data_16103_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16103
_Entry.PDB_ID 2KD2
_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 1 . 1 1 1 A 9 9 SER H H 94 8.475 8.851 -0.376 1
1 2 . 1 1 1 A 9 9 SER CA C 94 58.531 57.479 1.052 1
1 3 . 1 1 1 A 9 9 SER N N 94 117.432 122.785 -5.353 1
1 4 . 1 1 1 A 10 10 LYS H H 95 8.527 7.737 0.790 1
1 5 . 1 1 1 A 10 10 LYS C C 95 174.594 178.024 -3.430 1
1 6 . 1 1 1 A 10 10 LYS CA C 95 56.603 58.860 -2.257 1
1 7 . 1 1 1 A 10 10 LYS N N 95 123.104 122.419 0.685 1
1 8 . 1 1 1 A 11 11 THR H H 96 8.245 7.489 0.756 1
1 9 . 1 1 1 A 11 11 THR C C 96 174.393 173.242 1.151 1
1 10 . 1 1 1 A 11 11 THR CA C 96 62.149 60.823 1.326 1
1 11 . 1 1 1 A 11 11 THR CB C 96 69.183 68.882 0.301 1
1 13 . 1 1 1 A 11 11 THR N N 96 113.245 106.219 7.026 1
1 14 . 1 1 1 A 12 12 THR H H 97 7.769 7.524 0.245 1
1 15 . 1 1 1 A 12 12 THR HA H 97 5.583 4.865 0.718 1
1 20 . 1 1 1 A 12 12 THR C C 97 174.726 172.233 2.493 1
1 21 . 1 1 1 A 12 12 THR CA C 97 59.602 60.860 -1.258 1
1 22 . 1 1 1 A 12 12 THR CB C 97 72.805 71.373 1.432 1
1 24 . 1 1 1 A 12 12 THR N N 97 113.440 112.191 1.249 1
1 25 . 1 1 1 A 13 13 SER H H 98 8.593 8.598 -0.005 1
1 26 . 1 1 1 A 13 13 SER HA H 98 4.448 5.204 -0.756 1
1 29 . 1 1 1 A 13 13 SER C C 98 171.426 172.549 -1.123 1
1 30 . 1 1 1 A 13 13 SER CA C 98 59.056 57.058 1.998 1
1 31 . 1 1 1 A 13 13 SER CB C 98 67.839 65.224 2.615 1
1 32 . 1 1 1 A 13 13 SER N N 98 119.042 121.296 -2.254 1
1 33 . 1 1 1 A 14 14 THR H H 99 8.155 7.993 0.162 1
1 34 . 1 1 1 A 14 14 THR HA H 99 5.383 5.014 0.369 1
1 39 . 1 1 1 A 14 14 THR C C 99 171.565 172.850 -1.285 1
1 40 . 1 1 1 A 14 14 THR CA C 99 61.291 60.320 0.971 1
1 41 . 1 1 1 A 14 14 THR CB C 99 71.654 72.272 -0.618 1
1 43 . 1 1 1 A 14 14 THR N N 99 118.204 116.004 2.200 1
1 44 . 1 1 1 A 15 15 TRP H H 100 9.637 9.054 0.583 1
1 45 . 1 1 1 A 15 15 TRP HA H 100 4.807 5.074 -0.267 1
1 54 . 1 1 1 A 15 15 TRP C C 100 174.399 175.549 -1.150 1
1 55 . 1 1 1 A 15 15 TRP CA C 100 58.302 56.117 2.185 1
1 56 . 1 1 1 A 15 15 TRP CB C 100 34.810 33.542 1.268 1
1 63 . 1 1 1 A 15 15 TRP N N 100 125.132 122.838 2.294 1
1 65 . 1 1 1 A 16 16 VAL H H 101 8.863 9.044 -0.181 1
1 66 . 1 1 1 A 16 16 VAL HA H 101 5.267 4.733 0.534 1
1 74 . 1 1 1 A 16 16 VAL C C 101 174.955 175.216 -0.261 1
1 75 . 1 1 1 A 16 16 VAL CA C 101 60.653 61.675 -1.022 1
1 76 . 1 1 1 A 16 16 VAL CB C 101 34.284 32.921 1.363 1
1 79 . 1 1 1 A 16 16 VAL N N 101 119.527 123.235 -3.708 1
1 80 . 1 1 1 A 17 17 LEU H H 102 8.961 8.946 0.015 1
1 81 . 1 1 1 A 17 17 LEU HA H 102 4.729 5.142 -0.413 1
1 91 . 1 1 1 A 17 17 LEU C C 102 173.559 175.130 -1.571 1
1 92 . 1 1 1 A 17 17 LEU CA C 102 55.144 52.976 2.168 1
1 93 . 1 1 1 A 17 17 LEU CB C 102 42.948 45.951 -3.003 1
1 97 . 1 1 1 A 17 17 LEU N N 102 124.280 123.889 0.391 1
1 98 . 1 1 1 A 18 18 ARG H H 103 8.305 8.501 -0.196 1
1 99 . 1 1 1 A 18 18 ARG HA H 103 5.139 4.620 0.519 1
1 106 . 1 1 1 A 18 18 ARG C C 103 175.347 175.222 0.125 1
1 107 . 1 1 1 A 18 18 ARG CA C 103 54.793 55.897 -1.104 1
1 108 . 1 1 1 A 18 18 ARG CB C 103 31.347 29.873 1.474 1
1 111 . 1 1 1 A 18 18 ARG N N 103 122.020 123.396 -1.376 1
1 112 . 1 1 1 A 19 19 LEU H H 104 8.676 8.741 -0.065 1
1 113 . 1 1 1 A 19 19 LEU HA H 104 4.482 4.811 -0.329 1
1 123 . 1 1 1 A 19 19 LEU C C 104 175.957 175.811 0.146 1
1 124 . 1 1 1 A 19 19 LEU CA C 104 53.581 53.825 -0.244 1
1 125 . 1 1 1 A 19 19 LEU CB C 104 45.697 45.240 0.457 1
1 129 . 1 1 1 A 19 19 LEU N N 104 126.378 128.071 -1.693 1
1 130 . 1 1 1 A 20 20 ASP H H 105 9.390 9.508 -0.118 1
1 131 . 1 1 1 A 20 20 ASP HA H 105 4.287 4.352 -0.065 1
1 134 . 1 1 1 A 20 20 ASP C C 105 175.947 175.424 0.523 1
1 135 . 1 1 1 A 20 20 ASP CA C 105 55.263 55.122 0.141 1
1 136 . 1 1 1 A 20 20 ASP CB C 105 39.239 39.898 -0.659 1
1 137 . 1 1 1 A 20 20 ASP N N 105 125.208 125.905 -0.697 1
1 138 . 1 1 1 A 21 21 GLY H H 106 8.563 8.644 -0.081 1
1 139 . 1 1 1 A 21 21 GLY HA2 H 106 4.126 3.839 0.287 1
1 140 . 1 1 1 A 21 21 GLY HA3 H 106 3.509 3.840 -0.331 1
1 141 . 1 1 1 A 21 21 GLY C C 106 173.164 173.726 -0.562 1
1 142 . 1 1 1 A 21 21 GLY CA C 106 45.499 45.459 0.040 1
1 143 . 1 1 1 A 21 21 GLY N N 106 103.331 104.714 -1.383 1
1 144 . 1 1 1 A 22 22 GLU H H 107 7.713 8.000 -0.287 1
1 145 . 1 1 1 A 22 22 GLU HA H 107 4.634 4.920 -0.286 1
1 150 . 1 1 1 A 22 22 GLU C C 107 174.800 175.002 -0.202 1
1 151 . 1 1 1 A 22 22 GLU CA C 107 54.329 54.298 0.031 1
1 152 . 1 1 1 A 22 22 GLU CB C 107 32.832 34.061 -1.229 1
1 154 . 1 1 1 A 22 22 GLU N N 107 119.470 119.386 0.084 1
1 155 . 1 1 1 A 23 23 ASP H H 108 8.632 8.563 0.069 1
1 156 . 1 1 1 A 23 23 ASP HA H 108 4.872 4.705 0.167 1
1 159 . 1 1 1 A 23 23 ASP C C 108 175.533 175.684 -0.151 1
1 160 . 1 1 1 A 23 23 ASP CA C 108 55.180 53.873 1.307 1
1 161 . 1 1 1 A 23 23 ASP CB C 108 41.504 39.345 2.159 1
1 162 . 1 1 1 A 23 23 ASP N N 108 122.815 121.410 1.405 1
1 163 . 1 1 1 A 24 24 LEU H H 109 9.248 8.824 0.424 1
1 164 . 1 1 1 A 24 24 LEU HA H 109 4.836 4.477 0.359 1
1 174 . 1 1 1 A 24 24 LEU C C 109 174.322 175.781 -1.459 1
1 175 . 1 1 1 A 24 24 LEU CA C 109 54.473 55.418 -0.945 1
1 176 . 1 1 1 A 24 24 LEU CB C 109 44.718 42.589 2.129 1
1 180 . 1 1 1 A 24 24 LEU N N 109 125.550 126.567 -1.017 1
1 181 . 1 1 1 A 25 25 ARG H H 110 8.503 8.531 -0.028 1
1 182 . 1 1 1 A 25 25 ARG HA H 110 5.228 4.921 0.307 1
1 189 . 1 1 1 A 25 25 ARG C C 110 175.174 174.722 0.452 1
1 190 . 1 1 1 A 25 25 ARG CA C 110 54.745 54.607 0.138 1
1 191 . 1 1 1 A 25 25 ARG CB C 110 31.701 32.062 -0.361 1
1 194 . 1 1 1 A 25 25 ARG N N 110 125.424 127.807 -2.383 1
1 195 . 1 1 1 A 26 26 VAL H H 111 9.692 9.270 0.422 1
1 196 . 1 1 1 A 26 26 VAL HA H 111 5.091 5.118 -0.027 1
1 204 . 1 1 1 A 26 26 VAL C C 111 174.446 175.400 -0.954 1
1 205 . 1 1 1 A 26 26 VAL CA C 111 61.055 61.421 -0.366 1
1 206 . 1 1 1 A 26 26 VAL CB C 111 33.780 34.161 -0.381 1
1 209 . 1 1 1 A 26 26 VAL N N 111 130.649 127.098 3.551 1
1 210 . 1 1 1 A 27 27 VAL H H 112 9.401 8.977 0.424 1
1 211 . 1 1 1 A 27 27 VAL HA H 112 5.188 4.964 0.224 1
1 219 . 1 1 1 A 27 27 VAL C C 112 174.214 174.225 -0.011 1
1 220 . 1 1 1 A 27 27 VAL CA C 112 60.722 60.492 0.230 1
1 221 . 1 1 1 A 27 27 VAL CB C 112 36.082 35.947 0.135 1
1 224 . 1 1 1 A 27 27 VAL N N 112 127.416 126.770 0.646 1
1 225 . 1 1 1 A 28 28 LEU H H 113 9.265 9.140 0.125 1
1 226 . 1 1 1 A 28 28 LEU HA H 113 5.337 5.291 0.046 1
1 236 . 1 1 1 A 28 28 LEU C C 113 175.915 174.941 0.974 1
1 237 . 1 1 1 A 28 28 LEU CA C 113 52.599 53.396 -0.797 1
1 238 . 1 1 1 A 28 28 LEU CB C 113 47.495 44.351 3.144 1
1 242 . 1 1 1 A 28 28 LEU N N 113 127.527 128.964 -1.437 1
1 243 . 1 1 1 A 29 29 GLU H H 114 8.968 8.531 0.437 1
1 244 . 1 1 1 A 29 29 GLU HA H 114 4.701 4.301 0.400 1
1 249 . 1 1 1 A 29 29 GLU C C 114 176.715 177.608 -0.893 1
1 250 . 1 1 1 A 29 29 GLU CA C 114 55.342 56.556 -1.214 1
1 251 . 1 1 1 A 29 29 GLU CB C 114 30.005 30.160 -0.155 1
1 253 . 1 1 1 A 29 29 GLU N N 114 127.374 127.387 -0.013 1
1 254 . 1 1 1 A 30 30 LYS H H 115 8.243 8.535 -0.292 1
1 255 . 1 1 1 A 30 30 LYS HA H 115 3.711 4.156 -0.445 1
1 264 . 1 1 1 A 30 30 LYS C C 115 177.137 178.070 -0.933 1
1 265 . 1 1 1 A 30 30 LYS CA C 115 60.118 58.827 1.291 1
1 266 . 1 1 1 A 30 30 LYS CB C 115 32.656 32.087 0.569 1
1 270 . 1 1 1 A 30 30 LYS N N 115 124.225 125.143 -0.918 1
1 271 . 1 1 1 A 31 31 ASP H H 116 9.200 8.002 1.198 1
1 272 . 1 1 1 A 31 31 ASP HA H 116 4.444 4.395 0.049 1
1 275 . 1 1 1 A 31 31 ASP C C 116 177.774 176.910 0.864 1
1 276 . 1 1 1 A 31 31 ASP CA C 116 56.703 57.353 -0.650 1
1 277 . 1 1 1 A 31 31 ASP CB C 116 40.236 41.262 -1.026 1
1 278 . 1 1 1 A 31 31 ASP N N 116 115.955 119.586 -3.631 1
1 279 . 1 1 1 A 32 32 THR H H 117 7.352 7.647 -0.295 1
1 280 . 1 1 1 A 32 32 THR HA H 117 4.266 4.608 -0.342 1
1 285 . 1 1 1 A 32 32 THR C C 117 175.320 174.211 1.109 1
1 286 . 1 1 1 A 32 32 THR CA C 117 61.171 60.748 0.423 1
1 287 . 1 1 1 A 32 32 THR CB C 117 70.221 69.371 0.850 1
1 289 . 1 1 1 A 32 32 THR N N 117 106.440 107.973 -1.533 1
1 290 . 1 1 1 A 33 33 MET H H 118 8.216 7.917 0.299 1
1 291 . 1 1 1 A 33 33 MET HA H 118 4.184 4.325 -0.141 1
1 299 . 1 1 1 A 33 33 MET C C 118 174.952 174.568 0.384 1
1 300 . 1 1 1 A 33 33 MET CA C 118 55.195 57.005 -1.810 1
1 301 . 1 1 1 A 33 33 MET CB C 118 25.900 31.593 -5.693 1
1 304 . 1 1 1 A 33 33 MET N N 118 115.956 119.590 -3.634 1
1 305 . 1 1 1 A 34 34 ASP H H 119 7.509 8.040 -0.531 1
1 306 . 1 1 1 A 34 34 ASP HA H 119 4.486 4.833 -0.347 1
1 309 . 1 1 1 A 34 34 ASP C C 119 174.375 175.315 -0.940 1
1 310 . 1 1 1 A 34 34 ASP CA C 119 54.745 53.977 0.768 1
1 311 . 1 1 1 A 34 34 ASP CB C 119 42.865 42.109 0.756 1
1 312 . 1 1 1 A 34 34 ASP N N 119 118.500 118.922 -0.422 1
1 313 . 1 1 1 A 35 35 VAL H H 120 8.473 8.330 0.143 1
1 314 . 1 1 1 A 35 35 VAL HA H 120 4.709 4.722 -0.013 1
1 322 . 1 1 1 A 35 35 VAL C C 120 173.900 174.393 -0.493 1
1 323 . 1 1 1 A 35 35 VAL CA C 120 60.736 61.149 -0.413 1
1 324 . 1 1 1 A 35 35 VAL CB C 120 34.662 33.178 1.484 1
1 327 . 1 1 1 A 35 35 VAL N N 120 121.116 120.273 0.843 1
1 328 . 1 1 1 A 36 36 TRP H H 121 9.404 9.368 0.036 1
1 329 . 1 1 1 A 36 36 TRP HA H 121 5.174 5.518 -0.344 1
1 338 . 1 1 1 A 36 36 TRP C C 121 176.480 174.640 1.840 1
1 339 . 1 1 1 A 36 36 TRP CA C 121 55.070 55.084 -0.014 1
1 340 . 1 1 1 A 36 36 TRP CB C 121 32.179 32.490 -0.311 1
1 348 . 1 1 1 A 36 36 TRP N N 121 126.924 129.177 -2.253 1
1 350 . 1 1 1 A 37 37 CYS H H 122 9.230 8.491 0.739 1
1 351 . 1 1 1 A 37 37 CYS HA H 122 5.417 4.861 0.556 1
1 354 . 1 1 1 A 37 37 CYS C C 122 175.346 173.501 1.845 1
1 355 . 1 1 1 A 37 37 CYS CA C 122 57.083 57.882 -0.799 1
1 356 . 1 1 1 A 37 37 CYS CB C 122 28.713 30.257 -1.544 1
1 357 . 1 1 1 A 37 37 CYS N N 122 120.375 127.229 -6.854 1
1 358 . 1 1 1 A 38 38 ASN H H 123 9.817 9.183 0.634 1
1 359 . 1 1 1 A 38 38 ASN HA H 123 4.637 4.297 0.340 1
1 364 . 1 1 1 A 38 38 ASN C C 123 175.526 175.228 0.298 1
1 365 . 1 1 1 A 38 38 ASN CA C 123 54.023 54.392 -0.369 1
1 366 . 1 1 1 A 38 38 ASN CB C 123 36.581 37.387 -0.806 1
1 367 . 1 1 1 A 38 38 ASN N N 123 129.408 126.063 3.345 1
1 369 . 1 1 1 A 39 39 GLY H H 124 9.092 8.112 0.980 1
1 370 . 1 1 1 A 39 39 GLY HA2 H 124 4.241 3.410 0.831 1
1 371 . 1 1 1 A 39 39 GLY HA3 H 124 3.705 3.807 -0.102 1
1 372 . 1 1 1 A 39 39 GLY C C 124 173.405 173.881 -0.476 1
1 373 . 1 1 1 A 39 39 GLY CA C 124 45.595 46.709 -1.114 1
1 374 . 1 1 1 A 39 39 GLY N N 124 102.752 103.602 -0.850 1
1 375 . 1 1 1 A 40 40 GLN H H 125 8.006 7.649 0.357 1
1 376 . 1 1 1 A 40 40 GLN HA H 125 4.736 4.810 -0.074 1
1 383 . 1 1 1 A 40 40 GLN C C 125 174.477 175.034 -0.557 1
1 384 . 1 1 1 A 40 40 GLN CA C 125 53.747 55.303 -1.556 1
1 385 . 1 1 1 A 40 40 GLN CB C 125 30.413 30.971 -0.558 1
1 387 . 1 1 1 A 40 40 GLN N N 125 120.627 119.265 1.362 1
1 389 . 1 1 1 A 41 41 LYS H H 126 8.757 8.657 0.100 1
1 390 . 1 1 1 A 41 41 LYS HA H 126 3.464 4.433 -0.969 1
1 399 . 1 1 1 A 41 41 LYS C C 126 176.870 176.521 0.349 1
1 400 . 1 1 1 A 41 41 LYS CA C 126 57.136 57.014 0.122 1
1 401 . 1 1 1 A 41 41 LYS CB C 126 31.669 32.849 -1.180 1
1 405 . 1 1 1 A 41 41 LYS N N 126 129.107 127.923 1.184 1
1 406 . 1 1 1 A 42 42 MET H H 127 8.682 8.772 -0.090 1
1 407 . 1 1 1 A 42 42 MET HA H 127 4.712 4.459 0.253 1
1 415 . 1 1 1 A 42 42 MET C C 127 176.816 175.930 0.886 1
1 416 . 1 1 1 A 42 42 MET CA C 127 52.958 55.927 -2.969 1
1 417 . 1 1 1 A 42 42 MET CB C 127 33.023 33.542 -0.519 1
1 420 . 1 1 1 A 42 42 MET N N 127 126.569 126.403 0.166 1
1 421 . 1 1 1 A 43 43 GLU H H 128 8.734 8.622 0.112 1
1 422 . 1 1 1 A 43 43 GLU HA H 128 4.419 4.993 -0.574 1
1 427 . 1 1 1 A 43 43 GLU C C 128 176.531 176.228 0.303 1
1 428 . 1 1 1 A 43 43 GLU CA C 128 56.475 55.158 1.317 1
1 429 . 1 1 1 A 43 43 GLU CB C 128 29.604 31.897 -2.293 1
1 431 . 1 1 1 A 43 43 GLU N N 128 123.734 122.808 0.926 1
1 432 . 1 1 1 A 44 44 THR H H 129 8.263 8.927 -0.664 1
1 433 . 1 1 1 A 44 44 THR HA H 129 5.385 5.350 0.035 1
1 438 . 1 1 1 A 44 44 THR C C 129 174.205 174.582 -0.377 1
1 439 . 1 1 1 A 44 44 THR CA C 129 59.160 60.453 -1.293 1
1 440 . 1 1 1 A 44 44 THR CB C 129 72.419 71.196 1.223 1
1 442 . 1 1 1 A 44 44 THR N N 129 115.081 117.980 -2.899 1
1 443 . 1 1 1 A 45 45 ALA H H 130 8.727 8.301 0.426 1
1 444 . 1 1 1 A 45 45 ALA HA H 130 4.749 4.421 0.328 1
1 448 . 1 1 1 A 45 45 ALA C C 130 177.017 178.397 -1.380 1
1 449 . 1 1 1 A 45 45 ALA CA C 130 51.645 52.724 -1.079 1
1 450 . 1 1 1 A 45 45 ALA CB C 130 21.364 20.358 1.006 1
1 451 . 1 1 1 A 45 45 ALA N N 130 123.243 123.263 -0.020 1
1 452 . 1 1 1 A 46 46 GLY H H 131 8.818 8.218 0.600 1
1 453 . 1 1 1 A 46 46 GLY HA2 H 131 4.941 3.955 0.986 1
1 454 . 1 1 1 A 46 46 GLY HA3 H 131 3.690 4.031 -0.341 1
1 455 . 1 1 1 A 46 46 GLY C C 131 173.528 174.795 -1.267 1
1 456 . 1 1 1 A 46 46 GLY CA C 131 45.060 46.552 -1.492 1
1 457 . 1 1 1 A 46 46 GLY N N 131 112.392 107.752 4.640 1
1 458 . 1 1 1 A 47 47 GLU H H 132 8.746 8.022 0.724 1
1 459 . 1 1 1 A 47 47 GLU HA H 132 4.584 4.591 -0.007 1
1 464 . 1 1 1 A 47 47 GLU C C 132 175.223 175.869 -0.646 1
1 465 . 1 1 1 A 47 47 GLU CA C 132 55.008 56.356 -1.348 1
1 466 . 1 1 1 A 47 47 GLU CB C 132 32.939 30.864 2.075 1
1 468 . 1 1 1 A 47 47 GLU N N 132 122.107 120.868 1.239 1
1 469 . 1 1 1 A 48 48 PHE H H 133 8.920 9.179 -0.259 1
1 470 . 1 1 1 A 48 48 PHE HA H 133 4.822 5.159 -0.337 1
1 475 . 1 1 1 A 48 48 PHE C C 133 175.499 175.987 -0.488 1
1 476 . 1 1 1 A 48 48 PHE CA C 133 58.320 57.402 0.918 1
1 477 . 1 1 1 A 48 48 PHE CB C 133 39.175 40.236 -1.061 1
1 479 . 1 1 1 A 48 48 PHE N N 133 124.006 127.187 -3.181 1
1 480 . 1 1 1 A 49 49 VAL H H 134 8.161 8.262 -0.101 1
1 481 . 1 1 1 A 49 49 VAL HA H 134 4.492 4.702 -0.210 1
1 489 . 1 1 1 A 49 49 VAL C C 134 176.241 177.018 -0.777 1
1 490 . 1 1 1 A 49 49 VAL CA C 134 60.328 60.130 0.198 1
1 491 . 1 1 1 A 49 49 VAL CB C 134 34.542 34.620 -0.078 1
1 494 . 1 1 1 A 49 49 VAL N N 134 120.063 122.354 -2.291 1
1 495 . 1 1 1 A 50 50 ASP H H 135 8.596 8.654 -0.058 1
1 496 . 1 1 1 A 50 50 ASP HA H 135 4.278 4.411 -0.133 1
1 499 . 1 1 1 A 50 50 ASP C C 135 176.567 175.905 0.662 1
1 500 . 1 1 1 A 50 50 ASP CA C 135 57.149 57.084 0.065 1
1 501 . 1 1 1 A 50 50 ASP CB C 135 40.477 41.071 -0.594 1
1 502 . 1 1 1 A 50 50 ASP N N 135 122.137 122.087 0.050 1
1 503 . 1 1 1 A 51 51 ASP H H 136 8.328 7.966 0.362 1
1 504 . 1 1 1 A 51 51 ASP HA H 136 4.656 5.172 -0.516 1
1 507 . 1 1 1 A 51 51 ASP C C 136 175.798 174.717 1.081 1
1 508 . 1 1 1 A 51 51 ASP CA C 136 53.458 53.419 0.039 1
1 509 . 1 1 1 A 51 51 ASP CB C 136 40.306 43.081 -2.775 1
1 510 . 1 1 1 A 51 51 ASP N N 136 116.158 116.023 0.135 1
1 511 . 1 1 1 A 52 52 GLY H H 137 7.653 8.346 -0.693 1
1 512 . 1 1 1 A 52 52 GLY HA2 H 137 4.685 4.076 0.609 1
1 513 . 1 1 1 A 52 52 GLY HA3 H 137 4.069 4.076 -0.007 1
1 514 . 1 1 1 A 52 52 GLY C C 137 173.149 172.592 0.557 1
1 515 . 1 1 1 A 52 52 GLY CA C 137 45.860 43.993 1.867 1
1 516 . 1 1 1 A 52 52 GLY N N 137 107.634 109.526 -1.892 1
1 517 . 1 1 1 A 53 53 THR H H 138 8.445 8.094 0.351 1
1 518 . 1 1 1 A 53 53 THR HA H 138 4.996 4.773 0.223 1
1 523 . 1 1 1 A 53 53 THR C C 138 174.163 173.105 1.058 1
1 524 . 1 1 1 A 53 53 THR CA C 138 60.974 61.381 -0.407 1
1 525 . 1 1 1 A 53 53 THR CB C 138 72.266 71.631 0.635 1
1 527 . 1 1 1 A 53 53 THR N N 138 114.976 114.252 0.724 1
1 528 . 1 1 1 A 54 54 GLU H H 139 8.917 8.503 0.414 1
1 529 . 1 1 1 A 54 54 GLU HA H 139 5.205 4.621 0.584 1
1 534 . 1 1 1 A 54 54 GLU C C 139 175.700 175.155 0.545 1
1 535 . 1 1 1 A 54 54 GLU CA C 139 54.731 55.254 -0.523 1
1 536 . 1 1 1 A 54 54 GLU CB C 139 33.250 29.996 3.254 1
1 538 . 1 1 1 A 54 54 GLU N N 139 121.295 125.986 -4.691 1
1 539 . 1 1 1 A 55 55 THR H H 140 9.190 8.424 0.766 1
1 540 . 1 1 1 A 55 55 THR HA H 140 4.744 4.563 0.181 1
1 545 . 1 1 1 A 55 55 THR C C 140 174.537 173.500 1.037 1
1 546 . 1 1 1 A 55 55 THR CA C 140 62.678 61.766 0.912 1
1 547 . 1 1 1 A 55 55 THR CB C 140 69.744 68.799 0.945 1
1 549 . 1 1 1 A 55 55 THR N N 140 122.419 120.973 1.446 1
1 550 . 1 1 1 A 56 56 HIS H H 141 9.395 9.010 0.385 1
1 551 . 1 1 1 A 56 56 HIS HA H 141 5.204 4.995 0.209 1
1 556 . 1 1 1 A 56 56 HIS C C 141 174.675 174.677 -0.002 1
1 557 . 1 1 1 A 56 56 HIS CA C 141 55.557 54.102 1.455 1
1 558 . 1 1 1 A 56 56 HIS CB C 141 31.279 30.457 0.822 1
1 561 . 1 1 1 A 56 56 HIS N N 141 125.732 125.583 0.149 1
1 564 . 1 1 1 A 57 57 PHE H H 142 8.790 8.385 0.405 1
1 565 . 1 1 1 A 57 57 PHE HA H 142 4.918 6.035 -1.117 1
1 571 . 1 1 1 A 57 57 PHE C C 142 172.293 173.881 -1.588 1
1 572 . 1 1 1 A 57 57 PHE CA C 142 56.366 55.223 1.143 1
1 573 . 1 1 1 A 57 57 PHE CB C 142 39.962 42.687 -2.725 1
1 575 . 1 1 1 A 57 57 PHE N N 142 117.009 121.356 -4.347 1
1 576 . 1 1 1 A 58 58 SER H H 143 8.890 8.956 -0.066 1
