77 LEU H H 115 8.261 8.851 -0.590 1
1 880 . 12 1 1 A 77 77 LEU HA H 115 4.280 5.143 -0.863 1
1 890 . 12 1 1 A 77 77 LEU C C 115 170.921 175.808 -4.887 1
1 891 . 12 1 1 A 77 77 LEU CA C 115 51.499 53.560 -2.061 1
1 892 . 12 1 1 A 77 77 LEU CB C 115 44.625 45.550 -0.925 1
1 896 . 12 1 1 A 77 77 LEU N N 115 130.662 124.747 5.915 1
1 897 . 12 1 1 A 78 78 ALA H H 116 7.973 8.353 -0.380 1
1 898 . 12 1 1 A 78 78 ALA HA H 116 4.292 4.639 -0.347 1
1 902 . 12 1 1 A 78 78 ALA C C 116 172.093 174.891 -2.798 1
1 903 . 12 1 1 A 78 78 ALA CA C 116 47.749 49.940 -2.191 1
1 904 . 12 1 1 A 78 78 ALA CB C 116 19.626 20.465 -0.839 1
1 905 . 12 1 1 A 78 78 ALA N N 116 125.564 125.356 0.208 1
1 906 . 12 1 1 A 79 79 PRO HA H 117 4.698 4.880 -0.182 1
1 911 . 12 1 1 A 79 79 PRO C C 117 173.994 176.729 -2.735 1
1 912 . 12 1 1 A 79 79 PRO CA C 117 60.249 63.732 -3.483 1
1 913 . 12 1 1 A 79 79 PRO CB C 117 31.501 31.829 -0.328 1
1 916 . 12 1 1 A 80 80 GLY H H 118 7.096 8.424 -1.328 1
1 917 . 12 1 1 A 80 80 GLY HA2 H 118 3.797 4.066 -0.269 1
1 918 . 12 1 1 A 80 80 GLY HA3 H 118 3.517 4.076 -0.559 1
1 919 . 12 1 1 A 80 80 GLY C C 118 171.404 174.303 -2.899 1
1 920 . 12 1 1 A 80 80 GLY CA C 118 41.500 46.127 -4.627 1
1 921 . 12 1 1 A 80 80 GLY N N 118 108.306 107.317 0.989 1
1 922 . 12 1 1 A 81 81 THR H H 119 9.810 8.237 1.573 1
1 923 . 12 1 1 A 81 81 THR HA H 119 4.091 4.473 -0.382 1
1 928 . 12 1 1 A 81 81 THR C C 119 174.242 175.460 -1.218 1
1 929 . 12 1 1 A 81 81 THR CA C 119 60.874 62.574 -1.700 1
1 930 . 12 1 1 A 81 81 THR CB C 119 66.498 68.266 -1.768 1
1 932 . 12 1 1 A 81 81 THR N N 119 112.813 115.598 -2.785 1
1 933 . 12 1 1 A 82 82 LYS H H 120 8.964 8.270 0.694 1
1 934 . 12 1 1 A 82 82 LYS HA H 120 4.150 4.251 -0.101 1
1 941 . 12 1 1 A 82 82 LYS C C 120 172.886 175.424 -2.538 1
1 942 . 12 1 1 A 82 82 LYS CA C 120 53.999 57.711 -3.712 1
1 943 . 12 1 1 A 82 82 LYS CB C 120 30.876 30.535 0.341 1
1 944 . 12 1 1 A 82 82 LYS N N 120 123.569 124.367 -0.798 1
1 945 . 12 1 1 A 83 83 GLY H H 121 7.125 8.007 -0.882 1
1 946 . 12 1 1 A 83 83 GLY HA2 H 121 3.814 4.096 -0.282 1
1 947 . 12 1 1 A 83 83 GLY HA3 H 121 3.814 4.102 -0.288 1
1 948 . 12 1 1 A 83 83 GLY C C 121 167.671 174.476 -6.805 1
1 949 . 12 1 1 A 83 83 GLY CA C 121 42.125 45.067 -2.942 1
1 950 . 12 1 1 A 83 83 GLY N N 121 107.253 108.030 -0.777 1
1 951 . 12 1 1 A 84 84 PRO HA H 122 4.077 4.354 -0.277 1
1 958 . 12 1 1 A 84 84 PRO C C 122 175.199 176.732 -1.533 1
1 959 . 12 1 1 A 84 84 PRO CA C 122 63.373 64.689 -1.316 1
1 960 . 12 1 1 A 84 84 PRO CB C 122 30.251 31.828 -1.577 1
1 962 . 12 1 1 A 85 85 PHE H H 123 6.652 6.583 0.069 1
1 963 . 12 1 1 A 85 85 PHE HA H 123 4.744 4.633 0.111 1
1 971 . 12 1 1 A 85 85 PHE C C 123 170.340 171.780 -1.440 1
1 972 . 12 1 1 A 85 85 PHE CA C 123 53.999 56.298 -2.299 1
1 973 . 12 1 1 A 85 85 PHE CB C 123 39.000 40.145 -1.145 1
1 974 . 12 1 1 A 85 85 PHE N N 123 108.468 111.833 -3.365 1
1 975 . 12 1 1 A 86 86 ASP H H 124 9.268 8.339 0.929 1
1 976 . 12 1 1 A 86 86 ASP HA H 124 5.108 3.541 1.567 1
1 979 . 12 1 1 A 86 86 ASP C C 124 171.180 174.311 -3.131 1
1 980 . 12 1 1 A 86 86 ASP CA C 124 50.249 52.907 -2.658 1
1 981 . 12 1 1 A 86 86 ASP CB C 124 40.250 41.706 -1.456 1
1 982 . 12 1 1 A 86 86 ASP N N 124 121.741 119.353 2.388 1
1 983 . 12 1 1 A 87 87 LEU H H 125 8.018 7.930 0.088 1
1 984 . 12 1 1 A 87 87 LEU HA H 125 5.809 5.394 0.415 1
1 994 . 12 1 1 A 87 87 LEU C C 125 171.350 174.791 -3.441 1
1 995 . 12 1 1 A 87 87 LEU CA C 125 50.874 53.378 -2.504 1
1 996 . 12 1 1 A 87 87 LEU CB C 125 44.318 46.027 -1.709 1
1 999 . 12 1 1 A 87 87 LEU N N 125 123.629 127.068 -3.439 1
1 1000 . 12 1 1 A 88 88 TYR H H 126 8.912 8.456 0.456 1
1 1001 . 12 1 1 A 88 88 TYR HA H 126 5.630 5.598 0.032 1
1 1008 . 12 1 1 A 88 88 TYR C C 126 171.410 172.181 -0.771 1
1 1009 . 12 1 1 A 88 88 TYR CA C 126 52.749 56.537 -3.788 1
1 1010 . 12 1 1 A 88 88 TYR CB C 126 37.750 40.462 -2.712 1
1 1011 . 12 1 1 A 88 88 TYR N N 126 119.697 121.449 -1.752 1
1 1012 . 12 1 1 A 89 89 SER H H 127 9.319 9.409 -0.090 1
1 1013 . 12 1 1 A 89 89 SER HA H 127 5.429 5.182 0.247 1
1 1016 . 12 1 1 A 89 89 SER CA C 127 52.124 56.150 -4.026 1
1 1017 . 12 1 1 A 89 89 SER CB C 127 62.748 65.731 -2.983 1
1 1018 . 12 1 1 A 89 89 SER N N 127 112.637 115.690 -3.053 1
1 1019 . 12 1 1 A 90 90 LEU H H 128 8.759 8.456 0.303 1
1 1020 . 12 1 1 A 90 90 LEU HA H 128 4.186 4.418 -0.232 1
1 1030 . 12 1 1 A 90 90 LEU C C 128 175.121 178.368 -3.247 1
1 1031 . 12 1 1 A 90 90 LEU CA C 128 52.749 55.400 -2.651 1
1 1032 . 12 1 1 A 90 90 LEU CB C 128 35.875 42.149 -6.274 1
1 1033 . 12 1 1 A 90 90 LEU N N 128 126.728 126.833 -0.105 1
1 1034 . 12 1 1 A 91 91 GLY H H 129 8.356 8.140 0.216 1
1 1035 . 12 1 1 A 91 91 GLY HA2 H 129 3.373 3.781 -0.408 1
1 1036 . 12 1 1 A 91 91 GLY HA3 H 129 3.373 3.914 -0.541 1
1 1037 . 12 1 1 A 91 91 GLY C C 129 172.013 174.498 -2.485 1
1 1038 . 12 1 1 A 91 91 GLY CA C 129 41.500 43.886 -2.386 1
1 1039 . 12 1 1 A 91 91 GLY N N 129 108.559 108.846 -0.287 1
1 1040 . 12 1 1 A 92 92 ALA H H 130 7.047 8.354 -1.307 1
1 1041 . 12 1 1 A 92 92 ALA HA H 130 4.037 2.622 1.415 1
1 1045 . 12 1 1 A 92 92 ALA C C 130 174.890 177.837 -2.947 1
1 1046 . 12 1 1 A 92 92 ALA CA C 130 52.100 53.877 -1.777 1
1 1047 . 12 1 1 A 92 92 ALA CB C 130 16.502 17.699 -1.197 1
1 1048 . 12 1 1 A 92 92 ALA N N 130 118.393 122.060 -3.667 1
1 1049 . 12 1 1 A 93 93 ASP H H 131 7.222 7.990 -0.768 1
1 1050 . 12 1 1 A 93 93 ASP HA H 131 4.122 4.455 -0.333 1
1 1053 . 12 1 1 A 93 93 ASP C C 131 174.890 176.522 -1.632 1
1 1054 . 12 1 1 A 93 93 ASP CA C 131 50.249 53.051 -2.802 1
1 1055 . 12 1 1 A 93 93 ASP CB C 131 37.750 40.123 -2.373 1
1 1056 . 12 1 1 A 93 93 ASP N N 131 111.487 111.307 0.180 1
1 1057 . 12 1 1 A 94 94 GLY H H 132 7.199 9.510 -2.311 1
1 1058 . 12 1 1 A 94 94 GLY HA2 H 132 3.951 3.867 0.084 1
1 1059 . 12 1 1 A 94 94 GLY HA3 H 132 3.324 3.871 -0.547 1
1 1060 . 12 1 1 A 94 94 GLY C C 132 169.773 173.664 -3.891 1
1 1061 . 12 1 1 A 94 94 GLY CA C 132 44.625 45.677 -1.052 1
1 1062 . 12 1 1 A 94 94 GLY N N 132 106.932 111.255 -4.323 1
1 1063 . 12 1 1 A 95 95 LYS H H 133 7.215 7.523 -0.308 1
1 1064 . 12 1 1 A 95 95 LYS HA H 133 4.513 4.952 -0.439 1
1 1073 . 12 1 1 A 95 95 LYS C C 133 172.108 174.674 -2.566 1
1 1074 . 12 1 1 A 95 95 LYS CA C 133 51.512 54.764 -3.252 1
1 1075 . 12 1 1 A 95 95 LYS CB C 133 34.000 35.895 -1.895 1
1 1076 . 12 1 1 A 95 95 LYS N N 133 115.749 119.693 -3.944 1
1 1077 . 12 1 1 A 96 96 GLU H H 134 9.230 8.656 0.574 1
1 1078 . 12 1 1 A 96 96 GLU HA H 134 4.352 4.625 -0.273 1
1 1083 . 12 1 1 A 96 96 GLU C C 134 175.219 176.251 -1.032 1
1 1084 . 12 1 1 A 96 96 GLU CA C 134 55.874 56.069 -0.195 1
1 1085 . 12 1 1 A 96 96 GLU CB C 134 27.126 30.230 -3.104 1
1 1087 . 12 1 1 A 96 96 GLU N N 134 128.571 123.027 5.544 1
1 1088 . 12 1 1 A 97 97 GLY H H 135 10.677 8.551 2.126 1
1 1089 . 12 1 1 A 97 97 GLY HA2 H 135 4.037 4.318 -0.281 1
1 1090 . 12 1 1 A 97 97 GLY HA3 H 135 3.717 4.322 -0.605 1
1 1091 . 12 1 1 A 97 97 GLY C C 135 171.567 172.267 -0.700 1
1 1092 . 12 1 1 A 97 97 GLY CA C 135 41.500 45.688 -4.188 1
1 1093 . 12 1 1 A 97 97 GLY N N 135 117.011 110.267 6.744 1
1 1094 . 12 1 1 A 98 98 GLY H H 136 8.442 8.630 -0.188 1
1 1095 . 12 1 1 A 98 98 GLY HA2 H 136 4.195 4.192 0.003 1
1 1096 . 12 1 1 A 98 98 GLY HA3 H 136 4.195 4.196 -0.001 1
1 1097 . 12 1 1 A 98 98 GLY C C 136 170.299 172.887 -2.588 1
1 1098 . 12 1 1 A 98 98 GLY CA C 136 40.875 44.726 -3.851 1
1 1099 . 12 1 1 A 98 98 GLY N N 136 109.494 109.221 0.273 1
1 1100 . 12 1 1 A 99 99 SER H H 137 8.701 8.445 0.256 1
1 1101 . 12 1 1 A 99 99 SER HA H 137 4.639 4.845 -0.206 1
1 1104 . 12 1 1 A 99 99 SER C C 137 170.630 173.200 -2.570 1
1 1105 . 12 1 1 A 99 99 SER CA C 137 54.624 56.658 -2.034 1
1 1106 . 12 1 1 A 99 99 SER CB C 137 62.748 64.735 -1.987 1
1 1107 . 12 1 1 A 99 99 SER N N 137 114.685 117.597 -2.912 1
1 1108 . 12 1 1 A 100 100 ASP H H 138 9.117 8.916 0.201 1
1 1109 . 12 1 1 A 100 100 ASP HA H 138 3.965 4.416 -0.451 1
1 1112 . 12 1 1 A 100 100 ASP C C 138 175.540 178.143 -2.603 1
1 1113 . 12 1 1 A 100 100 ASP CA C 138 54.624 57.150 -2.526 1
1 1114 . 12 1 1 A 100 100 ASP CB C 138 36.500 40.686 -4.186 1
1 1115 . 12 1 1 A 100 100 ASP N N 138 120.777 123.748 -2.971 1
1 1116 . 12 1 1 A 101 101 ASN H H 139 8.667 8.390 0.277 1
1 1117 . 12 1 1 A 101 101 ASN HA H 139 4.333 4.754 -0.421 1
1 1122 . 12 1 1 A 101 101 ASN CA C 139 53.999 53.447 0.552 1
1 1123 . 12 1 1 A 101 101 ASN CB C 139 34.625 39.031 -4.406 1
1 1124 . 12 1 1 A 101 101 ASN N N 139 121.930 115.210 6.720 1
1 1126 . 12 1 1 A 102 102 ASP H H 140 7.714 7.798 -0.084 1
1 1127 . 12 1 1 A 102 102 ASP HA H 140 4.037 4.526 -0.489 1
1 1130 . 12 1 1 A 102 102 ASP C C 140 172.807 176.038 -3.231 1
1 1131 . 12 1 1 A 102 102 ASP CA C 140 53.374 54.215 -0.841 1
1 1132 . 12 1 1 A 102 102 ASP CB C 140 37.125 41.423 -4.298 1
1 1133 . 12 1 1 A 102 102 ASP N N 140 118.011 118.100 -0.089 1
1 1134 . 12 1 1 A 103 103 ALA H H 141 7.060 7.269 -0.209 1
1 1135 . 12 1 1 A 103 103 ALA HA H 141 3.353 4.805 -1.452 1
1 1139 . 12 1 1 A 103 103 ALA C C 141 172.233 176.533 -4.300 1
1 1140 . 12 1 1 A 103 103 ALA CA C 141 49.624 51.370 -1.746 1
1 1141 . 12 1 1 A 103 103 ALA CB C 141 16.502 20.484 -3.982 1
1 1142 . 12 1 1 A 103 103 ALA N N 141 125.777 122.609 3.168 1
1 1143 . 12 1 1 A 104 104 ASP H H 142 7.973 8.334 -0.361 1
1 1144 . 12 1 1 A 104 104 ASP HA H 142 4.420 5.062 -0.642 1
1 1147 . 12 1 1 A 104 104 ASP C C 142 174.188 176.076 -1.888 1
1 1148 . 12 1 1 A 104 104 ASP CA C 142 52.124 53.667 -1.543 1
1 1149 . 12 1 1 A 104 104 ASP CB C 142 37.125 41.264 -4.139 1
1 1150 . 12 1 1 A 104 104 ASP N N 142 122.965 120.348 2.617 1
1 1151 . 12 1 1 A 105 105 ILE H H 143 8.534 8.675 -0.141 1
1 1152 . 12 1 1 A 105 105 ILE HA H 143 4.060 4.900 -0.840 1
1 1162 . 12 1 1 A 105 105 ILE C C 143 173.235 176.110 -2.875 1
1 1163 . 12 1 1 A 105 105 ILE CA C 143 58.374 59.856 -1.482 1
1 1164 . 12 1 1 A 105 105 ILE CB C 143 39.123 39.608 -0.485 1
1 1167 . 12 1 1 A 105 105 ILE N N 143 124.757 121.300 3.457 1
1 1168 . 12 1 1 A 106 106 GLY H H 144 8.288 8.520 -0.232 1
1 1169 . 12 1 1 A 106 106 GLY HA2 H 144 4.764 4.506 0.258 1
1 1170 . 12 1 1 A 106 106 GLY HA3 H 144 4.764 4.585 0.179 1
1 1171 . 12 1 1 A 106 106 GLY C C 144 171.321 171.973 -0.652 1
1 1172 . 12 1 1 A 106 106 GLY CA C 144 40.250 45.738 -5.488 1
1 1173 . 12 1 1 A 106 106 GLY N N 144 110.895 110.865 0.030 1
1 1174 . 12 1 1 A 107 107 ASN H H 145 8.577 8.648 -0.071 1
1 1175 . 12 1 1 A 107 107 ASN HA H 145 4.268 5.876 -1.608 1
1 1180 . 12 1 1 A 107 107 ASN C C 145 171.757 173.512 -1.755 1
1 1181 . 12 1 1 A 107 107 ASN CA C 145 52.124 52.281 -0.157 1
1 1182 . 12 1 1 A 107 107 ASN CB C 145 34.625 42.652 -8.027 1
1 1183 . 12 1 1 A 107 107 ASN N N 145 118.042 118.387 -0.345 1
1 1185 . 12 1 1 A 108 108 TRP H H 146 6.822 8.821 -1.999 1
1 1186 . 12 1 1 A 108 108 TRP HA H 146 4.513 5.120 -0.607 1
1 1195 . 12 1 1 A 108 108 TRP C C 146 172.665 173.122 -0.457 1
1 1196 . 12 1 1 A 108 108 TRP CA C 146 54.624 56.314 -1.690 1
1 1197 . 12 1 1 A 108 108 TRP CB C 146 25.876 33.214 -7.338 1
1 1198 . 12 1 1 A 108 108 TRP N N 146 116.756 126.378 -9.622 1
1 1200 . 12 1 1 A 109 109 ASP H H 147 7.344 7.887 -0.543 1
1 1201 . 12 1 1 A 109 109 ASP HA H 147 4.655 5.070 -0.415 1
1 1204 . 12 1 1 A 109 109 ASP C C 147 172.193 174.613 -2.420 1
1 1205 . 12 1 1 A 109 109 ASP CA C 147 51.499 52.296 -0.797 1
1 1206 . 12 1 1 A 109 109 ASP CB C 147 39.000 41.893 -2.893 1
1 1207 . 12 1 1 A 109 109 ASP N N 147 121.461 128.620 -7.159 1
1 11 . 13 1 1 A 2 2 SER H H 40 8.461 8.988 -0.527 1
1 12 . 13 1 1 A 2 2 SER HA H 40 4.286 4.954 -0.668 1
1 15 . 13 1 1 A 2 2 SER C C 40 171.276 173.025 -1.749 1
1 16 . 13 1 1 A 2 2 SER CA C 40 55.249 57.023 -1.774 1
1 17 . 13 1 1 A 2 2 SER CB C 40 61.498 63.510 -2.012 1
1 18 . 13 1 1 A 2 2 SER N N 40 118.344 123.106 -4.762 1
1 19 . 13 1 1 A 3 3 ARG H H 41 8.469 8.618 -0.149 1
1 20 . 13 1 1 A 3 3 ARG HA H 41 4.400 4.934 -0.534 1
1 25 . 13 1 1 A 3 3 ARG C C 41 172.251 173.297 -1.046 1
1 26 . 13 1 1 A 3 3 ARG CA C 41 52.749 54.084 -1.335 1
1 27 . 13 1 1 A 3 3 ARG CB C 41 27.126 33.213 -6.087 1
1 28 . 13 1 1 A 3 3 ARG N N 41 123.070 124.236 -1.166 1
1 33 . 13 1 1 A 4 4 PRO CA C 42 61.498 63.951 -2.453 1
1 34 . 13 1 1 A 4 4 PRO CB C 42 29.001 31.680 -2.679 1
1 37 . 13 1 1 A 5 5 ASP H H 43 8.246 8.924 -0.678 1
1 38 . 13 1 1 A 5 5 ASP HA H 43 4.329 4.606 -0.277 1
1 41 . 13 1 1 A 5 5 ASP C C 43 174.605 177.345 -2.740 1
1 42 . 13 1 1 A 5 5 ASP CA C 43 53.374 55.877 -2.503 1
1 43 . 13 1 1 A 5 5 ASP CB C 43 38.375 40.595 -2.220 1
1 44 . 13 1 1 A 5 5 ASP N N 43 119.409 121.852 -2.443 1
1 45 . 13 1 1 A 6 6 GLN H H 44 8.309 8.363 -0.054 1
1 46 . 13 1 1 A 6 6 GLN HA H 44 4.393 4.192 0.201 1
1 53 . 13 1 1 A 6 6 GLN C C 44 175.053 178.628 -3.575 1
1 54 . 13 1 1 A 6 6 GLN CA C 44 55.874 58.298 -2.424 1
1 55 . 13 1 1 A 6 6 GLN CB C 44 25.876 28.142 -2.266 1
1 57 . 13 1 1 A 6 6 GLN N N 44 122.273 118.163 4.110 1
1 59 . 13 1 1 A 7 7 ALA H H 45 8.106 8.499 -0.393 1
1 60 . 13 1 1 A 7 7 ALA HA H 45 3.993 4.047 -0.054 1
1 64 . 13 1 1 A 7 7 ALA C C 45 177.465 178.572 -1.107 1
1 65 . 13 1 1 A 7 7 ALA CA C 45 52.124 54.946 -2.822 1
1 66 . 13 1 1 A 7 7 ALA CB C 45 15.252 18.125 -2.873 1
1 67 . 13 1 1 A 7 7 ALA N N 45 122.204 122.088 0.116 1
1 68 . 13 1 1 A 8 8 LYS H H 46 7.527 7.673 -0.146 1
1 69 . 13 1 1 A 8 8 LYS HA H 46 3.539 4.063 -0.524 1
1 78 . 13 1 1 A 8 8 LYS C C 46 175.412 178.995 -3.583 1
1 79 . 13 1 1 A 8 8 LYS CA C 46 57.124 58.456 -1.332 1
1 80 . 13 1 1 A 8 8 LYS CB C 46 30.876 32.146 -1.270 1
1 83 . 13 1 1 A 8 8 LYS N N 46 117.358 116.939 0.419 1
1 84 . 13 1 1 A 9 9 VAL H H 47 7.709 7.658 0.051 1
1 85 . 13 1 1 A 9 9 VAL HA H 47 3.578 3.851 -0.273 1
1 93 . 13 1 1 A 9 9 VAL C C 47 175.005 178.398 -3.393 1
1 94 . 13 1 1 A 9 9 VAL CA C 47 64.623 66.222 -1.599 1
1 95 . 13 1 1 A 9 9 VAL CB C 47 29.001 31.802 -2.801 1
1 98 . 13 1 1 A 9 9 VAL N N 47 119.115 120.420 -1.305 1
1 99 . 13 1 1 A 10 10 THR H H 48 7.767 8.246 -0.479 1
1 100 . 13 1 1 A 10 10 THR HA H 48 3.668 3.996 -0.328 1
1 105 . 13 1 1 A 10 10 THR CA C 48 63.998 66.220 -2.222 1
1 106 . 13 1 1 A 10 10 THR CB C 48 67.123 68.600 -1.477 1
1 108 . 13 1 1 A 10 10 THR N N 48 115.112 114.082 1.030 1
1 109 . 13 1 1 A 11 11 VAL H H 49 7.598 7.668 -0.070 1
1 110 . 13 1 1 A 11 11 VAL HA H 49 3.457 3.819 -0.362 1
1 118 . 13 1 1 A 11 11 VAL C C 49 175.412 177.977 -2.565 1
1 119 . 13 1 1 A 11 11 VAL CA C 49 63.998 65.051 -1.053 1
1 120 . 13 1 1 A 11 11 VAL CB C 49 29.001 31.678 -2.677 1
1 123 . 13 1 1 A 11 11 VAL N N 49 123.694 117.520 6.174 1
1 124 . 13 1 1 A 12 12 ALA H H 50 8.176 7.955 0.221 1
1 125 . 13 1 1 A 12 12 ALA HA H 50 4.742 4.010 0.732 1
1 129 . 13 1 1 A 12 12 ALA C C 50 177.074 179.748 -2.674 1
1 130 . 13 1 1 A 12 12 ALA CA C 50 52.124 55.627 -3.503 1
1 131 . 13 1 1 A 12 12 ALA CB C 50 15.252 18.452 -3.200 1
1 132 . 13 1 1 A 12 12 ALA N N 50 122.348 124.219 -1.871 1
1 133 . 13 1 1 A 13 13 LYS H H 51 8.499 8.287 0.212 1
1 134 . 13 1 1 A 13 13 LYS HA H 51 3.648 4.055 -0.407 1
1 143 . 13 1 1 A 13 13 LYS C C 51 177.252 179.720 -2.468 1
1 144 . 13 1 1 A 13 13 LYS CA C 51 58.072 59.135 -1.063 1
1 145 . 13 1 1 A 13 13 LYS CB C 51 30.251 32.363 -2.112 1
1 146 . 13 1 1 A 13 13 LYS N N 51 115.402 115.892 -0.490 1
1 147 . 13 1 1 A 14 14 GLY H H 52 7.858 8.254 -0.396 1
1 148 . 13 1 1 A 14 14 GLY HA2 H 52 3.823 3.813 0.010 1
1 149 . 13 1 1 A 14 14 GLY HA3 H 52 3.676 3.814 -0.138 1
1 150 . 13 1 1 A 14 14 GLY C C 52 174.090 175.594 -1.504 1
1 151 . 13 1 1 A 14 14 GLY CA C 52 44.625 46.928 -2.303 1
1 152 . 13 1 1 A 14 14 GLY N N 52 107.466 108.806 -1.340 1
1 153 . 13 1 1 A 15 15 ASP H H 53 8.403 7.822 0.581 1
1 154 . 13 1 1 A 15 15 ASP HA H 53 4.191 4.368 -0.177 1
1 157 . 13 1 1 A 15 15 ASP C C 53 175.316 179.028 -3.712 1
1 158 . 13 1 1 A 15 15 ASP CA C 53 54.624 56.567 -1.943 1
1 159 . 13 1 1 A 15 15 ASP CB C 53 35.875 40.552 -4.677 1
1 160 . 13 1 1 A 15 15 ASP N N 53 125.929 121.769 4.160 1
1 161 . 13 1 1 A 16 16 ILE H H 54 8.245 8.138 0.107 1
1 162 . 13 1 1 A 16 16 ILE HA H 54 3.034 3.872 -0.838 1
1 172 . 13 1 1 A 16 16 ILE C C 54 174.499 177.872 -3.373 1
1 173 . 13 1 1 A 16 16 ILE CA C 54 62.748 64.068 -1.320 1
1 174 . 13 1 1 A 16 16 ILE CB C 54 34.625 37.231 -2.606 1
1 178 . 13 1 1 A 16 16 ILE N N 54 119.456 116.638 2.818 1
1 179 . 13 1 1 A 17 17 LYS H H 55 7.547 8.179 -0.632 1
1 180 . 13 1 1 A 17 17 LYS HA H 55 3.843 4.054 -0.211 1
1 187 . 13 1 1 A 17 17 LYS C C 55 176.651 178.786 -2.135 1
1 188 . 13 1 1 A 17 17 LYS CA C 55 57.124 58.744 -1.620 1
1 189 . 13 1 1 A 17 17 LYS CB C 55 30.251 32.206 -1.955 1
1 190 . 13 1 1 A 17 17 LYS N N 55 118.505 120.662 -2.157 1
1 191 . 13 1 1 A 18 18 ALA H H 56 7.680 7.813 -0.133 1
1 192 . 13 1 1 A 18 18 ALA HA H 56 4.029 4.078 -0.049 1
1 196 . 13 1 1 A 18 18 ALA C C 56 176.638 180.167 -3.529 1
1 197 . 13 1 1 A 18 18 ALA CA C 56 52.749 54.830 -2.081 1
1 198 . 13 1 1 A 18 18 ALA CB C 56 15.877 18.555 -2.678 1
1 199 . 13 1 1 A 18 18 ALA N N 56 122.477 121.199 1.278 1
1 200 . 13 1 1 A 19 19 ILE H H 57 8.853 7.682 1.171 1
1 201 . 13 1 1 A 19 19 ILE HA H 57 3.304 3.561 -0.257 1
1 211 . 13 1 1 A 19 19 ILE C C 57 174.710 177.876 -3.166 1
1 212 . 13 1 1 A 19 19 ILE CA C 57 63.373 65.555 -2.182 1
1 213 . 13 1 1 A 19 19 ILE CB C 57 35.250 37.925 -2.675 1
1 217 . 13 1 1 A 19 19 ILE N N 57 120.901 119.826 1.075 1
1 218 . 13 1 1 A 20 20 ALA H H 58 8.702 8.122 0.580 1
1 219 . 13 1 1 A 20 20 ALA HA H 58 3.900 4.010 -0.110 1
1 223 . 13 1 1 A 20 20 ALA C C 58 176.512 180.110 -3.598 1
1 224 . 13 1 1 A 20 20 ALA CA C 58 52.749 55.600 -2.851 1
1 225 . 13 1 1 A 20 20 ALA CB C 58 15.252 17.991 -2.739 1
1 226 . 13 1 1 A 20 20 ALA N N 58 121.763 122.055 -0.292 1
1 227 . 13 1 1 A 21 21 ALA H H 59 7.662 7.660 0.002 1
1 228 . 13 1 1 A 21 21 ALA HA H 59 4.136 4.180 -0.044 1
1 232 . 13 1 1 A 21 21 ALA C C 59 177.949 179.811 -1.862 1
1 233 . 13 1 1 A 21 21 ALA CA C 59 52.749 55.029 -2.280 1
1 234 . 13 1 1 A 21 21 ALA CB C 59 15.252 18.494 -3.242 1
1 235 . 13 1 1 A 21 21 ALA N N 59 119.079 120.012 -0.933 1
1 236 . 13 1 1 A 22 22 ALA H H 60 7.403 7.766 -0.363 1
1 237 . 13 1 1 A 22 22 ALA HA H 60 4.318 4.257 0.061 1
1 241 . 13 1 1 A 22 22 ALA C C 60 176.730 180.570 -3.840 1
1 242 . 13 1 1 A 22 22 ALA CA C 60 52.749 54.230 -1.481 1
1 243 . 13 1 1 A 22 22 ALA CB C 60 17.126 18.830 -1.704 1
1 244 . 13 1 1 A 22 22 ALA N N 60 122.616 120.742 1.874 1
1 245 . 13 1 1 A 23 23 LEU H H 61 8.410 8.761 -0.351 1
1 246 . 13 1 1 A 23 23 LEU HA H 61 3.527 3.994 -0.467 1
1 256 . 13 1 1 A 23 23 LEU C C 61 176.057 178.387 -2.330 1
1 257 . 13 1 1 A 23 23 LEU CA C 61 55.249 57.192 -1.943 1
1 258 . 13 1 1 A 23 23 LEU CB C 61 39.000 40.936 -1.936 1
1 262 . 13 1 1 A 23 23 LEU N N 61 120.761 121.370 -0.609 1
1 263 . 13 1 1 A 24 24 ASP H H 62 8.227 7.858 0.369 1
1 264 . 13 1 1 A 24 24 ASP HA H 62 4.581 4.400 0.181 1
1 267 . 13 1 1 A 24 24 ASP C C 62 176.968 178.102 -1.134 1
1 268 . 13 1 1 A 24 24 ASP CA C 62 55.874 57.060 -1.186 1
1 269 . 13 1 1 A 24 24 ASP CB C 62 37.750 41.029 -3.279 1
1 270 . 13 1 1 A 24 24 ASP N N 62 119.068 119.093 -0.025 1
1 271 . 13 1 1 A 25 25 MET H H 63 7.718 8.006 -0.288 1
1 272 . 13 1 1 A 25 25 MET HA H 63 4.196 4.233 -0.037 1
1 277 . 13 1 1 A 25 25 MET C C 63 174.968 177.764 -2.796 1
1 278 . 13 1 1 A 25 25 MET CA C 63 55.249 58.153 -2.904 1
1 279 . 13 1 1 A 25 25 MET CB C 63 29.626 31.949 -2.323 1
1 281 . 13 1 1 A 25 25 MET N N 63 121.365 117.109 4.256 1
1 282 . 13 1 1 A 26 26 TYR H H 64 8.401 7.675 0.726 1
1 283 . 13 1 1 A 26 26 TYR HA H 64 4.400 3.517 0.883 1
1 291 . 13 1 1 A 26 26 TYR C C 64 176.098 177.323 -1.225 1
1 292 . 13 1 1 A 26 26 TYR CA C 64 58.999 60.847 -1.848 1
1 293 . 13 1 1 A 26 26 TYR CB C 64 35.250 38.316 -3.066 1
1 294 . 13 1 1 A 26 26 TYR N N 64 122.575 121.923 0.652 1
1 295 . 13 1 1 A 27 27 LYS H H 65 8.330 8.256 0.074 1
1 296 . 13 1 1 A 27 27 LYS HA H 65 3.568 4.144 -0.576 1
1 302 . 13 1 1 A 27 27 LYS C C 65 176.156 178.393 -2.237 1
1 303 . 13 1 1 A 27 27 LYS CA C 65 56.499 59.179 -2.680 1
1 304 . 13 1 1 A 27 27 LYS CB C 65 29.626 31.860 -2.234 1
1 306 . 13 1 1 A 27 27 LYS N N 65 121.390 118.775 2.615 1
1 307 . 13 1 1 A 28 28 LEU H H 66 7.833 7.281 0.552 1
1 308 . 13 1 1 A 28 28 LEU HA H 66 3.769 4.041 -0.272 1
1 318 . 13 1 1 A 28 28 LEU C C 66 175.925 177.937 -2.012 1
1 319 . 13 1 1 A 28 28 LEU CA C 66 55.874 56.919 -1.045 1
1 320 . 13 1 1 A 28 28 LEU CB C 66 38.375 42.156 -3.781 1
1 324 . 13 1 1 A 28 28 LEU N N 66 123.068 120.399 2.669 1
1 325 . 13 1 1 A 29 29 ASP H H 67 7.292 7.413 -0.121 1
1 326 . 13 1 1 A 29 29 ASP HA H 67 4.096 4.309 -0.213 1
1 329 . 13 1 1 A 29 29 ASP C C 67 174.618 176.851 -2.233 1
1 330 . 13 1 1 A 29 29 ASP CA C 67 53.999 56.270 -2.271 1
1 331 . 13 1 1 A 29 29 ASP CB C 67 38.375 40.890 -2.515 1
1 332 . 13 1 1 A 29 29 ASP N N 67 114.729 118.508 -3.779 1
1 333 . 13 1 1 A 30 30 ASN H H 68 8.097 7.516 0.581 1
1 334 . 13 1 1 A 30 30 ASN HA H 68 4.337 4.348 -0.011 1
1 339 . 13 1 1 A 30 30 ASN C C 68 172.822 174.405 -1.583 1
1 340 . 13 1 1 A 30 30 ASN CA C 68 52.124 51.553 0.571 1
1 341 . 13 1 1 A 30 30 ASN CB C 68 37.750 38.409 -0.659 1
1 342 . 13 1 1 A 30 30 ASN N N 68 111.054 115.663 -4.609 1
1 344 . 13 1 1 A 31 31 PHE H H 69 8.249 7.897 0.352 1
1 345 . 13 1 1 A 31 31 PHE HA H 69 4.135 4.269 -0.134 1
1 353 . 13 1 1 A 31 31 PHE C C 69 170.485 174.221 -3.736 1
1 354 . 13 1 1 A 31 31 PHE CA C 69 57.749 58.708 -0.959 1
1 355 . 13 1 1 A 31 31 PHE CB C 69 33.375 36.554 -3.179 1
1 356 . 13 1 1 A 31 31 PHE N N 69 116.277 119.041 -2.764 1
1 357 . 13 1 1 A 32 32 ALA H H 70 7.224 6.767 0.457 1
1 358 . 13 1 1 A 32 32 ALA HA H 70 4.194 4.529 -0.335 1
1 362 . 13 1 1 A 32 32 ALA C C 70 173.337 175.008 -1.671 1
1 363 . 13 1 1 A 32 32 ALA CA C 70 48.374 51.519 -3.145 1
1 364 . 13 1 1 A 32 32 ALA CB C 70 19.626 22.290 -2.664 1
1 365 . 13 1 1 A 32 32 ALA N N 70 119.914 120.236 -0.322 1
1 366 . 13 1 1 A 33 33 TYR H H 71 7.948 8.460 -0.512 1
1 367 . 13 1 1 A 33 33 TYR HA H 71 4.209 4.986 -0.777 1
1 374 . 13 1 1 A 33 33 TYR C C 71 170.591 174.265 -3.674 1
1 375 . 13 1 1 A 33 33 TYR CA C 71 54.624 56.467 -1.843 1
1 376 . 13 1 1 A 33 33 TYR CB C 71 34.000 38.221 -4.221 1
1 377 . 13 1 1 A 33 33 TYR N N 71 116.929 117.924 -0.995 1
1 378 . 13 1 1 A 34 34 PRO HA H 72 4.444 4.744 -0.300 1
1 381 . 13 1 1 A 34 34 PRO C C 72 174.775 176.290 -1.515 1
1 382 . 13 1 1 A 34 34 PRO CA C 72 59.624 62.557 -2.933 1
1 383 . 13 1 1 A 34 34 PRO CB C 72 28.376 32.418 -4.042 1
1 384 . 13 1 1 A 35 35 SER H H 73 8.721 8.429 0.292 1
1 385 . 13 1 1 A 35 35 SER HA H 73 4.467 4.887 -0.420 1
1 388 . 13 1 1 A 35 35 SER C C 73 173.271 176.222 -2.951 1
1 389 . 13 1 1 A 35 35 SER CA C 73 55.249 56.401 -1.152 1
1 390 . 13 1 1 A 35 35 SER CB C 73 63.373 66.192 -2.819 1
1 391 . 13 1 1 A 35 35 SER N N 73 118.284 114.204 4.080 1
1 392 . 13 1 1 A 36 36 THR H H 74 8.591 9.167 -0.576 1
1 393 . 13 1 1 A 36 36 THR HA H 74 3.649 4.007 -0.358 1
1 398 . 13 1 1 A 36 36 THR CA C 74 64.623 65.539 -0.916 1
1 399 . 13 1 1 A 36 36 THR CB C 74 66.498 68.529 -2.031 1
1 401 . 13 1 1 A 36 36 THR N N 74 117.769 117.608 0.161 1
1 402 . 13 1 1 A 37 37 GLN H H 75 8.210 7.900 0.310 1
1 403 . 13 1 1 A 37 37 GLN HA H 75 3.860 4.411 -0.551 1
1 410 . 13 1 1 A 37 37 GLN C C 75 175.349 177.715 -2.366 1
1 411 . 13 1 1 A 37 37 GLN CA C 75 56.499 57.819 -1.320 1
1 412 . 13 1 1 A 37 37 GLN CB C 75 25.876 29.533 -3.657 1
1 414 . 13 1 1 A 37 37 GLN N N 75 117.931 119.703 -1.772 1
1 416 . 13 1 1 A 38 38 GLN H H 76 7.667 8.160 -0.493 1
1 417 . 13 1 1 A 38 38 GLN HA H 76 3.810 4.111 -0.301 1
1 424 . 13 1 1 A 38 38 GLN C C 76 175.805 179.385 -3.580 1
1 425 . 13 1 1 A 38 38 GLN CA C 76 55.874 58.642 -2.768 1
1 426 . 13 1 1 A 38 38 GLN CB C 76 25.876 28.320 -2.444 1
1 428 . 13 1 1 A 38 38 GLN N N 76 120.607 118.281 2.326 1
1 430 . 13 1 1 A 39 39 GLY H H 77 8.470 8.079 0.391 1
1 431 . 13 1 1 A 39 39 GLY HA2 H 77 3.920 3.780 0.140 1
1 432 . 13 1 1 A 39 39 GLY HA3 H 77 3.603 3.798 -0.195 1
1 433 . 13 1 1 A 39 39 GLY C C 77 169.006 175.500 -6.494 1
1 434 . 13 1 1 A 39 39 GLY CA C 77 42.125 46.517 -4.392 1
1 435 . 13 1 1 A 39 39 GLY N N 77 103.281 109.443 -6.162 1
1 436 . 13 1 1 A 40 40 LEU H H 78 8.135 7.923 0.212 1
1 437 . 13 1 1 A 40 40 LEU HA H 78 3.237 4.214 -0.977 1
1 447 . 13 1 1 A 40 40 LEU C C 78 176.383 178.697 -2.314 1
1 448 . 13 1 1 A 40 40 LEU CA C 78 52.749 57.131 -4.382 1
1 449 . 13 1 1 A 40 40 LEU CB C 78 39.000 41.596 -2.596 1
1 453 . 13 1 1 A 40 40 LEU N N 78 114.444 123.448 -9.004 1
1 454 . 13 1 1 A 41 41 GLU H H 79 8.578 8.157 0.421 1
1 455 . 13 1 1 A 41 41 GLU HA H 79 3.720 4.045 -0.325 1
1 460 . 13 1 1 A 41 41 GLU C C 79 175.093 178.723 -3.630 1
1 461 . 13 1 1 A 41 41 GLU CA C 79 57.124 59.396 -2.272 1
1 462 . 13 1 1 A 41 41 GLU CB C 79 26.501 29.390 -2.889 1
1 464 . 13 1 1 A 41 41 GLU N N 79 118.295 118.753 -0.458 1
1 465 . 13 1 1 A 42 42 ALA H H 80 7.227 7.934 -0.707 1
1 466 . 13 1 1 A 42 42 ALA HA H 80 4.437 4.631 -0.194 1
1 470 . 13 1 1 A 42 42 ALA C C 80 173.745 177.927 -4.182 1
1 471 . 13 1 1 A 42 42 ALA CA C 80 51.499 53.553 -2.054 1
1 472 . 13 1 1 A 42 42 ALA CB C 80 15.877 18.321 -2.444 1
1 473 . 13 1 1 A 42 42 ALA N N 80 119.751 121.072 -1.321 1
1 474 . 13 1 1 A 43 43 LEU H H 81 7.932 7.471 0.461 1
1 475 . 13 1 1 A 43 43 LEU HA H 81 4.369 4.459 -0.090 1
1 485 . 13 1 1 A 43 43 LEU C C 81 174.788 177.921 -3.133 1
1 486 . 13 1 1 A 43 43 LEU CA C 81 53.374 55.273 -1.899 1
1 487 . 13 1 1 A 43 43 LEU CB C 81 39.625 42.383 -2.758 1
1 491 . 13 1 1 A 43 43 LEU N N 81 111.742 116.718 -4.976 1
1 492 . 13 1 1 A 44 44 VAL H H 82 7.886 7.561 0.325 1
1 493 . 13 1 1 A 44 44 VAL HA H 82 4.700 4.378 0.322 1
1 501 . 13 1 1 A 44 44 VAL C C 82 172.875 175.660 -2.785 1
1 502 . 13 1 1 A 44 44 VAL CA C 82 59.624 63.298 -3.674 1
1 503 . 13 1 1 A 44 44 VAL CB C 82 31.501 33.397 -1.896 1
1 506 . 13 1 1 A 44 44 VAL N N 82 113.604 115.414 -1.810 1
1 507 . 13 1 1 A 45 45 LYS H H 83 8.361 8.335 0.026 1
1 508 . 13 1 1 A 45 45 LYS HA H 83 4.251 4.961 -0.710 1
1 515 . 13 1 1 A 45 45 LYS C C 83 171.053 174.858 -3.805 1
1 516 . 13 1 1 A 45 45 LYS CA C 83 52.749 54.237 -1.488 1
1 517 . 13 1 1 A 45 45 LYS CB C 83 33.375 35.843 -2.468 1
1 521 . 13 1 1 A 45 45 LYS N N 83 123.860 122.663 1.197 1
1 522 . 13 1 1 A 46 46 LYS H H 84 7.243 7.856 -0.613 1
1 523 . 13 1 1 A 46 46 LYS HA H 84 2.175 2.642 -0.467 1
1 532 . 13 1 1 A 46 46 LYS C C 84 172.123 174.389 -2.266 1
1 533 . 13 1 1 A 46 46 LYS CA C 84 52.749 54.242 -1.493 1
1 534 . 13 1 1 A 46 46 LYS CB C 84 29.626 31.367 -1.741 1
1 537 . 13 1 1 A 46 46 LYS N N 84 128.615 124.595 4.020 1
1 538 . 13 1 1 A 47 47 PRO HA H 85 4.470 4.435 0.035 1
1 541 . 13 1 1 A 47 47 PRO C C 85 173.754 176.862 -3.108 1
1 542 . 13 1 1 A 47 47 PRO CA C 85 60.874 63.195 -2.321 1
1 543 . 13 1 1 A 47 47 PRO CB C 85 30.876 31.795 -0.919 1
1 546 . 13 1 1 A 48 48 THR H H 86 8.306 8.412 -0.106 1
1 547 . 13 1 1 A 48 48 THR HA H 86 4.287 4.205 0.082 1
1 552 . 13 1 1 A 48 48 THR C C 86 173.070 174.544 -1.474 1
1 553 . 13 1 1 A 48 48 THR CA C 86 57.749 62.366 -4.617 1
1 554 . 13 1 1 A 48 48 THR CB C 86 67.748 69.115 -1.367 1
1 556 . 13 1 1 A 48 48 THR N N 86 109.564 113.340 -3.776 1
1 557 . 13 1 1 A 49 49 GLY H H 87 8.317 8.727 -0.410 1
1 558 . 13 1 1 A 49 49 GLY HA2 H 87 3.851 3.930 -0.079 1
1 559 . 13 1 1 A 49 49 GLY HA3 H 87 3.678 3.934 -0.256 1
1 560 . 13 1 1 A 49 49 GLY C C 87 169.693 173.364 -3.671 1
1 561 . 13 1 1 A 49 49 GLY CA C 87 42.125 46.164 -4.039 1
1 562 . 13 1 1 A 49 49 GLY N N 87 109.071 110.235 -1.164 1
1 563 . 13 1 1 A 50 50 ASN H H 88 8.301 8.490 -0.189 1
1 564 . 13 1 1 A 50 50 ASN HA H 88 4.780 5.362 -0.582 1
1 569 . 13 1 1 A 50 50 ASN C C 88 171.370 173.716 -2.346 1
1 570 . 13 1 1 A 50 50 ASN CA C 88 47.749 50.801 -3.052 1
1 571 . 13 1 1 A 50 50 ASN CB C 88 37.125 39.147 -2.022 1
1 572 . 13 1 1 A 50 50 ASN N N 88 115.631 121.401 -5.770 1
1 574 . 13 1 1 A 51 51 PRO HA H 89 4.782 4.509 0.273 1
1 577 . 13 1 1 A 51 51 PRO C C 89 173.656 176.367 -2.711 1
1 578 . 13 1 1 A 51 51 PRO CA C 89 59.624 62.317 -2.693 1
1 579 . 13 1 1 A 51 51 PRO CB C 89 31.501 32.246 -0.745 1
1 582 . 13 1 1 A 52 52 GLN H H 90 9.076 8.666 0.410 1
1 583 . 13 1 1 A 52 52 GLN HA H 90 4.469 4.668 -0.199 1
1 590 . 13 1 1 A 52 52 GLN C C 90 172.386 174.510 -2.124 1
1 591 . 13 1 1 A 52 52 GLN CA C 90 50.874 54.281 -3.407 1
1 592 . 13 1 1 A 52 52 GLN CB C 90 26.501 27.876 -1.375 1
1 594 . 13 1 1 A 52 52 GLN N N 90 126.827 120.300 6.527 1
1 596 . 13 1 1 A 53 53 PRO HA H 91 4.384 4.563 -0.179 1
1 599 . 13 1 1 A 53 53 PRO C C 91 174.274 175.327 -1.053 1
1 600 . 13 1 1 A 53 53 PRO CB C 91 28.113 31.340 -3.227 1
1 601 . 13 1 1 A 54 54 LYS H H 92 8.401 8.770 -0.369 1
1 602 . 13 1 1 A 54 54 LYS HA H 92 3.984 4.751 -0.767 1
1 611 . 13 1 1 A 54 54 LYS C C 92 173.516 174.519 -1.003 1
1 612 . 13 1 1 A 54 54 LYS CA C 92 55.249 55.513 -0.264 1
1 613 . 13 1 1 A 54 54 LYS CB C 92 30.876 35.806 -4.930 1
1 615 . 13 1 1 A 54 54 LYS N N 92 124.538 124.244 0.294 1
1 616 . 13 1 1 A 55 55 ASN H H 93 8.183 8.710 -0.527 1
1 617 . 13 1 1 A 55 55 ASN HA H 93 4.716 4.987 -0.271 1
1 622 . 13 1 1 A 55 55 ASN CA C 93 48.999 53.211 -4.212 1
1 623 . 13 1 1 A 55 55 ASN CB C 93 35.875 38.227 -2.352 1
1 624 . 13 1 1 A 55 55 ASN N N 93 118.677 123.142 -4.465 1
1 626 . 13 1 1 A 56 56 TRP H H 94 8.007 8.674 -0.667 1
1 627 . 13 1 1 A 56 56 TRP HA H 94 3.827 5.361 -1.534 1
1 635 . 13 1 1 A 56 56 TRP C C 94 173.760 175.253 -1.493 1
1 636 . 13 1 1 A 56 56 TRP CA C 94 59.624 59.311 0.313 1
1 637 . 13 1 1 A 56 56 TRP CB C 94 27.126 30.387 -3.261 1
1 638 . 13 1 1 A 56 56 TRP N N 94 122.195 127.908 -5.713 1
1 640 . 13 1 1 A 57 57 ASN H H 95 7.563 7.664 -0.101 1
1 641 . 13 1 1 A 57 57 ASN HA H 95 3.735 4.840 -1.105 1
1 646 . 13 1 1 A 57 57 ASN C C 95 171.952 174.000 -2.048 1
1 647 . 13 1 1 A 57 57 ASN CA C 95 51.499 50.650 0.849 1
1 648 . 13 1 1 A 57 57 ASN CB C 95 35.250 41.183 -5.933 1
1 649 . 13 1 1 A 57 57 ASN N N 95 129.659 125.318 4.341 1
1 651 . 13 1 1 A 58 58 LYS H H 96 8.110 7.990 0.120 1
1 652 . 13 1 1 A 58 58 LYS HA H 96 4.035 3.911 0.124 1
1 659 . 13 1 1 A 58 58 LYS C C 96 174.530 175.229 -0.699 1
1 660 . 13 1 1 A 58 58 LYS CA C 96 56.499 54.569 1.930 1
1 661 . 13 1 1 A 58 58 LYS CB C 96 29.626 32.799 -3.173 1
1 665 . 13 1 1 A 58 58 LYS N N 96 123.913 123.426 0.487 1
1 666 . 13 1 1 A 59 59 ASP H H 97 7.903 9.166 -1.263 1
1 667 . 13 1 1 A 59 59 ASP HA H 97 4.393 4.038 0.355 1
1 670 . 13 1 1 A 59 59 ASP C C 97 173.724 175.556 -1.832 1
1 671 . 13 1 1 A 59 59 ASP CA C 97 52.124 54.991 -2.867 1
1 672 . 13 1 1 A 59 59 ASP CB C 97 38.375 39.477 -1.102 1
1 673 . 13 1 1 A 59 59 ASP N N 97 118.773 117.509 1.264 1
1 674 . 13 1 1 A 60 60 GLY H H 98 7.819 7.792 0.027 1
1 675 . 13 1 1 A 60 60 GLY HA2 H 98 3.917 3.077 0.840 1
1 676 . 13 1 1 A 60 60 GLY HA3 H 98 3.917 3.461 0.456 1
1 677 . 13 1 1 A 60 60 GLY C C 98 168.652 174.115 -5.463 1
1 678 . 13 1 1 A 60 60 GLY CA C 98 41.500 44.923 -3.423 1
1 679 . 13 1 1 A 60 60 GLY N N 98 108.742 103.727 5.015 1
1 680 . 13 1 1 A 61 61 TYR H H 99 8.105 7.630 0.475 1
1 681 . 13 1 1 A 61 61 TYR HA H 99 3.927 4.461 -0.534 1
1 689 . 13 1 1 A 61 61 TYR C C 99 172.831 174.078 -1.247 1
1 690 . 13 1 1 A 61 61 TYR CA C 99 57.124 58.271 -1.147 1
1 691 . 13 1 1 A 61 61 TYR CB C 99 37.125 36.324 0.801 1
1 692 . 13 1 1 A 61 61 TYR N N 99 113.836 115.832 -1.996 1
1 693 . 13 1 1 A 62 62 LEU H H 100 7.352 7.985 -0.633 1
1 694 . 13 1 1 A 62 62 LEU HA H 100 4.343 4.814 -0.471 1
1 704 . 13 1 1 A 62 62 LEU C C 100 173.430 175.107 -1.677 1
1 705 . 13 1 1 A 62 62 LEU CA C 100 50.874 52.910 -2.036 1
1 706 . 13 1 1 A 62 62 LEU CB C 100 44.000 44.617 -0.617 1
1 710 . 13 1 1 A 62 62 LEU N N 100 117.112 122.565 -5.453 1
1 711 . 13 1 1 A 63 63 LYS H H 101 8.626 8.507 0.119 1
1 712 . 13 1 1 A 63 63 LYS HA H 101 3.986 4.535 -0.549 1
1 721 . 13 1 1 A 63 63 LYS C C 101 173.851 177.746 -3.895 1
1 722 . 13 1 1 A 63 63 LYS CA C 101 55.249 55.148 0.101 1
1 723 . 13 1 1 A 63 63 LYS CB C 101 29.626 33.614 -3.988 1
1 724 . 13 1 1 A 63 63 LYS N N 101 129.991 121.631 8.360 1
1 725 . 13 1 1 A 64 64 LYS H H 102 7.059 8.797 -1.738 1
1 726 . 13 1 1 A 64 64 LYS HA H 102 4.138 4.171 -0.033 1
1 735 . 13 1 1 A 64 64 LYS C C 102 171.120 175.694 -4.574 1
1 736 . 13 1 1 A 64 64 LYS CA C 102 52.749 56.797 -4.048 1
1 737 . 13 1 1 A 64 64 LYS CB C 102 32.750 31.843 0.907 1
1 740 . 13 1 1 A 64 64 LYS N N 102 113.255 121.244 -7.989 1
1 741 . 13 1 1 A 65 65 LEU H H 103 8.883 7.802 1.081 1
1 742 . 13 1 1 A 65 65 LEU HA H 103 4.475 4.620 -0.145 1
1 752 . 13 1 1 A 65 65 LEU C C 103 171.487 174.935 -3.448 1
1 753 . 13 1 1 A 65 65 LEU CA C 103 48.999 51.923 -2.924 1
1 754 . 13 1 1 A 65 65 LEU CB C 103 39.625 42.543 -2.918 1
1 758 . 13 1 1 A 65 65 LEU N N 103 126.355 121.759 4.596 1
1 759 . 13 1 1 A 66 66 PRO HA H 104 4.449 4.617 -0.168 1
1 764 . 13 1 1 A 66 66 PRO C C 104 173.363 176.238 -2.875 1
1 765 . 13 1 1 A 66 66 PRO CA C 104 60.249 62.236 -1.987 1
1 766 . 13 1 1 A 66 66 PRO CB C 104 29.626 32.925 -3.299 1
1 769 . 13 1 1 A 67 67 VAL H H 105 7.682 8.379 -0.697 1
1 770 . 13 1 1 A 67 67 VAL HA H 105 4.121 4.529 -0.408 1
1 778 . 13 1 1 A 67 67 VAL C C 105 171.667 175.068 -3.401 1
1 779 . 13 1 1 A 67 67 VAL CA C 105 58.374 61.567 -3.193 1
1 780 . 13 1 1 A 67 67 VAL CB C 105 30.251 33.308 -3.057 1
1 783 . 13 1 1 A 67 67 VAL N N 105 114.671 121.065 -6.394 1
1 784 . 13 1 1 A 68 68 ASP H H 106 8.216 7.559 0.657 1
1 785 . 13 1 1 A 68 68 ASP HA H 106 4.474 4.567 -0.093 1
1 788 . 13 1 1 A 68 68 ASP C C 106 172.452 174.638 -2.186 1
1 789 . 13 1 1 A 68 68 ASP CA C 106 50.249 52.247 -1.998 1
1 790 . 13 1 1 A 68 68 ASP CB C 106 37.750 40.228 -2.478 1
1 791 . 13 1 1 A 68 68 ASP N N 106 123.825 125.411 -1.586 1
1 792 . 13 1 1 A 69 69 PRO HA H 107 3.920 3.976 -0.056 1
1 797 . 13 1 1 A 69 69 PRO CA C 107 62.123 62.956 -0.833 1
1 798 . 13 1 1 A 69 69 PRO CB C 107 27.751 31.458 -3.707 1
1 801 . 13 1 1 A 70 70 TRP H H 108 8.156 8.465 -0.309 1
1 802 . 13 1 1 A 70 70 TRP HA H 108 4.274 4.296 -0.022 1
1 811 . 13 1 1 A 70 70 TRP CA C 108 57.124 58.343 -1.219 1
1 812 . 13 1 1 A 70 70 TRP CB C 108 25.251 27.196 -1.945 1
1 813 . 13 1 1 A 70 70 TRP N N 108 118.137 117.441 0.696 1
1 815 . 13 1 1 A 71 71 GLY H H 109 8.209 8.734 -0.525 1
1 816 . 13 1 1 A 71 71 GLY HA2 H 109 4.030 3.866 0.164 1
1 817 . 13 1 1 A 71 71 GLY HA3 H 109 3.303 3.903 -0.600 1
1 818 . 13 1 1 A 71 71 GLY CA C 109 42.750 46.453 -3.703 1
1 819 . 13 1 1 A 71 71 GLY N N 109 107.495 105.368 2.127 1
1 820 . 13 1 1 A 72 72 ASN H H 110 8.116 7.937 0.179 1
1 821 . 13 1 1 A 72 72 ASN HA H 110 5.103 4.974 0.129 1
1 826 . 13 1 1 A 72 72 ASN CA C 110 48.374 50.038 -1.664 1
1 827 . 13 1 1 A 72 72 ASN CB C 110 36.500 39.137 -2.637 1
1 828 . 13 1 1 A 72 72 ASN N N 110 120.108 120.024 0.084 1
1 830 . 13 1 1 A 73 73 PRO HA H 111 4.397 4.470 -0.073 1
1 835 . 13 1 1 A 73 73 PRO C C 111 176.229 176.789 -0.560 1
1 836 . 13 1 1 A 73 73 PRO CA C 111 60.249 62.757 -2.508 1
1 837 . 13 1 1 A 73 73 PRO CB C 111 29.001 31.811 -2.810 1
1 840 . 13 1 1 A 74 74 TYR H H 112 8.893 8.543 0.350 1
1 841 . 13 1 1 A 74 74 TYR HA H 112 4.064 4.757 -0.693 1
1 849 . 13 1 1 A 74 74 TYR C C 112 171.951 176.011 -4.060 1
1 850 . 13 1 1 A 74 74 TYR CA C 112 60.249 58.336 1.913 1
1 851 . 13 1 1 A 74 74 TYR CB C 112 36.500 39.516 -3.016 1
1 852 . 13 1 1 A 74 74 TYR N N 112 124.595 121.451 3.144 1
1 853 . 13 1 1 A 75 75 GLN H H 113 9.127 8.858 0.269 1
1 854 . 13 1 1 A 75 75 GLN HA H 113 4.019 4.308 -0.289 1
1 861 . 13 1 1 A 75 75 GLN C C 113 171.436 174.161 -2.725 1
1 862 . 13 1 1 A 75 75 GLN CA C 113 50.874 54.722 -3.848 1
1 863 . 13 1 1 A 75 75 GLN CB C 113 29.469 29.379 0.090 1
1 865 . 13 1 1 A 75 75 GLN N N 113 120.777 122.065 -1.288 1
1 867 . 13 1 1 A 76 76 TYR H H 114 7.906 8.580 -0.674 1
1 868 . 13 1 1 A 76 76 TYR HA H 114 5.586 5.134 0.452 1
1 875 . 13 1 1 A 76 76 TYR C C 114 171.343 175.472 -4.129 1
1 876 . 13 1 1 A 76 76 TYR CA C 114 53.999 57.320 -3.321 1
1 877 . 13 1 1 A 76 76 TYR CB C 114 40.250 39.958 0.292 1
1 878 . 13 1 1 A 76 76 TYR N N 114 120.757 123.786 -3.029 1
1 879 . 13 1 1 A 77 77 LEU H H 115 8.261 9.121 -0.860 1
1 880 . 13 1 1 A 77 77 LEU HA H 115 4.280 5.224 -0.944 1
1 890 . 13 1 1 A 77 77 LEU C C 115 170.921 175.939 -5.018 1
1 891 . 13 1 1 A 77 77 LEU CA C 115 51.499 53.601 -2.102 1
1 892 . 13 1 1 A 77 77 LEU CB C 115 44.625 45.687 -1.062 1
1 896 . 13 1 1 A 77 77 LEU N N 115 130.662 124.983 5.679 1
1 897 . 13 1 1 A 78 78 ALA H H 116 7.973 8.473 -0.500 1
1 898 . 13 1 1 A 78 78 ALA HA H 116 4.292 4.813 -0.521 1
1 902 . 13 1 1 A 78 78 ALA C C 116 172.093 175.018 -2.925 1
1 903 . 13 1 1 A 78 78 ALA CA C 116 47.749 49.995 -2.246 1
1 904 . 13 1 1 A 78 78 ALA CB C 116 19.626 20.761 -1.135 1
1 905 . 13 1 1 A 78 78 ALA N N 116 125.564 125.112 0.452 1
1 906 . 13 1 1 A 79 79 PRO HA H 117 4.698 5.145 -0.447 1
1 911 . 13 1 1 A 79 79 PRO C C 117 173.994 177.186 -3.192 1
1 912 . 13 1 1 A 79 79 PRO CA C 117 60.249 63.468 -3.219 1
1 913 . 13 1 1 A 79 79 PRO CB C 117 31.501 31.957 -0.456 1
1 916 . 13 1 1 A 80 80 GLY H H 118 7.096 8.556 -1.460 1
1 917 . 13 1 1 A 80 80 GLY HA2 H 118 3.797 3.831 -0.034 1
1 918 . 13 1 1 A 80 80 GLY HA3 H 118 3.517 3.893 -0.376 1
1 919 . 13 1 1 A 80 80 GLY C C 118 171.404 174.247 -2.843 1
1 920 . 13 1 1 A 80 80 GLY CA C 118 41.500 46.731 -5.231 1
1 921 . 13 1 1 A 80 80 GLY N N 118 108.306 108.860 -0.554 1
1 922 . 13 1 1 A 81 81 THR H H 119 9.810 7.972 1.838 1
1 923 . 13 1 1 A 81 81 THR HA H 119 4.091 4.616 -0.525 1
1 928 . 13 1 1 A 81 81 THR C C 119 174.242 174.491 -0.249 1
1 929 . 13 1 1 A 81 81 THR CA C 119 60.874 60.733 0.141 1
1 930 . 13 1 1 A 81 81 THR CB C 119 66.498 69.284 -2.786 1
1 932 . 13 1 1 A 81 81 THR N N 119 112.813 113.034 -0.221 1
1 933 . 13 1 1 A 82 82 LYS H H 120 8.964 8.596 0.368 1
1 934 . 13 1 1 A 82 82 LYS HA H 120 4.150 3.847 0.303 1
1 941 . 13 1 1 A 82 82 LYS C C 120 172.886 175.522 -2.636 1
1 942 . 13 1 1 A 82 82 LYS CA C 120 53.999 57.759 -3.760 1
1 943 . 13 1 1 A 82 82 LYS CB C 120 30.876 29.714 1.162 1
1 944 . 13 1 1 A 82 82 LYS N N 120 123.569 125.109 -1.540 1
1 945 . 13 1 1 A 83 83 GLY H H 121 7.125 7.926 -0.801 1
1 946 . 13 1 1 A 83 83 GLY HA2 H 121 3.814 4.243 -0.429 1
1 947 . 13 1 1 A 83 83 GLY HA3 H 121 3.814 4.304 -0.490 1
1 948 . 13 1 1 A 83 83 GLY C C 121 167.671 174.226 -6.555 1
1 949 . 13 1 1 A 83 83 GLY CA C 121 42.125 44.148 -2.023 1
1 950 . 13 1 1 A 83 83 GLY N N 121 107.253 107.510 -0.257 1
1 951 . 13 1 1 A 84 84 PRO HA H 122 4.077 4.323 -0.246 1
1 958 . 13 1 1 A 84 84 PRO C C 122 175.199 176.683 -1.484 1
1 959 . 13 1 1 A 84 84 PRO CA C 122 63.373 64.809 -1.436 1
1 960 . 13 1 1 A 84 84 PRO CB C 122 30.251 31.776 -1.525 1
1 962 . 13 1 1 A 85 85 PHE H H 123 6.652 6.771 -0.119 1
1 963 . 13 1 1 A 85 85 PHE HA H 123 4.744 4.867 -0.123 1
1 971 . 13 1 1 A 85 85 PHE C C 123 170.340 172.637 -2.297 1
1 972 . 13 1 1 A 85 85 PHE CA C 123 53.999 56.345 -2.346 1
1 973 . 13 1 1 A 85 85 PHE CB C 123 39.000 40.386 -1.386 1
1 974 . 13 1 1 A 85 85 PHE N N 123 108.468 111.722 -3.254 1
1 975 . 13 1 1 A 86 86 ASP H H 124 9.268 9.025 0.243 1
1 976 . 13 1 1 A 86 86 ASP HA H 124 5.108 5.551 -0.443 1
1 979 . 13 1 1 A 86 86 ASP C C 124 171.180 175.154 -3.974 1
1 980 . 13 1 1 A 86 86 ASP CA C 124 50.249 53.684 -3.435 1
1 981 . 13 1 1 A 86 86 ASP CB C 124 40.250 43.262 -3.012 1
1 982 . 13 1 1 A 86 86 ASP N N 124 121.741 119.268 2.473 1
1 983 . 13 1 1 A 87 87 LEU H H 125 8.018 9.574 -1.556 1
1 984 . 13 1 1 A 87 87 LEU HA H 125 5.809 5.557 0.252 1
1 994 . 13 1 1 A 87 87 LEU C C 125 171.350 175.554 -4.204 1
1 995 . 13 1 1 A 87 87 LEU CA C 125 50.874 53.933 -3.059 1
1 996 . 13 1 1 A 87 87 LEU CB C 125 44.318 45.545 -1.227 1
1 999 . 13 1 1 A 87 87 LEU N N 125 123.629 126.224 -2.595 1
1 1000 . 13 1 1 A 88 88 TYR H H 126 8.912 8.623 0.289 1
1 1001 . 13 1 1 A 88 88 TYR HA H 126 5.630 5.539 0.091 1
1 1008 . 13 1 1 A 88 88 TYR C C 126 171.410 172.297 -0.887 1
1 1009 . 13 1 1 A 88 88 TYR CA C 126 52.749 56.617 -3.868 1
1 1010 . 13 1 1 A 88 88 TYR CB C 126 37.750 40.550 -2.800 1
1 1011 . 13 1 1 A 88 88 TYR N N 126 119.697 121.314 -1.617 1
1 1012 . 13 1 1 A 89 89 SER H H 127 9.319 9.315 0.004 1
1 1013 . 13 1 1 A 89 89 SER HA H 127 5.429 5.294 0.135 1
1 1016 . 13 1 1 A 89 89 SER CA C 127 52.124 56.458 -4.334 1
1 1017 . 13 1 1 A 89 89 SER CB C 127 62.748 66.359 -3.611 1
1 1018 . 13 1 1 A 89 89 SER N N 127 112.637 115.665 -3.028 1
1 1019 . 13 1 1 A 90 90 LEU H H 128 8.759 8.457 0.302 1
1 1020 . 13 1 1 A 90 90 LEU HA H 128 4.186 4.455 -0.269 1
1 1030 . 13 1 1 A 90 90 LEU C C 128 175.121 178.237 -3.116 1
1 1031 . 13 1 1 A 90 90 LEU CA C 128 52.749 55.055 -2.306 1
1 1032 . 13 1 1 A 90 90 LEU CB C 128 35.875 42.210 -6.335 1
1 1033 . 13 1 1 A 90 90 LEU N N 128 126.728 126.310 0.418 1
1 1034 . 13 1 1 A 91 91 GLY H H 129 8.356 8.123 0.233 1
1 1035 . 13 1 1 A 91 91 GLY HA2 H 129 3.373 3.691 -0.318 1
1 1036 . 13 1 1 A 91 91 GLY HA3 H 129 3.373 3.860 -0.487 1
1 1037 . 13 1 1 A 91 91 GLY C C 129 172.013 174.406 -2.393 1
1 1038 . 13 1 1 A 91 91 GLY CA C 129 41.500 44.015 -2.515 1
1 1039 . 13 1 1 A 91 91 GLY N N 129 108.559 108.810 -0.251 1
1 1040 . 13 1 1 A 92 92 ALA H H 130 7.047 7.997 -0.950 1
1 1041 . 13 1 1 A 92 92 ALA HA H 130 4.037 2.707 1.330 1
1 1045 . 13 1 1 A 92 92 ALA C C 130 174.890 177.806 -2.916 1
1 1046 . 13 1 1 A 92 92 ALA CA C 130 52.100 53.800 -1.700 1
1 1047 . 13 1 1 A 92 92 ALA CB C 130 16.502 17.744 -1.242 1
1 1048 . 13 1 1 A 92 92 ALA N N 130 118.393 121.512 -3.119 1
1 1049 . 13 1 1 A 93 93 ASP H H 131 7.222 7.881 -0.659 1
1 1050 . 13 1 1 A 93 93 ASP HA H 131 4.122 4.437 -0.315 1
1 1053 . 13 1 1 A 93 93 ASP C C 131 174.890 176.501 -1.611 1
1 1054 . 13 1 1 A 93 93 ASP CA C 131 50.249 53.112 -2.863 1
1 1055 . 13 1 1 A 93 93 ASP CB C 131 37.750 40.232 -2.482 1
1 1056 . 13 1 1 A 93 93 ASP N N 131 111.487 112.534 -1.047 1
1 1057 . 13 1 1 A 94 94 GLY H H 132 7.199 9.425 -2.226 1
1 1058 . 13 1 1 A 94 94 GLY HA2 H 132 3.951 3.896 0.055 1
1 1059 . 13 1 1 A 94 94 GLY HA3 H 132 3.324 3.900 -0.576 1
1 1060 . 13 1 1 A 94 94 GLY C C 132 169.773 173.641 -3.868 1
1 1061 . 13 1 1 A 94 94 GLY CA C 132 44.625 45.666 -1.041 1
1 1062 . 13 1 1 A 94 94 GLY N N 132 106.932 111.086 -4.154 1
1 1063 . 13 1 1 A 95 95 LYS H H 133 7.215 7.565 -0.350 1
1 1064 . 13 1 1 A 95 95 LYS HA H 133 4.513 4.961 -0.448 1
1 1073 . 13 1 1 A 95 95 LYS C C 133 172.108 174.470 -2.362 1
1 1074 . 13 1 1 A 95 95 LYS CA C 133 51.512 54.684 -3.172 1
1 1075 . 13 1 1 A 95 95 LYS CB C 133 34.000 36.078 -2.078 1
1 1076 . 13 1 1 A 95 95 LYS N N 133 115.749 119.999 -4.250 1
1 1077 . 13 1 1 A 96 96 GLU H H 134 9.230 8.598 0.632 1
1 1078 . 13 1 1 A 96 96 GLU HA H 134 4.352 4.498 -0.146 1
1 1083 . 13 1 1 A 96 96 GLU C C 134 175.219 176.923 -1.704 1
1 1084 . 13 1 1 A 96 96 GLU CA C 134 55.874 56.575 -0.701 1
1 1085 . 13 1 1 A 96 96 GLU CB C 134 27.126 30.002 -2.876 1
1 1087 . 13 1 1 A 96 96 GLU N N 134 128.571 123.065 5.506 1
1 1088 . 13 1 1 A 97 97 GLY H H 135 10.677 8.578 2.099 1
1 1089 . 13 1 1 A 97 97 GLY HA2 H 135 4.037 4.361 -0.324 1
1 1090 . 13 1 1 A 97 97 GLY HA3 H 135 3.717 4.371 -0.654 1
1 1091 . 13 1 1 A 97 97 GLY C C 135 171.567 172.458 -0.891 1
1 1092 . 13 1 1 A 97 97 GLY CA C 135 41.500 45.814 -4.314 1
1 1093 . 13 1 1 A 97 97 GLY N N 135 117.011 110.153 6.858 1
1 1094 . 13 1 1 A 98 98 GLY H H 136 8.442 8.639 -0.197 1
1 1095 . 13 1 1 A 98 98 GLY HA2 H 136 4.195 4.239 -0.044 1
1 1096 . 13 1 1 A 98 98 GLY HA3 H 136 4.195 4.241 -0.046 1
1 1097 . 13 1 1 A 98 98 GLY C C 136 170.299 173.256 -2.957 1
1 1098 . 13 1 1 A 98 98 GLY CA C 136 40.875 44.736 -3.861 1
1 1099 . 13 1 1 A 98 98 GLY N N 136 109.494 109.379 0.115 1
1 1100 . 13 1 1 A 99 99 SER H H 137 8.701 8.784 -0.083 1
1 1101 . 13 1 1 A 99 99 SER HA H 137 4.639 4.913 -0.274 1
1 1104 . 13 1 1 A 99 99 SER C C 137 170.630 173.412 -2.782 1
1 1105 . 13 1 1 A 99 99 SER CA C 137 54.624 57.444 -2.820 1
1 1106 . 13 1 1 A 99 99 SER CB C 137 62.748 66.546 -3.798 1
1 1107 . 13 1 1 A 99 99 SER N N 137 114.685 118.529 -3.844 1
1 1108 . 13 1 1 A 100 100 ASP H H 138 9.117 9.132 -0.015 1
1 1109 . 13 1 1 A 100 100 ASP HA H 138 3.965 4.456 -0.491 1
1 1112 . 13 1 1 A 100 100 ASP C C 138 175.540 178.435 -2.895 1
1 1113 . 13 1 1 A 100 100 ASP CA C 138 54.624 57.147 -2.523 1
1 1114 . 13 1 1 A 100 100 ASP CB C 138 36.500 40.507 -4.007 1
1 1115 . 13 1 1 A 100 100 ASP N N 138 120.777 122.660 -1.883 1
1 1116 . 13 1 1 A 101 101 ASN H H 139 8.667 8.325 0.342 1
1 1117 . 13 1 1 A 101 101 ASN HA H 139 4.333 4.758 -0.425 1
1 1122 . 13 1 1 A 101 101 ASN CA C 139 53.999 54.140 -0.141 1
1 1123 . 13 1 1 A 101 101 ASN CB C 139 34.625 38.947 -4.322 1
1 1124 . 13 1 1 A 101 101 ASN N N 139 121.930 116.549 5.381 1
1 1126 . 13 1 1 A 102 102 ASP H H 140 7.714 7.770 -0.056 1
1 1127 . 13 1 1 A 102 102 ASP HA H 140 4.037 4.546 -0.509 1
1 1130 . 13 1 1 A 102 102 ASP C C 140 172.807 175.814 -3.007 1
1 1131 . 13 1 1 A 102 102 ASP CA C 140 53.374 54.201 -0.827 1
1 1132 . 13 1 1 A 102 102 ASP CB C 140 37.125 41.259 -4.134 1
1 1133 . 13 1 1 A 102 102 ASP N N 140 118.011 117.954 0.057 1
1 1134 . 13 1 1 A 103 103 ALA H H 141 7.060 7.284 -0.224 1
1 1135 . 13 1 1 A 103 103 ALA HA H 141 3.353 4.760 -1.407 1
1 1139 . 13 1 1 A 103 103 ALA C C 141 172.233 176.756 -4.523 1
1 1140 . 13 1 1 A 103 103 ALA CA C 141 49.624 51.425 -1.801 1
1 1141 . 13 1 1 A 103 103 ALA CB C 141 16.502 20.714 -4.212 1
1 1142 . 13 1 1 A 103 103 ALA N N 141 125.777 122.715 3.062 1
1 1143 . 13 1 1 A 104 104 ASP H H 142 7.973 8.670 -0.697 1
1 1144 . 13 1 1 A 104 104 ASP HA H 142 4.420 4.996 -0.576 1
1 1147 . 13 1 1 A 104 104 ASP C C 142 174.188 175.987 -1.799 1
1 1148 . 13 1 1 A 104 104 ASP CA C 142 52.124 53.797 -1.673 1
1 1149 . 13 1 1 A 104 104 ASP CB C 142 37.125 41.542 -4.417 1
1 1150 . 13 1 1 A 104 104 ASP N N 142 122.965 120.030 2.935 1
1 1151 . 13 1 1 A 105 105 ILE H H 143 8.534 8.598 -0.064 1
1 1152 . 13 1 1 A 105 105 ILE HA H 143 4.060 4.905 -0.845 1
1 1162 . 13 1 1 A 105 105 ILE C C 143 173.235 175.409 -2.174 1
1 1163 . 13 1 1 A 105 105 ILE CA C 143 58.374 60.031 -1.657 1
1 1164 . 13 1 1 A 105 105 ILE CB C 143 39.123 39.540 -0.417 1
1 1167 . 13 1 1 A 105 105 ILE N N 143 124.757 121.106 3.651 1
1 1168 . 13 1 1 A 106 106 GLY H H 144 8.288 8.503 -0.215 1
1 1169 . 13 1 1 A 106 106 GLY HA2 H 144 4.764 4.119 0.645 1
1 1170 . 13 1 1 A 106 106 GLY HA3 H 144 4.764 4.526 0.238 1
1 1171 . 13 1 1 A 106 106 GLY C C 144 171.321 171.676 -0.355 1
1 1172 . 13 1 1 A 106 106 GLY CA C 144 40.250 44.522 -4.272 1
1 1173 . 13 1 1 A 106 106 GLY N N 144 110.895 112.126 -1.231 1
1 1174 . 13 1 1 A 107 107 ASN H H 145 8.577 9.505 -0.928 1
1 1175 . 13 1 1 A 107 107 ASN HA H 145 4.268 5.381 -1.113 1
1 1180 . 13 1 1 A 107 107 ASN C C 145 171.757 174.035 -2.278 1
1 1181 . 13 1 1 A 107 107 ASN CA C 145 52.124 52.130 -0.006 1
1 1182 . 13 1 1 A 107 107 ASN CB C 145 34.625 41.883 -7.258 1
1 1183 . 13 1 1 A 107 107 ASN N N 145 118.042 119.788 -1.746 1
1 1185 . 13 1 1 A 108 108 TRP H H 146 6.822 8.389 -1.567 1
1 1186 . 13 1 1 A 108 108 TRP HA H 146 4.513 4.864 -0.351 1
1 1195 . 13 1 1 A 108 108 TRP C C 146 172.665 172.398 0.267 1
1 1196 . 13 1 1 A 108 108 TRP CA C 146 54.624 55.567 -0.943 1
1 1197 . 13 1 1 A 108 108 TRP CB C 146 25.876 31.338 -5.462 1
1 1198 . 13 1 1 A 108 108 TRP N N 146 116.756 121.964 -5.208 1
1 1200 . 13 1 1 A 109 109 ASP H H 147 7.344 7.942 -0.598 1
1 1201 . 13 1 1 A 109 109 ASP HA H 147 4.655 5.307 -0.652 1
1 1204 . 13 1 1 A 109 109 ASP C C 147 172.193 174.887 -2.694 1
1 1205 . 13 1 1 A 109 109 ASP CA C 147 51.499 53.254 -1.755 1
1 1206 . 13 1 1 A 109 109 ASP CB C 147 39.000 42.892 -3.892 1
1 1207 . 13 1 1 A 109 109 ASP N N 147 121.461 119.213 2.248 1
1 11 . 14 1 1 A 2 2 SER H H 40 8.461 8.894 -0.433 1
1 12 . 14 1 1 A 2 2 SER HA H 40 4.286 4.979 -0.693 1
1 15 . 14 1 1 A 2 2 SER C C 40 171.276 173.484 -2.208 1
1 16 . 14 1 1 A 2 2 SER CA C 40 55.249 57.415 -2.166 1
1 17 . 14 1 1 A 2 2 SER CB C 40 61.498 64.115 -2.617 1
1 18 . 14 1 1 A 2 2 SER N N 40 118.344 122.930 -4.586 1
1 19 . 14 1 1 A 3 3 ARG H H 41 8.469 8.330 0.139 1
1 20 . 14 1 1 A 3 3 ARG HA H 41 4.400 4.865 -0.465 1
1 25 . 14 1 1 A 3 3 ARG C C 41 172.251 173.545 -1.294 1
1 26 . 14 1 1 A 3 3 ARG CA C 41 52.749 52.910 -0.161 1
1 27 . 14 1 1 A 3 3 ARG CB C 41 27.126 33.284 -6.158 1
1 28 . 14 1 1 A 3 3 ARG N N 41 123.070 123.417 -0.347 1
1 33 . 14 1 1 A 4 4 PRO CA C 42 61.498 63.871 -2.373 1
1 34 . 14 1 1 A 4 4 PRO CB C 42 29.001 31.725 -2.724 1
1 37 . 14 1 1 A 5 5 ASP H H 43 8.246 8.898 -0.652 1
1 38 . 14 1 1 A 5 5 ASP HA H 43 4.329 4.337 -0.008 1
1 41 . 14 1 1 A 5 5 ASP C C 43 174.605 176.641 -2.036 1
1 42 . 14 1 1 A 5 5 ASP CA C 43 53.374 56.475 -3.101 1
1 43 . 14 1 1 A 5 5 ASP CB C 43 38.375 38.558 -0.183 1
1 44 . 14 1 1 A 5 5 ASP N N 43 119.409 116.908 2.501 1
1 45 . 14 1 1 A 6 6 GLN H H 44 8.309 8.293 0.016 1
1 46 . 14 1 1 A 6 6 GLN HA H 44 4.393 4.215 0.178 1
1 53 . 14 1 1 A 6 6 GLN C C 44 175.053 177.974 -2.921 1
1 54 . 14 1 1 A 6 6 GLN CA C 44 55.874 58.332 -2.458 1
1 55 . 14 1 1 A 6 6 GLN CB C 44 25.876 28.258 -2.382 1
1 57 . 14 1 1 A 6 6 GLN N N 44 122.273 118.138 4.135 1
1 59 . 14 1 1 A 7 7 ALA H H 45 8.106 8.132 -0.026 1
1 60 . 14 1 1 A 7 7 ALA HA H 45 3.993 4.112 -0.119 1
1 64 . 14 1 1 A 7 7 ALA C C 45 177.465 178.028 -0.563 1
1 65 . 14 1 1 A 7 7 ALA CA C 45 52.124 54.349 -2.225 1
1 66 . 14 1 1 A 7 7 ALA CB C 45 15.252 18.238 -2.986 1
1 67 . 14 1 1 A 7 7 ALA N N 45 122.204 121.765 0.439 1
1 68 . 14 1 1 A 8 8 LYS H H 46 7.527 7.687 -0.160 1
1 69 . 14 1 1 A 8 8 LYS HA H 46 3.539 4.145 -0.606 1
1 78 . 14 1 1 A 8 8 LYS C C 46 175.412 179.063 -3.651 1
1 79 . 14 1 1 A 8 8 LYS CA C 46 57.124 57.710 -0.586 1
1 80 . 14 1 1 A 8 8 LYS CB C 46 30.876 32.233 -1.357 1
1 83 . 14 1 1 A 8 8 LYS N N 46 117.358 116.454 0.904 1
1 84 . 14 1 1 A 9 9 VAL H H 47 7.709 7.622 0.087 1
1 85 . 14 1 1 A 9 9 VAL HA H 47 3.578 3.774 -0.196 1
1 93 . 14 1 1 A 9 9 VAL C C 47 175.005 178.264 -3.259 1
1 94 . 14 1 1 A 9 9 VAL CA C 47 64.623 66.073 -1.450 1
1 95 . 14 1 1 A 9 9 VAL CB C 47 29.001 31.879 -2.878 1
1 98 . 14 1 1 A 9 9 VAL N N 47 119.115 120.215 -1.100 1
1 99 . 14 1 1 A 10 10 THR H H 48 7.767 8.313 -0.546 1
1 100 . 14 1 1 A 10 10 THR HA H 48 3.668 4.038 -0.370 1
1 105 . 14 1 1 A 10 10 THR CA C 48 63.998 65.583 -1.585 1
1 106 . 14 1 1 A 10 10 THR CB C 48 67.123 68.758 -1.635 1
1 108 . 14 1 1 A 10 10 THR N N 48 115.112 114.212 0.900 1
1 109 . 14 1 1 A 11 11 VAL H H 49 7.598 7.952 -0.354 1
1 110 . 14 1 1 A 11 11 VAL HA H 49 3.457 3.575 -0.118 1
1 118 . 14 1 1 A 11 11 VAL C C 49 175.412 177.881 -2.469 1
1 119 . 14 1 1 A 11 11 VAL CA C 49 63.998 66.398 -2.400 1
1 120 . 14 1 1 A 11 11 VAL CB C 49 29.001 31.350 -2.349 1
1 123 . 14 1 1 A 11 11 VAL N N 49 123.694 121.173 2.521 1
1 124 . 14 1 1 A 12 12 ALA H H 50 8.176 8.086 0.090 1
1 125 . 14 1 1 A 12 12 ALA HA H 50 4.742 3.968 0.774 1
1 129 . 14 1 1 A 12 12 ALA C C 50 177.074 179.808 -2.734 1
1 130 . 14 1 1 A 12 12 ALA CA C 50 52.124 55.711 -3.587 1
1 131 . 14 1 1 A 12 12 ALA CB C 50 15.252 18.438 -3.186 1
1 132 . 14 1 1 A 12 12 ALA N N 50 122.348 122.449 -0.101 1
1 133 . 14 1 1 A 13 13 LYS H H 51 8.499 8.477 0.022 1
1 134 . 14 1 1 A 13 13 LYS HA H 51 3.648 4.107 -0.459 1
1 143 . 14 1 1 A 13 13 LYS C C 51 177.252 179.525 -2.273 1
1 144 . 14 1 1 A 13 13 LYS CA C 51 58.072 59.435 -1.363 1
1 145 . 14 1 1 A 13 13 LYS CB C 51 30.251 32.280 -2.029 1
1 146 . 14 1 1 A 13 13 LYS N N 51 115.402 116.065 -0.663 1
1 147 . 14 1 1 A 14 14 GLY H H 52 7.858 7.975 -0.117 1
1 148 . 14 1 1 A 14 14 GLY HA2 H 52 3.823 3.923 -0.100 1
1 149 . 14 1 1 A 14 14 GLY HA3 H 52 3.676 3.931 -0.255 1
1 150 . 14 1 1 A 14 14 GLY C C 52 174.090 175.226 -1.136 1
1 151 . 14 1 1 A 14 14 GLY CA C 52 44.625 46.000 -1.375 1
1 152 . 14 1 1 A 14 14 GLY N N 52 107.466 108.478 -1.012 1
1 153 . 14 1 1 A 15 15 ASP H H 53 8.403 7.915 0.488 1
1 154 . 14 1 1 A 15 15 ASP HA H 53 4.191 4.491 -0.300 1
1 157 . 14 1 1 A 15 15 ASP C C 53 175.316 178.202 -2.886 1
1 158 . 14 1 1 A 15 15 ASP CA C 53 54.624 56.755 -2.131 1
1 159 . 14 1 1 A 15 15 ASP CB C 53 35.875 41.013 -5.138 1
1 160 . 14 1 1 A 15 15 ASP N N 53 125.929 121.256 4.673 1
1 161 . 14 1 1 A 16 16 ILE H H 54 8.245 8.427 -0.182 1
1 162 . 14 1 1 A 16 16 ILE HA H 54 3.034 3.817 -0.783 1
1 172 . 14 1 1 A 16 16 ILE C C 54 174.499 177.863 -3.364 1
1 173 . 14 1 1 A 16 16 ILE CA C 54 62.748 64.153 -1.405 1
1 174 . 14 1 1 A 16 16 ILE CB C 54 34.625 37.488 -2.863 1
1 178 . 14 1 1 A 16 16 ILE N N 54 119.456 118.253 1.203 1
1 179 . 14 1 1 A 17 17 LYS H H 55 7.547 8.071 -0.524 1
1 180 . 14 1 1 A 17 17 LYS HA H 55 3.843 4.135 -0.292 1
1 187 . 14 1 1 A 17 17 LYS C C 55 176.651 178.750 -2.099 1
1 188 . 14 1 1 A 17 17 LYS CA C 55 57.124 58.737 -1.613 1
1 189 . 14 1 1 A 17 17 LYS CB C 55 30.251 32.069 -1.818 1
1 190 . 14 1 1 A 17 17 LYS N N 55 118.505 120.671 -2.166 1
1 191 . 14 1 1 A 18 18 ALA H H 56 7.680 7.820 -0.140 1
1 192 . 14 1 1 A 18 18 ALA HA H 56 4.029 4.041 -0.012 1
1 196 . 14 1 1 A 18 18 ALA C C 56 176.638 179.878 -3.240 1
1 197 . 14 1 1 A 18 18 ALA CA C 56 52.749 54.788 -2.039 1
1 198 . 14 1 1 A 18 18 ALA CB C 56 15.877 18.334 -2.457 1
1 199 . 14 1 1 A 18 18 ALA N N 56 122.477 121.732 0.745 1
1 200 . 14 1 1 A 19 19 ILE H H 57 8.853 7.676 1.177 1
1 201 . 14 1 1 A 19 19 ILE HA H 57 3.304 3.525 -0.221 1
1 211 . 14 1 1 A 19 19 ILE C C 57 174.710 177.716 -3.006 1
1 212 . 14 1 1 A 19 19 ILE CA C 57 63.373 65.338 -1.965 1
1 213 . 14 1 1 A 19 19 ILE CB C 57 35.250 37.848 -2.598 1
1 217 . 14 1 1 A 19 19 ILE N N 57 120.901 118.502 2.399 1
1 218 . 14 1 1 A 20 20 ALA H H 58 8.702 8.394 0.308 1
1 219 . 14 1 1 A 20 20 ALA HA H 58 3.900 3.926 -0.026 1
1 223 . 14 1 1 A 20 20 ALA C C 58 176.512 179.444 -2.932 1
1 224 . 14 1 1 A 20 20 ALA CA C 58 52.749 54.951 -2.202 1
1 225 . 14 1 1 A 20 20 ALA CB C 58 15.252 18.108 -2.856 1
1 226 . 14 1 1 A 20 20 ALA N N 58 121.763 122.278 -0.515 1
1 227 . 14 1 1 A 21 21 ALA H H 59 7.662 7.498 0.164 1
1 228 . 14 1 1 A 21 21 ALA HA H 59 4.136 4.271 -0.135 1
1 232 . 14 1 1 A 21 21 ALA C C 59 177.949 179.469 -1.520 1
1 233 . 14 1 1 A 21 21 ALA CA C 59 52.749 54.704 -1.955 1
1 234 . 14 1 1 A 21 21 ALA CB C 59 15.252 18.748 -3.496 1
1 235 . 14 1 1 A 21 21 ALA N N 59 119.079 119.224 -0.145 1
1 236 . 14 1 1 A 22 22 ALA H H 60 7.403 7.634 -0.231 1
1 237 . 14 1 1 A 22 22 ALA HA H 60 4.318 4.222 0.096 1
1 241 . 14 1 1 A 22 22 ALA C C 60 176.730 180.574 -3.844 1
1 242 . 14 1 1 A 22 22 ALA CA C 60 52.749 54.182 -1.433 1
1 243 . 14 1 1 A 22 22 ALA CB C 60 17.126 18.832 -1.706 1
1 244 . 14 1 1 A 22 22 ALA N N 60 122.616 120.202 2.414 1
1 245 . 14 1 1 A 23 23 LEU H H 61 8.410 8.724 -0.314 1
1 246 . 14 1 1 A 23 23 LEU HA H 61 3.527 3.898 -0.371 1
1 256 . 14 1 1 A 23 23 LEU C C 61 176.057 178.323 -2.266 1
1 257 . 14 1 1 A 23 23 LEU CA C 61 55.249 57.113 -1.864 1
1 258 . 14 1 1 A 23 23 LEU CB C 61 39.000 40.829 -1.829 1
1 262 . 14 1 1 A 23 23 LEU N N 61 120.761 121.072 -0.311 1
1 263 . 14 1 1 A 24 24 ASP H H 62 8.227 8.111 0.116 1
1 264 . 14 1 1 A 24 24 ASP HA H 62 4.581 4.524 0.057 1
1 267 . 14 1 1 A 24 24 ASP C C 62 176.968 177.931 -0.963 1
1 268 . 14 1 1 A 24 24 ASP CA C 62 55.874 56.441 -0.567 1
1 269 . 14 1 1 A 24 24 ASP CB C 62 37.750 40.777 -3.027 1
1 270 . 14 1 1 A 24 24 ASP N N 62 119.068 119.129 -0.061 1
1 271 . 14 1 1 A 25 25 MET H H 63 7.718 7.885 -0.167 1
1 272 . 14 1 1 A 25 25 MET HA H 63 4.196 4.284 -0.088 1
1 277 . 14 1 1 A 25 25 MET C C 63 174.968 177.800 -2.832 1
1 278 . 14 1 1 A 25 25 MET CA C 63 55.249 58.166 -2.917 1
1 279 . 14 1 1 A 25 25 MET CB C 63 29.626 32.164 -2.538 1
1 281 . 14 1 1 A 25 25 MET N N 63 121.365 117.449 3.916 1
1 282 . 14 1 1 A 26 26 TYR H H 64 8.401 7.404 0.997 1
1 283 . 14 1 1 A 26 26 TYR HA H 64 4.400 3.676 0.724 1
1 291 . 14 1 1 A 26 26 TYR C C 64 176.098 177.639 -1.541 1
1 292 . 14 1 1 A 26 26 TYR CA C 64 58.999 61.183 -2.184 1
1 293 . 14 1 1 A 26 26 TYR CB C 64 35.250 38.216 -2.966 1
1 294 . 14 1 1 A 26 26 TYR N N 64 122.575 122.046 0.529 1
1 295 . 14 1 1 A 27 27 LYS H H 65 8.330 8.224 0.106 1
1 296 . 14 1 1 A 27 27 LYS HA H 65 3.568 4.524 -0.956 1
1 302 . 14 1 1 A 27 27 LYS C C 65 176.156 178.323 -2.167 1
1 303 . 14 1 1 A 27 27 LYS CA C 65 56.499 59.115 -2.616 1
1 304 . 14 1 1 A 27 27 LYS CB C 65 29.626 31.927 -2.301 1
1 306 . 14 1 1 A 27 27 LYS N N 65 121.390 119.239 2.151 1
1 307 . 14 1 1 A 28 28 LEU H H 66 7.833 7.349 0.484 1
1 308 . 14 1 1 A 28 28 LEU HA H 66 3.769 4.104 -0.335 1
1 318 . 14 1 1 A 28 28 LEU C C 66 175.925 178.022 -2.097 1
1 319 . 14 1 1 A 28 28 LEU CA C 66 55.874 56.899 -1.025 1
1 320 . 14 1 1 A 28 28 LEU CB C 66 38.375 42.530 -4.155 1
1 324 . 14 1 1 A 28 28 LEU N N 66 123.068 120.556 2.512 1
1 325 . 14 1 1 A 29 29 ASP H H 67 7.292 7.859 -0.567 1
1 326 . 14 1 1 A 29 29 ASP HA H 67 4.096 4.335 -0.239 1
1 329 . 14 1 1 A 29 29 ASP C C 67 174.618 176.820 -2.202 1
1 330 . 14 1 1 A 29 29 ASP CA C 67 53.999 56.461 -2.462 1
1 331 . 14 1 1 A 29 29 ASP CB C 67 38.375 40.770 -2.395 1
1 332 . 14 1 1 A 29 29 ASP N N 67 114.729 118.695 -3.966 1
1 333 . 14 1 1 A 30 30 ASN H H 68 8.097 7.851 0.246 1
1 334 . 14 1 1 A 30 30 ASN HA H 68 4.337 4.405 -0.068 1
1 339 . 14 1 1 A 30 30 ASN C C 68 172.822 174.261 -1.439 1
1 340 . 14 1 1 A 30 30 ASN CA C 68 52.124 52.127 -0.003 1
1 341 . 14 1 1 A 30 30 ASN CB C 68 37.750 38.495 -0.745 1
1 342 . 14 1 1 A 30 30 ASN N N 68 111.054 115.242 -4.188 1
1 344 . 14 1 1 A 31 31 PHE H H 69 8.249 8.005 0.244 1
1 345 . 14 1 1 A 31 31 PHE HA H 69 4.135 4.422 -0.287 1
1 353 . 14 1 1 A 31 31 PHE C C 69 170.485 174.284 -3.799 1
1 354 . 14 1 1 A 31 31 PHE CA C 69 57.749 58.789 -1.040 1
1 355 . 14 1 1 A 31 31 PHE CB C 69 33.375 36.611 -3.236 1
1 356 . 14 1 1 A 31 31 PHE N N 69 116.277 117.347 -1.070 1
1 357 . 14 1 1 A 32 32 ALA H H 70 7.224 7.185 0.039 1
1 358 . 14 1 1 A 32 32 ALA HA H 70 4.194 4.524 -0.330 1
1 362 . 14 1 1 A 32 32 ALA C C 70 173.337 175.084 -1.747 1
1 363 . 14 1 1 A 32 32 ALA CA C 70 48.374 51.526 -3.152 1
1 364 . 14 1 1 A 32 32 ALA CB C 70 19.626 22.346 -2.720 1
1 365 . 14 1 1 A 32 32 ALA N N 70 119.914 120.367 -0.453 1
1 366 . 14 1 1 A 33 33 TYR H H 71 7.948 8.340 -0.392 1
1 367 . 14 1 1 A 33 33 TYR HA H 71 4.209 4.877 -0.668 1
1 374 . 14 1 1 A 33 33 TYR C C 71 170.591 174.073 -3.482 1
1 375 . 14 1 1 A 33 33 TYR CA C 71 54.624 56.459 -1.835 1
1 376 . 14 1 1 A 33 33 TYR CB C 71 34.000 37.524 -3.524 1
1 377 . 14 1 1 A 33 33 TYR N N 71 116.929 118.104 -1.175 1
1 378 . 14 1 1 A 34 34 PRO HA H 72 4.444 4.512 -0.068 1
1 381 . 14 1 1 A 34 34 PRO C C 72 174.775 176.226 -1.451 1
1 382 . 14 1 1 A 34 34 PRO CA C 72 59.624 62.226 -2.602 1
1 383 . 14 1 1 A 34 34 PRO CB C 72 28.376 32.194 -3.818 1
1 384 . 14 1 1 A 35 35 SER H H 73 8.721 8.377 0.344 1
1 385 . 14 1 1 A 35 35 SER HA H 73 4.467 4.771 -0.304 1
1 388 . 14 1 1 A 35 35 SER C C 73 173.271 175.642 -2.371 1
1 389 . 14 1 1 A 35 35 SER CA C 73 55.249 56.513 -1.264 1
1 390 . 14 1 1 A 35 35 SER CB C 73 63.373 66.090 -2.717 1
1 391 . 14 1 1 A 35 35 SER N N 73 118.284 114.116 4.168 1
1 392 . 14 1 1 A 36 36 THR H H 74 8.591 8.858 -0.267 1
1 393 . 14 1 1 A 36 36 THR HA H 74 3.649 4.152 -0.503 1
1 398 . 14 1 1 A 36 36 THR CA C 74 64.623 64.135 0.488 1
1 399 . 14 1 1 A 36 36 THR CB C 74 66.498 69.108 -2.610 1
1 401 . 14 1 1 A 36 36 THR N N 74 117.769 117.312 0.457 1
1 402 . 14 1 1 A 37 37 GLN H H 75 8.210 7.878 0.332 1
1 403 . 14 1 1 A 37 37 GLN HA H 75 3.860 4.417 -0.557 1
1 410 . 14 1 1 A 37 37 GLN C C 75 175.349 177.633 -2.284 1
1 411 . 14 1 1 A 37 37 GLN CA C 75 56.499 57.697 -1.198 1
1 412 . 14 1 1 A 37 37 GLN CB C 75 25.876 29.522 -3.646 1
1 414 . 14 1 1 A 37 37 GLN N N 75 117.931 119.952 -2.021 1
1 416 . 14 1 1 A 38 38 GLN H H 76 7.667 8.126 -0.459 1
1 417 . 14 1 1 A 38 38 GLN HA H 76 3.810 4.099 -0.289 1
1 424 . 14 1 1 A 38 38 GLN C C 76 175.805 179.508 -3.703 1
1 425 . 14 1 1 A 38 38 GLN CA C 76 55.874 58.646 -2.772 1
1 426 . 14 1 1 A 38 38 GLN CB C 76 25.876 28.327 -2.451 1
1 428 . 14 1 1 A 38 38 GLN N N 76 120.607 118.356 2.251 1
1 430 . 14 1 1 A 39 39 GLY H H 77 8.470 8.185 0.285 1
1 431 . 14 1 1 A 39 39 GLY HA2 H 77 3.920 3.655 0.265 1
1 432 . 14 1 1 A 39 39 GLY HA3 H 77 3.603 3.734 -0.131 1
1 433 . 14 1 1 A 39 39 GLY C C 77 169.006 175.437 -6.431 1
1 434 . 14 1 1 A 39 39 GLY CA C 77 42.125 46.527 -4.402 1
1 435 . 14 1 1 A 39 39 GLY N N 77 103.281 109.113 -5.832 1
1 436 . 14 1 1 A 40 40 LEU H H 78 8.135 7.742 0.393 1
1 437 . 14 1 1 A 40 40 LEU HA H 78 3.237 4.188 -0.951 1
1 447 . 14 1 1 A 40 40 LEU C C 78 176.383 178.944 -2.561 1
1 448 . 14 1 1 A 40 40 LEU CA C 78 52.749 57.184 -4.435 1
1 449 . 14 1 1 A 40 40 LEU CB C 78 39.000 41.631 -2.631 1
1 453 . 14 1 1 A 40 40 LEU N N 78 114.444 123.476 -9.032 1
1 454 . 14 1 1 A 41 41 GLU H H 79 8.578 8.015 0.563 1
1 455 . 14 1 1 A 41 41 GLU HA H 79 3.720 4.080 -0.360 1
1 460 . 14 1 1 A 41 41 GLU C C 79 175.093 177.971 -2.878 1
1 461 . 14 1 1 A 41 41 GLU CA C 79 57.124 59.395 -2.271 1
1 462 . 14 1 1 A 41 41 GLU CB C 79 26.501 29.363 -2.862 1
1 464 . 14 1 1 A 41 41 GLU N N 79 118.295 118.598 -0.303 1
1 465 . 14 1 1 A 42 42 ALA H H 80 7.227 7.709 -0.482 1
1 466 . 14 1 1 A 42 42 ALA HA H 80 4.437 4.926 -0.489 1
1 470 . 14 1 1 A 42 42 ALA C C 80 173.745 178.195 -4.450 1
1 471 . 14 1 1 A 42 42 ALA CA C 80 51.499 53.249 -1.750 1
1 472 . 14 1 1 A 42 42 ALA CB C 80 15.877 19.056 -3.179 1
1 473 . 14 1 1 A 42 42 ALA N N 80 119.751 121.701 -1.950 1
1 474 . 14 1 1 A 43 43 LEU H H 81 7.932 7.695 0.237 1
1 475 . 14 1 1 A 43 43 LEU HA H 81 4.369 4.609 -0.240 1
1 485 . 14 1 1 A 43 43 LEU C C 81 174.788 178.141 -3.353 1
1 486 . 14 1 1 A 43 43 LEU CA C 81 53.374 55.849 -2.475 1
1 487 . 14 1 1 A 43 43 LEU CB C 81 39.625 42.447 -2.822 1
1 491 . 14 1 1 A 43 43 LEU N N 81 111.742 116.969 -5.227 1
1 492 . 14 1 1 A 44 44 VAL H H 82 7.886 7.556 0.330 1
1 493 . 14 1 1 A 44 44 VAL HA H 82 4.700 4.388 0.312 1
1 501 . 14 1 1 A 44 44 VAL C C 82 172.875 175.698 -2.823 1
1 502 . 14 1 1 A 44 44 VAL CA C 82 59.624 63.583 -3.959 1
1 503 . 14 1 1 A 44 44 VAL CB C 82 31.501 33.602 -2.101 1
1 506 . 14 1 1 A 44 44 VAL N N 82 113.604 115.531 -1.927 1
1 507 . 14 1 1 A 45 45 LYS H H 83 8.361 8.288 0.073 1
1 508 . 14 1 1 A 45 45 LYS HA H 83 4.251 4.858 -0.607 1
1 515 . 14 1 1 A 45 45 LYS C C 83 171.053 175.914 -4.861 1
1 516 . 14 1 1 A 45 45 LYS CA C 83 52.749 54.435 -1.686 1
1 517 . 14 1 1 A 45 45 LYS CB C 83 33.375 36.564 -3.189 1
1 521 . 14 1 1 A 45 45 LYS N N 83 123.860 119.065 4.795 1
1 522 . 14 1 1 A 46 46 LYS H H 84 7.243 7.969 -0.726 1
1 523 . 14 1 1 A 46 46 LYS HA H 84 2.175 2.762 -0.587 1
1 532 . 14 1 1 A 46 46 LYS C C 84 172.123 174.489 -2.366 1
1 533 . 14 1 1 A 46 46 LYS CA C 84 52.749 54.292 -1.543 1
1 534 . 14 1 1 A 46 46 LYS CB C 84 29.626 31.325 -1.699 1
1 537 . 14 1 1 A 46 46 LYS N N 84 128.615 122.021 6.594 1
1 538 . 14 1 1 A 47 47 PRO HA H 85 4.470 4.417 0.053 1
1 541 . 14 1 1 A 47 47 PRO C C 85 173.754 176.976 -3.222 1
1 542 . 14 1 1 A 47 47 PRO CA C 85 60.874 63.134 -2.260 1
1 543 . 14 1 1 A 47 47 PRO CB C 85 30.876 32.285 -1.409 1
1 546 . 14 1 1 A 48 48 THR H H 86 8.306 8.574 -0.268 1
1 547 . 14 1 1 A 48 48 THR HA H 86 4.287 4.443 -0.156 1
1 552 . 14 1 1 A 48 48 THR C C 86 173.070 174.764 -1.694 1
1 553 . 14 1 1 A 48 48 THR CA C 86 57.749 62.505 -4.756 1
1 554 . 14 1 1 A 48 48 THR CB C 86 67.748 69.553 -1.805 1
1 556 . 14 1 1 A 48 48 THR N N 86 109.564 117.748 -8.184 1
1 557 . 14 1 1 A 49 49 GLY H H 87 8.317 7.800 0.517 1
1 558 . 14 1 1 A 49 49 GLY HA2 H 87 3.851 4.032 -0.181 1
1 559 . 14 1 1 A 49 49 GLY HA3 H 87 3.678 4.040 -0.362 1
1 560 . 14 1 1 A 49 49 GLY C C 87 169.693 173.035 -3.342 1
1 561 . 14 1 1 A 49 49 GLY CA C 87 42.125 44.316 -2.191 1
1 562 . 14 1 1 A 49 49 GLY N N 87 109.071 110.160 -1.089 1
1 563 . 14 1 1 A 50 50 ASN H H 88 8.301 8.791 -0.490 1
1 564 . 14 1 1 A 50 50 ASN HA H 88 4.780 5.376 -0.596 1
1 569 . 14 1 1 A 50 50 ASN C C 88 171.370 174.526 -3.156 1
1 570 . 14 1 1 A 50 50 ASN CA C 88 47.749 50.744 -2.995 1
1 571 . 14 1 1 A 50 50 ASN CB C 88 37.125 38.977 -1.852 1
1 572 . 14 1 1 A 50 50 ASN N N 88 115.631 117.965 -2.334 1
1 574 . 14 1 1 A 51 51 PRO HA H 89 4.782 4.675 0.107 1
1 577 . 14 1 1 A 51 51 PRO C C 89 173.656 175.621 -1.965 1
1 578 . 14 1 1 A 51 51 PRO CA C 89 59.624 62.239 -2.615 1
1 579 . 14 1 1 A 51 51 PRO CB C 89 31.501 32.370 -0.869 1
1 582 . 14 1 1 A 52 52 GLN H H 90 9.076 8.568 0.508 1
1 583 . 14 1 1 A 52 52 GLN HA H 90 4.469 4.950 -0.481 1
1 590 . 14 1 1 A 52 52 GLN C C 90 172.386 173.723 -1.337 1
1 591 . 14 1 1 A 52 52 GLN CA C 90 50.874 52.472 -1.598 1
1 592 . 14 1 1 A 52 52 GLN CB C 90 26.501 29.669 -3.168 1
1 594 . 14 1 1 A 52 52 GLN N N 90 126.827 119.442 7.385 1
1 596 . 14 1 1 A 53 53 PRO HA H 91 4.384 4.428 -0.044 1
1 599 . 14 1 1 A 53 53 PRO C C 91 174.274 175.507 -1.233 1
1 600 . 14 1 1 A 53 53 PRO CB C 91 28.113 31.870 -3.757 1
1 601 . 14 1 1 A 54 54 LYS H H 92 8.401 8.753 -0.352 1
1 602 . 14 1 1 A 54 54 LYS HA H 92 3.984 4.785 -0.801 1
1 611 . 14 1 1 A 54 54 LYS C C 92 173.516 174.794 -1.278 1
1 612 . 14 1 1 A 54 54 LYS CA C 92 55.249 55.322 -0.073 1
1 613 . 14 1 1 A 54 54 LYS CB C 92 30.876 36.059 -5.183 1
1 615 . 14 1 1 A 54 54 LYS N N 92 124.538 124.202 0.336 1
1 616 . 14 1 1 A 55 55 ASN H H 93 8.183 8.736 -0.553 1
1 617 . 14 1 1 A 55 55 ASN HA H 93 4.716 4.869 -0.153 1
1 622 . 14 1 1 A 55 55 ASN CA C 93 48.999 53.489 -4.490 1
1 623 . 14 1 1 A 55 55 ASN CB C 93 35.875 38.216 -2.341 1
1 624 . 14 1 1 A 55 55 ASN N N 93 118.677 122.681 -4.004 1
1 626 . 14 1 1 A 56 56 TRP H H 94 8.007 8.511 -0.504 1
1 627 . 14 1 1 A 56 56 TRP HA H 94 3.827 5.291 -1.464 1
1 635 . 14 1 1 A 56 56 TRP C C 94 173.760 175.351 -1.591 1
1 636 . 14 1 1 A 56 56 TRP CA C 94 59.624 58.658 0.966 1
1 637 . 14 1 1 A 56 56 TRP CB C 94 27.126 30.328 -3.202 1
1 638 . 14 1 1 A 56 56 TRP N N 94 122.195 128.004 -5.809 1
1 640 . 14 1 1 A 57 57 ASN H H 95 7.563 7.319 0.244 1
1 641 . 14 1 1 A 57 57 ASN HA H 95 3.735 4.746 -1.011 1
1 646 . 14 1 1 A 57 57 ASN C C 95 171.952 173.689 -1.737 1
1 647 . 14 1 1 A 57 57 ASN CA C 95 51.499 51.092 0.407 1
1 648 . 14 1 1 A 57 57 ASN CB C 95 35.250 41.215 -5.965 1
1 649 . 14 1 1 A 57 57 ASN N N 95 129.659 125.125 4.534 1
1 651 . 14 1 1 A 58 58 LYS H H 96 8.110 7.945 0.165 1
1 652 . 14 1 1 A 58 58 LYS HA H 96 4.035 4.324 -0.289 1
1 659 . 14 1 1 A 58 58 LYS C C 96 174.530 175.539 -1.009 1
1 660 . 14 1 1 A 58 58 LYS CA C 96 56.499 54.473 2.026 1
1 661 . 14 1 1 A 58 58 LYS CB C 96 29.626 32.751 -3.125 1
1 665 . 14 1 1 A 58 58 LYS N N 96 123.913 122.739 1.174 1
1 666 . 14 1 1 A 59 59 ASP H H 97 7.903 9.199 -1.296 1
1 667 . 14 1 1 A 59 59 ASP HA H 97 4.393 4.293 0.100 1
1 670 . 14 1 1 A 59 59 ASP C C 97 173.724 174.916 -1.192 1
1 671 . 14 1 1 A 59 59 ASP CA C 97 52.124 54.887 -2.763 1
1 672 . 14 1 1 A 59 59 ASP CB C 97 38.375 39.683 -1.308 1
1 673 . 14 1 1 A 59 59 ASP N N 97 118.773 119.557 -0.784 1
1 674 . 14 1 1 A 60 60 GLY H H 98 7.819 7.699 0.120 1
1 675 . 14 1 1 A 60 60 GLY HA2 H 98 3.917 2.610 1.307 1
1 676 . 14 1 1 A 60 60 GLY HA3 H 98 3.917 3.346 0.571 1
1 677 . 14 1 1 A 60 60 GLY C C 98 168.652 174.116 -5.464 1
1 678 . 14 1 1 A 60 60 GLY CA C 98 41.500 45.044 -3.544 1
1 679 . 14 1 1 A 60 60 GLY N N 98 108.742 104.531 4.211 1
1 680 . 14 1 1 A 61 61 TYR H H 99 8.105 7.782 0.323 1
1 681 . 14 1 1 A 61 61 TYR HA H 99 3.927 4.243 -0.316 1
1 689 . 14 1 1 A 61 61 TYR C C 99 172.831 173.928 -1.097 1
1 690 . 14 1 1 A 61 61 TYR CA C 99 57.124 58.020 -0.896 1
1 691 . 14 1 1 A 61 61 TYR CB C 99 37.125 36.592 0.533 1
1 692 . 14 1 1 A 61 61 TYR N N 99 113.836 112.788 1.048 1
1 693 . 14 1 1 A 62 62 LEU H H 100 7.352 7.928 -0.576 1
1 694 . 14 1 1 A 62 62 LEU HA H 100 4.343 4.785 -0.442 1
1 704 . 14 1 1 A 62 62 LEU C C 100 173.430 175.097 -1.667 1
1 705 . 14 1 1 A 62 62 LEU CA C 100 50.874 53.006 -2.132 1
1 706 . 14 1 1 A 62 62 LEU CB C 100 44.000 44.978 -0.978 1
1 710 . 14 1 1 A 62 62 LEU N N 100 117.112 121.821 -4.709 1
1 711 . 14 1 1 A 63 63 LYS H H 101 8.626 8.297 0.329 1
1 712 . 14 1 1 A 63 63 LYS HA H 101 3.986 4.512 -0.526 1
1 721 . 14 1 1 A 63 63 LYS C C 101 173.851 176.824 -2.973 1
1 722 . 14 1 1 A 63 63 LYS CA C 101 55.249 55.158 0.091 1
1 723 . 14 1 1 A 63 63 LYS CB C 101 29.626 33.755 -4.129 1
1 724 . 14 1 1 A 63 63 LYS N N 101 129.991 121.480 8.511 1
1 725 . 14 1 1 A 64 64 LYS H H 102 7.059 8.507 -1.448 1
1 726 . 14 1 1 A 64 64 LYS HA H 102 4.138 4.206 -0.068 1
1 735 . 14 1 1 A 64 64 LYS C C 102 171.120 175.710 -4.590 1
1 736 . 14 1 1 A 64 64 LYS CA C 102 52.749 56.389 -3.640 1
1 737 . 14 1 1 A 64 64 LYS CB C 102 32.750 31.383 1.367 1
1 740 . 14 1 1 A 64 64 LYS N N 102 113.255 120.860 -7.605 1
1 741 . 14 1 1 A 65 65 LEU H H 103 8.883 8.040 0.843 1
1 742 . 14 1 1 A 65 65 LEU HA H 103 4.475 4.740 -0.265 1
1 752 . 14 1 1 A 65 65 LEU C C 103 171.487 174.318 -2.831 1
1 753 . 14 1 1 A 65 65 LEU CA C 103 48.999 51.061 -2.062 1
1 754 . 14 1 1 A 65 65 LEU CB C 103 39.625 45.098 -5.473 1
1 758 . 14 1 1 A 65 65 LEU N N 103 126.355 122.365 3.990 1
1 759 . 14 1 1 A 66 66 PRO HA H 104 4.449 4.601 -0.152 1
1 764 . 14 1 1 A 66 66 PRO C C 104 173.363 176.059 -2.696 1
1 765 . 14 1 1 A 66 66 PRO CA C 104 60.249 62.181 -1.932 1
1 766 . 14 1 1 A 66 66 PRO CB C 104 29.626 32.984 -3.358 1
1 769 . 14 1 1 A 67 67 VAL H H 105 7.682 8.386 -0.704 1
1 770 . 14 1 1 A 67 67 VAL HA H 105 4.121 4.438 -0.317 1
1 778 . 14 1 1 A 67 67 VAL C C 105 171.667 174.945 -3.278 1
1 779 . 14 1 1 A 67 67 VAL CA C 105 58.374 61.074 -2.700 1
1 780 . 14 1 1 A 67 67 VAL CB C 105 30.251 33.476 -3.225 1
1 783 . 14 1 1 A 67 67 VAL N N 105 114.671 121.214 -6.543 1
1 784 . 14 1 1 A 68 68 ASP H H 106 8.216 8.522 -0.306 1
1 785 . 14 1 1 A 68 68 ASP HA H 106 4.474 4.741 -0.267 1
1 788 . 14 1 1 A 68 68 ASP C C 106 172.452 175.447 -2.995 1
1 789 . 14 1 1 A 68 68 ASP CA C 106 50.249 52.174 -1.925 1
1 790 . 14 1 1 A 68 68 ASP CB C 106 37.750 40.825 -3.075 1
1 791 . 14 1 1 A 68 68 ASP N N 106 123.825 126.029 -2.204 1
1 792 . 14 1 1 A 69 69 PRO HA H 107 3.920 4.048 -0.128 1
1 797 . 14 1 1 A 69 69 PRO CA C 107 62.123 63.001 -0.878 1
1 798 . 14 1 1 A 69 69 PRO CB C 107 27.751 31.638 -3.887 1
1 801 . 14 1 1 A 70 70 TRP H H 108 8.156 8.436 -0.280 1
1 802 . 14 1 1 A 70 70 TRP HA H 108 4.274 4.298 -0.024 1
1 811 . 14 1 1 A 70 70 TRP CA C 108 57.124 58.511 -1.387 1
1 812 . 14 1 1 A 70 70 TRP CB C 108 25.251 27.105 -1.854 1
1 813 . 14 1 1 A 70 70 TRP N N 108 118.137 118.340 -0.203 1
1 815 . 14 1 1 A 71 71 GLY H H 109 8.209 8.759 -0.550 1
1 816 . 14 1 1 A 71 71 GLY HA2 H 109 4.030 3.902 0.128 1
1 817 . 14 1 1 A 71 71 GLY HA3 H 109 3.303 3.926 -0.623 1
1 818 . 14 1 1 A 71 71 GLY CA C 109 42.750 46.704 -3.954 1
1 819 . 14 1 1 A 71 71 GLY N N 109 107.495 105.418 2.077 1
1 820 . 14 1 1 A 72 72 ASN H H 110 8.116 8.041 0.075 1
1 821 . 14 1 1 A 72 72 ASN HA H 110 5.103 5.075 0.028 1
1 826 . 14 1 1 A 72 72 ASN CA C 110 48.374 50.137 -1.763 1
1 827 . 14 1 1 A 72 72 ASN CB C 110 36.500 39.173 -2.673 1
1 828 . 14 1 1 A 72 72 ASN N N 110 120.108 119.532 0.576 1
1 830 . 14 1 1 A 73 73 PRO HA H 111 4.397 4.572 -0.175 1
1 835 . 14 1 1 A 73 73 PRO C C 111 176.229 176.197 0.032 1
1 836 . 14 1 1 A 73 73 PRO CA C 111 60.249 62.447 -2.198 1
1 837 . 14 1 1 A 73 73 PRO CB C 111 29.001 32.183 -3.182 1
1 840 . 14 1 1 A 74 74 TYR H H 112 8.893 8.642 0.251 1
1 841 . 14 1 1 A 74 74 TYR HA H 112 4.064 4.837 -0.773 1
1 849 . 14 1 1 A 74 74 TYR C C 112 171.951 175.948 -3.997 1
1 850 . 14 1 1 A 74 74 TYR CA C 112 60.249 58.270 1.979 1
1 851 . 14 1 1 A 74 74 TYR CB C 112 36.500 39.548 -3.048 1
1 852 . 14 1 1 A 74 74 TYR N N 112 124.595 121.060 3.535 1
1 853 . 14 1 1 A 75 75 GLN H H 113 9.127 8.930 0.197 1
1 854 . 14 1 1 A 75 75 GLN HA H 113 4.019 4.361 -0.342 1
1 861 . 14 1 1 A 75 75 GLN C C 113 171.436 174.139 -2.703 1
1 862 . 14 1 1 A 75 75 GLN CA C 113 50.874 54.626 -3.752 1
1 863 . 14 1 1 A 75 75 GLN CB C 113 29.469 29.467 0.002 1
1 865 . 14 1 1 A 75 75 GLN N N 113 120.777 121.982 -1.205 1
1 867 . 14 1 1 A 76 76 TYR H H 114 7.906 8.488 -0.582 1
1 868 . 14 1 1 A 76 76 TYR HA H 114 5.586 5.025 0.561 1
1 875 . 14 1 1 A 76 76 TYR C C 114 171.343 175.572 -4.229 1
1 876 . 14 1 1 A 76 76 TYR CA C 114 53.999 57.336 -3.337 1
1 877 . 14 1 1 A 76 76 TYR CB C 114 40.250 39.929 0.321 1
1 878 . 14 1 1 A 76 76 TYR N N 114 120.757 123.785 -3.028 1
1 879 . 14 1 1 A 77 77 LEU H H 115 8.261 8.767 -0.506 1
1 880 . 14 1 1 A 77 77 LEU HA H 115 4.280 5.077 -0.797 1
1 890 . 14 1 1 A 77 77 LEU C C 115 170.921 175.845 -4.924 1
1 891 . 14 1 1 A 77 77 LEU CA C 115 51.499 53.456 -1.957 1
1 892 . 14 1 1 A 77 77 LEU CB C 115 44.625 45.127 -0.502 1
1 896 . 14 1 1 A 77 77 LEU N N 115 130.662 124.549 6.113 1
1 897 . 14 1 1 A 78 78 ALA H H 116 7.973 8.338 -0.365 1
1 898 . 14 1 1 A 78 78 ALA HA H 116 4.292 4.627 -0.335 1
1 902 . 14 1 1 A 78 78 ALA C C 116 172.093 175.058 -2.965 1
1 903 . 14 1 1 A 78 78 ALA CA C 116 47.749 49.960 -2.211 1
1 904 . 14 1 1 A 78 78 ALA CB C 116 19.626 20.309 -0.683 1
1 905 . 14 1 1 A 78 78 ALA N N 116 125.564 126.675 -1.111 1
1 906 . 14 1 1 A 79 79 PRO HA H 117 4.698 4.992 -0.294 1
1 911 . 14 1 1 A 79 79 PRO C C 117 173.994 176.651 -2.657 1
1 912 . 14 1 1 A 79 79 PRO CA C 117 60.249 63.816 -3.567 1
1 913 . 14 1 1 A 79 79 PRO CB C 117 31.501 31.851 -0.350 1
1 916 . 14 1 1 A 80 80 GLY H H 118 7.096 8.309 -1.213 1
1 917 . 14 1 1 A 80 80 GLY HA2 H 118 3.797 4.044 -0.247 1
1 918 . 14 1 1 A 80 80 GLY HA3 H 118 3.517 4.058 -0.541 1
1 919 . 14 1 1 A 80 80 GLY C C 118 171.404 174.503 -3.099 1
1 920 . 14 1 1 A 80 80 GLY CA C 118 41.500 46.322 -4.822 1
1 921 . 14 1 1 A 80 80 GLY N N 118 108.306 107.549 0.757 1
1 922 . 14 1 1 A 81 81 THR H H 119 9.810 8.613 1.197 1
1 923 . 14 1 1 A 81 81 THR HA H 119 4.091 4.535 -0.444 1
1 928 . 14 1 1 A 81 81 THR C C 119 174.242 175.377 -1.135 1
1 929 . 14 1 1 A 81 81 THR CA C 119 60.874 62.255 -1.381 1
1 930 . 14 1 1 A 81 81 THR CB C 119 66.498 67.808 -1.310 1
1 932 . 14 1 1 A 81 81 THR N N 119 112.813 115.563 -2.750 1
1 933 . 14 1 1 A 82 82 LYS H H 120 8.964 8.661 0.303 1
1 934 . 14 1 1 A 82 82 LYS HA H 120 4.150 3.948 0.202 1
1 941 . 14 1 1 A 82 82 LYS C C 120 172.886 175.657 -2.771 1
1 942 . 14 1 1 A 82 82 LYS CA C 120 53.999 58.031 -4.032 1
1 943 . 14 1 1 A 82 82 LYS CB C 120 30.876 30.702 0.174 1
1 944 . 14 1 1 A 82 82 LYS N N 120 123.569 124.417 -0.848 1
1 945 . 14 1 1 A 83 83 GLY H H 121 7.125 7.907 -0.782 1
1 946 . 14 1 1 A 83 83 GLY HA2 H 121 3.814 4.082 -0.268 1
1 947 . 14 1 1 A 83 83 GLY HA3 H 121 3.814 4.085 -0.271 1
1 948 . 14 1 1 A 83 83 GLY C C 121 167.671 174.495 -6.824 1
1 949 . 14 1 1 A 83 83 GLY CA C 121 42.125 45.045 -2.920 1
1 950 . 14 1 1 A 83 83 GLY N N 121 107.253 106.710 0.543 1
1 951 . 14 1 1 A 84 84 PRO HA H 122 4.077 4.351 -0.274 1
1 958 . 14 1 1 A 84 84 PRO C C 122 175.199 176.771 -1.572 1
1 959 . 14 1 1 A 84 84 PRO CA C 122 63.373 65.093 -1.720 1
1 960 . 14 1 1 A 84 84 PRO CB C 122 30.251 31.743 -1.492 1
1 962 . 14 1 1 A 85 85 PHE H H 123 6.652 6.544 0.108 1
1 963 . 14 1 1 A 85 85 PHE HA H 123 4.744 4.704 0.040 1
1 971 . 14 1 1 A 85 85 PHE C C 123 170.340 171.923 -1.583 1
1 972 . 14 1 1 A 85 85 PHE CA C 123 53.999 56.279 -2.280 1
1 973 . 14 1 1 A 85 85 PHE CB C 123 39.000 40.689 -1.689 1
1 974 . 14 1 1 A 85 85 PHE N N 123 108.468 111.019 -2.551 1
1 975 . 14 1 1 A 86 86 ASP H H 124 9.268 8.435 0.833 1
1 976 . 14 1 1 A 86 86 ASP HA H 124 5.108 3.596 1.512 1
1 979 . 14 1 1 A 86 86 ASP C C 124 171.180 174.332 -3.152 1
1 980 . 14 1 1 A 86 86 ASP CA C 124 50.249 52.902 -2.653 1
1 981 . 14 1 1 A 86 86 ASP CB C 124 40.250 41.622 -1.372 1
1 982 . 14 1 1 A 86 86 ASP N N 124 121.741 119.494 2.247 1
1 983 . 14 1 1 A 87 87 LEU H H 125 8.018 8.196 -0.178 1
1 984 . 14 1 1 A 87 87 LEU HA H 125 5.809 5.366 0.443 1
1 994 . 14 1 1 A 87 87 LEU C C 125 171.350 174.810 -3.460 1
1 995 . 14 1 1 A 87 87 LEU CA C 125 50.874 53.433 -2.559 1
1 996 . 14 1 1 A 87 87 LEU CB C 125 44.318 45.626 -1.308 1
1 999 . 14 1 1 A 87 87 LEU N N 125 123.629 127.155 -3.526 1
1 1000 . 14 1 1 A 88 88 TYR H H 126 8.912 8.446 0.466 1
1 1001 . 14 1 1 A 88 88 TYR HA H 126 5.630 5.646 -0.016 1
1 1008 . 14 1 1 A 88 88 TYR C C 126 171.410 172.266 -0.856 1
1 1009 . 14 1 1 A 88 88 TYR CA C 126 52.749 56.562 -3.813 1
1 1010 . 14 1 1 A 88 88 TYR CB C 126 37.750 40.470 -2.720 1
1 1011 . 14 1 1 A 88 88 TYR N N 126 119.697 121.474 -1.777 1
1 1012 . 14 1 1 A 89 89 SER H H 127 9.319 9.179 0.140 1
1 1013 . 14 1 1 A 89 89 SER HA H 127 5.429 5.219 0.210 1
1 1016 . 14 1 1 A 89 89 SER CA C 127 52.124 56.318 -4.194 1
1 1017 . 14 1 1 A 89 89 SER CB C 127 62.748 65.948 -3.200 1
1 1018 . 14 1 1 A 89 89 SER N N 127 112.637 115.656 -3.019 1
1 1019 . 14 1 1 A 90 90 LEU H H 128 8.759 8.556 0.203 1
1 1020 . 14 1 1 A 90 90 LEU HA H 128 4.186 4.383 -0.197 1
1 1030 . 14 1 1 A 90 90 LEU C C 128 175.121 178.193 -3.072 1
1 1031 . 14 1 1 A 90 90 LEU CA C 128 52.749 55.186 -2.437 1
1 1032 . 14 1 1 A 90 90 LEU CB C 128 35.875 42.050 -6.175 1
1 1033 . 14 1 1 A 90 90 LEU N N 128 126.728 126.134 0.594 1
1 1034 . 14 1 1 A 91 91 GLY H H 129 8.356 8.307 0.049 1
1 1035 . 14 1 1 A 91 91 GLY HA2 H 129 3.373 3.525 -0.152 1
1 1036 . 14 1 1 A 91 91 GLY HA3 H 129 3.373 3.789 -0.416 1
1 1037 . 14 1 1 A 91 91 GLY C C 129 172.013 174.296 -2.283 1
1 1038 . 14 1 1 A 91 91 GLY CA C 129 41.500 43.786 -2.286 1
1 1039 . 14 1 1 A 91 91 GLY N N 129 108.559 109.319 -0.760 1
1 1040 . 14 1 1 A 92 92 ALA H H 130 7.047 8.175 -1.128 1
1 1041 . 14 1 1 A 92 92 ALA HA H 130 4.037 3.358 0.679 1
1 1045 . 14 1 1 A 92 92 ALA C C 130 174.890 177.268 -2.378 1
1 1046 . 14 1 1 A 92 92 ALA CA C 130 52.100 53.013 -0.913 1
1 1047 . 14 1 1 A 92 92 ALA CB C 130 16.502 18.023 -1.521 1
1 1048 . 14 1 1 A 92 92 ALA N N 130 118.393 121.373 -2.980 1
1 1049 . 14 1 1 A 93 93 ASP H H 131 7.222 7.602 -0.380 1
1 1050 . 14 1 1 A 93 93 ASP HA H 131 4.122 4.668 -0.546 1
1 1053 . 14 1 1 A 93 93 ASP C C 131 174.890 176.326 -1.436 1
1 1054 . 14 1 1 A 93 93 ASP CA C 131 50.249 53.838 -3.589 1
1 1055 . 14 1 1 A 93 93 ASP CB C 131 37.750 41.403 -3.653 1
1 1056 . 14 1 1 A 93 93 ASP N N 131 111.487 116.893 -5.406 1
1 1057 . 14 1 1 A 94 94 GLY H H 132 7.199 9.197 -1.998 1
1 1058 . 14 1 1 A 94 94 GLY HA2 H 132 3.951 3.812 0.139 1
1 1059 . 14 1 1 A 94 94 GLY HA3 H 132 3.324 3.815 -0.491 1
1 1060 . 14 1 1 A 94 94 GLY C C 132 169.773 173.670 -3.897 1
1 1061 . 14 1 1 A 94 94 GLY CA C 132 44.625 45.623 -0.998 1
1 1062 . 14 1 1 A 94 94 GLY N N 132 106.932 108.437 -1.505 1
1 1063 . 14 1 1 A 95 95 LYS H H 133 7.215 7.642 -0.427 1
1 1064 . 14 1 1 A 95 95 LYS HA H 133 4.513 4.889 -0.376 1
1 1073 . 14 1 1 A 95 95 LYS C C 133 172.108 174.579 -2.471 1
1 1074 . 14 1 1 A 95 95 LYS CA C 133 51.512 54.716 -3.204 1
1 1075 . 14 1 1 A 95 95 LYS CB C 133 34.000 35.859 -1.859 1
1 1076 . 14 1 1 A 95 95 LYS N N 133 115.749 120.549 -4.800 1
1 1077 . 14 1 1 A 96 96 GLU H H 134 9.230 8.572 0.658 1
1 1078 . 14 1 1 A 96 96 GLU HA H 134 4.352 4.464 -0.112 1
1 1083 . 14 1 1 A 96 96 GLU C C 134 175.219 176.340 -1.121 1
1 1084 . 14 1 1 A 96 96 GLU CA C 134 55.874 56.311 -0.437 1
1 1085 . 14 1 1 A 96 96 GLU CB C 134 27.126 29.941 -2.815 1
1 1087 . 14 1 1 A 96 96 GLU N N 134 128.571 123.124 5.447 1
1 1088 . 14 1 1 A 97 97 GLY H H 135 10.677 8.551 2.126 1
1 1089 . 14 1 1 A 97 97 GLY HA2 H 135 4.037 4.324 -0.287 1
1 1090 . 14 1 1 A 97 97 GLY HA3 H 135 3.717 4.332 -0.615 1
1 1091 . 14 1 1 A 97 97 GLY C C 135 171.567 172.551 -0.984 1
1 1092 . 14 1 1 A 97 97 GLY CA C 135 41.500 45.775 -4.275 1
1 1093 . 14 1 1 A 97 97 GLY N N 135 117.011 110.124 6.887 1
1 1094 . 14 1 1 A 98 98 GLY H H 136 8.442 8.621 -0.179 1
1 1095 . 14 1 1 A 98 98 GLY HA2 H 136 4.195 4.201 -0.006 1
1 1096 . 14 1 1 A 98 98 GLY HA3 H 136 4.195 4.201 -0.006 1
1 1097 . 14 1 1 A 98 98 GLY C C 136 170.299 173.245 -2.946 1
1 1098 . 14 1 1 A 98 98 GLY CA C 136 40.875 44.712 -3.837 1
1 1099 . 14 1 1 A 98 98 GLY N N 136 109.494 109.269 0.225 1
1 1100 . 14 1 1 A 99 99 SER H H 137 8.701 8.751 -0.050 1
1 1101 . 14 1 1 A 99 99 SER HA H 137 4.639 4.909 -0.270 1
1 1104 . 14 1 1 A 99 99 SER C C 137 170.630 173.403 -2.773 1
1 1105 . 14 1 1 A 99 99 SER CA C 137 54.624 57.531 -2.907 1
1 1106 . 14 1 1 A 99 99 SER CB C 137 62.748 66.545 -3.797 1
1 1107 . 14 1 1 A 99 99 SER N N 137 114.685 118.466 -3.781 1
1 1108 . 14 1 1 A 100 100 ASP H H 138 9.117 8.936 0.181 1
1 1109 . 14 1 1 A 100 100 ASP HA H 138 3.965 4.480 -0.515 1
1 1112 . 14 1 1 A 100 100 ASP C C 138 175.540 178.186 -2.646 1
1 1113 . 14 1 1 A 100 100 ASP CA C 138 54.624 57.006 -2.382 1
1 1114 . 14 1 1 A 100 100 ASP CB C 138 36.500 40.630 -4.130 1
1 1115 . 14 1 1 A 100 100 ASP N N 138 120.777 122.580 -1.803 1
1 1116 . 14 1 1 A 101 101 ASN H H 139 8.667 8.382 0.285 1
1 1117 . 14 1 1 A 101 101 ASN HA H 139 4.333 4.824 -0.491 1
1 1122 . 14 1 1 A 101 101 ASN CA C 139 53.999 53.804 0.195 1
1 1123 . 14 1 1 A 101 101 ASN CB C 139 34.625 38.639 -4.014 1
1 1124 . 14 1 1 A 101 101 ASN N N 139 121.930 115.506 6.424 1
1 1126 . 14 1 1 A 102 102 ASP H H 140 7.714 7.920 -0.206 1
1 1127 . 14 1 1 A 102 102 ASP HA H 140 4.037 4.505 -0.468 1
1 1130 . 14 1 1 A 102 102 ASP C C 140 172.807 176.024 -3.217 1
1 1131 . 14 1 1 A 102 102 ASP CA C 140 53.374 54.273 -0.899 1
1 1132 . 14 1 1 A 102 102 ASP CB C 140 37.125 41.192 -4.067 1
1 1133 . 14 1 1 A 102 102 ASP N N 140 118.011 118.129 -0.118 1
1 1134 . 14 1 1 A 103 103 ALA H H 141 7.060 7.327 -0.267 1
1 1135 . 14 1 1 A 103 103 ALA HA H 141 3.353 4.282 -0.929 1
1 1139 . 14 1 1 A 103 103 ALA C C 141 172.233 176.636 -4.403 1
1 1140 . 14 1 1 A 103 103 ALA CA C 141 49.624 51.297 -1.673 1
1 1141 . 14 1 1 A 103 103 ALA CB C 141 16.502 21.013 -4.511 1
1 1142 . 14 1 1 A 103 103 ALA N N 141 125.777 122.421 3.356 1
1 1143 . 14 1 1 A 104 104 ASP H H 142 7.973 8.125 -0.152 1
1 1144 . 14 1 1 A 104 104 ASP HA H 142 4.420 4.991 -0.571 1
1 1147 . 14 1 1 A 104 104 ASP C C 142 174.188 176.032 -1.844 1
1 1148 . 14 1 1 A 104 104 ASP CA C 142 52.124 53.841 -1.717 1
1 1149 . 14 1 1 A 104 104 ASP CB C 142 37.125 41.399 -4.274 1
1 1150 . 14 1 1 A 104 104 ASP N N 142 122.965 120.117 2.848 1
1 1151 . 14 1 1 A 105 105 ILE H H 143 8.534 8.685 -0.151 1
1 1152 . 14 1 1 A 105 105 ILE HA H 143 4.060 4.994 -0.934 1
1 1162 . 14 1 1 A 105 105 ILE C C 143 173.235 176.001 -2.766 1
1 1163 . 14 1 1 A 105 105 ILE CA C 143 58.374 60.010 -1.636 1
1 1164 . 14 1 1 A 105 105 ILE CB C 143 39.123 39.520 -0.397 1
1 1167 . 14 1 1 A 105 105 ILE N N 143 124.757 121.003 3.754 1
1 1168 . 14 1 1 A 106 106 GLY H H 144 8.288 8.453 -0.165 1
1 1169 . 14 1 1 A 106 106 GLY HA2 H 144 4.764 4.456 0.308 1
1 1170 . 14 1 1 A 106 106 GLY HA3 H 144 4.764 4.541 0.223 1
1 1171 . 14 1 1 A 106 106 GLY C C 144 171.321 172.589 -1.268 1
1 1172 . 14 1 1 A 106 106 GLY CA C 144 40.250 45.647 -5.397 1
1 1173 . 14 1 1 A 106 106 GLY N N 144 110.895 111.817 -0.922 1
1 1174 . 14 1 1 A 107 107 ASN H H 145 8.577 9.045 -0.468 1
1 1175 . 14 1 1 A 107 107 ASN HA H 145 4.268 6.005 -1.737 1
1 1180 . 14 1 1 A 107 107 ASN C C 145 171.757 173.801 -2.044 1
1 1181 . 14 1 1 A 107 107 ASN CA C 145 52.124 51.578 0.546 1
1 1182 . 14 1 1 A 107 107 ASN CB C 145 34.625 41.559 -6.934 1
1 1183 . 14 1 1 A 107 107 ASN N N 145 118.042 116.384 1.658 1
1 1185 . 14 1 1 A 108 108 TRP H H 146 6.822 8.818 -1.996 1
1 1186 . 14 1 1 A 108 108 TRP HA H 146 4.513 5.237 -0.724 1
1 1195 . 14 1 1 A 108 108 TRP C C 146 172.665 173.215 -0.550 1
1 1196 . 14 1 1 A 108 108 TRP CA C 146 54.624 56.343 -1.719 1
1 1197 . 14 1 1 A 108 108 TRP CB C 146 25.876 33.215 -7.339 1
1 1198 . 14 1 1 A 108 108 TRP N N 146 116.756 122.382 -5.626 1
1 1200 . 14 1 1 A 109 109 ASP H H 147 7.344 8.121 -0.777 1
1 1201 . 14 1 1 A 109 109 ASP HA H 147 4.655 4.838 -0.183 1
1 1204 . 14 1 1 A 109 109 ASP C C 147 172.193 174.667 -2.474 1
1 1205 . 14 1 1 A 109 109 ASP CA C 147 51.499 52.450 -0.951 1
1 1206 . 14 1 1 A 109 109 ASP CB C 147 39.000 40.734 -1.734 1
1 1207 . 14 1 1 A 109 109 ASP N N 147 121.461 128.889 -7.428 1
1 11 . 15 1 1 A 2 2 SER H H 40 8.461 9.043 -0.582 1
1 12 . 15 1 1 A 2 2 SER HA H 40 4.286 5.089 -0.803 1
1 15 . 15 1 1 A 2 2 SER C C 40 171.276 173.065 -1.789 1
1 16 . 15 1 1 A 2 2 SER CA C 40 55.249 56.849 -1.600 1
1 17 . 15 1 1 A 2 2 SER CB C 40 61.498 63.867 -2.369 1
1 18 . 15 1 1 A 2 2 SER N N 40 118.344 123.623 -5.279 1
1 19 . 15 1 1 A 3 3 ARG H H 41 8.469 8.446 0.023 1
1 20 . 15 1 1 A 3 3 ARG HA H 41 4.400 4.818 -0.418 1
1 25 . 15 1 1 A 3 3 ARG C C 41 172.251 173.774 -1.523 1
1 26 . 15 1 1 A 3 3 ARG CA C 41 52.749 53.047 -0.298 1
1 27 . 15 1 1 A 3 3 ARG CB C 41 27.126 33.559 -6.433 1
1 28 . 15 1 1 A 3 3 ARG N N 41 123.070 126.585 -3.515 1
1 33 . 15 1 1 A 4 4 PRO CA C 42 61.498 63.825 -2.327 1
1 34 . 15 1 1 A 4 4 PRO CB C 42 29.001 31.725 -2.724 1
1 37 . 15 1 1 A 5 5 ASP H H 43 8.246 8.923 -0.677 1
1 38 . 15 1 1 A 5 5 ASP HA H 43 4.329 4.597 -0.268 1
1 41 . 15 1 1 A 5 5 ASP C C 43 174.605 177.216 -2.611 1
1 42 . 15 1 1 A 5 5 ASP CA C 43 53.374 55.827 -2.453 1
1 43 . 15 1 1 A 5 5 ASP CB C 43 38.375 40.625 -2.250 1
1 44 . 15 1 1 A 5 5 ASP N N 43 119.409 121.032 -1.623 1
1 45 . 15 1 1 A 6 6 GLN H H 44 8.309 8.179 0.130 1
1 46 . 15 1 1 A 6 6 GLN HA H 44 4.393 4.259 0.134 1