1 577 . 1 1 1 A 58 58 SER HA H 143 5.286 5.077 0.209 1
1 580 . 1 1 1 A 58 58 SER C C 143 173.716 174.758 -1.042 1
1 581 . 1 1 1 A 58 58 SER CA C 143 57.517 57.037 0.480 1
1 582 . 1 1 1 A 58 58 SER CB C 143 65.448 64.495 0.953 1
1 583 . 1 1 1 A 58 58 SER N N 143 115.269 116.070 -0.801 1
1 584 . 1 1 1 A 59 59 VAL H H 144 7.737 8.576 -0.839 1
1 585 . 1 1 1 A 59 59 VAL HA H 144 4.220 4.471 -0.251 1
1 593 . 1 1 1 A 59 59 VAL C C 144 176.234 176.119 0.115 1
1 594 . 1 1 1 A 59 59 VAL CA C 144 61.741 60.789 0.952 1
1 595 . 1 1 1 A 59 59 VAL CB C 144 33.711 33.316 0.395 1
1 598 . 1 1 1 A 59 59 VAL N N 144 123.186 123.541 -0.355 1
1 599 . 1 1 1 A 60 60 GLY H H 145 8.945 9.032 -0.087 1
1 600 . 1 1 1 A 60 60 GLY HA2 H 145 4.027 3.778 0.249 1
1 601 . 1 1 1 A 60 60 GLY HA3 H 145 3.692 3.809 -0.117 1
1 602 . 1 1 1 A 60 60 GLY C C 145 175.182 174.664 0.518 1
1 603 . 1 1 1 A 60 60 GLY CA C 145 47.141 47.269 -0.128 1
1 604 . 1 1 1 A 60 60 GLY N N 145 116.908 118.319 -1.411 1
1 605 . 1 1 1 A 61 61 ASN H H 146 8.929 8.406 0.523 1
1 606 . 1 1 1 A 61 61 ASN HA H 146 4.718 4.700 0.018 1
1 611 . 1 1 1 A 61 61 ASN C C 146 174.706 174.355 0.351 1
1 612 . 1 1 1 A 61 61 ASN CA C 146 52.802 52.053 0.749 1
1 613 . 1 1 1 A 61 61 ASN CB C 146 37.917 37.619 0.298 1
1 614 . 1 1 1 A 61 61 ASN N N 146 123.976 124.381 -0.405 1
1 616 . 1 1 1 A 62 62 HIS H H 147 8.400 7.740 0.660 1
1 617 . 1 1 1 A 62 62 HIS HA H 147 4.762 5.132 -0.370 1
1 622 . 1 1 1 A 62 62 HIS C C 147 173.871 174.022 -0.151 1
1 623 . 1 1 1 A 62 62 HIS CA C 147 55.374 54.742 0.632 1
1 624 . 1 1 1 A 62 62 HIS CB C 147 28.655 34.930 -6.275 1
1 628 . 1 1 1 A 62 62 HIS N N 147 118.620 118.603 0.017 1
1 631 . 1 1 1 A 63 63 ASP H H 148 8.734 9.020 -0.286 1
1 632 . 1 1 1 A 63 63 ASP HA H 148 4.785 5.172 -0.387 1
1 635 . 1 1 1 A 63 63 ASP C C 148 175.269 175.359 -0.090 1
1 636 . 1 1 1 A 63 63 ASP CA C 148 54.390 52.953 1.437 1
1 637 . 1 1 1 A 63 63 ASP CB C 148 42.105 41.990 0.115 1
1 638 . 1 1 1 A 63 63 ASP N N 148 125.336 120.018 5.318 1
1 639 . 1 1 1 A 64 64 CYS H H 149 8.225 9.066 -0.841 1
1 640 . 1 1 1 A 64 64 CYS HA H 149 5.118 5.318 -0.200 1
1 643 . 1 1 1 A 64 64 CYS C C 149 173.740 172.757 0.983 1
1 644 . 1 1 1 A 64 64 CYS CA C 149 55.423 57.891 -2.468 1
1 645 . 1 1 1 A 64 64 CYS CB C 149 29.972 30.628 -0.656 1
1 646 . 1 1 1 A 64 64 CYS N N 149 124.476 123.887 0.589 1
1 647 . 1 1 1 A 65 65 TYR H H 150 8.916 8.222 0.694 1
1 648 . 1 1 1 A 65 65 TYR HA H 150 5.121 3.778 1.343 1
1 655 . 1 1 1 A 65 65 TYR C C 150 172.821 171.929 0.892 1
1 656 . 1 1 1 A 65 65 TYR CA C 150 56.347 56.017 0.330 1
1 657 . 1 1 1 A 65 65 TYR CB C 150 38.901 39.811 -0.910 1
1 662 . 1 1 1 A 65 65 TYR N N 150 115.313 117.977 -2.664 1
1 663 . 1 1 1 A 66 66 ILE H H 151 8.423 8.698 -0.275 1
1 664 . 1 1 1 A 66 66 ILE HA H 151 5.000 4.455 0.545 1
1 674 . 1 1 1 A 66 66 ILE C C 151 176.225 174.613 1.612 1
1 675 . 1 1 1 A 66 66 ILE CA C 151 57.798 60.113 -2.315 1
1 676 . 1 1 1 A 66 66 ILE CB C 151 39.863 38.854 1.009 1
1 680 . 1 1 1 A 66 66 ILE N N 151 118.575 121.332 -2.757 1
1 681 . 1 1 1 A 67 67 LYS H H 152 9.480 8.881 0.599 1
1 682 . 1 1 1 A 67 67 LYS HA H 152 5.091 4.687 0.404 1
1 691 . 1 1 1 A 67 67 LYS C C 152 174.079 175.015 -0.936 1
1 692 . 1 1 1 A 67 67 LYS CA C 152 54.728 56.099 -1.371 1
1 693 . 1 1 1 A 67 67 LYS CB C 152 35.256 33.137 2.119 1
1 697 . 1 1 1 A 67 67 LYS N N 152 132.311 128.596 3.715 1
1 698 . 1 1 1 A 68 68 ALA H H 153 8.844 8.461 0.383 1
1 699 . 1 1 1 A 68 68 ALA HA H 153 5.039 5.401 -0.362 1
1 703 . 1 1 1 A 68 68 ALA C C 153 176.587 176.415 0.172 1
1 704 . 1 1 1 A 68 68 ALA CA C 153 50.484 50.831 -0.347 1
1 705 . 1 1 1 A 68 68 ALA CB C 153 20.570 21.283 -0.713 1
1 706 . 1 1 1 A 68 68 ALA N N 153 129.958 130.260 -0.302 1
1 707 . 1 1 1 A 69 69 VAL H H 154 8.461 8.590 -0.129 1
1 708 . 1 1 1 A 69 69 VAL HA H 154 4.558 4.536 0.022 1
1 716 . 1 1 1 A 69 69 VAL C C 154 175.331 175.045 0.286 1
1 717 . 1 1 1 A 69 69 VAL CA C 154 60.758 60.901 -0.143 1
1 718 . 1 1 1 A 69 69 VAL CB C 154 34.743 35.060 -0.317 1
1 721 . 1 1 1 A 69 69 VAL N N 154 121.496 122.000 -0.504 1
1 722 . 1 1 1 A 70 70 SER H H 155 8.695 9.005 -0.310 1
1 723 . 1 1 1 A 70 70 SER HA H 155 4.646 5.016 -0.370 1
1 726 . 1 1 1 A 70 70 SER C C 155 174.690 174.141 0.549 1
1 727 . 1 1 1 A 70 70 SER CA C 155 58.065 57.280 0.785 1
1 728 . 1 1 1 A 70 70 SER CB C 155 64.062 64.456 -0.394 1
1 729 . 1 1 1 A 70 70 SER N N 155 119.763 122.421 -2.658 1
1 730 . 1 1 1 A 71 71 SER H H 156 8.360 8.813 -0.453 1
1 731 . 1 1 1 A 71 71 SER HA H 156 4.430 5.076 -0.646 1
1 734 . 1 1 1 A 71 71 SER CA C 156 58.491 56.245 2.246 1
1 735 . 1 1 1 A 71 71 SER CB C 156 64.061 66.183 -2.122 1
1 736 . 1 1 1 A 71 71 SER N N 156 118.577 115.407 3.170 1
1 737 . 1 1 1 A 72 72 GLY H H 157 8.542 8.429 0.113 1
1 738 . 1 1 1 A 72 72 GLY HA2 H 157 4.002 4.126 -0.124 1
1 739 . 1 1 1 A 72 72 GLY HA3 H 157 4.002 4.127 -0.125 1
1 740 . 1 1 1 A 72 72 GLY CA C 157 45.565 43.925 1.640 1
1 741 . 1 1 1 A 72 72 GLY N N 157 111.540 108.645 2.895 1
1 742 . 1 1 1 A 73 73 LYS H H 158 8.369 8.729 -0.360 1
1 743 . 1 1 1 A 73 73 LYS CA C 158 56.720 59.083 -2.363 1
1 744 . 1 1 1 A 73 73 LYS CB C 158 32.915 32.441 0.474 1
1 747 . 1 1 1 A 73 73 LYS N N 158 120.293 121.838 -1.545 1
1 748 . 1 1 1 A 74 74 ARG H H 159 8.181 8.156 0.025 1
1 749 . 1 1 1 A 74 74 ARG CA C 159 56.148 57.163 -1.015 1
1 751 . 1 1 1 A 74 74 ARG N N 159 119.343 115.542 3.801 1
1 752 . 1 1 1 A 75 75 LYS H H 160 8.443 8.006 0.437 1
1 753 . 1 1 1 A 75 75 LYS HA H 160 4.067 4.580 -0.513 1
1 762 . 1 1 1 A 75 75 LYS C C 160 176.868 176.784 0.084 1
1 763 . 1 1 1 A 75 75 LYS CA C 160 57.711 55.409 2.302 1
1 764 . 1 1 1 A 75 75 LYS CB C 160 31.777 33.350 -1.573 1
1 768 . 1 1 1 A 75 75 LYS N N 160 120.467 117.601 2.866 1
1 769 . 1 1 1 A 76 76 GLU H H 161 8.693 7.958 0.735 1
1 770 . 1 1 1 A 76 76 GLU HA H 161 4.290 4.063 0.227 1
1 771 . 1 1 1 A 76 76 GLU C C 161 176.844 176.667 0.177 1
1 772 . 1 1 1 A 76 76 GLU CA C 161 57.294 59.522 -2.228 1
1 773 . 1 1 1 A 76 76 GLU CB C 161 29.794 30.511 -0.717 1
1 775 . 1 1 1 A 76 76 GLU N N 161 118.767 120.245 -1.478 1
1 776 . 1 1 1 A 77 77 GLY H H 162 8.168 7.784 0.384 1
1 777 . 1 1 1 A 77 77 GLY HA2 H 162 4.010 4.235 -0.225 1
1 778 . 1 1 1 A 77 77 GLY HA3 H 162 3.963 4.238 -0.275 1
1 779 . 1 1 1 A 77 77 GLY C C 162 173.512 171.805 1.707 1
1 780 . 1 1 1 A 77 77 GLY CA C 162 45.362 44.668 0.694 1
1 781 . 1 1 1 A 77 77 GLY N N 162 108.621 106.579 2.042 1
1 782 . 1 1 1 A 78 78 ILE H H 163 7.954 8.938 -0.984 1
1 783 . 1 1 1 A 78 78 ILE HA H 163 4.323 4.859 -0.536 1
1 793 . 1 1 1 A 78 78 ILE C C 163 175.402 175.475 -0.073 1
1 794 . 1 1 1 A 78 78 ILE CA C 163 60.632 59.542 1.090 1
1 795 . 1 1 1 A 78 78 ILE CB C 163 39.759 40.323 -0.564 1
1 799 . 1 1 1 A 78 78 ILE N N 163 121.604 126.003 -4.399 1
1 800 . 1 1 1 A 79 79 ILE H H 164 8.514 8.772 -0.258 1
1 801 . 1 1 1 A 79 79 ILE HA H 164 4.341 4.782 -0.441 1
1 811 . 1 1 1 A 79 79 ILE C C 164 175.172 174.481 0.691 1
1 812 . 1 1 1 A 79 79 ILE CA C 164 60.027 59.869 0.158 1
1 813 . 1 1 1 A 79 79 ILE CB C 164 40.153 40.906 -0.753 1
1 817 . 1 1 1 A 79 79 ILE N N 164 127.137 125.800 1.337 1
1 818 . 1 1 1 A 80 80 HIS H H 165 8.492 8.895 -0.403 1
1 819 . 1 1 1 A 80 80 HIS HA H 165 5.676 5.271 0.405 1
1 824 . 1 1 1 A 80 80 HIS C C 165 175.502 174.943 0.559 1
1 825 . 1 1 1 A 80 80 HIS CA C 165 57.043 54.919 2.124 1
1 826 . 1 1 1 A 80 80 HIS CB C 165 32.741 32.219 0.522 1
1 829 . 1 1 1 A 80 80 HIS N N 165 125.422 126.556 -1.134 1
1 830 . 1 1 1 A 81 81 THR H H 166 9.080 9.226 -0.146 1
1 831 . 1 1 1 A 81 81 THR HA H 166 4.999 4.859 0.140 1
1 836 . 1 1 1 A 81 81 THR C C 166 171.877 173.796 -1.919 1
1 837 . 1 1 1 A 81 81 THR CA C 166 59.924 61.171 -1.247 1
1 838 . 1 1 1 A 81 81 THR CB C 166 72.243 71.056 1.187 1
1 840 . 1 1 1 A 81 81 THR N N 166 117.682 118.027 -0.345 1
1 841 . 1 1 1 A 82 82 LEU H H 167 8.062 8.038 0.024 1
1 842 . 1 1 1 A 82 82 LEU HA H 167 4.350 3.933 0.417 1
1 852 . 1 1 1 A 82 82 LEU C C 167 172.705 174.985 -2.280 1
1 853 . 1 1 1 A 82 82 LEU CA C 167 53.553 55.570 -2.017 1
1 854 . 1 1 1 A 82 82 LEU CB C 167 39.768 41.356 -1.588 1
1 858 . 1 1 1 A 82 82 LEU N N 167 125.369 129.734 -4.365 1
1 859 . 1 1 1 A 83 83 ILE H H 168 8.657 8.271 0.386 1
1 860 . 1 1 1 A 83 83 ILE HA H 168 4.476 4.890 -0.414 1
1 870 . 1 1 1 A 83 83 ILE C C 168 175.159 174.355 0.804 1
1 871 . 1 1 1 A 83 83 ILE CA C 168 58.529 59.832 -1.303 1
1 872 . 1 1 1 A 83 83 ILE CB C 168 37.410 41.074 -3.664 1
1 876 . 1 1 1 A 83 83 ILE N N 168 128.042 127.295 0.747 1
1 877 . 1 1 1 A 84 84 VAL H H 169 8.464 8.477 -0.013 1
1 878 . 1 1 1 A 84 84 VAL HA H 169 4.284 4.344 -0.060 1
1 886 . 1 1 1 A 84 84 VAL C C 169 176.138 175.660 0.478 1
1 887 . 1 1 1 A 84 84 VAL CA C 169 61.029 61.111 -0.082 1
1 888 . 1 1 1 A 84 84 VAL CB C 169 34.714 34.016 0.698 1
1 891 . 1 1 1 A 84 84 VAL N N 169 124.644 126.731 -2.087 1
1 892 . 1 1 1 A 85 85 ASP H H 170 9.158 9.320 -0.162 1
1 893 . 1 1 1 A 85 85 ASP HA H 170 4.362 4.251 0.111 1
1 896 . 1 1 1 A 85 85 ASP C C 170 175.489 175.055 0.434 1
1 897 . 1 1 1 A 85 85 ASP CA C 170 55.868 55.130 0.738 1
1 898 . 1 1 1 A 85 85 ASP CB C 170 38.927 39.429 -0.502 1
1 899 . 1 1 1 A 85 85 ASP N N 170 129.061 127.509 1.552 1
1 900 . 1 1 1 A 86 86 ASN H H 171 8.811 8.468 0.343 1
1 901 . 1 1 1 A 86 86 ASN HA H 171 4.053 4.384 -0.331 1
1 906 . 1 1 1 A 86 86 ASN C C 171 173.802 173.793 0.009 1
1 907 . 1 1 1 A 86 86 ASN CA C 171 55.173 54.666 0.507 1
1 908 . 1 1 1 A 86 86 ASN CB C 171 38.150 36.933 1.217 1
1 909 . 1 1 1 A 86 86 ASN N N 171 108.418 108.703 -0.285 1
1 911 . 1 1 1 A 87 87 ARG H H 172 7.914 7.491 0.423 1
1 912 . 1 1 1 A 87 87 ARG HA H 172 4.597 4.626 -0.029 1
1 919 . 1 1 1 A 87 87 ARG C C 172 174.025 174.779 -0.754 1
1 920 . 1 1 1 A 87 87 ARG CA C 172 54.846 54.339 0.507 1
1 921 . 1 1 1 A 87 87 ARG CB C 172 32.697 33.101 -0.404 1
1 924 . 1 1 1 A 87 87 ARG N N 172 120.988 117.527 3.461 1
1 925 . 1 1 1 A 88 88 GLU H H 173 8.534 8.760 -0.226 1
1 926 . 1 1 1 A 88 88 GLU HA H 173 4.560 4.339 0.221 1
1 931 . 1 1 1 A 88 88 GLU C C 173 176.187 175.356 0.831 1
1 932 . 1 1 1 A 88 88 GLU CA C 173 56.044 56.849 -0.805 1
1 933 . 1 1 1 A 88 88 GLU CB C 173 30.329 30.391 -0.062 1
1 935 . 1 1 1 A 88 88 GLU N N 173 123.982 125.516 -1.534 1
1 936 . 1 1 1 A 89 89 ILE H H 174 8.897 7.960 0.937 1
1 937 . 1 1 1 A 89 89 ILE HA H 174 4.666 4.528 0.138 1
1 947 . 1 1 1 A 89 89 ILE C C 174 174.110 174.164 -0.054 1
1 948 . 1 1 1 A 89 89 ILE CA C 174 55.255 57.333 -2.078 1
1 949 . 1 1 1 A 89 89 ILE CB C 174 37.851 41.534 -3.683 1
1 953 . 1 1 1 A 89 89 ILE N N 174 130.008 127.263 2.745 1
1 954 . 1 1 1 A 90 90 PRO HA H 175 4.713 4.720 -0.007 1
1 961 . 1 1 1 A 90 90 PRO C C 175 176.956 176.469 0.487 1
1 962 . 1 1 1 A 90 90 PRO CA C 175 63.159 63.014 0.145 1
1 963 . 1 1 1 A 90 90 PRO CB C 175 32.428 32.474 -0.046 1
1 966 . 1 1 1 A 91 91 GLU H H 176 8.778 8.806 -0.028 1
1 967 . 1 1 1 A 91 91 GLU HA H 176 3.910 4.619 -0.709 1
1 972 . 1 1 1 A 91 91 GLU C C 176 176.426 177.194 -0.768 1
1 973 . 1 1 1 A 91 91 GLU CA C 176 56.738 56.328 0.410 1
1 974 . 1 1 1 A 91 91 GLU CB C 176 30.540 31.565 -1.025 1
1 976 . 1 1 1 A 91 91 GLU N N 176 124.561 122.120 2.441 1
1 977 . 1 1 1 A 92 92 LEU H H 177 8.630 8.291 0.339 1
1 978 . 1 1 1 A 92 92 LEU HA H 177 4.419 3.911 0.508 1
1 988 . 1 1 1 A 92 92 LEU C C 177 177.162 176.779 0.383 1
1 989 . 1 1 1 A 92 92 LEU CA C 177 55.350 58.126 -2.776 1
1 990 . 1 1 1 A 92 92 LEU CB C 177 42.390 41.603 0.787 1
1 994 . 1 1 1 A 92 92 LEU N N 177 126.683 126.704 -0.021 1
1 995 . 1 1 1 A 93 93 THR H H 178 8.375 7.419 0.956 1
1 996 . 1 1 1 A 93 93 THR HA H 178 4.359 4.269 0.090 1
1 1001 . 1 1 1 A 93 93 THR C C 178 173.589 174.765 -1.176 1
1 1002 . 1 1 1 A 93 93 THR CA C 178 61.621 62.836 -1.215 1
1 1003 . 1 1 1 A 93 93 THR CB C 178 69.724 68.444 1.280 1
1 1005 . 1 1 1 A 93 93 THR N N 178 119.699 108.127 11.572 1
1 1 . 2 1 1 A 9 9 SER H H 94 8.475 8.719 -0.244 1
1 2 . 2 1 1 A 9 9 SER CA C 94 58.531 58.784 -0.253 1
1 3 . 2 1 1 A 9 9 SER N N 94 117.432 121.736 -4.304 1
1 4 . 2 1 1 A 10 10 LYS H H 95 8.527 8.824 -0.297 1
1 5 . 2 1 1 A 10 10 LYS C C 95 174.594 177.637 -3.043 1
1 6 . 2 1 1 A 10 10 LYS CA C 95 56.603 56.219 0.384 1
1 7 . 2 1 1 A 10 10 LYS N N 95 123.104 123.538 -0.434 1
1 8 . 2 1 1 A 11 11 THR H H 96 8.245 8.967 -0.722 1
1 9 . 2 1 1 A 11 11 THR C C 96 174.393 174.863 -0.470 1
1 10 . 2 1 1 A 11 11 THR CA C 96 62.149 62.574 -0.425 1
1 11 . 2 1 1 A 11 11 THR CB C 96 69.183 69.367 -0.184 1
1 13 . 2 1 1 A 11 11 THR N N 96 113.245 116.845 -3.600 1
1 14 . 2 1 1 A 12 12 THR H H 97 7.769 7.733 0.036 1
1 15 . 2 1 1 A 12 12 THR HA H 97 5.583 4.749 0.834 1
1 20 . 2 1 1 A 12 12 THR C C 97 174.726 172.327 2.399 1
1 21 . 2 1 1 A 12 12 THR CA C 97 59.602 60.962 -1.360 1
1 22 . 2 1 1 A 12 12 THR CB C 97 72.805 71.005 1.800 1
1 24 . 2 1 1 A 12 12 THR N N 97 113.440 112.295 1.145 1
1 25 . 2 1 1 A 13 13 SER H H 98 8.593 9.021 -0.428 1
1 26 . 2 1 1 A 13 13 SER HA H 98 4.448 5.064 -0.616 1
1 29 . 2 1 1 A 13 13 SER C C 98 171.426 172.689 -1.263 1
1 30 . 2 1 1 A 13 13 SER CA C 98 59.056 57.022 2.034 1
1 31 . 2 1 1 A 13 13 SER CB C 98 67.839 65.198 2.641 1
1 32 . 2 1 1 A 13 13 SER N N 98 119.042 121.406 -2.364 1
1 33 . 2 1 1 A 14 14 THR H H 99 8.155 7.920 0.235 1
1 34 . 2 1 1 A 14 14 THR HA H 99 5.383 4.817 0.566 1
1 39 . 2 1 1 A 14 14 THR C C 99 171.565 172.974 -1.409 1
1 40 . 2 1 1 A 14 14 THR CA C 99 61.291 60.675 0.616 1
1 41 . 2 1 1 A 14 14 THR CB C 99 71.654 72.151 -0.497 1
1 43 . 2 1 1 A 14 14 THR N N 99 118.204 116.515 1.689 1
1 44 . 2 1 1 A 15 15 TRP H H 100 9.637 9.298 0.339 1
1 45 . 2 1 1 A 15 15 TRP HA H 100 4.807 5.364 -0.557 1
1 54 . 2 1 1 A 15 15 TRP C C 100 174.399 175.676 -1.277 1
1 55 . 2 1 1 A 15 15 TRP CA C 100 58.302 55.712 2.590 1
1 56 . 2 1 1 A 15 15 TRP CB C 100 34.810 34.142 0.668 1
1 63 . 2 1 1 A 15 15 TRP N N 100 125.132 125.511 -0.379 1
1 65 . 2 1 1 A 16 16 VAL H H 101 8.863 8.845 0.018 1
1 66 . 2 1 1 A 16 16 VAL HA H 101 5.267 4.849 0.418 1
1 74 . 2 1 1 A 16 16 VAL C C 101 174.955 175.005 -0.050 1
1 75 . 2 1 1 A 16 16 VAL CA C 101 60.653 61.435 -0.782 1
1 76 . 2 1 1 A 16 16 VAL CB C 101 34.284 34.106 0.178 1
1 79 . 2 1 1 A 16 16 VAL N N 101 119.527 120.721 -1.194 1
1 80 . 2 1 1 A 17 17 LEU H H 102 8.961 8.856 0.105 1
1 81 . 2 1 1 A 17 17 LEU HA H 102 4.729 5.100 -0.371 1
1 91 . 2 1 1 A 17 17 LEU C C 102 173.559 175.102 -1.543 1
1 92 . 2 1 1 A 17 17 LEU CA C 102 55.144 53.116 2.028 1
1 93 . 2 1 1 A 17 17 LEU CB C 102 42.948 45.901 -2.953 1
1 97 . 2 1 1 A 17 17 LEU N N 102 124.280 123.860 0.420 1
1 98 . 2 1 1 A 18 18 ARG H H 103 8.305 8.504 -0.199 1
1 99 . 2 1 1 A 18 18 ARG HA H 103 5.139 4.669 0.470 1
1 106 . 2 1 1 A 18 18 ARG C C 103 175.347 175.302 0.045 1
1 107 . 2 1 1 A 18 18 ARG CA C 103 54.793 55.897 -1.104 1
1 108 . 2 1 1 A 18 18 ARG CB C 103 31.347 29.754 1.593 1
1 111 . 2 1 1 A 18 18 ARG N N 103 122.020 122.780 -0.760 1
1 112 . 2 1 1 A 19 19 LEU H H 104 8.676 8.774 -0.098 1
1 113 . 2 1 1 A 19 19 LEU HA H 104 4.482 4.849 -0.367 1
1 123 . 2 1 1 A 19 19 LEU C C 104 175.957 175.832 0.125 1
1 124 . 2 1 1 A 19 19 LEU CA C 104 53.581 53.671 -0.090 1
1 125 . 2 1 1 A 19 19 LEU CB C 104 45.697 45.323 0.374 1
1 129 . 2 1 1 A 19 19 LEU N N 104 126.378 127.437 -1.059 1
1 130 . 2 1 1 A 20 20 ASP H H 105 9.390 9.550 -0.160 1
1 131 . 2 1 1 A 20 20 ASP HA H 105 4.287 4.392 -0.105 1
1 134 . 2 1 1 A 20 20 ASP C C 105 175.947 175.987 -0.040 1
1 135 . 2 1 1 A 20 20 ASP CA C 105 55.263 55.320 -0.057 1
1 136 . 2 1 1 A 20 20 ASP CB C 105 39.239 39.430 -0.191 1
1 137 . 2 1 1 A 20 20 ASP N N 105 125.208 125.778 -0.570 1
1 138 . 2 1 1 A 21 21 GLY H H 106 8.563 8.646 -0.083 1
1 139 . 2 1 1 A 21 21 GLY HA2 H 106 4.126 3.842 0.284 1
1 140 . 2 1 1 A 21 21 GLY HA3 H 106 3.509 3.843 -0.334 1
1 141 . 2 1 1 A 21 21 GLY C C 106 173.164 173.558 -0.394 1
1 142 . 2 1 1 A 21 21 GLY CA C 106 45.499 45.520 -0.021 1
1 143 . 2 1 1 A 21 21 GLY N N 106 103.331 104.028 -0.697 1
1 144 . 2 1 1 A 22 22 GLU H H 107 7.713 7.753 -0.040 1
1 145 . 2 1 1 A 22 22 GLU HA H 107 4.634 4.885 -0.251 1
1 150 . 2 1 1 A 22 22 GLU C C 107 174.800 174.774 0.026 1
1 151 . 2 1 1 A 22 22 GLU CA C 107 54.329 54.662 -0.333 1
1 152 . 2 1 1 A 22 22 GLU CB C 107 32.832 32.808 0.024 1
1 154 . 2 1 1 A 22 22 GLU N N 107 119.470 115.680 3.790 1
1 155 . 2 1 1 A 23 23 ASP H H 108 8.632 8.567 0.065 1
1 156 . 2 1 1 A 23 23 ASP HA H 108 4.872 4.714 0.158 1
1 159 . 2 1 1 A 23 23 ASP C C 108 175.533 175.451 0.082 1
1 160 . 2 1 1 A 23 23 ASP CA C 108 55.180 53.939 1.241 1
1 161 . 2 1 1 A 23 23 ASP CB C 108 41.504 39.424 2.080 1
1 162 . 2 1 1 A 23 23 ASP N N 108 122.815 120.124 2.691 1
1 163 . 2 1 1 A 24 24 LEU H H 109 9.248 8.908 0.340 1