1 53 . 15 1 1 A 6 6 GLN C C 44 175.053 178.648 -3.595 1
1 54 . 15 1 1 A 6 6 GLN CA C 44 55.874 58.247 -2.373 1
1 55 . 15 1 1 A 6 6 GLN CB C 44 25.876 28.177 -2.301 1
1 57 . 15 1 1 A 6 6 GLN N N 44 122.273 118.075 4.198 1
1 59 . 15 1 1 A 7 7 ALA H H 45 8.106 7.775 0.331 1
1 60 . 15 1 1 A 7 7 ALA HA H 45 3.993 4.091 -0.098 1
1 64 . 15 1 1 A 7 7 ALA C C 45 177.465 178.147 -0.682 1
1 65 . 15 1 1 A 7 7 ALA CA C 45 52.124 54.453 -2.329 1
1 66 . 15 1 1 A 7 7 ALA CB C 45 15.252 18.085 -2.833 1
1 67 . 15 1 1 A 7 7 ALA N N 45 122.204 121.806 0.398 1
1 68 . 15 1 1 A 8 8 LYS H H 46 7.527 7.850 -0.323 1
1 69 . 15 1 1 A 8 8 LYS HA H 46 3.539 4.178 -0.639 1
1 78 . 15 1 1 A 8 8 LYS C C 46 175.412 178.981 -3.569 1
1 79 . 15 1 1 A 8 8 LYS CA C 46 57.124 57.416 -0.292 1
1 80 . 15 1 1 A 8 8 LYS CB C 46 30.876 32.444 -1.568 1
1 83 . 15 1 1 A 8 8 LYS N N 46 117.358 116.392 0.966 1
1 84 . 15 1 1 A 9 9 VAL H H 47 7.709 7.600 0.109 1
1 85 . 15 1 1 A 9 9 VAL HA H 47 3.578 3.737 -0.159 1
1 93 . 15 1 1 A 9 9 VAL C C 47 175.005 178.244 -3.239 1
1 94 . 15 1 1 A 9 9 VAL CA C 47 64.623 66.112 -1.489 1
1 95 . 15 1 1 A 9 9 VAL CB C 47 29.001 31.833 -2.832 1
1 98 . 15 1 1 A 9 9 VAL N N 47 119.115 120.123 -1.008 1
1 99 . 15 1 1 A 10 10 THR H H 48 7.767 8.211 -0.444 1
1 100 . 15 1 1 A 10 10 THR HA H 48 3.668 4.035 -0.367 1
1 105 . 15 1 1 A 10 10 THR CA C 48 63.998 65.326 -1.328 1
1 106 . 15 1 1 A 10 10 THR CB C 48 67.123 68.798 -1.675 1
1 108 . 15 1 1 A 10 10 THR N N 48 115.112 113.884 1.228 1
1 109 . 15 1 1 A 11 11 VAL H H 49 7.598 7.767 -0.169 1
1 110 . 15 1 1 A 11 11 VAL HA H 49 3.457 3.838 -0.381 1
1 118 . 15 1 1 A 11 11 VAL C C 49 175.412 178.059 -2.647 1
1 119 . 15 1 1 A 11 11 VAL CA C 49 63.998 64.737 -0.739 1
1 120 . 15 1 1 A 11 11 VAL CB C 49 29.001 31.594 -2.593 1
1 123 . 15 1 1 A 11 11 VAL N N 49 123.694 117.885 5.809 1
1 124 . 15 1 1 A 12 12 ALA H H 50 8.176 7.944 0.232 1
1 125 . 15 1 1 A 12 12 ALA HA H 50 4.742 4.017 0.725 1
1 129 . 15 1 1 A 12 12 ALA C C 50 177.074 179.750 -2.676 1
1 130 . 15 1 1 A 12 12 ALA CA C 50 52.124 55.125 -3.001 1
1 131 . 15 1 1 A 12 12 ALA CB C 50 15.252 18.427 -3.175 1
1 132 . 15 1 1 A 12 12 ALA N N 50 122.348 124.326 -1.978 1
1 133 . 15 1 1 A 13 13 LYS H H 51 8.499 7.917 0.582 1
1 134 . 15 1 1 A 13 13 LYS HA H 51 3.648 4.067 -0.419 1
1 143 . 15 1 1 A 13 13 LYS C C 51 177.252 179.443 -2.191 1
1 144 . 15 1 1 A 13 13 LYS CA C 51 58.072 59.391 -1.319 1
1 145 . 15 1 1 A 13 13 LYS CB C 51 30.251 32.233 -1.982 1
1 146 . 15 1 1 A 13 13 LYS N N 51 115.402 117.145 -1.743 1
1 147 . 15 1 1 A 14 14 GLY H H 52 7.858 8.088 -0.230 1
1 148 . 15 1 1 A 14 14 GLY HA2 H 52 3.823 3.903 -0.080 1
1 149 . 15 1 1 A 14 14 GLY HA3 H 52 3.676 3.906 -0.230 1
1 150 . 15 1 1 A 14 14 GLY C C 52 174.090 175.642 -1.552 1
1 151 . 15 1 1 A 14 14 GLY CA C 52 44.625 46.418 -1.793 1
1 152 . 15 1 1 A 14 14 GLY N N 52 107.466 108.527 -1.061 1
1 153 . 15 1 1 A 15 15 ASP H H 53 8.403 7.662 0.741 1
1 154 . 15 1 1 A 15 15 ASP HA H 53 4.191 4.391 -0.200 1
1 157 . 15 1 1 A 15 15 ASP C C 53 175.316 178.947 -3.631 1
1 158 . 15 1 1 A 15 15 ASP CA C 53 54.624 56.615 -1.991 1
1 159 . 15 1 1 A 15 15 ASP CB C 53 35.875 40.999 -5.124 1
1 160 . 15 1 1 A 15 15 ASP N N 53 125.929 121.012 4.917 1
1 161 . 15 1 1 A 16 16 ILE H H 54 8.245 8.252 -0.007 1
1 162 . 15 1 1 A 16 16 ILE HA H 54 3.034 3.810 -0.776 1
1 172 . 15 1 1 A 16 16 ILE C C 54 174.499 177.995 -3.496 1
1 173 . 15 1 1 A 16 16 ILE CA C 54 62.748 63.846 -1.098 1
1 174 . 15 1 1 A 16 16 ILE CB C 54 34.625 37.189 -2.564 1
1 178 . 15 1 1 A 16 16 ILE N N 54 119.456 116.857 2.599 1
1 179 . 15 1 1 A 17 17 LYS H H 55 7.547 8.015 -0.468 1
1 180 . 15 1 1 A 17 17 LYS HA H 55 3.843 4.045 -0.202 1
1 187 . 15 1 1 A 17 17 LYS C C 55 176.651 178.718 -2.067 1
1 188 . 15 1 1 A 17 17 LYS CA C 55 57.124 58.723 -1.599 1
1 189 . 15 1 1 A 17 17 LYS CB C 55 30.251 32.229 -1.978 1
1 190 . 15 1 1 A 17 17 LYS N N 55 118.505 121.202 -2.697 1
1 191 . 15 1 1 A 18 18 ALA H H 56 7.680 7.779 -0.099 1
1 192 . 15 1 1 A 18 18 ALA HA H 56 4.029 4.062 -0.033 1
1 196 . 15 1 1 A 18 18 ALA C C 56 176.638 180.097 -3.459 1
1 197 . 15 1 1 A 18 18 ALA CA C 56 52.749 54.818 -2.069 1
1 198 . 15 1 1 A 18 18 ALA CB C 56 15.877 18.235 -2.358 1
1 199 . 15 1 1 A 18 18 ALA N N 56 122.477 122.150 0.327 1
1 200 . 15 1 1 A 19 19 ILE H H 57 8.853 7.637 1.216 1
1 201 . 15 1 1 A 19 19 ILE HA H 57 3.304 3.671 -0.367 1
1 211 . 15 1 1 A 19 19 ILE C C 57 174.710 177.971 -3.261 1
1 212 . 15 1 1 A 19 19 ILE CA C 57 63.373 65.190 -1.817 1
1 213 . 15 1 1 A 19 19 ILE CB C 57 35.250 37.660 -2.410 1
1 217 . 15 1 1 A 19 19 ILE N N 57 120.901 118.607 2.294 1
1 218 . 15 1 1 A 20 20 ALA H H 58 8.702 8.431 0.271 1
1 219 . 15 1 1 A 20 20 ALA HA H 58 3.900 4.113 -0.213 1
1 223 . 15 1 1 A 20 20 ALA C C 58 176.512 179.416 -2.904 1
1 224 . 15 1 1 A 20 20 ALA CA C 58 52.749 55.101 -2.352 1
1 225 . 15 1 1 A 20 20 ALA CB C 58 15.252 18.098 -2.846 1
1 226 . 15 1 1 A 20 20 ALA N N 58 121.763 122.614 -0.851 1
1 227 . 15 1 1 A 21 21 ALA H H 59 7.662 7.824 -0.162 1
1 228 . 15 1 1 A 21 21 ALA HA H 59 4.136 4.318 -0.182 1
1 232 . 15 1 1 A 21 21 ALA C C 59 177.949 179.385 -1.436 1
1 233 . 15 1 1 A 21 21 ALA CA C 59 52.749 54.788 -2.039 1
1 234 . 15 1 1 A 21 21 ALA CB C 59 15.252 18.794 -3.542 1
1 235 . 15 1 1 A 21 21 ALA N N 59 119.079 119.160 -0.081 1
1 236 . 15 1 1 A 22 22 ALA H H 60 7.403 8.121 -0.718 1
1 237 . 15 1 1 A 22 22 ALA HA H 60 4.318 4.165 0.153 1
1 241 . 15 1 1 A 22 22 ALA C C 60 176.730 180.005 -3.275 1
1 242 . 15 1 1 A 22 22 ALA CA C 60 52.749 54.815 -2.066 1
1 243 . 15 1 1 A 22 22 ALA CB C 60 17.126 18.424 -1.298 1
1 244 . 15 1 1 A 22 22 ALA N N 60 122.616 120.904 1.712 1
1 245 . 15 1 1 A 23 23 LEU H H 61 8.410 8.606 -0.196 1
1 246 . 15 1 1 A 23 23 LEU HA H 61 3.527 3.988 -0.461 1
1 256 . 15 1 1 A 23 23 LEU C C 61 176.057 178.320 -2.263 1
1 257 . 15 1 1 A 23 23 LEU CA C 61 55.249 57.317 -2.068 1
1 258 . 15 1 1 A 23 23 LEU CB C 61 39.000 40.798 -1.798 1
1 262 . 15 1 1 A 23 23 LEU N N 61 120.761 120.871 -0.110 1
1 263 . 15 1 1 A 24 24 ASP H H 62 8.227 8.164 0.063 1
1 264 . 15 1 1 A 24 24 ASP HA H 62 4.581 4.434 0.147 1
1 267 . 15 1 1 A 24 24 ASP C C 62 176.968 177.846 -0.878 1
1 268 . 15 1 1 A 24 24 ASP CA C 62 55.874 56.599 -0.725 1
1 269 . 15 1 1 A 24 24 ASP CB C 62 37.750 40.857 -3.107 1
1 270 . 15 1 1 A 24 24 ASP N N 62 119.068 118.898 0.170 1
1 271 . 15 1 1 A 25 25 MET H H 63 7.718 7.970 -0.252 1
1 272 . 15 1 1 A 25 25 MET HA H 63 4.196 4.262 -0.066 1
1 277 . 15 1 1 A 25 25 MET C C 63 174.968 177.918 -2.950 1
1 278 . 15 1 1 A 25 25 MET CA C 63 55.249 58.617 -3.368 1
1 279 . 15 1 1 A 25 25 MET CB C 63 29.626 32.807 -3.181 1
1 281 . 15 1 1 A 25 25 MET N N 63 121.365 117.493 3.872 1
1 282 . 15 1 1 A 26 26 TYR H H 64 8.401 7.868 0.533 1
1 283 . 15 1 1 A 26 26 TYR HA H 64 4.400 3.521 0.879 1
1 291 . 15 1 1 A 26 26 TYR C C 64 176.098 177.520 -1.422 1
1 292 . 15 1 1 A 26 26 TYR CA C 64 58.999 60.919 -1.920 1
1 293 . 15 1 1 A 26 26 TYR CB C 64 35.250 37.942 -2.692 1
1 294 . 15 1 1 A 26 26 TYR N N 64 122.575 121.388 1.187 1
1 295 . 15 1 1 A 27 27 LYS H H 65 8.330 8.159 0.171 1
1 296 . 15 1 1 A 27 27 LYS HA H 65 3.568 4.129 -0.561 1
1 302 . 15 1 1 A 27 27 LYS C C 65 176.156 178.152 -1.996 1
1 303 . 15 1 1 A 27 27 LYS CA C 65 56.499 59.074 -2.575 1
1 304 . 15 1 1 A 27 27 LYS CB C 65 29.626 31.899 -2.273 1
1 306 . 15 1 1 A 27 27 LYS N N 65 121.390 118.647 2.743 1
1 307 . 15 1 1 A 28 28 LEU H H 66 7.833 7.302 0.531 1
1 308 . 15 1 1 A 28 28 LEU HA H 66 3.769 4.179 -0.410 1
1 318 . 15 1 1 A 28 28 LEU C C 66 175.925 178.433 -2.508 1
1 319 . 15 1 1 A 28 28 LEU CA C 66 55.874 56.166 -0.292 1
1 320 . 15 1 1 A 28 28 LEU CB C 66 38.375 41.997 -3.622 1
1 324 . 15 1 1 A 28 28 LEU N N 66 123.068 118.796 4.272 1
1 325 . 15 1 1 A 29 29 ASP H H 67 7.292 7.900 -0.608 1
1 326 . 15 1 1 A 29 29 ASP HA H 67 4.096 4.332 -0.236 1
1 329 . 15 1 1 A 29 29 ASP C C 67 174.618 176.868 -2.250 1
1 330 . 15 1 1 A 29 29 ASP CA C 67 53.999 56.307 -2.308 1
1 331 . 15 1 1 A 29 29 ASP CB C 67 38.375 40.767 -2.392 1
1 332 . 15 1 1 A 29 29 ASP N N 67 114.729 119.254 -4.525 1
1 333 . 15 1 1 A 30 30 ASN H H 68 8.097 7.688 0.409 1
1 334 . 15 1 1 A 30 30 ASN HA H 68 4.337 4.382 -0.045 1
1 339 . 15 1 1 A 30 30 ASN C C 68 172.822 174.513 -1.691 1
1 340 . 15 1 1 A 30 30 ASN CA C 68 52.124 51.464 0.660 1
1 341 . 15 1 1 A 30 30 ASN CB C 68 37.750 38.181 -0.431 1
1 342 . 15 1 1 A 30 30 ASN N N 68 111.054 115.508 -4.454 1
1 344 . 15 1 1 A 31 31 PHE H H 69 8.249 7.905 0.344 1
1 345 . 15 1 1 A 31 31 PHE HA H 69 4.135 4.354 -0.219 1
1 353 . 15 1 1 A 31 31 PHE C C 69 170.485 174.208 -3.723 1
1 354 . 15 1 1 A 31 31 PHE CA C 69 57.749 58.702 -0.953 1
1 355 . 15 1 1 A 31 31 PHE CB C 69 33.375 36.550 -3.175 1
1 356 . 15 1 1 A 31 31 PHE N N 69 116.277 119.248 -2.971 1
1 357 . 15 1 1 A 32 32 ALA H H 70 7.224 7.039 0.185 1
1 358 . 15 1 1 A 32 32 ALA HA H 70 4.194 4.507 -0.313 1
1 362 . 15 1 1 A 32 32 ALA C C 70 173.337 175.016 -1.679 1
1 363 . 15 1 1 A 32 32 ALA CA C 70 48.374 51.513 -3.139 1
1 364 . 15 1 1 A 32 32 ALA CB C 70 19.626 22.269 -2.643 1
1 365 . 15 1 1 A 32 32 ALA N N 70 119.914 120.293 -0.379 1
1 366 . 15 1 1 A 33 33 TYR H H 71 7.948 8.406 -0.458 1
1 367 . 15 1 1 A 33 33 TYR HA H 71 4.209 4.968 -0.759 1
1 374 . 15 1 1 A 33 33 TYR C C 71 170.591 174.213 -3.622 1
1 375 . 15 1 1 A 33 33 TYR CA C 71 54.624 56.506 -1.882 1
1 376 . 15 1 1 A 33 33 TYR CB C 71 34.000 37.830 -3.830 1
1 377 . 15 1 1 A 33 33 TYR N N 71 116.929 118.029 -1.100 1
1 378 . 15 1 1 A 34 34 PRO HA H 72 4.444 4.773 -0.329 1
1 381 . 15 1 1 A 34 34 PRO C C 72 174.775 176.277 -1.502 1
1 382 . 15 1 1 A 34 34 PRO CA C 72 59.624 62.557 -2.933 1
1 383 . 15 1 1 A 34 34 PRO CB C 72 28.376 32.275 -3.899 1
1 384 . 15 1 1 A 35 35 SER H H 73 8.721 8.454 0.267 1
1 385 . 15 1 1 A 35 35 SER HA H 73 4.467 4.814 -0.347 1
1 388 . 15 1 1 A 35 35 SER C C 73 173.271 175.557 -2.286 1
1 389 . 15 1 1 A 35 35 SER CA C 73 55.249 56.629 -1.380 1
1 390 . 15 1 1 A 35 35 SER CB C 73 63.373 65.884 -2.511 1
1 391 . 15 1 1 A 35 35 SER N N 73 118.284 114.370 3.914 1
1 392 . 15 1 1 A 36 36 THR H H 74 8.591 8.779 -0.188 1
1 393 . 15 1 1 A 36 36 THR HA H 74 3.649 4.203 -0.554 1
1 398 . 15 1 1 A 36 36 THR CA C 74 64.623 64.194 0.429 1
1 399 . 15 1 1 A 36 36 THR CB C 74 66.498 69.053 -2.555 1
1 401 . 15 1 1 A 36 36 THR N N 74 117.769 117.115 0.654 1
1 402 . 15 1 1 A 37 37 GLN H H 75 8.210 7.880 0.330 1
1 403 . 15 1 1 A 37 37 GLN HA H 75 3.860 4.476 -0.616 1
1 410 . 15 1 1 A 37 37 GLN C C 75 175.349 177.652 -2.303 1
1 411 . 15 1 1 A 37 37 GLN CA C 75 56.499 57.572 -1.073 1
1 412 . 15 1 1 A 37 37 GLN CB C 75 25.876 29.730 -3.854 1
1 414 . 15 1 1 A 37 37 GLN N N 75 117.931 119.677 -1.746 1
1 416 . 15 1 1 A 38 38 GLN H H 76 7.667 8.123 -0.456 1
1 417 . 15 1 1 A 38 38 GLN HA H 76 3.810 4.105 -0.295 1
1 424 . 15 1 1 A 38 38 GLN C C 76 175.805 179.323 -3.518 1
1 425 . 15 1 1 A 38 38 GLN CA C 76 55.874 58.612 -2.738 1
1 426 . 15 1 1 A 38 38 GLN CB C 76 25.876 28.313 -2.437 1
1 428 . 15 1 1 A 38 38 GLN N N 76 120.607 118.060 2.547 1
1 430 . 15 1 1 A 39 39 GLY H H 77 8.470 8.225 0.245 1
1 431 . 15 1 1 A 39 39 GLY HA2 H 77 3.920 3.772 0.148 1
1 432 . 15 1 1 A 39 39 GLY HA3 H 77 3.603 3.777 -0.174 1
1 433 . 15 1 1 A 39 39 GLY C C 77 169.006 175.463 -6.457 1
1 434 . 15 1 1 A 39 39 GLY CA C 77 42.125 46.452 -4.327 1
1 435 . 15 1 1 A 39 39 GLY N N 77 103.281 109.547 -6.266 1
1 436 . 15 1 1 A 40 40 LEU H H 78 8.135 7.815 0.320 1
1 437 . 15 1 1 A 40 40 LEU HA H 78 3.237 4.151 -0.914 1
1 447 . 15 1 1 A 40 40 LEU C C 78 176.383 178.747 -2.364 1
1 448 . 15 1 1 A 40 40 LEU CA C 78 52.749 57.078 -4.329 1
1 449 . 15 1 1 A 40 40 LEU CB C 78 39.000 41.575 -2.575 1
1 453 . 15 1 1 A 40 40 LEU N N 78 114.444 123.329 -8.885 1
1 454 . 15 1 1 A 41 41 GLU H H 79 8.578 8.114 0.464 1
1 455 . 15 1 1 A 41 41 GLU HA H 79 3.720 4.231 -0.511 1
1 460 . 15 1 1 A 41 41 GLU C C 79 175.093 177.299 -2.206 1
1 461 . 15 1 1 A 41 41 GLU CA C 79 57.124 58.494 -1.370 1
1 462 . 15 1 1 A 41 41 GLU CB C 79 26.501 29.382 -2.881 1
1 464 . 15 1 1 A 41 41 GLU N N 79 118.295 118.466 -0.171 1
1 465 . 15 1 1 A 42 42 ALA H H 80 7.227 7.549 -0.322 1
1 466 . 15 1 1 A 42 42 ALA HA H 80 4.437 5.021 -0.584 1
1 470 . 15 1 1 A 42 42 ALA C C 80 173.745 178.196 -4.451 1
1 471 . 15 1 1 A 42 42 ALA CA C 80 51.499 52.431 -0.932 1
1 472 . 15 1 1 A 42 42 ALA CB C 80 15.877 19.766 -3.889 1
1 473 . 15 1 1 A 42 42 ALA N N 80 119.751 121.684 -1.933 1
1 474 . 15 1 1 A 43 43 LEU H H 81 7.932 7.433 0.499 1
1 475 . 15 1 1 A 43 43 LEU HA H 81 4.369 4.297 0.072 1
1 485 . 15 1 1 A 43 43 LEU C C 81 174.788 177.331 -2.543 1
1 486 . 15 1 1 A 43 43 LEU CA C 81 53.374 54.969 -1.595 1
1 487 . 15 1 1 A 43 43 LEU CB C 81 39.625 42.241 -2.616 1
1 491 . 15 1 1 A 43 43 LEU N N 81 111.742 116.369 -4.627 1
1 492 . 15 1 1 A 44 44 VAL H H 82 7.886 7.379 0.507 1
1 493 . 15 1 1 A 44 44 VAL HA H 82 4.700 4.143 0.557 1
1 501 . 15 1 1 A 44 44 VAL C C 82 172.875 175.614 -2.739 1
1 502 . 15 1 1 A 44 44 VAL CA C 82 59.624 63.581 -3.957 1
1 503 . 15 1 1 A 44 44 VAL CB C 82 31.501 33.722 -2.221 1
1 506 . 15 1 1 A 44 44 VAL N N 82 113.604 115.443 -1.839 1
1 507 . 15 1 1 A 45 45 LYS H H 83 8.361 8.083 0.278 1
1 508 . 15 1 1 A 45 45 LYS HA H 83 4.251 4.917 -0.666 1
1 515 . 15 1 1 A 45 45 LYS C C 83 171.053 175.164 -4.111 1
1 516 . 15 1 1 A 45 45 LYS CA C 83 52.749 54.243 -1.494 1
1 517 . 15 1 1 A 45 45 LYS CB C 83 33.375 35.736 -2.361 1
1 521 . 15 1 1 A 45 45 LYS N N 83 123.860 121.342 2.518 1
1 522 . 15 1 1 A 46 46 LYS H H 84 7.243 7.857 -0.614 1
1 523 . 15 1 1 A 46 46 LYS HA H 84 2.175 2.805 -0.630 1
1 532 . 15 1 1 A 46 46 LYS C C 84 172.123 174.488 -2.365 1
1 533 . 15 1 1 A 46 46 LYS CA C 84 52.749 54.365 -1.616 1
1 534 . 15 1 1 A 46 46 LYS CB C 84 29.626 31.528 -1.902 1
1 537 . 15 1 1 A 46 46 LYS N N 84 128.615 123.832 4.783 1
1 538 . 15 1 1 A 47 47 PRO HA H 85 4.470 4.449 0.021 1
1 541 . 15 1 1 A 47 47 PRO C C 85 173.754 176.558 -2.804 1
1 542 . 15 1 1 A 47 47 PRO CA C 85 60.874 63.084 -2.210 1
1 543 . 15 1 1 A 47 47 PRO CB C 85 30.876 32.057 -1.181 1
1 546 . 15 1 1 A 48 48 THR H H 86 8.306 8.262 0.044 1
1 547 . 15 1 1 A 48 48 THR HA H 86 4.287 4.480 -0.193 1
1 552 . 15 1 1 A 48 48 THR C C 86 173.070 174.855 -1.785 1
1 553 . 15 1 1 A 48 48 THR CA C 86 57.749 61.004 -3.255 1
1 554 . 15 1 1 A 48 48 THR CB C 86 67.748 70.548 -2.800 1
1 556 . 15 1 1 A 48 48 THR N N 86 109.564 113.368 -3.804 1
1 557 . 15 1 1 A 49 49 GLY H H 87 8.317 8.575 -0.258 1
1 558 . 15 1 1 A 49 49 GLY HA2 H 87 3.851 3.842 0.009 1
1 559 . 15 1 1 A 49 49 GLY HA3 H 87 3.678 3.844 -0.166 1
1 560 . 15 1 1 A 49 49 GLY C C 87 169.693 173.468 -3.775 1
1 561 . 15 1 1 A 49 49 GLY CA C 87 42.125 47.460 -5.335 1
1 562 . 15 1 1 A 49 49 GLY N N 87 109.071 109.854 -0.783 1
1 563 . 15 1 1 A 50 50 ASN H H 88 8.301 8.379 -0.078 1
1 564 . 15 1 1 A 50 50 ASN HA H 88 4.780 5.540 -0.760 1
1 569 . 15 1 1 A 50 50 ASN C C 88 171.370 173.963 -2.593 1
1 570 . 15 1 1 A 50 50 ASN CA C 88 47.749 51.325 -3.576 1
1 571 . 15 1 1 A 50 50 ASN CB C 88 37.125 41.265 -4.140 1
1 572 . 15 1 1 A 50 50 ASN N N 88 115.631 120.828 -5.197 1
1 574 . 15 1 1 A 51 51 PRO HA H 89 4.782 4.583 0.199 1
1 577 . 15 1 1 A 51 51 PRO C C 89 173.656 176.183 -2.527 1
1 578 . 15 1 1 A 51 51 PRO CA C 89 59.624 62.096 -2.472 1
1 579 . 15 1 1 A 51 51 PRO CB C 89 31.501 32.652 -1.151 1
1 582 . 15 1 1 A 52 52 GLN H H 90 9.076 8.859 0.217 1
1 583 . 15 1 1 A 52 52 GLN HA H 90 4.469 4.682 -0.213 1
1 590 . 15 1 1 A 52 52 GLN C C 90 172.386 174.413 -2.027 1
1 591 . 15 1 1 A 52 52 GLN CA C 90 50.874 54.219 -3.345 1
1 592 . 15 1 1 A 52 52 GLN CB C 90 26.501 27.782 -1.281 1
1 594 . 15 1 1 A 52 52 GLN N N 90 126.827 119.753 7.074 1
1 596 . 15 1 1 A 53 53 PRO HA H 91 4.384 4.760 -0.376 1
1 599 . 15 1 1 A 53 53 PRO C C 91 174.274 176.146 -1.872 1
1 600 . 15 1 1 A 53 53 PRO CB C 91 28.113 31.236 -3.123 1
1 601 . 15 1 1 A 54 54 LYS H H 92 8.401 8.277 0.124 1
1 602 . 15 1 1 A 54 54 LYS HA H 92 3.984 4.761 -0.777 1
1 611 . 15 1 1 A 54 54 LYS C C 92 173.516 175.959 -2.443 1
1 612 . 15 1 1 A 54 54 LYS CA C 92 55.249 54.770 0.479 1
1 613 . 15 1 1 A 54 54 LYS CB C 92 30.876 36.702 -5.826 1
1 615 . 15 1 1 A 54 54 LYS N N 92 124.538 123.710 0.828 1
1 616 . 15 1 1 A 55 55 ASN H H 93 8.183 8.671 -0.488 1
1 617 . 15 1 1 A 55 55 ASN HA H 93 4.716 4.957 -0.241 1
1 622 . 15 1 1 A 55 55 ASN CA C 93 48.999 53.214 -4.215 1
1 623 . 15 1 1 A 55 55 ASN CB C 93 35.875 38.037 -2.162 1
1 624 . 15 1 1 A 55 55 ASN N N 93 118.677 121.149 -2.472 1
1 626 . 15 1 1 A 56 56 TRP H H 94 8.007 8.747 -0.740 1
1 627 . 15 1 1 A 56 56 TRP HA H 94 3.827 5.556 -1.729 1
1 635 . 15 1 1 A 56 56 TRP C C 94 173.760 175.395 -1.635 1
1 636 . 15 1 1 A 56 56 TRP CA C 94 59.624 59.333 0.291 1
1 637 . 15 1 1 A 56 56 TRP CB C 94 27.126 30.385 -3.259 1
1 638 . 15 1 1 A 56 56 TRP N N 94 122.195 127.916 -5.721 1
1 640 . 15 1 1 A 57 57 ASN H H 95 7.563 7.632 -0.069 1
1 641 . 15 1 1 A 57 57 ASN HA H 95 3.735 4.852 -1.117 1
1 646 . 15 1 1 A 57 57 ASN C C 95 171.952 174.050 -2.098 1
1 647 . 15 1 1 A 57 57 ASN CA C 95 51.499 50.928 0.571 1
1 648 . 15 1 1 A 57 57 ASN CB C 95 35.250 41.165 -5.915 1
1 649 . 15 1 1 A 57 57 ASN N N 95 129.659 125.313 4.346 1
1 651 . 15 1 1 A 58 58 LYS H H 96 8.110 8.119 -0.009 1
1 652 . 15 1 1 A 58 58 LYS HA H 96 4.035 4.274 -0.239 1
1 659 . 15 1 1 A 58 58 LYS C C 96 174.530 175.461 -0.931 1
1 660 . 15 1 1 A 58 58 LYS CA C 96 56.499 54.268 2.231 1
1 661 . 15 1 1 A 58 58 LYS CB C 96 29.626 33.000 -3.374 1
1 665 . 15 1 1 A 58 58 LYS N N 96 123.913 123.310 0.603 1
1 666 . 15 1 1 A 59 59 ASP H H 97 7.903 9.124 -1.221 1
1 667 . 15 1 1 A 59 59 ASP HA H 97 4.393 4.366 0.027 1
1 670 . 15 1 1 A 59 59 ASP C C 97 173.724 175.340 -1.616 1
1 671 . 15 1 1 A 59 59 ASP CA C 97 52.124 55.015 -2.891 1
1 672 . 15 1 1 A 59 59 ASP CB C 97 38.375 39.804 -1.429 1
1 673 . 15 1 1 A 59 59 ASP N N 97 118.773 119.620 -0.847 1
1 674 . 15 1 1 A 60 60 GLY H H 98 7.819 7.847 -0.028 1
1 675 . 15 1 1 A 60 60 GLY HA2 H 98 3.917 3.529 0.388 1
1 676 . 15 1 1 A 60 60 GLY HA3 H 98 3.917 3.859 0.058 1
1 677 . 15 1 1 A 60 60 GLY C C 98 168.652 174.375 -5.723 1
1 678 . 15 1 1 A 60 60 GLY CA C 98 41.500 44.999 -3.499 1
1 679 . 15 1 1 A 60 60 GLY N N 98 108.742 104.913 3.829 1
1 680 . 15 1 1 A 61 61 TYR H H 99 8.105 7.780 0.325 1
1 681 . 15 1 1 A 61 61 TYR HA H 99 3.927 4.202 -0.275 1
1 689 . 15 1 1 A 61 61 TYR C C 99 172.831 174.117 -1.286 1
1 690 . 15 1 1 A 61 61 TYR CA C 99 57.124 58.434 -1.310 1
1 691 . 15 1 1 A 61 61 TYR CB C 99 37.125 36.407 0.718 1
1 692 . 15 1 1 A 61 61 TYR N N 99 113.836 115.808 -1.972 1
1 693 . 15 1 1 A 62 62 LEU H H 100 7.352 7.900 -0.548 1
1 694 . 15 1 1 A 62 62 LEU HA H 100 4.343 4.941 -0.598 1
1 704 . 15 1 1 A 62 62 LEU C C 100 173.430 175.266 -1.836 1
1 705 . 15 1 1 A 62 62 LEU CA C 100 50.874 53.577 -2.703 1
1 706 . 15 1 1 A 62 62 LEU CB C 100 44.000 46.167 -2.167 1
1 710 . 15 1 1 A 62 62 LEU N N 100 117.112 122.282 -5.170 1
1 711 . 15 1 1 A 63 63 LYS H H 101 8.626 8.196 0.430 1
1 712 . 15 1 1 A 63 63 LYS HA H 101 3.986 4.391 -0.405 1
1 721 . 15 1 1 A 63 63 LYS C C 101 173.851 176.986 -3.135 1
1 722 . 15 1 1 A 63 63 LYS CA C 101 55.249 55.646 -0.397 1
1 723 . 15 1 1 A 63 63 LYS CB C 101 29.626 33.531 -3.905 1
1 724 . 15 1 1 A 63 63 LYS N N 101 129.991 123.112 6.879 1
1 725 . 15 1 1 A 64 64 LYS H H 102 7.059 8.505 -1.446 1
1 726 . 15 1 1 A 64 64 LYS HA H 102 4.138 4.335 -0.197 1
1 735 . 15 1 1 A 64 64 LYS C C 102 171.120 174.504 -3.384 1
1 736 . 15 1 1 A 64 64 LYS CA C 102 52.749 55.896 -3.147 1
1 737 . 15 1 1 A 64 64 LYS CB C 102 32.750 30.907 1.843 1
1 740 . 15 1 1 A 64 64 LYS N N 102 113.255 121.270 -8.015 1
1 741 . 15 1 1 A 65 65 LEU H H 103 8.883 7.863 1.020 1
1 742 . 15 1 1 A 65 65 LEU HA H 103 4.475 4.751 -0.276 1
1 752 . 15 1 1 A 65 65 LEU C C 103 171.487 174.099 -2.612 1
1 753 . 15 1 1 A 65 65 LEU CA C 103 48.999 51.121 -2.122 1
1 754 . 15 1 1 A 65 65 LEU CB C 103 39.625 45.136 -5.511 1
1 758 . 15 1 1 A 65 65 LEU N N 103 126.355 126.360 -0.005 1
1 759 . 15 1 1 A 66 66 PRO HA H 104 4.449 4.566 -0.117 1
1 764 . 15 1 1 A 66 66 PRO C C 104 173.363 176.315 -2.952 1
1 765 . 15 1 1 A 66 66 PRO CA C 104 60.249 62.412 -2.163 1
1 766 . 15 1 1 A 66 66 PRO CB C 104 29.626 32.362 -2.736 1
1 769 . 15 1 1 A 67 67 VAL H H 105 7.682 8.365 -0.683 1
1 770 . 15 1 1 A 67 67 VAL HA H 105 4.121 4.415 -0.294 1
1 778 . 15 1 1 A 67 67 VAL C C 105 171.667 174.993 -3.326 1
1 779 . 15 1 1 A 67 67 VAL CA C 105 58.374 61.726 -3.352 1
1 780 . 15 1 1 A 67 67 VAL CB C 105 30.251 32.951 -2.700 1
1 783 . 15 1 1 A 67 67 VAL N N 105 114.671 121.463 -6.792 1
1 784 . 15 1 1 A 68 68 ASP H H 106 8.216 8.084 0.132 1
1 785 . 15 1 1 A 68 68 ASP HA H 106 4.474 4.677 -0.203 1
1 788 . 15 1 1 A 68 68 ASP C C 106 172.452 174.775 -2.323 1
1 789 . 15 1 1 A 68 68 ASP CA C 106 50.249 52.097 -1.848 1
1 790 . 15 1 1 A 68 68 ASP CB C 106 37.750 40.470 -2.720 1
1 791 . 15 1 1 A 68 68 ASP N N 106 123.825 126.170 -2.345 1
1 792 . 15 1 1 A 69 69 PRO HA H 107 3.920 3.989 -0.069 1
1 797 . 15 1 1 A 69 69 PRO CA C 107 62.123 63.084 -0.961 1
1 798 . 15 1 1 A 69 69 PRO CB C 107 27.751 31.502 -3.751 1
1 801 . 15 1 1 A 70 70 TRP H H 108 8.156 8.344 -0.188 1
1 802 . 15 1 1 A 70 70 TRP HA H 108 4.274 4.299 -0.025 1
1 811 . 15 1 1 A 70 70 TRP CA C 108 57.124 58.347 -1.223 1
1 812 . 15 1 1 A 70 70 TRP CB C 108 25.251 27.198 -1.947 1
1 813 . 15 1 1 A 70 70 TRP N N 108 118.137 117.454 0.683 1
1 815 . 15 1 1 A 71 71 GLY H H 109 8.209 8.691 -0.482 1
1 816 . 15 1 1 A 71 71 GLY HA2 H 109 4.030 3.880 0.150 1
1 817 . 15 1 1 A 71 71 GLY HA3 H 109 3.303 3.912 -0.609 1
1 818 . 15 1 1 A 71 71 GLY CA C 109 42.750 46.443 -3.693 1
1 819 . 15 1 1 A 71 71 GLY N N 109 107.495 105.357 2.138 1
1 820 . 15 1 1 A 72 72 ASN H H 110 8.116 7.932 0.184 1
1 821 . 15 1 1 A 72 72 ASN HA H 110 5.103 5.031 0.072 1
1 826 . 15 1 1 A 72 72 ASN CA C 110 48.374 50.059 -1.685 1
1 827 . 15 1 1 A 72 72 ASN CB C 110 36.500 39.140 -2.640 1
1 828 . 15 1 1 A 72 72 ASN N N 110 120.108 119.663 0.445 1
1 830 . 15 1 1 A 73 73 PRO HA H 111 4.397 4.452 -0.055 1
1 835 . 15 1 1 A 73 73 PRO C C 111 176.229 176.483 -0.254 1
1 836 . 15 1 1 A 73 73 PRO CA C 111 60.249 62.559 -2.310 1
1 837 . 15 1 1 A 73 73 PRO CB C 111 29.001 31.921 -2.920 1
1 840 . 15 1 1 A 74 74 TYR H H 112 8.893 8.609 0.284 1
1 841 . 15 1 1 A 74 74 TYR HA H 112 4.064 4.770 -0.706 1
1 849 . 15 1 1 A 74 74 TYR C C 112 171.951 176.099 -4.148 1
1 850 . 15 1 1 A 74 74 TYR CA C 112 60.249 58.345 1.904 1
1 851 . 15 1 1 A 74 74 TYR CB C 112 36.500 39.399 -2.899 1
1 852 . 15 1 1 A 74 74 TYR N N 112 124.595 121.223 3.372 1
1 853 . 15 1 1 A 75 75 GLN H H 113 9.127 8.860 0.267 1
1 854 . 15 1 1 A 75 75 GLN HA H 113 4.019 4.291 -0.272 1
1 861 . 15 1 1 A 75 75 GLN C C 113 171.436 174.394 -2.958 1
1 862 . 15 1 1 A 75 75 GLN CA C 113 50.874 54.775 -3.901 1
1 863 . 15 1 1 A 75 75 GLN CB C 113 29.469 29.379 0.090 1
1 865 . 15 1 1 A 75 75 GLN N N 113 120.777 122.104 -1.327 1
1 867 . 15 1 1 A 76 76 TYR H H 114 7.906 8.201 -0.295 1
1 868 . 15 1 1 A 76 76 TYR HA H 114 5.586 5.698 -0.112 1
1 875 . 15 1 1 A 76 76 TYR C C 114 171.343 175.240 -3.897 1
1 876 . 15 1 1 A 76 76 TYR CA C 114 53.999 55.954 -1.955 1
1 877 . 15 1 1 A 76 76 TYR CB C 114 40.250 40.625 -0.375 1
1 878 . 15 1 1 A 76 76 TYR N N 114 120.757 122.330 -1.573 1
1 879 . 15 1 1 A 77 77 LEU H H 115 8.261 9.277 -1.016 1
1 880 . 15 1 1 A 77 77 LEU HA H 115 4.280 5.253 -0.973 1
1 890 . 15 1 1 A 77 77 LEU C C 115 170.921 175.898 -4.977 1
1 891 . 15 1 1 A 77 77 LEU CA C 115 51.499 53.598 -2.099 1
1 892 . 15 1 1 A 77 77 LEU CB C 115 44.625 45.416 -0.791 1
1 896 . 15 1 1 A 77 77 LEU N N 115 130.662 125.930 4.732 1
1 897 . 15 1 1 A 78 78 ALA H H 116 7.973 8.519 -0.546 1
1 898 . 15 1 1 A 78 78 ALA HA H 116 4.292 4.767 -0.475 1
1 902 . 15 1 1 A 78 78 ALA C C 116 172.093 174.859 -2.766 1
1 903 . 15 1 1 A 78 78 ALA CA C 116 47.749 49.947 -2.198 1
1 904 . 15 1 1 A 78 78 ALA CB C 116 19.626 20.898 -1.272 1
1 905 . 15 1 1 A 78 78 ALA N N 116 125.564 124.882 0.682 1
1 906 . 15 1 1 A 79 79 PRO HA H 117 4.698 5.308 -0.610 1
1 911 . 15 1 1 A 79 79 PRO C C 117 173.994 176.760 -2.766 1
1 912 . 15 1 1 A 79 79 PRO CA C 117 60.249 63.578 -3.329 1
1 913 . 15 1 1 A 79 79 PRO CB C 117 31.501 31.947 -0.446 1
1 916 . 15 1 1 A 80 80 GLY H H 118 7.096 8.447 -1.351 1
1 917 . 15 1 1 A 80 80 GLY HA2 H 118 3.797 3.963 -0.166 1
1 918 . 15 1 1 A 80 80 GLY HA3 H 118 3.517 3.992 -0.475 1
1 919 . 15 1 1 A 80 80 GLY C C 118 171.404 174.280 -2.876 1
1 920 . 15 1 1 A 80 80 GLY CA C 118 41.500 46.127 -4.627 1
1 921 . 15 1 1 A 80 80 GLY N N 118 108.306 108.211 0.095 1
1 922 . 15 1 1 A 81 81 THR H H 119 9.810 8.160 1.650 1
1 923 . 15 1 1 A 81 81 THR HA H 119 4.091 4.606 -0.515 1
1 928 . 15 1 1 A 81 81 THR C C 119 174.242 174.542 -0.300 1
1 929 . 15 1 1 A 81 81 THR CA C 119 60.874 60.846 0.028 1
1 930 . 15 1 1 A 81 81 THR CB C 119 66.498 69.558 -3.060 1
1 932 . 15 1 1 A 81 81 THR N N 119 112.813 113.842 -1.029 1
1 933 . 15 1 1 A 82 82 LYS H H 120 8.964 8.722 0.242 1
1 934 . 15 1 1 A 82 82 LYS HA H 120 4.150 3.887 0.263 1
1 941 . 15 1 1 A 82 82 LYS C C 120 172.886 175.421 -2.535 1
1 942 . 15 1 1 A 82 82 LYS CA C 120 53.999 57.693 -3.694 1
1 943 . 15 1 1 A 82 82 LYS CB C 120 30.876 29.724 1.152 1
1 944 . 15 1 1 A 82 82 LYS N N 120 123.569 125.812 -2.243 1
1 945 . 15 1 1 A 83 83 GLY H H 121 7.125 8.038 -0.913 1
1 946 . 15 1 1 A 83 83 GLY HA2 H 121 3.814 4.233 -0.419 1
1 947 . 15 1 1 A 83 83 GLY HA3 H 121 3.814 4.272 -0.458 1
1 948 . 15 1 1 A 83 83 GLY C C 121 167.671 173.921 -6.250 1
1 949 . 15 1 1 A 83 83 GLY CA C 121 42.125 44.694 -2.569 1
1 950 . 15 1 1 A 83 83 GLY N N 121 107.253 107.449 -0.196 1
1 951 . 15 1 1 A 84 84 PRO HA H 122 4.077 4.465 -0.388 1
1 958 . 15 1 1 A 84 84 PRO C C 122 175.199 176.709 -1.510 1
1 959 . 15 1 1 A 84 84 PRO CA C 122 63.373 64.542 -1.169 1
1 960 . 15 1 1 A 84 84 PRO CB C 122 30.251 31.991 -1.740 1
1 962 . 15 1 1 A 85 85 PHE H H 123 6.652 6.862 -0.210 1
1 963 . 15 1 1 A 85 85 PHE HA H 123 4.744 4.724 0.020 1
1 971 . 15 1 1 A 85 85 PHE C C 123 170.340 172.557 -2.217 1
1 972 . 15 1 1 A 85 85 PHE CA C 123 53.999 56.389 -2.390 1
1 973 . 15 1 1 A 85 85 PHE CB C 123 39.000 40.224 -1.224 1
1 974 . 15 1 1 A 85 85 PHE N N 123 108.468 112.251 -3.783 1
1 975 . 15 1 1 A 86 86 ASP H H 124 9.268 9.275 -0.007 1
1 976 . 15 1 1 A 86 86 ASP HA H 124 5.108 5.234 -0.126 1
1 979 . 15 1 1 A 86 86 ASP C C 124 171.180 174.899 -3.719 1
1 980 . 15 1 1 A 86 86 ASP CA C 124 50.249 53.315 -3.066 1
1 981 . 15 1 1 A 86 86 ASP CB C 124 40.250 43.414 -3.164 1
1 982 . 15 1 1 A 86 86 ASP N N 124 121.741 119.022 2.719 1
1 983 . 15 1 1 A 87 87 LEU H H 125 8.018 9.518 -1.500 1
1 984 . 15 1 1 A 87 87 LEU HA H 125 5.809 5.551 0.258 1
1 994 . 15 1 1 A 87 87 LEU C C 125 171.350 175.575 -4.225 1
1 995 . 15 1 1 A 87 87 LEU CA C 125 50.874 53.947 -3.073 1
1 996 . 15 1 1 A 87 87 LEU CB C 125 44.318 45.576 -1.258 1
1 999 . 15 1 1 A 87 87 LEU N N 125 123.629 125.915 -2.286 1
1 1000 . 15 1 1 A 88 88 TYR H H 126 8.912 8.616 0.296 1
1 1001 . 15 1 1 A 88 88 TYR HA H 126 5.630 5.758 -0.128 1
1 1008 . 15 1 1 A 88 88 TYR C C 126 171.410 172.357 -0.947 1
1 1009 . 15 1 1 A 88 88 TYR CA C 126 52.749 56.620 -3.871 1
1 1010 . 15 1 1 A 88 88 TYR CB C 126 37.750 40.721 -2.971 1
1 1011 . 15 1 1 A 88 88 TYR N N 126 119.697 121.361 -1.664 1
1 1012 . 15 1 1 A 89 89 SER H H 127 9.319 9.361 -0.042 1
1 1013 . 15 1 1 A 89 89 SER HA H 127 5.429 5.216 0.213 1
1 1016 . 15 1 1 A 89 89 SER CA C 127 52.124 56.400 -4.276 1
1 1017 . 15 1 1 A 89 89 SER CB C 127 62.748 65.832 -3.084 1
1 1018 . 15 1 1 A 89 89 SER N N 127 112.637 115.662 -3.025 1
1 1019 . 15 1 1 A 90 90 LEU H H 128 8.759 8.568 0.191 1
1 1020 . 15 1 1 A 90 90 LEU HA H 128 4.186 4.342 -0.156 1
1 1030 . 15 1 1 A 90 90 LEU C C 128 175.121 177.967 -2.846 1
1 1031 . 15 1 1 A 90 90 LEU CA C 128 52.749 55.004 -2.255 1
1 1032 . 15 1 1 A 90 90 LEU CB C 128 35.875 41.779 -5.904 1
1 1033 . 15 1 1 A 90 90 LEU N N 128 126.728 125.774 0.954 1
1 1034 . 15 1 1 A 91 91 GLY H H 129 8.356 8.521 -0.165 1
1 1035 . 15 1 1 A 91 91 GLY HA2 H 129 3.373 3.658 -0.285 1
1 1036 . 15 1 1 A 91 91 GLY HA3 H 129 3.373 3.857 -0.484 1
1 1037 . 15 1 1 A 91 91 GLY C C 129 172.013 174.374 -2.361 1
1 1038 . 15 1 1 A 91 91 GLY CA C 129 41.500 44.072 -2.572 1
1 1039 . 15 1 1 A 91 91 GLY N N 129 108.559 110.318 -1.759 1
1 1040 . 15 1 1 A 92 92 ALA H H 130 7.047 8.199 -1.152 1
1 1041 . 15 1 1 A 92 92 ALA HA H 130 4.037 3.169 0.868 1
1 1045 . 15 1 1 A 92 92 ALA C C 130 174.890 177.740 -2.850 1
1 1046 . 15 1 1 A 92 92 ALA CA C 130 52.100 53.769 -1.669 1
1 1047 . 15 1 1 A 92 92 ALA CB C 130 16.502 17.768 -1.266 1
1 1048 . 15 1 1 A 92 92 ALA N N 130 118.393 121.618 -3.225 1
1 1049 . 15 1 1 A 93 93 ASP H H 131 7.222 7.602 -0.380 1
1 1050 . 15 1 1 A 93 93 ASP HA H 131 4.122 4.658 -0.536 1
1 1053 . 15 1 1 A 93 93 ASP C C 131 174.890 176.295 -1.405 1
1 1054 . 15 1 1 A 93 93 ASP CA C 131 50.249 53.908 -3.659 1
1 1055 . 15 1 1 A 93 93 ASP CB C 131 37.750 41.403 -3.653 1
1 1056 . 15 1 1 A 93 93 ASP N N 131 111.487 116.627 -5.140 1
1 1057 . 15 1 1 A 94 94 GLY H H 132 7.199 9.310 -2.111 1
1 1058 . 15 1 1 A 94 94 GLY HA2 H 132 3.951 3.820 0.131 1
1 1059 . 15 1 1 A 94 94 GLY HA3 H 132 3.324 3.826 -0.502 1
1 1060 . 15 1 1 A 94 94 GLY C C 132 169.773 173.245 -3.472 1
1 1061 . 15 1 1 A 94 94 GLY CA C 132 44.625 45.714 -1.089 1
1 1062 . 15 1 1 A 94 94 GLY N N 132 106.932 108.300 -1.368 1
1 1063 . 15 1 1 A 95 95 LYS H H 133 7.215 7.884 -0.669 1
1 1064 . 15 1 1 A 95 95 LYS HA H 133 4.513 4.855 -0.342 1
1 1073 . 15 1 1 A 95 95 LYS C C 133 172.108 175.652 -3.544 1
1 1074 . 15 1 1 A 95 95 LYS CA C 133 51.512 54.064 -2.552 1
1 1075 . 15 1 1 A 95 95 LYS CB C 133 34.000 35.481 -1.481 1
1 1076 . 15 1 1 A 95 95 LYS N N 133 115.749 120.367 -4.618 1
1 1077 . 15 1 1 A 96 96 GLU H H 134 9.230 8.783 0.447 1
1 1078 . 15 1 1 A 96 96 GLU HA H 134 4.352 4.791 -0.439 1
1 1083 . 15 1 1 A 96 96 GLU C C 134 175.219 175.761 -0.542 1
1 1084 . 15 1 1 A 96 96 GLU CA C 134 55.874 55.827 0.047 1
1 1085 . 15 1 1 A 96 96 GLU CB C 134 27.126 30.345 -3.219 1
1 1087 . 15 1 1 A 96 96 GLU N N 134 128.571 121.256 7.315 1
1 1088 . 15 1 1 A 97 97 GLY H H 135 10.677 8.461 2.216 1
1 1089 . 15 1 1 A 97 97 GLY HA2 H 135 4.037 4.374 -0.337 1
1 1090 . 15 1 1 A 97 97 GLY HA3 H 135 3.717 4.379 -0.662 1
1 1091 . 15 1 1 A 97 97 GLY C C 135 171.567 172.307 -0.740 1
1 1092 . 15 1 1 A 97 97 GLY CA C 135 41.500 45.818 -4.318 1
1 1093 . 15 1 1 A 97 97 GLY N N 135 117.011 110.628 6.383 1
1 1094 . 15 1 1 A 98 98 GLY H H 136 8.442 8.695 -0.253 1
1 1095 . 15 1 1 A 98 98 GLY HA2 H 136 4.195 4.235 -0.040 1
1 1096 . 15 1 1 A 98 98 GLY HA3 H 136 4.195 4.236 -0.041 1
1 1097 . 15 1 1 A 98 98 GLY C C 136 170.299 173.430 -3.131 1
1 1098 . 15 1 1 A 98 98 GLY CA C 136 40.875 44.892 -4.017 1
1 1099 . 15 1 1 A 98 98 GLY N N 136 109.494 109.143 0.351 1
1 1100 . 15 1 1 A 99 99 SER H H 137 8.701 8.772 -0.071 1
1 1101 . 15 1 1 A 99 99 SER HA H 137 4.639 4.919 -0.280 1
1 1104 . 15 1 1 A 99 99 SER C C 137 170.630 173.464 -2.834 1
1 1105 . 15 1 1 A 99 99 SER CA C 137 54.624 57.541 -2.917 1
1 1106 . 15 1 1 A 99 99 SER CB C 137 62.748 66.628 -3.880 1
1 1107 . 15 1 1 A 99 99 SER N N 137 114.685 118.789 -4.104 1
1 1108 . 15 1 1 A 100 100 ASP H H 138 9.117 8.915 0.202 1
1 1109 . 15 1 1 A 100 100 ASP HA H 138 3.965 4.495 -0.530 1
1 1112 . 15 1 1 A 100 100 ASP C C 138 175.540 177.810 -2.270 1
1 1113 . 15 1 1 A 100 100 ASP CA C 138 54.624 56.648 -2.024 1
1 1114 . 15 1 1 A 100 100 ASP CB C 138 36.500 40.570 -4.070 1
1 1115 . 15 1 1 A 100 100 ASP N N 138 120.777 122.584 -1.807 1
1 1116 . 15 1 1 A 101 101 ASN H H 139 8.667 8.362 0.305 1
1 1117 . 15 1 1 A 101 101 ASN HA H 139 4.333 4.842 -0.509 1
1 1122 . 15 1 1 A 101 101 ASN CA C 139 53.999 53.672 0.327 1
1 1123 . 15 1 1 A 101 101 ASN CB C 139 34.625 39.166 -4.541 1
1 1124 . 15 1 1 A 101 101 ASN N N 139 121.930 115.911 6.019 1
1 1126 . 15 1 1 A 102 102 ASP H H 140 7.714 7.868 -0.154 1
1 1127 . 15 1 1 A 102 102 ASP HA H 140 4.037 4.445 -0.408 1
1 1130 . 15 1 1 A 102 102 ASP C C 140 172.807 176.188 -3.381 1
1 1131 . 15 1 1 A 102 102 ASP CA C 140 53.374 54.607 -1.233 1
1 1132 . 15 1 1 A 102 102 ASP CB C 140 37.125 41.358 -4.233 1
1 1133 . 15 1 1 A 102 102 ASP N N 140 118.011 118.204 -0.193 1
1 1134 . 15 1 1 A 103 103 ALA H H 141 7.060 7.423 -0.363 1
1 1135 . 15 1 1 A 103 103 ALA HA H 141 3.353 4.287 -0.934 1
1 1139 . 15 1 1 A 103 103 ALA C C 141 172.233 176.904 -4.671 1
1 1140 . 15 1 1 A 103 103 ALA CA C 141 49.624 51.714 -2.090 1
1 1141 . 15 1 1 A 103 103 ALA CB C 141 16.502 20.529 -4.027 1
1 1142 . 15 1 1 A 103 103 ALA N N 141 125.777 121.952 3.825 1
1 1143 . 15 1 1 A 104 104 ASP H H 142 7.973 8.582 -0.609 1
1 1144 . 15 1 1 A 104 104 ASP HA H 142 4.420 4.826 -0.406 1
1 1147 . 15 1 1 A 104 104 ASP C C 142 174.188 176.075 -1.887 1
1 1148 . 15 1 1 A 104 104 ASP CA C 142 52.124 54.102 -1.978 1
1 1149 . 15 1 1 A 104 104 ASP CB C 142 37.125 41.374 -4.249 1
1 1150 . 15 1 1 A 104 104 ASP N N 142 122.965 120.069 2.896 1
1 1151 . 15 1 1 A 105 105 ILE H H 143 8.534 8.621 -0.087 1
1 1152 . 15 1 1 A 105 105 ILE HA H 143 4.060 4.905 -0.845 1
1 1162 . 15 1 1 A 105 105 ILE C C 143 173.235 175.957 -2.722 1
1 1163 . 15 1 1 A 105 105 ILE CA C 143 58.374 59.981 -1.607 1
1 1164 . 15 1 1 A 105 105 ILE CB C 143 39.123 39.529 -0.406 1
1 1167 . 15 1 1 A 105 105 ILE N N 143 124.757 120.254 4.503 1
1 1168 . 15 1 1 A 106 106 GLY H H 144 8.288 8.318 -0.030 1
1 1169 . 15 1 1 A 106 106 GLY HA2 H 144 4.764 4.439 0.325 1
1 1170 . 15 1 1 A 106 106 GLY HA3 H 144 4.764 4.543 0.221 1
1 1171 . 15 1 1 A 106 106 GLY C C 144 171.321 172.037 -0.716 1
1 1172 . 15 1 1 A 106 106 GLY CA C 144 40.250 45.676 -5.426 1
1 1173 . 15 1 1 A 106 106 GLY N N 144 110.895 111.354 -0.459 1
1 1174 . 15 1 1 A 107 107 ASN H H 145 8.577 8.894 -0.317 1
1 1175 . 15 1 1 A 107 107 ASN HA H 145 4.268 5.389 -1.121 1
1 1180 . 15 1 1 A 107 107 ASN C C 145 171.757 173.664 -1.907 1
1 1181 . 15 1 1 A 107 107 ASN CA C 145 52.124 51.537 0.587 1
1 1182 . 15 1 1 A 107 107 ASN CB C 145 34.625 42.790 -8.165 1
1 1183 . 15 1 1 A 107 107 ASN N N 145 118.042 115.945 2.097 1
1 1185 . 15 1 1 A 108 108 TRP H H 146 6.822 8.425 -1.603 1
1 1186 . 15 1 1 A 108 108 TRP HA H 146 4.513 4.951 -0.438 1
1 1195 . 15 1 1 A 108 108 TRP C C 146 172.665 172.048 0.617 1
1 1196 . 15 1 1 A 108 108 TRP CA C 146 54.624 55.628 -1.004 1
1 1197 . 15 1 1 A 108 108 TRP CB C 146 25.876 31.035 -5.159 1
1 1198 . 15 1 1 A 108 108 TRP N N 146 116.756 118.012 -1.256 1
1 1200 . 15 1 1 A 109 109 ASP H H 147 7.344 7.876 -0.532 1
1 1201 . 15 1 1 A 109 109 ASP HA H 147 4.655 5.376 -0.721 1
1 1204 . 15 1 1 A 109 109 ASP C C 147 172.193 174.834 -2.641 1
1 1205 . 15 1 1 A 109 109 ASP CA C 147 51.499 52.470 -0.971 1
1 1206 . 15 1 1 A 109 109 ASP CB C 147 39.000 43.739 -4.739 1
1 1207 . 15 1 1 A 109 109 ASP N N 147 121.461 120.398 1.063 1
1 11 . 16 1 1 A 2 2 SER H H 40 8.461 8.917 -0.456 1
1 12 . 16 1 1 A 2 2 SER HA H 40 4.286 4.819 -0.533 1
1 15 . 16 1 1 A 2 2 SER C C 40 171.276 172.826 -1.550 1
1 16 . 16 1 1 A 2 2 SER CA C 40 55.249 57.119 -1.870 1
1 17 . 16 1 1 A 2 2 SER CB C 40 61.498 62.732 -1.234 1
1 18 . 16 1 1 A 2 2 SER N N 40 118.344 119.959 -1.615 1
1 19 . 16 1 1 A 3 3 ARG H H 41 8.469 8.186 0.283 1
1 20 . 16 1 1 A 3 3 ARG HA H 41 4.400 4.881 -0.481 1
1 25 . 16 1 1 A 3 3 ARG C C 41 172.251 173.556 -1.305 1
1 26 . 16 1 1 A 3 3 ARG CA C 41 52.749 52.874 -0.125 1
1 27 . 16 1 1 A 3 3 ARG CB C 41 27.126 33.664 -6.538 1
1 28 . 16 1 1 A 3 3 ARG N N 41 123.070 125.680 -2.610 1
1 33 . 16 1 1 A 4 4 PRO CA C 42 61.498 63.798 -2.300 1
1 34 . 16 1 1 A 4 4 PRO CB C 42 29.001 31.804 -2.803 1
1 37 . 16 1 1 A 5 5 ASP H H 43 8.246 8.915 -0.669 1
1 38 . 16 1 1 A 5 5 ASP HA H 43 4.329 4.586 -0.257 1
1 41 . 16 1 1 A 5 5 ASP C C 43 174.605 177.330 -2.725 1
1 42 . 16 1 1 A 5 5 ASP CA C 43 53.374 55.871 -2.497 1
1 43 . 16 1 1 A 5 5 ASP CB C 43 38.375 40.615 -2.240 1
1 44 . 16 1 1 A 5 5 ASP N N 43 119.409 121.259 -1.850 1
1 45 . 16 1 1 A 6 6 GLN H H 44 8.309 8.353 -0.044 1
1 46 . 16 1 1 A 6 6 GLN HA H 44 4.393 4.264 0.129 1
1 53 . 16 1 1 A 6 6 GLN C C 44 175.053 178.286 -3.233 1
1 54 . 16 1 1 A 6 6 GLN CA C 44 55.874 58.191 -2.317 1
1 55 . 16 1 1 A 6 6 GLN CB C 44 25.876 28.275 -2.399 1
1 57 . 16 1 1 A 6 6 GLN N N 44 122.273 117.974 4.299 1
1 59 . 16 1 1 A 7 7 ALA H H 45 8.106 7.670 0.436 1
1 60 . 16 1 1 A 7 7 ALA HA H 45 3.993 4.134 -0.141 1
1 64 . 16 1 1 A 7 7 ALA C C 45 177.465 177.998 -0.533 1
1 65 . 16 1 1 A 7 7 ALA CA C 45 52.124 54.239 -2.115 1
1 66 . 16 1 1 A 7 7 ALA CB C 45 15.252 18.331 -3.079 1
1 67 . 16 1 1 A 7 7 ALA N N 45 122.204 121.605 0.599 1
1 68 . 16 1 1 A 8 8 LYS H H 46 7.527 7.740 -0.213 1
1 69 . 16 1 1 A 8 8 LYS HA H 46 3.539 4.170 -0.631 1
1 78 . 16 1 1 A 8 8 LYS C C 46 175.412 178.815 -3.403 1
1 79 . 16 1 1 A 8 8 LYS CA C 46 57.124 57.033 0.091 1
1 80 . 16 1 1 A 8 8 LYS CB C 46 30.876 32.275 -1.399 1
1 83 . 16 1 1 A 8 8 LYS N N 46 117.358 116.292 1.066 1
1 84 . 16 1 1 A 9 9 VAL H H 47 7.709 8.025 -0.316 1
1 85 . 16 1 1 A 9 9 VAL HA H 47 3.578 3.691 -0.113 1
1 93 . 16 1 1 A 9 9 VAL C C 47 175.005 178.557 -3.552 1
1 94 . 16 1 1 A 9 9 VAL CA C 47 64.623 66.161 -1.538 1
1 95 . 16 1 1 A 9 9 VAL CB C 47 29.001 31.811 -2.810 1
1 98 . 16 1 1 A 9 9 VAL N N 47 119.115 120.089 -0.974 1
1 99 . 16 1 1 A 10 10 THR H H 48 7.767 8.139 -0.372 1
1 100 . 16 1 1 A 10 10 THR HA H 48 3.668 4.072 -0.404 1
1 105 . 16 1 1 A 10 10 THR CA C 48 63.998 64.496 -0.498 1
1 106 . 16 1 1 A 10 10 THR CB C 48 67.123 68.730 -1.607 1
1 108 . 16 1 1 A 10 10 THR N N 48 115.112 113.721 1.391 1
1 109 . 16 1 1 A 11 11 VAL H H 49 7.598 7.635 -0.037 1
1 110 . 16 1 1 A 11 11 VAL HA H 49 3.457 3.727 -0.270 1
1 118 . 16 1 1 A 11 11 VAL C C 49 175.412 178.039 -2.627 1
1 119 . 16 1 1 A 11 11 VAL CA C 49 63.998 66.432 -2.434 1
1 120 . 16 1 1 A 11 11 VAL CB C 49 29.001 31.874 -2.873 1
1 123 . 16 1 1 A 11 11 VAL N N 49 123.694 119.785 3.909 1
1 124 . 16 1 1 A 12 12 ALA H H 50 8.176 8.099 0.077 1
1 125 . 16 1 1 A 12 12 ALA HA H 50 4.742 3.941 0.801 1
1 129 . 16 1 1 A 12 12 ALA C C 50 177.074 179.810 -2.736 1
1 130 . 16 1 1 A 12 12 ALA CA C 50 52.124 55.186 -3.062 1
1 131 . 16 1 1 A 12 12 ALA CB C 50 15.252 18.378 -3.126 1
1 132 . 16 1 1 A 12 12 ALA N N 50 122.348 122.388 -0.040 1
1 133 . 16 1 1 A 13 13 LYS H H 51 8.499 8.192 0.307 1
1 134 . 16 1 1 A 13 13 LYS HA H 51 3.648 4.045 -0.397 1
1 143 . 16 1 1 A 13 13 LYS C C 51 177.252 179.703 -2.451 1
1 144 . 16 1 1 A 13 13 LYS CA C 51 58.072 59.444 -1.372 1
1 145 . 16 1 1 A 13 13 LYS CB C 51 30.251 32.242 -1.991 1
1 146 . 16 1 1 A 13 13 LYS N N 51 115.402 116.777 -1.375 1
1 147 . 16 1 1 A 14 14 GLY H H 52 7.858 8.094 -0.236 1
1 148 . 16 1 1 A 14 14 GLY HA2 H 52 3.823 3.900 -0.077 1
1 149 . 16 1 1 A 14 14 GLY HA3 H 52 3.676 3.903 -0.227 1
1 150 . 16 1 1 A 14 14 GLY C C 52 174.090 175.597 -1.507 1
1 151 . 16 1 1 A 14 14 GLY CA C 52 44.625 46.549 -1.924 1
1 152 . 16 1 1 A 14 14 GLY N N 52 107.466 108.794 -1.328 1
1 153 . 16 1 1 A 15 15 ASP H H 53 8.403 7.641 0.762 1
1 154 . 16 1 1 A 15 15 ASP HA H 53 4.191 4.371 -0.180 1
1 157 . 16 1 1 A 15 15 ASP C C 53 175.316 179.010 -3.694 1
1 158 . 16 1 1 A 15 15 ASP CA C 53 54.624 56.623 -1.999 1
1 159 . 16 1 1 A 15 15 ASP CB C 53 35.875 40.943 -5.068 1
1 160 . 16 1 1 A 15 15 ASP N N 53 125.929 121.103 4.826 1
1 161 . 16 1 1 A 16 16 ILE H H 54 8.245 8.019 0.226 1
1 162 . 16 1 1 A 16 16 ILE HA H 54 3.034 3.871 -0.837 1
1 172 . 16 1 1 A 16 16 ILE C C 54 174.499 177.934 -3.435 1
1 173 . 16 1 1 A 16 16 ILE CA C 54 62.748 64.051 -1.303 1
1 174 . 16 1 1 A 16 16 ILE CB C 54 34.625 37.366 -2.741 1
1 178 . 16 1 1 A 16 16 ILE N N 54 119.456 116.630 2.826 1
1 179 . 16 1 1 A 17 17 LYS H H 55 7.547 8.082 -0.535 1
1 180 . 16 1 1 A 17 17 LYS HA H 55 3.843 4.098 -0.255 1
1 187 . 16 1 1 A 17 17 LYS C C 55 176.651 178.867 -2.216 1
1 188 . 16 1 1 A 17 17 LYS CA C 55 57.124 58.786 -1.662 1
1 189 . 16 1 1 A 17 17 LYS CB C 55 30.251 32.162 -1.911 1
1 190 . 16 1 1 A 17 17 LYS N N 55 118.505 120.601 -2.096 1
1 191 . 16 1 1 A 18 18 ALA H H 56 7.680 7.828 -0.148 1
1 192 . 16 1 1 A 18 18 ALA HA H 56 4.029 4.066 -0.037 1
1 196 . 16 1 1 A 18 18 ALA C C 56 176.638 180.127 -3.489 1
1 197 . 16 1 1 A 18 18 ALA CA C 56 52.749 54.797 -2.048 1
1 198 . 16 1 1 A 18 18 ALA CB C 56 15.877 18.348 -2.471 1
1 199 . 16 1 1 A 18 18 ALA N N 56 122.477 122.297 0.180 1
1 200 . 16 1 1 A 19 19 ILE H H 57 8.853 7.742 1.111 1
1 201 . 16 1 1 A 19 19 ILE HA H 57 3.304 3.636 -0.332 1
1 211 . 16 1 1 A 19 19 ILE C C 57 174.710 177.968 -3.258 1
1 212 . 16 1 1 A 19 19 ILE CA C 57 63.373 65.368 -1.995 1
1 213 . 16 1 1 A 19 19 ILE CB C 57 35.250 37.562 -2.312 1
1 217 . 16 1 1 A 19 19 ILE N N 57 120.901 118.274 2.627 1
1 218 . 16 1 1 A 20 20 ALA H H 58 8.702 8.377 0.325 1
1 219 . 16 1 1 A 20 20 ALA HA H 58 3.900 4.068 -0.168 1
1 223 . 16 1 1 A 20 20 ALA C C 58 176.512 179.504 -2.992 1
1 224 . 16 1 1 A 20 20 ALA CA C 58 52.749 55.089 -2.340 1
1 225 . 16 1 1 A 20 20 ALA CB C 58 15.252 18.084 -2.832 1
1 226 . 16 1 1 A 20 20 ALA N N 58 121.763 122.793 -1.030 1
1 227 . 16 1 1 A 21 21 ALA H H 59 7.662 7.580 0.082 1
1 228 . 16 1 1 A 21 21 ALA HA H 59 4.136 4.293 -0.157 1
1 232 . 16 1 1 A 21 21 ALA C C 59 177.949 179.640 -1.691 1
1 233 . 16 1 1 A 21 21 ALA CA C 59 52.749 54.784 -2.035 1
1 234 . 16 1 1 A 21 21 ALA CB C 59 15.252 18.732 -3.480 1
1 235 . 16 1 1 A 21 21 ALA N N 59 119.079 119.250 -0.171 1
1 236 . 16 1 1 A 22 22 ALA H H 60 7.403 7.812 -0.409 1
1 237 . 16 1 1 A 22 22 ALA HA H 60 4.318 4.201 0.117 1
1 241 . 16 1 1 A 22 22 ALA C C 60 176.730 180.455 -3.725 1
1 242 . 16 1 1 A 22 22 ALA CA C 60 52.749 54.492 -1.743 1
1 243 . 16 1 1 A 22 22 ALA CB C 60 17.126 18.699 -1.573 1
1 244 . 16 1 1 A 22 22 ALA N N 60 122.616 120.607 2.009 1
1 245 . 16 1 1 A 23 23 LEU H H 61 8.410 8.765 -0.355 1
1 246 . 16 1 1 A 23 23 LEU HA H 61 3.527 3.998 -0.471 1
1 256 . 16 1 1 A 23 23 LEU C C 61 176.057 178.271 -2.214 1
1 257 . 16 1 1 A 23 23 LEU CA C 61 55.249 57.242 -1.993 1
1 258 . 16 1 1 A 23 23 LEU CB C 61 39.000 40.893 -1.893 1
1 262 . 16 1 1 A 23 23 LEU N N 61 120.761 120.911 -0.150 1
1 263 . 16 1 1 A 24 24 ASP H H 62 8.227 8.128 0.099 1
1 264 . 16 1 1 A 24 24 ASP HA H 62 4.581 4.479 0.102 1
1 267 . 16 1 1 A 24 24 ASP C C 62 176.968 177.796 -0.828 1
1 268 . 16 1 1 A 24 24 ASP CA C 62 55.874 56.514 -0.640 1
1 269 . 16 1 1 A 24 24 ASP CB C 62 37.750 40.949 -3.199 1
1 270 . 16 1 1 A 24 24 ASP N N 62 119.068 118.962 0.106 1