1 164 . 2 1 1 A 24 24 LEU HA H 109 4.836 4.617 0.219 1
1 174 . 2 1 1 A 24 24 LEU C C 109 174.322 175.825 -1.503 1
1 175 . 2 1 1 A 24 24 LEU CA C 109 54.473 55.146 -0.673 1
1 176 . 2 1 1 A 24 24 LEU CB C 109 44.718 42.883 1.835 1
1 180 . 2 1 1 A 24 24 LEU N N 109 125.550 126.748 -1.198 1
1 181 . 2 1 1 A 25 25 ARG H H 110 8.503 8.711 -0.208 1
1 182 . 2 1 1 A 25 25 ARG HA H 110 5.228 4.965 0.263 1
1 189 . 2 1 1 A 25 25 ARG C C 110 175.174 174.702 0.472 1
1 190 . 2 1 1 A 25 25 ARG CA C 110 54.745 54.727 0.018 1
1 191 . 2 1 1 A 25 25 ARG CB C 110 31.701 31.852 -0.151 1
1 194 . 2 1 1 A 25 25 ARG N N 110 125.424 127.505 -2.081 1
1 195 . 2 1 1 A 26 26 VAL H H 111 9.692 8.920 0.772 1
1 196 . 2 1 1 A 26 26 VAL HA H 111 5.091 5.024 0.067 1
1 204 . 2 1 1 A 26 26 VAL C C 111 174.446 175.580 -1.134 1
1 205 . 2 1 1 A 26 26 VAL CA C 111 61.055 61.647 -0.592 1
1 206 . 2 1 1 A 26 26 VAL CB C 111 33.780 33.635 0.145 1
1 209 . 2 1 1 A 26 26 VAL N N 111 130.649 127.342 3.307 1
1 210 . 2 1 1 A 27 27 VAL H H 112 9.401 9.024 0.377 1
1 211 . 2 1 1 A 27 27 VAL HA H 112 5.188 4.878 0.310 1
1 219 . 2 1 1 A 27 27 VAL C C 112 174.214 174.277 -0.063 1
1 220 . 2 1 1 A 27 27 VAL CA C 112 60.722 60.951 -0.229 1
1 221 . 2 1 1 A 27 27 VAL CB C 112 36.082 35.232 0.850 1
1 224 . 2 1 1 A 27 27 VAL N N 112 127.416 127.187 0.229 1
1 225 . 2 1 1 A 28 28 LEU H H 113 9.265 9.213 0.052 1
1 226 . 2 1 1 A 28 28 LEU HA H 113 5.337 5.412 -0.075 1
1 236 . 2 1 1 A 28 28 LEU C C 113 175.915 174.946 0.969 1
1 237 . 2 1 1 A 28 28 LEU CA C 113 52.599 53.402 -0.803 1
1 238 . 2 1 1 A 28 28 LEU CB C 113 47.495 45.176 2.319 1
1 242 . 2 1 1 A 28 28 LEU N N 113 127.527 130.095 -2.568 1
1 243 . 2 1 1 A 29 29 GLU H H 114 8.968 8.581 0.387 1
1 244 . 2 1 1 A 29 29 GLU HA H 114 4.701 4.461 0.240 1
1 249 . 2 1 1 A 29 29 GLU C C 114 176.715 177.626 -0.911 1
1 250 . 2 1 1 A 29 29 GLU CA C 114 55.342 55.934 -0.592 1
1 251 . 2 1 1 A 29 29 GLU CB C 114 30.005 30.996 -0.991 1
1 253 . 2 1 1 A 29 29 GLU N N 114 127.374 127.320 0.054 1
1 254 . 2 1 1 A 30 30 LYS H H 115 8.243 8.310 -0.067 1
1 255 . 2 1 1 A 30 30 LYS HA H 115 3.711 4.072 -0.361 1
1 264 . 2 1 1 A 30 30 LYS C C 115 177.137 178.429 -1.292 1
1 265 . 2 1 1 A 30 30 LYS CA C 115 60.118 58.694 1.424 1
1 266 . 2 1 1 A 30 30 LYS CB C 115 32.656 31.961 0.695 1
1 270 . 2 1 1 A 30 30 LYS N N 115 124.225 124.299 -0.074 1
1 271 . 2 1 1 A 31 31 ASP H H 116 9.200 7.987 1.213 1
1 272 . 2 1 1 A 31 31 ASP HA H 116 4.444 4.407 0.037 1
1 275 . 2 1 1 A 31 31 ASP C C 116 177.774 176.992 0.782 1
1 276 . 2 1 1 A 31 31 ASP CA C 116 56.703 57.404 -0.701 1
1 277 . 2 1 1 A 31 31 ASP CB C 116 40.236 41.156 -0.920 1
1 278 . 2 1 1 A 31 31 ASP N N 116 115.955 120.559 -4.604 1
1 279 . 2 1 1 A 32 32 THR H H 117 7.352 7.638 -0.286 1
1 280 . 2 1 1 A 32 32 THR HA H 117 4.266 4.574 -0.308 1
1 285 . 2 1 1 A 32 32 THR C C 117 175.320 174.136 1.184 1
1 286 . 2 1 1 A 32 32 THR CA C 117 61.171 60.773 0.398 1
1 287 . 2 1 1 A 32 32 THR CB C 117 70.221 69.550 0.671 1
1 289 . 2 1 1 A 32 32 THR N N 117 106.440 107.642 -1.202 1
1 290 . 2 1 1 A 33 33 MET H H 118 8.216 7.917 0.299 1
1 291 . 2 1 1 A 33 33 MET HA H 118 4.184 4.403 -0.219 1
1 299 . 2 1 1 A 33 33 MET C C 118 174.952 174.737 0.215 1
1 300 . 2 1 1 A 33 33 MET CA C 118 55.195 56.806 -1.611 1
1 301 . 2 1 1 A 33 33 MET CB C 118 25.900 31.045 -5.145 1
1 304 . 2 1 1 A 33 33 MET N N 118 115.956 116.640 -0.684 1
1 305 . 2 1 1 A 34 34 ASP H H 119 7.509 7.881 -0.372 1
1 306 . 2 1 1 A 34 34 ASP HA H 119 4.486 4.720 -0.234 1
1 309 . 2 1 1 A 34 34 ASP C C 119 174.375 175.665 -1.290 1
1 310 . 2 1 1 A 34 34 ASP CA C 119 54.745 54.309 0.436 1
1 311 . 2 1 1 A 34 34 ASP CB C 119 42.865 42.096 0.769 1
1 312 . 2 1 1 A 34 34 ASP N N 119 118.500 118.303 0.197 1
1 313 . 2 1 1 A 35 35 VAL H H 120 8.473 8.544 -0.071 1
1 314 . 2 1 1 A 35 35 VAL HA H 120 4.709 4.611 0.098 1
1 322 . 2 1 1 A 35 35 VAL C C 120 173.900 174.393 -0.493 1
1 323 . 2 1 1 A 35 35 VAL CA C 120 60.736 61.048 -0.312 1
1 324 . 2 1 1 A 35 35 VAL CB C 120 34.662 32.641 2.021 1
1 327 . 2 1 1 A 35 35 VAL N N 120 121.116 123.595 -2.479 1
1 328 . 2 1 1 A 36 36 TRP H H 121 9.404 9.545 -0.141 1
1 329 . 2 1 1 A 36 36 TRP HA H 121 5.174 5.314 -0.140 1
1 338 . 2 1 1 A 36 36 TRP C C 121 176.480 174.712 1.768 1
1 339 . 2 1 1 A 36 36 TRP CA C 121 55.070 55.455 -0.385 1
1 340 . 2 1 1 A 36 36 TRP CB C 121 32.179 32.993 -0.814 1
1 348 . 2 1 1 A 36 36 TRP N N 121 126.924 129.624 -2.700 1
1 350 . 2 1 1 A 37 37 CYS H H 122 9.230 8.990 0.240 1
1 351 . 2 1 1 A 37 37 CYS HA H 122 5.417 4.890 0.527 1
1 354 . 2 1 1 A 37 37 CYS C C 122 175.346 174.387 0.959 1
1 355 . 2 1 1 A 37 37 CYS CA C 122 57.083 57.948 -0.865 1
1 356 . 2 1 1 A 37 37 CYS CB C 122 28.713 29.640 -0.927 1
1 357 . 2 1 1 A 37 37 CYS N N 122 120.375 125.877 -5.502 1
1 358 . 2 1 1 A 38 38 ASN H H 123 9.817 8.794 1.023 1
1 359 . 2 1 1 A 38 38 ASN HA H 123 4.637 4.208 0.429 1
1 364 . 2 1 1 A 38 38 ASN C C 123 175.526 175.184 0.342 1
1 365 . 2 1 1 A 38 38 ASN CA C 123 54.023 54.313 -0.290 1
1 366 . 2 1 1 A 38 38 ASN CB C 123 36.581 37.056 -0.475 1
1 367 . 2 1 1 A 38 38 ASN N N 123 129.408 125.589 3.819 1
1 369 . 2 1 1 A 39 39 GLY H H 124 9.092 7.975 1.117 1
1 370 . 2 1 1 A 39 39 GLY HA2 H 124 4.241 3.632 0.609 1
1 371 . 2 1 1 A 39 39 GLY HA3 H 124 3.705 3.821 -0.116 1
1 372 . 2 1 1 A 39 39 GLY C C 124 173.405 174.019 -0.614 1
1 373 . 2 1 1 A 39 39 GLY CA C 124 45.595 46.741 -1.146 1
1 374 . 2 1 1 A 39 39 GLY N N 124 102.752 103.251 -0.499 1
1 375 . 2 1 1 A 40 40 GLN H H 125 8.006 7.725 0.281 1
1 376 . 2 1 1 A 40 40 GLN HA H 125 4.736 4.887 -0.151 1
1 383 . 2 1 1 A 40 40 GLN C C 125 174.477 174.653 -0.176 1
1 384 . 2 1 1 A 40 40 GLN CA C 125 53.747 55.205 -1.458 1
1 385 . 2 1 1 A 40 40 GLN CB C 125 30.413 31.563 -1.150 1
1 387 . 2 1 1 A 40 40 GLN N N 125 120.627 119.264 1.363 1
1 389 . 2 1 1 A 41 41 LYS H H 126 8.757 8.717 0.040 1
1 390 . 2 1 1 A 41 41 LYS HA H 126 3.464 4.301 -0.837 1
1 399 . 2 1 1 A 41 41 LYS C C 126 176.870 175.744 1.126 1
1 400 . 2 1 1 A 41 41 LYS CA C 126 57.136 57.453 -0.317 1
1 401 . 2 1 1 A 41 41 LYS CB C 126 31.669 33.293 -1.624 1
1 405 . 2 1 1 A 41 41 LYS N N 126 129.107 126.727 2.380 1
1 406 . 2 1 1 A 42 42 MET H H 127 8.682 8.456 0.226 1
1 407 . 2 1 1 A 42 42 MET HA H 127 4.712 5.304 -0.592 1
1 415 . 2 1 1 A 42 42 MET C C 127 176.816 174.369 2.447 1
1 416 . 2 1 1 A 42 42 MET CA C 127 52.958 53.731 -0.773 1
1 417 . 2 1 1 A 42 42 MET CB C 127 33.023 36.930 -3.907 1
1 420 . 2 1 1 A 42 42 MET N N 127 126.569 119.107 7.462 1
1 421 . 2 1 1 A 43 43 GLU H H 128 8.734 8.836 -0.102 1
1 422 . 2 1 1 A 43 43 GLU HA H 128 4.419 5.131 -0.712 1
1 427 . 2 1 1 A 43 43 GLU C C 128 176.531 176.756 -0.225 1
1 428 . 2 1 1 A 43 43 GLU CA C 128 56.475 55.158 1.317 1
1 429 . 2 1 1 A 43 43 GLU CB C 128 29.604 31.488 -1.884 1
1 431 . 2 1 1 A 43 43 GLU N N 128 123.734 119.801 3.933 1
1 432 . 2 1 1 A 44 44 THR H H 129 8.263 8.778 -0.515 1
1 433 . 2 1 1 A 44 44 THR HA H 129 5.385 5.678 -0.293 1
1 438 . 2 1 1 A 44 44 THR C C 129 174.205 173.556 0.649 1
1 439 . 2 1 1 A 44 44 THR CA C 129 59.160 60.534 -1.374 1
1 440 . 2 1 1 A 44 44 THR CB C 129 72.419 71.734 0.685 1
1 442 . 2 1 1 A 44 44 THR N N 129 115.081 115.858 -0.777 1
1 443 . 2 1 1 A 45 45 ALA H H 130 8.727 8.562 0.165 1
1 444 . 2 1 1 A 45 45 ALA HA H 130 4.749 4.631 0.118 1
1 448 . 2 1 1 A 45 45 ALA C C 130 177.017 176.011 1.006 1
1 449 . 2 1 1 A 45 45 ALA CA C 130 51.645 51.503 0.142 1
1 450 . 2 1 1 A 45 45 ALA CB C 130 21.364 21.811 -0.447 1
1 451 . 2 1 1 A 45 45 ALA N N 130 123.243 121.706 1.537 1
1 452 . 2 1 1 A 46 46 GLY H H 131 8.818 8.471 0.347 1
1 453 . 2 1 1 A 46 46 GLY HA2 H 131 4.941 4.134 0.807 1
1 454 . 2 1 1 A 46 46 GLY HA3 H 131 3.690 4.340 -0.650 1
1 455 . 2 1 1 A 46 46 GLY C C 131 173.528 171.885 1.643 1
1 456 . 2 1 1 A 46 46 GLY CA C 131 45.060 45.007 0.053 1
1 457 . 2 1 1 A 46 46 GLY N N 131 112.392 105.245 7.147 1
1 458 . 2 1 1 A 47 47 GLU H H 132 8.746 8.549 0.197 1
1 459 . 2 1 1 A 47 47 GLU HA H 132 4.584 4.733 -0.149 1
1 464 . 2 1 1 A 47 47 GLU C C 132 175.223 174.550 0.673 1
1 465 . 2 1 1 A 47 47 GLU CA C 132 55.008 55.922 -0.914 1
1 466 . 2 1 1 A 47 47 GLU CB C 132 32.939 32.741 0.198 1
1 468 . 2 1 1 A 47 47 GLU N N 132 122.107 121.856 0.251 1
1 469 . 2 1 1 A 48 48 PHE H H 133 8.920 8.672 0.248 1
1 470 . 2 1 1 A 48 48 PHE HA H 133 4.822 5.844 -1.022 1
1 475 . 2 1 1 A 48 48 PHE C C 133 175.499 174.428 1.071 1
1 476 . 2 1 1 A 48 48 PHE CA C 133 58.320 55.201 3.119 1
1 477 . 2 1 1 A 48 48 PHE CB C 133 39.175 42.605 -3.430 1
1 479 . 2 1 1 A 48 48 PHE N N 133 124.006 117.546 6.460 1
1 480 . 2 1 1 A 49 49 VAL H H 134 8.161 8.819 -0.658 1
1 481 . 2 1 1 A 49 49 VAL HA H 134 4.492 4.695 -0.203 1
1 489 . 2 1 1 A 49 49 VAL C C 134 176.241 177.096 -0.855 1
1 490 . 2 1 1 A 49 49 VAL CA C 134 60.328 59.644 0.684 1
1 491 . 2 1 1 A 49 49 VAL CB C 134 34.542 34.511 0.031 1
1 494 . 2 1 1 A 49 49 VAL N N 134 120.063 117.636 2.427 1
1 495 . 2 1 1 A 50 50 ASP H H 135 8.596 8.546 0.050 1
1 496 . 2 1 1 A 50 50 ASP HA H 135 4.278 4.436 -0.158 1
1 499 . 2 1 1 A 50 50 ASP C C 135 176.567 176.013 0.554 1
1 500 . 2 1 1 A 50 50 ASP CA C 135 57.149 57.066 0.083 1
1 501 . 2 1 1 A 50 50 ASP CB C 135 40.477 40.749 -0.272 1
1 502 . 2 1 1 A 50 50 ASP N N 135 122.137 121.618 0.519 1
1 503 . 2 1 1 A 51 51 ASP H H 136 8.328 7.938 0.390 1
1 504 . 2 1 1 A 51 51 ASP HA H 136 4.656 5.219 -0.563 1
1 507 . 2 1 1 A 51 51 ASP C C 136 175.798 174.859 0.939 1
1 508 . 2 1 1 A 51 51 ASP CA C 136 53.458 53.278 0.180 1
1 509 . 2 1 1 A 51 51 ASP CB C 136 40.306 42.704 -2.398 1
1 510 . 2 1 1 A 51 51 ASP N N 136 116.158 115.851 0.307 1
1 511 . 2 1 1 A 52 52 GLY H H 137 7.653 8.380 -0.727 1
1 512 . 2 1 1 A 52 52 GLY HA2 H 137 4.685 4.174 0.511 1
1 513 . 2 1 1 A 52 52 GLY HA3 H 137 4.069 4.177 -0.108 1
1 514 . 2 1 1 A 52 52 GLY C C 137 173.149 172.645 0.504 1
1 515 . 2 1 1 A 52 52 GLY CA C 137 45.860 44.150 1.710 1
1 516 . 2 1 1 A 52 52 GLY N N 137 107.634 109.703 -2.069 1
1 517 . 2 1 1 A 53 53 THR H H 138 8.445 8.233 0.212 1
1 518 . 2 1 1 A 53 53 THR HA H 138 4.996 5.071 -0.075 1
1 523 . 2 1 1 A 53 53 THR C C 138 174.163 173.357 0.806 1
1 524 . 2 1 1 A 53 53 THR CA C 138 60.974 61.603 -0.629 1
1 525 . 2 1 1 A 53 53 THR CB C 138 72.266 71.910 0.356 1
1 527 . 2 1 1 A 53 53 THR N N 138 114.976 114.750 0.226 1
1 528 . 2 1 1 A 54 54 GLU H H 139 8.917 8.535 0.382 1
1 529 . 2 1 1 A 54 54 GLU HA H 139 5.205 4.651 0.554 1
1 534 . 2 1 1 A 54 54 GLU C C 139 175.700 175.198 0.502 1
1 535 . 2 1 1 A 54 54 GLU CA C 139 54.731 55.862 -1.131 1
1 536 . 2 1 1 A 54 54 GLU CB C 139 33.250 29.840 3.410 1
1 538 . 2 1 1 A 54 54 GLU N N 139 121.295 127.208 -5.913 1
1 539 . 2 1 1 A 55 55 THR H H 140 9.190 8.510 0.680 1
1 540 . 2 1 1 A 55 55 THR HA H 140 4.744 4.669 0.075 1
1 545 . 2 1 1 A 55 55 THR C C 140 174.537 174.004 0.533 1
1 546 . 2 1 1 A 55 55 THR CA C 140 62.678 62.306 0.372 1
1 547 . 2 1 1 A 55 55 THR CB C 140 69.744 68.980 0.764 1
1 549 . 2 1 1 A 55 55 THR N N 140 122.419 121.616 0.803 1
1 550 . 2 1 1 A 56 56 HIS H H 141 9.395 9.222 0.173 1
1 551 . 2 1 1 A 56 56 HIS HA H 141 5.204 5.119 0.085 1
1 556 . 2 1 1 A 56 56 HIS C C 141 174.675 174.821 -0.146 1
1 557 . 2 1 1 A 56 56 HIS CA C 141 55.557 53.909 1.648 1
1 558 . 2 1 1 A 56 56 HIS CB C 141 31.279 31.278 0.001 1
1 561 . 2 1 1 A 56 56 HIS N N 141 125.732 126.000 -0.268 1
1 564 . 2 1 1 A 57 57 PHE H H 142 8.790 7.931 0.859 1
1 565 . 2 1 1 A 57 57 PHE HA H 142 4.918 6.064 -1.146 1
1 571 . 2 1 1 A 57 57 PHE C C 142 172.293 174.042 -1.749 1
1 572 . 2 1 1 A 57 57 PHE CA C 142 56.366 55.145 1.221 1
1 573 . 2 1 1 A 57 57 PHE CB C 142 39.962 42.681 -2.719 1
1 575 . 2 1 1 A 57 57 PHE N N 142 117.009 121.266 -4.257 1
1 576 . 2 1 1 A 58 58 SER H H 143 8.890 8.963 -0.073 1
1 577 . 2 1 1 A 58 58 SER HA H 143 5.286 4.843 0.443 1
1 580 . 2 1 1 A 58 58 SER C C 143 173.716 174.626 -0.910 1
1 581 . 2 1 1 A 58 58 SER CA C 143 57.517 57.577 -0.060 1
1 582 . 2 1 1 A 58 58 SER CB C 143 65.448 64.172 1.276 1
1 583 . 2 1 1 A 58 58 SER N N 143 115.269 116.239 -0.970 1
1 584 . 2 1 1 A 59 59 VAL H H 144 7.737 8.970 -1.233 1
1 585 . 2 1 1 A 59 59 VAL HA H 144 4.220 4.487 -0.267 1
1 593 . 2 1 1 A 59 59 VAL C C 144 176.234 176.147 0.087 1
1 594 . 2 1 1 A 59 59 VAL CA C 144 61.741 60.804 0.937 1
1 595 . 2 1 1 A 59 59 VAL CB C 144 33.711 33.089 0.622 1
1 598 . 2 1 1 A 59 59 VAL N N 144 123.186 124.308 -1.122 1
1 599 . 2 1 1 A 60 60 GLY H H 145 8.945 9.039 -0.094 1
1 600 . 2 1 1 A 60 60 GLY HA2 H 145 4.027 3.778 0.249 1
1 601 . 2 1 1 A 60 60 GLY HA3 H 145 3.692 3.817 -0.125 1
1 602 . 2 1 1 A 60 60 GLY C C 145 175.182 174.776 0.406 1
1 603 . 2 1 1 A 60 60 GLY CA C 145 47.141 47.168 -0.027 1
1 604 . 2 1 1 A 60 60 GLY N N 145 116.908 118.410 -1.502 1
1 605 . 2 1 1 A 61 61 ASN H H 146 8.929 8.395 0.534 1
1 606 . 2 1 1 A 61 61 ASN HA H 146 4.718 4.789 -0.071 1
1 611 . 2 1 1 A 61 61 ASN C C 146 174.706 173.966 0.740 1
1 612 . 2 1 1 A 61 61 ASN CA C 146 52.802 52.956 -0.154 1
1 613 . 2 1 1 A 61 61 ASN CB C 146 37.917 38.721 -0.804 1
1 614 . 2 1 1 A 61 61 ASN N N 146 123.976 124.774 -0.798 1
1 616 . 2 1 1 A 62 62 HIS H H 147 8.400 7.703 0.697 1
1 617 . 2 1 1 A 62 62 HIS HA H 147 4.762 5.071 -0.309 1
1 622 . 2 1 1 A 62 62 HIS C C 147 173.871 173.912 -0.041 1
1 623 . 2 1 1 A 62 62 HIS CA C 147 55.374 54.556 0.818 1
1 624 . 2 1 1 A 62 62 HIS CB C 147 28.655 34.124 -5.469 1
1 628 . 2 1 1 A 62 62 HIS N N 147 118.620 117.694 0.926 1
1 631 . 2 1 1 A 63 63 ASP H H 148 8.734 9.109 -0.375 1
1 632 . 2 1 1 A 63 63 ASP HA H 148 4.785 5.125 -0.340 1
1 635 . 2 1 1 A 63 63 ASP C C 148 175.269 174.941 0.328 1
1 636 . 2 1 1 A 63 63 ASP CA C 148 54.390 53.260 1.130 1
1 637 . 2 1 1 A 63 63 ASP CB C 148 42.105 41.990 0.115 1
1 638 . 2 1 1 A 63 63 ASP N N 148 125.336 118.375 6.961 1
1 639 . 2 1 1 A 64 64 CYS H H 149 8.225 8.822 -0.597 1
1 640 . 2 1 1 A 64 64 CYS HA H 149 5.118 5.341 -0.223 1
1 643 . 2 1 1 A 64 64 CYS C C 149 173.740 172.992 0.748 1
1 644 . 2 1 1 A 64 64 CYS CA C 149 55.423 58.028 -2.605 1
1 645 . 2 1 1 A 64 64 CYS CB C 149 29.972 30.051 -0.079 1
1 646 . 2 1 1 A 64 64 CYS N N 149 124.476 123.570 0.906 1
1 647 . 2 1 1 A 65 65 TYR H H 150 8.916 8.373 0.543 1
1 648 . 2 1 1 A 65 65 TYR HA H 150 5.121 3.937 1.184 1
1 655 . 2 1 1 A 65 65 TYR C C 150 172.821 171.869 0.952 1
1 656 . 2 1 1 A 65 65 TYR CA C 150 56.347 56.018 0.329 1
1 657 . 2 1 1 A 65 65 TYR CB C 150 38.901 40.288 -1.387 1
1 662 . 2 1 1 A 65 65 TYR N N 150 115.313 117.949 -2.636 1
1 663 . 2 1 1 A 66 66 ILE H H 151 8.423 8.756 -0.333 1
1 664 . 2 1 1 A 66 66 ILE HA H 151 5.000 4.305 0.695 1
1 674 . 2 1 1 A 66 66 ILE C C 151 176.225 174.680 1.545 1
1 675 . 2 1 1 A 66 66 ILE CA C 151 57.798 59.971 -2.173 1
1 676 . 2 1 1 A 66 66 ILE CB C 151 39.863 38.644 1.219 1
1 680 . 2 1 1 A 66 66 ILE N N 151 118.575 121.299 -2.724 1
1 681 . 2 1 1 A 67 67 LYS H H 152 9.480 8.752 0.728 1
1 682 . 2 1 1 A 67 67 LYS HA H 152 5.091 4.676 0.415 1
1 691 . 2 1 1 A 67 67 LYS C C 152 174.079 175.205 -1.126 1
1 692 . 2 1 1 A 67 67 LYS CA C 152 54.728 56.109 -1.381 1
1 693 . 2 1 1 A 67 67 LYS CB C 152 35.256 33.101 2.155 1
1 697 . 2 1 1 A 67 67 LYS N N 152 132.311 128.454 3.857 1
1 698 . 2 1 1 A 68 68 ALA H H 153 8.844 8.407 0.437 1
1 699 . 2 1 1 A 68 68 ALA HA H 153 5.039 5.423 -0.384 1
1 703 . 2 1 1 A 68 68 ALA C C 153 176.587 176.390 0.197 1
1 704 . 2 1 1 A 68 68 ALA CA C 153 50.484 50.858 -0.374 1
1 705 . 2 1 1 A 68 68 ALA CB C 153 20.570 21.337 -0.767 1
1 706 . 2 1 1 A 68 68 ALA N N 153 129.958 129.732 0.226 1
1 707 . 2 1 1 A 69 69 VAL H H 154 8.461 8.702 -0.241 1
1 708 . 2 1 1 A 69 69 VAL HA H 154 4.558 4.594 -0.036 1
1 716 . 2 1 1 A 69 69 VAL C C 154 175.331 174.977 0.354 1
1 717 . 2 1 1 A 69 69 VAL CA C 154 60.758 60.875 -0.117 1
1 718 . 2 1 1 A 69 69 VAL CB C 154 34.743 34.998 -0.255 1
1 721 . 2 1 1 A 69 69 VAL N N 154 121.496 122.404 -0.908 1
1 722 . 2 1 1 A 70 70 SER H H 155 8.695 9.033 -0.338 1
1 723 . 2 1 1 A 70 70 SER HA H 155 4.646 5.102 -0.456 1
1 726 . 2 1 1 A 70 70 SER C C 155 174.690 174.038 0.652 1
1 727 . 2 1 1 A 70 70 SER CA C 155 58.065 57.109 0.956 1
1 728 . 2 1 1 A 70 70 SER CB C 155 64.062 64.453 -0.391 1
1 729 . 2 1 1 A 70 70 SER N N 155 119.763 122.210 -2.447 1
1 730 . 2 1 1 A 71 71 SER H H 156 8.360 8.824 -0.464 1
1 731 . 2 1 1 A 71 71 SER HA H 156 4.430 5.249 -0.819 1
1 734 . 2 1 1 A 71 71 SER CA C 156 58.491 56.164 2.327 1
1 735 . 2 1 1 A 71 71 SER CB C 156 64.061 65.950 -1.889 1
1 736 . 2 1 1 A 71 71 SER N N 156 118.577 116.318 2.259 1
1 737 . 2 1 1 A 72 72 GLY H H 157 8.542 8.228 0.314 1
1 738 . 2 1 1 A 72 72 GLY HA2 H 157 4.002 4.172 -0.170 1
1 739 . 2 1 1 A 72 72 GLY HA3 H 157 4.002 4.173 -0.171 1