1 271 . 16 1 1 A 25 25 MET H H 63 7.718 7.832 -0.114 1
1 272 . 16 1 1 A 25 25 MET HA H 63 4.196 4.263 -0.067 1
1 277 . 16 1 1 A 25 25 MET C C 63 174.968 177.646 -2.678 1
1 278 . 16 1 1 A 25 25 MET CA C 63 55.249 58.109 -2.860 1
1 279 . 16 1 1 A 25 25 MET CB C 63 29.626 32.248 -2.622 1
1 281 . 16 1 1 A 25 25 MET N N 63 121.365 117.268 4.097 1
1 282 . 16 1 1 A 26 26 TYR H H 64 8.401 7.560 0.841 1
1 283 . 16 1 1 A 26 26 TYR HA H 64 4.400 3.527 0.873 1
1 291 . 16 1 1 A 26 26 TYR C C 64 176.098 177.339 -1.241 1
1 292 . 16 1 1 A 26 26 TYR CA C 64 58.999 61.009 -2.010 1
1 293 . 16 1 1 A 26 26 TYR CB C 64 35.250 38.309 -3.059 1
1 294 . 16 1 1 A 26 26 TYR N N 64 122.575 121.974 0.601 1
1 295 . 16 1 1 A 27 27 LYS H H 65 8.330 8.178 0.152 1
1 296 . 16 1 1 A 27 27 LYS HA H 65 3.568 4.209 -0.641 1
1 302 . 16 1 1 A 27 27 LYS C C 65 176.156 178.736 -2.580 1
1 303 . 16 1 1 A 27 27 LYS CA C 65 56.499 59.397 -2.898 1
1 304 . 16 1 1 A 27 27 LYS CB C 65 29.626 31.955 -2.329 1
1 306 . 16 1 1 A 27 27 LYS N N 65 121.390 118.842 2.548 1
1 307 . 16 1 1 A 28 28 LEU H H 66 7.833 7.715 0.118 1
1 308 . 16 1 1 A 28 28 LEU HA H 66 3.769 4.117 -0.348 1
1 318 . 16 1 1 A 28 28 LEU C C 66 175.925 178.356 -2.431 1
1 319 . 16 1 1 A 28 28 LEU CA C 66 55.874 56.820 -0.946 1
1 320 . 16 1 1 A 28 28 LEU CB C 66 38.375 41.551 -3.176 1
1 324 . 16 1 1 A 28 28 LEU N N 66 123.068 119.295 3.773 1
1 325 . 16 1 1 A 29 29 ASP H H 67 7.292 7.681 -0.389 1
1 326 . 16 1 1 A 29 29 ASP HA H 67 4.096 4.307 -0.211 1
1 329 . 16 1 1 A 29 29 ASP C C 67 174.618 176.704 -2.086 1
1 330 . 16 1 1 A 29 29 ASP CA C 67 53.999 56.321 -2.322 1
1 331 . 16 1 1 A 29 29 ASP CB C 67 38.375 40.661 -2.286 1
1 332 . 16 1 1 A 29 29 ASP N N 67 114.729 119.258 -4.529 1
1 333 . 16 1 1 A 30 30 ASN H H 68 8.097 7.500 0.597 1
1 334 . 16 1 1 A 30 30 ASN HA H 68 4.337 4.403 -0.066 1
1 339 . 16 1 1 A 30 30 ASN C C 68 172.822 174.221 -1.399 1
1 340 . 16 1 1 A 30 30 ASN CA C 68 52.124 52.023 0.101 1
1 341 . 16 1 1 A 30 30 ASN CB C 68 37.750 38.515 -0.765 1
1 342 . 16 1 1 A 30 30 ASN N N 68 111.054 115.093 -4.039 1
1 344 . 16 1 1 A 31 31 PHE H H 69 8.249 7.950 0.299 1
1 345 . 16 1 1 A 31 31 PHE HA H 69 4.135 4.298 -0.163 1
1 353 . 16 1 1 A 31 31 PHE C C 69 170.485 174.251 -3.766 1
1 354 . 16 1 1 A 31 31 PHE CA C 69 57.749 58.751 -1.002 1
1 355 . 16 1 1 A 31 31 PHE CB C 69 33.375 36.589 -3.214 1
1 356 . 16 1 1 A 31 31 PHE N N 69 116.277 117.254 -0.977 1
1 357 . 16 1 1 A 32 32 ALA H H 70 7.224 6.818 0.406 1
1 358 . 16 1 1 A 32 32 ALA HA H 70 4.194 4.517 -0.323 1
1 362 . 16 1 1 A 32 32 ALA C C 70 173.337 175.046 -1.709 1
1 363 . 16 1 1 A 32 32 ALA CA C 70 48.374 51.514 -3.140 1
1 364 . 16 1 1 A 32 32 ALA CB C 70 19.626 22.345 -2.719 1
1 365 . 16 1 1 A 32 32 ALA N N 70 119.914 120.332 -0.418 1
1 366 . 16 1 1 A 33 33 TYR H H 71 7.948 8.435 -0.487 1
1 367 . 16 1 1 A 33 33 TYR HA H 71 4.209 4.990 -0.781 1
1 374 . 16 1 1 A 33 33 TYR C C 71 170.591 174.244 -3.653 1
1 375 . 16 1 1 A 33 33 TYR CA C 71 54.624 56.413 -1.789 1
1 376 . 16 1 1 A 33 33 TYR CB C 71 34.000 38.002 -4.002 1
1 377 . 16 1 1 A 33 33 TYR N N 71 116.929 117.809 -0.880 1
1 378 . 16 1 1 A 34 34 PRO HA H 72 4.444 4.763 -0.319 1
1 381 . 16 1 1 A 34 34 PRO C C 72 174.775 176.342 -1.567 1
1 382 . 16 1 1 A 34 34 PRO CA C 72 59.624 62.526 -2.902 1
1 383 . 16 1 1 A 34 34 PRO CB C 72 28.376 32.139 -3.763 1
1 384 . 16 1 1 A 35 35 SER H H 73 8.721 8.423 0.298 1
1 385 . 16 1 1 A 35 35 SER HA H 73 4.467 4.759 -0.292 1
1 388 . 16 1 1 A 35 35 SER C C 73 173.271 175.610 -2.339 1
1 389 . 16 1 1 A 35 35 SER CA C 73 55.249 56.635 -1.386 1
1 390 . 16 1 1 A 35 35 SER CB C 73 63.373 65.771 -2.398 1
1 391 . 16 1 1 A 35 35 SER N N 73 118.284 114.470 3.814 1
1 392 . 16 1 1 A 36 36 THR H H 74 8.591 8.955 -0.364 1
1 393 . 16 1 1 A 36 36 THR HA H 74 3.649 4.143 -0.494 1
1 398 . 16 1 1 A 36 36 THR CA C 74 64.623 64.596 0.027 1
1 399 . 16 1 1 A 36 36 THR CB C 74 66.498 68.699 -2.201 1
1 401 . 16 1 1 A 36 36 THR N N 74 117.769 116.367 1.402 1
1 402 . 16 1 1 A 37 37 GLN H H 75 8.210 7.882 0.328 1
1 403 . 16 1 1 A 37 37 GLN HA H 75 3.860 4.455 -0.595 1
1 410 . 16 1 1 A 37 37 GLN C C 75 175.349 177.634 -2.285 1
1 411 . 16 1 1 A 37 37 GLN CA C 75 56.499 57.630 -1.131 1
1 412 . 16 1 1 A 37 37 GLN CB C 75 25.876 29.587 -3.711 1
1 414 . 16 1 1 A 37 37 GLN N N 75 117.931 120.200 -2.269 1
1 416 . 16 1 1 A 38 38 GLN H H 76 7.667 8.149 -0.482 1
1 417 . 16 1 1 A 38 38 GLN HA H 76 3.810 4.089 -0.279 1
1 424 . 16 1 1 A 38 38 GLN C C 76 175.805 179.502 -3.697 1
1 425 . 16 1 1 A 38 38 GLN CA C 76 55.874 58.640 -2.766 1
1 426 . 16 1 1 A 38 38 GLN CB C 76 25.876 28.323 -2.447 1
1 428 . 16 1 1 A 38 38 GLN N N 76 120.607 118.355 2.252 1
1 430 . 16 1 1 A 39 39 GLY H H 77 8.470 8.226 0.244 1
1 431 . 16 1 1 A 39 39 GLY HA2 H 77 3.920 3.765 0.155 1
1 432 . 16 1 1 A 39 39 GLY HA3 H 77 3.603 3.793 -0.190 1
1 433 . 16 1 1 A 39 39 GLY C C 77 169.006 175.313 -6.307 1
1 434 . 16 1 1 A 39 39 GLY CA C 77 42.125 46.572 -4.447 1
1 435 . 16 1 1 A 39 39 GLY N N 77 103.281 109.309 -6.028 1
1 436 . 16 1 1 A 40 40 LEU H H 78 8.135 7.881 0.254 1
1 437 . 16 1 1 A 40 40 LEU HA H 78 3.237 4.062 -0.825 1
1 447 . 16 1 1 A 40 40 LEU C C 78 176.383 178.624 -2.241 1
1 448 . 16 1 1 A 40 40 LEU CA C 78 52.749 57.181 -4.432 1
1 449 . 16 1 1 A 40 40 LEU CB C 78 39.000 41.472 -2.472 1
1 453 . 16 1 1 A 40 40 LEU N N 78 114.444 123.259 -8.815 1
1 454 . 16 1 1 A 41 41 GLU H H 79 8.578 7.924 0.654 1
1 455 . 16 1 1 A 41 41 GLU HA H 79 3.720 4.143 -0.423 1
1 460 . 16 1 1 A 41 41 GLU C C 79 175.093 177.791 -2.698 1
1 461 . 16 1 1 A 41 41 GLU CA C 79 57.124 59.120 -1.996 1
1 462 . 16 1 1 A 41 41 GLU CB C 79 26.501 29.108 -2.607 1
1 464 . 16 1 1 A 41 41 GLU N N 79 118.295 118.066 0.229 1
1 465 . 16 1 1 A 42 42 ALA H H 80 7.227 7.681 -0.454 1
1 466 . 16 1 1 A 42 42 ALA HA H 80 4.437 4.611 -0.174 1
1 470 . 16 1 1 A 42 42 ALA C C 80 173.745 178.366 -4.621 1
1 471 . 16 1 1 A 42 42 ALA CA C 80 51.499 53.456 -1.957 1
1 472 . 16 1 1 A 42 42 ALA CB C 80 15.877 18.832 -2.955 1
1 473 . 16 1 1 A 42 42 ALA N N 80 119.751 122.233 -2.482 1
1 474 . 16 1 1 A 43 43 LEU H H 81 7.932 7.408 0.524 1
1 475 . 16 1 1 A 43 43 LEU HA H 81 4.369 4.372 -0.003 1
1 485 . 16 1 1 A 43 43 LEU C C 81 174.788 178.178 -3.390 1
1 486 . 16 1 1 A 43 43 LEU CA C 81 53.374 56.354 -2.980 1
1 487 . 16 1 1 A 43 43 LEU CB C 81 39.625 42.488 -2.863 1
1 491 . 16 1 1 A 43 43 LEU N N 81 111.742 116.721 -4.979 1
1 492 . 16 1 1 A 44 44 VAL H H 82 7.886 7.330 0.556 1
1 493 . 16 1 1 A 44 44 VAL HA H 82 4.700 4.153 0.547 1
1 501 . 16 1 1 A 44 44 VAL C C 82 172.875 175.823 -2.948 1
1 502 . 16 1 1 A 44 44 VAL CA C 82 59.624 63.766 -4.142 1
1 503 . 16 1 1 A 44 44 VAL CB C 82 31.501 33.188 -1.687 1
1 506 . 16 1 1 A 44 44 VAL N N 82 113.604 115.321 -1.717 1
1 507 . 16 1 1 A 45 45 LYS H H 83 8.361 8.218 0.143 1
1 508 . 16 1 1 A 45 45 LYS HA H 83 4.251 4.905 -0.654 1
1 515 . 16 1 1 A 45 45 LYS C C 83 171.053 174.876 -3.823 1
1 516 . 16 1 1 A 45 45 LYS CA C 83 52.749 54.225 -1.476 1
1 517 . 16 1 1 A 45 45 LYS CB C 83 33.375 35.787 -2.412 1
1 521 . 16 1 1 A 45 45 LYS N N 83 123.860 121.650 2.210 1
1 522 . 16 1 1 A 46 46 LYS H H 84 7.243 7.816 -0.573 1
1 523 . 16 1 1 A 46 46 LYS HA H 84 2.175 2.802 -0.627 1
1 532 . 16 1 1 A 46 46 LYS C C 84 172.123 174.441 -2.318 1
1 533 . 16 1 1 A 46 46 LYS CA C 84 52.749 54.315 -1.566 1
1 534 . 16 1 1 A 46 46 LYS CB C 84 29.626 31.314 -1.688 1
1 537 . 16 1 1 A 46 46 LYS N N 84 128.615 123.735 4.880 1
1 538 . 16 1 1 A 47 47 PRO HA H 85 4.470 4.459 0.011 1
1 541 . 16 1 1 A 47 47 PRO C C 85 173.754 177.468 -3.714 1
1 542 . 16 1 1 A 47 47 PRO CA C 85 60.874 63.012 -2.138 1
1 543 . 16 1 1 A 47 47 PRO CB C 85 30.876 32.460 -1.584 1
1 546 . 16 1 1 A 48 48 THR H H 86 8.306 8.666 -0.360 1
1 547 . 16 1 1 A 48 48 THR HA H 86 4.287 4.191 0.096 1
1 552 . 16 1 1 A 48 48 THR C C 86 173.070 175.148 -2.078 1
1 553 . 16 1 1 A 48 48 THR CA C 86 57.749 64.429 -6.680 1
1 554 . 16 1 1 A 48 48 THR CB C 86 67.748 69.319 -1.571 1
1 556 . 16 1 1 A 48 48 THR N N 86 109.564 118.710 -9.146 1
1 557 . 16 1 1 A 49 49 GLY H H 87 8.317 7.615 0.702 1
1 558 . 16 1 1 A 49 49 GLY HA2 H 87 3.851 4.022 -0.171 1
1 559 . 16 1 1 A 49 49 GLY HA3 H 87 3.678 4.025 -0.347 1
1 560 . 16 1 1 A 49 49 GLY C C 87 169.693 173.184 -3.491 1
1 561 . 16 1 1 A 49 49 GLY CA C 87 42.125 44.353 -2.228 1
1 562 . 16 1 1 A 49 49 GLY N N 87 109.071 109.588 -0.517 1
1 563 . 16 1 1 A 50 50 ASN H H 88 8.301 8.558 -0.257 1
1 564 . 16 1 1 A 50 50 ASN HA H 88 4.780 5.348 -0.568 1
1 569 . 16 1 1 A 50 50 ASN C C 88 171.370 172.987 -1.617 1
1 570 . 16 1 1 A 50 50 ASN CA C 88 47.749 50.337 -2.588 1
1 571 . 16 1 1 A 50 50 ASN CB C 88 37.125 39.323 -2.198 1
1 572 . 16 1 1 A 50 50 ASN N N 88 115.631 119.258 -3.627 1
1 574 . 16 1 1 A 51 51 PRO HA H 89 4.782 4.456 0.326 1
1 577 . 16 1 1 A 51 51 PRO C C 89 173.656 176.295 -2.639 1
1 578 . 16 1 1 A 51 51 PRO CA C 89 59.624 62.350 -2.726 1
1 579 . 16 1 1 A 51 51 PRO CB C 89 31.501 32.260 -0.759 1
1 582 . 16 1 1 A 52 52 GLN H H 90 9.076 8.801 0.275 1
1 583 . 16 1 1 A 52 52 GLN HA H 90 4.469 4.775 -0.306 1
1 590 . 16 1 1 A 52 52 GLN C C 90 172.386 174.233 -1.847 1
1 591 . 16 1 1 A 52 52 GLN CA C 90 50.874 54.107 -3.233 1
1 592 . 16 1 1 A 52 52 GLN CB C 90 26.501 27.661 -1.160 1
1 594 . 16 1 1 A 52 52 GLN N N 90 126.827 120.044 6.783 1
1 596 . 16 1 1 A 53 53 PRO HA H 91 4.384 4.573 -0.189 1
1 599 . 16 1 1 A 53 53 PRO C C 91 174.274 175.250 -0.976 1
1 600 . 16 1 1 A 53 53 PRO CB C 91 28.113 31.333 -3.220 1
1 601 . 16 1 1 A 54 54 LYS H H 92 8.401 8.425 -0.024 1
1 602 . 16 1 1 A 54 54 LYS HA H 92 3.984 4.777 -0.793 1
1 611 . 16 1 1 A 54 54 LYS C C 92 173.516 174.580 -1.064 1
1 612 . 16 1 1 A 54 54 LYS CA C 92 55.249 55.476 -0.227 1
1 613 . 16 1 1 A 54 54 LYS CB C 92 30.876 36.076 -5.200 1
1 615 . 16 1 1 A 54 54 LYS N N 92 124.538 124.296 0.242 1
1 616 . 16 1 1 A 55 55 ASN H H 93 8.183 8.715 -0.532 1
1 617 . 16 1 1 A 55 55 ASN HA H 93 4.716 4.947 -0.231 1
1 622 . 16 1 1 A 55 55 ASN CA C 93 48.999 53.181 -4.182 1
1 623 . 16 1 1 A 55 55 ASN CB C 93 35.875 37.676 -1.801 1
1 624 . 16 1 1 A 55 55 ASN N N 93 118.677 122.846 -4.169 1
1 626 . 16 1 1 A 56 56 TRP H H 94 8.007 8.734 -0.727 1
1 627 . 16 1 1 A 56 56 TRP HA H 94 3.827 5.171 -1.344 1
1 635 . 16 1 1 A 56 56 TRP C C 94 173.760 175.363 -1.603 1
1 636 . 16 1 1 A 56 56 TRP CA C 94 59.624 59.295 0.329 1
1 637 . 16 1 1 A 56 56 TRP CB C 94 27.126 30.361 -3.235 1
1 638 . 16 1 1 A 56 56 TRP N N 94 122.195 127.818 -5.623 1
1 640 . 16 1 1 A 57 57 ASN H H 95 7.563 7.574 -0.011 1
1 641 . 16 1 1 A 57 57 ASN HA H 95 3.735 4.904 -1.169 1
1 646 . 16 1 1 A 57 57 ASN C C 95 171.952 173.991 -2.039 1
1 647 . 16 1 1 A 57 57 ASN CA C 95 51.499 50.808 0.691 1
1 648 . 16 1 1 A 57 57 ASN CB C 95 35.250 41.211 -5.961 1
1 649 . 16 1 1 A 57 57 ASN N N 95 129.659 125.216 4.443 1
1 651 . 16 1 1 A 58 58 LYS H H 96 8.110 8.218 -0.108 1
1 652 . 16 1 1 A 58 58 LYS HA H 96 4.035 3.989 0.046 1
1 659 . 16 1 1 A 58 58 LYS C C 96 174.530 175.617 -1.087 1
1 660 . 16 1 1 A 58 58 LYS CA C 96 56.499 55.304 1.195 1
1 661 . 16 1 1 A 58 58 LYS CB C 96 29.626 33.254 -3.628 1
1 665 . 16 1 1 A 58 58 LYS N N 96 123.913 123.397 0.516 1
1 666 . 16 1 1 A 59 59 ASP H H 97 7.903 8.879 -0.976 1
1 667 . 16 1 1 A 59 59 ASP HA H 97 4.393 4.453 -0.060 1
1 670 . 16 1 1 A 59 59 ASP C C 97 173.724 175.531 -1.807 1
1 671 . 16 1 1 A 59 59 ASP CA C 97 52.124 55.146 -3.022 1
1 672 . 16 1 1 A 59 59 ASP CB C 97 38.375 39.739 -1.364 1
1 673 . 16 1 1 A 59 59 ASP N N 97 118.773 119.876 -1.103 1
1 674 . 16 1 1 A 60 60 GLY H H 98 7.819 8.020 -0.201 1
1 675 . 16 1 1 A 60 60 GLY HA2 H 98 3.917 4.018 -0.101 1
1 676 . 16 1 1 A 60 60 GLY HA3 H 98 3.917 4.156 -0.239 1
1 677 . 16 1 1 A 60 60 GLY C C 98 168.652 174.522 -5.870 1
1 678 . 16 1 1 A 60 60 GLY CA C 98 41.500 45.263 -3.763 1
1 679 . 16 1 1 A 60 60 GLY N N 98 108.742 105.205 3.537 1
1 680 . 16 1 1 A 61 61 TYR H H 99 8.105 8.232 -0.127 1
1 681 . 16 1 1 A 61 61 TYR HA H 99 3.927 4.559 -0.632 1
1 689 . 16 1 1 A 61 61 TYR C C 99 172.831 174.120 -1.289 1
1 690 . 16 1 1 A 61 61 TYR CA C 99 57.124 58.387 -1.263 1
1 691 . 16 1 1 A 61 61 TYR CB C 99 37.125 36.452 0.673 1
1 692 . 16 1 1 A 61 61 TYR N N 99 113.836 115.779 -1.943 1
1 693 . 16 1 1 A 62 62 LEU H H 100 7.352 7.880 -0.528 1
1 694 . 16 1 1 A 62 62 LEU HA H 100 4.343 4.939 -0.596 1
1 704 . 16 1 1 A 62 62 LEU C C 100 173.430 175.483 -2.053 1
1 705 . 16 1 1 A 62 62 LEU CA C 100 50.874 53.524 -2.650 1
1 706 . 16 1 1 A 62 62 LEU CB C 100 44.000 46.102 -2.102 1
1 710 . 16 1 1 A 62 62 LEU N N 100 117.112 121.053 -3.941 1
1 711 . 16 1 1 A 63 63 LYS H H 101 8.626 8.346 0.280 1
1 712 . 16 1 1 A 63 63 LYS HA H 101 3.986 4.339 -0.353 1
1 721 . 16 1 1 A 63 63 LYS C C 101 173.851 177.455 -3.604 1
1 722 . 16 1 1 A 63 63 LYS CA C 101 55.249 55.877 -0.628 1
1 723 . 16 1 1 A 63 63 LYS CB C 101 29.626 33.399 -3.773 1
1 724 . 16 1 1 A 63 63 LYS N N 101 129.991 123.488 6.503 1
1 725 . 16 1 1 A 64 64 LYS H H 102 7.059 8.536 -1.477 1
1 726 . 16 1 1 A 64 64 LYS HA H 102 4.138 4.214 -0.076 1
1 735 . 16 1 1 A 64 64 LYS C C 102 171.120 175.577 -4.457 1
1 736 . 16 1 1 A 64 64 LYS CA C 102 52.749 56.472 -3.723 1
1 737 . 16 1 1 A 64 64 LYS CB C 102 32.750 31.872 0.878 1
1 740 . 16 1 1 A 64 64 LYS N N 102 113.255 120.735 -7.480 1
1 741 . 16 1 1 A 65 65 LEU H H 103 8.883 7.814 1.069 1
1 742 . 16 1 1 A 65 65 LEU HA H 103 4.475 4.735 -0.260 1
1 752 . 16 1 1 A 65 65 LEU C C 103 171.487 174.347 -2.860 1
1 753 . 16 1 1 A 65 65 LEU CA C 103 48.999 51.151 -2.152 1
1 754 . 16 1 1 A 65 65 LEU CB C 103 39.625 44.918 -5.293 1
1 758 . 16 1 1 A 65 65 LEU N N 103 126.355 120.718 5.637 1
1 759 . 16 1 1 A 66 66 PRO HA H 104 4.449 4.651 -0.202 1
1 764 . 16 1 1 A 66 66 PRO C C 104 173.363 176.266 -2.903 1
1 765 . 16 1 1 A 66 66 PRO CA C 104 60.249 62.164 -1.915 1
1 766 . 16 1 1 A 66 66 PRO CB C 104 29.626 32.863 -3.237 1
1 769 . 16 1 1 A 67 67 VAL H H 105 7.682 8.407 -0.725 1
1 770 . 16 1 1 A 67 67 VAL HA H 105 4.121 4.465 -0.344 1
1 778 . 16 1 1 A 67 67 VAL C C 105 171.667 174.952 -3.285 1
1 779 . 16 1 1 A 67 67 VAL CA C 105 58.374 61.818 -3.444 1
1 780 . 16 1 1 A 67 67 VAL CB C 105 30.251 32.678 -2.427 1
1 783 . 16 1 1 A 67 67 VAL N N 105 114.671 121.124 -6.453 1
1 784 . 16 1 1 A 68 68 ASP H H 106 8.216 8.344 -0.128 1
1 785 . 16 1 1 A 68 68 ASP HA H 106 4.474 4.890 -0.416 1
1 788 . 16 1 1 A 68 68 ASP C C 106 172.452 174.953 -2.501 1
1 789 . 16 1 1 A 68 68 ASP CA C 106 50.249 52.405 -2.156 1
1 790 . 16 1 1 A 68 68 ASP CB C 106 37.750 40.652 -2.902 1
1 791 . 16 1 1 A 68 68 ASP N N 106 123.825 125.190 -1.365 1
1 792 . 16 1 1 A 69 69 PRO HA H 107 3.920 4.027 -0.107 1
1 797 . 16 1 1 A 69 69 PRO CA C 107 62.123 63.016 -0.893 1
1 798 . 16 1 1 A 69 69 PRO CB C 107 27.751 31.437 -3.686 1
1 801 . 16 1 1 A 70 70 TRP H H 108 8.156 8.371 -0.215 1
1 802 . 16 1 1 A 70 70 TRP HA H 108 4.274 4.302 -0.028 1
1 811 . 16 1 1 A 70 70 TRP CA C 108 57.124 58.348 -1.224 1
1 812 . 16 1 1 A 70 70 TRP CB C 108 25.251 27.196 -1.945 1
1 813 . 16 1 1 A 70 70 TRP N N 108 118.137 117.444 0.693 1
1 815 . 16 1 1 A 71 71 GLY H H 109 8.209 8.744 -0.535 1
1 816 . 16 1 1 A 71 71 GLY HA2 H 109 4.030 3.879 0.151 1
1 817 . 16 1 1 A 71 71 GLY HA3 H 109 3.303 3.906 -0.603 1
1 818 . 16 1 1 A 71 71 GLY CA C 109 42.750 46.405 -3.655 1
1 819 . 16 1 1 A 71 71 GLY N N 109 107.495 105.393 2.102 1
1 820 . 16 1 1 A 72 72 ASN H H 110 8.116 7.920 0.196 1
1 821 . 16 1 1 A 72 72 ASN HA H 110 5.103 4.984 0.119 1
1 826 . 16 1 1 A 72 72 ASN CA C 110 48.374 50.875 -2.501 1
1 827 . 16 1 1 A 72 72 ASN CB C 110 36.500 38.897 -2.397 1
1 828 . 16 1 1 A 72 72 ASN N N 110 120.108 120.150 -0.042 1
1 830 . 16 1 1 A 73 73 PRO HA H 111 4.397 4.672 -0.275 1
1 835 . 16 1 1 A 73 73 PRO C C 111 176.229 176.289 -0.060 1
1 836 . 16 1 1 A 73 73 PRO CA C 111 60.249 62.314 -2.065 1
1 837 . 16 1 1 A 73 73 PRO CB C 111 29.001 32.392 -3.391 1
1 840 . 16 1 1 A 74 74 TYR H H 112 8.893 8.549 0.344 1
1 841 . 16 1 1 A 74 74 TYR HA H 112 4.064 5.035 -0.971 1
1 849 . 16 1 1 A 74 74 TYR C C 112 171.951 176.049 -4.098 1
1 850 . 16 1 1 A 74 74 TYR CA C 112 60.249 58.250 1.999 1
1 851 . 16 1 1 A 74 74 TYR CB C 112 36.500 39.362 -2.862 1
1 852 . 16 1 1 A 74 74 TYR N N 112 124.595 121.230 3.365 1
1 853 . 16 1 1 A 75 75 GLN H H 113 9.127 8.844 0.283 1
1 854 . 16 1 1 A 75 75 GLN HA H 113 4.019 4.420 -0.401 1
1 861 . 16 1 1 A 75 75 GLN C C 113 171.436 174.122 -2.686 1
1 862 . 16 1 1 A 75 75 GLN CA C 113 50.874 54.576 -3.702 1
1 863 . 16 1 1 A 75 75 GLN CB C 113 29.469 29.785 -0.316 1
1 865 . 16 1 1 A 75 75 GLN N N 113 120.777 121.980 -1.203 1
1 867 . 16 1 1 A 76 76 TYR H H 114 7.906 8.858 -0.952 1
1 868 . 16 1 1 A 76 76 TYR HA H 114 5.586 5.158 0.428 1
1 875 . 16 1 1 A 76 76 TYR C C 114 171.343 175.759 -4.416 1
1 876 . 16 1 1 A 76 76 TYR CA C 114 53.999 57.523 -3.524 1
1 877 . 16 1 1 A 76 76 TYR CB C 114 40.250 39.971 0.279 1
1 878 . 16 1 1 A 76 76 TYR N N 114 120.757 123.175 -2.418 1
1 879 . 16 1 1 A 77 77 LEU H H 115 8.261 8.935 -0.674 1
1 880 . 16 1 1 A 77 77 LEU HA H 115 4.280 5.268 -0.988 1
1 890 . 16 1 1 A 77 77 LEU C C 115 170.921 175.786 -4.865 1
1 891 . 16 1 1 A 77 77 LEU CA C 115 51.499 53.649 -2.150 1
1 892 . 16 1 1 A 77 77 LEU CB C 115 44.625 45.543 -0.918 1
1 896 . 16 1 1 A 77 77 LEU N N 115 130.662 124.511 6.151 1
1 897 . 16 1 1 A 78 78 ALA H H 116 7.973 8.438 -0.465 1
1 898 . 16 1 1 A 78 78 ALA HA H 116 4.292 4.870 -0.578 1
1 902 . 16 1 1 A 78 78 ALA C C 116 172.093 174.673 -2.580 1
1 903 . 16 1 1 A 78 78 ALA CA C 116 47.749 49.929 -2.180 1
1 904 . 16 1 1 A 78 78 ALA CB C 116 19.626 21.421 -1.795 1
1 905 . 16 1 1 A 78 78 ALA N N 116 125.564 125.135 0.429 1
1 906 . 16 1 1 A 79 79 PRO HA H 117 4.698 5.454 -0.756 1
1 911 . 16 1 1 A 79 79 PRO C C 117 173.994 176.667 -2.673 1
1 912 . 16 1 1 A 79 79 PRO CA C 117 60.249 63.452 -3.203 1
1 913 . 16 1 1 A 79 79 PRO CB C 117 31.501 31.927 -0.426 1
1 916 . 16 1 1 A 80 80 GLY H H 118 7.096 8.441 -1.345 1
1 917 . 16 1 1 A 80 80 GLY HA2 H 118 3.797 4.043 -0.246 1
1 918 . 16 1 1 A 80 80 GLY HA3 H 118 3.517 4.065 -0.548 1
1 919 . 16 1 1 A 80 80 GLY C C 118 171.404 174.154 -2.750 1
1 920 . 16 1 1 A 80 80 GLY CA C 118 41.500 46.603 -5.103 1
1 921 . 16 1 1 A 80 80 GLY N N 118 108.306 108.134 0.172 1
1 922 . 16 1 1 A 81 81 THR H H 119 9.810 7.946 1.864 1
1 923 . 16 1 1 A 81 81 THR HA H 119 4.091 4.579 -0.488 1
1 928 . 16 1 1 A 81 81 THR C C 119 174.242 174.474 -0.232 1
1 929 . 16 1 1 A 81 81 THR CA C 119 60.874 60.734 0.140 1
1 930 . 16 1 1 A 81 81 THR CB C 119 66.498 69.325 -2.827 1
1 932 . 16 1 1 A 81 81 THR N N 119 112.813 113.311 -0.498 1
1 933 . 16 1 1 A 82 82 LYS H H 120 8.964 8.666 0.298 1
1 934 . 16 1 1 A 82 82 LYS HA H 120 4.150 3.857 0.293 1
1 941 . 16 1 1 A 82 82 LYS C C 120 172.886 175.222 -2.336 1
1 942 . 16 1 1 A 82 82 LYS CA C 120 53.999 57.758 -3.759 1
1 943 . 16 1 1 A 82 82 LYS CB C 120 30.876 29.548 1.328 1
1 944 . 16 1 1 A 82 82 LYS N N 120 123.569 125.934 -2.365 1
1 945 . 16 1 1 A 83 83 GLY H H 121 7.125 7.910 -0.785 1
1 946 . 16 1 1 A 83 83 GLY HA2 H 121 3.814 4.272 -0.458 1
1 947 . 16 1 1 A 83 83 GLY HA3 H 121 3.814 4.321 -0.507 1
1 948 . 16 1 1 A 83 83 GLY C C 121 167.671 173.826 -6.155 1
1 949 . 16 1 1 A 83 83 GLY CA C 121 42.125 44.631 -2.506 1
1 950 . 16 1 1 A 83 83 GLY N N 121 107.253 107.381 -0.128 1
1 951 . 16 1 1 A 84 84 PRO HA H 122 4.077 4.495 -0.418 1
1 958 . 16 1 1 A 84 84 PRO C C 122 175.199 176.717 -1.518 1
1 959 . 16 1 1 A 84 84 PRO CA C 122 63.373 64.529 -1.156 1
1 960 . 16 1 1 A 84 84 PRO CB C 122 30.251 32.019 -1.768 1
1 962 . 16 1 1 A 85 85 PHE H H 123 6.652 6.855 -0.203 1
1 963 . 16 1 1 A 85 85 PHE HA H 123 4.744 4.740 0.004 1
1 971 . 16 1 1 A 85 85 PHE C C 123 170.340 172.553 -2.213 1
1 972 . 16 1 1 A 85 85 PHE CA C 123 53.999 56.573 -2.574 1
1 973 . 16 1 1 A 85 85 PHE CB C 123 39.000 40.168 -1.168 1
1 974 . 16 1 1 A 85 85 PHE N N 123 108.468 112.205 -3.737 1
1 975 . 16 1 1 A 86 86 ASP H H 124 9.268 8.785 0.483 1
1 976 . 16 1 1 A 86 86 ASP HA H 124 5.108 5.482 -0.374 1
1 979 . 16 1 1 A 86 86 ASP C C 124 171.180 174.434 -3.254 1
1 980 . 16 1 1 A 86 86 ASP CA C 124 50.249 53.638 -3.389 1
1 981 . 16 1 1 A 86 86 ASP CB C 124 40.250 43.092 -2.842 1
1 982 . 16 1 1 A 86 86 ASP N N 124 121.741 119.321 2.420 1
1 983 . 16 1 1 A 87 87 LEU H H 125 8.018 9.684 -1.666 1
1 984 . 16 1 1 A 87 87 LEU HA H 125 5.809 5.553 0.256 1
1 994 . 16 1 1 A 87 87 LEU C C 125 171.350 175.173 -3.823 1
1 995 . 16 1 1 A 87 87 LEU CA C 125 50.874 53.690 -2.816 1
1 996 . 16 1 1 A 87 87 LEU CB C 125 44.318 44.511 -0.193 1
1 999 . 16 1 1 A 87 87 LEU N N 125 123.629 127.542 -3.913 1
1 1000 . 16 1 1 A 88 88 TYR H H 126 8.912 8.444 0.468 1
1 1001 . 16 1 1 A 88 88 TYR HA H 126 5.630 5.603 0.027 1
1 1008 . 16 1 1 A 88 88 TYR C C 126 171.410 172.702 -1.292 1
1 1009 . 16 1 1 A 88 88 TYR CA C 126 52.749 56.578 -3.829 1
1 1010 . 16 1 1 A 88 88 TYR CB C 126 37.750 40.428 -2.678 1
1 1011 . 16 1 1 A 88 88 TYR N N 126 119.697 121.772 -2.075 1
1 1012 . 16 1 1 A 89 89 SER H H 127 9.319 9.271 0.048 1
1 1013 . 16 1 1 A 89 89 SER HA H 127 5.429 4.966 0.463 1
1 1016 . 16 1 1 A 89 89 SER CA C 127 52.124 57.251 -5.127 1
1 1017 . 16 1 1 A 89 89 SER CB C 127 62.748 66.064 -3.316 1
1 1018 . 16 1 1 A 89 89 SER N N 127 112.637 116.597 -3.960 1
1 1019 . 16 1 1 A 90 90 LEU H H 128 8.759 8.524 0.235 1
1 1020 . 16 1 1 A 90 90 LEU HA H 128 4.186 4.523 -0.337 1
1 1030 . 16 1 1 A 90 90 LEU C C 128 175.121 178.168 -3.047 1
1 1031 . 16 1 1 A 90 90 LEU CA C 128 52.749 55.291 -2.542 1
1 1032 . 16 1 1 A 90 90 LEU CB C 128 35.875 42.020 -6.145 1
1 1033 . 16 1 1 A 90 90 LEU N N 128 126.728 124.353 2.375 1
1 1034 . 16 1 1 A 91 91 GLY H H 129 8.356 7.966 0.390 1
1 1035 . 16 1 1 A 91 91 GLY HA2 H 129 3.373 3.793 -0.420 1
1 1036 . 16 1 1 A 91 91 GLY HA3 H 129 3.373 3.880 -0.507 1
1 1037 . 16 1 1 A 91 91 GLY C C 129 172.013 174.378 -2.365 1
1 1038 . 16 1 1 A 91 91 GLY CA C 129 41.500 44.177 -2.677 1
1 1039 . 16 1 1 A 91 91 GLY N N 129 108.559 109.049 -0.490 1
1 1040 . 16 1 1 A 92 92 ALA H H 130 7.047 8.085 -1.038 1
1 1041 . 16 1 1 A 92 92 ALA HA H 130 4.037 2.545 1.492 1
1 1045 . 16 1 1 A 92 92 ALA C C 130 174.890 177.941 -3.051 1
1 1046 . 16 1 1 A 92 92 ALA CA C 130 52.100 53.732 -1.632 1
1 1047 . 16 1 1 A 92 92 ALA CB C 130 16.502 17.714 -1.212 1
1 1048 . 16 1 1 A 92 92 ALA N N 130 118.393 121.620 -3.227 1
1 1049 . 16 1 1 A 93 93 ASP H H 131 7.222 7.638 -0.416 1
1 1050 . 16 1 1 A 93 93 ASP HA H 131 4.122 4.675 -0.553 1
1 1053 . 16 1 1 A 93 93 ASP C C 131 174.890 176.351 -1.461 1
1 1054 . 16 1 1 A 93 93 ASP CA C 131 50.249 53.758 -3.509 1
1 1055 . 16 1 1 A 93 93 ASP CB C 131 37.750 41.385 -3.635 1
1 1056 . 16 1 1 A 93 93 ASP N N 131 111.487 116.007 -4.520 1
1 1057 . 16 1 1 A 94 94 GLY H H 132 7.199 8.816 -1.617 1
1 1058 . 16 1 1 A 94 94 GLY HA2 H 132 3.951 3.881 0.070 1
1 1059 . 16 1 1 A 94 94 GLY HA3 H 132 3.324 3.892 -0.568 1
1 1060 . 16 1 1 A 94 94 GLY C C 132 169.773 174.224 -4.451 1
1 1061 . 16 1 1 A 94 94 GLY CA C 132 44.625 46.038 -1.413 1
1 1062 . 16 1 1 A 94 94 GLY N N 132 106.932 108.487 -1.555 1
1 1063 . 16 1 1 A 95 95 LYS H H 133 7.215 7.620 -0.405 1
1 1064 . 16 1 1 A 95 95 LYS HA H 133 4.513 4.737 -0.224 1
1 1073 . 16 1 1 A 95 95 LYS C C 133 172.108 175.096 -2.988 1
1 1074 . 16 1 1 A 95 95 LYS CA C 133 51.512 54.619 -3.107 1
1 1075 . 16 1 1 A 95 95 LYS CB C 133 34.000 35.441 -1.441 1
1 1076 . 16 1 1 A 95 95 LYS N N 133 115.749 120.438 -4.689 1
1 1077 . 16 1 1 A 96 96 GLU H H 134 9.230 8.880 0.350 1
1 1078 . 16 1 1 A 96 96 GLU HA H 134 4.352 5.336 -0.984 1
1 1083 . 16 1 1 A 96 96 GLU C C 134 175.219 176.354 -1.135 1
1 1084 . 16 1 1 A 96 96 GLU CA C 134 55.874 56.048 -0.174 1
1 1085 . 16 1 1 A 96 96 GLU CB C 134 27.126 30.152 -3.026 1
1 1087 . 16 1 1 A 96 96 GLU N N 134 128.571 122.746 5.825 1
1 1088 . 16 1 1 A 97 97 GLY H H 135 10.677 8.410 2.267 1
1 1089 . 16 1 1 A 97 97 GLY HA2 H 135 4.037 4.327 -0.290 1
1 1090 . 16 1 1 A 97 97 GLY HA3 H 135 3.717 4.337 -0.620 1
1 1091 . 16 1 1 A 97 97 GLY C C 135 171.567 172.069 -0.502 1
1 1092 . 16 1 1 A 97 97 GLY CA C 135 41.500 45.075 -3.575 1
1 1093 . 16 1 1 A 97 97 GLY N N 135 117.011 110.736 6.275 1
1 1094 . 16 1 1 A 98 98 GLY H H 136 8.442 8.767 -0.325 1
1 1095 . 16 1 1 A 98 98 GLY HA2 H 136 4.195 4.226 -0.031 1
1 1096 . 16 1 1 A 98 98 GLY HA3 H 136 4.195 4.233 -0.038 1
1 1097 . 16 1 1 A 98 98 GLY C C 136 170.299 173.371 -3.072 1
1 1098 . 16 1 1 A 98 98 GLY CA C 136 40.875 44.814 -3.939 1
1 1099 . 16 1 1 A 98 98 GLY N N 136 109.494 107.615 1.879 1
1 1100 . 16 1 1 A 99 99 SER H H 137 8.701 8.664 0.037 1
1 1101 . 16 1 1 A 99 99 SER HA H 137 4.639 4.882 -0.243 1
1 1104 . 16 1 1 A 99 99 SER C C 137 170.630 173.741 -3.111 1
1 1105 . 16 1 1 A 99 99 SER CA C 137 54.624 57.531 -2.907 1
1 1106 . 16 1 1 A 99 99 SER CB C 137 62.748 66.766 -4.018 1
1 1107 . 16 1 1 A 99 99 SER N N 137 114.685 118.209 -3.524 1
1 1108 . 16 1 1 A 100 100 ASP H H 138 9.117 8.719 0.398 1
1 1109 . 16 1 1 A 100 100 ASP HA H 138 3.965 4.551 -0.586 1
1 1112 . 16 1 1 A 100 100 ASP C C 138 175.540 177.645 -2.105 1
1 1113 . 16 1 1 A 100 100 ASP CA C 138 54.624 55.995 -1.371 1
1 1114 . 16 1 1 A 100 100 ASP CB C 138 36.500 41.812 -5.312 1
1 1115 . 16 1 1 A 100 100 ASP N N 138 120.777 123.506 -2.729 1
1 1116 . 16 1 1 A 101 101 ASN H H 139 8.667 7.853 0.814 1
1 1117 . 16 1 1 A 101 101 ASN HA H 139 4.333 4.684 -0.351 1
1 1122 . 16 1 1 A 101 101 ASN CA C 139 53.999 55.529 -1.530 1
1 1123 . 16 1 1 A 101 101 ASN CB C 139 34.625 39.080 -4.455 1
1 1124 . 16 1 1 A 101 101 ASN N N 139 121.930 117.580 4.350 1
1 1126 . 16 1 1 A 102 102 ASP H H 140 7.714 7.605 0.109 1
1 1127 . 16 1 1 A 102 102 ASP HA H 140 4.037 4.469 -0.432 1
1 1130 . 16 1 1 A 102 102 ASP C C 140 172.807 175.901 -3.094 1
1 1131 . 16 1 1 A 102 102 ASP CA C 140 53.374 53.662 -0.288 1
1 1132 . 16 1 1 A 102 102 ASP CB C 140 37.125 40.885 -3.760 1
1 1133 . 16 1 1 A 102 102 ASP N N 140 118.011 117.201 0.810 1
1 1134 . 16 1 1 A 103 103 ALA H H 141 7.060 7.302 -0.242 1
1 1135 . 16 1 1 A 103 103 ALA HA H 141 3.353 4.534 -1.181 1
1 1139 . 16 1 1 A 103 103 ALA C C 141 172.233 177.210 -4.977 1
1 1140 . 16 1 1 A 103 103 ALA CA C 141 49.624 51.827 -2.203 1
1 1141 . 16 1 1 A 103 103 ALA CB C 141 16.502 19.944 -3.442 1
1 1142 . 16 1 1 A 103 103 ALA N N 141 125.777 121.724 4.053 1
1 1143 . 16 1 1 A 104 104 ASP H H 142 7.973 8.171 -0.198 1
1 1144 . 16 1 1 A 104 104 ASP HA H 142 4.420 5.111 -0.691 1
1 1147 . 16 1 1 A 104 104 ASP C C 142 174.188 176.148 -1.960 1
1 1148 . 16 1 1 A 104 104 ASP CA C 142 52.124 54.398 -2.274 1
1 1149 . 16 1 1 A 104 104 ASP CB C 142 37.125 41.456 -4.331 1
1 1150 . 16 1 1 A 104 104 ASP N N 142 122.965 120.239 2.726 1
1 1151 . 16 1 1 A 105 105 ILE H H 143 8.534 8.664 -0.130 1
1 1152 . 16 1 1 A 105 105 ILE HA H 143 4.060 4.828 -0.768 1
1 1162 . 16 1 1 A 105 105 ILE C C 143 173.235 176.110 -2.875 1
1 1163 . 16 1 1 A 105 105 ILE CA C 143 58.374 60.303 -1.929 1
1 1164 . 16 1 1 A 105 105 ILE CB C 143 39.123 39.445 -0.322 1
1 1167 . 16 1 1 A 105 105 ILE N N 143 124.757 121.196 3.561 1
1 1168 . 16 1 1 A 106 106 GLY H H 144 8.288 8.286 0.002 1
1 1169 . 16 1 1 A 106 106 GLY HA2 H 144 4.764 4.347 0.417 1
1 1170 . 16 1 1 A 106 106 GLY HA3 H 144 4.764 4.376 0.388 1
1 1171 . 16 1 1 A 106 106 GLY C C 144 171.321 171.718 -0.397 1
1 1172 . 16 1 1 A 106 106 GLY CA C 144 40.250 45.740 -5.490 1
1 1173 . 16 1 1 A 106 106 GLY N N 144 110.895 111.394 -0.499 1
1 1174 . 16 1 1 A 107 107 ASN H H 145 8.577 8.829 -0.252 1
1 1175 . 16 1 1 A 107 107 ASN HA H 145 4.268 5.120 -0.852 1
1 1180 . 16 1 1 A 107 107 ASN C C 145 171.757 173.677 -1.920 1
1 1181 . 16 1 1 A 107 107 ASN CA C 145 52.124 51.563 0.561 1
1 1182 . 16 1 1 A 107 107 ASN CB C 145 34.625 41.950 -7.325 1
1 1183 . 16 1 1 A 107 107 ASN N N 145 118.042 115.920 2.122 1
1 1185 . 16 1 1 A 108 108 TRP H H 146 6.822 8.499 -1.677 1
1 1186 . 16 1 1 A 108 108 TRP HA H 146 4.513 5.207 -0.694 1
1 1195 . 16 1 1 A 108 108 TRP C C 146 172.665 172.144 0.521 1
1 1196 . 16 1 1 A 108 108 TRP CA C 146 54.624 55.636 -1.012 1
1 1197 . 16 1 1 A 108 108 TRP CB C 146 25.876 31.287 -5.411 1
1 1198 . 16 1 1 A 108 108 TRP N N 146 116.756 117.973 -1.217 1
1 1200 . 16 1 1 A 109 109 ASP H H 147 7.344 7.329 0.015 1
1 1201 . 16 1 1 A 109 109 ASP HA H 147 4.655 5.257 -0.602 1
1 1204 . 16 1 1 A 109 109 ASP C C 147 172.193 174.565 -2.372 1
1 1205 . 16 1 1 A 109 109 ASP CA C 147 51.499 52.504 -1.005 1
1 1206 . 16 1 1 A 109 109 ASP CB C 147 39.000 43.115 -4.115 1
1 1207 . 16 1 1 A 109 109 ASP N N 147 121.461 120.017 1.444 1
1 11 . 17 1 1 A 2 2 SER H H 40 8.461 8.898 -0.437 1
1 12 . 17 1 1 A 2 2 SER HA H 40 4.286 5.027 -0.741 1
1 15 . 17 1 1 A 2 2 SER C C 40 171.276 173.605 -2.329 1
1 16 . 17 1 1 A 2 2 SER CA C 40 55.249 57.949 -2.700 1
1 17 . 17 1 1 A 2 2 SER CB C 40 61.498 62.515 -1.017 1
1 18 . 17 1 1 A 2 2 SER N N 40 118.344 122.427 -4.083 1
1 19 . 17 1 1 A 3 3 ARG H H 41 8.469 8.377 0.092 1
1 20 . 17 1 1 A 3 3 ARG HA H 41 4.400 4.881 -0.481 1
1 25 . 17 1 1 A 3 3 ARG C C 41 172.251 173.421 -1.170 1
1 26 . 17 1 1 A 3 3 ARG CA C 41 52.749 52.866 -0.117 1
1 27 . 17 1 1 A 3 3 ARG CB C 41 27.126 33.392 -6.266 1
1 28 . 17 1 1 A 3 3 ARG N N 41 123.070 124.107 -1.037 1
1 33 . 17 1 1 A 4 4 PRO CA C 42 61.498 63.784 -2.286 1
1 34 . 17 1 1 A 4 4 PRO CB C 42 29.001 31.832 -2.831 1
1 37 . 17 1 1 A 5 5 ASP H H 43 8.246 8.933 -0.687 1
1 38 . 17 1 1 A 5 5 ASP HA H 43 4.329 4.329 0.000 1
1 41 . 17 1 1 A 5 5 ASP C C 43 174.605 176.378 -1.773 1
1 42 . 17 1 1 A 5 5 ASP CA C 43 53.374 56.432 -3.058 1
1 43 . 17 1 1 A 5 5 ASP CB C 43 38.375 38.546 -0.171 1
1 44 . 17 1 1 A 5 5 ASP N N 43 119.409 116.806 2.603 1
1 45 . 17 1 1 A 6 6 GLN H H 44 8.309 8.366 -0.057 1
1 46 . 17 1 1 A 6 6 GLN HA H 44 4.393 4.285 0.108 1
1 53 . 17 1 1 A 6 6 GLN C C 44 175.053 178.499 -3.446 1
1 54 . 17 1 1 A 6 6 GLN CA C 44 55.874 57.937 -2.063 1
1 55 . 17 1 1 A 6 6 GLN CB C 44 25.876 28.109 -2.233 1
1 57 . 17 1 1 A 6 6 GLN N N 44 122.273 118.136 4.137 1
1 59 . 17 1 1 A 7 7 ALA H H 45 8.106 8.014 0.092 1
1 60 . 17 1 1 A 7 7 ALA HA H 45 3.993 4.025 -0.032 1
1 64 . 17 1 1 A 7 7 ALA C C 45 177.465 179.483 -2.018 1
1 65 . 17 1 1 A 7 7 ALA CA C 45 52.124 54.941 -2.817 1
1 66 . 17 1 1 A 7 7 ALA CB C 45 15.252 18.322 -3.070 1
1 67 . 17 1 1 A 7 7 ALA N N 45 122.204 121.769 0.435 1
1 68 . 17 1 1 A 8 8 LYS H H 46 7.527 7.958 -0.431 1
1 69 . 17 1 1 A 8 8 LYS HA H 46 3.539 3.995 -0.456 1
1 78 . 17 1 1 A 8 8 LYS C C 46 175.412 178.570 -3.158 1
1 79 . 17 1 1 A 8 8 LYS CA C 46 57.124 58.480 -1.356 1
1 80 . 17 1 1 A 8 8 LYS CB C 46 30.876 32.170 -1.294 1
1 83 . 17 1 1 A 8 8 LYS N N 46 117.358 116.193 1.165 1
1 84 . 17 1 1 A 9 9 VAL H H 47 7.709 8.021 -0.312 1
1 85 . 17 1 1 A 9 9 VAL HA H 47 3.578 3.801 -0.223 1
1 93 . 17 1 1 A 9 9 VAL C C 47 175.005 178.275 -3.270 1
1 94 . 17 1 1 A 9 9 VAL CA C 47 64.623 66.153 -1.530 1
1 95 . 17 1 1 A 9 9 VAL CB C 47 29.001 31.823 -2.822 1
1 98 . 17 1 1 A 9 9 VAL N N 47 119.115 120.328 -1.213 1
1 99 . 17 1 1 A 10 10 THR H H 48 7.767 8.505 -0.738 1
1 100 . 17 1 1 A 10 10 THR HA H 48 3.668 3.988 -0.320 1
1 105 . 17 1 1 A 10 10 THR CA C 48 63.998 66.266 -2.268 1
1 106 . 17 1 1 A 10 10 THR CB C 48 67.123 68.738 -1.615 1
1 108 . 17 1 1 A 10 10 THR N N 48 115.112 113.959 1.153 1
1 109 . 17 1 1 A 11 11 VAL H H 49 7.598 8.179 -0.581 1
1 110 . 17 1 1 A 11 11 VAL HA H 49 3.457 3.527 -0.070 1
1 118 . 17 1 1 A 11 11 VAL C C 49 175.412 177.973 -2.561 1
1 119 . 17 1 1 A 11 11 VAL CA C 49 63.998 66.182 -2.184 1
1 120 . 17 1 1 A 11 11 VAL CB C 49 29.001 31.480 -2.479 1
1 123 . 17 1 1 A 11 11 VAL N N 49 123.694 121.486 2.208 1
1 124 . 17 1 1 A 12 12 ALA H H 50 8.176 7.966 0.210 1
1 125 . 17 1 1 A 12 12 ALA HA H 50 4.742 4.101 0.641 1
1 129 . 17 1 1 A 12 12 ALA C C 50 177.074 179.766 -2.692 1
1 130 . 17 1 1 A 12 12 ALA CA C 50 52.124 55.645 -3.521 1
1 131 . 17 1 1 A 12 12 ALA CB C 50 15.252 18.311 -3.059 1
1 132 . 17 1 1 A 12 12 ALA N N 50 122.348 121.726 0.622 1
1 133 . 17 1 1 A 13 13 LYS H H 51 8.499 8.116 0.383 1
1 134 . 17 1 1 A 13 13 LYS HA H 51 3.648 4.061 -0.413 1
1 143 . 17 1 1 A 13 13 LYS C C 51 177.252 179.715 -2.463 1
1 144 . 17 1 1 A 13 13 LYS CA C 51 58.072 59.454 -1.382 1
1 145 . 17 1 1 A 13 13 LYS CB C 51 30.251 32.248 -1.997 1
1 146 . 17 1 1 A 13 13 LYS N N 51 115.402 116.061 -0.659 1
1 147 . 17 1 1 A 14 14 GLY H H 52 7.858 8.035 -0.177 1
1 148 . 17 1 1 A 14 14 GLY HA2 H 52 3.823 3.908 -0.085 1
1 149 . 17 1 1 A 14 14 GLY HA3 H 52 3.676 3.909 -0.233 1
1 150 . 17 1 1 A 14 14 GLY C C 52 174.090 175.381 -1.291 1
1 151 . 17 1 1 A 14 14 GLY CA C 52 44.625 46.548 -1.923 1
1 152 . 17 1 1 A 14 14 GLY N N 52 107.466 108.676 -1.210 1
1 153 . 17 1 1 A 15 15 ASP H H 53 8.403 7.877 0.526 1
1 154 . 17 1 1 A 15 15 ASP HA H 53 4.191 4.508 -0.317 1
1 157 . 17 1 1 A 15 15 ASP C C 53 175.316 178.751 -3.435 1
1 158 . 17 1 1 A 15 15 ASP CA C 53 54.624 56.408 -1.784 1
1 159 . 17 1 1 A 15 15 ASP CB C 53 35.875 40.870 -4.995 1
1 160 . 17 1 1 A 15 15 ASP N N 53 125.929 120.746 5.183 1
1 161 . 17 1 1 A 16 16 ILE H H 54 8.245 8.054 0.191 1
1 162 . 17 1 1 A 16 16 ILE HA H 54 3.034 3.797 -0.763 1
1 172 . 17 1 1 A 16 16 ILE C C 54 174.499 177.744 -3.245 1
1 173 . 17 1 1 A 16 16 ILE CA C 54 62.748 64.121 -1.373 1
1 174 . 17 1 1 A 16 16 ILE CB C 54 34.625 37.179 -2.554 1
1 178 . 17 1 1 A 16 16 ILE N N 54 119.456 116.035 3.421 1
1 179 . 17 1 1 A 17 17 LYS H H 55 7.547 8.204 -0.657 1
1 180 . 17 1 1 A 17 17 LYS HA H 55 3.843 4.095 -0.252 1
1 187 . 17 1 1 A 17 17 LYS C C 55 176.651 178.847 -2.196 1
1 188 . 17 1 1 A 17 17 LYS CA C 55 57.124 58.737 -1.613 1
1 189 . 17 1 1 A 17 17 LYS CB C 55 30.251 31.760 -1.509 1
1 190 . 17 1 1 A 17 17 LYS N N 55 118.505 121.014 -2.509 1
1 191 . 17 1 1 A 18 18 ALA H H 56 7.680 7.907 -0.227 1
1 192 . 17 1 1 A 18 18 ALA HA H 56 4.029 4.066 -0.037 1
1 196 . 17 1 1 A 18 18 ALA C C 56 176.638 179.867 -3.229 1
1 197 . 17 1 1 A 18 18 ALA CA C 56 52.749 54.701 -1.952 1
1 198 . 17 1 1 A 18 18 ALA CB C 56 15.877 18.425 -2.548 1
1 199 . 17 1 1 A 18 18 ALA N N 56 122.477 122.172 0.305 1
1 200 . 17 1 1 A 19 19 ILE H H 57 8.853 7.659 1.194 1
1 201 . 17 1 1 A 19 19 ILE HA H 57 3.304 3.624 -0.320 1
1 211 . 17 1 1 A 19 19 ILE C C 57 174.710 177.909 -3.199 1
1 212 . 17 1 1 A 19 19 ILE CA C 57 63.373 65.452 -2.079 1
1 213 . 17 1 1 A 19 19 ILE CB C 57 35.250 37.487 -2.237 1
1 217 . 17 1 1 A 19 19 ILE N N 57 120.901 118.676 2.225 1
1 218 . 17 1 1 A 20 20 ALA H H 58 8.702 8.269 0.433 1
1 219 . 17 1 1 A 20 20 ALA HA H 58 3.900 4.138 -0.238 1
1 223 . 17 1 1 A 20 20 ALA C C 58 176.512 179.993 -3.481 1
1 224 . 17 1 1 A 20 20 ALA CA C 58 52.749 55.662 -2.913 1
1 225 . 17 1 1 A 20 20 ALA CB C 58 15.252 18.073 -2.821 1
1 226 . 17 1 1 A 20 20 ALA N N 58 121.763 122.951 -1.188 1
1 227 . 17 1 1 A 21 21 ALA H H 59 7.662 7.716 -0.054 1
1 228 . 17 1 1 A 21 21 ALA HA H 59 4.136 4.214 -0.078 1
1 232 . 17 1 1 A 21 21 ALA C C 59 177.949 179.312 -1.363 1
1 233 . 17 1 1 A 21 21 ALA CA C 59 52.749 54.633 -1.884 1
1 234 . 17 1 1 A 21 21 ALA CB C 59 15.252 18.439 -3.187 1
1 235 . 17 1 1 A 21 21 ALA N N 59 119.079 119.431 -0.352 1
1 236 . 17 1 1 A 22 22 ALA H H 60 7.403 7.588 -0.185 1
1 237 . 17 1 1 A 22 22 ALA HA H 60 4.318 4.280 0.038 1
1 241 . 17 1 1 A 22 22 ALA C C 60 176.730 180.057 -3.327 1
1 242 . 17 1 1 A 22 22 ALA CA C 60 52.749 54.290 -1.541 1
1 243 . 17 1 1 A 22 22 ALA CB C 60 17.126 18.818 -1.692 1
1 244 . 17 1 1 A 22 22 ALA N N 60 122.616 120.048 2.568 1
1 245 . 17 1 1 A 23 23 LEU H H 61 8.410 8.768 -0.358 1
1 246 . 17 1 1 A 23 23 LEU HA H 61 3.527 3.945 -0.418 1
1 256 . 17 1 1 A 23 23 LEU C C 61 176.057 178.490 -2.433 1
1 257 . 17 1 1 A 23 23 LEU CA C 61 55.249 57.036 -1.787 1
1 258 . 17 1 1 A 23 23 LEU CB C 61 39.000 40.977 -1.977 1
1 262 . 17 1 1 A 23 23 LEU N N 61 120.761 121.111 -0.350 1
1 263 . 17 1 1 A 24 24 ASP H H 62 8.227 8.065 0.162 1
1 264 . 17 1 1 A 24 24 ASP HA H 62 4.581 4.485 0.096 1
1 267 . 17 1 1 A 24 24 ASP C C 62 176.968 178.493 -1.525 1
1 268 . 17 1 1 A 24 24 ASP CA C 62 55.874 57.362 -1.488 1
1 269 . 17 1 1 A 24 24 ASP CB C 62 37.750 41.391 -3.641 1
1 270 . 17 1 1 A 24 24 ASP N N 62 119.068 119.163 -0.095 1
1 271 . 17 1 1 A 25 25 MET H H 63 7.718 8.091 -0.373 1
1 272 . 17 1 1 A 25 25 MET HA H 63 4.196 4.246 -0.050 1
1 277 . 17 1 1 A 25 25 MET C C 63 174.968 177.838 -2.870 1
1 278 . 17 1 1 A 25 25 MET CA C 63 55.249 58.253 -3.004 1
1 279 . 17 1 1 A 25 25 MET CB C 63 29.626 32.029 -2.403 1
1 281 . 17 1 1 A 25 25 MET N N 63 121.365 117.161 4.204 1
1 282 . 17 1 1 A 26 26 TYR H H 64 8.401 7.697 0.704 1
1 283 . 17 1 1 A 26 26 TYR HA H 64 4.400 3.600 0.800 1
1 291 . 17 1 1 A 26 26 TYR C C 64 176.098 177.837 -1.739 1
1 292 . 17 1 1 A 26 26 TYR CA C 64 58.999 61.015 -2.016 1
1 293 . 17 1 1 A 26 26 TYR CB C 64 35.250 38.070 -2.820 1
1 294 . 17 1 1 A 26 26 TYR N N 64 122.575 121.759 0.816 1
1 295 . 17 1 1 A 27 27 LYS H H 65 8.330 8.415 -0.085 1
1 296 . 17 1 1 A 27 27 LYS HA H 65 3.568 4.314 -0.746 1
1 302 . 17 1 1 A 27 27 LYS C C 65 176.156 178.198 -2.042 1
1 303 . 17 1 1 A 27 27 LYS CA C 65 56.499 58.398 -1.899 1
1 304 . 17 1 1 A 27 27 LYS CB C 65 29.626 31.026 -1.400 1
1 306 . 17 1 1 A 27 27 LYS N N 65 121.390 118.130 3.260 1
1 307 . 17 1 1 A 28 28 LEU H H 66 7.833 7.293 0.540 1
1 308 . 17 1 1 A 28 28 LEU HA H 66 3.769 4.061 -0.292 1
1 318 . 17 1 1 A 28 28 LEU C C 66 175.925 178.021 -2.096 1
1 319 . 17 1 1 A 28 28 LEU CA C 66 55.874 56.829 -0.955 1
1 320 . 17 1 1 A 28 28 LEU CB C 66 38.375 42.571 -4.196 1
1 324 . 17 1 1 A 28 28 LEU N N 66 123.068 121.238 1.830 1
1 325 . 17 1 1 A 29 29 ASP H H 67 7.292 7.942 -0.650 1
1 326 . 17 1 1 A 29 29 ASP HA H 67 4.096 4.344 -0.248 1
1 329 . 17 1 1 A 29 29 ASP C C 67 174.618 176.850 -2.232 1
1 330 . 17 1 1 A 29 29 ASP CA C 67 53.999 56.373 -2.374 1
1 331 . 17 1 1 A 29 29 ASP CB C 67 38.375 40.842 -2.467 1
1 332 . 17 1 1 A 29 29 ASP N N 67 114.729 118.680 -3.951 1
1 333 . 17 1 1 A 30 30 ASN H H 68 8.097 7.638 0.459 1
1 334 . 17 1 1 A 30 30 ASN HA H 68 4.337 4.318 0.019 1
1 339 . 17 1 1 A 30 30 ASN C C 68 172.822 174.385 -1.563 1
1 340 . 17 1 1 A 30 30 ASN CA C 68 52.124 51.378 0.746 1
1 341 . 17 1 1 A 30 30 ASN CB C 68 37.750 38.261 -0.511 1
1 342 . 17 1 1 A 30 30 ASN N N 68 111.054 115.548 -4.494 1
1 344 . 17 1 1 A 31 31 PHE H H 69 8.249 7.896 0.353 1
1 345 . 17 1 1 A 31 31 PHE HA H 69 4.135 4.338 -0.203 1
1 353 . 17 1 1 A 31 31 PHE C C 69 170.485 174.162 -3.677 1
1 354 . 17 1 1 A 31 31 PHE CA C 69 57.749 58.716 -0.967 1
1 355 . 17 1 1 A 31 31 PHE CB C 69 33.375 36.561 -3.186 1
1 356 . 17 1 1 A 31 31 PHE N N 69 116.277 119.221 -2.944 1
1 357 . 17 1 1 A 32 32 ALA H H 70 7.224 7.029 0.195 1
1 358 . 17 1 1 A 32 32 ALA HA H 70 4.194 4.554 -0.360 1
1 362 . 17 1 1 A 32 32 ALA C C 70 173.337 175.047 -1.710 1
1 363 . 17 1 1 A 32 32 ALA CA C 70 48.374 51.606 -3.232 1
1 364 . 17 1 1 A 32 32 ALA CB C 70 19.626 22.370 -2.744 1
1 365 . 17 1 1 A 32 32 ALA N N 70 119.914 120.285 -0.371 1
1 366 . 17 1 1 A 33 33 TYR H H 71 7.948 8.444 -0.496 1
1 367 . 17 1 1 A 33 33 TYR HA H 71 4.209 5.026 -0.817 1
1 374 . 17 1 1 A 33 33 TYR C C 71 170.591 174.209 -3.618 1
1 375 . 17 1 1 A 33 33 TYR CA C 71 54.624 56.458 -1.834 1
1 376 . 17 1 1 A 33 33 TYR CB C 71 34.000 37.639 -3.639 1
1 377 . 17 1 1 A 33 33 TYR N N 71 116.929 118.260 -1.331 1
1 378 . 17 1 1 A 34 34 PRO HA H 72 4.444 4.803 -0.359 1
1 381 . 17 1 1 A 34 34 PRO C C 72 174.775 176.360 -1.585 1
1 382 . 17 1 1 A 34 34 PRO CA C 72 59.624 62.466 -2.842 1
1 383 . 17 1 1 A 34 34 PRO CB C 72 28.376 32.371 -3.995 1
1 384 . 17 1 1 A 35 35 SER H H 73 8.721 8.481 0.240 1
1 385 . 17 1 1 A 35 35 SER HA H 73 4.467 4.813 -0.346 1
1 388 . 17 1 1 A 35 35 SER C C 73 173.271 175.721 -2.450 1
1 389 . 17 1 1 A 35 35 SER CA C 73 55.249 56.559 -1.310 1
1 390 . 17 1 1 A 35 35 SER CB C 73 63.373 66.133 -2.760 1
1 391 . 17 1 1 A 35 35 SER N N 73 118.284 114.155 4.129 1
1 392 . 17 1 1 A 36 36 THR H H 74 8.591 8.987 -0.396 1
1 393 . 17 1 1 A 36 36 THR HA H 74 3.649 4.153 -0.504 1
1 398 . 17 1 1 A 36 36 THR CA C 74 64.623 64.652 -0.029 1
1 399 . 17 1 1 A 36 36 THR CB C 74 66.498 68.787 -2.289 1
1 401 . 17 1 1 A 36 36 THR N N 74 117.769 116.500 1.269 1
1 402 . 17 1 1 A 37 37 GLN H H 75 8.210 7.876 0.334 1
1 403 . 17 1 1 A 37 37 GLN HA H 75 3.860 4.469 -0.609 1
1 410 . 17 1 1 A 37 37 GLN C C 75 175.349 177.646 -2.297 1
1 411 . 17 1 1 A 37 37 GLN CA C 75 56.499 57.575 -1.076 1
1 412 . 17 1 1 A 37 37 GLN CB C 75 25.876 29.707 -3.831 1
1 414 . 17 1 1 A 37 37 GLN N N 75 117.931 120.081 -2.150 1
1 416 . 17 1 1 A 38 38 GLN H H 76 7.667 8.205 -0.538 1
1 417 . 17 1 1 A 38 38 GLN HA H 76 3.810 4.100 -0.290 1
1 424 . 17 1 1 A 38 38 GLN C C 76 175.805 179.193 -3.388 1
1 425 . 17 1 1 A 38 38 GLN CA C 76 55.874 58.628 -2.754 1
1 426 . 17 1 1 A 38 38 GLN CB C 76 25.876 28.325 -2.449 1
1 428 . 17 1 1 A 38 38 GLN N N 76 120.607 118.163 2.444 1
1 430 . 17 1 1 A 39 39 GLY H H 77 8.470 8.065 0.405 1
1 431 . 17 1 1 A 39 39 GLY HA2 H 77 3.920 3.829 0.091 1
1 432 . 17 1 1 A 39 39 GLY HA3 H 77 3.603 3.847 -0.244 1
1 433 . 17 1 1 A 39 39 GLY C C 77 169.006 175.444 -6.438 1
1 434 . 17 1 1 A 39 39 GLY CA C 77 42.125 46.090 -3.965 1
1 435 . 17 1 1 A 39 39 GLY N N 77 103.281 109.350 -6.069 1
1 436 . 17 1 1 A 40 40 LEU H H 78 8.135 7.916 0.219 1
1 437 . 17 1 1 A 40 40 LEU HA H 78 3.237 4.116 -0.879 1
1 447 . 17 1 1 A 40 40 LEU C C 78 176.383 178.767 -2.384 1
1 448 . 17 1 1 A 40 40 LEU CA C 78 52.749 57.052 -4.303 1
1 449 . 17 1 1 A 40 40 LEU CB C 78 39.000 41.472 -2.472 1
1 453 . 17 1 1 A 40 40 LEU N N 78 114.444 123.341 -8.897 1
1 454 . 17 1 1 A 41 41 GLU H H 79 8.578 8.319 0.259 1
1 455 . 17 1 1 A 41 41 GLU HA H 79 3.720 4.091 -0.371 1
1 460 . 17 1 1 A 41 41 GLU C C 79 175.093 177.854 -2.761 1
1 461 . 17 1 1 A 41 41 GLU CA C 79 57.124 59.170 -2.046 1
1 462 . 17 1 1 A 41 41 GLU CB C 79 26.501 29.074 -2.573 1
1 464 . 17 1 1 A 41 41 GLU N N 79 118.295 118.509 -0.214 1
1 465 . 17 1 1 A 42 42 ALA H H 80 7.227 7.560 -0.333 1
1 466 . 17 1 1 A 42 42 ALA HA H 80 4.437 4.718 -0.281 1
1 470 . 17 1 1 A 42 42 ALA C C 80 173.745 178.238 -4.493 1
1 471 . 17 1 1 A 42 42 ALA CA C 80 51.499 53.365 -1.866 1
1 472 . 17 1 1 A 42 42 ALA CB C 80 15.877 19.029 -3.152 1
1 473 . 17 1 1 A 42 42 ALA N N 80 119.751 121.983 -2.232 1
1 474 . 17 1 1 A 43 43 LEU H H 81 7.932 7.444 0.488 1
1 475 . 17 1 1 A 43 43 LEU HA H 81 4.369 4.245 0.124 1
1 485 . 17 1 1 A 43 43 LEU C C 81 174.788 177.985 -3.197 1
1 486 . 17 1 1 A 43 43 LEU CA C 81 53.374 55.729 -2.355 1
1 487 . 17 1 1 A 43 43 LEU CB C 81 39.625 42.358 -2.733 1