1 740 . 2 1 1 A 72 72 GLY CA C 157 45.565 45.153 0.412 1
1 741 . 2 1 1 A 72 72 GLY N N 157 111.540 108.316 3.224 1
1 742 . 2 1 1 A 73 73 LYS H H 158 8.369 8.736 -0.367 1
1 743 . 2 1 1 A 73 73 LYS CA C 158 56.720 57.559 -0.839 1
1 744 . 2 1 1 A 73 73 LYS CB C 158 32.915 35.491 -2.576 1
1 747 . 2 1 1 A 73 73 LYS N N 158 120.293 126.246 -5.953 1
1 748 . 2 1 1 A 74 74 ARG H H 159 8.181 8.254 -0.073 1
1 749 . 2 1 1 A 74 74 ARG CA C 159 56.148 57.402 -1.254 1
1 751 . 2 1 1 A 74 74 ARG N N 159 119.343 118.860 0.483 1
1 752 . 2 1 1 A 75 75 LYS H H 160 8.443 7.748 0.695 1
1 753 . 2 1 1 A 75 75 LYS HA H 160 4.067 4.517 -0.450 1
1 762 . 2 1 1 A 75 75 LYS C C 160 176.868 176.229 0.639 1
1 763 . 2 1 1 A 75 75 LYS CA C 160 57.711 55.555 2.156 1
1 764 . 2 1 1 A 75 75 LYS CB C 160 31.777 32.565 -0.788 1
1 768 . 2 1 1 A 75 75 LYS N N 160 120.467 118.585 1.882 1
1 769 . 2 1 1 A 76 76 GLU H H 161 8.693 8.482 0.211 1
1 770 . 2 1 1 A 76 76 GLU HA H 161 4.290 4.329 -0.039 1
1 771 . 2 1 1 A 76 76 GLU C C 161 176.844 177.192 -0.348 1
1 772 . 2 1 1 A 76 76 GLU CA C 161 57.294 58.706 -1.412 1
1 773 . 2 1 1 A 76 76 GLU CB C 161 29.794 30.662 -0.868 1
1 775 . 2 1 1 A 76 76 GLU N N 161 118.767 123.812 -5.045 1
1 776 . 2 1 1 A 77 77 GLY H H 162 8.168 7.811 0.357 1
1 777 . 2 1 1 A 77 77 GLY HA2 H 162 4.010 4.332 -0.322 1
1 778 . 2 1 1 A 77 77 GLY HA3 H 162 3.963 4.332 -0.369 1
1 779 . 2 1 1 A 77 77 GLY C C 162 173.512 171.871 1.641 1
1 780 . 2 1 1 A 77 77 GLY CA C 162 45.362 44.675 0.687 1
1 781 . 2 1 1 A 77 77 GLY N N 162 108.621 104.179 4.442 1
1 782 . 2 1 1 A 78 78 ILE H H 163 7.954 9.168 -1.214 1
1 783 . 2 1 1 A 78 78 ILE HA H 163 4.323 4.830 -0.507 1
1 793 . 2 1 1 A 78 78 ILE C C 163 175.402 175.422 -0.020 1
1 794 . 2 1 1 A 78 78 ILE CA C 163 60.632 59.748 0.884 1
1 795 . 2 1 1 A 78 78 ILE CB C 163 39.759 40.108 -0.349 1
1 799 . 2 1 1 A 78 78 ILE N N 163 121.604 126.291 -4.687 1
1 800 . 2 1 1 A 79 79 ILE H H 164 8.514 9.113 -0.599 1
1 801 . 2 1 1 A 79 79 ILE HA H 164 4.341 4.779 -0.438 1
1 811 . 2 1 1 A 79 79 ILE C C 164 175.172 174.912 0.260 1
1 812 . 2 1 1 A 79 79 ILE CA C 164 60.027 59.995 0.032 1
1 813 . 2 1 1 A 79 79 ILE CB C 164 40.153 40.878 -0.725 1
1 817 . 2 1 1 A 79 79 ILE N N 164 127.137 125.785 1.352 1
1 818 . 2 1 1 A 80 80 HIS H H 165 8.492 8.873 -0.381 1
1 819 . 2 1 1 A 80 80 HIS HA H 165 5.676 5.200 0.476 1
1 824 . 2 1 1 A 80 80 HIS C C 165 175.502 174.906 0.596 1
1 825 . 2 1 1 A 80 80 HIS CA C 165 57.043 55.238 1.805 1
1 826 . 2 1 1 A 80 80 HIS CB C 165 32.741 31.333 1.408 1
1 829 . 2 1 1 A 80 80 HIS N N 165 125.422 126.473 -1.051 1
1 830 . 2 1 1 A 81 81 THR H H 166 9.080 9.005 0.075 1
1 831 . 2 1 1 A 81 81 THR HA H 166 4.999 4.976 0.023 1
1 836 . 2 1 1 A 81 81 THR C C 166 171.877 173.732 -1.855 1
1 837 . 2 1 1 A 81 81 THR CA C 166 59.924 61.344 -1.420 1
1 838 . 2 1 1 A 81 81 THR CB C 166 72.243 70.891 1.352 1
1 840 . 2 1 1 A 81 81 THR N N 166 117.682 116.883 0.799 1
1 841 . 2 1 1 A 82 82 LEU H H 167 8.062 8.015 0.047 1
1 842 . 2 1 1 A 82 82 LEU HA H 167 4.350 3.832 0.518 1
1 852 . 2 1 1 A 82 82 LEU C C 167 172.705 174.935 -2.230 1
1 853 . 2 1 1 A 82 82 LEU CA C 167 53.553 55.597 -2.044 1
1 854 . 2 1 1 A 82 82 LEU CB C 167 39.768 41.312 -1.544 1
1 858 . 2 1 1 A 82 82 LEU N N 167 125.369 128.762 -3.393 1
1 859 . 2 1 1 A 83 83 ILE H H 168 8.657 8.236 0.421 1
1 860 . 2 1 1 A 83 83 ILE HA H 168 4.476 4.971 -0.495 1
1 870 . 2 1 1 A 83 83 ILE C C 168 175.159 174.262 0.897 1
1 871 . 2 1 1 A 83 83 ILE CA C 168 58.529 60.159 -1.630 1
1 872 . 2 1 1 A 83 83 ILE CB C 168 37.410 40.446 -3.036 1
1 876 . 2 1 1 A 83 83 ILE N N 168 128.042 127.335 0.707 1
1 877 . 2 1 1 A 84 84 VAL H H 169 8.464 8.469 -0.005 1
1 878 . 2 1 1 A 84 84 VAL HA H 169 4.284 4.446 -0.162 1
1 886 . 2 1 1 A 84 84 VAL C C 169 176.138 175.642 0.496 1
1 887 . 2 1 1 A 84 84 VAL CA C 169 61.029 61.382 -0.353 1
1 888 . 2 1 1 A 84 84 VAL CB C 169 34.714 34.154 0.560 1
1 891 . 2 1 1 A 84 84 VAL N N 169 124.644 126.834 -2.190 1
1 892 . 2 1 1 A 85 85 ASP H H 170 9.158 9.491 -0.333 1
1 893 . 2 1 1 A 85 85 ASP HA H 170 4.362 4.345 0.017 1
1 896 . 2 1 1 A 85 85 ASP C C 170 175.489 175.689 -0.200 1
1 897 . 2 1 1 A 85 85 ASP CA C 170 55.868 55.684 0.184 1
1 898 . 2 1 1 A 85 85 ASP CB C 170 38.927 39.255 -0.328 1
1 899 . 2 1 1 A 85 85 ASP N N 170 129.061 129.111 -0.050 1
1 900 . 2 1 1 A 86 86 ASN H H 171 8.811 8.430 0.381 1
1 901 . 2 1 1 A 86 86 ASN HA H 171 4.053 4.378 -0.325 1
1 906 . 2 1 1 A 86 86 ASN C C 171 173.802 173.944 -0.142 1
1 907 . 2 1 1 A 86 86 ASN CA C 171 55.173 54.335 0.838 1
1 908 . 2 1 1 A 86 86 ASN CB C 171 38.150 37.376 0.774 1
1 909 . 2 1 1 A 86 86 ASN N N 171 108.418 110.733 -2.315 1
1 911 . 2 1 1 A 87 87 ARG H H 172 7.914 7.481 0.433 1
1 912 . 2 1 1 A 87 87 ARG HA H 172 4.597 4.664 -0.067 1
1 919 . 2 1 1 A 87 87 ARG C C 172 174.025 174.865 -0.840 1
1 920 . 2 1 1 A 87 87 ARG CA C 172 54.846 54.296 0.550 1
1 921 . 2 1 1 A 87 87 ARG CB C 172 32.697 33.299 -0.602 1
1 924 . 2 1 1 A 87 87 ARG N N 172 120.988 117.255 3.733 1
1 925 . 2 1 1 A 88 88 GLU H H 173 8.534 8.733 -0.199 1
1 926 . 2 1 1 A 88 88 GLU HA H 173 4.560 4.350 0.210 1
1 931 . 2 1 1 A 88 88 GLU C C 173 176.187 175.453 0.734 1
1 932 . 2 1 1 A 88 88 GLU CA C 173 56.044 56.856 -0.812 1
1 933 . 2 1 1 A 88 88 GLU CB C 173 30.329 30.456 -0.127 1
1 935 . 2 1 1 A 88 88 GLU N N 173 123.982 124.726 -0.744 1
1 936 . 2 1 1 A 89 89 ILE H H 174 8.897 8.048 0.849 1
1 937 . 2 1 1 A 89 89 ILE HA H 174 4.666 4.604 0.062 1
1 947 . 2 1 1 A 89 89 ILE C C 174 174.110 174.132 -0.022 1
1 948 . 2 1 1 A 89 89 ILE CA C 174 55.255 57.386 -2.131 1
1 949 . 2 1 1 A 89 89 ILE CB C 174 37.851 41.706 -3.855 1
1 953 . 2 1 1 A 89 89 ILE N N 174 130.008 127.269 2.739 1
1 954 . 2 1 1 A 90 90 PRO HA H 175 4.713 4.718 -0.005 1
1 961 . 2 1 1 A 90 90 PRO C C 175 176.956 176.681 0.275 1
1 962 . 2 1 1 A 90 90 PRO CA C 175 63.159 63.003 0.156 1
1 963 . 2 1 1 A 90 90 PRO CB C 175 32.428 32.540 -0.112 1
1 966 . 2 1 1 A 91 91 GLU H H 176 8.778 8.730 0.048 1
1 967 . 2 1 1 A 91 91 GLU HA H 176 3.910 4.497 -0.587 1
1 972 . 2 1 1 A 91 91 GLU C C 176 176.426 176.179 0.247 1
1 973 . 2 1 1 A 91 91 GLU CA C 176 56.738 55.827 0.911 1
1 974 . 2 1 1 A 91 91 GLU CB C 176 30.540 31.096 -0.556 1
1 976 . 2 1 1 A 91 91 GLU N N 176 124.561 121.665 2.896 1
1 977 . 2 1 1 A 92 92 LEU H H 177 8.630 8.488 0.142 1
1 978 . 2 1 1 A 92 92 LEU HA H 177 4.419 4.253 0.166 1
1 988 . 2 1 1 A 92 92 LEU C C 177 177.162 176.452 0.710 1
1 989 . 2 1 1 A 92 92 LEU CA C 177 55.350 55.404 -0.054 1
1 990 . 2 1 1 A 92 92 LEU CB C 177 42.390 41.581 0.809 1
1 994 . 2 1 1 A 92 92 LEU N N 177 126.683 126.594 0.089 1
1 995 . 2 1 1 A 93 93 THR H H 178 8.375 8.927 -0.552 1
1 996 . 2 1 1 A 93 93 THR HA H 178 4.359 4.518 -0.159 1
1 1001 . 2 1 1 A 93 93 THR C C 178 173.589 174.829 -1.240 1
1 1002 . 2 1 1 A 93 93 THR CA C 178 61.621 62.323 -0.702 1
1 1003 . 2 1 1 A 93 93 THR CB C 178 69.724 69.696 0.028 1
1 1005 . 2 1 1 A 93 93 THR N N 178 119.699 117.128 2.571 1
1 1 . 3 1 1 A 9 9 SER H H 94 8.475 8.051 0.424 1
1 2 . 3 1 1 A 9 9 SER CA C 94 58.531 56.785 1.746 1
1 3 . 3 1 1 A 9 9 SER N N 94 117.432 111.765 5.667 1
1 4 . 3 1 1 A 10 10 LYS H H 95 8.527 7.642 0.885 1
1 5 . 3 1 1 A 10 10 LYS C C 95 174.594 176.537 -1.943 1
1 6 . 3 1 1 A 10 10 LYS CA C 95 56.603 55.359 1.244 1
1 7 . 3 1 1 A 10 10 LYS N N 95 123.104 122.088 1.016 1
1 8 . 3 1 1 A 11 11 THR H H 96 8.245 7.881 0.364 1
1 9 . 3 1 1 A 11 11 THR C C 96 174.393 174.017 0.376 1
1 10 . 3 1 1 A 11 11 THR CA C 96 62.149 62.051 0.098 1
1 11 . 3 1 1 A 11 11 THR CB C 96 69.183 70.894 -1.711 1
1 13 . 3 1 1 A 11 11 THR N N 96 113.245 113.126 0.119 1
1 14 . 3 1 1 A 12 12 THR H H 97 7.769 7.888 -0.119 1
1 15 . 3 1 1 A 12 12 THR HA H 97 5.583 4.720 0.863 1
1 20 . 3 1 1 A 12 12 THR C C 97 174.726 172.248 2.478 1
1 21 . 3 1 1 A 12 12 THR CA C 97 59.602 60.895 -1.293 1
1 22 . 3 1 1 A 12 12 THR CB C 97 72.805 71.085 1.720 1
1 24 . 3 1 1 A 12 12 THR N N 97 113.440 112.311 1.129 1
1 25 . 3 1 1 A 13 13 SER H H 98 8.593 8.783 -0.190 1
1 26 . 3 1 1 A 13 13 SER HA H 98 4.448 5.136 -0.688 1
1 29 . 3 1 1 A 13 13 SER C C 98 171.426 173.143 -1.717 1
1 30 . 3 1 1 A 13 13 SER CA C 98 59.056 56.911 2.145 1
1 31 . 3 1 1 A 13 13 SER CB C 98 67.839 65.400 2.439 1
1 32 . 3 1 1 A 13 13 SER N N 98 119.042 121.292 -2.250 1
1 33 . 3 1 1 A 14 14 THR H H 99 8.155 8.082 0.073 1
1 34 . 3 1 1 A 14 14 THR HA H 99 5.383 5.165 0.218 1
1 39 . 3 1 1 A 14 14 THR C C 99 171.565 172.682 -1.117 1
1 40 . 3 1 1 A 14 14 THR CA C 99 61.291 60.005 1.286 1
1 41 . 3 1 1 A 14 14 THR CB C 99 71.654 72.249 -0.595 1
1 43 . 3 1 1 A 14 14 THR N N 99 118.204 112.035 6.169 1
1 44 . 3 1 1 A 15 15 TRP H H 100 9.637 9.158 0.479 1
1 45 . 3 1 1 A 15 15 TRP HA H 100 4.807 5.088 -0.281 1
1 54 . 3 1 1 A 15 15 TRP C C 100 174.399 175.544 -1.145 1
1 55 . 3 1 1 A 15 15 TRP CA C 100 58.302 56.247 2.055 1
1 56 . 3 1 1 A 15 15 TRP CB C 100 34.810 33.597 1.213 1
1 63 . 3 1 1 A 15 15 TRP N N 100 125.132 120.855 4.277 1
1 65 . 3 1 1 A 16 16 VAL H H 101 8.863 9.063 -0.200 1
1 66 . 3 1 1 A 16 16 VAL HA H 101 5.267 4.748 0.519 1
1 74 . 3 1 1 A 16 16 VAL C C 101 174.955 175.243 -0.288 1
1 75 . 3 1 1 A 16 16 VAL CA C 101 60.653 61.694 -1.041 1
1 76 . 3 1 1 A 16 16 VAL CB C 101 34.284 32.952 1.332 1
1 79 . 3 1 1 A 16 16 VAL N N 101 119.527 123.179 -3.652 1
1 80 . 3 1 1 A 17 17 LEU H H 102 8.961 8.958 0.003 1
1 81 . 3 1 1 A 17 17 LEU HA H 102 4.729 5.163 -0.434 1
1 91 . 3 1 1 A 17 17 LEU C C 102 173.559 175.136 -1.577 1
1 92 . 3 1 1 A 17 17 LEU CA C 102 55.144 53.153 1.991 1
1 93 . 3 1 1 A 17 17 LEU CB C 102 42.948 45.974 -3.026 1
1 97 . 3 1 1 A 17 17 LEU N N 102 124.280 123.927 0.353 1
1 98 . 3 1 1 A 18 18 ARG H H 103 8.305 8.521 -0.216 1
1 99 . 3 1 1 A 18 18 ARG HA H 103 5.139 4.668 0.471 1
1 106 . 3 1 1 A 18 18 ARG C C 103 175.347 175.393 -0.046 1
1 107 . 3 1 1 A 18 18 ARG CA C 103 54.793 55.889 -1.096 1
1 108 . 3 1 1 A 18 18 ARG CB C 103 31.347 29.770 1.577 1
1 111 . 3 1 1 A 18 18 ARG N N 103 122.020 122.845 -0.825 1
1 112 . 3 1 1 A 19 19 LEU H H 104 8.676 8.766 -0.090 1
1 113 . 3 1 1 A 19 19 LEU HA H 104 4.482 4.879 -0.397 1
1 123 . 3 1 1 A 19 19 LEU C C 104 175.957 175.853 0.104 1
1 124 . 3 1 1 A 19 19 LEU CA C 104 53.581 53.819 -0.238 1
1 125 . 3 1 1 A 19 19 LEU CB C 104 45.697 45.236 0.461 1
1 129 . 3 1 1 A 19 19 LEU N N 104 126.378 127.408 -1.030 1
1 130 . 3 1 1 A 20 20 ASP H H 105 9.390 9.565 -0.175 1
1 131 . 3 1 1 A 20 20 ASP HA H 105 4.287 4.349 -0.062 1
1 134 . 3 1 1 A 20 20 ASP C C 105 175.947 175.433 0.514 1
1 135 . 3 1 1 A 20 20 ASP CA C 105 55.263 55.132 0.131 1
1 136 . 3 1 1 A 20 20 ASP CB C 105 39.239 39.901 -0.662 1
1 137 . 3 1 1 A 20 20 ASP N N 105 125.208 125.915 -0.707 1
1 138 . 3 1 1 A 21 21 GLY H H 106 8.563 8.668 -0.105 1
1 139 . 3 1 1 A 21 21 GLY HA2 H 106 4.126 3.851 0.275 1
1 140 . 3 1 1 A 21 21 GLY HA3 H 106 3.509 3.854 -0.345 1
1 141 . 3 1 1 A 21 21 GLY C C 106 173.164 173.738 -0.574 1
1 142 . 3 1 1 A 21 21 GLY CA C 106 45.499 45.468 0.031 1
1 143 . 3 1 1 A 21 21 GLY N N 106 103.331 104.733 -1.402 1
1 144 . 3 1 1 A 22 22 GLU H H 107 7.713 8.017 -0.304 1
1 145 . 3 1 1 A 22 22 GLU HA H 107 4.634 4.954 -0.320 1
1 150 . 3 1 1 A 22 22 GLU C C 107 174.800 174.874 -0.074 1
1 151 . 3 1 1 A 22 22 GLU CA C 107 54.329 54.314 0.015 1
1 152 . 3 1 1 A 22 22 GLU CB C 107 32.832 34.082 -1.250 1
1 154 . 3 1 1 A 22 22 GLU N N 107 119.470 119.404 0.066 1
1 155 . 3 1 1 A 23 23 ASP H H 108 8.632 8.543 0.089 1
1 156 . 3 1 1 A 23 23 ASP HA H 108 4.872 4.753 0.119 1
1 159 . 3 1 1 A 23 23 ASP C C 108 175.533 175.721 -0.188 1
1 160 . 3 1 1 A 23 23 ASP CA C 108 55.180 53.840 1.340 1
1 161 . 3 1 1 A 23 23 ASP CB C 108 41.504 39.367 2.137 1
1 162 . 3 1 1 A 23 23 ASP N N 108 122.815 121.167 1.648 1
1 163 . 3 1 1 A 24 24 LEU H H 109 9.248 8.853 0.395 1
1 164 . 3 1 1 A 24 24 LEU HA H 109 4.836 4.528 0.308 1
1 174 . 3 1 1 A 24 24 LEU C C 109 174.322 175.745 -1.423 1
1 175 . 3 1 1 A 24 24 LEU CA C 109 54.473 55.463 -0.990 1
1 176 . 3 1 1 A 24 24 LEU CB C 109 44.718 42.634 2.084 1
1 180 . 3 1 1 A 24 24 LEU N N 109 125.550 126.603 -1.053 1
1 181 . 3 1 1 A 25 25 ARG H H 110 8.503 8.782 -0.279 1
1 182 . 3 1 1 A 25 25 ARG HA H 110 5.228 4.963 0.265 1
1 189 . 3 1 1 A 25 25 ARG C C 110 175.174 174.812 0.362 1
1 190 . 3 1 1 A 25 25 ARG CA C 110 54.745 54.808 -0.063 1
1 191 . 3 1 1 A 25 25 ARG CB C 110 31.701 32.078 -0.377 1
1 194 . 3 1 1 A 25 25 ARG N N 110 125.424 128.431 -3.007 1
1 195 . 3 1 1 A 26 26 VAL H H 111 9.692 9.282 0.410 1
1 196 . 3 1 1 A 26 26 VAL HA H 111 5.091 5.156 -0.065 1
1 204 . 3 1 1 A 26 26 VAL C C 111 174.446 175.548 -1.102 1
1 205 . 3 1 1 A 26 26 VAL CA C 111 61.055 61.486 -0.431 1
1 206 . 3 1 1 A 26 26 VAL CB C 111 33.780 33.934 -0.154 1
1 209 . 3 1 1 A 26 26 VAL N N 111 130.649 127.705 2.944 1
1 210 . 3 1 1 A 27 27 VAL H H 112 9.401 9.179 0.222 1
1 211 . 3 1 1 A 27 27 VAL HA H 112 5.188 4.804 0.384 1
1 219 . 3 1 1 A 27 27 VAL C C 112 174.214 174.222 -0.008 1
1 220 . 3 1 1 A 27 27 VAL CA C 112 60.722 60.838 -0.116 1
1 221 . 3 1 1 A 27 27 VAL CB C 112 36.082 35.499 0.583 1
1 224 . 3 1 1 A 27 27 VAL N N 112 127.416 127.124 0.292 1
1 225 . 3 1 1 A 28 28 LEU H H 113 9.265 9.180 0.085 1
1 226 . 3 1 1 A 28 28 LEU HA H 113 5.337 5.411 -0.074 1
1 236 . 3 1 1 A 28 28 LEU C C 113 175.915 175.059 0.856 1
1 237 . 3 1 1 A 28 28 LEU CA C 113 52.599 53.397 -0.798 1
1 238 . 3 1 1 A 28 28 LEU CB C 113 47.495 44.578 2.917 1
1 242 . 3 1 1 A 28 28 LEU N N 113 127.527 129.966 -2.439 1
1 243 . 3 1 1 A 29 29 GLU H H 114 8.968 8.499 0.469 1
1 244 . 3 1 1 A 29 29 GLU HA H 114 4.701 4.382 0.319 1
1 249 . 3 1 1 A 29 29 GLU C C 114 176.715 177.520 -0.805 1
1 250 . 3 1 1 A 29 29 GLU CA C 114 55.342 56.378 -1.036 1
1 251 . 3 1 1 A 29 29 GLU CB C 114 30.005 30.755 -0.750 1
1 253 . 3 1 1 A 29 29 GLU N N 114 127.374 127.286 0.088 1
1 254 . 3 1 1 A 30 30 LYS H H 115 8.243 8.683 -0.440 1
1 255 . 3 1 1 A 30 30 LYS HA H 115 3.711 4.181 -0.470 1
1 264 . 3 1 1 A 30 30 LYS C C 115 177.137 178.196 -1.059 1
1 265 . 3 1 1 A 30 30 LYS CA C 115 60.118 58.816 1.302 1
1 266 . 3 1 1 A 30 30 LYS CB C 115 32.656 32.107 0.549 1
1 270 . 3 1 1 A 30 30 LYS N N 115 124.225 126.181 -1.956 1
1 271 . 3 1 1 A 31 31 ASP H H 116 9.200 8.128 1.072 1
1 272 . 3 1 1 A 31 31 ASP HA H 116 4.444 4.440 0.004 1
1 275 . 3 1 1 A 31 31 ASP C C 116 177.774 177.368 0.406 1
1 276 . 3 1 1 A 31 31 ASP CA C 116 56.703 57.350 -0.647 1
1 277 . 3 1 1 A 31 31 ASP CB C 116 40.236 40.558 -0.322 1
1 278 . 3 1 1 A 31 31 ASP N N 116 115.955 119.521 -3.566 1
1 279 . 3 1 1 A 32 32 THR H H 117 7.352 7.581 -0.229 1
1 280 . 3 1 1 A 32 32 THR HA H 117 4.266 4.576 -0.310 1
1 285 . 3 1 1 A 32 32 THR C C 117 175.320 173.991 1.329 1
1 286 . 3 1 1 A 32 32 THR CA C 117 61.171 61.427 -0.256 1
1 287 . 3 1 1 A 32 32 THR CB C 117 70.221 69.583 0.638 1
1 289 . 3 1 1 A 32 32 THR N N 117 106.440 109.012 -2.572 1
1 290 . 3 1 1 A 33 33 MET H H 118 8.216 7.915 0.301 1
1 291 . 3 1 1 A 33 33 MET HA H 118 4.184 4.330 -0.146 1
1 299 . 3 1 1 A 33 33 MET C C 118 174.952 174.485 0.467 1
1 300 . 3 1 1 A 33 33 MET CA C 118 55.195 56.556 -1.361 1
1 301 . 3 1 1 A 33 33 MET CB C 118 25.900 31.776 -5.876 1
1 304 . 3 1 1 A 33 33 MET N N 118 115.956 120.401 -4.445 1
1 305 . 3 1 1 A 34 34 ASP H H 119 7.509 8.082 -0.573 1
1 306 . 3 1 1 A 34 34 ASP HA H 119 4.486 4.890 -0.404 1
1 309 . 3 1 1 A 34 34 ASP C C 119 174.375 175.582 -1.207 1
1 310 . 3 1 1 A 34 34 ASP CA C 119 54.745 53.945 0.800 1
1 311 . 3 1 1 A 34 34 ASP CB C 119 42.865 42.233 0.632 1
1 312 . 3 1 1 A 34 34 ASP N N 119 118.500 118.754 -0.254 1
1 313 . 3 1 1 A 35 35 VAL H H 120 8.473 8.363 0.110 1
1 314 . 3 1 1 A 35 35 VAL HA H 120 4.709 4.698 0.011 1
1 322 . 3 1 1 A 35 35 VAL C C 120 173.900 174.253 -0.353 1
1 323 . 3 1 1 A 35 35 VAL CA C 120 60.736 61.068 -0.332 1
1 324 . 3 1 1 A 35 35 VAL CB C 120 34.662 32.860 1.802 1
1 327 . 3 1 1 A 35 35 VAL N N 120 121.116 121.088 0.028 1
1 328 . 3 1 1 A 36 36 TRP H H 121 9.404 9.413 -0.009 1
1 329 . 3 1 1 A 36 36 TRP HA H 121 5.174 5.728 -0.554 1
1 338 . 3 1 1 A 36 36 TRP C C 121 176.480 174.552 1.928 1
1 339 . 3 1 1 A 36 36 TRP CA C 121 55.070 55.096 -0.026 1
1 340 . 3 1 1 A 36 36 TRP CB C 121 32.179 32.784 -0.605 1
1 348 . 3 1 1 A 36 36 TRP N N 121 126.924 129.228 -2.304 1
1 350 . 3 1 1 A 37 37 CYS H H 122 9.230 8.359 0.871 1
1 351 . 3 1 1 A 37 37 CYS HA H 122 5.417 5.117 0.300 1
1 354 . 3 1 1 A 37 37 CYS C C 122 175.346 173.639 1.707 1
1 355 . 3 1 1 A 37 37 CYS CA C 122 57.083 57.571 -0.488 1
1 356 . 3 1 1 A 37 37 CYS CB C 122 28.713 30.241 -1.528 1
1 357 . 3 1 1 A 37 37 CYS N N 122 120.375 127.645 -7.270 1
1 358 . 3 1 1 A 38 38 ASN H H 123 9.817 8.907 0.910 1
1 359 . 3 1 1 A 38 38 ASN HA H 123 4.637 4.453 0.184 1