1 491 . 17 1 1 A 43 43 LEU N N 81 111.742 117.124 -5.382 1
1 492 . 17 1 1 A 44 44 VAL H H 82 7.886 7.268 0.618 1
1 493 . 17 1 1 A 44 44 VAL HA H 82 4.700 4.054 0.646 1
1 501 . 17 1 1 A 44 44 VAL C C 82 172.875 175.635 -2.760 1
1 502 . 17 1 1 A 44 44 VAL CA C 82 59.624 63.614 -3.990 1
1 503 . 17 1 1 A 44 44 VAL CB C 82 31.501 33.390 -1.889 1
1 506 . 17 1 1 A 44 44 VAL N N 82 113.604 116.311 -2.707 1
1 507 . 17 1 1 A 45 45 LYS H H 83 8.361 8.388 -0.027 1
1 508 . 17 1 1 A 45 45 LYS HA H 83 4.251 4.853 -0.602 1
1 515 . 17 1 1 A 45 45 LYS C C 83 171.053 175.773 -4.720 1
1 516 . 17 1 1 A 45 45 LYS CA C 83 52.749 54.101 -1.352 1
1 517 . 17 1 1 A 45 45 LYS CB C 83 33.375 35.217 -1.842 1
1 521 . 17 1 1 A 45 45 LYS N N 83 123.860 118.011 5.849 1
1 522 . 17 1 1 A 46 46 LYS H H 84 7.243 7.993 -0.750 1
1 523 . 17 1 1 A 46 46 LYS HA H 84 2.175 2.587 -0.412 1
1 532 . 17 1 1 A 46 46 LYS C C 84 172.123 174.698 -2.575 1
1 533 . 17 1 1 A 46 46 LYS CA C 84 52.749 53.767 -1.018 1
1 534 . 17 1 1 A 46 46 LYS CB C 84 29.626 32.468 -2.842 1
1 537 . 17 1 1 A 46 46 LYS N N 84 128.615 122.515 6.100 1
1 538 . 17 1 1 A 47 47 PRO HA H 85 4.470 4.307 0.163 1
1 541 . 17 1 1 A 47 47 PRO C C 85 173.754 176.716 -2.962 1
1 542 . 17 1 1 A 47 47 PRO CA C 85 60.874 63.094 -2.220 1
1 543 . 17 1 1 A 47 47 PRO CB C 85 30.876 31.900 -1.024 1
1 546 . 17 1 1 A 48 48 THR H H 86 8.306 8.360 -0.054 1
1 547 . 17 1 1 A 48 48 THR HA H 86 4.287 4.270 0.017 1
1 552 . 17 1 1 A 48 48 THR C C 86 173.070 174.149 -1.079 1
1 553 . 17 1 1 A 48 48 THR CA C 86 57.749 62.580 -4.831 1
1 554 . 17 1 1 A 48 48 THR CB C 86 67.748 68.691 -0.943 1
1 556 . 17 1 1 A 48 48 THR N N 86 109.564 113.545 -3.981 1
1 557 . 17 1 1 A 49 49 GLY H H 87 8.317 8.424 -0.107 1
1 558 . 17 1 1 A 49 49 GLY HA2 H 87 3.851 4.087 -0.236 1
1 559 . 17 1 1 A 49 49 GLY HA3 H 87 3.678 4.092 -0.414 1
1 560 . 17 1 1 A 49 49 GLY C C 87 169.693 172.586 -2.893 1
1 561 . 17 1 1 A 49 49 GLY CA C 87 42.125 44.175 -2.050 1
1 562 . 17 1 1 A 49 49 GLY N N 87 109.071 110.261 -1.190 1
1 563 . 17 1 1 A 50 50 ASN H H 88 8.301 8.381 -0.080 1
1 564 . 17 1 1 A 50 50 ASN HA H 88 4.780 5.466 -0.686 1
1 569 . 17 1 1 A 50 50 ASN C C 88 171.370 172.793 -1.423 1
1 570 . 17 1 1 A 50 50 ASN CA C 88 47.749 50.321 -2.572 1
1 571 . 17 1 1 A 50 50 ASN CB C 88 37.125 39.684 -2.559 1
1 572 . 17 1 1 A 50 50 ASN N N 88 115.631 119.999 -4.368 1
1 574 . 17 1 1 A 51 51 PRO HA H 89 4.782 4.605 0.177 1
1 577 . 17 1 1 A 51 51 PRO C C 89 173.656 176.768 -3.112 1
1 578 . 17 1 1 A 51 51 PRO CA C 89 59.624 62.468 -2.844 1
1 579 . 17 1 1 A 51 51 PRO CB C 89 31.501 32.336 -0.835 1
1 582 . 17 1 1 A 52 52 GLN H H 90 9.076 8.399 0.677 1
1 583 . 17 1 1 A 52 52 GLN HA H 90 4.469 4.583 -0.114 1
1 590 . 17 1 1 A 52 52 GLN C C 90 172.386 175.078 -2.692 1
1 591 . 17 1 1 A 52 52 GLN CA C 90 50.874 54.455 -3.581 1
1 592 . 17 1 1 A 52 52 GLN CB C 90 26.501 29.207 -2.706 1
1 594 . 17 1 1 A 52 52 GLN N N 90 126.827 119.213 7.614 1
1 596 . 17 1 1 A 53 53 PRO HA H 91 4.384 4.658 -0.274 1
1 599 . 17 1 1 A 53 53 PRO C C 91 174.274 175.263 -0.989 1
1 600 . 17 1 1 A 53 53 PRO CB C 91 28.113 31.368 -3.255 1
1 601 . 17 1 1 A 54 54 LYS H H 92 8.401 8.433 -0.032 1
1 602 . 17 1 1 A 54 54 LYS HA H 92 3.984 4.789 -0.805 1
1 611 . 17 1 1 A 54 54 LYS C C 92 173.516 174.740 -1.224 1
1 612 . 17 1 1 A 54 54 LYS CA C 92 55.249 55.426 -0.177 1
1 613 . 17 1 1 A 54 54 LYS CB C 92 30.876 36.163 -5.287 1
1 615 . 17 1 1 A 54 54 LYS N N 92 124.538 124.309 0.229 1
1 616 . 17 1 1 A 55 55 ASN H H 93 8.183 8.756 -0.573 1
1 617 . 17 1 1 A 55 55 ASN HA H 93 4.716 4.967 -0.251 1
1 622 . 17 1 1 A 55 55 ASN CA C 93 48.999 53.245 -4.246 1
1 623 . 17 1 1 A 55 55 ASN CB C 93 35.875 37.969 -2.094 1
1 624 . 17 1 1 A 55 55 ASN N N 93 118.677 122.696 -4.019 1
1 626 . 17 1 1 A 56 56 TRP H H 94 8.007 8.743 -0.736 1
1 627 . 17 1 1 A 56 56 TRP HA H 94 3.827 5.473 -1.646 1
1 635 . 17 1 1 A 56 56 TRP C C 94 173.760 175.424 -1.664 1
1 636 . 17 1 1 A 56 56 TRP CA C 94 59.624 58.864 0.760 1
1 637 . 17 1 1 A 56 56 TRP CB C 94 27.126 30.381 -3.255 1
1 638 . 17 1 1 A 56 56 TRP N N 94 122.195 128.003 -5.808 1
1 640 . 17 1 1 A 57 57 ASN H H 95 7.563 7.360 0.203 1
1 641 . 17 1 1 A 57 57 ASN HA H 95 3.735 4.726 -0.991 1
1 646 . 17 1 1 A 57 57 ASN C C 95 171.952 173.757 -1.805 1
1 647 . 17 1 1 A 57 57 ASN CA C 95 51.499 51.165 0.334 1
1 648 . 17 1 1 A 57 57 ASN CB C 95 35.250 41.396 -6.146 1
1 649 . 17 1 1 A 57 57 ASN N N 95 129.659 125.166 4.493 1
1 651 . 17 1 1 A 58 58 LYS H H 96 8.110 8.049 0.061 1
1 652 . 17 1 1 A 58 58 LYS HA H 96 4.035 4.150 -0.115 1
1 659 . 17 1 1 A 58 58 LYS C C 96 174.530 175.608 -1.078 1
1 660 . 17 1 1 A 58 58 LYS CA C 96 56.499 54.690 1.809 1
1 661 . 17 1 1 A 58 58 LYS CB C 96 29.626 32.992 -3.366 1
1 665 . 17 1 1 A 58 58 LYS N N 96 123.913 122.809 1.104 1
1 666 . 17 1 1 A 59 59 ASP H H 97 7.903 9.150 -1.247 1
1 667 . 17 1 1 A 59 59 ASP HA H 97 4.393 4.407 -0.014 1
1 670 . 17 1 1 A 59 59 ASP C C 97 173.724 175.462 -1.738 1
1 671 . 17 1 1 A 59 59 ASP CA C 97 52.124 55.143 -3.019 1
1 672 . 17 1 1 A 59 59 ASP CB C 97 38.375 39.848 -1.473 1
1 673 . 17 1 1 A 59 59 ASP N N 97 118.773 119.624 -0.851 1
1 674 . 17 1 1 A 60 60 GLY H H 98 7.819 7.957 -0.138 1
1 675 . 17 1 1 A 60 60 GLY HA2 H 98 3.917 3.760 0.157 1
1 676 . 17 1 1 A 60 60 GLY HA3 H 98 3.917 4.084 -0.167 1
1 677 . 17 1 1 A 60 60 GLY C C 98 168.652 174.416 -5.764 1
1 678 . 17 1 1 A 60 60 GLY CA C 98 41.500 45.008 -3.508 1
1 679 . 17 1 1 A 60 60 GLY N N 98 108.742 105.143 3.599 1
1 680 . 17 1 1 A 61 61 TYR H H 99 8.105 8.153 -0.048 1
1 681 . 17 1 1 A 61 61 TYR HA H 99 3.927 4.046 -0.119 1
1 689 . 17 1 1 A 61 61 TYR C C 99 172.831 174.184 -1.353 1
1 690 . 17 1 1 A 61 61 TYR CA C 99 57.124 58.352 -1.228 1
1 691 . 17 1 1 A 61 61 TYR CB C 99 37.125 36.375 0.750 1
1 692 . 17 1 1 A 61 61 TYR N N 99 113.836 115.838 -2.002 1
1 693 . 17 1 1 A 62 62 LEU H H 100 7.352 8.200 -0.848 1
1 694 . 17 1 1 A 62 62 LEU HA H 100 4.343 4.976 -0.633 1
1 704 . 17 1 1 A 62 62 LEU C C 100 173.430 175.402 -1.972 1
1 705 . 17 1 1 A 62 62 LEU CA C 100 50.874 53.479 -2.605 1
1 706 . 17 1 1 A 62 62 LEU CB C 100 44.000 45.580 -1.580 1
1 710 . 17 1 1 A 62 62 LEU N N 100 117.112 122.585 -5.473 1
1 711 . 17 1 1 A 63 63 LYS H H 101 8.626 8.347 0.279 1
1 712 . 17 1 1 A 63 63 LYS HA H 101 3.986 4.541 -0.555 1
1 721 . 17 1 1 A 63 63 LYS C C 101 173.851 176.970 -3.119 1
1 722 . 17 1 1 A 63 63 LYS CA C 101 55.249 55.179 0.070 1
1 723 . 17 1 1 A 63 63 LYS CB C 101 29.626 33.626 -4.000 1
1 724 . 17 1 1 A 63 63 LYS N N 101 129.991 121.638 8.353 1
1 725 . 17 1 1 A 64 64 LYS H H 102 7.059 8.459 -1.400 1
1 726 . 17 1 1 A 64 64 LYS HA H 102 4.138 4.261 -0.123 1
1 735 . 17 1 1 A 64 64 LYS C C 102 171.120 175.739 -4.619 1
1 736 . 17 1 1 A 64 64 LYS CA C 102 52.749 56.449 -3.700 1
1 737 . 17 1 1 A 64 64 LYS CB C 102 32.750 31.369 1.381 1
1 740 . 17 1 1 A 64 64 LYS N N 102 113.255 120.876 -7.621 1
1 741 . 17 1 1 A 65 65 LEU H H 103 8.883 8.053 0.830 1
1 742 . 17 1 1 A 65 65 LEU HA H 103 4.475 4.761 -0.286 1
1 752 . 17 1 1 A 65 65 LEU C C 103 171.487 174.241 -2.754 1
1 753 . 17 1 1 A 65 65 LEU CA C 103 48.999 51.150 -2.151 1
1 754 . 17 1 1 A 65 65 LEU CB C 103 39.625 45.171 -5.546 1
1 758 . 17 1 1 A 65 65 LEU N N 103 126.355 123.388 2.967 1
1 759 . 17 1 1 A 66 66 PRO HA H 104 4.449 4.626 -0.177 1
1 764 . 17 1 1 A 66 66 PRO C C 104 173.363 176.264 -2.901 1
1 765 . 17 1 1 A 66 66 PRO CA C 104 60.249 62.238 -1.989 1
1 766 . 17 1 1 A 66 66 PRO CB C 104 29.626 32.373 -2.747 1
1 769 . 17 1 1 A 67 67 VAL H H 105 7.682 8.333 -0.651 1
1 770 . 17 1 1 A 67 67 VAL HA H 105 4.121 4.274 -0.153 1
1 778 . 17 1 1 A 67 67 VAL C C 105 171.667 175.323 -3.656 1
1 779 . 17 1 1 A 67 67 VAL CA C 105 58.374 61.614 -3.240 1
1 780 . 17 1 1 A 67 67 VAL CB C 105 30.251 32.835 -2.584 1
1 783 . 17 1 1 A 67 67 VAL N N 105 114.671 121.397 -6.726 1
1 784 . 17 1 1 A 68 68 ASP H H 106 8.216 8.233 -0.017 1
1 785 . 17 1 1 A 68 68 ASP HA H 106 4.474 4.664 -0.190 1
1 788 . 17 1 1 A 68 68 ASP C C 106 172.452 174.151 -1.699 1
1 789 . 17 1 1 A 68 68 ASP CA C 106 50.249 52.767 -2.518 1
1 790 . 17 1 1 A 68 68 ASP CB C 106 37.750 39.699 -1.949 1
1 791 . 17 1 1 A 68 68 ASP N N 106 123.825 125.463 -1.638 1
1 792 . 17 1 1 A 69 69 PRO HA H 107 3.920 4.050 -0.130 1
1 797 . 17 1 1 A 69 69 PRO CA C 107 62.123 63.130 -1.007 1
1 798 . 17 1 1 A 69 69 PRO CB C 107 27.751 31.483 -3.732 1
1 801 . 17 1 1 A 70 70 TRP H H 108 8.156 8.338 -0.182 1
1 802 . 17 1 1 A 70 70 TRP HA H 108 4.274 4.286 -0.012 1
1 811 . 17 1 1 A 70 70 TRP CA C 108 57.124 58.493 -1.369 1
1 812 . 17 1 1 A 70 70 TRP CB C 108 25.251 26.934 -1.683 1
1 813 . 17 1 1 A 70 70 TRP N N 108 118.137 118.296 -0.159 1
1 815 . 17 1 1 A 71 71 GLY H H 109 8.209 8.725 -0.516 1
1 816 . 17 1 1 A 71 71 GLY HA2 H 109 4.030 3.877 0.153 1
1 817 . 17 1 1 A 71 71 GLY HA3 H 109 3.303 3.908 -0.605 1
1 818 . 17 1 1 A 71 71 GLY CA C 109 42.750 46.784 -4.034 1
1 819 . 17 1 1 A 71 71 GLY N N 109 107.495 105.399 2.096 1
1 820 . 17 1 1 A 72 72 ASN H H 110 8.116 8.034 0.082 1
1 821 . 17 1 1 A 72 72 ASN HA H 110 5.103 4.999 0.104 1
1 826 . 17 1 1 A 72 72 ASN CA C 110 48.374 50.116 -1.742 1
1 827 . 17 1 1 A 72 72 ASN CB C 110 36.500 39.080 -2.580 1
1 828 . 17 1 1 A 72 72 ASN N N 110 120.108 119.838 0.270 1
1 830 . 17 1 1 A 73 73 PRO HA H 111 4.397 4.384 0.013 1
1 835 . 17 1 1 A 73 73 PRO C C 111 176.229 176.365 -0.136 1
1 836 . 17 1 1 A 73 73 PRO CA C 111 60.249 62.434 -2.185 1
1 837 . 17 1 1 A 73 73 PRO CB C 111 29.001 31.808 -2.807 1
1 840 . 17 1 1 A 74 74 TYR H H 112 8.893 8.507 0.386 1
1 841 . 17 1 1 A 74 74 TYR HA H 112 4.064 4.791 -0.727 1
1 849 . 17 1 1 A 74 74 TYR C C 112 171.951 175.889 -3.938 1
1 850 . 17 1 1 A 74 74 TYR CA C 112 60.249 58.308 1.941 1
1 851 . 17 1 1 A 74 74 TYR CB C 112 36.500 39.365 -2.865 1
1 852 . 17 1 1 A 74 74 TYR N N 112 124.595 120.936 3.659 1
1 853 . 17 1 1 A 75 75 GLN H H 113 9.127 8.929 0.198 1
1 854 . 17 1 1 A 75 75 GLN HA H 113 4.019 4.297 -0.278 1
1 861 . 17 1 1 A 75 75 GLN C C 113 171.436 174.304 -2.868 1
1 862 . 17 1 1 A 75 75 GLN CA C 113 50.874 54.727 -3.853 1
1 863 . 17 1 1 A 75 75 GLN CB C 113 29.469 29.108 0.361 1
1 865 . 17 1 1 A 75 75 GLN N N 113 120.777 121.969 -1.192 1
1 867 . 17 1 1 A 76 76 TYR H H 114 7.906 8.231 -0.325 1
1 868 . 17 1 1 A 76 76 TYR HA H 114 5.586 5.595 -0.009 1
1 875 . 17 1 1 A 76 76 TYR C C 114 171.343 175.253 -3.910 1
1 876 . 17 1 1 A 76 76 TYR CA C 114 53.999 55.848 -1.849 1
1 877 . 17 1 1 A 76 76 TYR CB C 114 40.250 40.477 -0.227 1
1 878 . 17 1 1 A 76 76 TYR N N 114 120.757 122.618 -1.861 1
1 879 . 17 1 1 A 77 77 LEU H H 115 8.261 9.173 -0.912 1
1 880 . 17 1 1 A 77 77 LEU HA H 115 4.280 5.209 -0.929 1
1 890 . 17 1 1 A 77 77 LEU C C 115 170.921 175.972 -5.051 1
1 891 . 17 1 1 A 77 77 LEU CA C 115 51.499 53.641 -2.142 1
1 892 . 17 1 1 A 77 77 LEU CB C 115 44.625 45.573 -0.948 1
1 896 . 17 1 1 A 77 77 LEU N N 115 130.662 125.456 5.206 1
1 897 . 17 1 1 A 78 78 ALA H H 116 7.973 8.448 -0.475 1
1 898 . 17 1 1 A 78 78 ALA HA H 116 4.292 4.691 -0.399 1
1 902 . 17 1 1 A 78 78 ALA C C 116 172.093 175.114 -3.021 1
1 903 . 17 1 1 A 78 78 ALA CA C 116 47.749 50.067 -2.318 1
1 904 . 17 1 1 A 78 78 ALA CB C 116 19.626 20.346 -0.720 1
1 905 . 17 1 1 A 78 78 ALA N N 116 125.564 125.229 0.335 1
1 906 . 17 1 1 A 79 79 PRO HA H 117 4.698 5.310 -0.612 1
1 911 . 17 1 1 A 79 79 PRO C C 117 173.994 177.001 -3.007 1
1 912 . 17 1 1 A 79 79 PRO CA C 117 60.249 63.499 -3.250 1
1 913 . 17 1 1 A 79 79 PRO CB C 117 31.501 31.920 -0.419 1
1 916 . 17 1 1 A 80 80 GLY H H 118 7.096 8.449 -1.353 1
1 917 . 17 1 1 A 80 80 GLY HA2 H 118 3.797 3.901 -0.104 1
1 918 . 17 1 1 A 80 80 GLY HA3 H 118 3.517 3.955 -0.438 1
1 919 . 17 1 1 A 80 80 GLY C C 118 171.404 174.263 -2.859 1
1 920 . 17 1 1 A 80 80 GLY CA C 118 41.500 46.366 -4.866 1
1 921 . 17 1 1 A 80 80 GLY N N 118 108.306 108.666 -0.360 1
1 922 . 17 1 1 A 81 81 THR H H 119 9.810 8.013 1.797 1
1 923 . 17 1 1 A 81 81 THR HA H 119 4.091 4.547 -0.456 1
1 928 . 17 1 1 A 81 81 THR C C 119 174.242 175.221 -0.979 1
1 929 . 17 1 1 A 81 81 THR CA C 119 60.874 60.664 0.210 1
1 930 . 17 1 1 A 81 81 THR CB C 119 66.498 69.100 -2.602 1
1 932 . 17 1 1 A 81 81 THR N N 119 112.813 113.961 -1.148 1
1 933 . 17 1 1 A 82 82 LYS H H 120 8.964 8.360 0.604 1
1 934 . 17 1 1 A 82 82 LYS HA H 120 4.150 3.987 0.163 1
1 941 . 17 1 1 A 82 82 LYS C C 120 172.886 175.696 -2.810 1
1 942 . 17 1 1 A 82 82 LYS CA C 120 53.999 57.495 -3.496 1
1 943 . 17 1 1 A 82 82 LYS CB C 120 30.876 30.232 0.644 1
1 944 . 17 1 1 A 82 82 LYS N N 120 123.569 124.695 -1.126 1
1 945 . 17 1 1 A 83 83 GLY H H 121 7.125 8.010 -0.885 1
1 946 . 17 1 1 A 83 83 GLY HA2 H 121 3.814 4.014 -0.200 1
1 947 . 17 1 1 A 83 83 GLY HA3 H 121 3.814 4.070 -0.256 1
1 948 . 17 1 1 A 83 83 GLY C C 121 167.671 174.385 -6.714 1
1 949 . 17 1 1 A 83 83 GLY CA C 121 42.125 45.023 -2.898 1
1 950 . 17 1 1 A 83 83 GLY N N 121 107.253 108.331 -1.078 1
1 951 . 17 1 1 A 84 84 PRO HA H 122 4.077 4.370 -0.293 1
1 958 . 17 1 1 A 84 84 PRO C C 122 175.199 176.719 -1.520 1
1 959 . 17 1 1 A 84 84 PRO CA C 122 63.373 64.762 -1.389 1
1 960 . 17 1 1 A 84 84 PRO CB C 122 30.251 31.698 -1.447 1
1 962 . 17 1 1 A 85 85 PHE H H 123 6.652 6.678 -0.026 1
1 963 . 17 1 1 A 85 85 PHE HA H 123 4.744 4.839 -0.095 1
1 971 . 17 1 1 A 85 85 PHE C C 123 170.340 172.398 -2.058 1
1 972 . 17 1 1 A 85 85 PHE CA C 123 53.999 56.194 -2.195 1
1 973 . 17 1 1 A 85 85 PHE CB C 123 39.000 40.562 -1.562 1
1 974 . 17 1 1 A 85 85 PHE N N 123 108.468 112.097 -3.629 1
1 975 . 17 1 1 A 86 86 ASP H H 124 9.268 9.349 -0.081 1
1 976 . 17 1 1 A 86 86 ASP HA H 124 5.108 5.320 -0.212 1
1 979 . 17 1 1 A 86 86 ASP C C 124 171.180 174.604 -3.424 1
1 980 . 17 1 1 A 86 86 ASP CA C 124 50.249 53.484 -3.235 1
1 981 . 17 1 1 A 86 86 ASP CB C 124 40.250 42.927 -2.677 1
1 982 . 17 1 1 A 86 86 ASP N N 124 121.741 119.437 2.304 1
1 983 . 17 1 1 A 87 87 LEU H H 125 8.018 9.828 -1.810 1
1 984 . 17 1 1 A 87 87 LEU HA H 125 5.809 5.520 0.289 1
1 994 . 17 1 1 A 87 87 LEU C C 125 171.350 175.076 -3.726 1
1 995 . 17 1 1 A 87 87 LEU CA C 125 50.874 53.632 -2.758 1
1 996 . 17 1 1 A 87 87 LEU CB C 125 44.318 44.912 -0.594 1
1 999 . 17 1 1 A 87 87 LEU N N 125 123.629 127.493 -3.864 1
1 1000 . 17 1 1 A 88 88 TYR H H 126 8.912 8.448 0.464 1
1 1001 . 17 1 1 A 88 88 TYR HA H 126 5.630 5.676 -0.046 1
1 1008 . 17 1 1 A 88 88 TYR C C 126 171.410 172.228 -0.818 1
1 1009 . 17 1 1 A 88 88 TYR CA C 126 52.749 56.570 -3.821 1
1 1010 . 17 1 1 A 88 88 TYR CB C 126 37.750 40.586 -2.836 1
1 1011 . 17 1 1 A 88 88 TYR N N 126 119.697 121.736 -2.039 1
1 1012 . 17 1 1 A 89 89 SER H H 127 9.319 9.045 0.274 1
1 1013 . 17 1 1 A 89 89 SER HA H 127 5.429 5.294 0.135 1
1 1016 . 17 1 1 A 89 89 SER CA C 127 52.124 56.543 -4.419 1
1 1017 . 17 1 1 A 89 89 SER CB C 127 62.748 66.240 -3.492 1
1 1018 . 17 1 1 A 89 89 SER N N 127 112.637 115.771 -3.134 1
1 1019 . 17 1 1 A 90 90 LEU H H 128 8.759 8.530 0.229 1
1 1020 . 17 1 1 A 90 90 LEU HA H 128 4.186 4.400 -0.214 1
1 1030 . 17 1 1 A 90 90 LEU C C 128 175.121 177.937 -2.816 1
1 1031 . 17 1 1 A 90 90 LEU CA C 128 52.749 55.178 -2.429 1
1 1032 . 17 1 1 A 90 90 LEU CB C 128 35.875 42.323 -6.448 1
1 1033 . 17 1 1 A 90 90 LEU N N 128 126.728 126.722 0.006 1
1 1034 . 17 1 1 A 91 91 GLY H H 129 8.356 7.888 0.468 1
1 1035 . 17 1 1 A 91 91 GLY HA2 H 129 3.373 3.300 0.073 1
1 1036 . 17 1 1 A 91 91 GLY HA3 H 129 3.373 3.723 -0.350 1
1 1037 . 17 1 1 A 91 91 GLY C C 129 172.013 174.211 -2.198 1
1 1038 . 17 1 1 A 91 91 GLY CA C 129 41.500 43.863 -2.363 1
1 1039 . 17 1 1 A 91 91 GLY N N 129 108.559 108.841 -0.282 1
1 1040 . 17 1 1 A 92 92 ALA H H 130 7.047 8.133 -1.086 1
1 1041 . 17 1 1 A 92 92 ALA HA H 130 4.037 3.077 0.960 1
1 1045 . 17 1 1 A 92 92 ALA C C 130 174.890 177.963 -3.073 1
1 1046 . 17 1 1 A 92 92 ALA CA C 130 52.100 53.790 -1.690 1
1 1047 . 17 1 1 A 92 92 ALA CB C 130 16.502 18.142 -1.640 1
1 1048 . 17 1 1 A 92 92 ALA N N 130 118.393 121.539 -3.146 1
1 1049 . 17 1 1 A 93 93 ASP H H 131 7.222 7.560 -0.338 1
1 1050 . 17 1 1 A 93 93 ASP HA H 131 4.122 4.692 -0.570 1
1 1053 . 17 1 1 A 93 93 ASP C C 131 174.890 176.337 -1.447 1
1 1054 . 17 1 1 A 93 93 ASP CA C 131 50.249 53.777 -3.528 1
1 1055 . 17 1 1 A 93 93 ASP CB C 131 37.750 41.333 -3.583 1
1 1056 . 17 1 1 A 93 93 ASP N N 131 111.487 116.498 -5.011 1
1 1057 . 17 1 1 A 94 94 GLY H H 132 7.199 8.830 -1.631 1
1 1058 . 17 1 1 A 94 94 GLY HA2 H 132 3.951 3.890 0.061 1
1 1059 . 17 1 1 A 94 94 GLY HA3 H 132 3.324 3.908 -0.584 1
1 1060 . 17 1 1 A 94 94 GLY C C 132 169.773 173.538 -3.765 1
1 1061 . 17 1 1 A 94 94 GLY CA C 132 44.625 46.095 -1.470 1
1 1062 . 17 1 1 A 94 94 GLY N N 132 106.932 108.604 -1.672 1
1 1063 . 17 1 1 A 95 95 LYS H H 133 7.215 7.690 -0.475 1
1 1064 . 17 1 1 A 95 95 LYS HA H 133 4.513 4.848 -0.335 1
1 1073 . 17 1 1 A 95 95 LYS C C 133 172.108 175.315 -3.207 1
1 1074 . 17 1 1 A 95 95 LYS CA C 133 51.512 54.161 -2.649 1
1 1075 . 17 1 1 A 95 95 LYS CB C 133 34.000 36.206 -2.206 1
1 1076 . 17 1 1 A 95 95 LYS N N 133 115.749 119.595 -3.846 1
1 1077 . 17 1 1 A 96 96 GLU H H 134 9.230 8.649 0.581 1
1 1078 . 17 1 1 A 96 96 GLU HA H 134 4.352 4.673 -0.321 1
1 1083 . 17 1 1 A 96 96 GLU C C 134 175.219 175.872 -0.653 1
1 1084 . 17 1 1 A 96 96 GLU CA C 134 55.874 55.827 0.047 1
1 1085 . 17 1 1 A 96 96 GLU CB C 134 27.126 30.166 -3.040 1
1 1087 . 17 1 1 A 96 96 GLU N N 134 128.571 121.396 7.175 1
1 1088 . 17 1 1 A 97 97 GLY H H 135 10.677 8.367 2.310 1
1 1089 . 17 1 1 A 97 97 GLY HA2 H 135 4.037 4.322 -0.285 1
1 1090 . 17 1 1 A 97 97 GLY HA3 H 135 3.717 4.326 -0.609 1
1 1091 . 17 1 1 A 97 97 GLY C C 135 171.567 172.600 -1.033 1
1 1092 . 17 1 1 A 97 97 GLY CA C 135 41.500 45.598 -4.098 1
1 1093 . 17 1 1 A 97 97 GLY N N 135 117.011 110.553 6.458 1
1 1094 . 17 1 1 A 98 98 GLY H H 136 8.442 8.629 -0.187 1
1 1095 . 17 1 1 A 98 98 GLY HA2 H 136 4.195 4.225 -0.030 1
1 1096 . 17 1 1 A 98 98 GLY HA3 H 136 4.195 4.231 -0.036 1
1 1097 . 17 1 1 A 98 98 GLY C C 136 170.299 173.256 -2.957 1
1 1098 . 17 1 1 A 98 98 GLY CA C 136 40.875 44.720 -3.845 1
1 1099 . 17 1 1 A 98 98 GLY N N 136 109.494 109.343 0.151 1
1 1100 . 17 1 1 A 99 99 SER H H 137 8.701 8.780 -0.079 1
1 1101 . 17 1 1 A 99 99 SER HA H 137 4.639 4.915 -0.276 1
1 1104 . 17 1 1 A 99 99 SER C C 137 170.630 173.381 -2.751 1
1 1105 . 17 1 1 A 99 99 SER CA C 137 54.624 57.444 -2.820 1
1 1106 . 17 1 1 A 99 99 SER CB C 137 62.748 66.552 -3.804 1
1 1107 . 17 1 1 A 99 99 SER N N 137 114.685 118.444 -3.759 1
1 1108 . 17 1 1 A 100 100 ASP H H 138 9.117 8.899 0.218 1
1 1109 . 17 1 1 A 100 100 ASP HA H 138 3.965 4.398 -0.433 1
1 1112 . 17 1 1 A 100 100 ASP C C 138 175.540 177.536 -1.996 1
1 1113 . 17 1 1 A 100 100 ASP CA C 138 54.624 56.829 -2.205 1
1 1114 . 17 1 1 A 100 100 ASP CB C 138 36.500 41.372 -4.872 1
1 1115 . 17 1 1 A 100 100 ASP N N 138 120.777 122.657 -1.880 1
1 1116 . 17 1 1 A 101 101 ASN H H 139 8.667 8.210 0.457 1
1 1117 . 17 1 1 A 101 101 ASN HA H 139 4.333 4.904 -0.571 1
1 1122 . 17 1 1 A 101 101 ASN CA C 139 53.999 52.764 1.235 1
1 1123 . 17 1 1 A 101 101 ASN CB C 139 34.625 39.385 -4.760 1
1 1124 . 17 1 1 A 101 101 ASN N N 139 121.930 114.513 7.417 1
1 1126 . 17 1 1 A 102 102 ASP H H 140 7.714 7.936 -0.222 1
1 1127 . 17 1 1 A 102 102 ASP HA H 140 4.037 4.532 -0.495 1
1 1130 . 17 1 1 A 102 102 ASP C C 140 172.807 175.943 -3.136 1
1 1131 . 17 1 1 A 102 102 ASP CA C 140 53.374 54.262 -0.888 1
1 1132 . 17 1 1 A 102 102 ASP CB C 140 37.125 41.354 -4.229 1
1 1133 . 17 1 1 A 102 102 ASP N N 140 118.011 118.413 -0.402 1
1 1134 . 17 1 1 A 103 103 ALA H H 141 7.060 7.272 -0.212 1
1 1135 . 17 1 1 A 103 103 ALA HA H 141 3.353 4.678 -1.325 1
1 1139 . 17 1 1 A 103 103 ALA C C 141 172.233 176.931 -4.698 1
1 1140 . 17 1 1 A 103 103 ALA CA C 141 49.624 51.371 -1.747 1
1 1141 . 17 1 1 A 103 103 ALA CB C 141 16.502 20.722 -4.220 1
1 1142 . 17 1 1 A 103 103 ALA N N 141 125.777 122.572 3.205 1
1 1143 . 17 1 1 A 104 104 ASP H H 142 7.973 8.381 -0.408 1
1 1144 . 17 1 1 A 104 104 ASP HA H 142 4.420 4.956 -0.536 1
1 1147 . 17 1 1 A 104 104 ASP C C 142 174.188 175.854 -1.666 1
1 1148 . 17 1 1 A 104 104 ASP CA C 142 52.124 53.912 -1.788 1
1 1149 . 17 1 1 A 104 104 ASP CB C 142 37.125 41.278 -4.153 1
1 1150 . 17 1 1 A 104 104 ASP N N 142 122.965 119.971 2.994 1
1 1151 . 17 1 1 A 105 105 ILE H H 143 8.534 8.726 -0.192 1
1 1152 . 17 1 1 A 105 105 ILE HA H 143 4.060 4.839 -0.779 1
1 1162 . 17 1 1 A 105 105 ILE C C 143 173.235 175.580 -2.345 1
1 1163 . 17 1 1 A 105 105 ILE CA C 143 58.374 60.191 -1.817 1
1 1164 . 17 1 1 A 105 105 ILE CB C 143 39.123 39.241 -0.118 1
1 1167 . 17 1 1 A 105 105 ILE N N 143 124.757 120.485 4.272 1
1 1168 . 17 1 1 A 106 106 GLY H H 144 8.288 8.739 -0.451 1
1 1169 . 17 1 1 A 106 106 GLY HA2 H 144 4.764 4.271 0.493 1
1 1170 . 17 1 1 A 106 106 GLY HA3 H 144 4.764 4.506 0.258 1
1 1171 . 17 1 1 A 106 106 GLY C C 144 171.321 172.228 -0.907 1
1 1172 . 17 1 1 A 106 106 GLY CA C 144 40.250 44.148 -3.898 1
1 1173 . 17 1 1 A 106 106 GLY N N 144 110.895 112.749 -1.854 1
1 1174 . 17 1 1 A 107 107 ASN H H 145 8.577 9.270 -0.693 1
1 1175 . 17 1 1 A 107 107 ASN HA H 145 4.268 5.154 -0.886 1
1 1180 . 17 1 1 A 107 107 ASN C C 145 171.757 173.599 -1.842 1
1 1181 . 17 1 1 A 107 107 ASN CA C 145 52.124 52.528 -0.404 1
1 1182 . 17 1 1 A 107 107 ASN CB C 145 34.625 41.681 -7.056 1
1 1183 . 17 1 1 A 107 107 ASN N N 145 118.042 119.126 -1.084 1
1 1185 . 17 1 1 A 108 108 TRP H H 146 6.822 8.346 -1.524 1
1 1186 . 17 1 1 A 108 108 TRP HA H 146 4.513 5.138 -0.625 1
1 1195 . 17 1 1 A 108 108 TRP C C 146 172.665 172.328 0.337 1
1 1196 . 17 1 1 A 108 108 TRP CA C 146 54.624 55.477 -0.853 1
1 1197 . 17 1 1 A 108 108 TRP CB C 146 25.876 32.127 -6.251 1
1 1198 . 17 1 1 A 108 108 TRP N N 146 116.756 121.853 -5.097 1
1 1200 . 17 1 1 A 109 109 ASP H H 147 7.344 7.445 -0.101 1
1 1201 . 17 1 1 A 109 109 ASP HA H 147 4.655 4.605 0.050 1
1 1204 . 17 1 1 A 109 109 ASP C C 147 172.193 174.792 -2.599 1
1 1205 . 17 1 1 A 109 109 ASP CA C 147 51.499 52.987 -1.488 1
1 1206 . 17 1 1 A 109 109 ASP CB C 147 39.000 41.036 -2.036 1
1 1207 . 17 1 1 A 109 109 ASP N N 147 121.461 121.198 0.263 1
1 11 . 18 1 1 A 2 2 SER H H 40 8.461 9.021 -0.560 1
1 12 . 18 1 1 A 2 2 SER HA H 40 4.286 4.996 -0.710 1
1 15 . 18 1 1 A 2 2 SER C C 40 171.276 172.829 -1.553 1
1 16 . 18 1 1 A 2 2 SER CA C 40 55.249 56.928 -1.679 1
1 17 . 18 1 1 A 2 2 SER CB C 40 61.498 63.521 -2.023 1
1 18 . 18 1 1 A 2 2 SER N N 40 118.344 119.462 -1.118 1
1 19 . 18 1 1 A 3 3 ARG H H 41 8.469 8.360 0.109 1
1 20 . 18 1 1 A 3 3 ARG HA H 41 4.400 4.842 -0.442 1
1 25 . 18 1 1 A 3 3 ARG C C 41 172.251 173.643 -1.392 1
1 26 . 18 1 1 A 3 3 ARG CA C 41 52.749 52.936 -0.187 1
1 27 . 18 1 1 A 3 3 ARG CB C 41 27.126 33.837 -6.711 1
1 28 . 18 1 1 A 3 3 ARG N N 41 123.070 126.371 -3.301 1
1 33 . 18 1 1 A 4 4 PRO CA C 42 61.498 63.834 -2.336 1
1 34 . 18 1 1 A 4 4 PRO CB C 42 29.001 31.739 -2.738 1
1 37 . 18 1 1 A 5 5 ASP H H 43 8.246 8.906 -0.660 1
1 38 . 18 1 1 A 5 5 ASP HA H 43 4.329 4.334 -0.005 1
1 41 . 18 1 1 A 5 5 ASP C C 43 174.605 176.589 -1.984 1
1 42 . 18 1 1 A 5 5 ASP CA C 43 53.374 56.339 -2.965 1
1 43 . 18 1 1 A 5 5 ASP CB C 43 38.375 38.546 -0.171 1
1 44 . 18 1 1 A 5 5 ASP N N 43 119.409 117.241 2.168 1
1 45 . 18 1 1 A 6 6 GLN H H 44 8.309 8.368 -0.059 1
1 46 . 18 1 1 A 6 6 GLN HA H 44 4.393 4.197 0.196 1
1 53 . 18 1 1 A 6 6 GLN C C 44 175.053 177.966 -2.913 1
1 54 . 18 1 1 A 6 6 GLN CA C 44 55.874 58.238 -2.364 1
1 55 . 18 1 1 A 6 6 GLN CB C 44 25.876 28.196 -2.320 1
1 57 . 18 1 1 A 6 6 GLN N N 44 122.273 118.082 4.191 1
1 59 . 18 1 1 A 7 7 ALA H H 45 8.106 7.938 0.168 1
1 60 . 18 1 1 A 7 7 ALA HA H 45 3.993 4.110 -0.117 1
1 64 . 18 1 1 A 7 7 ALA C C 45 177.465 178.037 -0.572 1
1 65 . 18 1 1 A 7 7 ALA CA C 45 52.124 54.256 -2.132 1
1 66 . 18 1 1 A 7 7 ALA CB C 45 15.252 18.355 -3.103 1
1 67 . 18 1 1 A 7 7 ALA N N 45 122.204 121.866 0.338 1
1 68 . 18 1 1 A 8 8 LYS H H 46 7.527 7.781 -0.254 1
1 69 . 18 1 1 A 8 8 LYS HA H 46 3.539 4.122 -0.583 1
1 78 . 18 1 1 A 8 8 LYS C C 46 175.412 179.115 -3.703 1
1 79 . 18 1 1 A 8 8 LYS CA C 46 57.124 57.742 -0.618 1
1 80 . 18 1 1 A 8 8 LYS CB C 46 30.876 32.399 -1.523 1
1 83 . 18 1 1 A 8 8 LYS N N 46 117.358 116.388 0.970 1
1 84 . 18 1 1 A 9 9 VAL H H 47 7.709 7.608 0.101 1
1 85 . 18 1 1 A 9 9 VAL HA H 47 3.578 3.768 -0.190 1
1 93 . 18 1 1 A 9 9 VAL C C 47 175.005 178.339 -3.334 1
1 94 . 18 1 1 A 9 9 VAL CA C 47 64.623 66.074 -1.451 1
1 95 . 18 1 1 A 9 9 VAL CB C 47 29.001 31.799 -2.798 1
1 98 . 18 1 1 A 9 9 VAL N N 47 119.115 120.207 -1.092 1
1 99 . 18 1 1 A 10 10 THR H H 48 7.767 8.118 -0.351 1
1 100 . 18 1 1 A 10 10 THR HA H 48 3.668 3.990 -0.322 1
1 105 . 18 1 1 A 10 10 THR CA C 48 63.998 65.507 -1.509 1
1 106 . 18 1 1 A 10 10 THR CB C 48 67.123 68.757 -1.634 1
1 108 . 18 1 1 A 10 10 THR N N 48 115.112 113.655 1.457 1
1 109 . 18 1 1 A 11 11 VAL H H 49 7.598 7.756 -0.158 1
1 110 . 18 1 1 A 11 11 VAL HA H 49 3.457 3.872 -0.415 1
1 118 . 18 1 1 A 11 11 VAL C C 49 175.412 178.049 -2.637 1
1 119 . 18 1 1 A 11 11 VAL CA C 49 63.998 64.762 -0.764 1
1 120 . 18 1 1 A 11 11 VAL CB C 49 29.001 31.583 -2.582 1
1 123 . 18 1 1 A 11 11 VAL N N 49 123.694 117.388 6.306 1
1 124 . 18 1 1 A 12 12 ALA H H 50 8.176 8.000 0.176 1
1 125 . 18 1 1 A 12 12 ALA HA H 50 4.742 4.018 0.724 1
1 129 . 18 1 1 A 12 12 ALA C C 50 177.074 179.663 -2.589 1
1 130 . 18 1 1 A 12 12 ALA CA C 50 52.124 55.374 -3.250 1
1 131 . 18 1 1 A 12 12 ALA CB C 50 15.252 18.256 -3.004 1
1 132 . 18 1 1 A 12 12 ALA N N 50 122.348 124.425 -2.077 1
1 133 . 18 1 1 A 13 13 LYS H H 51 8.499 8.146 0.353 1
1 134 . 18 1 1 A 13 13 LYS HA H 51 3.648 4.096 -0.448 1
1 143 . 18 1 1 A 13 13 LYS C C 51 177.252 179.786 -2.534 1
1 144 . 18 1 1 A 13 13 LYS CA C 51 58.072 59.507 -1.435 1
1 145 . 18 1 1 A 13 13 LYS CB C 51 30.251 32.243 -1.992 1
1 146 . 18 1 1 A 13 13 LYS N N 51 115.402 116.265 -0.863 1
1 147 . 18 1 1 A 14 14 GLY H H 52 7.858 8.097 -0.239 1
1 148 . 18 1 1 A 14 14 GLY HA2 H 52 3.823 3.922 -0.099 1
1 149 . 18 1 1 A 14 14 GLY HA3 H 52 3.676 3.931 -0.255 1
1 150 . 18 1 1 A 14 14 GLY C C 52 174.090 175.367 -1.277 1
1 151 . 18 1 1 A 14 14 GLY CA C 52 44.625 46.546 -1.921 1
1 152 . 18 1 1 A 14 14 GLY N N 52 107.466 108.551 -1.085 1
1 153 . 18 1 1 A 15 15 ASP H H 53 8.403 7.886 0.517 1
1 154 . 18 1 1 A 15 15 ASP HA H 53 4.191 4.511 -0.320 1
1 157 . 18 1 1 A 15 15 ASP C C 53 175.316 178.763 -3.447 1
1 158 . 18 1 1 A 15 15 ASP CA C 53 54.624 56.151 -1.527 1
1 159 . 18 1 1 A 15 15 ASP CB C 53 35.875 40.673 -4.798 1
1 160 . 18 1 1 A 15 15 ASP N N 53 125.929 120.713 5.216 1
1 161 . 18 1 1 A 16 16 ILE H H 54 8.245 7.986 0.259 1
1 162 . 18 1 1 A 16 16 ILE HA H 54 3.034 3.821 -0.787 1
1 172 . 18 1 1 A 16 16 ILE C C 54 174.499 177.914 -3.415 1
1 173 . 18 1 1 A 16 16 ILE CA C 54 62.748 64.060 -1.312 1
1 174 . 18 1 1 A 16 16 ILE CB C 54 34.625 37.221 -2.596 1
1 178 . 18 1 1 A 16 16 ILE N N 54 119.456 116.110 3.346 1
1 179 . 18 1 1 A 17 17 LYS H H 55 7.547 8.172 -0.625 1
1 180 . 18 1 1 A 17 17 LYS HA H 55 3.843 4.229 -0.386 1
1 187 . 18 1 1 A 17 17 LYS C C 55 176.651 179.443 -2.792 1
1 188 . 18 1 1 A 17 17 LYS CA C 55 57.124 59.122 -1.998 1
1 189 . 18 1 1 A 17 17 LYS CB C 55 30.251 31.823 -1.572 1
1 190 . 18 1 1 A 17 17 LYS N N 55 118.505 121.335 -2.830 1
1 191 . 18 1 1 A 18 18 ALA H H 56 7.680 7.931 -0.251 1
1 192 . 18 1 1 A 18 18 ALA HA H 56 4.029 4.069 -0.040 1
1 196 . 18 1 1 A 18 18 ALA C C 56 176.638 180.598 -3.960 1
1 197 . 18 1 1 A 18 18 ALA CA C 56 52.749 54.888 -2.139 1
1 198 . 18 1 1 A 18 18 ALA CB C 56 15.877 18.152 -2.275 1
1 199 . 18 1 1 A 18 18 ALA N N 56 122.477 121.864 0.613 1
1 200 . 18 1 1 A 19 19 ILE H H 57 8.853 7.611 1.242 1
1 201 . 18 1 1 A 19 19 ILE HA H 57 3.304 3.642 -0.338 1
1 211 . 18 1 1 A 19 19 ILE C C 57 174.710 177.856 -3.146 1
1 212 . 18 1 1 A 19 19 ILE CA C 57 63.373 65.090 -1.717 1
1 213 . 18 1 1 A 19 19 ILE CB C 57 35.250 37.063 -1.813 1
1 217 . 18 1 1 A 19 19 ILE N N 57 120.901 119.012 1.889 1
1 218 . 18 1 1 A 20 20 ALA H H 58 8.702 8.285 0.417 1
1 219 . 18 1 1 A 20 20 ALA HA H 58 3.900 4.156 -0.256 1
1 223 . 18 1 1 A 20 20 ALA C C 58 176.512 179.807 -3.295 1
1 224 . 18 1 1 A 20 20 ALA CA C 58 52.749 55.631 -2.882 1
1 225 . 18 1 1 A 20 20 ALA CB C 58 15.252 17.937 -2.685 1
1 226 . 18 1 1 A 20 20 ALA N N 58 121.763 123.515 -1.752 1
1 227 . 18 1 1 A 21 21 ALA H H 59 7.662 7.485 0.177 1
1 228 . 18 1 1 A 21 21 ALA HA H 59 4.136 4.271 -0.135 1
1 232 . 18 1 1 A 21 21 ALA C C 59 177.949 179.688 -1.739 1
1 233 . 18 1 1 A 21 21 ALA CA C 59 52.749 54.860 -2.111 1
1 234 . 18 1 1 A 21 21 ALA CB C 59 15.252 18.495 -3.243 1
1 235 . 18 1 1 A 21 21 ALA N N 59 119.079 119.164 -0.085 1
1 236 . 18 1 1 A 22 22 ALA H H 60 7.403 7.915 -0.512 1
1 237 . 18 1 1 A 22 22 ALA HA H 60 4.318 4.200 0.118 1
1 241 . 18 1 1 A 22 22 ALA C C 60 176.730 180.069 -3.339 1
1 242 . 18 1 1 A 22 22 ALA CA C 60 52.749 54.662 -1.913 1
1 243 . 18 1 1 A 22 22 ALA CB C 60 17.126 18.523 -1.397 1
1 244 . 18 1 1 A 22 22 ALA N N 60 122.616 120.826 1.790 1
1 245 . 18 1 1 A 23 23 LEU H H 61 8.410 8.708 -0.298 1
1 246 . 18 1 1 A 23 23 LEU HA H 61 3.527 3.985 -0.458 1
1 256 . 18 1 1 A 23 23 LEU C C 61 176.057 178.386 -2.329 1
1 257 . 18 1 1 A 23 23 LEU CA C 61 55.249 57.148 -1.899 1
1 258 . 18 1 1 A 23 23 LEU CB C 61 39.000 40.837 -1.837 1
1 262 . 18 1 1 A 23 23 LEU N N 61 120.761 120.906 -0.145 1
1 263 . 18 1 1 A 24 24 ASP H H 62 8.227 8.225 0.002 1
1 264 . 18 1 1 A 24 24 ASP HA H 62 4.581 4.498 0.083 1
1 267 . 18 1 1 A 24 24 ASP C C 62 176.968 178.074 -1.106 1
1 268 . 18 1 1 A 24 24 ASP CA C 62 55.874 56.498 -0.624 1
1 269 . 18 1 1 A 24 24 ASP CB C 62 37.750 40.934 -3.184 1
1 270 . 18 1 1 A 24 24 ASP N N 62 119.068 118.925 0.143 1
1 271 . 18 1 1 A 25 25 MET H H 63 7.718 8.003 -0.285 1
1 272 . 18 1 1 A 25 25 MET HA H 63 4.196 4.262 -0.066 1
1 277 . 18 1 1 A 25 25 MET C C 63 174.968 177.894 -2.926 1
1 278 . 18 1 1 A 25 25 MET CA C 63 55.249 58.614 -3.365 1
1 279 . 18 1 1 A 25 25 MET CB C 63 29.626 33.172 -3.546 1
1 281 . 18 1 1 A 25 25 MET N N 63 121.365 117.504 3.861 1
1 282 . 18 1 1 A 26 26 TYR H H 64 8.401 7.643 0.758 1
1 283 . 18 1 1 A 26 26 TYR HA H 64 4.400 3.587 0.813 1
1 291 . 18 1 1 A 26 26 TYR C C 64 176.098 177.310 -1.212 1
1 292 . 18 1 1 A 26 26 TYR CA C 64 58.999 60.888 -1.889 1
1 293 . 18 1 1 A 26 26 TYR CB C 64 35.250 37.987 -2.737 1
1 294 . 18 1 1 A 26 26 TYR N N 64 122.575 121.119 1.456 1
1 295 . 18 1 1 A 27 27 LYS H H 65 8.330 8.330 0.000 1
1 296 . 18 1 1 A 27 27 LYS HA H 65 3.568 4.040 -0.472 1
1 302 . 18 1 1 A 27 27 LYS C C 65 176.156 178.892 -2.736 1
1 303 . 18 1 1 A 27 27 LYS CA C 65 56.499 59.475 -2.976 1
1 304 . 18 1 1 A 27 27 LYS CB C 65 29.626 31.619 -1.993 1
1 306 . 18 1 1 A 27 27 LYS N N 65 121.390 118.621 2.769 1
1 307 . 18 1 1 A 28 28 LEU H H 66 7.833 7.697 0.136 1
1 308 . 18 1 1 A 28 28 LEU HA H 66 3.769 4.098 -0.329 1
1 318 . 18 1 1 A 28 28 LEU C C 66 175.925 178.431 -2.506 1
1 319 . 18 1 1 A 28 28 LEU CA C 66 55.874 56.686 -0.812 1
1 320 . 18 1 1 A 28 28 LEU CB C 66 38.375 41.468 -3.093 1
1 324 . 18 1 1 A 28 28 LEU N N 66 123.068 119.362 3.706 1
1 325 . 18 1 1 A 29 29 ASP H H 67 7.292 7.966 -0.674 1
1 326 . 18 1 1 A 29 29 ASP HA H 67 4.096 4.306 -0.210 1
1 329 . 18 1 1 A 29 29 ASP C C 67 174.618 176.665 -2.047 1
1 330 . 18 1 1 A 29 29 ASP CA C 67 53.999 56.241 -2.242 1
1 331 . 18 1 1 A 29 29 ASP CB C 67 38.375 40.602 -2.227 1
1 332 . 18 1 1 A 29 29 ASP N N 67 114.729 119.207 -4.478 1
1 333 . 18 1 1 A 30 30 ASN H H 68 8.097 7.558 0.539 1
1 334 . 18 1 1 A 30 30 ASN HA H 68 4.337 4.370 -0.033 1
1 339 . 18 1 1 A 30 30 ASN C C 68 172.822 174.226 -1.404 1
1 340 . 18 1 1 A 30 30 ASN CA C 68 52.124 52.054 0.070 1
1 341 . 18 1 1 A 30 30 ASN CB C 68 37.750 38.372 -0.622 1
1 342 . 18 1 1 A 30 30 ASN N N 68 111.054 115.110 -4.056 1
1 344 . 18 1 1 A 31 31 PHE H H 69 8.249 7.952 0.297 1
1 345 . 18 1 1 A 31 31 PHE HA H 69 4.135 4.274 -0.139 1
1 353 . 18 1 1 A 31 31 PHE C C 69 170.485 174.198 -3.713 1
1 354 . 18 1 1 A 31 31 PHE CA C 69 57.749 58.737 -0.988 1
1 355 . 18 1 1 A 31 31 PHE CB C 69 33.375 36.568 -3.193 1
1 356 . 18 1 1 A 31 31 PHE N N 69 116.277 117.294 -1.017 1
1 357 . 18 1 1 A 32 32 ALA H H 70 7.224 6.987 0.237 1
1 358 . 18 1 1 A 32 32 ALA HA H 70 4.194 4.571 -0.377 1
1 362 . 18 1 1 A 32 32 ALA C C 70 173.337 175.007 -1.670 1
1 363 . 18 1 1 A 32 32 ALA CA C 70 48.374 51.645 -3.271 1
1 364 . 18 1 1 A 32 32 ALA CB C 70 19.626 22.395 -2.769 1
1 365 . 18 1 1 A 32 32 ALA N N 70 119.914 120.292 -0.378 1
1 366 . 18 1 1 A 33 33 TYR H H 71 7.948 8.466 -0.518 1
1 367 . 18 1 1 A 33 33 TYR HA H 71 4.209 4.939 -0.730 1
1 374 . 18 1 1 A 33 33 TYR C C 71 170.591 174.379 -3.788 1
1 375 . 18 1 1 A 33 33 TYR CA C 71 54.624 56.603 -1.979 1
1 376 . 18 1 1 A 33 33 TYR CB C 71 34.000 37.996 -3.996 1
1 377 . 18 1 1 A 33 33 TYR N N 71 116.929 118.311 -1.382 1
1 378 . 18 1 1 A 34 34 PRO HA H 72 4.444 4.734 -0.290 1
1 381 . 18 1 1 A 34 34 PRO C C 72 174.775 176.300 -1.525 1
1 382 . 18 1 1 A 34 34 PRO CA C 72 59.624 62.580 -2.956 1
1 383 . 18 1 1 A 34 34 PRO CB C 72 28.376 31.964 -3.588 1
1 384 . 18 1 1 A 35 35 SER H H 73 8.721 8.392 0.329 1
1 385 . 18 1 1 A 35 35 SER HA H 73 4.467 4.732 -0.265 1
1 388 . 18 1 1 A 35 35 SER C C 73 173.271 175.516 -2.245 1
1 389 . 18 1 1 A 35 35 SER CA C 73 55.249 56.703 -1.454 1
1 390 . 18 1 1 A 35 35 SER CB C 73 63.373 65.756 -2.383 1
1 391 . 18 1 1 A 35 35 SER N N 73 118.284 114.570 3.714 1
1 392 . 18 1 1 A 36 36 THR H H 74 8.591 8.748 -0.157 1
1 393 . 18 1 1 A 36 36 THR HA H 74 3.649 4.187 -0.538 1
1 398 . 18 1 1 A 36 36 THR CA C 74 64.623 64.059 0.564 1
1 399 . 18 1 1 A 36 36 THR CB C 74 66.498 69.100 -2.602 1
1 401 . 18 1 1 A 36 36 THR N N 74 117.769 117.154 0.615 1
1 402 . 18 1 1 A 37 37 GLN H H 75 8.210 7.867 0.343 1
1 403 . 18 1 1 A 37 37 GLN HA H 75 3.860 4.466 -0.606 1
1 410 . 18 1 1 A 37 37 GLN C C 75 175.349 177.500 -2.151 1
1 411 . 18 1 1 A 37 37 GLN CA C 75 56.499 57.572 -1.073 1
1 412 . 18 1 1 A 37 37 GLN CB C 75 25.876 29.674 -3.798 1
1 414 . 18 1 1 A 37 37 GLN N N 75 117.931 119.664 -1.733 1
1 416 . 18 1 1 A 38 38 GLN H H 76 7.667 8.178 -0.511 1
1 417 . 18 1 1 A 38 38 GLN HA H 76 3.810 4.085 -0.275 1
1 424 . 18 1 1 A 38 38 GLN C C 76 175.805 179.469 -3.664 1
1 425 . 18 1 1 A 38 38 GLN CA C 76 55.874 58.628 -2.754 1
1 426 . 18 1 1 A 38 38 GLN CB C 76 25.876 28.309 -2.433 1
1 428 . 18 1 1 A 38 38 GLN N N 76 120.607 118.346 2.261 1
1 430 . 18 1 1 A 39 39 GLY H H 77 8.470 8.239 0.231 1
1 431 . 18 1 1 A 39 39 GLY HA2 H 77 3.920 3.703 0.217 1
1 432 . 18 1 1 A 39 39 GLY HA3 H 77 3.603 3.727 -0.124 1
1 433 . 18 1 1 A 39 39 GLY C C 77 169.006 175.369 -6.363 1
1 434 . 18 1 1 A 39 39 GLY CA C 77 42.125 46.474 -4.349 1
1 435 . 18 1 1 A 39 39 GLY N N 77 103.281 109.285 -6.004 1
1 436 . 18 1 1 A 40 40 LEU H H 78 8.135 7.808 0.327 1
1 437 . 18 1 1 A 40 40 LEU HA H 78 3.237 4.036 -0.799 1
1 447 . 18 1 1 A 40 40 LEU C C 78 176.383 178.630 -2.247 1
1 448 . 18 1 1 A 40 40 LEU CA C 78 52.749 57.064 -4.315 1
1 449 . 18 1 1 A 40 40 LEU CB C 78 39.000 41.524 -2.524 1
1 453 . 18 1 1 A 40 40 LEU N N 78 114.444 123.217 -8.773 1
1 454 . 18 1 1 A 41 41 GLU H H 79 8.578 8.109 0.469 1
1 455 . 18 1 1 A 41 41 GLU HA H 79 3.720 4.211 -0.491 1
1 460 . 18 1 1 A 41 41 GLU C C 79 175.093 177.056 -1.963 1
1 461 . 18 1 1 A 41 41 GLU CA C 79 57.124 58.520 -1.396 1
1 462 . 18 1 1 A 41 41 GLU CB C 79 26.501 29.236 -2.735 1
1 464 . 18 1 1 A 41 41 GLU N N 79 118.295 118.276 0.019 1
1 465 . 18 1 1 A 42 42 ALA H H 80 7.227 7.435 -0.208 1
1 466 . 18 1 1 A 42 42 ALA HA H 80 4.437 4.829 -0.392 1
1 470 . 18 1 1 A 42 42 ALA C C 80 173.745 178.248 -4.503 1
1 471 . 18 1 1 A 42 42 ALA CA C 80 51.499 52.657 -1.158 1
1 472 . 18 1 1 A 42 42 ALA CB C 80 15.877 19.864 -3.987 1
1 473 . 18 1 1 A 42 42 ALA N N 80 119.751 121.630 -1.879 1
1 474 . 18 1 1 A 43 43 LEU H H 81 7.932 7.417 0.515 1
1 475 . 18 1 1 A 43 43 LEU HA H 81 4.369 4.309 0.060 1
1 485 . 18 1 1 A 43 43 LEU C C 81 174.788 177.656 -2.868 1
1 486 . 18 1 1 A 43 43 LEU CA C 81 53.374 55.522 -2.148 1
1 487 . 18 1 1 A 43 43 LEU CB C 81 39.625 42.150 -2.525 1
1 491 . 18 1 1 A 43 43 LEU N N 81 111.742 116.091 -4.349 1
1 492 . 18 1 1 A 44 44 VAL H H 82 7.886 7.290 0.596 1
1 493 . 18 1 1 A 44 44 VAL HA H 82 4.700 4.106 0.594 1
1 501 . 18 1 1 A 44 44 VAL C C 82 172.875 175.490 -2.615 1
1 502 . 18 1 1 A 44 44 VAL CA C 82 59.624 63.704 -4.080 1
1 503 . 18 1 1 A 44 44 VAL CB C 82 31.501 33.341 -1.840 1
1 506 . 18 1 1 A 44 44 VAL N N 82 113.604 115.528 -1.924 1
1 507 . 18 1 1 A 45 45 LYS H H 83 8.361 8.166 0.195 1
1 508 . 18 1 1 A 45 45 LYS HA H 83 4.251 4.820 -0.569 1
1 515 . 18 1 1 A 45 45 LYS C C 83 171.053 175.776 -4.723 1
1 516 . 18 1 1 A 45 45 LYS CA C 83 52.749 54.064 -1.315 1
1 517 . 18 1 1 A 45 45 LYS CB C 83 33.375 35.051 -1.676 1
1 521 . 18 1 1 A 45 45 LYS N N 83 123.860 117.796 6.064 1
1 522 . 18 1 1 A 46 46 LYS H H 84 7.243 7.973 -0.730 1
1 523 . 18 1 1 A 46 46 LYS HA H 84 2.175 2.564 -0.389 1
1 532 . 18 1 1 A 46 46 LYS C C 84 172.123 174.740 -2.617 1
1 533 . 18 1 1 A 46 46 LYS CA C 84 52.749 53.714 -0.965 1
1 534 . 18 1 1 A 46 46 LYS CB C 84 29.626 32.447 -2.821 1
1 537 . 18 1 1 A 46 46 LYS N N 84 128.615 122.109 6.506 1
1 538 . 18 1 1 A 47 47 PRO HA H 85 4.470 4.380 0.090 1
1 541 . 18 1 1 A 47 47 PRO C C 85 173.754 177.351 -3.597 1
1 542 . 18 1 1 A 47 47 PRO CA C 85 60.874 63.104 -2.230 1
1 543 . 18 1 1 A 47 47 PRO CB C 85 30.876 31.831 -0.955 1
1 546 . 18 1 1 A 48 48 THR H H 86 8.306 8.609 -0.303 1
1 547 . 18 1 1 A 48 48 THR HA H 86 4.287 4.388 -0.101 1
1 552 . 18 1 1 A 48 48 THR C C 86 173.070 174.836 -1.766 1
1 553 . 18 1 1 A 48 48 THR CA C 86 57.749 62.735 -4.986 1
1 554 . 18 1 1 A 48 48 THR CB C 86 67.748 69.056 -1.308 1
1 556 . 18 1 1 A 48 48 THR N N 86 109.564 118.899 -9.335 1
1 557 . 18 1 1 A 49 49 GLY H H 87 8.317 7.764 0.553 1
1 558 . 18 1 1 A 49 49 GLY HA2 H 87 3.851 3.987 -0.136 1
1 559 . 18 1 1 A 49 49 GLY HA3 H 87 3.678 3.999 -0.321 1
1 560 . 18 1 1 A 49 49 GLY C C 87 169.693 173.067 -3.374 1
1 561 . 18 1 1 A 49 49 GLY CA C 87 42.125 44.343 -2.218 1
1 562 . 18 1 1 A 49 49 GLY N N 87 109.071 109.735 -0.664 1
1 563 . 18 1 1 A 50 50 ASN H H 88 8.301 8.504 -0.203 1
1 564 . 18 1 1 A 50 50 ASN HA H 88 4.780 5.349 -0.569 1
1 569 . 18 1 1 A 50 50 ASN C C 88 171.370 173.098 -1.728 1
1 570 . 18 1 1 A 50 50 ASN CA C 88 47.749 50.040 -2.291 1
1 571 . 18 1 1 A 50 50 ASN CB C 88 37.125 39.470 -2.345 1
1 572 . 18 1 1 A 50 50 ASN N N 88 115.631 119.093 -3.462 1
1 574 . 18 1 1 A 51 51 PRO HA H 89 4.782 4.804 -0.022 1
1 577 . 18 1 1 A 51 51 PRO C C 89 173.656 175.629 -1.973 1
1 578 . 18 1 1 A 51 51 PRO CA C 89 59.624 62.054 -2.430 1
1 579 . 18 1 1 A 51 51 PRO CB C 89 31.501 32.718 -1.217 1
1 582 . 18 1 1 A 52 52 GLN H H 90 9.076 8.890 0.186 1
1 583 . 18 1 1 A 52 52 GLN HA H 90 4.469 4.797 -0.328 1
1 590 . 18 1 1 A 52 52 GLN C C 90 172.386 174.053 -1.667 1
1 591 . 18 1 1 A 52 52 GLN CA C 90 50.874 52.917 -2.043 1
1 592 . 18 1 1 A 52 52 GLN CB C 90 26.501 29.536 -3.035 1
1 594 . 18 1 1 A 52 52 GLN N N 90 126.827 119.743 7.084 1
1 596 . 18 1 1 A 53 53 PRO HA H 91 4.384 4.417 -0.033 1
1 599 . 18 1 1 A 53 53 PRO C C 91 174.274 176.604 -2.330 1
1 600 . 18 1 1 A 53 53 PRO CB C 91 28.113 31.778 -3.665 1
1 601 . 18 1 1 A 54 54 LYS H H 92 8.401 9.156 -0.755 1
1 602 . 18 1 1 A 54 54 LYS HA H 92 3.984 4.889 -0.905 1
1 611 . 18 1 1 A 54 54 LYS C C 92 173.516 176.453 -2.937 1
1 612 . 18 1 1 A 54 54 LYS CA C 92 55.249 54.579 0.670 1
1 613 . 18 1 1 A 54 54 LYS CB C 92 30.876 35.215 -4.339 1
1 615 . 18 1 1 A 54 54 LYS N N 92 124.538 123.489 1.049 1
1 616 . 18 1 1 A 55 55 ASN H H 93 8.183 8.651 -0.468 1
1 617 . 18 1 1 A 55 55 ASN HA H 93 4.716 4.758 -0.042 1
1 622 . 18 1 1 A 55 55 ASN CA C 93 48.999 53.380 -4.381 1
1 623 . 18 1 1 A 55 55 ASN CB C 93 35.875 37.411 -1.536 1
1 624 . 18 1 1 A 55 55 ASN N N 93 118.677 120.831 -2.154 1
1 626 . 18 1 1 A 56 56 TRP H H 94 8.007 8.678 -0.671 1
1 627 . 18 1 1 A 56 56 TRP HA H 94 3.827 5.439 -1.612 1
1 635 . 18 1 1 A 56 56 TRP C C 94 173.760 175.350 -1.590 1
1 636 . 18 1 1 A 56 56 TRP CA C 94 59.624 59.303 0.321 1
1 637 . 18 1 1 A 56 56 TRP CB C 94 27.126 30.358 -3.232 1
1 638 . 18 1 1 A 56 56 TRP N N 94 122.195 127.475 -5.280 1
1 640 . 18 1 1 A 57 57 ASN H H 95 7.563 7.575 -0.012 1
1 641 . 18 1 1 A 57 57 ASN HA H 95 3.735 4.852 -1.117 1
1 646 . 18 1 1 A 57 57 ASN C C 95 171.952 173.943 -1.991 1
1 647 . 18 1 1 A 57 57 ASN CA C 95 51.499 50.761 0.738 1
1 648 . 18 1 1 A 57 57 ASN CB C 95 35.250 41.209 -5.959 1
1 649 . 18 1 1 A 57 57 ASN N N 95 129.659 125.300 4.359 1
1 651 . 18 1 1 A 58 58 LYS H H 96 8.110 8.098 0.012 1
1 652 . 18 1 1 A 58 58 LYS HA H 96 4.035 4.326 -0.291 1
1 659 . 18 1 1 A 58 58 LYS C C 96 174.530 175.508 -0.978 1
1 660 . 18 1 1 A 58 58 LYS CA C 96 56.499 54.284 2.215 1
1 661 . 18 1 1 A 58 58 LYS CB C 96 29.626 33.450 -3.824 1
1 665 . 18 1 1 A 58 58 LYS N N 96 123.913 123.126 0.787 1
1 666 . 18 1 1 A 59 59 ASP H H 97 7.903 8.898 -0.995 1
1 667 . 18 1 1 A 59 59 ASP HA H 97 4.393 4.337 0.056 1
1 670 . 18 1 1 A 59 59 ASP C C 97 173.724 175.293 -1.569 1
1 671 . 18 1 1 A 59 59 ASP CA C 97 52.124 55.001 -2.877 1
1 672 . 18 1 1 A 59 59 ASP CB C 97 38.375 39.797 -1.422 1
1 673 . 18 1 1 A 59 59 ASP N N 97 118.773 119.824 -1.051 1
1 674 . 18 1 1 A 60 60 GLY H H 98 7.819 7.856 -0.037 1
1 675 . 18 1 1 A 60 60 GLY HA2 H 98 3.917 3.651 0.266 1
1 676 . 18 1 1 A 60 60 GLY HA3 H 98 3.917 3.987 -0.070 1
1 677 . 18 1 1 A 60 60 GLY C C 98 168.652 174.343 -5.691 1
1 678 . 18 1 1 A 60 60 GLY CA C 98 41.500 44.814 -3.314 1
1 679 . 18 1 1 A 60 60 GLY N N 98 108.742 104.917 3.825 1
1 680 . 18 1 1 A 61 61 TYR H H 99 8.105 8.105 0.000 1
1 681 . 18 1 1 A 61 61 TYR HA H 99 3.927 4.410 -0.483 1
1 689 . 18 1 1 A 61 61 TYR C C 99 172.831 174.076 -1.245 1
1 690 . 18 1 1 A 61 61 TYR CA C 99 57.124 58.417 -1.293 1
1 691 . 18 1 1 A 61 61 TYR CB C 99 37.125 36.363 0.762 1
1 692 . 18 1 1 A 61 61 TYR N N 99 113.836 117.141 -3.305 1
1 693 . 18 1 1 A 62 62 LEU H H 100 7.352 8.056 -0.704 1
1 694 . 18 1 1 A 62 62 LEU HA H 100 4.343 4.871 -0.528 1
1 704 . 18 1 1 A 62 62 LEU C C 100 173.430 175.254 -1.824 1
1 705 . 18 1 1 A 62 62 LEU CA C 100 50.874 53.590 -2.716 1
1 706 . 18 1 1 A 62 62 LEU CB C 100 44.000 46.080 -2.080 1
1 710 . 18 1 1 A 62 62 LEU N N 100 117.112 122.354 -5.242 1
1 711 . 18 1 1 A 63 63 LYS H H 101 8.626 8.194 0.432 1
1 712 . 18 1 1 A 63 63 LYS HA H 101 3.986 4.331 -0.345 1