1 364 . 3 1 1 A 38 38 ASN C C 123 175.526 175.431 0.095 1
1 365 . 3 1 1 A 38 38 ASN CA C 123 54.023 54.542 -0.519 1
1 366 . 3 1 1 A 38 38 ASN CB C 123 36.581 37.262 -0.681 1
1 367 . 3 1 1 A 38 38 ASN N N 123 129.408 126.197 3.211 1
1 369 . 3 1 1 A 39 39 GLY H H 124 9.092 8.764 0.328 1
1 370 . 3 1 1 A 39 39 GLY HA2 H 124 4.241 4.038 0.203 1
1 371 . 3 1 1 A 39 39 GLY HA3 H 124 3.705 4.327 -0.622 1
1 372 . 3 1 1 A 39 39 GLY C C 124 173.405 173.624 -0.219 1
1 373 . 3 1 1 A 39 39 GLY CA C 124 45.595 46.767 -1.172 1
1 374 . 3 1 1 A 39 39 GLY N N 124 102.752 103.736 -0.984 1
1 375 . 3 1 1 A 40 40 GLN H H 125 8.006 6.998 1.008 1
1 376 . 3 1 1 A 40 40 GLN HA H 125 4.736 4.441 0.295 1
1 383 . 3 1 1 A 40 40 GLN C C 125 174.477 172.659 1.818 1
1 384 . 3 1 1 A 40 40 GLN CA C 125 53.747 52.998 0.749 1
1 385 . 3 1 1 A 40 40 GLN CB C 125 30.413 32.712 -2.299 1
1 387 . 3 1 1 A 40 40 GLN N N 125 120.627 118.185 2.442 1
1 389 . 3 1 1 A 41 41 LYS H H 126 8.757 7.898 0.859 1
1 390 . 3 1 1 A 41 41 LYS HA H 126 3.464 3.750 -0.286 1
1 399 . 3 1 1 A 41 41 LYS C C 126 176.870 175.095 1.775 1
1 400 . 3 1 1 A 41 41 LYS CA C 126 57.136 55.319 1.817 1
1 401 . 3 1 1 A 41 41 LYS CB C 126 31.669 33.306 -1.637 1
1 405 . 3 1 1 A 41 41 LYS N N 126 129.107 121.252 7.855 1
1 406 . 3 1 1 A 42 42 MET H H 127 8.682 8.317 0.365 1
1 407 . 3 1 1 A 42 42 MET HA H 127 4.712 5.146 -0.434 1
1 415 . 3 1 1 A 42 42 MET C C 127 176.816 174.368 2.448 1
1 416 . 3 1 1 A 42 42 MET CA C 127 52.958 53.600 -0.642 1
1 417 . 3 1 1 A 42 42 MET CB C 127 33.023 36.957 -3.934 1
1 420 . 3 1 1 A 42 42 MET N N 127 126.569 124.309 2.260 1
1 421 . 3 1 1 A 43 43 GLU H H 128 8.734 8.792 -0.058 1
1 422 . 3 1 1 A 43 43 GLU HA H 128 4.419 5.069 -0.650 1
1 427 . 3 1 1 A 43 43 GLU C C 128 176.531 176.768 -0.237 1
1 428 . 3 1 1 A 43 43 GLU CA C 128 56.475 55.013 1.462 1
1 429 . 3 1 1 A 43 43 GLU CB C 128 29.604 31.564 -1.960 1
1 431 . 3 1 1 A 43 43 GLU N N 128 123.734 120.125 3.609 1
1 432 . 3 1 1 A 44 44 THR H H 129 8.263 8.891 -0.628 1
1 433 . 3 1 1 A 44 44 THR HA H 129 5.385 5.339 0.046 1
1 438 . 3 1 1 A 44 44 THR C C 129 174.205 174.402 -0.197 1
1 439 . 3 1 1 A 44 44 THR CA C 129 59.160 60.431 -1.271 1
1 440 . 3 1 1 A 44 44 THR CB C 129 72.419 71.176 1.243 1
1 442 . 3 1 1 A 44 44 THR N N 129 115.081 117.867 -2.786 1
1 443 . 3 1 1 A 45 45 ALA H H 130 8.727 8.325 0.402 1
1 444 . 3 1 1 A 45 45 ALA HA H 130 4.749 4.571 0.178 1
1 448 . 3 1 1 A 45 45 ALA C C 130 177.017 178.458 -1.441 1
1 449 . 3 1 1 A 45 45 ALA CA C 130 51.645 52.364 -0.719 1
1 450 . 3 1 1 A 45 45 ALA CB C 130 21.364 20.948 0.416 1
1 451 . 3 1 1 A 45 45 ALA N N 130 123.243 122.930 0.313 1
1 452 . 3 1 1 A 46 46 GLY H H 131 8.818 8.201 0.617 1
1 453 . 3 1 1 A 46 46 GLY HA2 H 131 4.941 3.999 0.942 1
1 454 . 3 1 1 A 46 46 GLY HA3 H 131 3.690 4.005 -0.315 1
1 455 . 3 1 1 A 46 46 GLY C C 131 173.528 174.852 -1.324 1
1 456 . 3 1 1 A 46 46 GLY CA C 131 45.060 46.767 -1.707 1
1 457 . 3 1 1 A 46 46 GLY N N 131 112.392 107.832 4.560 1
1 458 . 3 1 1 A 47 47 GLU H H 132 8.746 7.733 1.013 1
1 459 . 3 1 1 A 47 47 GLU HA H 132 4.584 4.334 0.250 1
1 464 . 3 1 1 A 47 47 GLU C C 132 175.223 175.908 -0.685 1
1 465 . 3 1 1 A 47 47 GLU CA C 132 55.008 56.488 -1.480 1
1 466 . 3 1 1 A 47 47 GLU CB C 132 32.939 30.888 2.051 1
1 468 . 3 1 1 A 47 47 GLU N N 132 122.107 121.619 0.488 1
1 469 . 3 1 1 A 48 48 PHE H H 133 8.920 8.382 0.538 1
1 470 . 3 1 1 A 48 48 PHE HA H 133 4.822 5.745 -0.923 1
1 475 . 3 1 1 A 48 48 PHE C C 133 175.499 174.809 0.690 1
1 476 . 3 1 1 A 48 48 PHE CA C 133 58.320 55.435 2.885 1
1 477 . 3 1 1 A 48 48 PHE CB C 133 39.175 41.440 -2.265 1
1 479 . 3 1 1 A 48 48 PHE N N 133 124.006 121.629 2.377 1
1 480 . 3 1 1 A 49 49 VAL H H 134 8.161 8.715 -0.554 1
1 481 . 3 1 1 A 49 49 VAL HA H 134 4.492 4.730 -0.238 1
1 489 . 3 1 1 A 49 49 VAL C C 134 176.241 176.946 -0.705 1
1 490 . 3 1 1 A 49 49 VAL CA C 134 60.328 59.778 0.550 1
1 491 . 3 1 1 A 49 49 VAL CB C 134 34.542 34.706 -0.164 1
1 494 . 3 1 1 A 49 49 VAL N N 134 120.063 119.928 0.135 1
1 495 . 3 1 1 A 50 50 ASP H H 135 8.596 8.577 0.019 1
1 496 . 3 1 1 A 50 50 ASP HA H 135 4.278 4.421 -0.143 1
1 499 . 3 1 1 A 50 50 ASP C C 135 176.567 176.095 0.472 1
1 500 . 3 1 1 A 50 50 ASP CA C 135 57.149 57.112 0.037 1
1 501 . 3 1 1 A 50 50 ASP CB C 135 40.477 40.753 -0.276 1
1 502 . 3 1 1 A 50 50 ASP N N 135 122.137 121.576 0.561 1
1 503 . 3 1 1 A 51 51 ASP H H 136 8.328 7.818 0.510 1
1 504 . 3 1 1 A 51 51 ASP HA H 136 4.656 5.080 -0.424 1
1 507 . 3 1 1 A 51 51 ASP C C 136 175.798 174.748 1.050 1
1 508 . 3 1 1 A 51 51 ASP CA C 136 53.458 53.455 0.003 1
1 509 . 3 1 1 A 51 51 ASP CB C 136 40.306 42.514 -2.208 1
1 510 . 3 1 1 A 51 51 ASP N N 136 116.158 115.627 0.531 1
1 511 . 3 1 1 A 52 52 GLY H H 137 7.653 8.399 -0.746 1
1 512 . 3 1 1 A 52 52 GLY HA2 H 137 4.685 4.108 0.577 1
1 513 . 3 1 1 A 52 52 GLY HA3 H 137 4.069 4.112 -0.043 1
1 514 . 3 1 1 A 52 52 GLY C C 137 173.149 172.578 0.571 1
1 515 . 3 1 1 A 52 52 GLY CA C 137 45.860 44.318 1.542 1
1 516 . 3 1 1 A 52 52 GLY N N 137 107.634 109.433 -1.799 1
1 517 . 3 1 1 A 53 53 THR H H 138 8.445 7.873 0.572 1
1 518 . 3 1 1 A 53 53 THR HA H 138 4.996 5.162 -0.166 1
1 523 . 3 1 1 A 53 53 THR C C 138 174.163 173.222 0.941 1
1 524 . 3 1 1 A 53 53 THR CA C 138 60.974 61.637 -0.663 1
1 525 . 3 1 1 A 53 53 THR CB C 138 72.266 72.019 0.247 1
1 527 . 3 1 1 A 53 53 THR N N 138 114.976 115.162 -0.186 1
1 528 . 3 1 1 A 54 54 GLU H H 139 8.917 8.938 -0.021 1
1 529 . 3 1 1 A 54 54 GLU HA H 139 5.205 4.766 0.439 1
1 534 . 3 1 1 A 54 54 GLU C C 139 175.700 174.996 0.704 1
1 535 . 3 1 1 A 54 54 GLU CA C 139 54.731 55.353 -0.622 1
1 536 . 3 1 1 A 54 54 GLU CB C 139 33.250 30.300 2.950 1
1 538 . 3 1 1 A 54 54 GLU N N 139 121.295 126.043 -4.748 1
1 539 . 3 1 1 A 55 55 THR H H 140 9.190 8.579 0.611 1
1 540 . 3 1 1 A 55 55 THR HA H 140 4.744 4.668 0.076 1
1 545 . 3 1 1 A 55 55 THR C C 140 174.537 173.587 0.950 1
1 546 . 3 1 1 A 55 55 THR CA C 140 62.678 61.943 0.735 1
1 547 . 3 1 1 A 55 55 THR CB C 140 69.744 68.879 0.865 1
1 549 . 3 1 1 A 55 55 THR N N 140 122.419 121.332 1.087 1
1 550 . 3 1 1 A 56 56 HIS H H 141 9.395 9.006 0.389 1
1 551 . 3 1 1 A 56 56 HIS HA H 141 5.204 5.042 0.162 1
1 556 . 3 1 1 A 56 56 HIS C C 141 174.675 174.590 0.085 1
1 557 . 3 1 1 A 56 56 HIS CA C 141 55.557 53.949 1.608 1
1 558 . 3 1 1 A 56 56 HIS CB C 141 31.279 30.402 0.877 1
1 561 . 3 1 1 A 56 56 HIS N N 141 125.732 125.589 0.143 1
1 564 . 3 1 1 A 57 57 PHE H H 142 8.790 7.939 0.851 1
1 565 . 3 1 1 A 57 57 PHE HA H 142 4.918 6.046 -1.128 1
1 571 . 3 1 1 A 57 57 PHE C C 142 172.293 174.041 -1.748 1
1 572 . 3 1 1 A 57 57 PHE CA C 142 56.366 55.162 1.204 1
1 573 . 3 1 1 A 57 57 PHE CB C 142 39.962 42.655 -2.693 1
1 575 . 3 1 1 A 57 57 PHE N N 142 117.009 121.553 -4.544 1
1 576 . 3 1 1 A 58 58 SER H H 143 8.890 8.931 -0.041 1
1 577 . 3 1 1 A 58 58 SER HA H 143 5.286 4.767 0.519 1
1 580 . 3 1 1 A 58 58 SER C C 143 173.716 174.708 -0.992 1
1 581 . 3 1 1 A 58 58 SER CA C 143 57.517 57.810 -0.293 1
1 582 . 3 1 1 A 58 58 SER CB C 143 65.448 63.989 1.459 1
1 583 . 3 1 1 A 58 58 SER N N 143 115.269 116.165 -0.896 1
1 584 . 3 1 1 A 59 59 VAL H H 144 7.737 8.920 -1.183 1
1 585 . 3 1 1 A 59 59 VAL HA H 144 4.220 4.444 -0.224 1
1 593 . 3 1 1 A 59 59 VAL C C 144 176.234 176.112 0.122 1
1 594 . 3 1 1 A 59 59 VAL CA C 144 61.741 60.847 0.894 1
1 595 . 3 1 1 A 59 59 VAL CB C 144 33.711 33.627 0.084 1
1 598 . 3 1 1 A 59 59 VAL N N 144 123.186 124.125 -0.939 1
1 599 . 3 1 1 A 60 60 GLY H H 145 8.945 9.018 -0.073 1
1 600 . 3 1 1 A 60 60 GLY HA2 H 145 4.027 3.728 0.299 1
1 601 . 3 1 1 A 60 60 GLY HA3 H 145 3.692 3.776 -0.084 1
1 602 . 3 1 1 A 60 60 GLY C C 145 175.182 174.593 0.589 1
1 603 . 3 1 1 A 60 60 GLY CA C 145 47.141 47.270 -0.129 1
1 604 . 3 1 1 A 60 60 GLY N N 145 116.908 117.742 -0.834 1
1 605 . 3 1 1 A 61 61 ASN H H 146 8.929 8.446 0.483 1
1 606 . 3 1 1 A 61 61 ASN HA H 146 4.718 4.818 -0.100 1
1 611 . 3 1 1 A 61 61 ASN C C 146 174.706 174.300 0.406 1
1 612 . 3 1 1 A 61 61 ASN CA C 146 52.802 52.292 0.510 1
1 613 . 3 1 1 A 61 61 ASN CB C 146 37.917 38.365 -0.448 1
1 614 . 3 1 1 A 61 61 ASN N N 146 123.976 124.648 -0.672 1
1 616 . 3 1 1 A 62 62 HIS H H 147 8.400 7.709 0.691 1
1 617 . 3 1 1 A 62 62 HIS HA H 147 4.762 4.994 -0.232 1
1 622 . 3 1 1 A 62 62 HIS C C 147 173.871 173.926 -0.055 1
1 623 . 3 1 1 A 62 62 HIS CA C 147 55.374 54.696 0.678 1
1 624 . 3 1 1 A 62 62 HIS CB C 147 28.655 34.223 -5.568 1
1 628 . 3 1 1 A 62 62 HIS N N 147 118.620 118.442 0.178 1
1 631 . 3 1 1 A 63 63 ASP H H 148 8.734 9.128 -0.394 1
1 632 . 3 1 1 A 63 63 ASP HA H 148 4.785 5.141 -0.356 1
1 635 . 3 1 1 A 63 63 ASP C C 148 175.269 175.153 0.116 1
1 636 . 3 1 1 A 63 63 ASP CA C 148 54.390 53.191 1.199 1
1 637 . 3 1 1 A 63 63 ASP CB C 148 42.105 42.226 -0.121 1
1 638 . 3 1 1 A 63 63 ASP N N 148 125.336 118.298 7.038 1
1 639 . 3 1 1 A 64 64 CYS H H 149 8.225 8.645 -0.420 1
1 640 . 3 1 1 A 64 64 CYS HA H 149 5.118 5.137 -0.019 1
1 643 . 3 1 1 A 64 64 CYS C C 149 173.740 173.208 0.532 1
1 644 . 3 1 1 A 64 64 CYS CA C 149 55.423 58.333 -2.910 1
1 645 . 3 1 1 A 64 64 CYS CB C 149 29.972 29.841 0.131 1
1 646 . 3 1 1 A 64 64 CYS N N 149 124.476 123.665 0.811 1
1 647 . 3 1 1 A 65 65 TYR H H 150 8.916 8.350 0.566 1
1 648 . 3 1 1 A 65 65 TYR HA H 150 5.121 4.237 0.884 1
1 655 . 3 1 1 A 65 65 TYR C C 150 172.821 172.061 0.760 1
1 656 . 3 1 1 A 65 65 TYR CA C 150 56.347 55.768 0.579 1
1 657 . 3 1 1 A 65 65 TYR CB C 150 38.901 40.800 -1.899 1
1 662 . 3 1 1 A 65 65 TYR N N 150 115.313 118.284 -2.971 1
1 663 . 3 1 1 A 66 66 ILE H H 151 8.423 8.878 -0.455 1
1 664 . 3 1 1 A 66 66 ILE HA H 151 5.000 4.413 0.587 1
1 674 . 3 1 1 A 66 66 ILE C C 151 176.225 174.577 1.648 1
1 675 . 3 1 1 A 66 66 ILE CA C 151 57.798 60.054 -2.256 1
1 676 . 3 1 1 A 66 66 ILE CB C 151 39.863 38.659 1.204 1
1 680 . 3 1 1 A 66 66 ILE N N 151 118.575 121.643 -3.068 1
1 681 . 3 1 1 A 67 67 LYS H H 152 9.480 8.837 0.643 1
1 682 . 3 1 1 A 67 67 LYS HA H 152 5.091 4.695 0.396 1
1 691 . 3 1 1 A 67 67 LYS C C 152 174.079 174.894 -0.815 1
1 692 . 3 1 1 A 67 67 LYS CA C 152 54.728 56.090 -1.362 1
1 693 . 3 1 1 A 67 67 LYS CB C 152 35.256 33.089 2.167 1
1 697 . 3 1 1 A 67 67 LYS N N 152 132.311 128.548 3.763 1
1 698 . 3 1 1 A 68 68 ALA H H 153 8.844 8.648 0.196 1
1 699 . 3 1 1 A 68 68 ALA HA H 153 5.039 5.407 -0.368 1
1 703 . 3 1 1 A 68 68 ALA C C 153 176.587 176.480 0.107 1
1 704 . 3 1 1 A 68 68 ALA CA C 153 50.484 50.938 -0.454 1
1 705 . 3 1 1 A 68 68 ALA CB C 153 20.570 21.335 -0.765 1
1 706 . 3 1 1 A 68 68 ALA N N 153 129.958 130.298 -0.340 1
1 707 . 3 1 1 A 69 69 VAL H H 154 8.461 8.669 -0.208 1
1 708 . 3 1 1 A 69 69 VAL HA H 154 4.558 4.635 -0.077 1
1 716 . 3 1 1 A 69 69 VAL C C 154 175.331 174.970 0.361 1
1 717 . 3 1 1 A 69 69 VAL CA C 154 60.758 60.758 0.000 1
1 718 . 3 1 1 A 69 69 VAL CB C 154 34.743 35.049 -0.306 1
1 721 . 3 1 1 A 69 69 VAL N N 154 121.496 122.275 -0.779 1
1 722 . 3 1 1 A 70 70 SER H H 155 8.695 8.994 -0.299 1
1 723 . 3 1 1 A 70 70 SER HA H 155 4.646 5.245 -0.599 1
1 726 . 3 1 1 A 70 70 SER C C 155 174.690 173.901 0.789 1
1 727 . 3 1 1 A 70 70 SER CA C 155 58.065 57.020 1.045 1
1 728 . 3 1 1 A 70 70 SER CB C 155 64.062 64.505 -0.443 1
1 729 . 3 1 1 A 70 70 SER N N 155 119.763 121.580 -1.817 1
1 730 . 3 1 1 A 71 71 SER H H 156 8.360 8.912 -0.552 1
1 731 . 3 1 1 A 71 71 SER HA H 156 4.430 5.265 -0.835 1
1 734 . 3 1 1 A 71 71 SER CA C 156 58.491 57.332 1.159 1
1 735 . 3 1 1 A 71 71 SER CB C 156 64.061 66.766 -2.705 1
1 736 . 3 1 1 A 71 71 SER N N 156 118.577 119.032 -0.455 1
1 737 . 3 1 1 A 72 72 GLY H H 157 8.542 8.348 0.194 1
1 738 . 3 1 1 A 72 72 GLY HA2 H 157 4.002 4.157 -0.155 1
1 739 . 3 1 1 A 72 72 GLY HA3 H 157 4.002 4.158 -0.156 1
1 740 . 3 1 1 A 72 72 GLY CA C 157 45.565 43.745 1.820 1
1 741 . 3 1 1 A 72 72 GLY N N 157 111.540 110.969 0.571 1
1 742 . 3 1 1 A 73 73 LYS H H 158 8.369 8.270 0.099 1
1 743 . 3 1 1 A 73 73 LYS CA C 158 56.720 55.986 0.734 1
1 744 . 3 1 1 A 73 73 LYS CB C 158 32.915 33.239 -0.324 1
1 747 . 3 1 1 A 73 73 LYS N N 158 120.293 120.911 -0.618 1
1 748 . 3 1 1 A 74 74 ARG H H 159 8.181 9.490 -1.309 1
1 749 . 3 1 1 A 74 74 ARG CA C 159 56.148 57.436 -1.288 1
1 751 . 3 1 1 A 74 74 ARG N N 159 119.343 126.263 -6.920 1
1 752 . 3 1 1 A 75 75 LYS H H 160 8.443 8.344 0.099 1
1 753 . 3 1 1 A 75 75 LYS HA H 160 4.067 3.903 0.164 1
1 762 . 3 1 1 A 75 75 LYS C C 160 176.868 176.485 0.383 1
1 763 . 3 1 1 A 75 75 LYS CA C 160 57.711 57.264 0.447 1
1 764 . 3 1 1 A 75 75 LYS CB C 160 31.777 29.752 2.025 1
1 768 . 3 1 1 A 75 75 LYS N N 160 120.467 110.289 10.178 1
1 769 . 3 1 1 A 76 76 GLU H H 161 8.693 7.974 0.719 1
1 770 . 3 1 1 A 76 76 GLU HA H 161 4.290 3.962 0.328 1
1 771 . 3 1 1 A 76 76 GLU C C 161 176.844 176.534 0.310 1
1 772 . 3 1 1 A 76 76 GLU CA C 161 57.294 59.663 -2.369 1
1 773 . 3 1 1 A 76 76 GLU CB C 161 29.794 30.148 -0.354 1
1 775 . 3 1 1 A 76 76 GLU N N 161 118.767 118.376 0.391 1
1 776 . 3 1 1 A 77 77 GLY H H 162 8.168 7.944 0.224 1
1 777 . 3 1 1 A 77 77 GLY HA2 H 162 4.010 4.125 -0.115 1
1 778 . 3 1 1 A 77 77 GLY HA3 H 162 3.963 4.125 -0.162 1
1 779 . 3 1 1 A 77 77 GLY C C 162 173.512 172.085 1.427 1
1 780 . 3 1 1 A 77 77 GLY CA C 162 45.362 44.621 0.741 1
1 781 . 3 1 1 A 77 77 GLY N N 162 108.621 107.284 1.337 1
1 782 . 3 1 1 A 78 78 ILE H H 163 7.954 8.957 -1.003 1
1 783 . 3 1 1 A 78 78 ILE HA H 163 4.323 4.921 -0.598 1
1 793 . 3 1 1 A 78 78 ILE C C 163 175.402 175.139 0.263 1
1 794 . 3 1 1 A 78 78 ILE CA C 163 60.632 59.601 1.031 1
1 795 . 3 1 1 A 78 78 ILE CB C 163 39.759 40.555 -0.796 1
1 799 . 3 1 1 A 78 78 ILE N N 163 121.604 125.675 -4.071 1
1 800 . 3 1 1 A 79 79 ILE H H 164 8.514 8.865 -0.351 1
1 801 . 3 1 1 A 79 79 ILE HA H 164 4.341 4.733 -0.392 1
1 811 . 3 1 1 A 79 79 ILE C C 164 175.172 174.614 0.558 1
1 812 . 3 1 1 A 79 79 ILE CA C 164 60.027 60.002 0.025 1
1 813 . 3 1 1 A 79 79 ILE CB C 164 40.153 41.130 -0.977 1
1 817 . 3 1 1 A 79 79 ILE N N 164 127.137 126.029 1.108 1
1 818 . 3 1 1 A 80 80 HIS H H 165 8.492 8.914 -0.422 1
1 819 . 3 1 1 A 80 80 HIS HA H 165 5.676 5.304 0.372 1
1 824 . 3 1 1 A 80 80 HIS C C 165 175.502 174.366 1.136 1
1 825 . 3 1 1 A 80 80 HIS CA C 165 57.043 55.152 1.891 1
1 826 . 3 1 1 A 80 80 HIS CB C 165 32.741 32.291 0.450 1
1 829 . 3 1 1 A 80 80 HIS N N 165 125.422 126.772 -1.350 1
1 830 . 3 1 1 A 81 81 THR H H 166 9.080 9.186 -0.106 1
1 831 . 3 1 1 A 81 81 THR HA H 166 4.999 4.803 0.196 1
1 836 . 3 1 1 A 81 81 THR C C 166 171.877 172.937 -1.060 1
1 837 . 3 1 1 A 81 81 THR CA C 166 59.924 61.004 -1.080 1
1 838 . 3 1 1 A 81 81 THR CB C 166 72.243 70.851 1.392 1
1 840 . 3 1 1 A 81 81 THR N N 166 117.682 114.402 3.280 1
1 841 . 3 1 1 A 82 82 LEU H H 167 8.062 7.991 0.071 1
1 842 . 3 1 1 A 82 82 LEU HA H 167 4.350 3.922 0.428 1
1 852 . 3 1 1 A 82 82 LEU C C 167 172.705 174.938 -2.233 1
1 853 . 3 1 1 A 82 82 LEU CA C 167 53.553 55.464 -1.911 1
1 854 . 3 1 1 A 82 82 LEU CB C 167 39.768 41.366 -1.598 1
1 858 . 3 1 1 A 82 82 LEU N N 167 125.369 127.643 -2.274 1
1 859 . 3 1 1 A 83 83 ILE H H 168 8.657 8.231 0.426 1
1 860 . 3 1 1 A 83 83 ILE HA H 168 4.476 4.881 -0.405 1
1 870 . 3 1 1 A 83 83 ILE C C 168 175.159 174.358 0.801 1
1 871 . 3 1 1 A 83 83 ILE CA C 168 58.529 59.825 -1.296 1
1 872 . 3 1 1 A 83 83 ILE CB C 168 37.410 41.052 -3.642 1
1 876 . 3 1 1 A 83 83 ILE N N 168 128.042 127.197 0.845 1
1 877 . 3 1 1 A 84 84 VAL H H 169 8.464 8.436 0.028 1
1 878 . 3 1 1 A 84 84 VAL HA H 169 4.284 4.375 -0.091 1
1 886 . 3 1 1 A 84 84 VAL C C 169 176.138 175.690 0.448 1
1 887 . 3 1 1 A 84 84 VAL CA C 169 61.029 61.184 -0.155 1
1 888 . 3 1 1 A 84 84 VAL CB C 169 34.714 34.086 0.628 1
1 891 . 3 1 1 A 84 84 VAL N N 169 124.644 126.750 -2.106 1
1 892 . 3 1 1 A 85 85 ASP H H 170 9.158 9.436 -0.278 1
1 893 . 3 1 1 A 85 85 ASP HA H 170 4.362 4.262 0.100 1
1 896 . 3 1 1 A 85 85 ASP C C 170 175.489 175.354 0.135 1
1 897 . 3 1 1 A 85 85 ASP CA C 170 55.868 55.197 0.671 1
1 898 . 3 1 1 A 85 85 ASP CB C 170 38.927 39.454 -0.527 1
1 899 . 3 1 1 A 85 85 ASP N N 170 129.061 127.859 1.202 1
1 900 . 3 1 1 A 86 86 ASN H H 171 8.811 8.440 0.371 1
1 901 . 3 1 1 A 86 86 ASN HA H 171 4.053 4.345 -0.292 1
1 906 . 3 1 1 A 86 86 ASN C C 171 173.802 173.873 -0.071 1
1 907 . 3 1 1 A 86 86 ASN CA C 171 55.173 54.306 0.867 1
1 908 . 3 1 1 A 86 86 ASN CB C 171 38.150 37.376 0.774 1
1 909 . 3 1 1 A 86 86 ASN N N 171 108.418 114.868 -6.450 1
1 911 . 3 1 1 A 87 87 ARG H H 172 7.914 7.503 0.411 1
1 912 . 3 1 1 A 87 87 ARG HA H 172 4.597 4.654 -0.057 1
1 919 . 3 1 1 A 87 87 ARG C C 172 174.025 174.776 -0.751 1
1 920 . 3 1 1 A 87 87 ARG CA C 172 54.846 54.267 0.579 1
1 921 . 3 1 1 A 87 87 ARG CB C 172 32.697 33.131 -0.434 1