1 721 . 18 1 1 A 63 63 LYS C C 101 173.851 176.845 -2.994 1
1 722 . 18 1 1 A 63 63 LYS CA C 101 55.249 55.865 -0.616 1
1 723 . 18 1 1 A 63 63 LYS CB C 101 29.626 33.458 -3.832 1
1 724 . 18 1 1 A 63 63 LYS N N 101 129.991 123.197 6.794 1
1 725 . 18 1 1 A 64 64 LYS H H 102 7.059 8.409 -1.350 1
1 726 . 18 1 1 A 64 64 LYS HA H 102 4.138 4.330 -0.192 1
1 735 . 18 1 1 A 64 64 LYS C C 102 171.120 174.534 -3.414 1
1 736 . 18 1 1 A 64 64 LYS CA C 102 52.749 55.903 -3.154 1
1 737 . 18 1 1 A 64 64 LYS CB C 102 32.750 30.654 2.096 1
1 740 . 18 1 1 A 64 64 LYS N N 102 113.255 120.567 -7.312 1
1 741 . 18 1 1 A 65 65 LEU H H 103 8.883 8.007 0.876 1
1 742 . 18 1 1 A 65 65 LEU HA H 103 4.475 4.748 -0.273 1
1 752 . 18 1 1 A 65 65 LEU C C 103 171.487 174.132 -2.645 1
1 753 . 18 1 1 A 65 65 LEU CA C 103 48.999 51.153 -2.154 1
1 754 . 18 1 1 A 65 65 LEU CB C 103 39.625 45.092 -5.467 1
1 758 . 18 1 1 A 65 65 LEU N N 103 126.355 125.675 0.680 1
1 759 . 18 1 1 A 66 66 PRO HA H 104 4.449 4.591 -0.142 1
1 764 . 18 1 1 A 66 66 PRO C C 104 173.363 176.149 -2.786 1
1 765 . 18 1 1 A 66 66 PRO CA C 104 60.249 62.193 -1.944 1
1 766 . 18 1 1 A 66 66 PRO CB C 104 29.626 33.011 -3.385 1
1 769 . 18 1 1 A 67 67 VAL H H 105 7.682 8.367 -0.685 1
1 770 . 18 1 1 A 67 67 VAL HA H 105 4.121 4.427 -0.306 1
1 778 . 18 1 1 A 67 67 VAL C C 105 171.667 175.081 -3.414 1
1 779 . 18 1 1 A 67 67 VAL CA C 105 58.374 61.396 -3.022 1
1 780 . 18 1 1 A 67 67 VAL CB C 105 30.251 33.354 -3.103 1
1 783 . 18 1 1 A 67 67 VAL N N 105 114.671 121.050 -6.379 1
1 784 . 18 1 1 A 68 68 ASP H H 106 8.216 7.678 0.538 1
1 785 . 18 1 1 A 68 68 ASP HA H 106 4.474 4.607 -0.133 1
1 788 . 18 1 1 A 68 68 ASP C C 106 172.452 174.927 -2.475 1
1 789 . 18 1 1 A 68 68 ASP CA C 106 50.249 51.967 -1.718 1
1 790 . 18 1 1 A 68 68 ASP CB C 106 37.750 40.227 -2.477 1
1 791 . 18 1 1 A 68 68 ASP N N 106 123.825 125.442 -1.617 1
1 792 . 18 1 1 A 69 69 PRO HA H 107 3.920 3.947 -0.027 1
1 797 . 18 1 1 A 69 69 PRO CA C 107 62.123 62.903 -0.780 1
1 798 . 18 1 1 A 69 69 PRO CB C 107 27.751 31.166 -3.415 1
1 801 . 18 1 1 A 70 70 TRP H H 108 8.156 8.408 -0.252 1
1 802 . 18 1 1 A 70 70 TRP HA H 108 4.274 4.296 -0.022 1
1 811 . 18 1 1 A 70 70 TRP CA C 108 57.124 58.344 -1.220 1
1 812 . 18 1 1 A 70 70 TRP CB C 108 25.251 27.199 -1.948 1
1 813 . 18 1 1 A 70 70 TRP N N 108 118.137 118.541 -0.404 1
1 815 . 18 1 1 A 71 71 GLY H H 109 8.209 8.707 -0.498 1
1 816 . 18 1 1 A 71 71 GLY HA2 H 109 4.030 3.843 0.187 1
1 817 . 18 1 1 A 71 71 GLY HA3 H 109 3.303 3.878 -0.575 1
1 818 . 18 1 1 A 71 71 GLY CA C 109 42.750 45.623 -2.873 1
1 819 . 18 1 1 A 71 71 GLY N N 109 107.495 105.457 2.038 1
1 820 . 18 1 1 A 72 72 ASN H H 110 8.116 7.481 0.635 1
1 821 . 18 1 1 A 72 72 ASN HA H 110 5.103 4.844 0.259 1
1 826 . 18 1 1 A 72 72 ASN CA C 110 48.374 50.950 -2.576 1
1 827 . 18 1 1 A 72 72 ASN CB C 110 36.500 38.903 -2.403 1
1 828 . 18 1 1 A 72 72 ASN N N 110 120.108 119.915 0.193 1
1 830 . 18 1 1 A 73 73 PRO HA H 111 4.397 4.436 -0.039 1
1 835 . 18 1 1 A 73 73 PRO C C 111 176.229 176.569 -0.340 1
1 836 . 18 1 1 A 73 73 PRO CA C 111 60.249 62.654 -2.405 1
1 837 . 18 1 1 A 73 73 PRO CB C 111 29.001 31.837 -2.836 1
1 840 . 18 1 1 A 74 74 TYR H H 112 8.893 8.564 0.329 1
1 841 . 18 1 1 A 74 74 TYR HA H 112 4.064 4.763 -0.699 1
1 849 . 18 1 1 A 74 74 TYR C C 112 171.951 176.022 -4.071 1
1 850 . 18 1 1 A 74 74 TYR CA C 112 60.249 58.323 1.926 1
1 851 . 18 1 1 A 74 74 TYR CB C 112 36.500 39.313 -2.813 1
1 852 . 18 1 1 A 74 74 TYR N N 112 124.595 121.327 3.268 1
1 853 . 18 1 1 A 75 75 GLN H H 113 9.127 8.855 0.272 1
1 854 . 18 1 1 A 75 75 GLN HA H 113 4.019 4.321 -0.302 1
1 861 . 18 1 1 A 75 75 GLN C C 113 171.436 174.410 -2.974 1
1 862 . 18 1 1 A 75 75 GLN CA C 113 50.874 54.805 -3.931 1
1 863 . 18 1 1 A 75 75 GLN CB C 113 29.469 29.251 0.218 1
1 865 . 18 1 1 A 75 75 GLN N N 113 120.777 122.082 -1.305 1
1 867 . 18 1 1 A 76 76 TYR H H 114 7.906 8.248 -0.342 1
1 868 . 18 1 1 A 76 76 TYR HA H 114 5.586 5.596 -0.010 1
1 875 . 18 1 1 A 76 76 TYR C C 114 171.343 175.215 -3.872 1
1 876 . 18 1 1 A 76 76 TYR CA C 114 53.999 55.774 -1.775 1
1 877 . 18 1 1 A 76 76 TYR CB C 114 40.250 40.551 -0.301 1
1 878 . 18 1 1 A 76 76 TYR N N 114 120.757 122.284 -1.527 1
1 879 . 18 1 1 A 77 77 LEU H H 115 8.261 8.941 -0.680 1
1 880 . 18 1 1 A 77 77 LEU HA H 115 4.280 5.165 -0.885 1
1 890 . 18 1 1 A 77 77 LEU C C 115 170.921 175.906 -4.985 1
1 891 . 18 1 1 A 77 77 LEU CA C 115 51.499 53.597 -2.098 1
1 892 . 18 1 1 A 77 77 LEU CB C 115 44.625 45.367 -0.742 1
1 896 . 18 1 1 A 77 77 LEU N N 115 130.662 125.819 4.843 1
1 897 . 18 1 1 A 78 78 ALA H H 116 7.973 8.347 -0.374 1
1 898 . 18 1 1 A 78 78 ALA HA H 116 4.292 4.653 -0.361 1
1 902 . 18 1 1 A 78 78 ALA C C 116 172.093 175.153 -3.060 1
1 903 . 18 1 1 A 78 78 ALA CA C 116 47.749 50.123 -2.374 1
1 904 . 18 1 1 A 78 78 ALA CB C 116 19.626 20.189 -0.563 1
1 905 . 18 1 1 A 78 78 ALA N N 116 125.564 125.909 -0.345 1
1 906 . 18 1 1 A 79 79 PRO HA H 117 4.698 4.827 -0.129 1
1 911 . 18 1 1 A 79 79 PRO C C 117 173.994 176.743 -2.749 1
1 912 . 18 1 1 A 79 79 PRO CA C 117 60.249 63.804 -3.555 1
1 913 . 18 1 1 A 79 79 PRO CB C 117 31.501 31.946 -0.445 1
1 916 . 18 1 1 A 80 80 GLY H H 118 7.096 7.831 -0.735 1
1 917 . 18 1 1 A 80 80 GLY HA2 H 118 3.797 4.060 -0.263 1
1 918 . 18 1 1 A 80 80 GLY HA3 H 118 3.517 4.071 -0.554 1
1 919 . 18 1 1 A 80 80 GLY C C 118 171.404 174.372 -2.968 1
1 920 . 18 1 1 A 80 80 GLY CA C 118 41.500 46.076 -4.576 1
1 921 . 18 1 1 A 80 80 GLY N N 118 108.306 107.261 1.045 1
1 922 . 18 1 1 A 81 81 THR H H 119 9.810 8.465 1.345 1
1 923 . 18 1 1 A 81 81 THR HA H 119 4.091 4.570 -0.479 1
1 928 . 18 1 1 A 81 81 THR C C 119 174.242 175.275 -1.033 1
1 929 . 18 1 1 A 81 81 THR CA C 119 60.874 62.194 -1.320 1
1 930 . 18 1 1 A 81 81 THR CB C 119 66.498 68.047 -1.549 1
1 932 . 18 1 1 A 81 81 THR N N 119 112.813 115.523 -2.710 1
1 933 . 18 1 1 A 82 82 LYS H H 120 8.964 8.565 0.399 1
1 934 . 18 1 1 A 82 82 LYS HA H 120 4.150 3.984 0.166 1
1 941 . 18 1 1 A 82 82 LYS C C 120 172.886 175.555 -2.669 1
1 942 . 18 1 1 A 82 82 LYS CA C 120 53.999 58.106 -4.107 1
1 943 . 18 1 1 A 82 82 LYS CB C 120 30.876 30.516 0.360 1
1 944 . 18 1 1 A 82 82 LYS N N 120 123.569 124.349 -0.780 1
1 945 . 18 1 1 A 83 83 GLY H H 121 7.125 7.906 -0.781 1
1 946 . 18 1 1 A 83 83 GLY HA2 H 121 3.814 4.057 -0.243 1
1 947 . 18 1 1 A 83 83 GLY HA3 H 121 3.814 4.066 -0.252 1
1 948 . 18 1 1 A 83 83 GLY C C 121 167.671 174.420 -6.749 1
1 949 . 18 1 1 A 83 83 GLY CA C 121 42.125 45.034 -2.909 1
1 950 . 18 1 1 A 83 83 GLY N N 121 107.253 105.785 1.468 1
1 951 . 18 1 1 A 84 84 PRO HA H 122 4.077 4.261 -0.184 1
1 958 . 18 1 1 A 84 84 PRO C C 122 175.199 176.584 -1.385 1
1 959 . 18 1 1 A 84 84 PRO CA C 122 63.373 64.345 -0.972 1
1 960 . 18 1 1 A 84 84 PRO CB C 122 30.251 31.749 -1.498 1
1 962 . 18 1 1 A 85 85 PHE H H 123 6.652 6.536 0.116 1
1 963 . 18 1 1 A 85 85 PHE HA H 123 4.744 4.616 0.128 1
1 971 . 18 1 1 A 85 85 PHE C C 123 170.340 171.810 -1.470 1
1 972 . 18 1 1 A 85 85 PHE CA C 123 53.999 56.263 -2.264 1
1 973 . 18 1 1 A 85 85 PHE CB C 123 39.000 39.920 -0.920 1
1 974 . 18 1 1 A 85 85 PHE N N 123 108.468 112.303 -3.835 1
1 975 . 18 1 1 A 86 86 ASP H H 124 9.268 8.521 0.747 1
1 976 . 18 1 1 A 86 86 ASP HA H 124 5.108 3.638 1.470 1
1 979 . 18 1 1 A 86 86 ASP C C 124 171.180 174.365 -3.185 1
1 980 . 18 1 1 A 86 86 ASP CA C 124 50.249 52.997 -2.748 1
1 981 . 18 1 1 A 86 86 ASP CB C 124 40.250 41.758 -1.508 1
1 982 . 18 1 1 A 86 86 ASP N N 124 121.741 119.341 2.400 1
1 983 . 18 1 1 A 87 87 LEU H H 125 8.018 8.050 -0.032 1
1 984 . 18 1 1 A 87 87 LEU HA H 125 5.809 5.425 0.384 1
1 994 . 18 1 1 A 87 87 LEU C C 125 171.350 174.860 -3.510 1
1 995 . 18 1 1 A 87 87 LEU CA C 125 50.874 53.361 -2.487 1
1 996 . 18 1 1 A 87 87 LEU CB C 125 44.318 45.894 -1.576 1
1 999 . 18 1 1 A 87 87 LEU N N 125 123.629 127.165 -3.536 1
1 1000 . 18 1 1 A 88 88 TYR H H 126 8.912 8.460 0.452 1
1 1001 . 18 1 1 A 88 88 TYR HA H 126 5.630 5.647 -0.017 1
1 1008 . 18 1 1 A 88 88 TYR C C 126 171.410 172.229 -0.819 1
1 1009 . 18 1 1 A 88 88 TYR CA C 126 52.749 56.569 -3.820 1
1 1010 . 18 1 1 A 88 88 TYR CB C 126 37.750 40.605 -2.855 1
1 1011 . 18 1 1 A 88 88 TYR N N 126 119.697 121.445 -1.748 1
1 1012 . 18 1 1 A 89 89 SER H H 127 9.319 9.394 -0.075 1
1 1013 . 18 1 1 A 89 89 SER HA H 127 5.429 5.246 0.183 1
1 1016 . 18 1 1 A 89 89 SER CA C 127 52.124 56.317 -4.193 1
1 1017 . 18 1 1 A 89 89 SER CB C 127 62.748 65.901 -3.153 1
1 1018 . 18 1 1 A 89 89 SER N N 127 112.637 115.741 -3.104 1
1 1019 . 18 1 1 A 90 90 LEU H H 128 8.759 8.719 0.040 1
1 1020 . 18 1 1 A 90 90 LEU HA H 128 4.186 4.384 -0.198 1
1 1030 . 18 1 1 A 90 90 LEU C C 128 175.121 177.713 -2.592 1
1 1031 . 18 1 1 A 90 90 LEU CA C 128 52.749 55.118 -2.369 1
1 1032 . 18 1 1 A 90 90 LEU CB C 128 35.875 41.788 -5.913 1
1 1033 . 18 1 1 A 90 90 LEU N N 128 126.728 126.864 -0.136 1
1 1034 . 18 1 1 A 91 91 GLY H H 129 8.356 7.964 0.392 1
1 1035 . 18 1 1 A 91 91 GLY HA2 H 129 3.373 3.346 0.027 1
1 1036 . 18 1 1 A 91 91 GLY HA3 H 129 3.373 3.775 -0.402 1
1 1037 . 18 1 1 A 91 91 GLY C C 129 172.013 174.291 -2.278 1
1 1038 . 18 1 1 A 91 91 GLY CA C 129 41.500 44.183 -2.683 1
1 1039 . 18 1 1 A 91 91 GLY N N 129 108.559 110.241 -1.682 1
1 1040 . 18 1 1 A 92 92 ALA H H 130 7.047 8.098 -1.051 1
1 1041 . 18 1 1 A 92 92 ALA HA H 130 4.037 3.409 0.628 1
1 1045 . 18 1 1 A 92 92 ALA C C 130 174.890 177.578 -2.688 1
1 1046 . 18 1 1 A 92 92 ALA CA C 130 52.100 53.092 -0.992 1
1 1047 . 18 1 1 A 92 92 ALA CB C 130 16.502 18.031 -1.529 1
1 1048 . 18 1 1 A 92 92 ALA N N 130 118.393 122.044 -3.651 1
1 1049 . 18 1 1 A 93 93 ASP H H 131 7.222 7.597 -0.375 1
1 1050 . 18 1 1 A 93 93 ASP HA H 131 4.122 4.695 -0.573 1
1 1053 . 18 1 1 A 93 93 ASP C C 131 174.890 176.275 -1.385 1
1 1054 . 18 1 1 A 93 93 ASP CA C 131 50.249 53.703 -3.454 1
1 1055 . 18 1 1 A 93 93 ASP CB C 131 37.750 41.017 -3.267 1
1 1056 . 18 1 1 A 93 93 ASP N N 131 111.487 116.857 -5.370 1
1 1057 . 18 1 1 A 94 94 GLY H H 132 7.199 8.795 -1.596 1
1 1058 . 18 1 1 A 94 94 GLY HA2 H 132 3.951 3.904 0.047 1
1 1059 . 18 1 1 A 94 94 GLY HA3 H 132 3.324 3.914 -0.590 1
1 1060 . 18 1 1 A 94 94 GLY C C 132 169.773 173.809 -4.036 1
1 1061 . 18 1 1 A 94 94 GLY CA C 132 44.625 46.393 -1.768 1
1 1062 . 18 1 1 A 94 94 GLY N N 132 106.932 108.619 -1.687 1
1 1063 . 18 1 1 A 95 95 LYS H H 133 7.215 7.735 -0.520 1
1 1064 . 18 1 1 A 95 95 LYS HA H 133 4.513 4.830 -0.317 1
1 1073 . 18 1 1 A 95 95 LYS C C 133 172.108 175.020 -2.912 1
1 1074 . 18 1 1 A 95 95 LYS CA C 133 51.512 54.183 -2.671 1
1 1075 . 18 1 1 A 95 95 LYS CB C 133 34.000 36.147 -2.147 1
1 1076 . 18 1 1 A 95 95 LYS N N 133 115.749 119.333 -3.584 1
1 1077 . 18 1 1 A 96 96 GLU H H 134 9.230 8.738 0.492 1
1 1078 . 18 1 1 A 96 96 GLU HA H 134 4.352 4.835 -0.483 1
1 1083 . 18 1 1 A 96 96 GLU C C 134 175.219 175.406 -0.187 1
1 1084 . 18 1 1 A 96 96 GLU CA C 134 55.874 55.428 0.446 1
1 1085 . 18 1 1 A 96 96 GLU CB C 134 27.126 30.383 -3.257 1
1 1087 . 18 1 1 A 96 96 GLU N N 134 128.571 120.481 8.090 1
1 1088 . 18 1 1 A 97 97 GLY H H 135 10.677 8.391 2.286 1
1 1089 . 18 1 1 A 97 97 GLY HA2 H 135 4.037 4.295 -0.258 1
1 1090 . 18 1 1 A 97 97 GLY HA3 H 135 3.717 4.302 -0.585 1
1 1091 . 18 1 1 A 97 97 GLY C C 135 171.567 172.266 -0.699 1
1 1092 . 18 1 1 A 97 97 GLY CA C 135 41.500 45.750 -4.250 1
1 1093 . 18 1 1 A 97 97 GLY N N 135 117.011 110.560 6.451 1
1 1094 . 18 1 1 A 98 98 GLY H H 136 8.442 8.661 -0.219 1
1 1095 . 18 1 1 A 98 98 GLY HA2 H 136 4.195 4.215 -0.020 1
1 1096 . 18 1 1 A 98 98 GLY HA3 H 136 4.195 4.215 -0.020 1
1 1097 . 18 1 1 A 98 98 GLY C C 136 170.299 173.298 -2.999 1
1 1098 . 18 1 1 A 98 98 GLY CA C 136 40.875 44.782 -3.907 1
1 1099 . 18 1 1 A 98 98 GLY N N 136 109.494 109.186 0.308 1
1 1100 . 18 1 1 A 99 99 SER H H 137 8.701 8.726 -0.025 1
1 1101 . 18 1 1 A 99 99 SER HA H 137 4.639 4.913 -0.274 1
1 1104 . 18 1 1 A 99 99 SER C C 137 170.630 173.265 -2.635 1
1 1105 . 18 1 1 A 99 99 SER CA C 137 54.624 57.640 -3.016 1
1 1106 . 18 1 1 A 99 99 SER CB C 137 62.748 66.566 -3.818 1
1 1107 . 18 1 1 A 99 99 SER N N 137 114.685 118.307 -3.622 1
1 1108 . 18 1 1 A 100 100 ASP H H 138 9.117 8.945 0.172 1
1 1109 . 18 1 1 A 100 100 ASP HA H 138 3.965 4.579 -0.614 1
1 1112 . 18 1 1 A 100 100 ASP C C 138 175.540 178.081 -2.541 1
1 1113 . 18 1 1 A 100 100 ASP CA C 138 54.624 56.299 -1.675 1
1 1114 . 18 1 1 A 100 100 ASP CB C 138 36.500 41.058 -4.558 1
1 1115 . 18 1 1 A 100 100 ASP N N 138 120.777 122.610 -1.833 1
1 1116 . 18 1 1 A 101 101 ASN H H 139 8.667 7.898 0.769 1
1 1117 . 18 1 1 A 101 101 ASN HA H 139 4.333 4.703 -0.370 1
1 1122 . 18 1 1 A 101 101 ASN CA C 139 53.999 55.492 -1.493 1
1 1123 . 18 1 1 A 101 101 ASN CB C 139 34.625 38.721 -4.096 1
1 1124 . 18 1 1 A 101 101 ASN N N 139 121.930 117.647 4.283 1
1 1126 . 18 1 1 A 102 102 ASP H H 140 7.714 7.761 -0.047 1
1 1127 . 18 1 1 A 102 102 ASP HA H 140 4.037 4.484 -0.447 1
1 1130 . 18 1 1 A 102 102 ASP C C 140 172.807 175.679 -2.872 1
1 1131 . 18 1 1 A 102 102 ASP CA C 140 53.374 54.075 -0.701 1
1 1132 . 18 1 1 A 102 102 ASP CB C 140 37.125 41.421 -4.296 1
1 1133 . 18 1 1 A 102 102 ASP N N 140 118.011 116.729 1.282 1
1 1134 . 18 1 1 A 103 103 ALA H H 141 7.060 7.269 -0.209 1
1 1135 . 18 1 1 A 103 103 ALA HA H 141 3.353 4.475 -1.122 1
1 1139 . 18 1 1 A 103 103 ALA C C 141 172.233 176.371 -4.138 1
1 1140 . 18 1 1 A 103 103 ALA CA C 141 49.624 50.706 -1.082 1
1 1141 . 18 1 1 A 103 103 ALA CB C 141 16.502 21.932 -5.430 1
1 1142 . 18 1 1 A 103 103 ALA N N 141 125.777 122.233 3.544 1
1 1143 . 18 1 1 A 104 104 ASP H H 142 7.973 7.988 -0.015 1
1 1144 . 18 1 1 A 104 104 ASP HA H 142 4.420 5.206 -0.786 1
1 1147 . 18 1 1 A 104 104 ASP C C 142 174.188 176.128 -1.940 1
1 1148 . 18 1 1 A 104 104 ASP CA C 142 52.124 53.859 -1.735 1
1 1149 . 18 1 1 A 104 104 ASP CB C 142 37.125 41.489 -4.364 1
1 1150 . 18 1 1 A 104 104 ASP N N 142 122.965 120.141 2.824 1
1 1151 . 18 1 1 A 105 105 ILE H H 143 8.534 8.631 -0.097 1
1 1152 . 18 1 1 A 105 105 ILE HA H 143 4.060 5.004 -0.944 1
1 1162 . 18 1 1 A 105 105 ILE C C 143 173.235 176.008 -2.773 1
1 1163 . 18 1 1 A 105 105 ILE CA C 143 58.374 59.919 -1.545 1
1 1164 . 18 1 1 A 105 105 ILE CB C 143 39.123 39.618 -0.495 1
1 1167 . 18 1 1 A 105 105 ILE N N 143 124.757 121.119 3.638 1
1 1168 . 18 1 1 A 106 106 GLY H H 144 8.288 8.516 -0.228 1
1 1169 . 18 1 1 A 106 106 GLY HA2 H 144 4.764 4.616 0.148 1
1 1170 . 18 1 1 A 106 106 GLY HA3 H 144 4.764 4.688 0.076 1
1 1171 . 18 1 1 A 106 106 GLY C C 144 171.321 172.327 -1.006 1
1 1172 . 18 1 1 A 106 106 GLY CA C 144 40.250 45.481 -5.231 1
1 1173 . 18 1 1 A 106 106 GLY N N 144 110.895 110.657 0.238 1
1 1174 . 18 1 1 A 107 107 ASN H H 145 8.577 8.921 -0.344 1
1 1175 . 18 1 1 A 107 107 ASN HA H 145 4.268 5.869 -1.601 1
1 1180 . 18 1 1 A 107 107 ASN C C 145 171.757 173.768 -2.011 1
1 1181 . 18 1 1 A 107 107 ASN CA C 145 52.124 52.180 -0.056 1
1 1182 . 18 1 1 A 107 107 ASN CB C 145 34.625 42.740 -8.115 1
1 1183 . 18 1 1 A 107 107 ASN N N 145 118.042 118.330 -0.288 1
1 1185 . 18 1 1 A 108 108 TRP H H 146 6.822 8.948 -2.126 1
1 1186 . 18 1 1 A 108 108 TRP HA H 146 4.513 5.182 -0.669 1
1 1195 . 18 1 1 A 108 108 TRP C C 146 172.665 173.326 -0.661 1
1 1196 . 18 1 1 A 108 108 TRP CA C 146 54.624 56.408 -1.784 1
1 1197 . 18 1 1 A 108 108 TRP CB C 146 25.876 33.298 -7.422 1
1 1198 . 18 1 1 A 108 108 TRP N N 146 116.756 126.123 -9.367 1
1 1200 . 18 1 1 A 109 109 ASP H H 147 7.344 7.427 -0.083 1
1 1201 . 18 1 1 A 109 109 ASP HA H 147 4.655 4.818 -0.163 1
1 1204 . 18 1 1 A 109 109 ASP C C 147 172.193 174.991 -2.798 1
1 1205 . 18 1 1 A 109 109 ASP CA C 147 51.499 52.193 -0.694 1
1 1206 . 18 1 1 A 109 109 ASP CB C 147 39.000 41.108 -2.108 1
1 1207 . 18 1 1 A 109 109 ASP N N 147 121.461 128.043 -6.582 1
1 11 . 19 1 1 A 2 2 SER H H 40 8.461 8.814 -0.353 1
1 12 . 19 1 1 A 2 2 SER HA H 40 4.286 5.092 -0.806 1
1 15 . 19 1 1 A 2 2 SER C C 40 171.276 172.984 -1.708 1
1 16 . 19 1 1 A 2 2 SER CA C 40 55.249 58.076 -2.827 1
1 17 . 19 1 1 A 2 2 SER CB C 40 61.498 62.606 -1.108 1
1 18 . 19 1 1 A 2 2 SER N N 40 118.344 121.814 -3.470 1
1 19 . 19 1 1 A 3 3 ARG H H 41 8.469 8.534 -0.065 1
1 20 . 19 1 1 A 3 3 ARG HA H 41 4.400 4.935 -0.535 1
1 25 . 19 1 1 A 3 3 ARG C C 41 172.251 174.090 -1.839 1
1 26 . 19 1 1 A 3 3 ARG CA C 41 52.749 53.945 -1.196 1
1 27 . 19 1 1 A 3 3 ARG CB C 41 27.126 32.894 -5.768 1
1 28 . 19 1 1 A 3 3 ARG N N 41 123.070 121.726 1.344 1
1 33 . 19 1 1 A 4 4 PRO CA C 42 61.498 63.949 -2.451 1
1 34 . 19 1 1 A 4 4 PRO CB C 42 29.001 31.663 -2.662 1
1 37 . 19 1 1 A 5 5 ASP H H 43 8.246 8.923 -0.677 1
1 38 . 19 1 1 A 5 5 ASP HA H 43 4.329 4.575 -0.246 1
1 41 . 19 1 1 A 5 5 ASP C C 43 174.605 177.300 -2.695 1
1 42 . 19 1 1 A 5 5 ASP CA C 43 53.374 55.959 -2.585 1
1 43 . 19 1 1 A 5 5 ASP CB C 43 38.375 40.601 -2.226 1
1 44 . 19 1 1 A 5 5 ASP N N 43 119.409 123.728 -4.319 1
1 45 . 19 1 1 A 6 6 GLN H H 44 8.309 8.464 -0.155 1
1 46 . 19 1 1 A 6 6 GLN HA H 44 4.393 4.234 0.159 1
1 53 . 19 1 1 A 6 6 GLN C C 44 175.053 178.575 -3.522 1
1 54 . 19 1 1 A 6 6 GLN CA C 44 55.874 58.276 -2.402 1
1 55 . 19 1 1 A 6 6 GLN CB C 44 25.876 28.221 -2.345 1
1 57 . 19 1 1 A 6 6 GLN N N 44 122.273 117.730 4.543 1
1 59 . 19 1 1 A 7 7 ALA H H 45 8.106 8.316 -0.210 1
1 60 . 19 1 1 A 7 7 ALA HA H 45 3.993 4.038 -0.045 1
1 64 . 19 1 1 A 7 7 ALA C C 45 177.465 178.408 -0.943 1
1 65 . 19 1 1 A 7 7 ALA CA C 45 52.124 54.770 -2.646 1
1 66 . 19 1 1 A 7 7 ALA CB C 45 15.252 18.019 -2.767 1
1 67 . 19 1 1 A 7 7 ALA N N 45 122.204 122.031 0.173 1
1 68 . 19 1 1 A 8 8 LYS H H 46 7.527 7.838 -0.311 1
1 69 . 19 1 1 A 8 8 LYS HA H 46 3.539 4.055 -0.516 1
1 78 . 19 1 1 A 8 8 LYS C C 46 175.412 179.102 -3.690 1
1 79 . 19 1 1 A 8 8 LYS CA C 46 57.124 58.473 -1.349 1
1 80 . 19 1 1 A 8 8 LYS CB C 46 30.876 31.866 -0.990 1
1 83 . 19 1 1 A 8 8 LYS N N 46 117.358 117.131 0.227 1
1 84 . 19 1 1 A 9 9 VAL H H 47 7.709 8.128 -0.419 1
1 85 . 19 1 1 A 9 9 VAL HA H 47 3.578 3.872 -0.294 1
1 93 . 19 1 1 A 9 9 VAL C C 47 175.005 178.519 -3.514 1
1 94 . 19 1 1 A 9 9 VAL CA C 47 64.623 66.249 -1.626 1
1 95 . 19 1 1 A 9 9 VAL CB C 47 29.001 31.836 -2.835 1
1 98 . 19 1 1 A 9 9 VAL N N 47 119.115 120.421 -1.306 1
1 99 . 19 1 1 A 10 10 THR H H 48 7.767 8.157 -0.390 1
1 100 . 19 1 1 A 10 10 THR HA H 48 3.668 4.046 -0.378 1
1 105 . 19 1 1 A 10 10 THR CA C 48 63.998 65.813 -1.815 1
1 106 . 19 1 1 A 10 10 THR CB C 48 67.123 68.708 -1.585 1
1 108 . 19 1 1 A 10 10 THR N N 48 115.112 113.854 1.258 1
1 109 . 19 1 1 A 11 11 VAL H H 49 7.598 7.587 0.011 1
1 110 . 19 1 1 A 11 11 VAL HA H 49 3.457 3.841 -0.384 1
1 118 . 19 1 1 A 11 11 VAL C C 49 175.412 177.877 -2.465 1
1 119 . 19 1 1 A 11 11 VAL CA C 49 63.998 64.767 -0.769 1
1 120 . 19 1 1 A 11 11 VAL CB C 49 29.001 31.507 -2.506 1
1 123 . 19 1 1 A 11 11 VAL N N 49 123.694 119.710 3.984 1
1 124 . 19 1 1 A 12 12 ALA H H 50 8.176 7.953 0.223 1
1 125 . 19 1 1 A 12 12 ALA HA H 50 4.742 4.038 0.704 1
1 129 . 19 1 1 A 12 12 ALA C C 50 177.074 179.807 -2.733 1
1 130 . 19 1 1 A 12 12 ALA CA C 50 52.124 55.060 -2.936 1
1 131 . 19 1 1 A 12 12 ALA CB C 50 15.252 18.589 -3.337 1
1 132 . 19 1 1 A 12 12 ALA N N 50 122.348 122.913 -0.565 1
1 133 . 19 1 1 A 13 13 LYS H H 51 8.499 7.861 0.638 1
1 134 . 19 1 1 A 13 13 LYS HA H 51 3.648 4.092 -0.444 1
1 143 . 19 1 1 A 13 13 LYS C C 51 177.252 179.848 -2.596 1
1 144 . 19 1 1 A 13 13 LYS CA C 51 58.072 59.490 -1.418 1
1 145 . 19 1 1 A 13 13 LYS CB C 51 30.251 32.274 -2.023 1
1 146 . 19 1 1 A 13 13 LYS N N 51 115.402 117.163 -1.761 1
1 147 . 19 1 1 A 14 14 GLY H H 52 7.858 8.240 -0.382 1
1 148 . 19 1 1 A 14 14 GLY HA2 H 52 3.823 3.784 0.039 1
1 149 . 19 1 1 A 14 14 GLY HA3 H 52 3.676 3.786 -0.110 1
1 150 . 19 1 1 A 14 14 GLY C C 52 174.090 175.588 -1.498 1
1 151 . 19 1 1 A 14 14 GLY CA C 52 44.625 46.925 -2.300 1
1 152 . 19 1 1 A 14 14 GLY N N 52 107.466 108.907 -1.441 1
1 153 . 19 1 1 A 15 15 ASP H H 53 8.403 7.579 0.824 1
1 154 . 19 1 1 A 15 15 ASP HA H 53 4.191 4.371 -0.180 1
1 157 . 19 1 1 A 15 15 ASP C C 53 175.316 179.108 -3.792 1
1 158 . 19 1 1 A 15 15 ASP CA C 53 54.624 56.593 -1.969 1
1 159 . 19 1 1 A 15 15 ASP CB C 53 35.875 40.925 -5.050 1
1 160 . 19 1 1 A 15 15 ASP N N 53 125.929 121.724 4.205 1
1 161 . 19 1 1 A 16 16 ILE H H 54 8.245 8.196 0.049 1
1 162 . 19 1 1 A 16 16 ILE HA H 54 3.034 3.723 -0.689 1
1 172 . 19 1 1 A 16 16 ILE C C 54 174.499 178.356 -3.857 1
1 173 . 19 1 1 A 16 16 ILE CA C 54 62.748 64.321 -1.573 1
1 174 . 19 1 1 A 16 16 ILE CB C 54 34.625 37.545 -2.920 1
1 178 . 19 1 1 A 16 16 ILE N N 54 119.456 116.900 2.556 1
1 179 . 19 1 1 A 17 17 LYS H H 55 7.547 7.593 -0.046 1
1 180 . 19 1 1 A 17 17 LYS HA H 55 3.843 4.351 -0.508 1
1 187 . 19 1 1 A 17 17 LYS C C 55 176.651 179.235 -2.584 1
1 188 . 19 1 1 A 17 17 LYS CA C 55 57.124 59.220 -2.096 1
1 189 . 19 1 1 A 17 17 LYS CB C 55 30.251 32.099 -1.848 1
1 190 . 19 1 1 A 17 17 LYS N N 55 118.505 121.513 -3.008 1
1 191 . 19 1 1 A 18 18 ALA H H 56 7.680 7.710 -0.030 1
1 192 . 19 1 1 A 18 18 ALA HA H 56 4.029 4.040 -0.011 1
1 196 . 19 1 1 A 18 18 ALA C C 56 176.638 179.946 -3.308 1
1 197 . 19 1 1 A 18 18 ALA CA C 56 52.749 54.785 -2.036 1
1 198 . 19 1 1 A 18 18 ALA CB C 56 15.877 18.124 -2.247 1
1 199 . 19 1 1 A 18 18 ALA N N 56 122.477 122.259 0.218 1
1 200 . 19 1 1 A 19 19 ILE H H 57 8.853 7.965 0.888 1
1 201 . 19 1 1 A 19 19 ILE HA H 57 3.304 3.557 -0.253 1
1 211 . 19 1 1 A 19 19 ILE C C 57 174.710 177.729 -3.019 1
1 212 . 19 1 1 A 19 19 ILE CA C 57 63.373 65.456 -2.083 1
1 213 . 19 1 1 A 19 19 ILE CB C 57 35.250 37.909 -2.659 1
1 217 . 19 1 1 A 19 19 ILE N N 57 120.901 118.404 2.497 1
1 218 . 19 1 1 A 20 20 ALA H H 58 8.702 8.194 0.508 1
1 219 . 19 1 1 A 20 20 ALA HA H 58 3.900 3.965 -0.065 1
1 223 . 19 1 1 A 20 20 ALA C C 58 176.512 180.050 -3.538 1
1 224 . 19 1 1 A 20 20 ALA CA C 58 52.749 55.279 -2.530 1
1 225 . 19 1 1 A 20 20 ALA CB C 58 15.252 18.250 -2.998 1
1 226 . 19 1 1 A 20 20 ALA N N 58 121.763 122.274 -0.511 1
1 227 . 19 1 1 A 21 21 ALA H H 59 7.662 7.902 -0.240 1
1 228 . 19 1 1 A 21 21 ALA HA H 59 4.136 4.208 -0.072 1
1 232 . 19 1 1 A 21 21 ALA C C 59 177.949 179.871 -1.922 1
1 233 . 19 1 1 A 21 21 ALA CA C 59 52.749 54.886 -2.137 1
1 234 . 19 1 1 A 21 21 ALA CB C 59 15.252 18.436 -3.184 1
1 235 . 19 1 1 A 21 21 ALA N N 59 119.079 119.732 -0.653 1
1 236 . 19 1 1 A 22 22 ALA H H 60 7.403 7.642 -0.239 1
1 237 . 19 1 1 A 22 22 ALA HA H 60 4.318 4.166 0.152 1
1 241 . 19 1 1 A 22 22 ALA C C 60 176.730 180.539 -3.809 1
1 242 . 19 1 1 A 22 22 ALA CA C 60 52.749 54.380 -1.631 1
1 243 . 19 1 1 A 22 22 ALA CB C 60 17.126 18.606 -1.480 1
1 244 . 19 1 1 A 22 22 ALA N N 60 122.616 120.167 2.449 1
1 245 . 19 1 1 A 23 23 LEU H H 61 8.410 8.413 -0.003 1
1 246 . 19 1 1 A 23 23 LEU HA H 61 3.527 4.007 -0.480 1
1 256 . 19 1 1 A 23 23 LEU C C 61 176.057 178.421 -2.364 1
1 257 . 19 1 1 A 23 23 LEU CA C 61 55.249 57.367 -2.118 1
1 258 . 19 1 1 A 23 23 LEU CB C 61 39.000 41.097 -2.097 1
1 262 . 19 1 1 A 23 23 LEU N N 61 120.761 120.972 -0.211 1
1 263 . 19 1 1 A 24 24 ASP H H 62 8.227 7.978 0.249 1
1 264 . 19 1 1 A 24 24 ASP HA H 62 4.581 4.464 0.117 1
1 267 . 19 1 1 A 24 24 ASP C C 62 176.968 177.918 -0.950 1
1 268 . 19 1 1 A 24 24 ASP CA C 62 55.874 57.177 -1.303 1
1 269 . 19 1 1 A 24 24 ASP CB C 62 37.750 41.462 -3.712 1
1 270 . 19 1 1 A 24 24 ASP N N 62 119.068 119.201 -0.133 1
1 271 . 19 1 1 A 25 25 MET H H 63 7.718 7.815 -0.097 1
1 272 . 19 1 1 A 25 25 MET HA H 63 4.196 4.133 0.063 1
1 277 . 19 1 1 A 25 25 MET C C 63 174.968 177.653 -2.685 1
1 278 . 19 1 1 A 25 25 MET CA C 63 55.249 58.032 -2.783 1
1 279 . 19 1 1 A 25 25 MET CB C 63 29.626 32.287 -2.661 1
1 281 . 19 1 1 A 25 25 MET N N 63 121.365 119.592 1.773 1
1 282 . 19 1 1 A 26 26 TYR H H 64 8.401 7.703 0.698 1
1 283 . 19 1 1 A 26 26 TYR HA H 64 4.400 3.542 0.858 1
1 291 . 19 1 1 A 26 26 TYR C C 64 176.098 177.470 -1.372 1
1 292 . 19 1 1 A 26 26 TYR CA C 64 58.999 60.683 -1.684 1
1 293 . 19 1 1 A 26 26 TYR CB C 64 35.250 38.363 -3.113 1
1 294 . 19 1 1 A 26 26 TYR N N 64 122.575 120.756 1.819 1
1 295 . 19 1 1 A 27 27 LYS H H 65 8.330 8.225 0.105 1
1 296 . 19 1 1 A 27 27 LYS HA H 65 3.568 4.288 -0.720 1
1 302 . 19 1 1 A 27 27 LYS C C 65 176.156 178.193 -2.037 1
1 303 . 19 1 1 A 27 27 LYS CA C 65 56.499 58.925 -2.426 1
1 304 . 19 1 1 A 27 27 LYS CB C 65 29.626 31.902 -2.276 1
1 306 . 19 1 1 A 27 27 LYS N N 65 121.390 119.153 2.237 1
1 307 . 19 1 1 A 28 28 LEU H H 66 7.833 7.240 0.593 1
1 308 . 19 1 1 A 28 28 LEU HA H 66 3.769 4.053 -0.284 1
1 318 . 19 1 1 A 28 28 LEU C C 66 175.925 177.854 -1.929 1
1 319 . 19 1 1 A 28 28 LEU CA C 66 55.874 56.836 -0.962 1
1 320 . 19 1 1 A 28 28 LEU CB C 66 38.375 42.503 -4.128 1
1 324 . 19 1 1 A 28 28 LEU N N 66 123.068 120.480 2.588 1
1 325 . 19 1 1 A 29 29 ASP H H 67 7.292 7.650 -0.358 1
1 326 . 19 1 1 A 29 29 ASP HA H 67 4.096 4.316 -0.220 1
1 329 . 19 1 1 A 29 29 ASP C C 67 174.618 176.582 -1.964 1
1 330 . 19 1 1 A 29 29 ASP CA C 67 53.999 56.365 -2.366 1
1 331 . 19 1 1 A 29 29 ASP CB C 67 38.375 40.890 -2.515 1
1 332 . 19 1 1 A 29 29 ASP N N 67 114.729 118.605 -3.876 1
1 333 . 19 1 1 A 30 30 ASN H H 68 8.097 7.462 0.635 1
1 334 . 19 1 1 A 30 30 ASN HA H 68 4.337 4.404 -0.067 1
1 339 . 19 1 1 A 30 30 ASN C C 68 172.822 174.155 -1.333 1
1 340 . 19 1 1 A 30 30 ASN CA C 68 52.124 51.852 0.272 1
1 341 . 19 1 1 A 30 30 ASN CB C 68 37.750 38.385 -0.635 1
1 342 . 19 1 1 A 30 30 ASN N N 68 111.054 115.017 -3.963 1
1 344 . 19 1 1 A 31 31 PHE H H 69 8.249 7.888 0.361 1
1 345 . 19 1 1 A 31 31 PHE HA H 69 4.135 4.423 -0.288 1
1 353 . 19 1 1 A 31 31 PHE C C 69 170.485 174.211 -3.726 1
1 354 . 19 1 1 A 31 31 PHE CA C 69 57.749 58.705 -0.956 1
1 355 . 19 1 1 A 31 31 PHE CB C 69 33.375 36.555 -3.180 1
1 356 . 19 1 1 A 31 31 PHE N N 69 116.277 117.174 -0.897 1
1 357 . 19 1 1 A 32 32 ALA H H 70 7.224 7.053 0.171 1
1 358 . 19 1 1 A 32 32 ALA HA H 70 4.194 4.488 -0.294 1
1 362 . 19 1 1 A 32 32 ALA C C 70 173.337 175.042 -1.705 1
1 363 . 19 1 1 A 32 32 ALA CA C 70 48.374 51.519 -3.145 1
1 364 . 19 1 1 A 32 32 ALA CB C 70 19.626 22.318 -2.692 1
1 365 . 19 1 1 A 32 32 ALA N N 70 119.914 120.301 -0.387 1
1 366 . 19 1 1 A 33 33 TYR H H 71 7.948 8.376 -0.428 1
1 367 . 19 1 1 A 33 33 TYR HA H 71 4.209 4.981 -0.772 1
1 374 . 19 1 1 A 33 33 TYR C C 71 170.591 174.210 -3.619 1
1 375 . 19 1 1 A 33 33 TYR CA C 71 54.624 56.436 -1.812 1
1 376 . 19 1 1 A 33 33 TYR CB C 71 34.000 37.853 -3.853 1
1 377 . 19 1 1 A 33 33 TYR N N 71 116.929 117.996 -1.067 1
1 378 . 19 1 1 A 34 34 PRO HA H 72 4.444 4.802 -0.358 1
1 381 . 19 1 1 A 34 34 PRO C C 72 174.775 176.417 -1.642 1
1 382 . 19 1 1 A 34 34 PRO CA C 72 59.624 62.482 -2.858 1
1 383 . 19 1 1 A 34 34 PRO CB C 72 28.376 32.337 -3.961 1
1 384 . 19 1 1 A 35 35 SER H H 73 8.721 8.433 0.288 1
1 385 . 19 1 1 A 35 35 SER HA H 73 4.467 4.728 -0.261 1
1 388 . 19 1 1 A 35 35 SER C C 73 173.271 175.291 -2.020 1
1 389 . 19 1 1 A 35 35 SER CA C 73 55.249 56.829 -1.580 1
1 390 . 19 1 1 A 35 35 SER CB C 73 63.373 65.610 -2.237 1
1 391 . 19 1 1 A 35 35 SER N N 73 118.284 114.842 3.442 1
1 392 . 19 1 1 A 36 36 THR H H 74 8.591 8.789 -0.198 1
1 393 . 19 1 1 A 36 36 THR HA H 74 3.649 4.203 -0.554 1
1 398 . 19 1 1 A 36 36 THR CA C 74 64.623 63.844 0.779 1
1 399 . 19 1 1 A 36 36 THR CB C 74 66.498 68.987 -2.489 1
1 401 . 19 1 1 A 36 36 THR N N 74 117.769 117.179 0.590 1
1 402 . 19 1 1 A 37 37 GLN H H 75 8.210 8.064 0.146 1
1 403 . 19 1 1 A 37 37 GLN HA H 75 3.860 4.355 -0.495 1
1 410 . 19 1 1 A 37 37 GLN C C 75 175.349 178.141 -2.792 1
1 411 . 19 1 1 A 37 37 GLN CA C 75 56.499 57.586 -1.087 1
1 412 . 19 1 1 A 37 37 GLN CB C 75 25.876 29.910 -4.034 1
1 414 . 19 1 1 A 37 37 GLN N N 75 117.931 121.058 -3.127 1
1 416 . 19 1 1 A 38 38 GLN H H 76 7.667 8.132 -0.465 1
1 417 . 19 1 1 A 38 38 GLN HA H 76 3.810 4.135 -0.325 1
1 424 . 19 1 1 A 38 38 GLN C C 76 175.805 179.179 -3.374 1
1 425 . 19 1 1 A 38 38 GLN CA C 76 55.874 58.074 -2.200 1
1 426 . 19 1 1 A 38 38 GLN CB C 76 25.876 28.497 -2.621 1
1 428 . 19 1 1 A 38 38 GLN N N 76 120.607 117.691 2.916 1
1 430 . 19 1 1 A 39 39 GLY H H 77 8.470 8.320 0.150 1
1 431 . 19 1 1 A 39 39 GLY HA2 H 77 3.920 3.784 0.136 1
1 432 . 19 1 1 A 39 39 GLY HA3 H 77 3.603 3.792 -0.189 1
1 433 . 19 1 1 A 39 39 GLY C C 77 169.006 175.500 -6.494 1
1 434 . 19 1 1 A 39 39 GLY CA C 77 42.125 46.514 -4.389 1
1 435 . 19 1 1 A 39 39 GLY N N 77 103.281 109.568 -6.287 1
1 436 . 19 1 1 A 40 40 LEU H H 78 8.135 7.970 0.165 1
1 437 . 19 1 1 A 40 40 LEU HA H 78 3.237 4.134 -0.897 1
1 447 . 19 1 1 A 40 40 LEU C C 78 176.383 178.302 -1.919 1
1 448 . 19 1 1 A 40 40 LEU CA C 78 52.749 57.155 -4.406 1
1 449 . 19 1 1 A 40 40 LEU CB C 78 39.000 41.505 -2.505 1
1 453 . 19 1 1 A 40 40 LEU N N 78 114.444 123.341 -8.897 1
1 454 . 19 1 1 A 41 41 GLU H H 79 8.578 8.496 0.082 1
1 455 . 19 1 1 A 41 41 GLU HA H 79 3.720 4.024 -0.304 1
1 460 . 19 1 1 A 41 41 GLU C C 79 175.093 178.325 -3.232 1
1 461 . 19 1 1 A 41 41 GLU CA C 79 57.124 59.541 -2.417 1
1 462 . 19 1 1 A 41 41 GLU CB C 79 26.501 29.443 -2.942 1
1 464 . 19 1 1 A 41 41 GLU N N 79 118.295 119.147 -0.852 1
1 465 . 19 1 1 A 42 42 ALA H H 80 7.227 7.840 -0.613 1
1 466 . 19 1 1 A 42 42 ALA HA H 80 4.437 4.532 -0.095 1
1 470 . 19 1 1 A 42 42 ALA C C 80 173.745 178.091 -4.346 1
1 471 . 19 1 1 A 42 42 ALA CA C 80 51.499 53.530 -2.031 1
1 472 . 19 1 1 A 42 42 ALA CB C 80 15.877 18.596 -2.719 1
1 473 . 19 1 1 A 42 42 ALA N N 80 119.751 121.238 -1.487 1
1 474 . 19 1 1 A 43 43 LEU H H 81 7.932 7.516 0.416 1
1 475 . 19 1 1 A 43 43 LEU HA H 81 4.369 4.407 -0.038 1
1 485 . 19 1 1 A 43 43 LEU C C 81 174.788 178.206 -3.418 1
1 486 . 19 1 1 A 43 43 LEU CA C 81 53.374 55.856 -2.482 1
1 487 . 19 1 1 A 43 43 LEU CB C 81 39.625 42.338 -2.713 1
1 491 . 19 1 1 A 43 43 LEU N N 81 111.742 116.520 -4.778 1
1 492 . 19 1 1 A 44 44 VAL H H 82 7.886 7.487 0.399 1
1 493 . 19 1 1 A 44 44 VAL HA H 82 4.700 4.321 0.379 1
1 501 . 19 1 1 A 44 44 VAL C C 82 172.875 175.977 -3.102 1
1 502 . 19 1 1 A 44 44 VAL CA C 82 59.624 63.870 -4.246 1
1 503 . 19 1 1 A 44 44 VAL CB C 82 31.501 33.376 -1.875 1
1 506 . 19 1 1 A 44 44 VAL N N 82 113.604 115.809 -2.205 1
1 507 . 19 1 1 A 45 45 LYS H H 83 8.361 8.342 0.019 1
1 508 . 19 1 1 A 45 45 LYS HA H 83 4.251 4.907 -0.656 1
1 515 . 19 1 1 A 45 45 LYS C C 83 171.053 174.912 -3.859 1
1 516 . 19 1 1 A 45 45 LYS CA C 83 52.749 54.207 -1.458 1
1 517 . 19 1 1 A 45 45 LYS CB C 83 33.375 35.783 -2.408 1
1 521 . 19 1 1 A 45 45 LYS N N 83 123.860 121.709 2.151 1
1 522 . 19 1 1 A 46 46 LYS H H 84 7.243 8.093 -0.850 1
1 523 . 19 1 1 A 46 46 LYS HA H 84 2.175 2.461 -0.286 1
1 532 . 19 1 1 A 46 46 LYS C C 84 172.123 174.675 -2.552 1
1 533 . 19 1 1 A 46 46 LYS CA C 84 52.749 53.687 -0.938 1
1 534 . 19 1 1 A 46 46 LYS CB C 84 29.626 32.478 -2.852 1
1 537 . 19 1 1 A 46 46 LYS N N 84 128.615 126.520 2.095 1
1 538 . 19 1 1 A 47 47 PRO HA H 85 4.470 4.296 0.174 1
1 541 . 19 1 1 A 47 47 PRO C C 85 173.754 176.252 -2.498 1
1 542 . 19 1 1 A 47 47 PRO CA C 85 60.874 63.135 -2.261 1
1 543 . 19 1 1 A 47 47 PRO CB C 85 30.876 31.969 -1.093 1
1 546 . 19 1 1 A 48 48 THR H H 86 8.306 8.253 0.053 1
1 547 . 19 1 1 A 48 48 THR HA H 86 4.287 4.801 -0.514 1
1 552 . 19 1 1 A 48 48 THR C C 86 173.070 173.865 -0.795 1
1 553 . 19 1 1 A 48 48 THR CA C 86 57.749 60.691 -2.942 1
1 554 . 19 1 1 A 48 48 THR CB C 86 67.748 69.180 -1.432 1
1 556 . 19 1 1 A 48 48 THR N N 86 109.564 112.114 -2.550 1
1 557 . 19 1 1 A 49 49 GLY H H 87 8.317 8.146 0.171 1
1 558 . 19 1 1 A 49 49 GLY HA2 H 87 3.851 4.183 -0.332 1
1 559 . 19 1 1 A 49 49 GLY HA3 H 87 3.678 4.193 -0.515 1
1 560 . 19 1 1 A 49 49 GLY C C 87 169.693 171.777 -2.084 1
1 561 . 19 1 1 A 49 49 GLY CA C 87 42.125 46.105 -3.980 1
1 562 . 19 1 1 A 49 49 GLY N N 87 109.071 110.398 -1.327 1
1 563 . 19 1 1 A 50 50 ASN H H 88 8.301 8.467 -0.166 1
1 564 . 19 1 1 A 50 50 ASN HA H 88 4.780 5.444 -0.664 1
1 569 . 19 1 1 A 50 50 ASN C C 88 171.370 172.886 -1.516 1
1 570 . 19 1 1 A 50 50 ASN CA C 88 47.749 50.413 -2.664 1
1 571 . 19 1 1 A 50 50 ASN CB C 88 37.125 39.641 -2.516 1
1 572 . 19 1 1 A 50 50 ASN N N 88 115.631 121.298 -5.667 1
1 574 . 19 1 1 A 51 51 PRO HA H 89 4.782 4.648 0.134 1
1 577 . 19 1 1 A 51 51 PRO C C 89 173.656 175.869 -2.213 1
1 578 . 19 1 1 A 51 51 PRO CA C 89 59.624 62.071 -2.447 1
1 579 . 19 1 1 A 51 51 PRO CB C 89 31.501 32.665 -1.164 1
1 582 . 19 1 1 A 52 52 GLN H H 90 9.076 8.901 0.175 1
1 583 . 19 1 1 A 52 52 GLN HA H 90 4.469 4.834 -0.365 1
1 590 . 19 1 1 A 52 52 GLN C C 90 172.386 174.014 -1.628 1
1 591 . 19 1 1 A 52 52 GLN CA C 90 50.874 53.220 -2.346 1
1 592 . 19 1 1 A 52 52 GLN CB C 90 26.501 28.180 -1.679 1
1 594 . 19 1 1 A 52 52 GLN N N 90 126.827 119.299 7.528 1
1 596 . 19 1 1 A 53 53 PRO HA H 91 4.384 4.651 -0.267 1
1 599 . 19 1 1 A 53 53 PRO C C 91 174.274 175.251 -0.977 1
1 600 . 19 1 1 A 53 53 PRO CB C 91 28.113 31.374 -3.261 1
1 601 . 19 1 1 A 54 54 LYS H H 92 8.401 8.414 -0.013 1
1 602 . 19 1 1 A 54 54 LYS HA H 92 3.984 4.788 -0.804 1
1 611 . 19 1 1 A 54 54 LYS C C 92 173.516 174.555 -1.039 1
1 612 . 19 1 1 A 54 54 LYS CA C 92 55.249 55.527 -0.278 1
1 613 . 19 1 1 A 54 54 LYS CB C 92 30.876 36.115 -5.239 1
1 615 . 19 1 1 A 54 54 LYS N N 92 124.538 124.300 0.238 1
1 616 . 19 1 1 A 55 55 ASN H H 93 8.183 8.723 -0.540 1
1 617 . 19 1 1 A 55 55 ASN HA H 93 4.716 5.125 -0.409 1
1 622 . 19 1 1 A 55 55 ASN CA C 93 48.999 53.098 -4.099 1
1 623 . 19 1 1 A 55 55 ASN CB C 93 35.875 38.405 -2.530 1
1 624 . 19 1 1 A 55 55 ASN N N 93 118.677 122.866 -4.189 1
1 626 . 19 1 1 A 56 56 TRP H H 94 8.007 8.656 -0.649 1
1 627 . 19 1 1 A 56 56 TRP HA H 94 3.827 5.136 -1.309 1
1 635 . 19 1 1 A 56 56 TRP C C 94 173.760 175.201 -1.441 1
1 636 . 19 1 1 A 56 56 TRP CA C 94 59.624 59.356 0.268 1
1 637 . 19 1 1 A 56 56 TRP CB C 94 27.126 30.402 -3.276 1
1 638 . 19 1 1 A 56 56 TRP N N 94 122.195 128.097 -5.902 1
1 640 . 19 1 1 A 57 57 ASN H H 95 7.563 7.790 -0.227 1
1 641 . 19 1 1 A 57 57 ASN HA H 95 3.735 4.915 -1.180 1
1 646 . 19 1 1 A 57 57 ASN C C 95 171.952 173.990 -2.038 1
1 647 . 19 1 1 A 57 57 ASN CA C 95 51.499 50.598 0.901 1
1 648 . 19 1 1 A 57 57 ASN CB C 95 35.250 40.905 -5.655 1
1 649 . 19 1 1 A 57 57 ASN N N 95 129.659 125.457 4.202 1
1 651 . 19 1 1 A 58 58 LYS H H 96 8.110 8.071 0.039 1
1 652 . 19 1 1 A 58 58 LYS HA H 96 4.035 3.980 0.055 1
1 659 . 19 1 1 A 58 58 LYS C C 96 174.530 175.511 -0.981 1
1 660 . 19 1 1 A 58 58 LYS CA C 96 56.499 55.134 1.365 1
1 661 . 19 1 1 A 58 58 LYS CB C 96 29.626 33.034 -3.408 1
1 665 . 19 1 1 A 58 58 LYS N N 96 123.913 123.573 0.340 1
1 666 . 19 1 1 A 59 59 ASP H H 97 7.903 8.836 -0.933 1
1 667 . 19 1 1 A 59 59 ASP HA H 97 4.393 4.273 0.120 1
1 670 . 19 1 1 A 59 59 ASP C C 97 173.724 174.762 -1.038 1
1 671 . 19 1 1 A 59 59 ASP CA C 97 52.124 54.834 -2.710 1
1 672 . 19 1 1 A 59 59 ASP CB C 97 38.375 39.720 -1.345 1
1 673 . 19 1 1 A 59 59 ASP N N 97 118.773 119.637 -0.864 1
1 674 . 19 1 1 A 60 60 GLY H H 98 7.819 7.858 -0.039 1
1 675 . 19 1 1 A 60 60 GLY HA2 H 98 3.917 2.710 1.207 1
1 676 . 19 1 1 A 60 60 GLY HA3 H 98 3.917 3.496 0.421 1
1 677 . 19 1 1 A 60 60 GLY C C 98 168.652 174.053 -5.401 1
1 678 . 19 1 1 A 60 60 GLY CA C 98 41.500 44.801 -3.301 1
1 679 . 19 1 1 A 60 60 GLY N N 98 108.742 104.508 4.234 1
1 680 . 19 1 1 A 61 61 TYR H H 99 8.105 7.975 0.130 1
1 681 . 19 1 1 A 61 61 TYR HA H 99 3.927 4.290 -0.363 1
1 689 . 19 1 1 A 61 61 TYR C C 99 172.831 173.945 -1.114 1
1 690 . 19 1 1 A 61 61 TYR CA C 99 57.124 58.344 -1.220 1
1 691 . 19 1 1 A 61 61 TYR CB C 99 37.125 36.442 0.683 1
1 692 . 19 1 1 A 61 61 TYR N N 99 113.836 115.877 -2.041 1
1 693 . 19 1 1 A 62 62 LEU H H 100 7.352 7.764 -0.412 1
1 694 . 19 1 1 A 62 62 LEU HA H 100 4.343 4.947 -0.604 1
1 704 . 19 1 1 A 62 62 LEU C C 100 173.430 175.492 -2.062 1
1 705 . 19 1 1 A 62 62 LEU CA C 100 50.874 53.583 -2.709 1
1 706 . 19 1 1 A 62 62 LEU CB C 100 44.000 46.225 -2.225 1
1 710 . 19 1 1 A 62 62 LEU N N 100 117.112 121.584 -4.472 1
1 711 . 19 1 1 A 63 63 LYS H H 101 8.626 8.212 0.414 1
1 712 . 19 1 1 A 63 63 LYS HA H 101 3.986 4.346 -0.360 1
1 721 . 19 1 1 A 63 63 LYS C C 101 173.851 176.815 -2.964 1
1 722 . 19 1 1 A 63 63 LYS CA C 101 55.249 55.829 -0.580 1
1 723 . 19 1 1 A 63 63 LYS CB C 101 29.626 33.385 -3.759 1
1 724 . 19 1 1 A 63 63 LYS N N 101 129.991 123.567 6.424 1
1 725 . 19 1 1 A 64 64 LYS H H 102 7.059 8.452 -1.393 1
1 726 . 19 1 1 A 64 64 LYS HA H 102 4.138 4.319 -0.181 1
1 735 . 19 1 1 A 64 64 LYS C C 102 171.120 174.522 -3.402 1
1 736 . 19 1 1 A 64 64 LYS CA C 102 52.749 55.860 -3.111 1
1 737 . 19 1 1 A 64 64 LYS CB C 102 32.750 30.773 1.977 1
1 740 . 19 1 1 A 64 64 LYS N N 102 113.255 121.345 -8.090 1
1 741 . 19 1 1 A 65 65 LEU H H 103 8.883 7.977 0.906 1
1 742 . 19 1 1 A 65 65 LEU HA H 103 4.475 4.755 -0.280 1
1 752 . 19 1 1 A 65 65 LEU C C 103 171.487 174.191 -2.704 1
1 753 . 19 1 1 A 65 65 LEU CA C 103 48.999 51.149 -2.150 1
1 754 . 19 1 1 A 65 65 LEU CB C 103 39.625 45.192 -5.567 1
1 758 . 19 1 1 A 65 65 LEU N N 103 126.355 126.292 0.063 1
1 759 . 19 1 1 A 66 66 PRO HA H 104 4.449 4.615 -0.166 1
1 764 . 19 1 1 A 66 66 PRO C C 104 173.363 176.283 -2.920 1
1 765 . 19 1 1 A 66 66 PRO CA C 104 60.249 62.142 -1.893 1
1 766 . 19 1 1 A 66 66 PRO CB C 104 29.626 32.795 -3.169 1
1 769 . 19 1 1 A 67 67 VAL H H 105 7.682 8.386 -0.704 1
1 770 . 19 1 1 A 67 67 VAL HA H 105 4.121 4.491 -0.370 1
1 778 . 19 1 1 A 67 67 VAL C C 105 171.667 175.028 -3.361 1
1 779 . 19 1 1 A 67 67 VAL CA C 105 58.374 61.533 -3.159 1
1 780 . 19 1 1 A 67 67 VAL CB C 105 30.251 33.057 -2.806 1
1 783 . 19 1 1 A 67 67 VAL N N 105 114.671 121.113 -6.442 1
1 784 . 19 1 1 A 68 68 ASP H H 106 8.216 7.951 0.265 1
1 785 . 19 1 1 A 68 68 ASP HA H 106 4.474 4.573 -0.099 1
1 788 . 19 1 1 A 68 68 ASP C C 106 172.452 174.661 -2.209 1
1 789 . 19 1 1 A 68 68 ASP CA C 106 50.249 51.851 -1.602 1
1 790 . 19 1 1 A 68 68 ASP CB C 106 37.750 40.664 -2.914 1
1 791 . 19 1 1 A 68 68 ASP N N 106 123.825 126.166 -2.341 1
1 792 . 19 1 1 A 69 69 PRO HA H 107 3.920 4.007 -0.087 1
1 797 . 19 1 1 A 69 69 PRO CA C 107 62.123 63.183 -1.060 1
1 798 . 19 1 1 A 69 69 PRO CB C 107 27.751 31.566 -3.815 1
1 801 . 19 1 1 A 70 70 TRP H H 108 8.156 8.385 -0.229 1
1 802 . 19 1 1 A 70 70 TRP HA H 108 4.274 4.300 -0.026 1
1 811 . 19 1 1 A 70 70 TRP CA C 108 57.124 58.350 -1.226 1
1 812 . 19 1 1 A 70 70 TRP CB C 108 25.251 27.198 -1.947 1
1 813 . 19 1 1 A 70 70 TRP N N 108 118.137 117.331 0.806 1
1 815 . 19 1 1 A 71 71 GLY H H 109 8.209 8.735 -0.526 1
1 816 . 19 1 1 A 71 71 GLY HA2 H 109 4.030 3.895 0.135 1
1 817 . 19 1 1 A 71 71 GLY HA3 H 109 3.303 3.928 -0.625 1
1 818 . 19 1 1 A 71 71 GLY CA C 109 42.750 46.584 -3.834 1
1 819 . 19 1 1 A 71 71 GLY N N 109 107.495 105.388 2.107 1
1 820 . 19 1 1 A 72 72 ASN H H 110 8.116 7.992 0.124 1
1 821 . 19 1 1 A 72 72 ASN HA H 110 5.103 4.967 0.136 1
1 826 . 19 1 1 A 72 72 ASN CA C 110 48.374 50.044 -1.670 1
1 827 . 19 1 1 A 72 72 ASN CB C 110 36.500 39.131 -2.631 1
1 828 . 19 1 1 A 72 72 ASN N N 110 120.108 119.889 0.219 1
1 830 . 19 1 1 A 73 73 PRO HA H 111 4.397 4.491 -0.094 1
1 835 . 19 1 1 A 73 73 PRO C C 111 176.229 176.673 -0.444 1
1 836 . 19 1 1 A 73 73 PRO CA C 111 60.249 62.777 -2.528 1
1 837 . 19 1 1 A 73 73 PRO CB C 111 29.001 32.249 -3.248 1
1 840 . 19 1 1 A 74 74 TYR H H 112 8.893 8.523 0.370 1
1 841 . 19 1 1 A 74 74 TYR HA H 112 4.064 4.721 -0.657 1
1 849 . 19 1 1 A 74 74 TYR C C 112 171.951 175.911 -3.960 1
1 850 . 19 1 1 A 74 74 TYR CA C 112 60.249 58.264 1.985 1
1 851 . 19 1 1 A 74 74 TYR CB C 112 36.500 39.390 -2.890 1
1 852 . 19 1 1 A 74 74 TYR N N 112 124.595 121.476 3.119 1
1 853 . 19 1 1 A 75 75 GLN H H 113 9.127 8.900 0.227 1
1 854 . 19 1 1 A 75 75 GLN HA H 113 4.019 4.303 -0.284 1
1 861 . 19 1 1 A 75 75 GLN C C 113 171.436 173.939 -2.503 1
1 862 . 19 1 1 A 75 75 GLN CA C 113 50.874 54.673 -3.799 1
1 863 . 19 1 1 A 75 75 GLN CB C 113 29.469 29.222 0.247 1
1 865 . 19 1 1 A 75 75 GLN N N 113 120.777 121.992 -1.215 1
1 867 . 19 1 1 A 76 76 TYR H H 114 7.906 8.571 -0.665 1
1 868 . 19 1 1 A 76 76 TYR HA H 114 5.586 5.085 0.501 1
1 875 . 19 1 1 A 76 76 TYR C C 114 171.343 175.535 -4.192 1
1 876 . 19 1 1 A 76 76 TYR CA C 114 53.999 57.379 -3.380 1
1 877 . 19 1 1 A 76 76 TYR CB C 114 40.250 39.985 0.265 1
1 878 . 19 1 1 A 76 76 TYR N N 114 120.757 123.789 -3.032 1
1 879 . 19 1 1 A 77 77 LEU H H 115 8.261 8.883 -0.622 1
1 880 . 19 1 1 A 77 77 LEU HA H 115 4.280 5.204 -0.924 1
1 890 . 19 1 1 A 77 77 LEU C C 115 170.921 175.664 -4.743 1
1 891 . 19 1 1 A 77 77 LEU CA C 115 51.499 53.518 -2.019 1
1 892 . 19 1 1 A 77 77 LEU CB C 115 44.625 45.621 -0.996 1
1 896 . 19 1 1 A 77 77 LEU N N 115 130.662 124.761 5.901 1
1 897 . 19 1 1 A 78 78 ALA H H 116 7.973 8.520 -0.547 1
1 898 . 19 1 1 A 78 78 ALA HA H 116 4.292 4.870 -0.578 1
1 902 . 19 1 1 A 78 78 ALA C C 116 172.093 174.794 -2.701 1
1 903 . 19 1 1 A 78 78 ALA CA C 116 47.749 49.975 -2.226 1
1 904 . 19 1 1 A 78 78 ALA CB C 116 19.626 21.402 -1.776 1
1 905 . 19 1 1 A 78 78 ALA N N 116 125.564 124.648 0.916 1
1 906 . 19 1 1 A 79 79 PRO HA H 117 4.698 4.873 -0.175 1
1 911 . 19 1 1 A 79 79 PRO C C 117 173.994 176.592 -2.598 1
1 912 . 19 1 1 A 79 79 PRO CA C 117 60.249 63.585 -3.336 1
1 913 . 19 1 1 A 79 79 PRO CB C 117 31.501 32.046 -0.545 1
1 916 . 19 1 1 A 80 80 GLY H H 118 7.096 8.294 -1.198 1
1 917 . 19 1 1 A 80 80 GLY HA2 H 118 3.797 4.013 -0.216 1
1 918 . 19 1 1 A 80 80 GLY HA3 H 118 3.517 4.032 -0.515 1
1 919 . 19 1 1 A 80 80 GLY C C 118 171.404 173.629 -2.225 1
1 920 . 19 1 1 A 80 80 GLY CA C 118 41.500 45.676 -4.176 1
1 921 . 19 1 1 A 80 80 GLY N N 118 108.306 108.044 0.262 1
1 922 . 19 1 1 A 81 81 THR H H 119 9.810 7.895 1.915 1
1 923 . 19 1 1 A 81 81 THR HA H 119 4.091 4.595 -0.504 1
1 928 . 19 1 1 A 81 81 THR C C 119 174.242 174.620 -0.378 1
1 929 . 19 1 1 A 81 81 THR CA C 119 60.874 60.619 0.255 1
1 930 . 19 1 1 A 81 81 THR CB C 119 66.498 69.924 -3.426 1
1 932 . 19 1 1 A 81 81 THR N N 119 112.813 113.550 -0.737 1
1 933 . 19 1 1 A 82 82 LYS H H 120 8.964 8.723 0.241 1
1 934 . 19 1 1 A 82 82 LYS HA H 120 4.150 3.898 0.252 1
1 941 . 19 1 1 A 82 82 LYS C C 120 172.886 175.966 -3.080 1
1 942 . 19 1 1 A 82 82 LYS CA C 120 53.999 57.618 -3.619 1
1 943 . 19 1 1 A 82 82 LYS CB C 120 30.876 30.254 0.622 1
1 944 . 19 1 1 A 82 82 LYS N N 120 123.569 119.552 4.017 1
1 945 . 19 1 1 A 83 83 GLY H H 121 7.125 8.008 -0.883 1
1 946 . 19 1 1 A 83 83 GLY HA2 H 121 3.814 3.944 -0.130 1
1 947 . 19 1 1 A 83 83 GLY HA3 H 121 3.814 3.999 -0.185 1