1 924 . 3 1 1 A 87 87 ARG N N 172 120.988 117.653 3.335 1
1 925 . 3 1 1 A 88 88 GLU H H 173 8.534 8.769 -0.235 1
1 926 . 3 1 1 A 88 88 GLU HA H 173 4.560 4.343 0.217 1
1 931 . 3 1 1 A 88 88 GLU C C 173 176.187 175.464 0.723 1
1 932 . 3 1 1 A 88 88 GLU CA C 173 56.044 56.858 -0.814 1
1 933 . 3 1 1 A 88 88 GLU CB C 173 30.329 30.434 -0.105 1
1 935 . 3 1 1 A 88 88 GLU N N 173 123.982 125.048 -1.066 1
1 936 . 3 1 1 A 89 89 ILE H H 174 8.897 7.932 0.965 1
1 937 . 3 1 1 A 89 89 ILE HA H 174 4.666 4.539 0.127 1
1 947 . 3 1 1 A 89 89 ILE C C 174 174.110 174.171 -0.061 1
1 948 . 3 1 1 A 89 89 ILE CA C 174 55.255 57.345 -2.090 1
1 949 . 3 1 1 A 89 89 ILE CB C 174 37.851 41.613 -3.762 1
1 953 . 3 1 1 A 89 89 ILE N N 174 130.008 127.185 2.823 1
1 954 . 3 1 1 A 90 90 PRO HA H 175 4.713 4.750 -0.037 1
1 961 . 3 1 1 A 90 90 PRO C C 175 176.956 176.140 0.816 1
1 962 . 3 1 1 A 90 90 PRO CA C 175 63.159 62.916 0.243 1
1 963 . 3 1 1 A 90 90 PRO CB C 175 32.428 32.379 0.049 1
1 966 . 3 1 1 A 91 91 GLU H H 176 8.778 8.731 0.047 1
1 967 . 3 1 1 A 91 91 GLU HA H 176 3.910 4.753 -0.843 1
1 972 . 3 1 1 A 91 91 GLU C C 176 176.426 176.047 0.379 1
1 973 . 3 1 1 A 91 91 GLU CA C 176 56.738 55.622 1.116 1
1 974 . 3 1 1 A 91 91 GLU CB C 176 30.540 30.998 -0.458 1
1 976 . 3 1 1 A 91 91 GLU N N 176 124.561 122.211 2.350 1
1 977 . 3 1 1 A 92 92 LEU H H 177 8.630 8.736 -0.106 1
1 978 . 3 1 1 A 92 92 LEU HA H 177 4.419 4.420 -0.001 1
1 988 . 3 1 1 A 92 92 LEU C C 177 177.162 175.490 1.672 1
1 989 . 3 1 1 A 92 92 LEU CA C 177 55.350 56.333 -0.983 1
1 990 . 3 1 1 A 92 92 LEU CB C 177 42.390 41.882 0.508 1
1 994 . 3 1 1 A 92 92 LEU N N 177 126.683 129.410 -2.727 1
1 995 . 3 1 1 A 93 93 THR H H 178 8.375 8.521 -0.146 1
1 996 . 3 1 1 A 93 93 THR HA H 178 4.359 4.740 -0.381 1
1 1001 . 3 1 1 A 93 93 THR C C 178 173.589 171.925 1.664 1
1 1002 . 3 1 1 A 93 93 THR CA C 178 61.621 61.422 0.199 1
1 1003 . 3 1 1 A 93 93 THR CB C 178 69.724 71.451 -1.727 1
1 1005 . 3 1 1 A 93 93 THR N N 178 119.699 119.020 0.679 1
1 1 . 4 1 1 A 9 9 SER H H 94 8.475 7.757 0.718 1
1 2 . 4 1 1 A 9 9 SER CA C 94 58.531 57.475 1.056 1
1 3 . 4 1 1 A 9 9 SER N N 94 117.432 114.713 2.719 1
1 4 . 4 1 1 A 10 10 LYS H H 95 8.527 8.868 -0.341 1
1 5 . 4 1 1 A 10 10 LYS C C 95 174.594 176.228 -1.634 1
1 6 . 4 1 1 A 10 10 LYS CA C 95 56.603 57.958 -1.355 1
1 7 . 4 1 1 A 10 10 LYS N N 95 123.104 124.305 -1.201 1
1 8 . 4 1 1 A 11 11 THR H H 96 8.245 8.147 0.098 1
1 9 . 4 1 1 A 11 11 THR C C 96 174.393 173.271 1.122 1
1 10 . 4 1 1 A 11 11 THR CA C 96 62.149 63.026 -0.877 1
1 11 . 4 1 1 A 11 11 THR CB C 96 69.183 66.522 2.661 1
1 13 . 4 1 1 A 11 11 THR N N 96 113.245 113.643 -0.398 1
1 14 . 4 1 1 A 12 12 THR H H 97 7.769 7.335 0.434 1
1 15 . 4 1 1 A 12 12 THR HA H 97 5.583 4.880 0.703 1
1 20 . 4 1 1 A 12 12 THR C C 97 174.726 172.522 2.204 1
1 21 . 4 1 1 A 12 12 THR CA C 97 59.602 60.848 -1.246 1
1 22 . 4 1 1 A 12 12 THR CB C 97 72.805 71.193 1.612 1
1 24 . 4 1 1 A 12 12 THR N N 97 113.440 112.759 0.681 1
1 25 . 4 1 1 A 13 13 SER H H 98 8.593 8.556 0.037 1
1 26 . 4 1 1 A 13 13 SER HA H 98 4.448 5.289 -0.841 1
1 29 . 4 1 1 A 13 13 SER C C 98 171.426 172.466 -1.040 1
1 30 . 4 1 1 A 13 13 SER CA C 98 59.056 56.930 2.126 1
1 31 . 4 1 1 A 13 13 SER CB C 98 67.839 64.675 3.164 1
1 32 . 4 1 1 A 13 13 SER N N 98 119.042 121.363 -2.321 1
1 33 . 4 1 1 A 14 14 THR H H 99 8.155 8.393 -0.238 1
1 34 . 4 1 1 A 14 14 THR HA H 99 5.383 4.938 0.445 1
1 39 . 4 1 1 A 14 14 THR C C 99 171.565 173.004 -1.439 1
1 40 . 4 1 1 A 14 14 THR CA C 99 61.291 60.609 0.682 1
1 41 . 4 1 1 A 14 14 THR CB C 99 71.654 71.910 -0.256 1
1 43 . 4 1 1 A 14 14 THR N N 99 118.204 116.402 1.802 1
1 44 . 4 1 1 A 15 15 TRP H H 100 9.637 9.323 0.314 1
1 45 . 4 1 1 A 15 15 TRP HA H 100 4.807 5.240 -0.433 1
1 54 . 4 1 1 A 15 15 TRP C C 100 174.399 175.280 -0.881 1
1 55 . 4 1 1 A 15 15 TRP CA C 100 58.302 55.739 2.563 1
1 56 . 4 1 1 A 15 15 TRP CB C 100 34.810 32.249 2.561 1
1 63 . 4 1 1 A 15 15 TRP N N 100 125.132 125.717 -0.585 1
1 65 . 4 1 1 A 16 16 VAL H H 101 8.863 9.009 -0.146 1
1 66 . 4 1 1 A 16 16 VAL HA H 101 5.267 4.714 0.553 1
1 74 . 4 1 1 A 16 16 VAL C C 101 174.955 175.421 -0.466 1
1 75 . 4 1 1 A 16 16 VAL CA C 101 60.653 61.815 -1.162 1
1 76 . 4 1 1 A 16 16 VAL CB C 101 34.284 32.905 1.379 1
1 79 . 4 1 1 A 16 16 VAL N N 101 119.527 123.917 -4.390 1
1 80 . 4 1 1 A 17 17 LEU H H 102 8.961 8.938 0.023 1
1 81 . 4 1 1 A 17 17 LEU HA H 102 4.729 5.098 -0.369 1
1 91 . 4 1 1 A 17 17 LEU C C 102 173.559 175.013 -1.454 1
1 92 . 4 1 1 A 17 17 LEU CA C 102 55.144 53.117 2.027 1
1 93 . 4 1 1 A 17 17 LEU CB C 102 42.948 45.911 -2.963 1
1 97 . 4 1 1 A 17 17 LEU N N 102 124.280 123.862 0.418 1
1 98 . 4 1 1 A 18 18 ARG H H 103 8.305 8.379 -0.074 1
1 99 . 4 1 1 A 18 18 ARG HA H 103 5.139 4.708 0.431 1
1 106 . 4 1 1 A 18 18 ARG C C 103 175.347 175.255 0.092 1
1 107 . 4 1 1 A 18 18 ARG CA C 103 54.793 56.091 -1.298 1
1 108 . 4 1 1 A 18 18 ARG CB C 103 31.347 29.896 1.451 1
1 111 . 4 1 1 A 18 18 ARG N N 103 122.020 120.163 1.857 1
1 112 . 4 1 1 A 19 19 LEU H H 104 8.676 8.739 -0.063 1
1 113 . 4 1 1 A 19 19 LEU HA H 104 4.482 4.829 -0.347 1
1 123 . 4 1 1 A 19 19 LEU C C 104 175.957 175.828 0.129 1
1 124 . 4 1 1 A 19 19 LEU CA C 104 53.581 53.793 -0.212 1
1 125 . 4 1 1 A 19 19 LEU CB C 104 45.697 45.329 0.368 1
1 129 . 4 1 1 A 19 19 LEU N N 104 126.378 124.841 1.537 1
1 130 . 4 1 1 A 20 20 ASP H H 105 9.390 9.548 -0.158 1
1 131 . 4 1 1 A 20 20 ASP HA H 105 4.287 4.358 -0.071 1
1 134 . 4 1 1 A 20 20 ASP C C 105 175.947 175.406 0.541 1
1 135 . 4 1 1 A 20 20 ASP CA C 105 55.263 55.124 0.139 1
1 136 . 4 1 1 A 20 20 ASP CB C 105 39.239 39.723 -0.484 1
1 137 . 4 1 1 A 20 20 ASP N N 105 125.208 125.846 -0.638 1
1 138 . 4 1 1 A 21 21 GLY H H 106 8.563 8.661 -0.098 1
1 139 . 4 1 1 A 21 21 GLY HA2 H 106 4.126 3.846 0.280 1
1 140 . 4 1 1 A 21 21 GLY HA3 H 106 3.509 3.849 -0.340 1
1 141 . 4 1 1 A 21 21 GLY C C 106 173.164 173.726 -0.562 1
1 142 . 4 1 1 A 21 21 GLY CA C 106 45.499 45.505 -0.006 1
1 143 . 4 1 1 A 21 21 GLY N N 106 103.331 104.855 -1.524 1
1 144 . 4 1 1 A 22 22 GLU H H 107 7.713 8.007 -0.294 1
1 145 . 4 1 1 A 22 22 GLU HA H 107 4.634 4.938 -0.304 1
1 150 . 4 1 1 A 22 22 GLU C C 107 174.800 175.597 -0.797 1
1 151 . 4 1 1 A 22 22 GLU CA C 107 54.329 54.318 0.011 1
1 152 . 4 1 1 A 22 22 GLU CB C 107 32.832 34.112 -1.280 1
1 154 . 4 1 1 A 22 22 GLU N N 107 119.470 119.398 0.072 1
1 155 . 4 1 1 A 23 23 ASP H H 108 8.632 8.510 0.122 1
1 156 . 4 1 1 A 23 23 ASP HA H 108 4.872 4.744 0.128 1
1 159 . 4 1 1 A 23 23 ASP C C 108 175.533 175.217 0.316 1
1 160 . 4 1 1 A 23 23 ASP CA C 108 55.180 53.623 1.557 1
1 161 . 4 1 1 A 23 23 ASP CB C 108 41.504 39.728 1.776 1
1 162 . 4 1 1 A 23 23 ASP N N 108 122.815 122.011 0.804 1
1 163 . 4 1 1 A 24 24 LEU H H 109 9.248 8.844 0.404 1
1 164 . 4 1 1 A 24 24 LEU HA H 109 4.836 4.522 0.314 1
1 174 . 4 1 1 A 24 24 LEU C C 109 174.322 176.017 -1.695 1
1 175 . 4 1 1 A 24 24 LEU CA C 109 54.473 55.483 -1.010 1
1 176 . 4 1 1 A 24 24 LEU CB C 109 44.718 42.445 2.273 1
1 180 . 4 1 1 A 24 24 LEU N N 109 125.550 126.674 -1.124 1
1 181 . 4 1 1 A 25 25 ARG H H 110 8.503 8.815 -0.312 1
1 182 . 4 1 1 A 25 25 ARG HA H 110 5.228 4.843 0.385 1
1 189 . 4 1 1 A 25 25 ARG C C 110 175.174 174.547 0.627 1
1 190 . 4 1 1 A 25 25 ARG CA C 110 54.745 55.127 -0.382 1
1 191 . 4 1 1 A 25 25 ARG CB C 110 31.701 31.549 0.152 1
1 194 . 4 1 1 A 25 25 ARG N N 110 125.424 128.133 -2.709 1
1 195 . 4 1 1 A 26 26 VAL H H 111 9.692 9.061 0.631 1
1 196 . 4 1 1 A 26 26 VAL HA H 111 5.091 5.050 0.041 1
1 204 . 4 1 1 A 26 26 VAL C C 111 174.446 175.396 -0.950 1
1 205 . 4 1 1 A 26 26 VAL CA C 111 61.055 62.002 -0.947 1
1 206 . 4 1 1 A 26 26 VAL CB C 111 33.780 33.010 0.770 1
1 209 . 4 1 1 A 26 26 VAL N N 111 130.649 127.690 2.959 1
1 210 . 4 1 1 A 27 27 VAL H H 112 9.401 9.015 0.386 1
1 211 . 4 1 1 A 27 27 VAL HA H 112 5.188 4.714 0.474 1
1 219 . 4 1 1 A 27 27 VAL C C 112 174.214 174.206 0.008 1
1 220 . 4 1 1 A 27 27 VAL CA C 112 60.722 61.065 -0.343 1
1 221 . 4 1 1 A 27 27 VAL CB C 112 36.082 35.048 1.034 1
1 224 . 4 1 1 A 27 27 VAL N N 112 127.416 127.553 -0.137 1
1 225 . 4 1 1 A 28 28 LEU H H 113 9.265 9.167 0.098 1
1 226 . 4 1 1 A 28 28 LEU HA H 113 5.337 5.348 -0.011 1
1 236 . 4 1 1 A 28 28 LEU C C 113 175.915 174.818 1.097 1
1 237 . 4 1 1 A 28 28 LEU CA C 113 52.599 53.309 -0.710 1
1 238 . 4 1 1 A 28 28 LEU CB C 113 47.495 44.810 2.685 1
1 242 . 4 1 1 A 28 28 LEU N N 113 127.527 129.874 -2.347 1
1 243 . 4 1 1 A 29 29 GLU H H 114 8.968 8.631 0.337 1
1 244 . 4 1 1 A 29 29 GLU HA H 114 4.701 4.369 0.332 1
1 249 . 4 1 1 A 29 29 GLU C C 114 176.715 177.307 -0.592 1
1 250 . 4 1 1 A 29 29 GLU CA C 114 55.342 56.258 -0.916 1
1 251 . 4 1 1 A 29 29 GLU CB C 114 30.005 30.803 -0.798 1
1 253 . 4 1 1 A 29 29 GLU N N 114 127.374 127.354 0.020 1
1 254 . 4 1 1 A 30 30 LYS H H 115 8.243 8.604 -0.361 1
1 255 . 4 1 1 A 30 30 LYS HA H 115 3.711 4.156 -0.445 1
1 264 . 4 1 1 A 30 30 LYS C C 115 177.137 178.129 -0.992 1
1 265 . 4 1 1 A 30 30 LYS CA C 115 60.118 58.771 1.347 1
1 266 . 4 1 1 A 30 30 LYS CB C 115 32.656 32.087 0.569 1
1 270 . 4 1 1 A 30 30 LYS N N 115 124.225 125.492 -1.267 1
1 271 . 4 1 1 A 31 31 ASP H H 116 9.200 8.070 1.130 1
1 272 . 4 1 1 A 31 31 ASP HA H 116 4.444 4.449 -0.005 1
1 275 . 4 1 1 A 31 31 ASP C C 116 177.774 177.278 0.496 1
1 276 . 4 1 1 A 31 31 ASP CA C 116 56.703 57.296 -0.593 1
1 277 . 4 1 1 A 31 31 ASP CB C 116 40.236 40.669 -0.433 1
1 278 . 4 1 1 A 31 31 ASP N N 116 115.955 119.820 -3.865 1
1 279 . 4 1 1 A 32 32 THR H H 117 7.352 7.532 -0.180 1
1 280 . 4 1 1 A 32 32 THR HA H 117 4.266 4.559 -0.293 1
1 285 . 4 1 1 A 32 32 THR C C 117 175.320 173.956 1.364 1
1 286 . 4 1 1 A 32 32 THR CA C 117 61.171 61.384 -0.213 1
1 287 . 4 1 1 A 32 32 THR CB C 117 70.221 69.855 0.366 1
1 289 . 4 1 1 A 32 32 THR N N 117 106.440 108.516 -2.076 1
1 290 . 4 1 1 A 33 33 MET H H 118 8.216 7.900 0.316 1
1 291 . 4 1 1 A 33 33 MET HA H 118 4.184 4.383 -0.199 1
1 299 . 4 1 1 A 33 33 MET C C 118 174.952 174.694 0.258 1
1 300 . 4 1 1 A 33 33 MET CA C 118 55.195 56.754 -1.559 1
1 301 . 4 1 1 A 33 33 MET CB C 118 25.900 31.171 -5.271 1
1 304 . 4 1 1 A 33 33 MET N N 118 115.956 117.144 -1.188 1
1 305 . 4 1 1 A 34 34 ASP H H 119 7.509 8.038 -0.529 1
1 306 . 4 1 1 A 34 34 ASP HA H 119 4.486 4.733 -0.247 1
1 309 . 4 1 1 A 34 34 ASP C C 119 174.375 175.338 -0.963 1
1 310 . 4 1 1 A 34 34 ASP CA C 119 54.745 54.473 0.272 1
1 311 . 4 1 1 A 34 34 ASP CB C 119 42.865 42.119 0.746 1
1 312 . 4 1 1 A 34 34 ASP N N 119 118.500 118.978 -0.478 1
1 313 . 4 1 1 A 35 35 VAL H H 120 8.473 8.465 0.008 1
1 314 . 4 1 1 A 35 35 VAL HA H 120 4.709 4.742 -0.033 1
1 322 . 4 1 1 A 35 35 VAL C C 120 173.900 174.437 -0.537 1
1 323 . 4 1 1 A 35 35 VAL CA C 120 60.736 61.130 -0.394 1
1 324 . 4 1 1 A 35 35 VAL CB C 120 34.662 33.114 1.548 1
1 327 . 4 1 1 A 35 35 VAL N N 120 121.116 121.645 -0.529 1
1 328 . 4 1 1 A 36 36 TRP H H 121 9.404 9.169 0.235 1
1 329 . 4 1 1 A 36 36 TRP HA H 121 5.174 5.681 -0.507 1
1 338 . 4 1 1 A 36 36 TRP C C 121 176.480 174.559 1.921 1
1 339 . 4 1 1 A 36 36 TRP CA C 121 55.070 55.199 -0.129 1
1 340 . 4 1 1 A 36 36 TRP CB C 121 32.179 32.785 -0.606 1
1 348 . 4 1 1 A 36 36 TRP N N 121 126.924 129.030 -2.106 1
1 350 . 4 1 1 A 37 37 CYS H H 122 9.230 8.610 0.620 1
1 351 . 4 1 1 A 37 37 CYS HA H 122 5.417 5.267 0.150 1
1 354 . 4 1 1 A 37 37 CYS C C 122 175.346 174.395 0.951 1
1 355 . 4 1 1 A 37 37 CYS CA C 122 57.083 57.899 -0.816 1
1 356 . 4 1 1 A 37 37 CYS CB C 122 28.713 30.608 -1.895 1
1 357 . 4 1 1 A 37 37 CYS N N 122 120.375 124.131 -3.756 1
1 358 . 4 1 1 A 38 38 ASN H H 123 9.817 9.391 0.426 1
1 359 . 4 1 1 A 38 38 ASN HA H 123 4.637 4.467 0.170 1
1 364 . 4 1 1 A 38 38 ASN C C 123 175.526 175.451 0.075 1
1 365 . 4 1 1 A 38 38 ASN CA C 123 54.023 54.555 -0.532 1
1 366 . 4 1 1 A 38 38 ASN CB C 123 36.581 37.310 -0.729 1
1 367 . 4 1 1 A 38 38 ASN N N 123 129.408 124.593 4.815 1
1 369 . 4 1 1 A 39 39 GLY H H 124 9.092 8.790 0.302 1
1 370 . 4 1 1 A 39 39 GLY HA2 H 124 4.241 4.036 0.205 1
1 371 . 4 1 1 A 39 39 GLY HA3 H 124 3.705 4.326 -0.621 1
1 372 . 4 1 1 A 39 39 GLY C C 124 173.405 173.746 -0.341 1
1 373 . 4 1 1 A 39 39 GLY CA C 124 45.595 46.940 -1.345 1
1 374 . 4 1 1 A 39 39 GLY N N 124 102.752 103.842 -1.090 1
1 375 . 4 1 1 A 40 40 GLN H H 125 8.006 6.952 1.054 1
1 376 . 4 1 1 A 40 40 GLN HA H 125 4.736 4.433 0.303 1
1 383 . 4 1 1 A 40 40 GLN C C 125 174.477 173.058 1.419 1
1 384 . 4 1 1 A 40 40 GLN CA C 125 53.747 53.072 0.675 1
1 385 . 4 1 1 A 40 40 GLN CB C 125 30.413 32.754 -2.341 1
1 387 . 4 1 1 A 40 40 GLN N N 125 120.627 118.363 2.264 1
1 389 . 4 1 1 A 41 41 LYS H H 126 8.757 7.806 0.951 1
1 390 . 4 1 1 A 41 41 LYS HA H 126 3.464 3.577 -0.113 1
1 399 . 4 1 1 A 41 41 LYS C C 126 176.870 175.114 1.756 1
1 400 . 4 1 1 A 41 41 LYS CA C 126 57.136 55.382 1.754 1
1 401 . 4 1 1 A 41 41 LYS CB C 126 31.669 33.037 -1.368 1
1 405 . 4 1 1 A 41 41 LYS N N 126 129.107 121.663 7.444 1
1 406 . 4 1 1 A 42 42 MET H H 127 8.682 8.245 0.437 1
1 407 . 4 1 1 A 42 42 MET HA H 127 4.712 5.141 -0.429 1
1 415 . 4 1 1 A 42 42 MET C C 127 176.816 174.234 2.582 1
1 416 . 4 1 1 A 42 42 MET CA C 127 52.958 53.593 -0.635 1
1 417 . 4 1 1 A 42 42 MET CB C 127 33.023 36.976 -3.953 1
1 420 . 4 1 1 A 42 42 MET N N 127 126.569 124.359 2.210 1
1 421 . 4 1 1 A 43 43 GLU H H 128 8.734 8.760 -0.026 1
1 422 . 4 1 1 A 43 43 GLU HA H 128 4.419 5.117 -0.698 1
1 427 . 4 1 1 A 43 43 GLU C C 128 176.531 176.745 -0.214 1
1 428 . 4 1 1 A 43 43 GLU CA C 128 56.475 55.122 1.353 1
1 429 . 4 1 1 A 43 43 GLU CB C 128 29.604 31.496 -1.892 1
1 431 . 4 1 1 A 43 43 GLU N N 128 123.734 119.725 4.009 1
1 432 . 4 1 1 A 44 44 THR H H 129 8.263 8.929 -0.666 1
1 433 . 4 1 1 A 44 44 THR HA H 129 5.385 5.342 0.043 1
1 438 . 4 1 1 A 44 44 THR C C 129 174.205 174.280 -0.075 1
1 439 . 4 1 1 A 44 44 THR CA C 129 59.160 60.431 -1.271 1
1 440 . 4 1 1 A 44 44 THR CB C 129 72.419 71.191 1.228 1
1 442 . 4 1 1 A 44 44 THR N N 129 115.081 118.032 -2.951 1
1 443 . 4 1 1 A 45 45 ALA H H 130 8.727 8.286 0.441 1
1 444 . 4 1 1 A 45 45 ALA HA H 130 4.749 4.578 0.171 1
1 448 . 4 1 1 A 45 45 ALA C C 130 177.017 178.262 -1.245 1
1 449 . 4 1 1 A 45 45 ALA CA C 130 51.645 52.363 -0.718 1
1 450 . 4 1 1 A 45 45 ALA CB C 130 21.364 21.048 0.316 1
1 451 . 4 1 1 A 45 45 ALA N N 130 123.243 122.440 0.803 1
1 452 . 4 1 1 A 46 46 GLY H H 131 8.818 8.155 0.663 1
1 453 . 4 1 1 A 46 46 GLY HA2 H 131 4.941 3.963 0.978 1
1 454 . 4 1 1 A 46 46 GLY HA3 H 131 3.690 3.974 -0.284 1
1 455 . 4 1 1 A 46 46 GLY C C 131 173.528 174.729 -1.201 1
1 456 . 4 1 1 A 46 46 GLY CA C 131 45.060 46.959 -1.899 1
1 457 . 4 1 1 A 46 46 GLY N N 131 112.392 107.888 4.504 1
1 458 . 4 1 1 A 47 47 GLU H H 132 8.746 7.630 1.116 1
1 459 . 4 1 1 A 47 47 GLU HA H 132 4.584 4.485 0.099 1
1 464 . 4 1 1 A 47 47 GLU C C 132 175.223 175.452 -0.229 1
1 465 . 4 1 1 A 47 47 GLU CA C 132 55.008 55.877 -0.869 1
1 466 . 4 1 1 A 47 47 GLU CB C 132 32.939 29.815 3.124 1
1 468 . 4 1 1 A 47 47 GLU N N 132 122.107 120.415 1.692 1
1 469 . 4 1 1 A 48 48 PHE H H 133 8.920 9.145 -0.225 1
1 470 . 4 1 1 A 48 48 PHE HA H 133 4.822 4.785 0.037 1
1 475 . 4 1 1 A 48 48 PHE C C 133 175.499 175.174 0.325 1
1 476 . 4 1 1 A 48 48 PHE CA C 133 58.320 57.072 1.248 1
1 477 . 4 1 1 A 48 48 PHE CB C 133 39.175 39.418 -0.243 1
1 479 . 4 1 1 A 48 48 PHE N N 133 124.006 128.587 -4.581 1
1 480 . 4 1 1 A 49 49 VAL H H 134 8.161 7.970 0.191 1
1 481 . 4 1 1 A 49 49 VAL HA H 134 4.492 4.598 -0.106 1
1 489 . 4 1 1 A 49 49 VAL C C 134 176.241 176.791 -0.550 1
1 490 . 4 1 1 A 49 49 VAL CA C 134 60.328 59.762 0.566 1
1 491 . 4 1 1 A 49 49 VAL CB C 134 34.542 34.541 0.001 1
1 494 . 4 1 1 A 49 49 VAL N N 134 120.063 121.901 -1.838 1
1 495 . 4 1 1 A 50 50 ASP H H 135 8.596 8.463 0.133 1
1 496 . 4 1 1 A 50 50 ASP HA H 135 4.278 4.284 -0.006 1
1 499 . 4 1 1 A 50 50 ASP C C 135 176.567 176.414 0.153 1
1 500 . 4 1 1 A 50 50 ASP CA C 135 57.149 56.635 0.514 1
1 501 . 4 1 1 A 50 50 ASP CB C 135 40.477 41.049 -0.572 1
1 502 . 4 1 1 A 50 50 ASP N N 135 122.137 121.302 0.835 1
1 503 . 4 1 1 A 51 51 ASP H H 136 8.328 7.497 0.831 1
1 504 . 4 1 1 A 51 51 ASP HA H 136 4.656 4.957 -0.301 1
1 507 . 4 1 1 A 51 51 ASP C C 136 175.798 174.802 0.996 1
1 508 . 4 1 1 A 51 51 ASP CA C 136 53.458 53.207 0.251 1
1 509 . 4 1 1 A 51 51 ASP CB C 136 40.306 42.816 -2.510 1
1 510 . 4 1 1 A 51 51 ASP N N 136 116.158 115.747 0.411 1
1 511 . 4 1 1 A 52 52 GLY H H 137 7.653 8.151 -0.498 1
1 512 . 4 1 1 A 52 52 GLY HA2 H 137 4.685 4.019 0.666 1
1 513 . 4 1 1 A 52 52 GLY HA3 H 137 4.069 4.046 0.023 1
1 514 . 4 1 1 A 52 52 GLY C C 137 173.149 172.538 0.611 1