1 948 . 19 1 1 A 83 83 GLY C C 121 167.671 174.334 -6.663 1
1 949 . 19 1 1 A 83 83 GLY CA C 121 42.125 44.639 -2.514 1
1 950 . 19 1 1 A 83 83 GLY N N 121 107.253 107.925 -0.672 1
1 951 . 19 1 1 A 84 84 PRO HA H 122 4.077 4.507 -0.430 1
1 958 . 19 1 1 A 84 84 PRO C C 122 175.199 176.099 -0.900 1
1 959 . 19 1 1 A 84 84 PRO CA C 122 63.373 64.447 -1.074 1
1 960 . 19 1 1 A 84 84 PRO CB C 122 30.251 32.116 -1.865 1
1 962 . 19 1 1 A 85 85 PHE H H 123 6.652 6.840 -0.188 1
1 963 . 19 1 1 A 85 85 PHE HA H 123 4.744 4.834 -0.090 1
1 971 . 19 1 1 A 85 85 PHE C C 123 170.340 172.533 -2.193 1
1 972 . 19 1 1 A 85 85 PHE CA C 123 53.999 56.324 -2.325 1
1 973 . 19 1 1 A 85 85 PHE CB C 123 39.000 40.327 -1.327 1
1 974 . 19 1 1 A 85 85 PHE N N 123 108.468 112.170 -3.702 1
1 975 . 19 1 1 A 86 86 ASP H H 124 9.268 8.826 0.442 1
1 976 . 19 1 1 A 86 86 ASP HA H 124 5.108 5.232 -0.124 1
1 979 . 19 1 1 A 86 86 ASP C C 124 171.180 174.564 -3.384 1
1 980 . 19 1 1 A 86 86 ASP CA C 124 50.249 53.411 -3.162 1
1 981 . 19 1 1 A 86 86 ASP CB C 124 40.250 43.534 -3.284 1
1 982 . 19 1 1 A 86 86 ASP N N 124 121.741 119.126 2.615 1
1 983 . 19 1 1 A 87 87 LEU H H 125 8.018 9.760 -1.742 1
1 984 . 19 1 1 A 87 87 LEU HA H 125 5.809 5.613 0.196 1
1 994 . 19 1 1 A 87 87 LEU C C 125 171.350 175.072 -3.722 1
1 995 . 19 1 1 A 87 87 LEU CA C 125 50.874 53.694 -2.820 1
1 996 . 19 1 1 A 87 87 LEU CB C 125 44.318 45.592 -1.274 1
1 999 . 19 1 1 A 87 87 LEU N N 125 123.629 127.822 -4.193 1
1 1000 . 19 1 1 A 88 88 TYR H H 126 8.912 8.442 0.470 1
1 1001 . 19 1 1 A 88 88 TYR HA H 126 5.630 5.613 0.017 1
1 1008 . 19 1 1 A 88 88 TYR C C 126 171.410 172.438 -1.028 1
1 1009 . 19 1 1 A 88 88 TYR CA C 126 52.749 56.641 -3.892 1
1 1010 . 19 1 1 A 88 88 TYR CB C 126 37.750 40.451 -2.701 1
1 1011 . 19 1 1 A 88 88 TYR N N 126 119.697 121.961 -2.264 1
1 1012 . 19 1 1 A 89 89 SER H H 127 9.319 9.645 -0.326 1
1 1013 . 19 1 1 A 89 89 SER HA H 127 5.429 5.398 0.031 1
1 1016 . 19 1 1 A 89 89 SER CA C 127 52.124 56.452 -4.328 1
1 1017 . 19 1 1 A 89 89 SER CB C 127 62.748 66.569 -3.821 1
1 1018 . 19 1 1 A 89 89 SER N N 127 112.637 115.699 -3.062 1
1 1019 . 19 1 1 A 90 90 LEU H H 128 8.759 8.575 0.184 1
1 1020 . 19 1 1 A 90 90 LEU HA H 128 4.186 4.459 -0.273 1
1 1030 . 19 1 1 A 90 90 LEU C C 128 175.121 177.841 -2.720 1
1 1031 . 19 1 1 A 90 90 LEU CA C 128 52.749 54.873 -2.124 1
1 1032 . 19 1 1 A 90 90 LEU CB C 128 35.875 42.634 -6.759 1
1 1033 . 19 1 1 A 90 90 LEU N N 128 126.728 125.030 1.698 1
1 1034 . 19 1 1 A 91 91 GLY H H 129 8.356 7.963 0.393 1
1 1035 . 19 1 1 A 91 91 GLY HA2 H 129 3.373 3.834 -0.461 1
1 1036 . 19 1 1 A 91 91 GLY HA3 H 129 3.373 3.899 -0.526 1
1 1037 . 19 1 1 A 91 91 GLY C C 129 172.013 174.509 -2.496 1
1 1038 . 19 1 1 A 91 91 GLY CA C 129 41.500 43.867 -2.367 1
1 1039 . 19 1 1 A 91 91 GLY N N 129 108.559 108.141 0.418 1
1 1040 . 19 1 1 A 92 92 ALA H H 130 7.047 7.917 -0.870 1
1 1041 . 19 1 1 A 92 92 ALA HA H 130 4.037 3.072 0.965 1
1 1045 . 19 1 1 A 92 92 ALA C C 130 174.890 177.657 -2.767 1
1 1046 . 19 1 1 A 92 92 ALA CA C 130 52.100 53.454 -1.354 1
1 1047 . 19 1 1 A 92 92 ALA CB C 130 16.502 17.694 -1.192 1
1 1048 . 19 1 1 A 92 92 ALA N N 130 118.393 121.483 -3.090 1
1 1049 . 19 1 1 A 93 93 ASP H H 131 7.222 7.614 -0.392 1
1 1050 . 19 1 1 A 93 93 ASP HA H 131 4.122 4.664 -0.542 1
1 1053 . 19 1 1 A 93 93 ASP C C 131 174.890 176.368 -1.478 1
1 1054 . 19 1 1 A 93 93 ASP CA C 131 50.249 53.921 -3.672 1
1 1055 . 19 1 1 A 93 93 ASP CB C 131 37.750 41.405 -3.655 1
1 1056 . 19 1 1 A 93 93 ASP N N 131 111.487 116.634 -5.147 1
1 1057 . 19 1 1 A 94 94 GLY H H 132 7.199 9.299 -2.100 1
1 1058 . 19 1 1 A 94 94 GLY HA2 H 132 3.951 3.886 0.065 1
1 1059 . 19 1 1 A 94 94 GLY HA3 H 132 3.324 3.890 -0.566 1
1 1060 . 19 1 1 A 94 94 GLY C C 132 169.773 173.439 -3.666 1
1 1061 . 19 1 1 A 94 94 GLY CA C 132 44.625 46.041 -1.416 1
1 1062 . 19 1 1 A 94 94 GLY N N 132 106.932 108.405 -1.473 1
1 1063 . 19 1 1 A 95 95 LYS H H 133 7.215 7.751 -0.536 1
1 1064 . 19 1 1 A 95 95 LYS HA H 133 4.513 4.863 -0.350 1
1 1073 . 19 1 1 A 95 95 LYS C C 133 172.108 175.214 -3.106 1
1 1074 . 19 1 1 A 95 95 LYS CA C 133 51.512 54.186 -2.674 1
1 1075 . 19 1 1 A 95 95 LYS CB C 133 34.000 36.203 -2.203 1
1 1076 . 19 1 1 A 95 95 LYS N N 133 115.749 119.761 -4.012 1
1 1077 . 19 1 1 A 96 96 GLU H H 134 9.230 8.815 0.415 1
1 1078 . 19 1 1 A 96 96 GLU HA H 134 4.352 4.786 -0.434 1
1 1083 . 19 1 1 A 96 96 GLU C C 134 175.219 175.770 -0.551 1
1 1084 . 19 1 1 A 96 96 GLU CA C 134 55.874 55.626 0.248 1
1 1085 . 19 1 1 A 96 96 GLU CB C 134 27.126 30.401 -3.275 1
1 1087 . 19 1 1 A 96 96 GLU N N 134 128.571 120.713 7.858 1
1 1088 . 19 1 1 A 97 97 GLY H H 135 10.677 8.452 2.225 1
1 1089 . 19 1 1 A 97 97 GLY HA2 H 135 4.037 4.327 -0.290 1
1 1090 . 19 1 1 A 97 97 GLY HA3 H 135 3.717 4.329 -0.612 1
1 1091 . 19 1 1 A 97 97 GLY C C 135 171.567 172.113 -0.546 1
1 1092 . 19 1 1 A 97 97 GLY CA C 135 41.500 45.685 -4.185 1
1 1093 . 19 1 1 A 97 97 GLY N N 135 117.011 110.619 6.392 1
1 1094 . 19 1 1 A 98 98 GLY H H 136 8.442 8.715 -0.273 1
1 1095 . 19 1 1 A 98 98 GLY HA2 H 136 4.195 4.215 -0.020 1
1 1096 . 19 1 1 A 98 98 GLY HA3 H 136 4.195 4.220 -0.025 1
1 1097 . 19 1 1 A 98 98 GLY C C 136 170.299 173.428 -3.129 1
1 1098 . 19 1 1 A 98 98 GLY CA C 136 40.875 44.862 -3.987 1
1 1099 . 19 1 1 A 98 98 GLY N N 136 109.494 108.964 0.530 1
1 1100 . 19 1 1 A 99 99 SER H H 137 8.701 8.689 0.012 1
1 1101 . 19 1 1 A 99 99 SER HA H 137 4.639 4.900 -0.261 1
1 1104 . 19 1 1 A 99 99 SER C C 137 170.630 173.097 -2.467 1
1 1105 . 19 1 1 A 99 99 SER CA C 137 54.624 57.556 -2.932 1
1 1106 . 19 1 1 A 99 99 SER CB C 137 62.748 66.815 -4.067 1
1 1107 . 19 1 1 A 99 99 SER N N 137 114.685 118.177 -3.492 1
1 1108 . 19 1 1 A 100 100 ASP H H 138 9.117 8.991 0.126 1
1 1109 . 19 1 1 A 100 100 ASP HA H 138 3.965 4.559 -0.594 1
1 1112 . 19 1 1 A 100 100 ASP C C 138 175.540 176.568 -1.028 1
1 1113 . 19 1 1 A 100 100 ASP CA C 138 54.624 54.870 -0.246 1
1 1114 . 19 1 1 A 100 100 ASP CB C 138 36.500 42.033 -5.533 1
1 1115 . 19 1 1 A 100 100 ASP N N 138 120.777 121.607 -0.830 1
1 1116 . 19 1 1 A 101 101 ASN H H 139 8.667 8.438 0.229 1
1 1117 . 19 1 1 A 101 101 ASN HA H 139 4.333 5.127 -0.794 1
1 1122 . 19 1 1 A 101 101 ASN CA C 139 53.999 53.979 0.020 1
1 1123 . 19 1 1 A 101 101 ASN CB C 139 34.625 41.500 -6.875 1
1 1124 . 19 1 1 A 101 101 ASN N N 139 121.930 117.005 4.925 1
1 1126 . 19 1 1 A 102 102 ASP H H 140 7.714 7.760 -0.046 1
1 1127 . 19 1 1 A 102 102 ASP HA H 140 4.037 4.508 -0.471 1
1 1130 . 19 1 1 A 102 102 ASP C C 140 172.807 175.889 -3.082 1
1 1131 . 19 1 1 A 102 102 ASP CA C 140 53.374 54.063 -0.689 1
1 1132 . 19 1 1 A 102 102 ASP CB C 140 37.125 41.224 -4.099 1
1 1133 . 19 1 1 A 102 102 ASP N N 140 118.011 116.563 1.448 1
1 1134 . 19 1 1 A 103 103 ALA H H 141 7.060 7.279 -0.219 1
1 1135 . 19 1 1 A 103 103 ALA HA H 141 3.353 4.748 -1.395 1
1 1139 . 19 1 1 A 103 103 ALA C C 141 172.233 176.762 -4.529 1
1 1140 . 19 1 1 A 103 103 ALA CA C 141 49.624 51.643 -2.019 1
1 1141 . 19 1 1 A 103 103 ALA CB C 141 16.502 20.457 -3.955 1
1 1142 . 19 1 1 A 103 103 ALA N N 141 125.777 122.916 2.861 1
1 1143 . 19 1 1 A 104 104 ASP H H 142 7.973 8.371 -0.398 1
1 1144 . 19 1 1 A 104 104 ASP HA H 142 4.420 4.913 -0.493 1
1 1147 . 19 1 1 A 104 104 ASP C C 142 174.188 175.906 -1.718 1
1 1148 . 19 1 1 A 104 104 ASP CA C 142 52.124 53.836 -1.712 1
1 1149 . 19 1 1 A 104 104 ASP CB C 142 37.125 41.391 -4.266 1
1 1150 . 19 1 1 A 104 104 ASP N N 142 122.965 120.035 2.930 1
1 1151 . 19 1 1 A 105 105 ILE H H 143 8.534 8.724 -0.190 1
1 1152 . 19 1 1 A 105 105 ILE HA H 143 4.060 4.877 -0.817 1
1 1162 . 19 1 1 A 105 105 ILE C C 143 173.235 176.072 -2.837 1
1 1163 . 19 1 1 A 105 105 ILE CA C 143 58.374 60.284 -1.910 1
1 1164 . 19 1 1 A 105 105 ILE CB C 143 39.123 39.523 -0.400 1
1 1167 . 19 1 1 A 105 105 ILE N N 143 124.757 121.098 3.659 1
1 1168 . 19 1 1 A 106 106 GLY H H 144 8.288 8.408 -0.120 1
1 1169 . 19 1 1 A 106 106 GLY HA2 H 144 4.764 4.504 0.260 1
1 1170 . 19 1 1 A 106 106 GLY HA3 H 144 4.764 4.561 0.203 1
1 1171 . 19 1 1 A 106 106 GLY C C 144 171.321 172.208 -0.887 1
1 1172 . 19 1 1 A 106 106 GLY CA C 144 40.250 45.790 -5.540 1
1 1173 . 19 1 1 A 106 106 GLY N N 144 110.895 111.562 -0.667 1
1 1174 . 19 1 1 A 107 107 ASN H H 145 8.577 9.381 -0.804 1
1 1175 . 19 1 1 A 107 107 ASN HA H 145 4.268 5.239 -0.971 1
1 1180 . 19 1 1 A 107 107 ASN C C 145 171.757 173.734 -1.977 1
1 1181 . 19 1 1 A 107 107 ASN CA C 145 52.124 51.825 0.299 1
1 1182 . 19 1 1 A 107 107 ASN CB C 145 34.625 42.115 -7.490 1
1 1183 . 19 1 1 A 107 107 ASN N N 145 118.042 116.039 2.003 1
1 1185 . 19 1 1 A 108 108 TRP H H 146 6.822 8.354 -1.532 1
1 1186 . 19 1 1 A 108 108 TRP HA H 146 4.513 5.265 -0.752 1
1 1195 . 19 1 1 A 108 108 TRP C C 146 172.665 172.067 0.598 1
1 1196 . 19 1 1 A 108 108 TRP CA C 146 54.624 55.554 -0.930 1
1 1197 . 19 1 1 A 108 108 TRP CB C 146 25.876 31.170 -5.294 1
1 1198 . 19 1 1 A 108 108 TRP N N 146 116.756 118.084 -1.328 1
1 1200 . 19 1 1 A 109 109 ASP H H 147 7.344 7.754 -0.410 1
1 1201 . 19 1 1 A 109 109 ASP HA H 147 4.655 5.268 -0.613 1
1 1204 . 19 1 1 A 109 109 ASP C C 147 172.193 175.065 -2.872 1
1 1205 . 19 1 1 A 109 109 ASP CA C 147 51.499 52.573 -1.074 1
1 1206 . 19 1 1 A 109 109 ASP CB C 147 39.000 43.737 -4.737 1
1 1207 . 19 1 1 A 109 109 ASP N N 147 121.461 120.582 0.879 1
1 11 . 20 1 1 A 2 2 SER H H 40 8.461 8.921 -0.460 1
1 12 . 20 1 1 A 2 2 SER HA H 40 4.286 4.928 -0.642 1
1 15 . 20 1 1 A 2 2 SER C C 40 171.276 173.285 -2.009 1
1 16 . 20 1 1 A 2 2 SER CA C 40 55.249 56.969 -1.720 1
1 17 . 20 1 1 A 2 2 SER CB C 40 61.498 63.667 -2.169 1
1 18 . 20 1 1 A 2 2 SER N N 40 118.344 123.866 -5.522 1
1 19 . 20 1 1 A 3 3 ARG H H 41 8.469 8.389 0.080 1
1 20 . 20 1 1 A 3 3 ARG HA H 41 4.400 4.860 -0.460 1
1 25 . 20 1 1 A 3 3 ARG C C 41 172.251 174.317 -2.066 1
1 26 . 20 1 1 A 3 3 ARG CA C 41 52.749 52.914 -0.165 1
1 27 . 20 1 1 A 3 3 ARG CB C 41 27.126 33.334 -6.208 1
1 28 . 20 1 1 A 3 3 ARG N N 41 123.070 126.349 -3.279 1
1 33 . 20 1 1 A 4 4 PRO CA C 42 61.498 63.861 -2.363 1
1 34 . 20 1 1 A 4 4 PRO CB C 42 29.001 31.658 -2.657 1
1 37 . 20 1 1 A 5 5 ASP H H 43 8.246 8.896 -0.650 1
1 38 . 20 1 1 A 5 5 ASP HA H 43 4.329 4.521 -0.192 1
1 41 . 20 1 1 A 5 5 ASP C C 43 174.605 177.235 -2.630 1
1 42 . 20 1 1 A 5 5 ASP CA C 43 53.374 55.820 -2.446 1
1 43 . 20 1 1 A 5 5 ASP CB C 43 38.375 40.617 -2.242 1
1 44 . 20 1 1 A 5 5 ASP N N 43 119.409 123.702 -4.293 1
1 45 . 20 1 1 A 6 6 GLN H H 44 8.309 8.379 -0.070 1
1 46 . 20 1 1 A 6 6 GLN HA H 44 4.393 4.195 0.198 1
1 53 . 20 1 1 A 6 6 GLN C C 44 175.053 178.140 -3.087 1
1 54 . 20 1 1 A 6 6 GLN CA C 44 55.874 58.314 -2.440 1
1 55 . 20 1 1 A 6 6 GLN CB C 44 25.876 28.205 -2.329 1
1 57 . 20 1 1 A 6 6 GLN N N 44 122.273 117.931 4.342 1
1 59 . 20 1 1 A 7 7 ALA H H 45 8.106 7.980 0.126 1
1 60 . 20 1 1 A 7 7 ALA HA H 45 3.993 4.105 -0.112 1
1 64 . 20 1 1 A 7 7 ALA C C 45 177.465 178.039 -0.574 1
1 65 . 20 1 1 A 7 7 ALA CA C 45 52.124 54.265 -2.141 1
1 66 . 20 1 1 A 7 7 ALA CB C 45 15.252 18.270 -3.018 1
1 67 . 20 1 1 A 7 7 ALA N N 45 122.204 121.790 0.414 1
1 68 . 20 1 1 A 8 8 LYS H H 46 7.527 7.763 -0.236 1
1 69 . 20 1 1 A 8 8 LYS HA H 46 3.539 4.092 -0.553 1
1 78 . 20 1 1 A 8 8 LYS C C 46 175.412 179.109 -3.697 1
1 79 . 20 1 1 A 8 8 LYS CA C 46 57.124 57.686 -0.562 1
1 80 . 20 1 1 A 8 8 LYS CB C 46 30.876 32.089 -1.213 1
1 83 . 20 1 1 A 8 8 LYS N N 46 117.358 116.402 0.956 1
1 84 . 20 1 1 A 9 9 VAL H H 47 7.709 8.073 -0.364 1
1 85 . 20 1 1 A 9 9 VAL HA H 47 3.578 3.790 -0.212 1
1 93 . 20 1 1 A 9 9 VAL C C 47 175.005 178.170 -3.165 1
1 94 . 20 1 1 A 9 9 VAL CA C 47 64.623 66.194 -1.571 1
1 95 . 20 1 1 A 9 9 VAL CB C 47 29.001 31.787 -2.786 1
1 98 . 20 1 1 A 9 9 VAL N N 47 119.115 120.400 -1.285 1
1 99 . 20 1 1 A 10 10 THR H H 48 7.767 8.248 -0.481 1
1 100 . 20 1 1 A 10 10 THR HA H 48 3.668 3.970 -0.302 1
1 105 . 20 1 1 A 10 10 THR CA C 48 63.998 66.206 -2.208 1
1 106 . 20 1 1 A 10 10 THR CB C 48 67.123 68.860 -1.737 1
1 108 . 20 1 1 A 10 10 THR N N 48 115.112 113.748 1.364 1
1 109 . 20 1 1 A 11 11 VAL H H 49 7.598 7.877 -0.279 1
1 110 . 20 1 1 A 11 11 VAL HA H 49 3.457 3.867 -0.410 1
1 118 . 20 1 1 A 11 11 VAL C C 49 175.412 178.071 -2.659 1
1 119 . 20 1 1 A 11 11 VAL CA C 49 63.998 64.774 -0.776 1
1 120 . 20 1 1 A 11 11 VAL CB C 49 29.001 31.611 -2.610 1
1 123 . 20 1 1 A 11 11 VAL N N 49 123.694 117.480 6.214 1
1 124 . 20 1 1 A 12 12 ALA H H 50 8.176 7.949 0.227 1
1 125 . 20 1 1 A 12 12 ALA HA H 50 4.742 4.052 0.690 1
1 129 . 20 1 1 A 12 12 ALA C C 50 177.074 179.738 -2.664 1
1 130 . 20 1 1 A 12 12 ALA CA C 50 52.124 55.195 -3.071 1
1 131 . 20 1 1 A 12 12 ALA CB C 50 15.252 18.437 -3.185 1
1 132 . 20 1 1 A 12 12 ALA N N 50 122.348 124.492 -2.144 1
1 133 . 20 1 1 A 13 13 LYS H H 51 8.499 8.033 0.466 1
1 134 . 20 1 1 A 13 13 LYS HA H 51 3.648 4.080 -0.432 1
1 143 . 20 1 1 A 13 13 LYS C C 51 177.252 179.499 -2.247 1
1 144 . 20 1 1 A 13 13 LYS CA C 51 58.072 59.429 -1.357 1
1 145 . 20 1 1 A 13 13 LYS CB C 51 30.251 32.255 -2.004 1
1 146 . 20 1 1 A 13 13 LYS N N 51 115.402 116.833 -1.431 1
1 147 . 20 1 1 A 14 14 GLY H H 52 7.858 8.162 -0.304 1
1 148 . 20 1 1 A 14 14 GLY HA2 H 52 3.823 3.911 -0.088 1
1 149 . 20 1 1 A 14 14 GLY HA3 H 52 3.676 3.913 -0.237 1
1 150 . 20 1 1 A 14 14 GLY C C 52 174.090 175.373 -1.283 1
1 151 . 20 1 1 A 14 14 GLY CA C 52 44.625 46.045 -1.420 1
1 152 . 20 1 1 A 14 14 GLY N N 52 107.466 108.450 -0.984 1
1 153 . 20 1 1 A 15 15 ASP H H 53 8.403 7.684 0.719 1
1 154 . 20 1 1 A 15 15 ASP HA H 53 4.191 4.486 -0.295 1
1 157 . 20 1 1 A 15 15 ASP C C 53 175.316 178.822 -3.506 1
1 158 . 20 1 1 A 15 15 ASP CA C 53 54.624 56.650 -2.026 1
1 159 . 20 1 1 A 15 15 ASP CB C 53 35.875 40.868 -4.993 1
1 160 . 20 1 1 A 15 15 ASP N N 53 125.929 120.536 5.393 1
1 161 . 20 1 1 A 16 16 ILE H H 54 8.245 8.388 -0.143 1
1 162 . 20 1 1 A 16 16 ILE HA H 54 3.034 3.796 -0.762 1
1 172 . 20 1 1 A 16 16 ILE C C 54 174.499 178.146 -3.647 1
1 173 . 20 1 1 A 16 16 ILE CA C 54 62.748 64.153 -1.405 1
1 174 . 20 1 1 A 16 16 ILE CB C 54 34.625 37.465 -2.840 1
1 178 . 20 1 1 A 16 16 ILE N N 54 119.456 116.826 2.630 1
1 179 . 20 1 1 A 17 17 LYS H H 55 7.547 7.974 -0.427 1
1 180 . 20 1 1 A 17 17 LYS HA H 55 3.843 4.111 -0.268 1
1 187 . 20 1 1 A 17 17 LYS C C 55 176.651 179.332 -2.681 1
1 188 . 20 1 1 A 17 17 LYS CA C 55 57.124 59.266 -2.142 1
1 189 . 20 1 1 A 17 17 LYS CB C 55 30.251 32.256 -2.005 1
1 190 . 20 1 1 A 17 17 LYS N N 55 118.505 121.133 -2.628 1
1 191 . 20 1 1 A 18 18 ALA H H 56 7.680 7.741 -0.061 1
1 192 . 20 1 1 A 18 18 ALA HA H 56 4.029 4.042 -0.013 1
1 196 . 20 1 1 A 18 18 ALA C C 56 176.638 179.920 -3.282 1
1 197 . 20 1 1 A 18 18 ALA CA C 56 52.749 54.854 -2.105 1
1 198 . 20 1 1 A 18 18 ALA CB C 56 15.877 18.479 -2.602 1
1 199 . 20 1 1 A 18 18 ALA N N 56 122.477 122.122 0.355 1
1 200 . 20 1 1 A 19 19 ILE H H 57 8.853 7.902 0.951 1
1 201 . 20 1 1 A 19 19 ILE HA H 57 3.304 3.605 -0.301 1
1 211 . 20 1 1 A 19 19 ILE C C 57 174.710 177.775 -3.065 1
1 212 . 20 1 1 A 19 19 ILE CA C 57 63.373 65.356 -1.983 1
1 213 . 20 1 1 A 19 19 ILE CB C 57 35.250 37.887 -2.637 1
1 217 . 20 1 1 A 19 19 ILE N N 57 120.901 118.055 2.846 1
1 218 . 20 1 1 A 20 20 ALA H H 58 8.702 8.113 0.589 1
1 219 . 20 1 1 A 20 20 ALA HA H 58 3.900 3.958 -0.058 1
1 223 . 20 1 1 A 20 20 ALA C C 58 176.512 179.418 -2.906 1
1 224 . 20 1 1 A 20 20 ALA CA C 58 52.749 55.056 -2.307 1
1 225 . 20 1 1 A 20 20 ALA CB C 58 15.252 18.068 -2.816 1
1 226 . 20 1 1 A 20 20 ALA N N 58 121.763 122.352 -0.589 1
1 227 . 20 1 1 A 21 21 ALA H H 59 7.662 7.432 0.230 1
1 228 . 20 1 1 A 21 21 ALA HA H 59 4.136 4.238 -0.102 1
1 232 . 20 1 1 A 21 21 ALA C C 59 177.949 178.948 -0.999 1
1 233 . 20 1 1 A 21 21 ALA CA C 59 52.749 53.319 -0.570 1
1 234 . 20 1 1 A 21 21 ALA CB C 59 15.252 19.035 -3.783 1
1 235 . 20 1 1 A 21 21 ALA N N 59 119.079 119.246 -0.167 1
1 236 . 20 1 1 A 22 22 ALA H H 60 7.403 7.603 -0.200 1
1 237 . 20 1 1 A 22 22 ALA HA H 60 4.318 4.254 0.064 1
1 241 . 20 1 1 A 22 22 ALA C C 60 176.730 180.464 -3.734 1
1 242 . 20 1 1 A 22 22 ALA CA C 60 52.749 54.139 -1.390 1
1 243 . 20 1 1 A 22 22 ALA CB C 60 17.126 18.975 -1.849 1
1 244 . 20 1 1 A 22 22 ALA N N 60 122.616 119.818 2.798 1
1 245 . 20 1 1 A 23 23 LEU H H 61 8.410 8.729 -0.319 1
1 246 . 20 1 1 A 23 23 LEU HA H 61 3.527 3.914 -0.387 1
1 256 . 20 1 1 A 23 23 LEU C C 61 176.057 178.226 -2.169 1
1 257 . 20 1 1 A 23 23 LEU CA C 61 55.249 57.106 -1.857 1
1 258 . 20 1 1 A 23 23 LEU CB C 61 39.000 40.907 -1.907 1
1 262 . 20 1 1 A 23 23 LEU N N 61 120.761 121.107 -0.346 1
1 263 . 20 1 1 A 24 24 ASP H H 62 8.227 8.106 0.121 1
1 264 . 20 1 1 A 24 24 ASP HA H 62 4.581 4.509 0.072 1
1 267 . 20 1 1 A 24 24 ASP C C 62 176.968 178.178 -1.210 1
1 268 . 20 1 1 A 24 24 ASP CA C 62 55.874 56.500 -0.626 1
1 269 . 20 1 1 A 24 24 ASP CB C 62 37.750 40.813 -3.063 1
1 270 . 20 1 1 A 24 24 ASP N N 62 119.068 118.919 0.149 1
1 271 . 20 1 1 A 25 25 MET H H 63 7.718 7.762 -0.044 1
1 272 . 20 1 1 A 25 25 MET HA H 63 4.196 4.149 0.047 1
1 277 . 20 1 1 A 25 25 MET C C 63 174.968 177.668 -2.700 1
1 278 . 20 1 1 A 25 25 MET CA C 63 55.249 58.225 -2.976 1
1 279 . 20 1 1 A 25 25 MET CB C 63 29.626 32.113 -2.487 1
1 281 . 20 1 1 A 25 25 MET N N 63 121.365 119.325 2.040 1
1 282 . 20 1 1 A 26 26 TYR H H 64 8.401 7.579 0.822 1
1 283 . 20 1 1 A 26 26 TYR HA H 64 4.400 3.737 0.663 1
1 291 . 20 1 1 A 26 26 TYR C C 64 176.098 177.506 -1.408 1
1 292 . 20 1 1 A 26 26 TYR CA C 64 58.999 61.253 -2.254 1
1 293 . 20 1 1 A 26 26 TYR CB C 64 35.250 38.127 -2.877 1
1 294 . 20 1 1 A 26 26 TYR N N 64 122.575 120.674 1.901 1
1 295 . 20 1 1 A 27 27 LYS H H 65 8.330 8.046 0.284 1
1 296 . 20 1 1 A 27 27 LYS HA H 65 3.568 4.290 -0.722 1
1 302 . 20 1 1 A 27 27 LYS C C 65 176.156 178.391 -2.235 1
1 303 . 20 1 1 A 27 27 LYS CA C 65 56.499 59.253 -2.754 1
1 304 . 20 1 1 A 27 27 LYS CB C 65 29.626 31.841 -2.215 1
1 306 . 20 1 1 A 27 27 LYS N N 65 121.390 118.623 2.767 1
1 307 . 20 1 1 A 28 28 LEU H H 66 7.833 7.586 0.247 1
1 308 . 20 1 1 A 28 28 LEU HA H 66 3.769 4.184 -0.415 1
1 318 . 20 1 1 A 28 28 LEU C C 66 175.925 178.505 -2.580 1
1 319 . 20 1 1 A 28 28 LEU CA C 66 55.874 56.755 -0.881 1
1 320 . 20 1 1 A 28 28 LEU CB C 66 38.375 41.710 -3.335 1
1 324 . 20 1 1 A 28 28 LEU N N 66 123.068 119.710 3.358 1
1 325 . 20 1 1 A 29 29 ASP H H 67 7.292 8.037 -0.745 1
1 326 . 20 1 1 A 29 29 ASP HA H 67 4.096 4.385 -0.289 1
1 329 . 20 1 1 A 29 29 ASP C C 67 174.618 176.888 -2.270 1
1 330 . 20 1 1 A 29 29 ASP CA C 67 53.999 56.412 -2.413 1
1 331 . 20 1 1 A 29 29 ASP CB C 67 38.375 40.740 -2.365 1
1 332 . 20 1 1 A 29 29 ASP N N 67 114.729 119.404 -4.675 1
1 333 . 20 1 1 A 30 30 ASN H H 68 8.097 7.761 0.336 1
1 334 . 20 1 1 A 30 30 ASN HA H 68 4.337 4.500 -0.163 1
1 339 . 20 1 1 A 30 30 ASN C C 68 172.822 174.348 -1.526 1
1 340 . 20 1 1 A 30 30 ASN CA C 68 52.124 52.246 -0.122 1
1 341 . 20 1 1 A 30 30 ASN CB C 68 37.750 38.668 -0.918 1
1 342 . 20 1 1 A 30 30 ASN N N 68 111.054 115.353 -4.299 1
1 344 . 20 1 1 A 31 31 PHE H H 69 8.249 8.053 0.196 1
1 345 . 20 1 1 A 31 31 PHE HA H 69 4.135 4.408 -0.273 1
1 353 . 20 1 1 A 31 31 PHE C C 69 170.485 174.344 -3.859 1
1 354 . 20 1 1 A 31 31 PHE CA C 69 57.749 58.796 -1.047 1
1 355 . 20 1 1 A 31 31 PHE CB C 69 33.375 36.613 -3.238 1
1 356 . 20 1 1 A 31 31 PHE N N 69 116.277 117.387 -1.110 1
1 357 . 20 1 1 A 32 32 ALA H H 70 7.224 6.938 0.286 1
1 358 . 20 1 1 A 32 32 ALA HA H 70 4.194 4.572 -0.378 1
1 362 . 20 1 1 A 32 32 ALA C C 70 173.337 174.998 -1.661 1
1 363 . 20 1 1 A 32 32 ALA CA C 70 48.374 51.647 -3.273 1
1 364 . 20 1 1 A 32 32 ALA CB C 70 19.626 22.451 -2.825 1
1 365 . 20 1 1 A 32 32 ALA N N 70 119.914 120.347 -0.433 1
1 366 . 20 1 1 A 33 33 TYR H H 71 7.948 8.410 -0.462 1
1 367 . 20 1 1 A 33 33 TYR HA H 71 4.209 4.797 -0.588 1
1 374 . 20 1 1 A 33 33 TYR C C 71 170.591 174.079 -3.488 1
1 375 . 20 1 1 A 33 33 TYR CA C 71 54.624 56.464 -1.840 1
1 376 . 20 1 1 A 33 33 TYR CB C 71 34.000 38.003 -4.003 1
1 377 . 20 1 1 A 33 33 TYR N N 71 116.929 118.067 -1.138 1
1 378 . 20 1 1 A 34 34 PRO HA H 72 4.444 4.493 -0.049 1
1 381 . 20 1 1 A 34 34 PRO C C 72 174.775 176.250 -1.475 1
1 382 . 20 1 1 A 34 34 PRO CA C 72 59.624 62.435 -2.811 1
1 383 . 20 1 1 A 34 34 PRO CB C 72 28.376 31.569 -3.193 1
1 384 . 20 1 1 A 35 35 SER H H 73 8.721 8.336 0.385 1
1 385 . 20 1 1 A 35 35 SER HA H 73 4.467 4.670 -0.203 1
1 388 . 20 1 1 A 35 35 SER C C 73 173.271 175.188 -1.917 1
1 389 . 20 1 1 A 35 35 SER CA C 73 55.249 56.722 -1.473 1
1 390 . 20 1 1 A 35 35 SER CB C 73 63.373 65.686 -2.313 1
1 391 . 20 1 1 A 35 35 SER N N 73 118.284 114.632 3.652 1
1 392 . 20 1 1 A 36 36 THR H H 74 8.591 8.502 0.089 1
1 393 . 20 1 1 A 36 36 THR HA H 74 3.649 4.173 -0.524 1
1 398 . 20 1 1 A 36 36 THR CA C 74 64.623 64.299 0.324 1
1 399 . 20 1 1 A 36 36 THR CB C 74 66.498 69.019 -2.521 1
1 401 . 20 1 1 A 36 36 THR N N 74 117.769 116.665 1.104 1
1 402 . 20 1 1 A 37 37 GLN H H 75 8.210 7.888 0.322 1
1 403 . 20 1 1 A 37 37 GLN HA H 75 3.860 4.439 -0.579 1
1 410 . 20 1 1 A 37 37 GLN C C 75 175.349 177.630 -2.281 1
1 411 . 20 1 1 A 37 37 GLN CA C 75 56.499 57.626 -1.127 1
1 412 . 20 1 1 A 37 37 GLN CB C 75 25.876 29.526 -3.650 1
1 414 . 20 1 1 A 37 37 GLN N N 75 117.931 119.650 -1.719 1
1 416 . 20 1 1 A 38 38 GLN H H 76 7.667 8.158 -0.491 1
1 417 . 20 1 1 A 38 38 GLN HA H 76 3.810 4.087 -0.277 1
1 424 . 20 1 1 A 38 38 GLN C C 76 175.805 179.501 -3.696 1
1 425 . 20 1 1 A 38 38 GLN CA C 76 55.874 58.650 -2.776 1
1 426 . 20 1 1 A 38 38 GLN CB C 76 25.876 28.320 -2.444 1
1 428 . 20 1 1 A 38 38 GLN N N 76 120.607 118.351 2.256 1
1 430 . 20 1 1 A 39 39 GLY H H 77 8.470 8.173 0.297 1
1 431 . 20 1 1 A 39 39 GLY HA2 H 77 3.920 3.679 0.241 1
1 432 . 20 1 1 A 39 39 GLY HA3 H 77 3.603 3.748 -0.145 1
1 433 . 20 1 1 A 39 39 GLY C C 77 169.006 175.377 -6.371 1
1 434 . 20 1 1 A 39 39 GLY CA C 77 42.125 46.527 -4.402 1
1 435 . 20 1 1 A 39 39 GLY N N 77 103.281 109.292 -6.011 1
1 436 . 20 1 1 A 40 40 LEU H H 78 8.135 7.780 0.355 1
1 437 . 20 1 1 A 40 40 LEU HA H 78 3.237 4.116 -0.879 1
1 447 . 20 1 1 A 40 40 LEU C C 78 176.383 178.664 -2.281 1
1 448 . 20 1 1 A 40 40 LEU CA C 78 52.749 57.142 -4.393 1
1 449 . 20 1 1 A 40 40 LEU CB C 78 39.000 41.562 -2.562 1
1 453 . 20 1 1 A 40 40 LEU N N 78 114.444 123.349 -8.905 1
1 454 . 20 1 1 A 41 41 GLU H H 79 8.578 7.926 0.652 1
1 455 . 20 1 1 A 41 41 GLU HA H 79 3.720 4.038 -0.318 1
1 460 . 20 1 1 A 41 41 GLU C C 79 175.093 178.132 -3.039 1
1 461 . 20 1 1 A 41 41 GLU CA C 79 57.124 59.606 -2.482 1
1 462 . 20 1 1 A 41 41 GLU CB C 79 26.501 29.334 -2.833 1
1 464 . 20 1 1 A 41 41 GLU N N 79 118.295 118.467 -0.172 1
1 465 . 20 1 1 A 42 42 ALA H H 80 7.227 7.788 -0.561 1
1 466 . 20 1 1 A 42 42 ALA HA H 80 4.437 4.934 -0.497 1
1 470 . 20 1 1 A 42 42 ALA C C 80 173.745 178.594 -4.849 1
1 471 . 20 1 1 A 42 42 ALA CA C 80 51.499 53.541 -2.042 1
1 472 . 20 1 1 A 42 42 ALA CB C 80 15.877 19.127 -3.250 1
1 473 . 20 1 1 A 42 42 ALA N N 80 119.751 121.644 -1.893 1
1 474 . 20 1 1 A 43 43 LEU H H 81 7.932 7.635 0.297 1
1 475 . 20 1 1 A 43 43 LEU HA H 81 4.369 4.512 -0.143 1
1 485 . 20 1 1 A 43 43 LEU C C 81 174.788 178.015 -3.227 1
1 486 . 20 1 1 A 43 43 LEU CA C 81 53.374 56.202 -2.828 1
1 487 . 20 1 1 A 43 43 LEU CB C 81 39.625 42.267 -2.642 1
1 491 . 20 1 1 A 43 43 LEU N N 81 111.742 116.988 -5.246 1
1 492 . 20 1 1 A 44 44 VAL H H 82 7.886 7.470 0.416 1
1 493 . 20 1 1 A 44 44 VAL HA H 82 4.700 4.159 0.541 1
1 501 . 20 1 1 A 44 44 VAL C C 82 172.875 175.555 -2.680 1
1 502 . 20 1 1 A 44 44 VAL CA C 82 59.624 63.715 -4.091 1
1 503 . 20 1 1 A 44 44 VAL CB C 82 31.501 33.439 -1.938 1
1 506 . 20 1 1 A 44 44 VAL N N 82 113.604 115.608 -2.004 1
1 507 . 20 1 1 A 45 45 LYS H H 83 8.361 8.125 0.236 1
1 508 . 20 1 1 A 45 45 LYS HA H 83 4.251 4.874 -0.623 1
1 515 . 20 1 1 A 45 45 LYS C C 83 171.053 175.935 -4.882 1
1 516 . 20 1 1 A 45 45 LYS CA C 83 52.749 54.444 -1.695 1
1 517 . 20 1 1 A 45 45 LYS CB C 83 33.375 36.665 -3.290 1
1 521 . 20 1 1 A 45 45 LYS N N 83 123.860 118.534 5.326 1
1 522 . 20 1 1 A 46 46 LYS H H 84 7.243 7.905 -0.662 1
1 523 . 20 1 1 A 46 46 LYS HA H 84 2.175 2.898 -0.723 1
1 532 . 20 1 1 A 46 46 LYS C C 84 172.123 174.366 -2.243 1
1 533 . 20 1 1 A 46 46 LYS CA C 84 52.749 54.449 -1.700 1
1 534 . 20 1 1 A 46 46 LYS CB C 84 29.626 31.378 -1.752 1
1 537 . 20 1 1 A 46 46 LYS N N 84 128.615 122.085 6.530 1
1 538 . 20 1 1 A 47 47 PRO HA H 85 4.470 4.519 -0.049 1
1 541 . 20 1 1 A 47 47 PRO C C 85 173.754 175.849 -2.095 1
1 542 . 20 1 1 A 47 47 PRO CA C 85 60.874 62.734 -1.860 1
1 543 . 20 1 1 A 47 47 PRO CB C 85 30.876 32.173 -1.297 1
1 546 . 20 1 1 A 48 48 THR H H 86 8.306 8.404 -0.098 1
1 547 . 20 1 1 A 48 48 THR HA H 86 4.287 5.156 -0.869 1
1 552 . 20 1 1 A 48 48 THR C C 86 173.070 173.470 -0.400 1
1 553 . 20 1 1 A 48 48 THR CA C 86 57.749 60.400 -2.651 1
1 554 . 20 1 1 A 48 48 THR CB C 86 67.748 70.503 -2.755 1
1 556 . 20 1 1 A 48 48 THR N N 86 109.564 112.015 -2.451 1
1 557 . 20 1 1 A 49 49 GLY H H 87 8.317 8.279 0.038 1
1 558 . 20 1 1 A 49 49 GLY HA2 H 87 3.851 4.191 -0.340 1
1 559 . 20 1 1 A 49 49 GLY HA3 H 87 3.678 4.199 -0.521 1
1 560 . 20 1 1 A 49 49 GLY C C 87 169.693 172.260 -2.567 1
1 561 . 20 1 1 A 49 49 GLY CA C 87 42.125 45.455 -3.330 1
1 562 . 20 1 1 A 49 49 GLY N N 87 109.071 109.560 -0.489 1
1 563 . 20 1 1 A 50 50 ASN H H 88 8.301 8.430 -0.129 1
1 564 . 20 1 1 A 50 50 ASN HA H 88 4.780 5.400 -0.620 1
1 569 . 20 1 1 A 50 50 ASN C C 88 171.370 172.612 -1.242 1
1 570 . 20 1 1 A 50 50 ASN CA C 88 47.749 50.429 -2.680 1
1 571 . 20 1 1 A 50 50 ASN CB C 88 37.125 39.683 -2.558 1
1 572 . 20 1 1 A 50 50 ASN N N 88 115.631 122.511 -6.880 1
1 574 . 20 1 1 A 51 51 PRO HA H 89 4.782 4.680 0.102 1
1 577 . 20 1 1 A 51 51 PRO C C 89 173.656 175.921 -2.265 1
1 578 . 20 1 1 A 51 51 PRO CA C 89 59.624 62.074 -2.450 1
1 579 . 20 1 1 A 51 51 PRO CB C 89 31.501 32.566 -1.065 1
1 582 . 20 1 1 A 52 52 GLN H H 90 9.076 8.964 0.112 1
1 583 . 20 1 1 A 52 52 GLN HA H 90 4.469 4.846 -0.377 1
1 590 . 20 1 1 A 52 52 GLN C C 90 172.386 173.994 -1.608 1
1 591 . 20 1 1 A 52 52 GLN CA C 90 50.874 53.615 -2.741 1
1 592 . 20 1 1 A 52 52 GLN CB C 90 26.501 27.945 -1.444 1
1 594 . 20 1 1 A 52 52 GLN N N 90 126.827 119.680 7.147 1
1 596 . 20 1 1 A 53 53 PRO HA H 91 4.384 4.637 -0.253 1
1 599 . 20 1 1 A 53 53 PRO C C 91 174.274 175.248 -0.974 1
1 600 . 20 1 1 A 53 53 PRO CB C 91 28.113 31.389 -3.276 1
1 601 . 20 1 1 A 54 54 LYS H H 92 8.401 8.367 0.034 1
1 602 . 20 1 1 A 54 54 LYS HA H 92 3.984 4.724 -0.740 1
1 611 . 20 1 1 A 54 54 LYS C C 92 173.516 174.759 -1.243 1
1 612 . 20 1 1 A 54 54 LYS CA C 92 55.249 55.311 -0.062 1
1 613 . 20 1 1 A 54 54 LYS CB C 92 30.876 36.117 -5.241 1
1 615 . 20 1 1 A 54 54 LYS N N 92 124.538 124.207 0.331 1
1 616 . 20 1 1 A 55 55 ASN H H 93 8.183 8.738 -0.555 1
1 617 . 20 1 1 A 55 55 ASN HA H 93 4.716 4.875 -0.159 1
1 622 . 20 1 1 A 55 55 ASN CA C 93 48.999 53.407 -4.408 1
1 623 . 20 1 1 A 55 55 ASN CB C 93 35.875 37.805 -1.930 1
1 624 . 20 1 1 A 55 55 ASN N N 93 118.677 122.329 -3.652 1
1 626 . 20 1 1 A 56 56 TRP H H 94 8.007 8.601 -0.594 1
1 627 . 20 1 1 A 56 56 TRP HA H 94 3.827 5.380 -1.553 1
1 635 . 20 1 1 A 56 56 TRP C C 94 173.760 175.493 -1.733 1
1 636 . 20 1 1 A 56 56 TRP CA C 94 59.624 58.507 1.117 1
1 637 . 20 1 1 A 56 56 TRP CB C 94 27.126 30.231 -3.105 1
1 638 . 20 1 1 A 56 56 TRP N N 94 122.195 127.990 -5.795 1
1 640 . 20 1 1 A 57 57 ASN H H 95 7.563 7.151 0.412 1
1 641 . 20 1 1 A 57 57 ASN HA H 95 3.735 4.649 -0.914 1
1 646 . 20 1 1 A 57 57 ASN C C 95 171.952 173.535 -1.583 1
1 647 . 20 1 1 A 57 57 ASN CA C 95 51.499 51.144 0.355 1
1 648 . 20 1 1 A 57 57 ASN CB C 95 35.250 41.234 -5.984 1
1 649 . 20 1 1 A 57 57 ASN N N 95 129.659 125.054 4.605 1
1 651 . 20 1 1 A 58 58 LYS H H 96 8.110 8.012 0.098 1
1 652 . 20 1 1 A 58 58 LYS HA H 96 4.035 4.276 -0.241 1
1 659 . 20 1 1 A 58 58 LYS C C 96 174.530 175.424 -0.894 1
1 660 . 20 1 1 A 58 58 LYS CA C 96 56.499 54.658 1.841 1
1 661 . 20 1 1 A 58 58 LYS CB C 96 29.626 32.731 -3.105 1
1 665 . 20 1 1 A 58 58 LYS N N 96 123.913 121.776 2.137 1
1 666 . 20 1 1 A 59 59 ASP H H 97 7.903 9.265 -1.362 1
1 667 . 20 1 1 A 59 59 ASP HA H 97 4.393 4.509 -0.116 1
1 670 . 20 1 1 A 59 59 ASP C C 97 173.724 176.368 -2.644 1
1 671 . 20 1 1 A 59 59 ASP CA C 97 52.124 55.376 -3.252 1
1 672 . 20 1 1 A 59 59 ASP CB C 97 38.375 39.251 -0.876 1
1 673 . 20 1 1 A 59 59 ASP N N 97 118.773 117.698 1.075 1
1 674 . 20 1 1 A 60 60 GLY H H 98 7.819 7.954 -0.135 1
1 675 . 20 1 1 A 60 60 GLY HA2 H 98 3.917 3.748 0.169 1
1 676 . 20 1 1 A 60 60 GLY HA3 H 98 3.917 4.010 -0.093 1
1 677 . 20 1 1 A 60 60 GLY C C 98 168.652 174.474 -5.822 1
1 678 . 20 1 1 A 60 60 GLY CA C 98 41.500 45.555 -4.055 1
1 679 . 20 1 1 A 60 60 GLY N N 98 108.742 105.135 3.607 1
1 680 . 20 1 1 A 61 61 TYR H H 99 8.105 7.977 0.128 1
1 681 . 20 1 1 A 61 61 TYR HA H 99 3.927 4.115 -0.188 1
1 689 . 20 1 1 A 61 61 TYR C C 99 172.831 174.151 -1.320 1
1 690 . 20 1 1 A 61 61 TYR CA C 99 57.124 58.057 -0.933 1
1 691 . 20 1 1 A 61 61 TYR CB C 99 37.125 36.895 0.230 1
1 692 . 20 1 1 A 61 61 TYR N N 99 113.836 113.225 0.611 1
1 693 . 20 1 1 A 62 62 LEU H H 100 7.352 8.033 -0.681 1
1 694 . 20 1 1 A 62 62 LEU HA H 100 4.343 5.002 -0.659 1
1 704 . 20 1 1 A 62 62 LEU C C 100 173.430 175.415 -1.985 1
1 705 . 20 1 1 A 62 62 LEU CA C 100 50.874 53.648 -2.774 1
1 706 . 20 1 1 A 62 62 LEU CB C 100 44.000 46.357 -2.357 1
1 710 . 20 1 1 A 62 62 LEU N N 100 117.112 123.746 -6.634 1
1 711 . 20 1 1 A 63 63 LYS H H 101 8.626 8.299 0.327 1
1 712 . 20 1 1 A 63 63 LYS HA H 101 3.986 4.478 -0.492 1
1 721 . 20 1 1 A 63 63 LYS C C 101 173.851 176.853 -3.002 1
1 722 . 20 1 1 A 63 63 LYS CA C 101 55.249 55.446 -0.197 1
1 723 . 20 1 1 A 63 63 LYS CB C 101 29.626 33.637 -4.011 1
1 724 . 20 1 1 A 63 63 LYS N N 101 129.991 123.454 6.537 1
1 725 . 20 1 1 A 64 64 LYS H H 102 7.059 8.539 -1.480 1
1 726 . 20 1 1 A 64 64 LYS HA H 102 4.138 4.229 -0.091 1
1 735 . 20 1 1 A 64 64 LYS C C 102 171.120 175.738 -4.618 1
1 736 . 20 1 1 A 64 64 LYS CA C 102 52.749 56.342 -3.593 1
1 737 . 20 1 1 A 64 64 LYS CB C 102 32.750 31.320 1.430 1
1 740 . 20 1 1 A 64 64 LYS N N 102 113.255 120.948 -7.693 1
1 741 . 20 1 1 A 65 65 LEU H H 103 8.883 8.164 0.719 1
1 742 . 20 1 1 A 65 65 LEU HA H 103 4.475 4.751 -0.276 1
1 752 . 20 1 1 A 65 65 LEU C C 103 171.487 175.168 -3.681 1
1 753 . 20 1 1 A 65 65 LEU CA C 103 48.999 51.151 -2.152 1
1 754 . 20 1 1 A 65 65 LEU CB C 103 39.625 45.029 -5.404 1
1 758 . 20 1 1 A 65 65 LEU N N 103 126.355 122.545 3.810 1
1 759 . 20 1 1 A 66 66 PRO HA H 104 4.449 4.639 -0.190 1
1 764 . 20 1 1 A 66 66 PRO C C 104 173.363 176.296 -2.933 1
1 765 . 20 1 1 A 66 66 PRO CA C 104 60.249 62.256 -2.007 1
1 766 . 20 1 1 A 66 66 PRO CB C 104 29.626 32.927 -3.301 1
1 769 . 20 1 1 A 67 67 VAL H H 105 7.682 8.387 -0.705 1
1 770 . 20 1 1 A 67 67 VAL HA H 105 4.121 4.464 -0.343 1
1 778 . 20 1 1 A 67 67 VAL C C 105 171.667 174.662 -2.995 1
1 779 . 20 1 1 A 67 67 VAL CA C 105 58.374 61.219 -2.845 1
1 780 . 20 1 1 A 67 67 VAL CB C 105 30.251 33.209 -2.958 1
1 783 . 20 1 1 A 67 67 VAL N N 105 114.671 121.221 -6.550 1
1 784 . 20 1 1 A 68 68 ASP H H 106 8.216 7.976 0.240 1
1 785 . 20 1 1 A 68 68 ASP HA H 106 4.474 5.043 -0.569 1
1 788 . 20 1 1 A 68 68 ASP C C 106 172.452 175.347 -2.895 1
1 789 . 20 1 1 A 68 68 ASP CA C 106 50.249 51.455 -1.206 1
1 790 . 20 1 1 A 68 68 ASP CB C 106 37.750 41.896 -4.146 1
1 791 . 20 1 1 A 68 68 ASP N N 106 123.825 125.704 -1.879 1
1 792 . 20 1 1 A 69 69 PRO HA H 107 3.920 4.084 -0.164 1
1 797 . 20 1 1 A 69 69 PRO CA C 107 62.123 63.255 -1.132 1
1 798 . 20 1 1 A 69 69 PRO CB C 107 27.751 31.517 -3.766 1
1 801 . 20 1 1 A 70 70 TRP H H 108 8.156 8.378 -0.222 1
1 802 . 20 1 1 A 70 70 TRP HA H 108 4.274 4.285 -0.011 1
1 811 . 20 1 1 A 70 70 TRP CA C 108 57.124 58.496 -1.372 1
1 812 . 20 1 1 A 70 70 TRP CB C 108 25.251 26.928 -1.677 1
1 813 . 20 1 1 A 70 70 TRP N N 108 118.137 118.021 0.116 1
1 815 . 20 1 1 A 71 71 GLY H H 109 8.209 8.739 -0.530 1
1 816 . 20 1 1 A 71 71 GLY HA2 H 109 4.030 3.894 0.136 1
1 817 . 20 1 1 A 71 71 GLY HA3 H 109 3.303 3.915 -0.612 1
1 818 . 20 1 1 A 71 71 GLY CA C 109 42.750 46.527 -3.777 1
1 819 . 20 1 1 A 71 71 GLY N N 109 107.495 105.403 2.092 1
1 820 . 20 1 1 A 72 72 ASN H H 110 8.116 7.967 0.149 1
1 821 . 20 1 1 A 72 72 ASN HA H 110 5.103 5.056 0.047 1
1 826 . 20 1 1 A 72 72 ASN CA C 110 48.374 50.117 -1.743 1
1 827 . 20 1 1 A 72 72 ASN CB C 110 36.500 38.956 -2.456 1
1 828 . 20 1 1 A 72 72 ASN N N 110 120.108 120.195 -0.087 1
1 830 . 20 1 1 A 73 73 PRO HA H 111 4.397 4.476 -0.079 1
1 835 . 20 1 1 A 73 73 PRO C C 111 176.229 176.489 -0.260 1
1 836 . 20 1 1 A 73 73 PRO CA C 111 60.249 62.582 -2.333 1
1 837 . 20 1 1 A 73 73 PRO CB C 111 29.001 31.854 -2.853 1
1 840 . 20 1 1 A 74 74 TYR H H 112 8.893 8.619 0.274 1
1 841 . 20 1 1 A 74 74 TYR HA H 112 4.064 4.722 -0.658 1
1 849 . 20 1 1 A 74 74 TYR C C 112 171.951 175.897 -3.946 1
1 850 . 20 1 1 A 74 74 TYR CA C 112 60.249 58.343 1.906 1
1 851 . 20 1 1 A 74 74 TYR CB C 112 36.500 39.495 -2.995 1
1 852 . 20 1 1 A 74 74 TYR N N 112 124.595 121.310 3.285 1
1 853 . 20 1 1 A 75 75 GLN H H 113 9.127 8.918 0.209 1
1 854 . 20 1 1 A 75 75 GLN HA H 113 4.019 4.312 -0.293 1
1 861 . 20 1 1 A 75 75 GLN C C 113 171.436 174.478 -3.042 1
1 862 . 20 1 1 A 75 75 GLN CA C 113 50.874 54.745 -3.871 1
1 863 . 20 1 1 A 75 75 GLN CB C 113 29.469 29.223 0.246 1
1 865 . 20 1 1 A 75 75 GLN N N 113 120.777 121.862 -1.085 1
1 867 . 20 1 1 A 76 76 TYR H H 114 7.906 8.262 -0.356 1
1 868 . 20 1 1 A 76 76 TYR HA H 114 5.586 5.604 -0.018 1
1 875 . 20 1 1 A 76 76 TYR C C 114 171.343 175.353 -4.010 1
1 876 . 20 1 1 A 76 76 TYR CA C 114 53.999 56.001 -2.002 1
1 877 . 20 1 1 A 76 76 TYR CB C 114 40.250 40.461 -0.211 1
1 878 . 20 1 1 A 76 76 TYR N N 114 120.757 122.589 -1.832 1
1 879 . 20 1 1 A 77 77 LEU H H 115 8.261 9.177 -0.916 1
1 880 . 20 1 1 A 77 77 LEU HA H 115 4.280 5.192 -0.912 1
1 890 . 20 1 1 A 77 77 LEU C C 115 170.921 175.943 -5.022 1
1 891 . 20 1 1 A 77 77 LEU CA C 115 51.499 53.419 -1.920 1
1 892 . 20 1 1 A 77 77 LEU CB C 115 44.625 45.447 -0.822 1
1 896 . 20 1 1 A 77 77 LEU N N 115 130.662 126.231 4.431 1
1 897 . 20 1 1 A 78 78 ALA H H 116 7.973 8.640 -0.667 1
1 898 . 20 1 1 A 78 78 ALA HA H 116 4.292 4.738 -0.446 1
1 902 . 20 1 1 A 78 78 ALA C C 116 172.093 174.995 -2.902 1
1 903 . 20 1 1 A 78 78 ALA CA C 116 47.749 49.942 -2.193 1
1 904 . 20 1 1 A 78 78 ALA CB C 116 19.626 20.610 -0.984 1
1 905 . 20 1 1 A 78 78 ALA N N 116 125.564 126.286 -0.722 1
1 906 . 20 1 1 A 79 79 PRO HA H 117 4.698 5.342 -0.644 1
1 911 . 20 1 1 A 79 79 PRO C C 117 173.994 176.536 -2.542 1
1 912 . 20 1 1 A 79 79 PRO CA C 117 60.249 63.258 -3.009 1
1 913 . 20 1 1 A 79 79 PRO CB C 117 31.501 32.116 -0.615 1
1 916 . 20 1 1 A 80 80 GLY H H 118 7.096 7.887 -0.791 1
1 917 . 20 1 1 A 80 80 GLY HA2 H 118 3.797 4.021 -0.224 1
1 918 . 20 1 1 A 80 80 GLY HA3 H 118 3.517 4.039 -0.522 1
1 919 . 20 1 1 A 80 80 GLY C C 118 171.404 173.660 -2.256 1
1 920 . 20 1 1 A 80 80 GLY CA C 118 41.500 45.570 -4.070 1
1 921 . 20 1 1 A 80 80 GLY N N 118 108.306 107.730 0.576 1
1 922 . 20 1 1 A 81 81 THR H H 119 9.810 8.269 1.541 1
1 923 . 20 1 1 A 81 81 THR HA H 119 4.091 4.550 -0.459 1
1 928 . 20 1 1 A 81 81 THR C C 119 174.242 175.355 -1.113 1
1 929 . 20 1 1 A 81 81 THR CA C 119 60.874 60.806 0.068 1
1 930 . 20 1 1 A 81 81 THR CB C 119 66.498 69.475 -2.977 1
1 932 . 20 1 1 A 81 81 THR N N 119 112.813 113.986 -1.173 1
1 933 . 20 1 1 A 82 82 LYS H H 120 8.964 8.608 0.356 1
1 934 . 20 1 1 A 82 82 LYS HA H 120 4.150 4.117 0.033 1
1 941 . 20 1 1 A 82 82 LYS C C 120 172.886 175.342 -2.456 1
1 942 . 20 1 1 A 82 82 LYS CA C 120 53.999 57.655 -3.656 1
1 943 . 20 1 1 A 82 82 LYS CB C 120 30.876 30.433 0.443 1
1 944 . 20 1 1 A 82 82 LYS N N 120 123.569 124.274 -0.705 1
1 945 . 20 1 1 A 83 83 GLY H H 121 7.125 8.016 -0.891 1
1 946 . 20 1 1 A 83 83 GLY HA2 H 121 3.814 3.961 -0.147 1
1 947 . 20 1 1 A 83 83 GLY HA3 H 121 3.814 4.016 -0.202 1
1 948 . 20 1 1 A 83 83 GLY C C 121 167.671 174.363 -6.692 1
1 949 . 20 1 1 A 83 83 GLY CA C 121 42.125 45.031 -2.906 1
1 950 . 20 1 1 A 83 83 GLY N N 121 107.253 107.985 -0.732 1
1 951 . 20 1 1 A 84 84 PRO HA H 122 4.077 4.386 -0.309 1
1 958 . 20 1 1 A 84 84 PRO C C 122 175.199 176.630 -1.431 1
1 959 . 20 1 1 A 84 84 PRO CA C 122 63.373 64.338 -0.965 1
1 960 . 20 1 1 A 84 84 PRO CB C 122 30.251 31.991 -1.740 1
1 962 . 20 1 1 A 85 85 PHE H H 123 6.652 6.752 -0.100 1
1 963 . 20 1 1 A 85 85 PHE HA H 123 4.744 4.719 0.025 1
1 971 . 20 1 1 A 85 85 PHE C C 123 170.340 172.547 -2.207 1
1 972 . 20 1 1 A 85 85 PHE CA C 123 53.999 56.317 -2.318 1
1 973 . 20 1 1 A 85 85 PHE CB C 123 39.000 40.270 -1.270 1
1 974 . 20 1 1 A 85 85 PHE N N 123 108.468 112.430 -3.962 1
1 975 . 20 1 1 A 86 86 ASP H H 124 9.268 9.349 -0.081 1
1 976 . 20 1 1 A 86 86 ASP HA H 124 5.108 5.376 -0.268 1
1 979 . 20 1 1 A 86 86 ASP C C 124 171.180 174.664 -3.484 1
1 980 . 20 1 1 A 86 86 ASP CA C 124 50.249 53.553 -3.304 1
1 981 . 20 1 1 A 86 86 ASP CB C 124 40.250 43.252 -3.002 1
1 982 . 20 1 1 A 86 86 ASP N N 124 121.741 119.143 2.598 1
1 983 . 20 1 1 A 87 87 LEU H H 125 8.018 9.378 -1.360 1
1 984 . 20 1 1 A 87 87 LEU HA H 125 5.809 5.630 0.179 1
1 994 . 20 1 1 A 87 87 LEU C C 125 171.350 175.039 -3.689 1
1 995 . 20 1 1 A 87 87 LEU CA C 125 50.874 53.417 -2.543 1
1 996 . 20 1 1 A 87 87 LEU CB C 125 44.318 45.664 -1.346 1
1 999 . 20 1 1 A 87 87 LEU N N 125 123.629 127.623 -3.994 1
1 1000 . 20 1 1 A 88 88 TYR H H 126 8.912 8.540 0.372 1
1 1001 . 20 1 1 A 88 88 TYR HA H 126 5.630 5.620 0.010 1
1 1008 . 20 1 1 A 88 88 TYR C C 126 171.410 172.180 -0.770 1
1 1009 . 20 1 1 A 88 88 TYR CA C 126 52.749 56.613 -3.864 1
1 1010 . 20 1 1 A 88 88 TYR CB C 126 37.750 40.422 -2.672 1
1 1011 . 20 1 1 A 88 88 TYR N N 126 119.697 121.714 -2.017 1
1 1012 . 20 1 1 A 89 89 SER H H 127 9.319 9.263 0.056 1
1 1013 . 20 1 1 A 89 89 SER HA H 127 5.429 5.107 0.322 1
1 1016 . 20 1 1 A 89 89 SER CA C 127 52.124 56.184 -4.060 1
1 1017 . 20 1 1 A 89 89 SER CB C 127 62.748 65.441 -2.693 1
1 1018 . 20 1 1 A 89 89 SER N N 127 112.637 115.824 -3.187 1
1 1019 . 20 1 1 A 90 90 LEU H H 128 8.759 8.541 0.218 1
1 1020 . 20 1 1 A 90 90 LEU HA H 128 4.186 4.336 -0.150 1
1 1030 . 20 1 1 A 90 90 LEU C C 128 175.121 177.757 -2.636 1
1 1031 . 20 1 1 A 90 90 LEU CA C 128 52.749 55.275 -2.526 1
1 1032 . 20 1 1 A 90 90 LEU CB C 128 35.875 41.640 -5.765 1
1 1033 . 20 1 1 A 90 90 LEU N N 128 126.728 126.896 -0.168 1
1 1034 . 20 1 1 A 91 91 GLY H H 129 8.356 8.236 0.120 1
1 1035 . 20 1 1 A 91 91 GLY HA2 H 129 3.373 2.623 0.750 1
1 1036 . 20 1 1 A 91 91 GLY HA3 H 129 3.373 3.454 -0.081 1
1 1037 . 20 1 1 A 91 91 GLY C C 129 172.013 174.003 -1.990 1
1 1038 . 20 1 1 A 91 91 GLY CA C 129 41.500 43.622 -2.122 1
1 1039 . 20 1 1 A 91 91 GLY N N 129 108.559 109.943 -1.384 1
1 1040 . 20 1 1 A 92 92 ALA H H 130 7.047 7.990 -0.943 1
1 1041 . 20 1 1 A 92 92 ALA HA H 130 4.037 3.448 0.589 1
1 1045 . 20 1 1 A 92 92 ALA C C 130 174.890 177.760 -2.870 1
1 1046 . 20 1 1 A 92 92 ALA CA C 130 52.100 53.561 -1.461 1
1 1047 . 20 1 1 A 92 92 ALA CB C 130 16.502 18.382 -1.880 1
1 1048 . 20 1 1 A 92 92 ALA N N 130 118.393 121.650 -3.257 1
1 1049 . 20 1 1 A 93 93 ASP H H 131 7.222 7.564 -0.342 1
1 1050 . 20 1 1 A 93 93 ASP HA H 131 4.122 4.679 -0.557 1
1 1053 . 20 1 1 A 93 93 ASP C C 131 174.890 176.346 -1.456 1
1 1054 . 20 1 1 A 93 93 ASP CA C 131 50.249 53.882 -3.633 1
1 1055 . 20 1 1 A 93 93 ASP CB C 131 37.750 41.426 -3.676 1
1 1056 . 20 1 1 A 93 93 ASP N N 131 111.487 116.753 -5.266 1
1 1057 . 20 1 1 A 94 94 GLY H H 132 7.199 8.823 -1.624 1
1 1058 . 20 1 1 A 94 94 GLY HA2 H 132 3.951 3.852 0.099 1
1 1059 . 20 1 1 A 94 94 GLY HA3 H 132 3.324 3.877 -0.553 1
1 1060 . 20 1 1 A 94 94 GLY C C 132 169.773 173.735 -3.962 1
1 1061 . 20 1 1 A 94 94 GLY CA C 132 44.625 45.971 -1.346 1
1 1062 . 20 1 1 A 94 94 GLY N N 132 106.932 108.223 -1.291 1
1 1063 . 20 1 1 A 95 95 LYS H H 133 7.215 7.526 -0.311 1
1 1064 . 20 1 1 A 95 95 LYS HA H 133 4.513 4.862 -0.349 1
1 1073 . 20 1 1 A 95 95 LYS C C 133 172.108 174.644 -2.536 1
1 1074 . 20 1 1 A 95 95 LYS CA C 133 51.512 54.899 -3.387 1
1 1075 . 20 1 1 A 95 95 LYS CB C 133 34.000 35.657 -1.657 1
1 1076 . 20 1 1 A 95 95 LYS N N 133 115.749 120.177 -4.428 1
1 1077 . 20 1 1 A 96 96 GLU H H 134 9.230 8.645 0.585 1
1 1078 . 20 1 1 A 96 96 GLU HA H 134 4.352 4.530 -0.178 1
1 1083 . 20 1 1 A 96 96 GLU C C 134 175.219 176.404 -1.185 1
1 1084 . 20 1 1 A 96 96 GLU CA C 134 55.874 56.399 -0.525 1
1 1085 . 20 1 1 A 96 96 GLU CB C 134 27.126 30.009 -2.883 1
1 1087 . 20 1 1 A 96 96 GLU N N 134 128.571 123.244 5.327 1
1 1088 . 20 1 1 A 97 97 GLY H H 135 10.677 8.058 2.619 1
1 1089 . 20 1 1 A 97 97 GLY HA2 H 135 4.037 4.344 -0.307 1
1 1090 . 20 1 1 A 97 97 GLY HA3 H 135 3.717 4.349 -0.632 1
1 1091 . 20 1 1 A 97 97 GLY C C 135 171.567 172.262 -0.695 1
1 1092 . 20 1 1 A 97 97 GLY CA C 135 41.500 45.760 -4.260 1
1 1093 . 20 1 1 A 97 97 GLY N N 135 117.011 110.569 6.442 1
1 1094 . 20 1 1 A 98 98 GLY H H 136 8.442 8.677 -0.235 1
1 1095 . 20 1 1 A 98 98 GLY HA2 H 136 4.195 4.213 -0.018 1
1 1096 . 20 1 1 A 98 98 GLY HA3 H 136 4.195 4.222 -0.027 1
1 1097 . 20 1 1 A 98 98 GLY C C 136 170.299 173.298 -2.999 1
1 1098 . 20 1 1 A 98 98 GLY CA C 136 40.875 44.771 -3.896 1
1 1099 . 20 1 1 A 98 98 GLY N N 136 109.494 109.198 0.296 1
1 1100 . 20 1 1 A 99 99 SER H H 137 8.701 8.693 0.008 1
1 1101 . 20 1 1 A 99 99 SER HA H 137 4.639 4.913 -0.274 1
1 1104 . 20 1 1 A 99 99 SER C C 137 170.630 173.819 -3.189 1
1 1105 . 20 1 1 A 99 99 SER CA C 137 54.624 57.541 -2.917 1
1 1106 . 20 1 1 A 99 99 SER CB C 137 62.748 66.639 -3.891 1
1 1107 . 20 1 1 A 99 99 SER N N 137 114.685 118.223 -3.538 1
1 1108 . 20 1 1 A 100 100 ASP H H 138 9.117 8.818 0.299 1
1 1109 . 20 1 1 A 100 100 ASP HA H 138 3.965 4.573 -0.608 1
1 1112 . 20 1 1 A 100 100 ASP C C 138 175.540 177.339 -1.799 1
1 1113 . 20 1 1 A 100 100 ASP CA C 138 54.624 56.126 -1.502 1
1 1114 . 20 1 1 A 100 100 ASP CB C 138 36.500 41.422 -4.922 1
1 1115 . 20 1 1 A 100 100 ASP N N 138 120.777 123.474 -2.697 1
1 1116 . 20 1 1 A 101 101 ASN H H 139 8.667 8.193 0.474 1
1 1117 . 20 1 1 A 101 101 ASN HA H 139 4.333 4.849 -0.516 1
1 1122 . 20 1 1 A 101 101 ASN CA C 139 53.999 53.993 0.006 1
1 1123 . 20 1 1 A 101 101 ASN CB C 139 34.625 39.434 -4.809 1
1 1124 . 20 1 1 A 101 101 ASN N N 139 121.930 114.375 7.555 1
1 1126 . 20 1 1 A 102 102 ASP H H 140 7.714 7.921 -0.207 1
1 1127 . 20 1 1 A 102 102 ASP HA H 140 4.037 4.378 -0.341 1
1 1130 . 20 1 1 A 102 102 ASP C C 140 172.807 176.662 -3.855 1
1 1131 . 20 1 1 A 102 102 ASP CA C 140 53.374 56.539 -3.165 1
1 1132 . 20 1 1 A 102 102 ASP CB C 140 37.125 41.306 -4.181 1
1 1133 . 20 1 1 A 102 102 ASP N N 140 118.011 118.438 -0.427 1
1 1134 . 20 1 1 A 103 103 ALA H H 141 7.060 7.524 -0.464 1
1 1135 . 20 1 1 A 103 103 ALA HA H 141 3.353 4.254 -0.901 1
1 1139 . 20 1 1 A 103 103 ALA C C 141 172.233 176.802 -4.569 1
1 1140 . 20 1 1 A 103 103 ALA CA C 141 49.624 51.883 -2.259 1
1 1141 . 20 1 1 A 103 103 ALA CB C 141 16.502 19.955 -3.453 1
1 1142 . 20 1 1 A 103 103 ALA N N 141 125.777 121.247 4.530 1
1 1143 . 20 1 1 A 104 104 ASP H H 142 7.973 8.503 -0.530 1
1 1144 . 20 1 1 A 104 104 ASP HA H 142 4.420 4.884 -0.464 1
1 1147 . 20 1 1 A 104 104 ASP C C 142 174.188 176.049 -1.861 1
1 1148 . 20 1 1 A 104 104 ASP CA C 142 52.124 54.014 -1.890 1
1 1149 . 20 1 1 A 104 104 ASP CB C 142 37.125 41.218 -4.093 1
1 1150 . 20 1 1 A 104 104 ASP N N 142 122.965 119.449 3.516 1
1 1151 . 20 1 1 A 105 105 ILE H H 143 8.534 8.623 -0.089 1
1 1152 . 20 1 1 A 105 105 ILE HA H 143 4.060 4.924 -0.864 1
1 1162 . 20 1 1 A 105 105 ILE C C 143 173.235 176.025 -2.790 1
1 1163 . 20 1 1 A 105 105 ILE CA C 143 58.374 59.727 -1.353 1
1 1164 . 20 1 1 A 105 105 ILE CB C 143 39.123 39.685 -0.562 1
1 1167 . 20 1 1 A 105 105 ILE N N 143 124.757 120.171 4.586 1
1 1168 . 20 1 1 A 106 106 GLY H H 144 8.288 8.180 0.108 1
1 1169 . 20 1 1 A 106 106 GLY HA2 H 144 4.764 4.407 0.357 1
1 1170 . 20 1 1 A 106 106 GLY HA3 H 144 4.764 4.423 0.341 1
1 1171 . 20 1 1 A 106 106 GLY C C 144 171.321 171.566 -0.245 1
1 1172 . 20 1 1 A 106 106 GLY CA C 144 40.250 45.789 -5.539 1
1 1173 . 20 1 1 A 106 106 GLY N N 144 110.895 110.358 0.537 1
1 1174 . 20 1 1 A 107 107 ASN H H 145 8.577 9.043 -0.466 1
1 1175 . 20 1 1 A 107 107 ASN HA H 145 4.268 5.062 -0.794 1
1 1180 . 20 1 1 A 107 107 ASN C C 145 171.757 173.675 -1.918 1
1 1181 . 20 1 1 A 107 107 ASN CA C 145 52.124 51.941 0.183 1
1 1182 . 20 1 1 A 107 107 ASN CB C 145 34.625 41.897 -7.272 1
1 1183 . 20 1 1 A 107 107 ASN N N 145 118.042 115.958 2.084 1
1 1185 . 20 1 1 A 108 108 TRP H H 146 6.822 8.485 -1.663 1
1 1186 . 20 1 1 A 108 108 TRP HA H 146 4.513 5.117 -0.604 1
1 1195 . 20 1 1 A 108 108 TRP C C 146 172.665 172.047 0.618 1
1 1196 . 20 1 1 A 108 108 TRP CA C 146 54.624 55.699 -1.075 1
1 1197 . 20 1 1 A 108 108 TRP CB C 146 25.876 31.064 -5.188 1
1 1198 . 20 1 1 A 108 108 TRP N N 146 116.756 117.810 -1.054 1
1 1200 . 20 1 1 A 109 109 ASP H H 147 7.344 7.808 -0.464 1
1 1201 . 20 1 1 A 109 109 ASP HA H 147 4.655 5.366 -0.711 1
1 1204 . 20 1 1 A 109 109 ASP C C 147 172.193 174.497 -2.304 1
1 1205 . 20 1 1 A 109 109 ASP CA C 147 51.499 52.447 -0.948 1
1 1206 . 20 1 1 A 109 109 ASP CB C 147 39.000 43.911 -4.911 1
1 1207 . 20 1 1 A 109 109 ASP N N 147 121.461 120.559 0.902 1
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Assigned_chem_shift_list_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Entity_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Entity_delta_chem_shifts_ID
1 1 1 1 "RMS(OBS, PRED)" C 98 2.893 1
2 1 1 1 "RMS(OBS, PRED)" CA 107 2.508 1
3 1 1 1 "RMS(OBS, PRED)" CB 96 3.137 1
4 1 1 1 "RMS(OBS, PRED)" H 98 0.609 1
5 1 1 1 "RMS(OBS, PRED)" HA 119 0.493 1
6 1 1 1 "RMS(OBS, PRED)" N 98 3.718 1
7 1 2 1 "RMS(OBS, PRED)" C 98 2.961 1
8 1 2 1 "RMS(OBS, PRED)" CA 107 2.473 1
9 1 2 1 "RMS(OBS, PRED)" CB 96 3.015 1
10 1 2 1 "RMS(OBS, PRED)" H 98 0.654 1
11 1 2 1 "RMS(OBS, PRED)" HA 119 0.482 1
12 1 2 1 "RMS(OBS, PRED)" N 98 3.432 1
13 1 3 1 "RMS(OBS, PRED)" C 98 2.881 1
14 1 3 1 "RMS(OBS, PRED)" CA 107 2.510 1
15 1 3 1 "RMS(OBS, PRED)" CB 96 3.077 1
16 1 3 1 "RMS(OBS, PRED)" H 98 0.664 1
17 1 3 1 "RMS(OBS, PRED)" HA 119 0.493 1
18 1 3 1 "RMS(OBS, PRED)" N 98 3.395 1
19 1 4 1 "RMS(OBS, PRED)" C 98 2.882 1
20 1 4 1 "RMS(OBS, PRED)" CA 107 2.476 1
21 1 4 1 "RMS(OBS, PRED)" CB 96 3.060 1
22 1 4 1 "RMS(OBS, PRED)" H 98 0.642 1
23 1 4 1 "RMS(OBS, PRED)" HA 119 0.511 1
24 1 4 1 "RMS(OBS, PRED)" N 98 3.466 1
25 1 5 1 "RMS(OBS, PRED)" C 98 2.884 1
26 1 5 1 "RMS(OBS, PRED)" CA 107 2.448 1
27 1 5 1 "RMS(OBS, PRED)" CB 96 3.123 1
28 1 5 1 "RMS(OBS, PRED)" H 98 0.637 1
29 1 5 1 "RMS(OBS, PRED)" HA 119 0.482 1
30 1 5 1 "RMS(OBS, PRED)" N 98 3.477 1
31 1 6 1 "RMS(OBS, PRED)" C 98 2.907 1
32 1 6 1 "RMS(OBS, PRED)" CA 107 2.495 1
33 1 6 1 "RMS(OBS, PRED)" CB 96 3.084 1
34 1 6 1 "RMS(OBS, PRED)" H 98 0.622 1
35 1 6 1 "RMS(OBS, PRED)" HA 119 0.471 1
36 1 6 1 "RMS(OBS, PRED)" N 98 3.645 1
37 1 7 1 "RMS(OBS, PRED)" C 98 2.859 1
38 1 7 1 "RMS(OBS, PRED)" CA 107 2.530 1
39 1 7 1 "RMS(OBS, PRED)" CB 96 3.110 1
40 1 7 1 "RMS(OBS, PRED)" H 98 0.611 1
41 1 7 1 "RMS(OBS, PRED)" HA 119 0.506 1
42 1 7 1 "RMS(OBS, PRED)" N 98 3.463 1
43 1 8 1 "RMS(OBS, PRED)" C 98 2.911 1
44 1 8 1 "RMS(OBS, PRED)" CA 107 2.530 1
45 1 8 1 "RMS(OBS, PRED)" CB 96 3.029 1
46 1 8 1 "RMS(OBS, PRED)" H 98 0.642 1
47 1 8 1 "RMS(OBS, PRED)" HA 119 0.511 1
48 1 8 1 "RMS(OBS, PRED)" N 98 3.556 1
49 1 9 1 "RMS(OBS, PRED)" C 98 2.896 1
50 1 9 1 "RMS(OBS, PRED)" CA 107 2.512 1
51 1 9 1 "RMS(OBS, PRED)" CB 96 3.130 1
52 1 9 1 "RMS(OBS, PRED)" H 98 0.597 1
53 1 9 1 "RMS(OBS, PRED)" HA 119 0.511 1
54 1 9 1 "RMS(OBS, PRED)" N 98 3.523 1
55 1 10 1 "RMS(OBS, PRED)" C 98 2.898 1
56 1 10 1 "RMS(OBS, PRED)" CA 107 2.493 1
57 1 10 1 "RMS(OBS, PRED)" CB 96 3.135 1
58 1 10 1 "RMS(OBS, PRED)" H 98 0.630 1
59 1 10 1 "RMS(OBS, PRED)" HA 119 0.479 1
60 1 10 1 "RMS(OBS, PRED)" N 98 3.468 1
61 1 11 1 "RMS(OBS, PRED)" C 98 2.834 1
62 1 11 1 "RMS(OBS, PRED)" CA 107 2.470 1
63 1 11 1 "RMS(OBS, PRED)" CB 96 3.104 1
64 1 11 1 "RMS(OBS, PRED)" H 98 0.645 1
65 1 11 1 "RMS(OBS, PRED)" HA 119 0.473 1
66 1 11 1 "RMS(OBS, PRED)" N 98 3.623 1
67 1 12 1 "RMS(OBS, PRED)" C 98 2.839 1
68 1 12 1 "RMS(OBS, PRED)" CA 107 2.479 1
69 1 12 1 "RMS(OBS, PRED)" CB 96 3.051 1
70 1 12 1 "RMS(OBS, PRED)" H 98 0.647 1
71 1 12 1 "RMS(OBS, PRED)" HA 119 0.517 1
72 1 12 1 "RMS(OBS, PRED)" N 98 3.674 1
73 1 13 1 "RMS(OBS, PRED)" C 98 2.935 1
74 1 13 1 "RMS(OBS, PRED)" CA 107 2.544 1
75 1 13 1 "RMS(OBS, PRED)" CB 96 3.004 1
76 1 13 1 "RMS(OBS, PRED)" H 98 0.672 1
77 1 13 1 "RMS(OBS, PRED)" HA 119 0.488 1
78 1 13 1 "RMS(OBS, PRED)" N 98 3.453 1
79 1 14 1 "RMS(OBS, PRED)" C 98 2.858 1
80 1 14 1 "RMS(OBS, PRED)" CA 107 2.503 1
81 1 14 1 "RMS(OBS, PRED)" CB 96 3.096 1
82 1 14 1 "RMS(OBS, PRED)" H 98 0.609 1
83 1 14 1 "RMS(OBS, PRED)" HA 119 0.504 1
84 1 14 1 "RMS(OBS, PRED)" N 98 3.624 1
85 1 15 1 "RMS(OBS, PRED)" C 98 2.869 1
86 1 15 1 "RMS(OBS, PRED)" CA 107 2.492 1
87 1 15 1 "RMS(OBS, PRED)" CB 96 3.160 1
88 1 15 1 "RMS(OBS, PRED)" H 98 0.639 1
89 1 15 1 "RMS(OBS, PRED)" HA 119 0.478 1
90 1 15 1 "RMS(OBS, PRED)" N 98 3.460 1
91 1 16 1 "RMS(OBS, PRED)" C 98 2.904 1
92 1 16 1 "RMS(OBS, PRED)" CA 107 2.584 1
93 1 16 1 "RMS(OBS, PRED)" CB 96 3.070 1
94 1 16 1 "RMS(OBS, PRED)" H 98 0.639 1
95 1 16 1 "RMS(OBS, PRED)" HA 119 0.500 1
96 1 16 1 "RMS(OBS, PRED)" N 98 3.437 1
97 1 17 1 "RMS(OBS, PRED)" C 98 2.880 1
98 1 17 1 "RMS(OBS, PRED)" CA 107 2.494 1
99 1 17 1 "RMS(OBS, PRED)" CB 96 3.066 1
100 1 17 1 "RMS(OBS, PRED)" H 98 0.649 1
101 1 17 1 "RMS(OBS, PRED)" HA 119 0.458 1
102 1 17 1 "RMS(OBS, PRED)" N 98 3.567 1
103 1 18 1 "RMS(OBS, PRED)" C 98 2.863 1
104 1 18 1 "RMS(OBS, PRED)" CA 107 2.454 1
105 1 18 1 "RMS(OBS, PRED)" CB 96 3.110 1
106 1 18 1 "RMS(OBS, PRED)" H 98 0.604 1
107 1 18 1 "RMS(OBS, PRED)" HA 119 0.487 1
108 1 18 1 "RMS(OBS, PRED)" N 98 3.702 1
109 1 19 1 "RMS(OBS, PRED)" C 98 2.815 1
110 1 19 1 "RMS(OBS, PRED)" CA 107 2.470 1
111 1 19 1 "RMS(OBS, PRED)" CB 96 3.212 1
112 1 19 1 "RMS(OBS, PRED)" H 98 0.628 1
113 1 19 1 "RMS(OBS, PRED)" HA 119 0.489 1
114 1 19 1 "RMS(OBS, PRED)" N 98 3.360 1
115 1 20 1 "RMS(OBS, PRED)" C 98 2.874 1
116 1 20 1 "RMS(OBS, PRED)" CA 107 2.474 1
117 1 20 1 "RMS(OBS, PRED)" CB 96 3.107 1
118 1 20 1 "RMS(OBS, PRED)" H 98 0.620 1
119 1 20 1 "RMS(OBS, PRED)" HA 119 0.457 1
120 1 20 1 "RMS(OBS, PRED)" N 98 3.613 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 11 . 1 1 A 2 2 SER H H 40 8.461 8.923 -0.462 2
1 12 . 1 1 A 2 2 SER HA H 40 4.286 4.949 -0.663 2
1 15 . 1 1 A 2 2 SER C C 40 171.276 173.248 -1.972 2
1 16 . 1 1 A 2 2 SER CA C 40 55.249 57.430 -2.181 2
1 17 . 1 1 A 2 2 SER CB C 40 61.498 62.778 -1.280 2
1 18 . 1 1 A 2 2 SER N N 40 118.344 122.680 -4.336 2
1 19 . 1 1 A 3 3 ARG H H 41 8.469 8.269 0.200 2
1 20 . 1 1 A 3 3 ARG HA H 41 4.400 4.876 -0.476 2
1 25 . 1 1 A 3 3 ARG C C 41 172.251 173.691 -1.440 2
1 26 . 1 1 A 3 3 ARG CA C 41 52.749 53.134 -0.385 2
1 27 . 1 1 A 3 3 ARG CB C 41 27.126 33.429 -6.303 2
1 28 . 1 1 A 3 3 ARG N N 41 123.070 123.998 -0.928 2
1 33 . 1 1 A 4 4 PRO CA C 42 61.498 63.835 -2.337 2
1 34 . 1 1 A 4 4 PRO CB C 42 29.001 31.736 -2.735 2
1 37 . 1 1 A 5 5 ASP H H 43 8.246 8.921 -0.675 2
1 38 . 1 1 A 5 5 ASP HA H 43 4.329 4.487 -0.158 2
1 41 . 1 1 A 5 5 ASP C C 43 174.605 177.035 -2.430 2
1 42 . 1 1 A 5 5 ASP CA C 43 53.374 56.164 -2.790 2
1 43 . 1 1 A 5 5 ASP CB C 43 38.375 39.711 -1.336 2
1 44 . 1 1 A 5 5 ASP N N 43 119.409 119.678 -0.269 2
1 45 . 1 1 A 6 6 GLN H H 44 8.309 8.393 -0.084 2
1 46 . 1 1 A 6 6 GLN HA H 44 4.393 4.231 0.163 2
1 53 . 1 1 A 6 6 GLN C C 44 175.053 178.379 -3.326 2
1 54 . 1 1 A 6 6 GLN CA C 44 55.874 58.237 -2.363 2
1 55 . 1 1 A 6 6 GLN CB C 44 25.876 28.201 -2.325 2
1 57 . 1 1 A 6 6 GLN N N 44 122.273 118.026 4.247 2
1 59 . 1 1 A 7 7 ALA H H 45 8.106 8.103 0.003 2
1 60 . 1 1 A 7 7 ALA HA H 45 3.993 4.095 -0.102 2
1 64 . 1 1 A 7 7 ALA C C 45 177.465 178.344 -0.879 2
1 65 . 1 1 A 7 7 ALA CA C 45 52.124 54.594 -2.470 2
1 66 . 1 1 A 7 7 ALA CB C 45 15.252 18.229 -2.977 2
1 67 . 1 1 A 7 7 ALA N N 45 122.204 121.935 0.269 2
1 68 . 1 1 A 8 8 LYS H H 46 7.527 7.746 -0.219 2
1 69 . 1 1 A 8 8 LYS HA H 46 3.539 4.088 -0.549 2
1 78 . 1 1 A 8 8 LYS C C 46 175.412 179.046 -3.634 2
1 79 . 1 1 A 8 8 LYS CA C 46 57.124 58.009 -0.885 2
1 80 . 1 1 A 8 8 LYS CB C 46 30.876 32.100 -1.224 2
1 83 . 1 1 A 8 8 LYS N N 46 117.358 116.632 0.726 2
1 84 . 1 1 A 9 9 VAL H H 47 7.709 7.810 -0.101 2
1 85 . 1 1 A 9 9 VAL HA H 47 3.578 3.802 -0.224 2
1 93 . 1 1 A 9 9 VAL C C 47 175.005 178.362 -3.357 2
1 94 . 1 1 A 9 9 VAL CA C 47 64.623 66.162 -1.539 2
1 95 . 1 1 A 9 9 VAL CB C 47 29.001 31.820 -2.819 2
1 98 . 1 1 A 9 9 VAL N N 47 119.115 120.299 -1.184 2
1 99 . 1 1 A 10 10 THR H H 48 7.767 8.201 -0.434 2
1 100 . 1 1 A 10 10 THR HA H 48 3.668 4.015 -0.347 2
1 105 . 1 1 A 10 10 THR CA C 48 63.998 65.790 -1.792 2
1 106 . 1 1 A 10 10 THR CB C 48 67.123 68.722 -1.599 2
1 108 . 1 1 A 10 10 THR N N 48 115.112 113.864 1.248 2
1 109 . 1 1 A 11 11 VAL H H 49 7.598 7.769 -0.171 2
1 110 . 1 1 A 11 11 VAL HA H 49 3.457 3.799 -0.342 2
1 118 . 1 1 A 11 11 VAL C C 49 175.412 178.005 -2.593 2
1 119 . 1 1 A 11 11 VAL CA C 49 63.998 65.205 -1.207 2
1 120 . 1 1 A 11 11 VAL CB C 49 29.001 31.584 -2.583 2
1 123 . 1 1 A 11 11 VAL N N 49 123.694 118.734 4.960 2
1 124 . 1 1 A 12 12 ALA H H 50 8.176 7.954 0.222 2
1 125 . 1 1 A 12 12 ALA HA H 50 4.742 4.042 0.700 2
1 129 . 1 1 A 12 12 ALA C C 50 177.074 179.744 -2.670 2
1 130 . 1 1 A 12 12 ALA CA C 50 52.124 55.336 -3.212 2
1 131 . 1 1 A 12 12 ALA CB C 50 15.252 18.296 -3.044 2
1 132 . 1 1 A 12 12 ALA N N 50 122.348 123.646 -1.298 2
1 133 . 1 1 A 13 13 LYS H H 51 8.499 8.093 0.406 2
1 134 . 1 1 A 13 13 LYS HA H 51 3.648 4.084 -0.436 2
1 143 . 1 1 A 13 13 LYS C C 51 177.252 179.785 -2.533 2
1 144 . 1 1 A 13 13 LYS CA C 51 58.072 59.429 -1.357 2
1 145 . 1 1 A 13 13 LYS CB C 51 30.251 32.294 -2.043 2
1 146 . 1 1 A 13 13 LYS N N 51 115.402 116.620 -1.218 2
1 147 . 1 1 A 14 14 GLY H H 52 7.858 8.101 -0.243 2
1 148 . 1 1 A 14 14 GLY HA2 H 52 3.823 3.831 -0.008 2
1 149 . 1 1 A 14 14 GLY HA3 H 52 3.676 3.835 -0.159 2
1 150 . 1 1 A 14 14 GLY C C 52 174.090 175.510 -1.420 2
1 151 . 1 1 A 14 14 GLY CA C 52 44.625 46.714 -2.089 2
1 152 . 1 1 A 14 14 GLY N N 52 107.466 108.729 -1.263 2
1 153 . 1 1 A 15 15 ASP H H 53 8.403 7.765 0.638 2
1 154 . 1 1 A 15 15 ASP HA H 53 4.191 4.427 -0.236 2
1 157 . 1 1 A 15 15 ASP C C 53 175.316 178.805 -3.489 2
1 158 . 1 1 A 15 15 ASP CA C 53 54.624 56.514 -1.890 2
1 159 . 1 1 A 15 15 ASP CB C 53 35.875 40.899 -5.024 2
1 160 . 1 1 A 15 15 ASP N N 53 125.929 121.210 4.719 2
1 161 . 1 1 A 16 16 ILE H H 54 8.245 8.178 0.067 2
1 162 . 1 1 A 16 16 ILE HA H 54 3.034 3.798 -0.764 2
1 172 . 1 1 A 16 16 ILE C C 54 174.499 178.001 -3.502 2
1 173 . 1 1 A 16 16 ILE CA C 54 62.748 64.066 -1.318 2
1 174 . 1 1 A 16 16 ILE CB C 54 34.625 37.343 -2.717 2
1 178 . 1 1 A 16 16 ILE N N 54 119.456 116.683 2.773 2
1 179 . 1 1 A 17 17 LYS H H 55 7.547 7.942 -0.395 2
1 180 . 1 1 A 17 17 LYS HA H 55 3.843 4.158 -0.315 2
1 187 . 1 1 A 17 17 LYS C C 55 176.651 179.111 -2.460 2
1 188 . 1 1 A 17 17 LYS CA C 55 57.124 59.051 -1.927 2
1 189 . 1 1 A 17 17 LYS CB C 55 30.251 32.017 -1.766 2
1 190 . 1 1 A 17 17 LYS N N 55 118.505 121.134 -2.629 2
1 191 . 1 1 A 18 18 ALA H H 56 7.680 7.858 -0.178 2
1 192 . 1 1 A 18 18 ALA HA H 56 4.029 4.044 -0.015 2
1 196 . 1 1 A 18 18 ALA C C 56 176.638 179.995 -3.357 2
1 197 . 1 1 A 18 18 ALA CA C 56 52.749 54.889 -2.140 2
1 198 . 1 1 A 18 18 ALA CB C 56 15.877 18.310 -2.433 2
1 199 . 1 1 A 18 18 ALA N N 56 122.477 121.968 0.509 2
1 200 . 1 1 A 19 19 ILE H H 57 8.853 7.742 1.111 2
1 201 . 1 1 A 19 19 ILE HA H 57 3.304 3.579 -0.275 2
1 211 . 1 1 A 19 19 ILE C C 57 174.710 177.822 -3.112 2
1 212 . 1 1 A 19 19 ILE CA C 57 63.373 65.371 -1.998 2
1 213 . 1 1 A 19 19 ILE CB C 57 35.250 37.723 -2.473 2
1 217 . 1 1 A 19 19 ILE N N 57 120.901 118.577 2.324 2
1 218 . 1 1 A 20 20 ALA H H 58 8.702 8.206 0.496 2
1 219 . 1 1 A 20 20 ALA HA H 58 3.900 3.989 -0.089 2
1 223 . 1 1 A 20 20 ALA C C 58 176.512 179.783 -3.271 2
1 224 . 1 1 A 20 20 ALA CA C 58 52.749 55.267 -2.518 2
1 225 . 1 1 A 20 20 ALA CB C 58 15.252 18.100 -2.848 2
1 226 . 1 1 A 20 20 ALA N N 58 121.763 122.526 -0.763 2
1 227 . 1 1 A 21 21 ALA H H 59 7.662 7.648 0.014 2
1 228 . 1 1 A 21 21 ALA HA H 59 4.136 4.244 -0.108 2
1 232 . 1 1 A 21 21 ALA C C 59 177.949 179.589 -1.640 2
1 233 . 1 1 A 21 21 ALA CA C 59 52.749 54.711 -1.962 2
1 234 . 1 1 A 21 21 ALA CB C 59 15.252 18.587 -3.335 2
1 235 . 1 1 A 21 21 ALA N N 59 119.079 119.433 -0.354 2
1 236 . 1 1 A 22 22 ALA H H 60 7.403 7.680 -0.277 2
1 237 . 1 1 A 22 22 ALA HA H 60 4.318 4.194 0.124 2
1 241 . 1 1 A 22 22 ALA C C 60 176.730 180.353 -3.623 2
1 242 . 1 1 A 22 22 ALA CA C 60 52.749 54.494 -1.745 2
1 243 . 1 1 A 22 22 ALA CB C 60 17.126 18.656 -1.530 2
1 244 . 1 1 A 22 22 ALA N N 60 122.616 120.428 2.188 2
1 245 . 1 1 A 23 23 LEU H H 61 8.410 8.620 -0.210 2
1 246 . 1 1 A 23 23 LEU HA H 61 3.527 3.950 -0.423 2
1 256 . 1 1 A 23 23 LEU C C 61 176.057 178.400 -2.343 2
1 257 . 1 1 A 23 23 LEU CA C 61 55.249 57.226 -1.977 2
1 258 . 1 1 A 23 23 LEU CB C 61 39.000 40.856 -1.856 2
1 262 . 1 1 A 23 23 LEU N N 61 120.761 121.080 -0.319 2
1 263 . 1 1 A 24 24 ASP H H 62 8.227 8.098 0.129 2
1 264 . 1 1 A 24 24 ASP HA H 62 4.581 4.503 0.078 2
1 267 . 1 1 A 24 24 ASP C C 62 176.968 178.115 -1.147 2
1 268 . 1 1 A 24 24 ASP CA C 62 55.874 56.781 -0.907 2
1 269 . 1 1 A 24 24 ASP CB C 62 37.750 40.931 -3.181 2
1 270 . 1 1 A 24 24 ASP N N 62 119.068 119.084 -0.016 2
1 271 . 1 1 A 25 25 MET H H 63 7.718 7.948 -0.230 2
1 272 . 1 1 A 25 25 MET HA H 63 4.196 4.230 -0.034 2
1 277 . 1 1 A 25 25 MET C C 63 174.968 177.798 -2.830 2
1 278 . 1 1 A 25 25 MET CA C 63 55.249 58.263 -3.014 2
1 279 . 1 1 A 25 25 MET CB C 63 29.626 32.359 -2.733 2
1 281 . 1 1 A 25 25 MET N N 63 121.365 117.939 3.426 2
1 282 . 1 1 A 26 26 TYR H H 64 8.401 7.609 0.792 2
1 283 . 1 1 A 26 26 TYR HA H 64 4.400 3.565 0.835 2
1 291 . 1 1 A 26 26 TYR C C 64 176.098 177.423 -1.325 2
1 292 . 1 1 A 26 26 TYR CA C 64 58.999 60.934 -1.935 2
1 293 . 1 1 A 26 26 TYR CB C 64 35.250 38.143 -2.893 2
1 294 . 1 1 A 26 26 TYR N N 64 122.575 121.624 0.951 2
1 295 . 1 1 A 27 27 LYS H H 65 8.330 8.246 0.084 2
1 296 . 1 1 A 27 27 LYS HA H 65 3.568 4.290 -0.722 2
1 302 . 1 1 A 27 27 LYS C C 65 176.156 178.447 -2.291 2
1 303 . 1 1 A 27 27 LYS CA C 65 56.499 59.195 -2.696 2
1 304 . 1 1 A 27 27 LYS CB C 65 29.626 31.810 -2.184 2
1 306 . 1 1 A 27 27 LYS N N 65 121.390 118.744 2.646 2
1 307 . 1 1 A 28 28 LEU H H 66 7.833 7.502 0.331 2
1 308 . 1 1 A 28 28 LEU HA H 66 3.769 4.101 -0.332 2
1 318 . 1 1 A 28 28 LEU C C 66 175.925 178.185 -2.260 2
1 319 . 1 1 A 28 28 LEU CA C 66 55.874 56.781 -0.907 2
1 320 . 1 1 A 28 28 LEU CB C 66 38.375 42.002 -3.627 2
1 324 . 1 1 A 28 28 LEU N N 66 123.068 119.976 3.092 2
1 325 . 1 1 A 29 29 ASP H H 67 7.292 7.785 -0.493 2
1 326 . 1 1 A 29 29 ASP HA H 67 4.096 4.357 -0.261 2
1 329 . 1 1 A 29 29 ASP C C 67 174.618 176.767 -2.149 2
1 330 . 1 1 A 29 29 ASP CA C 67 53.999 56.322 -2.323 2
1 331 . 1 1 A 29 29 ASP CB C 67 38.375 40.759 -2.384 2
1 332 . 1 1 A 29 29 ASP N N 67 114.729 118.908 -4.179 2
1 333 . 1 1 A 30 30 ASN H H 68 8.097 7.604 0.493 2
1 334 . 1 1 A 30 30 ASN HA H 68 4.337 4.378 -0.041 2
1 339 . 1 1 A 30 30 ASN C C 68 172.822 174.298 -1.476 2
1 340 . 1 1 A 30 30 ASN CA C 68 52.124 51.849 0.275 2
1 341 . 1 1 A 30 30 ASN CB C 68 37.750 38.342 -0.592 2
1 342 . 1 1 A 30 30 ASN N N 68 111.054 115.320 -4.266 2
1 344 . 1 1 A 31 31 PHE H H 69 8.249 7.937 0.312 2
1 345 . 1 1 A 31 31 PHE HA H 69 4.135 4.315 -0.180 2
1 353 . 1 1 A 31 31 PHE C C 69 170.485 174.232 -3.747 2
1 354 . 1 1 A 31 31 PHE CA C 69 57.749 58.736 -0.987 2
1 355 . 1 1 A 31 31 PHE CB C 69 33.375 36.575 -3.200 2
1 356 . 1 1 A 31 31 PHE N N 69 116.277 117.912 -1.635 2
1 357 . 1 1 A 32 32 ALA H H 70 7.224 6.980 0.244 2
1 358 . 1 1 A 32 32 ALA HA H 70 4.194 4.522 -0.328 2
1 362 . 1 1 A 32 32 ALA C C 70 173.337 175.036 -1.699 2
1 363 . 1 1 A 32 32 ALA CA C 70 48.374 51.545 -3.171 2
1 364 . 1 1 A 32 32 ALA CB C 70 19.626 22.286 -2.660 2
1 365 . 1 1 A 32 32 ALA N N 70 119.914 120.310 -0.396 2
1 366 . 1 1 A 33 33 TYR H H 71 7.948 8.408 -0.460 2
1 367 . 1 1 A 33 33 TYR HA H 71 4.209 4.950 -0.741 2
1 374 . 1 1 A 33 33 TYR C C 71 170.591 174.201 -3.610 2
1 375 . 1 1 A 33 33 TYR CA C 71 54.624 56.471 -1.847 2
1 376 . 1 1 A 33 33 TYR CB C 71 34.000 37.831 -3.831 2
1 377 . 1 1 A 33 33 TYR N N 71 116.929 118.067 -1.138 2
1 378 . 1 1 A 34 34 PRO HA H 72 4.444 4.723 -0.279 2
1 381 . 1 1 A 34 34 PRO C C 72 174.775 176.332 -1.557 2
1 382 . 1 1 A 34 34 PRO CA C 72 59.624 62.543 -2.919 2
1 383 . 1 1 A 34 34 PRO CB C 72 28.376 32.108 -3.732 2
1 384 . 1 1 A 35 35 SER H H 73 8.721 8.413 0.308 2
1 385 . 1 1 A 35 35 SER HA H 73 4.467 4.759 -0.292 2
1 388 . 1 1 A 35 35 SER C C 73 173.271 175.527 -2.256 2
1 389 . 1 1 A 35 35 SER CA C 73 55.249 56.664 -1.415 2
1 390 . 1 1 A 35 35 SER CB C 73 63.373 65.826 -2.453 2
1 391 . 1 1 A 35 35 SER N N 73 118.284 114.513 3.771 2
1 392 . 1 1 A 36 36 THR H H 74 8.591 8.842 -0.251 2
1 393 . 1 1 A 36 36 THR HA H 74 3.649 4.169 -0.520 2
1 398 . 1 1 A 36 36 THR CA C 74 64.623 64.228 0.395 2
1 399 . 1 1 A 36 36 THR CB C 74 66.498 68.971 -2.473 2
1 401 . 1 1 A 36 36 THR N N 74 117.769 117.049 0.720 2
1 402 . 1 1 A 37 37 GLN H H 75 8.210 7.907 0.303 2
1 403 . 1 1 A 37 37 GLN HA H 75 3.860 4.426 -0.566 2
1 410 . 1 1 A 37 37 GLN C C 75 175.349 177.732 -2.383 2
1 411 . 1 1 A 37 37 GLN CA C 75 56.499 57.620 -1.121 2
1 412 . 1 1 A 37 37 GLN CB C 75 25.876 29.670 -3.794 2
1 414 . 1 1 A 37 37 GLN N N 75 117.931 120.177 -2.246 2
1 416 . 1 1 A 38 38 GLN H H 76 7.667 8.177 -0.510 2
1 417 . 1 1 A 38 38 GLN HA H 76 3.810 4.108 -0.298 2
1 424 . 1 1 A 38 38 GLN C C 76 175.805 179.418 -3.613 2
1 425 . 1 1 A 38 38 GLN CA C 76 55.874 58.521 -2.647 2
1 426 . 1 1 A 38 38 GLN CB C 76 25.876 28.324 -2.448 2
1 428 . 1 1 A 38 38 GLN N N 76 120.607 118.151 2.456 2
1 430 . 1 1 A 39 39 GLY H H 77 8.470 8.214 0.256 2
1 431 . 1 1 A 39 39 GLY HA2 H 77 3.920 3.743 0.177 2
1 432 . 1 1 A 39 39 GLY HA3 H 77 3.603 3.773 -0.170 2
1 433 . 1 1 A 39 39 GLY C C 77 169.006 175.445 -6.439 2
1 434 . 1 1 A 39 39 GLY CA C 77 42.125 46.506 -4.381 2
1 435 . 1 1 A 39 39 GLY N N 77 103.281 109.342 -6.061 2
1 436 . 1 1 A 40 40 LEU H H 78 8.135 7.837 0.298 2
1 437 . 1 1 A 40 40 LEU HA H 78 3.237 4.117 -0.880 2
1 447 . 1 1 A 40 40 LEU C C 78 176.383 178.640 -2.257 2
1 448 . 1 1 A 40 40 LEU CA C 78 52.749 57.141 -4.392 2
1 449 . 1 1 A 40 40 LEU CB C 78 39.000 41.546 -2.546 2
1 453 . 1 1 A 40 40 LEU N N 78 114.444 123.333 -8.889 2
1 454 . 1 1 A 41 41 GLU H H 79 8.578 8.133 0.445 2
1 455 . 1 1 A 41 41 GLU HA H 79 3.720 4.104 -0.384 2
1 460 . 1 1 A 41 41 GLU C C 79 175.093 177.983 -2.890 2
1 461 . 1 1 A 41 41 GLU CA C 79 57.124 59.156 -2.032 2
1 462 . 1 1 A 41 41 GLU CB C 79 26.501 29.156 -2.655 2
1 464 . 1 1 A 41 41 GLU N N 79 118.295 118.353 -0.058 2
1 465 . 1 1 A 42 42 ALA H H 80 7.227 7.728 -0.501 2
1 466 . 1 1 A 42 42 ALA HA H 80 4.437 4.741 -0.304 2
1 470 . 1 1 A 42 42 ALA C C 80 173.745 178.301 -4.556 2
1 471 . 1 1 A 42 42 ALA CA C 80 51.499 53.387 -1.888 2
1 472 . 1 1 A 42 42 ALA CB C 80 15.877 18.944 -3.067 2
1 473 . 1 1 A 42 42 ALA N N 80 119.751 121.631 -1.880 2
1 474 . 1 1 A 43 43 LEU H H 81 7.932 7.537 0.395 2
1 475 . 1 1 A 43 43 LEU HA H 81 4.369 4.372 -0.003 2
1 485 . 1 1 A 43 43 LEU C C 81 174.788 178.014 -3.226 2
1 486 . 1 1 A 43 43 LEU CA C 81 53.374 55.891 -2.517 2
1 487 . 1 1 A 43 43 LEU CB C 81 39.625 42.332 -2.707 2
1 491 . 1 1 A 43 43 LEU N N 81 111.742 116.805 -5.063 2
1 492 . 1 1 A 44 44 VAL H H 82 7.886 7.426 0.460 2
1 493 . 1 1 A 44 44 VAL HA H 82 4.700 4.219 0.481 2
1 501 . 1 1 A 44 44 VAL C C 82 172.875 175.817 -2.942 2
1 502 . 1 1 A 44 44 VAL CA C 82 59.624 63.705 -4.081 2
1 503 . 1 1 A 44 44 VAL CB C 82 31.501 33.419 -1.918 2
1 506 . 1 1 A 44 44 VAL N N 82 113.604 115.752 -2.148 2
1 507 . 1 1 A 45 45 LYS H H 83 8.361 8.245 0.116 2
1 508 . 1 1 A 45 45 LYS HA H 83 4.251 4.925 -0.674 2
1 515 . 1 1 A 45 45 LYS C C 83 171.053 175.267 -4.214 2
1 516 . 1 1 A 45 45 LYS CA C 83 52.749 54.321 -1.572 2
1 517 . 1 1 A 45 45 LYS CB C 83 33.375 35.857 -2.482 2
1 521 . 1 1 A 45 45 LYS N N 83 123.860 120.193 3.667 2
1 522 . 1 1 A 46 46 LYS H H 84 7.243 7.945 -0.702 2
1 523 . 1 1 A 46 46 LYS HA H 84 2.175 2.781 -0.606 2
1 532 . 1 1 A 46 46 LYS C C 84 172.123 174.551 -2.428 2
1 533 . 1 1 A 46 46 LYS CA C 84 52.749 54.153 -1.404 2
1 534 . 1 1 A 46 46 LYS CB C 84 29.626 31.833 -2.207 2
1 537 . 1 1 A 46 46 LYS N N 84 128.615 123.663 4.952 2
1 538 . 1 1 A 47 47 PRO HA H 85 4.470 4.414 0.056 2
1 541 . 1 1 A 47 47 PRO C C 85 173.754 176.510 -2.756 2
1 542 . 1 1 A 47 47 PRO CA C 85 60.874 63.070 -2.196 2
1 543 . 1 1 A 47 47 PRO CB C 85 30.876 32.071 -1.195 2
1 546 . 1 1 A 48 48 THR H H 86 8.306 8.377 -0.071 2
1 547 . 1 1 A 48 48 THR HA H 86 4.287 4.566 -0.279 2
1 552 . 1 1 A 48 48 THR C C 86 173.070 174.302 -1.232 2
1 553 . 1 1 A 48 48 THR CA C 86 57.749 61.726 -3.977 2
1 554 . 1 1 A 48 48 THR CB C 86 67.748 69.802 -2.054 2
1 556 . 1 1 A 48 48 THR N N 86 109.564 114.477 -4.913 2
1 557 . 1 1 A 49 49 GLY H H 87 8.317 8.273 0.044 2
1 558 . 1 1 A 49 49 GLY HA2 H 87 3.851 4.068 -0.217 2
1 559 . 1 1 A 49 49 GLY HA3 H 87 3.678 4.076 -0.398 2
1 560 . 1 1 A 49 49 GLY C C 87 169.693 172.805 -3.112 2
1 561 . 1 1 A 49 49 GLY CA C 87 42.125 45.125 -3.000 2
1 562 . 1 1 A 49 49 GLY N N 87 109.071 110.381 -1.310 2
1 563 . 1 1 A 50 50 ASN H H 88 8.301 8.503 -0.202 2
1 564 . 1 1 A 50 50 ASN HA H 88 4.780 5.413 -0.633 2
1 569 . 1 1 A 50 50 ASN C C 88 171.370 173.471 -2.101 2
1 570 . 1 1 A 50 50 ASN CA C 88 47.749 50.444 -2.695 2
1 571 . 1 1 A 50 50 ASN CB C 88 37.125 39.585 -2.460 2
1 572 . 1 1 A 50 50 ASN N N 88 115.631 120.446 -4.815 2
1 574 . 1 1 A 51 51 PRO HA H 89 4.782 4.638 0.144 2
1 577 . 1 1 A 51 51 PRO C C 89 173.656 175.966 -2.310 2
1 578 . 1 1 A 51 51 PRO CA C 89 59.624 62.196 -2.572 2
1 579 . 1 1 A 51 51 PRO CB C 89 31.501 32.429 -0.928 2
1 582 . 1 1 A 52 52 GLN H H 90 9.076 8.828 0.248 2
1 583 . 1 1 A 52 52 GLN HA H 90 4.469 4.799 -0.330 2
1 590 . 1 1 A 52 52 GLN C C 90 172.386 174.164 -1.778 2
1 591 . 1 1 A 52 52 GLN CA C 90 50.874 53.398 -2.525 2
1 592 . 1 1 A 52 52 GLN CB C 90 26.501 28.707 -2.206 2
1 594 . 1 1 A 52 52 GLN N N 90 126.827 119.857 6.970 2
1 596 . 1 1 A 53 53 PRO HA H 91 4.384 4.565 -0.181 2
1 599 . 1 1 A 53 53 PRO C C 91 174.274 175.677 -1.403 2
1 600 . 1 1 A 53 53 PRO CB C 91 28.113 31.506 -3.393 2
1 601 . 1 1 A 54 54 LYS H H 92 8.401 8.609 -0.208 2
1 602 . 1 1 A 54 54 LYS HA H 92 3.984 4.775 -0.791 2
1 611 . 1 1 A 54 54 LYS C C 92 173.516 175.345 -1.829 2
1 612 . 1 1 A 54 54 LYS CA C 92 55.249 55.146 0.103 2
1 613 . 1 1 A 54 54 LYS CB C 92 30.876 36.027 -5.151 2
1 615 . 1 1 A 54 54 LYS N N 92 124.538 123.941 0.597 2
1 616 . 1 1 A 55 55 ASN H H 93 8.183 8.727 -0.544 2
1 617 . 1 1 A 55 55 ASN HA H 93 4.716 4.906 -0.190 2
1 622 . 1 1 A 55 55 ASN CA C 93 48.999 53.188 -4.189 2
1 623 . 1 1 A 55 55 ASN CB C 93 35.875 37.875 -2.000 2
1 624 . 1 1 A 55 55 ASN N N 93 118.677 122.118 -3.441 2
1 626 . 1 1 A 56 56 TRP H H 94 8.007 8.673 -0.666 2
1 627 . 1 1 A 56 56 TRP HA H 94 3.827 5.428 -1.601 2
1 635 . 1 1 A 56 56 TRP C C 94 173.760 175.341 -1.581 2
1 636 . 1 1 A 56 56 TRP CA C 94 59.624 59.102 0.522 2
1 637 . 1 1 A 56 56 TRP CB C 94 27.126 30.364 -3.238 2
1 638 . 1 1 A 56 56 TRP N N 94 122.195 127.993 -5.798 2
1 640 . 1 1 A 57 57 ASN H H 95 7.563 7.513 0.050 2
1 641 . 1 1 A 57 57 ASN HA H 95 3.735 4.830 -1.095 2
1 646 . 1 1 A 57 57 ASN C C 95 171.952 173.893 -1.941 2
1 647 . 1 1 A 57 57 ASN CA C 95 51.499 50.895 0.604 2
1 648 . 1 1 A 57 57 ASN CB C 95 35.250 41.160 -5.910 2
1 649 . 1 1 A 57 57 ASN N N 95 129.659 125.249 4.410 2
1 651 . 1 1 A 58 58 LYS H H 96 8.110 8.062 0.048 2
1 652 . 1 1 A 58 58 LYS HA H 96 4.035 4.100 -0.065 2
1 659 . 1 1 A 58 58 LYS C C 96 174.530 175.527 -0.997 2
1 660 . 1 1 A 58 58 LYS CA C 96 56.499 54.766 1.733 2
1 661 . 1 1 A 58 58 LYS CB C 96 29.626 33.007 -3.381 2
1 665 . 1 1 A 58 58 LYS N N 96 123.913 123.104 0.809 2
1 666 . 1 1 A 59 59 ASP H H 97 7.903 9.088 -1.185 2
1 667 . 1 1 A 59 59 ASP HA H 97 4.393 4.353 0.040 2
1 670 . 1 1 A 59 59 ASP C C 97 173.724 175.287 -1.563 2
1 671 . 1 1 A 59 59 ASP CA C 97 52.124 55.037 -2.913 2
1 672 . 1 1 A 59 59 ASP CB C 97 38.375 39.742 -1.367 2
1 673 . 1 1 A 59 59 ASP N N 97 118.773 119.400 -0.627 2
1 674 . 1 1 A 60 60 GLY H H 98 7.819 7.920 -0.101 2
1 675 . 1 1 A 60 60 GLY HA2 H 98 3.917 3.277 0.640 2
1 676 . 1 1 A 60 60 GLY HA3 H 98 3.917 3.779 0.138 2
1 677 . 1 1 A 60 60 GLY C C 98 168.652 174.268 -5.616 2
1 678 . 1 1 A 60 60 GLY CA C 98 41.500 44.972 -3.472 2
1 679 . 1 1 A 60 60 GLY N N 98 108.742 104.778 3.964 2
1 680 . 1 1 A 61 61 TYR H H 99 8.105 7.873 0.232 2
1 681 . 1 1 A 61 61 TYR HA H 99 3.927 4.214 -0.287 2
1 689 . 1 1 A 61 61 TYR C C 99 172.831 174.088 -1.257 2
1 690 . 1 1 A 61 61 TYR CA C 99 57.124 58.175 -1.051 2
1 691 . 1 1 A 61 61 TYR CB C 99 37.125 36.467 0.658 2
1 692 . 1 1 A 61 61 TYR N N 99 113.836 115.315 -1.479 2
1 693 . 1 1 A 62 62 LEU H H 100 7.352 7.982 -0.630 2
1 694 . 1 1 A 62 62 LEU HA H 100 4.343 4.896 -0.553 2
1 704 . 1 1 A 62 62 LEU C C 100 173.430 175.452 -2.022 2
1 705 . 1 1 A 62 62 LEU CA C 100 50.874 53.315 -2.441 2
1 706 . 1 1 A 62 62 LEU CB C 100 44.000 45.652 -1.652 2
1 710 . 1 1 A 62 62 LEU N N 100 117.112 121.856 -4.743 2
1 711 . 1 1 A 63 63 LYS H H 101 8.626 8.342 0.284 2
1 712 . 1 1 A 63 63 LYS HA H 101 3.986 4.434 -0.448 2
1 721 . 1 1 A 63 63 LYS C C 101 173.851 177.087 -3.236 2
1 722 . 1 1 A 63 63 LYS CA C 101 55.249 55.484 -0.235 2
1 723 . 1 1 A 63 63 LYS CB C 101 29.626 33.611 -3.985 2
1 724 . 1 1 A 63 63 LYS N N 101 129.991 122.320 7.671 2
1 725 . 1 1 A 64 64 LYS H H 102 7.059 8.534 -1.475 2
1 726 . 1 1 A 64 64 LYS HA H 102 4.138 4.267 -0.129 2
1 735 . 1 1 A 64 64 LYS C C 102 171.120 175.305 -4.185 2
1 736 . 1 1 A 64 64 LYS CA C 102 52.749 56.281 -3.532 2
1 737 . 1 1 A 64 64 LYS CB C 102 32.750 31.340 1.410 2
1 740 . 1 1 A 64 64 LYS N N 102 113.255 120.915 -7.660 2
1 741 . 1 1 A 65 65 LEU H H 103 8.883 7.864 1.019 2
1 742 . 1 1 A 65 65 LEU HA H 103 4.475 4.751 -0.276 2
1 752 . 1 1 A 65 65 LEU C C 103 171.487 174.549 -3.062 2
1 753 . 1 1 A 65 65 LEU CA C 103 48.999 51.326 -2.327 2
1 754 . 1 1 A 65 65 LEU CB C 103 39.625 44.583 -4.958 2
1 758 . 1 1 A 65 65 LEU N N 103 126.355 123.430 2.925 2
1 759 . 1 1 A 66 66 PRO HA H 104 4.449 4.612 -0.163 2
1 764 . 1 1 A 66 66 PRO C C 104 173.363 176.229 -2.866 2
1 765 . 1 1 A 66 66 PRO CA C 104 60.249 62.225 -1.976 2
1 766 . 1 1 A 66 66 PRO CB C 104 29.626 32.823 -3.197 2
1 769 . 1 1 A 67 67 VAL H H 105 7.682 8.372 -0.690 2
1 770 . 1 1 A 67 67 VAL HA H 105 4.121 4.419 -0.298 2
1 778 . 1 1 A 67 67 VAL C C 105 171.667 174.963 -3.296 2
1 779 . 1 1 A 67 67 VAL CA C 105 58.374 61.491 -3.117 2
1 780 . 1 1 A 67 67 VAL CB C 105 30.251 32.991 -2.740 2
1 783 . 1 1 A 67 67 VAL N N 105 114.671 121.181 -6.510 2
1 784 . 1 1 A 68 68 ASP H H 106 8.216 8.051 0.165 2
1 785 . 1 1 A 68 68 ASP HA H 106 4.474 4.681 -0.207 2
1 788 . 1 1 A 68 68 ASP C C 106 172.452 174.925 -2.473 2
1 789 . 1 1 A 68 68 ASP CA C 106 50.249 52.158 -1.909 2
1 790 . 1 1 A 68 68 ASP CB C 106 37.750 40.419 -2.669 2
1 791 . 1 1 A 68 68 ASP N N 106 123.825 125.508 -1.683 2
1 792 . 1 1 A 69 69 PRO HA H 107 3.920 4.012 -0.092 2
1 797 . 1 1 A 69 69 PRO CA C 107 62.123 63.083 -0.960 2
1 798 . 1 1 A 69 69 PRO CB C 107 27.751 31.475 -3.724 2
1 801 . 1 1 A 70 70 TRP H H 108 8.156 8.418 -0.261 2
1 802 . 1 1 A 70 70 TRP HA H 108 4.274 4.295 -0.021 2
1 811 . 1 1 A 70 70 TRP CA C 108 57.124 58.439 -1.315 2
1 812 . 1 1 A 70 70 TRP CB C 108 25.251 27.154 -1.903 2
1 813 . 1 1 A 70 70 TRP N N 108 118.137 117.759 0.378 2
1 815 . 1 1 A 71 71 GLY H H 109 8.209 8.730 -0.521 2
1 816 . 1 1 A 71 71 GLY HA2 H 109 4.030 3.867 0.163 2
1 817 . 1 1 A 71 71 GLY HA3 H 109 3.303 3.898 -0.595 2
1 818 . 1 1 A 71 71 GLY CA C 109 42.750 46.245 -3.495 2
1 819 . 1 1 A 71 71 GLY N N 109 107.495 105.419 2.076 2
1 820 . 1 1 A 72 72 ASN H H 110 8.116 7.823 0.293 2
1 821 . 1 1 A 72 72 ASN HA H 110 5.103 4.980 0.123 2
1 826 . 1 1 A 72 72 ASN CA C 110 48.374 50.489 -2.115 2
1 827 . 1 1 A 72 72 ASN CB C 110 36.500 38.992 -2.492 2
1 828 . 1 1 A 72 72 ASN N N 110 120.108 119.840 0.268 2
1 830 . 1 1 A 73 73 PRO HA H 111 4.397 4.495 -0.098 2
1 835 . 1 1 A 73 73 PRO C C 111 176.229 176.390 -0.161 2
1 836 . 1 1 A 73 73 PRO CA C 111 60.249 62.493 -2.244 2
1 837 . 1 1 A 73 73 PRO CB C 111 29.001 32.086 -3.085 2
1 840 . 1 1 A 74 74 TYR H H 112 8.893 8.547 0.346 2
1 841 . 1 1 A 74 74 TYR HA H 112 4.064 4.794 -0.730 2
1 849 . 1 1 A 74 74 TYR C C 112 171.951 175.973 -4.022 2
1 850 . 1 1 A 74 74 TYR CA C 112 60.249 58.345 1.904 2
1 851 . 1 1 A 74 74 TYR CB C 112 36.500 39.413 -2.913 2
1 852 . 1 1 A 74 74 TYR N N 112 124.595 121.233 3.362 2
1 853 . 1 1 A 75 75 GLN H H 113 9.127 8.922 0.205 2
1 854 . 1 1 A 75 75 GLN HA H 113 4.019 4.361 -0.342 2
1 861 . 1 1 A 75 75 GLN C C 113 171.436 174.306 -2.870 2
1 862 . 1 1 A 75 75 GLN CA C 113 50.874 54.675 -3.801 2
1 863 . 1 1 A 75 75 GLN CB C 113 29.469 29.468 0.001 2
1 865 . 1 1 A 75 75 GLN N N 113 120.777 122.022 -1.245 2
1 867 . 1 1 A 76 76 TYR H H 114 7.906 8.420 -0.514 2
1 868 . 1 1 A 76 76 TYR HA H 114 5.586 5.387 0.199 2
1 875 . 1 1 A 76 76 TYR C C 114 171.343 175.331 -3.988 2
1 876 . 1 1 A 76 76 TYR CA C 114 53.999 56.449 -2.450 2
1 877 . 1 1 A 76 76 TYR CB C 114 40.250 40.316 -0.066 2
1 878 . 1 1 A 76 76 TYR N N 114 120.757 122.786 -2.029 2
1 879 . 1 1 A 77 77 LEU H H 115 8.261 9.059 -0.798 2
1 880 . 1 1 A 77 77 LEU HA H 115 4.280 5.190 -0.910 2
1 890 . 1 1 A 77 77 LEU C C 115 170.921 175.893 -4.972 2
1 891 . 1 1 A 77 77 LEU CA C 115 51.499 53.573 -2.074 2
1 892 . 1 1 A 77 77 LEU CB C 115 44.625 45.510 -0.885 2
1 896 . 1 1 A 77 77 LEU N N 115 130.662 125.398 5.264 2
1 897 . 1 1 A 78 78 ALA H H 116 7.973 8.443 -0.470 2
1 898 . 1 1 A 78 78 ALA HA H 116 4.292 4.722 -0.430 2
1 902 . 1 1 A 78 78 ALA C C 116 172.093 174.973 -2.880 2
1 903 . 1 1 A 78 78 ALA CA C 116 47.749 50.018 -2.269 2
1 904 . 1 1 A 78 78 ALA CB C 116 19.626 20.604 -0.978 2
1 905 . 1 1 A 78 78 ALA N N 116 125.564 125.385 0.179 2
1 906 . 1 1 A 79 79 PRO HA H 117 4.698 5.167 -0.469 2
1 911 . 1 1 A 79 79 PRO C C 117 173.994 176.762 -2.768 2
1 912 . 1 1 A 79 79 PRO CA C 117 60.249 63.512 -3.263 2
1 913 . 1 1 A 79 79 PRO CB C 117 31.501 31.917 -0.416 2
1 916 . 1 1 A 80 80 GLY H H 118 7.096 8.324 -1.228 2
1 917 . 1 1 A 80 80 GLY HA2 H 118 3.797 3.982 -0.185 2
1 918 . 1 1 A 80 80 GLY HA3 H 118 3.517 4.009 -0.492 2
1 919 . 1 1 A 80 80 GLY C C 118 171.404 174.171 -2.766 2
1 920 . 1 1 A 80 80 GLY CA C 118 41.500 46.267 -4.766 2
1 921 . 1 1 A 80 80 GLY N N 118 108.306 108.122 0.184 2
1 922 . 1 1 A 81 81 THR H H 119 9.810 8.172 1.638 2
1 923 . 1 1 A 81 81 THR HA H 119 4.091 4.551 -0.460 2
1 928 . 1 1 A 81 81 THR C C 119 174.242 174.879 -0.637 2
1 929 . 1 1 A 81 81 THR CA C 119 60.874 61.021 -0.147 2
1 930 . 1 1 A 81 81 THR CB C 119 66.498 69.019 -2.521 2
1 932 . 1 1 A 81 81 THR N N 119 112.813 113.924 -1.111 2
1 933 . 1 1 A 82 82 LYS H H 120 8.964 8.571 0.393 2
1 934 . 1 1 A 82 82 LYS HA H 120 4.150 3.946 0.204 2
1 941 . 1 1 A 82 82 LYS C C 120 172.886 175.618 -2.732 2
1 942 . 1 1 A 82 82 LYS CA C 120 53.999 57.710 -3.711 2
1 943 . 1 1 A 82 82 LYS CB C 120 30.876 30.177 0.700 2
1 944 . 1 1 A 82 82 LYS N N 120 123.569 124.131 -0.562 2
1 945 . 1 1 A 83 83 GLY H H 121 7.125 7.963 -0.838 2
1 946 . 1 1 A 83 83 GLY HA2 H 121 3.814 4.154 -0.340 2
1 947 . 1 1 A 83 83 GLY HA3 H 121 3.814 4.199 -0.385 2
1 948 . 1 1 A 83 83 GLY C C 121 167.671 174.257 -6.586 2
1 949 . 1 1 A 83 83 GLY CA C 121 42.125 44.597 -2.472 2
1 950 . 1 1 A 83 83 GLY N N 121 107.253 107.733 -0.480 2
1 951 . 1 1 A 84 84 PRO HA H 122 4.077 4.411 -0.334 2
1 958 . 1 1 A 84 84 PRO C C 122 175.199 176.644 -1.445 2
1 959 . 1 1 A 84 84 PRO CA C 122 63.373 64.532 -1.159 2
1 960 . 1 1 A 84 84 PRO CB C 122 30.251 31.905 -1.654 2
1 962 . 1 1 A 85 85 PHE H H 123 6.652 6.704 -0.052 2
1 963 . 1 1 A 85 85 PHE HA H 123 4.744 4.736 0.008 2
1 971 . 1 1 A 85 85 PHE C C 123 170.340 172.317 -1.977 2
1 972 . 1 1 A 85 85 PHE CA C 123 53.999 56.327 -2.328 2
1 973 . 1 1 A 85 85 PHE CB C 123 39.000 40.352 -1.352 2
1 974 . 1 1 A 85 85 PHE N N 123 108.468 112.141 -3.673 2
1 975 . 1 1 A 86 86 ASP H H 124 9.268 8.909 0.359 2
1 976 . 1 1 A 86 86 ASP HA H 124 5.108 4.886 0.222 2
1 979 . 1 1 A 86 86 ASP C C 124 171.180 174.650 -3.470 2
1 980 . 1 1 A 86 86 ASP CA C 124 50.249 53.344 -3.095 2
1 981 . 1 1 A 86 86 ASP CB C 124 40.250 42.915 -2.665 2
1 982 . 1 1 A 86 86 ASP N N 124 121.741 119.267 2.474 2
1 983 . 1 1 A 87 87 LEU H H 125 8.018 9.048 -1.030 2
1 984 . 1 1 A 87 87 LEU HA H 125 5.809 5.524 0.285 2
1 994 . 1 1 A 87 87 LEU C C 125 171.350 175.070 -3.720 2
1 995 . 1 1 A 87 87 LEU CA C 125 50.874 53.576 -2.702 2
1 996 . 1 1 A 87 87 LEU CB C 125 44.318 45.569 -1.252 2
1 999 . 1 1 A 87 87 LEU N N 125 123.629 126.310 -2.681 2
1 1000 . 1 1 A 88 88 TYR H H 126 8.912 8.542 0.370 2
1 1001 . 1 1 A 88 88 TYR HA H 126 5.630 5.616 0.014 2
1 1008 . 1 1 A 88 88 TYR C C 126 171.410 172.510 -1.100 2
1 1009 . 1 1 A 88 88 TYR CA C 126 52.749 56.595 -3.846 2
1 1010 . 1 1 A 88 88 TYR CB C 126 37.750 40.510 -2.760 2
1 1011 . 1 1 A 88 88 TYR N N 126 119.697 120.976 -1.279 2
1 1012 . 1 1 A 89 89 SER H H 127 9.319 9.360 -0.041 2
1 1013 . 1 1 A 89 89 SER HA H 127 5.429 5.251 0.178 2
1 1016 . 1 1 A 89 89 SER CA C 127 52.124 56.563 -4.439 2
1 1017 . 1 1 A 89 89 SER CB C 127 62.748 66.054 -3.306 2
1 1018 . 1 1 A 89 89 SER N N 127 112.637 115.751 -3.114 2
1 1019 . 1 1 A 90 90 LEU H H 128 8.759 8.536 0.223 2
1 1020 . 1 1 A 90 90 LEU HA H 128 4.186 4.426 -0.240 2
1 1030 . 1 1 A 90 90 LEU C C 128 175.121 178.098 -2.977 2
1 1031 . 1 1 A 90 90 LEU CA C 128 52.749 55.174 -2.425 2
1 1032 . 1 1 A 90 90 LEU CB C 128 35.875 42.112 -6.237 2
1 1033 . 1 1 A 90 90 LEU N N 128 126.728 125.791 0.937 2
1 1034 . 1 1 A 91 91 GLY H H 129 8.356 8.185 0.171 2
1 1035 . 1 1 A 91 91 GLY HA2 H 129 3.373 3.535 -0.162 2
1 1036 . 1 1 A 91 91 GLY HA3 H 129 3.373 3.805 -0.432 2
1 1037 . 1 1 A 91 91 GLY C C 129 172.013 174.343 -2.330 2
1 1038 . 1 1 A 91 91 GLY CA C 129 41.500 43.972 -2.472 2
1 1039 . 1 1 A 91 91 GLY N N 129 108.559 109.204 -0.645 2
1 1040 . 1 1 A 92 92 ALA H H 130 7.047 8.108 -1.061 2
1 1041 . 1 1 A 92 92 ALA HA H 130 4.037 3.080 0.957 2
1 1045 . 1 1 A 92 92 ALA C C 130 174.890 177.728 -2.838 2
1 1046 . 1 1 A 92 92 ALA CA C 130 52.100 53.592 -1.492 2
1 1047 . 1 1 A 92 92 ALA CB C 130 16.502 17.872 -1.370 2
1 1048 . 1 1 A 92 92 ALA N N 130 118.393 121.723 -3.330 2
1 1049 . 1 1 A 93 93 ASP H H 131 7.222 7.667 -0.445 2
1 1050 . 1 1 A 93 93 ASP HA H 131 4.122 4.639 -0.517 2
1 1053 . 1 1 A 93 93 ASP C C 131 174.890 176.348 -1.458 2
1 1054 . 1 1 A 93 93 ASP CA C 131 50.249 53.666 -3.417 2
1 1055 . 1 1 A 93 93 ASP CB C 131 37.750 41.075 -3.325 2
1 1056 . 1 1 A 93 93 ASP N N 131 111.487 115.748 -4.261 2
1 1057 . 1 1 A 94 94 GLY H H 132 7.199 8.965 -1.766 2
1 1058 . 1 1 A 94 94 GLY HA2 H 132 3.951 3.870 0.081 2
1 1059 . 1 1 A 94 94 GLY HA3 H 132 3.324 3.879 -0.555 2
1 1060 . 1 1 A 94 94 GLY C C 132 169.773 173.751 -3.978 2
1 1061 . 1 1 A 94 94 GLY CA C 132 44.625 45.971 -1.346 2
1 1062 . 1 1 A 94 94 GLY N N 132 106.932 108.983 -2.051 2
1 1063 . 1 1 A 95 95 LYS H H 133 7.215 7.625 -0.410 2
1 1064 . 1 1 A 95 95 LYS HA H 133 4.513 4.838 -0.325 2
1 1073 . 1 1 A 95 95 LYS C C 133 172.108 174.939 -2.831 2
1 1074 . 1 1 A 95 95 LYS CA C 133 51.512 54.554 -3.042 2
1 1075 . 1 1 A 95 95 LYS CB C 133 34.000 35.624 -1.624 2
1 1076 . 1 1 A 95 95 LYS N N 133 115.749 119.983 -4.234 2
1 1077 . 1 1 A 96 96 GLU H H 134 9.230 8.691 0.539 2
1 1078 . 1 1 A 96 96 GLU HA H 134 4.352 4.796 -0.444 2
1 1083 . 1 1 A 96 96 GLU C C 134 175.219 175.966 -0.747 2
1 1084 . 1 1 A 96 96 GLU CA C 134 55.874 55.850 0.024 2
1 1085 . 1 1 A 96 96 GLU CB C 134 27.126 30.319 -3.193 2
1 1087 . 1 1 A 96 96 GLU N N 134 128.571 122.689 5.882 2
1 1088 . 1 1 A 97 97 GLY H H 135 10.677 8.388 2.289 2
1 1089 . 1 1 A 97 97 GLY HA2 H 135 4.037 4.326 -0.289 2
1 1090 . 1 1 A 97 97 GLY HA3 H 135 3.717 4.332 -0.615 2
1 1091 . 1 1 A 97 97 GLY C C 135 171.567 172.332 -0.765 2
1 1092 . 1 1 A 97 97 GLY CA C 135 41.500 45.686 -4.186 2
1 1093 . 1 1 A 97 97 GLY N N 135 117.011 110.857 6.154 2
1 1094 . 1 1 A 98 98 GLY H H 136 8.442 8.652 -0.210 2
1 1095 . 1 1 A 98 98 GLY HA2 H 136 4.195 4.222 -0.027 2
1 1096 . 1 1 A 98 98 GLY HA3 H 136 4.195 4.226 -0.031 2
1 1097 . 1 1 A 98 98 GLY C C 136 170.299 173.220 -2.921 2
1 1098 . 1 1 A 98 98 GLY CA C 136 40.875 44.774 -3.899 2
1 1099 . 1 1 A 98 98 GLY N N 136 109.494 109.130 0.364 2
1 1100 . 1 1 A 99 99 SER H H 137 8.701 8.727 -0.026 2
1 1101 . 1 1 A 99 99 SER HA H 137 4.639 4.906 -0.267 2
1 1104 . 1 1 A 99 99 SER C C 137 170.630 173.409 -2.779 2
1 1105 . 1 1 A 99 99 SER CA C 137 54.624 57.427 -2.803 2
1 1106 . 1 1 A 99 99 SER CB C 137 62.748 66.410 -3.662 2
1 1107 . 1 1 A 99 99 SER N N 137 114.685 118.330 -3.645 2
1 1108 . 1 1 A 100 100 ASP H H 138 9.117 8.915 0.202 2
1 1109 . 1 1 A 100 100 ASP HA H 138 3.965 4.483 -0.518 2
1 1112 . 1 1 A 100 100 ASP C C 138 175.540 177.791 -2.251 2
1 1113 . 1 1 A 100 100 ASP CA C 138 54.624 56.658 -2.034 2
1 1114 . 1 1 A 100 100 ASP CB C 138 36.500 41.032 -4.532 2
1 1115 . 1 1 A 100 100 ASP N N 138 120.777 122.829 -2.052 2
1 1116 . 1 1 A 101 101 ASN H H 139 8.667 8.208 0.459 2
1 1117 . 1 1 A 101 101 ASN HA H 139 4.333 4.785 -0.452 2
1 1122 . 1 1 A 101 101 ASN CA C 139 53.999 54.023 -0.024 2
1 1123 . 1 1 A 101 101 ASN CB C 139 34.625 39.035 -4.410 2
1 1124 . 1 1 A 101 101 ASN N N 139 121.930 115.987 5.943 2
1 1126 . 1 1 A 102 102 ASP H H 140 7.714 7.806 -0.092 2
1 1127 . 1 1 A 102 102 ASP HA H 140 4.037 4.496 -0.459 2
1 1130 . 1 1 A 102 102 ASP C C 140 172.807 175.930 -3.123 2
1 1131 . 1 1 A 102 102 ASP CA C 140 53.374 54.285 -0.911 2
1 1132 . 1 1 A 102 102 ASP CB C 140 37.125 41.284 -4.159 2
1 1133 . 1 1 A 102 102 ASP N N 140 118.011 117.759 0.252 2
1 1134 . 1 1 A 103 103 ALA H H 141 7.060 7.313 -0.253 2
1 1135 . 1 1 A 103 103 ALA HA H 141 3.353 4.558 -1.205 2
1 1139 . 1 1 A 103 103 ALA C C 141 172.233 176.710 -4.477 2
1 1140 . 1 1 A 103 103 ALA CA C 141 49.624 51.400 -1.776 2
1 1141 . 1 1 A 103 103 ALA CB C 141 16.502 20.807 -4.305 2
1 1142 . 1 1 A 103 103 ALA N N 141 125.777 122.332 3.445 2
1 1143 . 1 1 A 104 104 ASP H H 142 7.973 8.318 -0.345 2
1 1144 . 1 1 A 104 104 ASP HA H 142 4.420 5.046 -0.626 2
1 1147 . 1 1 A 104 104 ASP C C 142 174.188 176.058 -1.870 2
1 1148 . 1 1 A 104 104 ASP CA C 142 52.124 53.904 -1.780 2
1 1149 . 1 1 A 104 104 ASP CB C 142 37.125 41.364 -4.239 2
1 1150 . 1 1 A 104 104 ASP N N 142 122.965 120.066 2.899 2
1 1151 . 1 1 A 105 105 ILE H H 143 8.534 8.718 -0.184 2
1 1152 . 1 1 A 105 105 ILE HA H 143 4.060 4.942 -0.882 2
1 1162 . 1 1 A 105 105 ILE C C 143 173.235 175.855 -2.620 2
1 1163 . 1 1 A 105 105 ILE CA C 143 58.374 59.937 -1.563 2
1 1164 . 1 1 A 105 105 ILE CB C 143 39.123 39.619 -0.496 2
1 1167 . 1 1 A 105 105 ILE N N 143 124.757 120.779 3.978 2
1 1168 . 1 1 A 106 106 GLY H H 144 8.288 8.421 -0.133 2
1 1169 . 1 1 A 106 106 GLY HA2 H 144 4.764 4.440 0.324 2
1 1170 . 1 1 A 106 106 GLY HA3 H 144 4.764 4.535 0.229 2
1 1171 . 1 1 A 106 106 GLY C C 144 171.321 172.019 -0.698 2
1 1172 . 1 1 A 106 106 GLY CA C 144 40.250 45.505 -5.255 2
1 1173 . 1 1 A 106 106 GLY N N 144 110.895 111.362 -0.467 2
1 1174 . 1 1 A 107 107 ASN H H 145 8.577 9.064 -0.487 2
1 1175 . 1 1 A 107 107 ASN HA H 145 4.268 5.397 -1.129 2
1 1180 . 1 1 A 107 107 ASN C C 145 171.757 173.695 -1.938 2
1 1181 . 1 1 A 107 107 ASN CA C 145 52.124 51.898 0.226 2
1 1182 . 1 1 A 107 107 ASN CB C 145 34.625 42.160 -7.535 2
1 1183 . 1 1 A 107 107 ASN N N 145 118.042 117.051 0.991 2
1 1185 . 1 1 A 108 108 TRP H H 146 6.822 8.561 -1.739 2
1 1186 . 1 1 A 108 108 TRP HA H 146 4.513 5.078 -0.565 2
1 1195 . 1 1 A 108 108 TRP C C 146 172.665 172.556 0.109 2
1 1196 . 1 1 A 108 108 TRP CA C 146 54.624 55.907 -1.283 2
1 1197 . 1 1 A 108 108 TRP CB C 146 25.876 31.895 -6.019 2
1 1198 . 1 1 A 108 108 TRP N N 146 116.756 120.905 -4.149 2
1 1200 . 1 1 A 109 109 ASP H H 147 7.344 7.755 -0.411 2
1 1201 . 1 1 A 109 109 ASP HA H 147 4.655 5.187 -0.532 2
1 1204 . 1 1 A 109 109 ASP C C 147 172.193 174.750 -2.557 2
1 1205 . 1 1 A 109 109 ASP CA C 147 51.499 52.571 -1.072 2
1 1206 . 1 1 A 109 109 ASP CB C 147 39.000 42.898 -3.897 2
1 1207 . 1 1 A 109 109 ASP N N 147 121.461 123.041 -1.580 2
stop_
save_