1 515 . 4 1 1 A 52 52 GLY CA C 137 45.860 43.933 1.927 1
1 516 . 4 1 1 A 52 52 GLY N N 137 107.634 111.761 -4.127 1
1 517 . 4 1 1 A 53 53 THR H H 138 8.445 7.780 0.665 1
1 518 . 4 1 1 A 53 53 THR HA H 138 4.996 5.024 -0.028 1
1 523 . 4 1 1 A 53 53 THR C C 138 174.163 173.224 0.939 1
1 524 . 4 1 1 A 53 53 THR CA C 138 60.974 61.614 -0.640 1
1 525 . 4 1 1 A 53 53 THR CB C 138 72.266 72.039 0.227 1
1 527 . 4 1 1 A 53 53 THR N N 138 114.976 114.467 0.509 1
1 528 . 4 1 1 A 54 54 GLU H H 139 8.917 8.689 0.228 1
1 529 . 4 1 1 A 54 54 GLU HA H 139 5.205 4.682 0.523 1
1 534 . 4 1 1 A 54 54 GLU C C 139 175.700 175.196 0.504 1
1 535 . 4 1 1 A 54 54 GLU CA C 139 54.731 55.331 -0.600 1
1 536 . 4 1 1 A 54 54 GLU CB C 139 33.250 29.985 3.265 1
1 538 . 4 1 1 A 54 54 GLU N N 139 121.295 126.036 -4.741 1
1 539 . 4 1 1 A 55 55 THR H H 140 9.190 8.551 0.639 1
1 540 . 4 1 1 A 55 55 THR HA H 140 4.744 4.574 0.170 1
1 545 . 4 1 1 A 55 55 THR C C 140 174.537 173.482 1.055 1
1 546 . 4 1 1 A 55 55 THR CA C 140 62.678 61.385 1.293 1
1 547 . 4 1 1 A 55 55 THR CB C 140 69.744 69.047 0.697 1
1 549 . 4 1 1 A 55 55 THR N N 140 122.419 120.049 2.370 1
1 550 . 4 1 1 A 56 56 HIS H H 141 9.395 8.999 0.396 1
1 551 . 4 1 1 A 56 56 HIS HA H 141 5.204 5.028 0.176 1
1 556 . 4 1 1 A 56 56 HIS C C 141 174.675 174.453 0.222 1
1 557 . 4 1 1 A 56 56 HIS CA C 141 55.557 53.970 1.587 1
1 558 . 4 1 1 A 56 56 HIS CB C 141 31.279 30.810 0.469 1
1 561 . 4 1 1 A 56 56 HIS N N 141 125.732 125.182 0.550 1
1 564 . 4 1 1 A 57 57 PHE H H 142 8.790 7.915 0.875 1
1 565 . 4 1 1 A 57 57 PHE HA H 142 4.918 6.018 -1.100 1
1 571 . 4 1 1 A 57 57 PHE C C 142 172.293 174.492 -2.199 1
1 572 . 4 1 1 A 57 57 PHE CA C 142 56.366 55.244 1.122 1
1 573 . 4 1 1 A 57 57 PHE CB C 142 39.962 42.503 -2.541 1
1 575 . 4 1 1 A 57 57 PHE N N 142 117.009 121.688 -4.679 1
1 576 . 4 1 1 A 58 58 SER H H 143 8.890 8.966 -0.076 1
1 577 . 4 1 1 A 58 58 SER HA H 143 5.286 4.930 0.356 1
1 580 . 4 1 1 A 58 58 SER C C 143 173.716 174.568 -0.852 1
1 581 . 4 1 1 A 58 58 SER CA C 143 57.517 57.682 -0.165 1
1 582 . 4 1 1 A 58 58 SER CB C 143 65.448 64.845 0.603 1
1 583 . 4 1 1 A 58 58 SER N N 143 115.269 116.798 -1.529 1
1 584 . 4 1 1 A 59 59 VAL H H 144 7.737 8.763 -1.026 1
1 585 . 4 1 1 A 59 59 VAL HA H 144 4.220 4.422 -0.202 1
1 593 . 4 1 1 A 59 59 VAL C C 144 176.234 176.096 0.138 1
1 594 . 4 1 1 A 59 59 VAL CA C 144 61.741 60.949 0.792 1
1 595 . 4 1 1 A 59 59 VAL CB C 144 33.711 33.822 -0.111 1
1 598 . 4 1 1 A 59 59 VAL N N 144 123.186 121.767 1.419 1
1 599 . 4 1 1 A 60 60 GLY H H 145 8.945 9.027 -0.082 1
1 600 . 4 1 1 A 60 60 GLY HA2 H 145 4.027 3.793 0.234 1
1 601 . 4 1 1 A 60 60 GLY HA3 H 145 3.692 3.810 -0.118 1
1 602 . 4 1 1 A 60 60 GLY C C 145 175.182 174.686 0.496 1
1 603 . 4 1 1 A 60 60 GLY CA C 145 47.141 47.326 -0.185 1
1 604 . 4 1 1 A 60 60 GLY N N 145 116.908 118.155 -1.247 1
1 605 . 4 1 1 A 61 61 ASN H H 146 8.929 8.597 0.332 1
1 606 . 4 1 1 A 61 61 ASN HA H 146 4.718 4.842 -0.124 1
1 611 . 4 1 1 A 61 61 ASN C C 146 174.706 174.550 0.156 1
1 612 . 4 1 1 A 61 61 ASN CA C 146 52.802 51.990 0.812 1
1 613 . 4 1 1 A 61 61 ASN CB C 146 37.917 38.899 -0.982 1
1 614 . 4 1 1 A 61 61 ASN N N 146 123.976 124.545 -0.569 1
1 616 . 4 1 1 A 62 62 HIS H H 147 8.400 7.774 0.626 1
1 617 . 4 1 1 A 62 62 HIS HA H 147 4.762 5.059 -0.297 1
1 622 . 4 1 1 A 62 62 HIS C C 147 173.871 173.680 0.191 1
1 623 . 4 1 1 A 62 62 HIS CA C 147 55.374 54.282 1.092 1
1 624 . 4 1 1 A 62 62 HIS CB C 147 28.655 33.984 -5.329 1
1 628 . 4 1 1 A 62 62 HIS N N 147 118.620 118.051 0.569 1
1 631 . 4 1 1 A 63 63 ASP H H 148 8.734 8.857 -0.123 1
1 632 . 4 1 1 A 63 63 ASP HA H 148 4.785 4.959 -0.174 1
1 635 . 4 1 1 A 63 63 ASP C C 148 175.269 175.165 0.104 1
1 636 . 4 1 1 A 63 63 ASP CA C 148 54.390 53.247 1.143 1
1 637 . 4 1 1 A 63 63 ASP CB C 148 42.105 40.883 1.222 1
1 638 . 4 1 1 A 63 63 ASP N N 148 125.336 119.969 5.367 1
1 639 . 4 1 1 A 64 64 CYS H H 149 8.225 8.455 -0.230 1
1 640 . 4 1 1 A 64 64 CYS HA H 149 5.118 5.169 -0.051 1
1 643 . 4 1 1 A 64 64 CYS C C 149 173.740 173.038 0.702 1
1 644 . 4 1 1 A 64 64 CYS CA C 149 55.423 58.282 -2.859 1
1 645 . 4 1 1 A 64 64 CYS CB C 149 29.972 29.997 -0.025 1
1 646 . 4 1 1 A 64 64 CYS N N 149 124.476 124.617 -0.141 1
1 647 . 4 1 1 A 65 65 TYR H H 150 8.916 8.257 0.659 1
1 648 . 4 1 1 A 65 65 TYR HA H 150 5.121 4.082 1.039 1
1 655 . 4 1 1 A 65 65 TYR C C 150 172.821 172.034 0.787 1
1 656 . 4 1 1 A 65 65 TYR CA C 150 56.347 55.796 0.551 1
1 657 . 4 1 1 A 65 65 TYR CB C 150 38.901 40.691 -1.790 1
1 662 . 4 1 1 A 65 65 TYR N N 150 115.313 118.129 -2.816 1
1 663 . 4 1 1 A 66 66 ILE H H 151 8.423 8.978 -0.555 1
1 664 . 4 1 1 A 66 66 ILE HA H 151 5.000 4.469 0.531 1
1 674 . 4 1 1 A 66 66 ILE C C 151 176.225 174.651 1.574 1
1 675 . 4 1 1 A 66 66 ILE CA C 151 57.798 60.135 -2.337 1
1 676 . 4 1 1 A 66 66 ILE CB C 151 39.863 38.703 1.160 1
1 680 . 4 1 1 A 66 66 ILE N N 151 118.575 121.529 -2.954 1
1 681 . 4 1 1 A 67 67 LYS H H 152 9.480 8.909 0.571 1
1 682 . 4 1 1 A 67 67 LYS HA H 152 5.091 4.719 0.372 1
1 691 . 4 1 1 A 67 67 LYS C C 152 174.079 175.045 -0.966 1
1 692 . 4 1 1 A 67 67 LYS CA C 152 54.728 56.131 -1.403 1
1 693 . 4 1 1 A 67 67 LYS CB C 152 35.256 33.143 2.113 1
1 697 . 4 1 1 A 67 67 LYS N N 152 132.311 128.628 3.683 1
1 698 . 4 1 1 A 68 68 ALA H H 153 8.844 8.675 0.169 1
1 699 . 4 1 1 A 68 68 ALA HA H 153 5.039 5.289 -0.250 1
1 703 . 4 1 1 A 68 68 ALA C C 153 176.587 176.610 -0.023 1
1 704 . 4 1 1 A 68 68 ALA CA C 153 50.484 50.988 -0.504 1
1 705 . 4 1 1 A 68 68 ALA CB C 153 20.570 21.172 -0.602 1
1 706 . 4 1 1 A 68 68 ALA N N 153 129.958 130.286 -0.328 1
1 707 . 4 1 1 A 69 69 VAL H H 154 8.461 8.629 -0.168 1
1 708 . 4 1 1 A 69 69 VAL HA H 154 4.558 4.580 -0.022 1
1 716 . 4 1 1 A 69 69 VAL C C 154 175.331 175.281 0.050 1
1 717 . 4 1 1 A 69 69 VAL CA C 154 60.758 60.997 -0.239 1
1 718 . 4 1 1 A 69 69 VAL CB C 154 34.743 35.073 -0.330 1
1 721 . 4 1 1 A 69 69 VAL N N 154 121.496 122.285 -0.789 1
1 722 . 4 1 1 A 70 70 SER H H 155 8.695 8.978 -0.283 1
1 723 . 4 1 1 A 70 70 SER HA H 155 4.646 5.071 -0.425 1
1 726 . 4 1 1 A 70 70 SER C C 155 174.690 173.421 1.269 1
1 727 . 4 1 1 A 70 70 SER CA C 155 58.065 57.190 0.875 1
1 728 . 4 1 1 A 70 70 SER CB C 155 64.062 64.794 -0.732 1
1 729 . 4 1 1 A 70 70 SER N N 155 119.763 122.387 -2.624 1
1 730 . 4 1 1 A 71 71 SER H H 156 8.360 8.984 -0.624 1
1 731 . 4 1 1 A 71 71 SER HA H 156 4.430 5.357 -0.927 1
1 734 . 4 1 1 A 71 71 SER CA C 156 58.491 56.952 1.539 1
1 735 . 4 1 1 A 71 71 SER CB C 156 64.061 66.367 -2.306 1
1 736 . 4 1 1 A 71 71 SER N N 156 118.577 116.856 1.721 1
1 737 . 4 1 1 A 72 72 GLY H H 157 8.542 8.441 0.101 1
1 738 . 4 1 1 A 72 72 GLY HA2 H 157 4.002 4.144 -0.142 1
1 739 . 4 1 1 A 72 72 GLY HA3 H 157 4.002 4.147 -0.145 1
1 740 . 4 1 1 A 72 72 GLY CA C 157 45.565 44.148 1.417 1
1 741 . 4 1 1 A 72 72 GLY N N 157 111.540 112.627 -1.087 1
1 742 . 4 1 1 A 73 73 LYS H H 158 8.369 8.222 0.147 1
1 743 . 4 1 1 A 73 73 LYS CA C 158 56.720 58.094 -1.374 1
1 744 . 4 1 1 A 73 73 LYS CB C 158 32.915 32.856 0.059 1
1 747 . 4 1 1 A 73 73 LYS N N 158 120.293 122.887 -2.594 1
1 748 . 4 1 1 A 74 74 ARG H H 159 8.181 7.888 0.293 1
1 749 . 4 1 1 A 74 74 ARG CA C 159 56.148 56.847 -0.699 1
1 751 . 4 1 1 A 74 74 ARG N N 159 119.343 114.131 5.212 1
1 752 . 4 1 1 A 75 75 LYS H H 160 8.443 7.839 0.604 1
1 753 . 4 1 1 A 75 75 LYS HA H 160 4.067 4.587 -0.520 1
1 762 . 4 1 1 A 75 75 LYS C C 160 176.868 176.762 0.106 1
1 763 . 4 1 1 A 75 75 LYS CA C 160 57.711 55.293 2.418 1
1 764 . 4 1 1 A 75 75 LYS CB C 160 31.777 33.693 -1.916 1
1 768 . 4 1 1 A 75 75 LYS N N 160 120.467 118.863 1.604 1
1 769 . 4 1 1 A 76 76 GLU H H 161 8.693 8.193 0.500 1
1 770 . 4 1 1 A 76 76 GLU HA H 161 4.290 3.974 0.316 1
1 771 . 4 1 1 A 76 76 GLU C C 161 176.844 176.390 0.454 1
1 772 . 4 1 1 A 76 76 GLU CA C 161 57.294 59.715 -2.421 1
1 773 . 4 1 1 A 76 76 GLU CB C 161 29.794 30.223 -0.429 1
1 775 . 4 1 1 A 76 76 GLU N N 161 118.767 122.024 -3.257 1
1 776 . 4 1 1 A 77 77 GLY H H 162 8.168 7.754 0.414 1
1 777 . 4 1 1 A 77 77 GLY HA2 H 162 4.010 4.170 -0.160 1
1 778 . 4 1 1 A 77 77 GLY HA3 H 162 3.963 4.176 -0.213 1
1 779 . 4 1 1 A 77 77 GLY C C 162 173.512 172.172 1.340 1
1 780 . 4 1 1 A 77 77 GLY CA C 162 45.362 44.388 0.974 1
1 781 . 4 1 1 A 77 77 GLY N N 162 108.621 106.995 1.626 1
1 782 . 4 1 1 A 78 78 ILE H H 163 7.954 8.561 -0.607 1
1 783 . 4 1 1 A 78 78 ILE HA H 163 4.323 4.831 -0.508 1
1 793 . 4 1 1 A 78 78 ILE C C 163 175.402 174.967 0.435 1
1 794 . 4 1 1 A 78 78 ILE CA C 163 60.632 59.601 1.031 1
1 795 . 4 1 1 A 78 78 ILE CB C 163 39.759 42.219 -2.460 1
1 799 . 4 1 1 A 78 78 ILE N N 163 121.604 120.766 0.838 1
1 800 . 4 1 1 A 79 79 ILE H H 164 8.514 8.731 -0.217 1
1 801 . 4 1 1 A 79 79 ILE HA H 164 4.341 4.776 -0.435 1
1 811 . 4 1 1 A 79 79 ILE C C 164 175.172 174.696 0.476 1
1 812 . 4 1 1 A 79 79 ILE CA C 164 60.027 59.936 0.091 1
1 813 . 4 1 1 A 79 79 ILE CB C 164 40.153 41.190 -1.037 1
1 817 . 4 1 1 A 79 79 ILE N N 164 127.137 125.752 1.385 1
1 818 . 4 1 1 A 80 80 HIS H H 165 8.492 9.080 -0.588 1
1 819 . 4 1 1 A 80 80 HIS HA H 165 5.676 5.296 0.380 1
1 824 . 4 1 1 A 80 80 HIS C C 165 175.502 174.421 1.081 1
1 825 . 4 1 1 A 80 80 HIS CA C 165 57.043 55.150 1.893 1
1 826 . 4 1 1 A 80 80 HIS CB C 165 32.741 32.180 0.561 1
1 829 . 4 1 1 A 80 80 HIS N N 165 125.422 126.560 -1.138 1
1 830 . 4 1 1 A 81 81 THR H H 166 9.080 9.368 -0.288 1
1 831 . 4 1 1 A 81 81 THR HA H 166 4.999 4.928 0.071 1
1 836 . 4 1 1 A 81 81 THR C C 166 171.877 173.336 -1.459 1
1 837 . 4 1 1 A 81 81 THR CA C 166 59.924 61.130 -1.206 1
1 838 . 4 1 1 A 81 81 THR CB C 166 72.243 70.999 1.244 1
1 840 . 4 1 1 A 81 81 THR N N 166 117.682 114.409 3.273 1
1 841 . 4 1 1 A 82 82 LEU H H 167 8.062 8.009 0.053 1
1 842 . 4 1 1 A 82 82 LEU HA H 167 4.350 3.927 0.423 1
1 852 . 4 1 1 A 82 82 LEU C C 167 172.705 174.954 -2.249 1
1 853 . 4 1 1 A 82 82 LEU CA C 167 53.553 55.476 -1.923 1
1 854 . 4 1 1 A 82 82 LEU CB C 167 39.768 41.306 -1.538 1
1 858 . 4 1 1 A 82 82 LEU N N 167 125.369 128.279 -2.910 1
1 859 . 4 1 1 A 83 83 ILE H H 168 8.657 8.200 0.457 1
1 860 . 4 1 1 A 83 83 ILE HA H 168 4.476 4.893 -0.417 1
1 870 . 4 1 1 A 83 83 ILE C C 168 175.159 174.351 0.808 1
1 871 . 4 1 1 A 83 83 ILE CA C 168 58.529 59.804 -1.275 1
1 872 . 4 1 1 A 83 83 ILE CB C 168 37.410 41.074 -3.664 1
1 876 . 4 1 1 A 83 83 ILE N N 168 128.042 127.216 0.826 1
1 877 . 4 1 1 A 84 84 VAL H H 169 8.464 8.463 0.001 1
1 878 . 4 1 1 A 84 84 VAL HA H 169 4.284 4.312 -0.028 1
1 886 . 4 1 1 A 84 84 VAL C C 169 176.138 175.856 0.282 1
1 887 . 4 1 1 A 84 84 VAL CA C 169 61.029 61.257 -0.228 1
1 888 . 4 1 1 A 84 84 VAL CB C 169 34.714 34.167 0.547 1
1 891 . 4 1 1 A 84 84 VAL N N 169 124.644 126.745 -2.101 1
1 892 . 4 1 1 A 85 85 ASP H H 170 9.158 9.472 -0.314 1
1 893 . 4 1 1 A 85 85 ASP HA H 170 4.362 4.340 0.022 1
1 896 . 4 1 1 A 85 85 ASP C C 170 175.489 175.651 -0.162 1
1 897 . 4 1 1 A 85 85 ASP CA C 170 55.868 55.738 0.130 1
1 898 . 4 1 1 A 85 85 ASP CB C 170 38.927 39.234 -0.307 1
1 899 . 4 1 1 A 85 85 ASP N N 170 129.061 129.090 -0.029 1
1 900 . 4 1 1 A 86 86 ASN H H 171 8.811 8.367 0.444 1
1 901 . 4 1 1 A 86 86 ASN HA H 171 4.053 4.337 -0.284 1
1 906 . 4 1 1 A 86 86 ASN C C 171 173.802 173.864 -0.062 1
1 907 . 4 1 1 A 86 86 ASN CA C 171 55.173 54.287 0.886 1
1 908 . 4 1 1 A 86 86 ASN CB C 171 38.150 37.373 0.777 1
1 909 . 4 1 1 A 86 86 ASN N N 171 108.418 110.218 -1.800 1
1 911 . 4 1 1 A 87 87 ARG H H 172 7.914 7.476 0.438 1
1 912 . 4 1 1 A 87 87 ARG HA H 172 4.597 4.649 -0.052 1
1 919 . 4 1 1 A 87 87 ARG C C 172 174.025 174.769 -0.744 1
1 920 . 4 1 1 A 87 87 ARG CA C 172 54.846 54.143 0.703 1
1 921 . 4 1 1 A 87 87 ARG CB C 172 32.697 33.015 -0.318 1
1 924 . 4 1 1 A 87 87 ARG N N 172 120.988 117.619 3.369 1
1 925 . 4 1 1 A 88 88 GLU H H 173 8.534 8.767 -0.233 1
1 926 . 4 1 1 A 88 88 GLU HA H 173 4.560 4.351 0.209 1
1 931 . 4 1 1 A 88 88 GLU C C 173 176.187 175.448 0.739 1
1 932 . 4 1 1 A 88 88 GLU CA C 173 56.044 56.879 -0.835 1
1 933 . 4 1 1 A 88 88 GLU CB C 173 30.329 30.439 -0.110 1
1 935 . 4 1 1 A 88 88 GLU N N 173 123.982 125.032 -1.050 1
1 936 . 4 1 1 A 89 89 ILE H H 174 8.897 7.958 0.939 1
1 937 . 4 1 1 A 89 89 ILE HA H 174 4.666 4.565 0.101 1
1 947 . 4 1 1 A 89 89 ILE C C 174 174.110 174.115 -0.005 1
1 948 . 4 1 1 A 89 89 ILE CA C 174 55.255 57.373 -2.118 1
1 949 . 4 1 1 A 89 89 ILE CB C 174 37.851 41.693 -3.842 1
1 953 . 4 1 1 A 89 89 ILE N N 174 130.008 126.987 3.021 1
1 954 . 4 1 1 A 90 90 PRO HA H 175 4.713 4.748 -0.035 1
1 961 . 4 1 1 A 90 90 PRO C C 175 176.956 176.677 0.279 1
1 962 . 4 1 1 A 90 90 PRO CA C 175 63.159 62.879 0.280 1
1 963 . 4 1 1 A 90 90 PRO CB C 175 32.428 32.544 -0.116 1
1 966 . 4 1 1 A 91 91 GLU H H 176 8.778 8.610 0.168 1
1 967 . 4 1 1 A 91 91 GLU HA H 176 3.910 4.789 -0.879 1
1 972 . 4 1 1 A 91 91 GLU C C 176 176.426 175.088 1.338 1
1 973 . 4 1 1 A 91 91 GLU CA C 176 56.738 55.925 0.813 1
1 974 . 4 1 1 A 91 91 GLU CB C 176 30.540 31.197 -0.657 1
1 976 . 4 1 1 A 91 91 GLU N N 176 124.561 121.096 3.465 1
1 977 . 4 1 1 A 92 92 LEU H H 177 8.630 8.264 0.366 1
1 978 . 4 1 1 A 92 92 LEU HA H 177 4.419 5.149 -0.730 1
1 988 . 4 1 1 A 92 92 LEU C C 177 177.162 175.747 1.415 1
1 989 . 4 1 1 A 92 92 LEU CA C 177 55.350 53.604 1.746 1
1 990 . 4 1 1 A 92 92 LEU CB C 177 42.390 44.338 -1.948 1
1 994 . 4 1 1 A 92 92 LEU N N 177 126.683 124.218 2.465 1
1 995 . 4 1 1 A 93 93 THR H H 178 8.375 8.717 -0.342 1
1 996 . 4 1 1 A 93 93 THR HA H 178 4.359 4.492 -0.133 1
1 1001 . 4 1 1 A 93 93 THR C C 178 173.589 174.100 -0.511 1
1 1002 . 4 1 1 A 93 93 THR CA C 178 61.621 62.831 -1.210 1
1 1003 . 4 1 1 A 93 93 THR CB C 178 69.724 71.613 -1.889 1
1 1005 . 4 1 1 A 93 93 THR N N 178 119.699 121.227 -1.528 1
1 1 . 5 1 1 A 9 9 SER H H 94 8.475 8.586 -0.111 1
1 2 . 5 1 1 A 9 9 SER CA C 94 58.531 59.493 -0.962 1
1 3 . 5 1 1 A 9 9 SER N N 94 117.432 120.218 -2.786 1
1 4 . 5 1 1 A 10 10 LYS H H 95 8.527 7.218 1.309 1
1 5 . 5 1 1 A 10 10 LYS C C 95 174.594 175.585 -0.991 1
1 6 . 5 1 1 A 10 10 LYS CA C 95 56.603 54.926 1.677 1
1 7 . 5 1 1 A 10 10 LYS N N 95 123.104 119.741 3.363 1
1 8 . 5 1 1 A 11 11 THR H H 96 8.245 8.727 -0.482 1
1 9 . 5 1 1 A 11 11 THR C C 96 174.393 173.523 0.870 1
1 10 . 5 1 1 A 11 11 THR CA C 96 62.149 60.572 1.577 1
1 11 . 5 1 1 A 11 11 THR CB C 96 69.183 69.032 0.151 1
1 13 . 5 1 1 A 11 11 THR N N 96 113.245 116.831 -3.586 1
1 14 . 5 1 1 A 12 12 THR H H 97 7.769 7.528 0.241 1
1 15 . 5 1 1 A 12 12 THR HA H 97 5.583 4.934 0.649 1
1 20 . 5 1 1 A 12 12 THR C C 97 174.726 172.112 2.614 1
1 21 . 5 1 1 A 12 12 THR CA C 97 59.602 60.773 -1.171 1
1 22 . 5 1 1 A 12 12 THR CB C 97 72.805 71.380 1.425 1
1 24 . 5 1 1 A 12 12 THR N N 97 113.440 111.919 1.521 1
1 25 . 5 1 1 A 13 13 SER H H 98 8.593 8.535 0.058 1
1 26 . 5 1 1 A 13 13 SER HA H 98 4.448 5.322 -0.874 1
1 29 . 5 1 1 A 13 13 SER C C 98 171.426 172.457 -1.031 1
1 30 . 5 1 1 A 13 13 SER CA C 98 59.056 56.913 2.143 1
1 31 . 5 1 1 A 13 13 SER CB C 98 67.839 64.644 3.195 1
1 32 . 5 1 1 A 13 13 SER N N 98 119.042 121.344 -2.302 1
1 33 . 5 1 1 A 14 14 THR H H 99 8.155 8.499 -0.344 1
1 34 . 5 1 1 A 14 14 THR HA H 99 5.383 4.934 0.449 1
1 39 . 5 1 1 A 14 14 THR C C 99 171.565 173.115 -1.550 1
1 40 . 5 1 1 A 14 14 THR CA C 99 61.291 60.610 0.681 1
1 41 . 5 1 1 A 14 14 THR CB C 99 71.654 71.788 -0.134 1
1 43 . 5 1 1 A 14 14 THR N N 99 118.204 116.431 1.773 1
1 44 . 5 1 1 A 15 15 TRP H H 100 9.637 9.308 0.329 1
1 45 . 5 1 1 A 15 15 TRP HA H 100 4.807 5.240 -0.433 1
1 54 . 5 1 1 A 15 15 TRP C C 100 174.399 175.271 -0.872 1
1 55 . 5 1 1 A 15 15 TRP CA C 100 58.302 55.727 2.575 1
1 56 . 5 1 1 A 15 15 TRP CB C 100 34.810 32.242 2.568 1
1 63 . 5 1 1 A 15 15 TRP N N 100 125.132 125.684 -0.552 1
1 65 . 5 1 1 A 16 16 VAL H H 101 8.863 9.032 -0.169 1
1 66 . 5 1 1 A 16 16 VAL HA H 101 5.267 4.707 0.560 1
1 74 . 5 1 1 A 16 16 VAL C C 101 174.955 175.410 -0.455 1
1 75 . 5 1 1 A 16 16 VAL CA C 101 60.653 61.983 -1.330 1
1 76 . 5 1 1 A 16 16 VAL CB C 101 34.284 32.781 1.503 1
1 79 . 5 1 1 A 16 16 VAL N N 101 119.527 123.947 -4.420 1
1 80 . 5 1 1 A 17 17 LEU H H 102 8.961 8.939 0.022 1
1 81 . 5 1 1 A 17 17 LEU HA H 102 4.729 5.103 -0.374 1
1 91 . 5 1 1 A 17 17 LEU C C 102 173.559 175.087 -1.528 1
1 92 . 5 1 1 A 17 17 LEU CA C 102 55.144 53.150 1.994 1
1 93 . 5 1 1 A 17 17 LEU CB C 102 42.948 45.921 -2.973 1
1 97 . 5 1 1 A 17 17 LEU N N 102 124.280 123.860 0.420 1
1 98 . 5 1 1 A 18 18 ARG H H 103 8.305 8.367 -0.062 1
1 99 . 5 1 1 A 18 18 ARG HA H 103 5.139 4.662 0.477 1
1 106 . 5 1 1 A 18 18 ARG C C 103 175.347 175.195 0.152 1
1 107 . 5 1 1 A 18 18 ARG CA C 103 54.793 56.099 -1.306 1
1 108 . 5 1 1 A 18 18 ARG CB C 103 31.347 29.732 1.615 1
1 111 . 5 1 1 A 18 18 ARG N N 103 122.020 120.120 1.900 1
1 112 . 5 1 1 A 19 19 LEU H H 104 8.676 8.766 -0.090 1
1 113 . 5 1 1 A 19 19 LEU HA H 104 4.482 4.811 -0.329 1
1 123 . 5 1 1 A 19 19 LEU C C 104 175.957 175.824 0.133 1
1 124 . 5 1 1 A 19 19 LEU CA C 104 53.581 53.652 -0.071 1
1 125 . 5 1 1 A 19 19 LEU CB C 104 45.697 45.491 0.206 1
1 129 . 5 1 1 A 19 19 LEU N N 104 126.378 124.841 1.537 1
1 130 . 5 1 1 A 20 20 ASP H H 105 9.390 9.607 -0.217 1
1 131 . 5 1 1 A 20 20 ASP HA H 105 4.287 4.378 -0.091 1
1 134 . 5 1 1 A 20 20 ASP C C 105 175.947 175.784 0.163 1
1 135 . 5 1 1 A 20 20 ASP CA C 105 55.263 55.247 0.016 1
1 136 . 5 1 1 A 20 20 ASP CB C 105 39.239 39.298 -0.059 1
1 137 . 5 1 1 A 20 20 ASP N N 105 125.208 126.331 -1.123 1
1 138 . 5 1 1 A 21 21 GLY H H 106 8.563 8.660 -0.097 1
1 139 . 5 1 1 A 21 21 GLY HA2 H 106 4.126 3.851 0.275 1
1 140 . 5 1 1 A 21 21 GLY HA3 H 106 3.509 3.856 -0.347 1
1 141 . 5 1 1 A 21 21 GLY C C 106 173.164 173.567 -0.403 1
1 142 . 5 1 1 A 21 21 GLY CA C 106 45.499 45.558 -0.059 1
1 143 . 5 1 1 A 21 21 GLY N N 106 103.331 103.882 -0.551 1
1 144 . 5 1 1 A 22 22 GLU H H 107 7.713 7.752 -0.039 1
1 145 . 5 1 1 A 22 22 GLU HA H 107 4.634 4.896 -0.262 1
1 150 . 5 1 1 A 22 22 GLU C C 107 174.800 174.847 -0.047 1
1 151 . 5 1 1 A 22 22 GLU CA C 107 54.329 54.677 -0.348 1
1 152 . 5 1 1 A 22 22 GLU CB C 107 32.832 32.824 0.008 1
1 154 . 5 1 1 A 22 22 GLU N N 107 119.470 115.620 3.850 1
1 155 . 5 1 1 A 23 23 ASP H H 108 8.632 8.514 0.118 1
1 156 . 5 1 1 A 23 23 ASP HA H 108 4.872 4.705 0.167 1
1 159 . 5 1 1 A 23 23 ASP C C 108 175.533 175.230 0.303 1
1 160 . 5 1 1 A 23 23 ASP CA C 108 55.180 53.630 1.550 1
1 161 . 5 1 1 A 23 23 ASP CB C 108 41.504 39.679 1.825 1
1 162 . 5 1 1 A 23 23 ASP N N 108 122.815 120.982 1.833 1
1 163 . 5 1 1 A 24 24 LEU H H 109 9.248 8.852 0.396 1
1 164 . 5 1 1 A 24 24 LEU HA H 109 4.836 4.624 0.212 1
1 174 . 5 1 1 A 24 24 LEU C C 109 174.322 175.952 -1.630 1
1 175 . 5 1 1 A 24 24 LEU CA C 109 54.473 55.161 -0.688 1
1 176 . 5 1 1 A 24 24 LEU CB C 109 44.718 42.707 2.011 1
1 180 . 5 1 1 A 24 24 LEU N N 109 125.550 126.682 -1.132 1
1 181 . 5 1 1 A 25 25 ARG H H 110 8.503 8.788 -0.285 1
1 182 . 5 1 1 A 25 25 ARG HA H 110 5.228 4.799 0.429 1
1 189 . 5 1 1 A 25 25 ARG C C 110 175.174 174.532 0.642 1
1 190 . 5 1 1 A 25 25 ARG CA C 110 54.745 54.995 -0.250 1
1 191 . 5 1 1 A 25 25 ARG CB C 110 31.701 31.575 0.126 1
1 194 . 5 1 1 A 25 25 ARG N N 110 125.424 128.117 -2.693 1
1 195 . 5 1 1 A 26 26 VAL H H 111 9.692 9.117 0.575 1
1 196 . 5 1 1 A 26 26 VAL HA H 111 5.091 5.080 0.011 1
1 204 . 5 1 1 A 26 26 VAL C C 111 174.446 175.297 -0.851 1
1 205 . 5 1 1 A 26 26 VAL CA C 111 61.055 62.042 -0.987 1
1 206 . 5 1 1 A 26 26 VAL CB C 111 33.780 33.073 0.707 1
1 209 . 5 1 1 A 26 26 VAL N N 111 130.649 127.706 2.943 1
1 210 . 5 1 1 A 27 27 VAL H H 112 9.401 9.056 0.345 1
1 211 . 5 1 1 A 27 27 VAL HA H 112 5.188 4.705 0.483 1
1 219 . 5 1 1 A 27 27 VAL C C 112 174.214 174.162 0.052 1
1 220 . 5 1 1 A 27 27 VAL CA C 112 60.722 60.946 -0.224 1
1 221 . 5 1 1 A 27 27 VAL CB C 112 36.082 35.195 0.887 1
1 224 . 5 1 1 A 27 27 VAL N N 112 127.416 127.551 -0.135 1
1 225 . 5 1 1 A 28 28 LEU H H 113 9.265 9.120 0.145 1
1 226 . 5 1 1 A 28 28 LEU HA H 113 5.337 5.341 -0.004 1
1 236 . 5 1 1 A 28 28 LEU C C 113 175.915 174.867 1.048 1
1 237 . 5 1 1 A 28 28 LEU CA C 113 52.599 53.285 -0.686 1
1 238 . 5 1 1 A 28 28 LEU CB C 113 47.495 44.563 2.932 1
1 242 . 5 1 1 A 28 28 LEU N N 113 127.527 129.884 -2.357 1
1 243 . 5 1 1 A 29 29 GLU H H 114 8.968 8.597 0.371 1
1 244 . 5 1 1 A 29 29 GLU HA H 114 4.701 4.335 0.366 1
1 249 . 5 1 1 A 29 29 GLU C C 114 176.715 177.262 -0.547 1
1 250 . 5 1 1 A 29 29 GLU CA C 114 55.342 56.300 -0.958 1
1 251 . 5 1 1 A 29 29 GLU CB C 114 30.005 30.813 -0.808 1
1 253 . 5 1 1 A 29 29 GLU N N 114 127.374 127.272 0.102 1
1 254 . 5 1 1 A 30 30 LYS H H 115 8.243 8.578 -0.335 1
1 255 . 5 1 1 A 30 30 LYS HA H 115 3.711 4.133 -0.422 1
1 264 . 5 1 1 A 30 30 LYS C C 115 177.137 178.280 -1.143 1
1 265 . 5 1 1 A 30 30 LYS CA C 115 60.118 58.759 1.359 1
1 266 . 5 1 1 A 30 30 LYS CB C 115 32.656 32.067 0.589 1
1 270 . 5 1 1 A 30 30 LYS N N 115 124.225 125.236 -1.011 1
1 271 . 5 1 1 A 31 31 ASP H H 116 9.200 8.097 1.103 1
1 272 . 5 1 1 A 31 31 ASP HA H 116 4.444 4.450 -0.006 1
1 275 . 5 1 1 A 31 31 ASP C C 116 177.774 177.562 0.212 1
1 276 . 5 1 1 A 31 31 ASP CA C 116 56.703 57.381 -0.678 1
1 277 . 5 1 1 A 31 31 ASP CB C 116 40.236 41.004 -0.768 1
1 278 . 5 1 1 A 31 31 ASP N N 116 115.955 119.955 -4.000 1
1 279 . 5 1 1 A 32 32 THR H H 117 7.352 7.287 0.065 1
1 280 . 5 1 1 A 32 32 THR HA H 117 4.266 4.649 -0.383 1
1 285 . 5 1 1 A 32 32 THR C C 117 175.320 174.087 1.233 1
1 286 . 5 1 1 A 32 32 THR CA C 117 61.171 60.703 0.468 1
1 287 . 5 1 1 A 32 32 THR CB C 117 70.221 69.287 0.934 1
1 289 . 5 1 1 A 32 32 THR N N 117 106.440 106.386 0.054 1
1 290 . 5 1 1 A 33 33 MET H H 118 8.216 7.957 0.259 1
1 291 . 5 1 1 A 33 33 MET HA H 118 4.184 4.331 -0.147 1
1 299 . 5 1 1 A 33 33 MET C C 118 174.952 175.074 -0.122 1
1 300 . 5 1 1 A 33 33 MET CA C 118 55.195 57.070 -1.875 1
1 301 . 5 1 1 A 33 33 MET CB C 118 25.900 31.675 -5.775 1
1 304 . 5 1 1 A 33 33 MET N N 118 115.956 119.008 -3.052 1
1 305 . 5 1 1 A 34 34 ASP H H 119 7.509 7.915 -0.406 1
1 306 . 5 1 1 A 34 34 ASP HA H 119 4.486 4.829 -0.343 1
1 309 . 5 1 1 A 34 34 ASP C C 119 174.375 175.726 -1.351 1
1 310 . 5 1 1 A 34 34 ASP CA C 119 54.745 54.150 0.595 1
1 311 . 5 1 1 A 34 34 ASP CB C 119 42.865 42.340 0.525 1
1 312 . 5 1 1 A 34 34 ASP N N 119 118.500 119.291 -0.791 1
1 313 . 5 1 1 A 35 35 VAL H H 120 8.473 8.368 0.105 1
1 314 . 5 1 1 A 35 35 VAL HA H 120 4.709 4.802 -0.093 1
1 322 . 5 1 1 A 35 35 VAL C C 120 173.900 174.530 -0.630 1
1 323 . 5 1 1 A 35 35 VAL CA C 120 60.736 61.191 -0.455 1
1 324 . 5 1 1 A 35 35 VAL CB C 120 34.662 33.267 1.395 1
1 327 . 5 1 1 A 35 35 VAL N N 120 121.116 123.544 -2.428 1
1 328 . 5 1 1 A 36 36 TRP H H 121 9.404 9.139 0.265 1
1 329 . 5 1 1 A 36 36 TRP HA H 121 5.174 5.634 -0.460 1
1 338 . 5 1 1 A 36 36 TRP C C 121 176.480 174.842 1.638 1
1 339 . 5 1 1 A 36 36 TRP CA C 121 55.070 55.214 -0.144 1
1 340 . 5 1 1 A 36 36 TRP CB C 121 32.179 32.814 -0.635 1
1 348 . 5 1 1 A 36 36 TRP N N 121 126.924 128.888 -1.964 1
1 350 . 5 1 1 A 37 37 CYS H H 122 9.230 8.693 0.537 1
1 351 . 5 1 1 A 37 37 CYS HA H 122 5.417 5.310 0.107 1
1 354 . 5 1 1 A 37 37 CYS C C 122 175.346 174.375 0.971 1
1 355 . 5 1 1 A 37 37 CYS CA C 122 57.083 57.870 -0.787 1
1 356 . 5 1 1 A 37 37 CYS CB C 122 28.713 30.634 -1.921 1
1 357 . 5 1 1 A 37 37 CYS N N 122 120.375 123.928 -3.553 1
1 358 . 5 1 1 A 38 38 ASN H H 123 9.817 9.399 0.418 1
1 359 . 5 1 1 A 38 38 ASN HA H 123 4.637 4.470 0.167 1
1 364 . 5 1 1 A 38 38 ASN C C 123 175.526 175.397 0.129 1
1 365 . 5 1 1 A 38 38 ASN CA C 123 54.023 54.564 -0.541 1
1 366 . 5 1 1 A 38 38 ASN CB C 123 36.581 37.277 -0.696 1
1 367 . 5 1 1 A 38 38 ASN N N 123 129.408 124.603 4.805 1
1 369 . 5 1 1 A 39 39 GLY H H 124 9.092 8.804 0.288 1
1 370 . 5 1 1 A 39 39 GLY HA2 H 124 4.241 4.048 0.193 1
1 371 . 5 1 1 A 39 39 GLY HA3 H 124 3.705 4.341 -0.636 1
1 372 . 5 1 1 A 39 39 GLY C C 124 173.405 173.743 -0.338 1
1 373 . 5 1 1 A 39 39 GLY CA C 124 45.595 47.090 -1.495 1
1 374 . 5 1 1 A 39 39 GLY N N 124 102.752 103.859 -1.107 1
1 375 . 5 1 1 A 40 40 GLN H H 125 8.006 6.942 1.064 1
1 376 . 5 1 1 A 40 40 GLN HA H 125 4.736 4.344 0.392 1
1 383 . 5 1 1 A 40 40 GLN C C 125 174.477 172.956 1.521 1
1 384 . 5 1 1 A 40 40 GLN CA C 125 53.747 53.381 0.366 1
1 385 . 5 1 1 A 40 40 GLN CB C 125 30.413 32.650 -2.237 1
1 387 . 5 1 1 A 40 40 GLN N N 125 120.627 118.229 2.398 1
1 389 . 5 1 1 A 41 41 LYS H H 126 8.757 7.735 1.022 1
1 390 . 5 1 1 A 41 41 LYS HA H 126 3.464 3.463 0.001 1
1 399 . 5 1 1 A 41 41 LYS C C 126 176.870 175.166 1.704 1
1 400 . 5 1 1 A 41 41 LYS CA C 126 57.136 55.622 1.514 1
1 401 . 5 1 1 A 41 41 LYS CB C 126 31.669 32.948 -1.279 1
1 405 . 5 1 1 A 41 41 LYS N N 126 129.107 123.666 5.441 1
1 406 . 5 1 1 A 42 42 MET H H 127 8.682 8.246 0.436 1
1 407 . 5 1 1 A 42 42 MET HA H 127 4.712 5.161 -0.449 1
1 415 . 5 1 1 A 42 42 MET C C 127 176.816 174.334 2.482 1
1 416 . 5 1 1 A 42 42 MET CA C 127 52.958 53.590 -0.632 1
1 417 . 5 1 1 A 42 42 MET CB C 127 33.023 36.877 -3.854 1
1 420 . 5 1 1 A 42 42 MET N N 127 126.569 124.465 2.104 1
1 421 . 5 1 1 A 43 43 GLU H H 128 8.734 8.778 -0.044 1
1 422 . 5 1 1 A 43 43 GLU HA H 128 4.419 5.079 -0.660 1
1 427 . 5 1 1 A 43 43 GLU C C 128 176.531 176.584 -0.053 1
1 428 . 5 1 1 A 43 43 GLU CA C 128 56.475 55.089 1.386 1
1 429 . 5 1 1 A 43 43 GLU CB C 128 29.604 31.465 -1.861 1
1 431 . 5 1 1 A 43 43 GLU N N 128 123.734 120.314 3.420 1
1 432 . 5 1 1 A 44 44 THR H H 129 8.263 8.889 -0.626 1
1 433 . 5 1 1 A 44 44 THR HA H 129 5.385 5.350 0.035 1
1 438 . 5 1 1 A 44 44 THR C C 129 174.205 174.510 -0.305 1
1 439 . 5 1 1 A 44 44 THR CA C 129 59.160 60.432 -1.272 1
1 440 . 5 1 1 A 44 44 THR CB C 129 72.419 71.162 1.257 1
1 442 . 5 1 1 A 44 44 THR N N 129 115.081 117.825 -2.744 1
1 443 . 5 1 1 A 45 45 ALA H H 130 8.727 8.372 0.355 1
1 444 . 5 1 1 A 45 45 ALA HA H 130 4.749 4.467 0.282 1
1 448 . 5 1 1 A 45 45 ALA C C 130 177.017 177.871 -0.854 1
1 449 . 5 1 1 A 45 45 ALA CA C 130 51.645 52.377 -0.732 1
1 450 . 5 1 1 A 45 45 ALA CB C 130 21.364 20.626 0.738 1
1 451 . 5 1 1 A 45 45 ALA N N 130 123.243 122.069 1.174 1
1 452 . 5 1 1 A 46 46 GLY H H 131 8.818 8.207 0.611 1
1 453 . 5 1 1 A 46 46 GLY HA2 H 131 4.941 3.964 0.977 1
1 454 . 5 1 1 A 46 46 GLY HA3 H 131 3.690 3.970 -0.280 1
1 455 . 5 1 1 A 46 46 GLY C C 131 173.528 174.115 -0.587 1
1 456 . 5 1 1 A 46 46 GLY CA C 131 45.060 46.824 -1.764 1
1 457 . 5 1 1 A 46 46 GLY N N 131 112.392 106.732 5.660 1
1 458 . 5 1 1 A 47 47 GLU H H 132 8.746 8.293 0.453 1
1 459 . 5 1 1 A 47 47 GLU HA H 132 4.584 4.830 -0.246 1
1 464 . 5 1 1 A 47 47 GLU C C 132 175.223 175.220 0.003 1
1 465 . 5 1 1 A 47 47 GLU CA C 132 55.008 55.438 -0.430 1
1 466 . 5 1 1 A 47 47 GLU CB C 132 32.939 32.039 0.900 1
1 468 . 5 1 1 A 47 47 GLU N N 132 122.107 122.460 -0.353 1
1 469 . 5 1 1 A 48 48 PHE H H 133 8.920 9.140 -0.220 1
1 470 . 5 1 1 A 48 48 PHE HA H 133 4.822 5.051 -0.229 1
1 475 . 5 1 1 A 48 48 PHE C C 133 175.499 174.978 0.521 1
1 476 . 5 1 1 A 48 48 PHE CA C 133 58.320 59.012 -0.692 1
1 477 . 5 1 1 A 48 48 PHE CB C 133 39.175 40.279 -1.104 1
1 479 . 5 1 1 A 48 48 PHE N N 133 124.006 127.255 -3.249 1
1 480 . 5 1 1 A 49 49 VAL H H 134 8.161 7.981 0.180 1
1 481 . 5 1 1 A 49 49 VAL HA H 134 4.492 4.374 0.118 1
1 489 . 5 1 1 A 49 49 VAL C C 134 176.241 175.623 0.618 1
1 490 . 5 1 1 A 49 49 VAL CA C 134 60.328 58.715 1.613 1
1 491 . 5 1 1 A 49 49 VAL CB C 134 34.542 35.386 -0.844 1
1 494 . 5 1 1 A 49 49 VAL N N 134 120.063 118.618 1.445 1
1 495 . 5 1 1 A 50 50 ASP H H 135 8.596 8.997 -0.401 1
1 496 . 5 1 1 A 50 50 ASP HA H 135 4.278 4.406 -0.128 1
1 499 . 5 1 1 A 50 50 ASP C C 135 176.567 177.156 -0.589 1
1 500 . 5 1 1 A 50 50 ASP CA C 135 57.149 56.242 0.907 1
1 501 . 5 1 1 A 50 50 ASP CB C 135 40.477 39.937 0.540 1
1 502 . 5 1 1 A 50 50 ASP N N 135 122.137 120.878 1.259 1
1 503 . 5 1 1 A 51 51 ASP H H 136 8.328 7.756 0.572 1
1 504 . 5 1 1 A 51 51 ASP HA H 136 4.656 4.590 0.066 1
1 507 . 5 1 1 A 51 51 ASP C C 136 175.798 176.466 -0.668 1
1 508 . 5 1 1 A 51 51 ASP CA C 136 53.458 55.903 -2.445 1
1 509 . 5 1 1 A 51 51 ASP CB C 136 40.306 41.052 -0.746 1
1 510 . 5 1 1 A 51 51 ASP N N 136 116.158 118.937 -2.779 1
1 511 . 5 1 1 A 52 52 GLY H H 137 7.653 7.420 0.233 1
1 512 . 5 1 1 A 52 52 GLY HA2 H 137 4.685 4.128 0.557 1
1 513 . 5 1 1 A 52 52 GLY HA3 H 137 4.069 4.144 -0.075 1
1 514 . 5 1 1 A 52 52 GLY C C 137 173.149 171.829 1.320 1
1 515 . 5 1 1 A 52 52 GLY CA C 137 45.860 45.703 0.157 1
1 516 . 5 1 1 A 52 52 GLY N N 137 107.634 103.801 3.833 1
1 517 . 5 1 1 A 53 53 THR H H 138 8.445 8.353 0.092 1
1 518 . 5 1 1 A 53 53 THR HA H 138 4.996 5.101 -0.105 1
1 523 . 5 1 1 A 53 53 THR C C 138 174.163 173.218 0.945 1
1 524 . 5 1 1 A 53 53 THR CA C 138 60.974 61.448 -0.474 1
1 525 . 5 1 1 A 53 53 THR CB C 138 72.266 72.105 0.161 1
1 527 . 5 1 1 A 53 53 THR N N 138 114.976 116.233 -1.257 1
1 528 . 5 1 1 A 54 54 GLU H H 139 8.917 9.135 -0.218 1
1 529 . 5 1 1 A 54 54 GLU HA H 139 5.205 4.672 0.533 1
1 534 . 5 1 1 A 54 54 GLU C C 139 175.700 175.030 0.670 1
1 535 . 5 1 1 A 54 54 GLU CA C 139 54.731 55.379 -0.648 1
1 536 . 5 1 1 A 54 54 GLU CB C 139 33.250 29.933 3.317 1
1 538 . 5 1 1 A 54 54 GLU N N 139 121.295 126.178 -4.883 1
1 539 . 5 1 1 A 55 55 THR H H 140 9.190 8.669 0.521 1
1 540 . 5 1 1 A 55 55 THR HA H 140 4.744 4.624 0.120 1
1 545 . 5 1 1 A 55 55 THR C C 140 174.537 173.575 0.962 1
1 546 . 5 1 1 A 55 55 THR CA C 140 62.678 61.512 1.166 1
1 547 . 5 1 1 A 55 55 THR CB C 140 69.744 69.079 0.665 1
1 549 . 5 1 1 A 55 55 THR N N 140 122.419 120.300 2.119 1
1 550 . 5 1 1 A 56 56 HIS H H 141 9.395 9.050 0.345 1
1 551 . 5 1 1 A 56 56 HIS HA H 141 5.204 5.006 0.198 1
1 556 . 5 1 1 A 56 56 HIS C C 141 174.675 174.493 0.182 1
1 557 . 5 1 1 A 56 56 HIS CA C 141 55.557 54.183 1.374 1
1 558 . 5 1 1 A 56 56 HIS CB C 141 31.279 30.500 0.779 1
1 561 . 5 1 1 A 56 56 HIS N N 141 125.732 125.320 0.412 1
1 564 . 5 1 1 A 57 57 PHE H H 142 8.790 8.058 0.732 1
1 565 . 5 1 1 A 57 57 PHE HA H 142 4.918 5.888 -0.970 1
1 571 . 5 1 1 A 57 57 PHE C C 142 172.293 174.089 -1.796 1
1 572 . 5 1 1 A 57 57 PHE CA C 142 56.366 55.316 1.050 1
1 573 . 5 1 1 A 57 57 PHE CB C 142 39.962 42.071 -2.109 1
1 575 . 5 1 1 A 57 57 PHE N N 142 117.009 121.685 -4.676 1
1 576 . 5 1 1 A 58 58 SER H H 143 8.890 8.815 0.075 1
1 577 . 5 1 1 A 58 58 SER HA H 143 5.286 5.009 0.277 1
1 580 . 5 1 1 A 58 58 SER C C 143 173.716 174.261 -0.545 1
1 581 . 5 1 1 A 58 58 SER CA C 143 57.517 58.564 -1.047 1
1 582 . 5 1 1 A 58 58 SER CB C 143 65.448 64.279 1.169 1
1 583 . 5 1 1 A 58 58 SER N N 143 115.269 119.917 -4.648 1
1 584 . 5 1 1 A 59 59 VAL H H 144 7.737 8.385 -0.648 1
1 585 . 5 1 1 A 59 59 VAL HA H 144 4.220 4.427 -0.207 1
1 593 . 5 1 1 A 59 59 VAL C C 144 176.234 176.088 0.146 1
1 594 . 5 1 1 A 59 59 VAL CA C 144 61.741 60.987 0.754 1
1 595 . 5 1 1 A 59 59 VAL CB C 144 33.711 33.966 -0.255 1
1 598 . 5 1 1 A 59 59 VAL N N 144 123.186 124.054 -0.868 1
1 599 . 5 1 1 A 60 60 GLY H H 145 8.945 9.016 -0.071 1
1 600 . 5 1 1 A 60 60 GLY HA2 H 145 4.027 3.739 0.288 1
1 601 . 5 1 1 A 60 60 GLY HA3 H 145 3.692 3.789 -0.097 1
1 602 . 5 1 1 A 60 60 GLY C C 145 175.182 174.590 0.592 1
1 603 . 5 1 1 A 60 60 GLY CA C 145 47.141 47.287 -0.146 1
1 604 . 5 1 1 A 60 60 GLY N N 145 116.908 117.675 -0.767 1
1 605 . 5 1 1 A 61 61 ASN H H 146 8.929 8.248 0.681 1
1 606 . 5 1 1 A 61 61 ASN HA H 146 4.718 4.725 -0.007 1
1 611 . 5 1 1 A 61 61 ASN C C 146 174.706 173.538 1.168 1
1 612 . 5 1 1 A 61 61 ASN CA C 146 52.802 52.662 0.140 1
1 613 . 5 1 1 A 61 61 ASN CB C 146 37.917 39.289 -1.372 1
1 614 . 5 1 1 A 61 61 ASN N N 146 123.976 124.216 -0.240 1
1 616 . 5 1 1 A 62 62 HIS H H 147 8.400 7.598 0.802 1
1 617 . 5 1 1 A 62 62 HIS HA H 147 4.762 5.121 -0.359 1
1 622 . 5 1 1 A 62 62 HIS C C 147 173.871 173.237 0.634 1
1 623 . 5 1 1 A 62 62 HIS CA C 147 55.374 54.860 0.514 1
1 624 . 5 1 1 A 62 62 HIS CB C 147 28.655 34.108 -5.453 1
1 628 . 5 1 1 A 62 62 HIS N N 147 118.620 118.180 0.440 1
1 631 . 5 1 1 A 63 63 ASP H H 148 8.734 8.896 -0.162 1
1 632 . 5 1 1 A 63 63 ASP HA H 148 4.785 5.412 -0.627 1
1 635 . 5 1 1 A 63 63 ASP C C 148 175.269 174.882 0.387 1
1 636 . 5 1 1 A 63 63 ASP CA C 148 54.390 52.666 1.724 1
1 637 . 5 1 1 A 63 63 ASP CB C 148 42.105 44.135 -2.030 1
1 638 . 5 1 1 A 63 63 ASP N N 148 125.336 119.985 5.351 1
1 639 . 5 1 1 A 64 64 CYS H H 149 8.225 9.106 -0.881 1
1 640 . 5 1 1 A 64 64 CYS HA H 149 5.118 5.325 -0.207 1
1 643 . 5 1 1 A 64 64 CYS C C 149 173.740 172.634 1.106 1
1 644 . 5 1 1 A 64 64 CYS CA C 149 55.423 56.572 -1.149 1
1 645 . 5 1 1 A 64 64 CYS CB C 149 29.972 31.473 -1.501 1
1 646 . 5 1 1 A 64 64 CYS N N 149 124.476 123.719 0.757 1
1 647 . 5 1 1 A 65 65 TYR H H 150 8.916 8.470 0.446 1
1 648 . 5 1 1 A 65 65 TYR HA H 150 5.121 4.514 0.607 1
1 655 . 5 1 1 A 65 65 TYR C C 150 172.821 172.104 0.717 1
1 656 . 5 1 1 A 65 65 TYR CA C 150 56.347 55.386 0.961 1
1 657 . 5 1 1 A 65 65 TYR CB C 150 38.901 41.358 -2.457 1
1 662 . 5 1 1 A 65 65 TYR N N 150 115.313 118.051 -2.738 1
1 663 . 5 1 1 A 66 66 ILE H H 151 8.423 9.252 -0.829 1
1 664 . 5 1 1 A 66 66 ILE HA H 151 5.000 4.421 0.579 1
1 674 . 5 1 1 A 66 66 ILE C C 151 176.225 174.582 1.643 1
1 675 . 5 1 1 A 66 66 ILE CA C 151 57.798 60.105 -2.307 1
1 676 . 5 1 1 A 66 66 ILE CB C 151 39.863 38.766 1.097 1
1 680 . 5 1 1 A 66 66 ILE N N 151 118.575 121.100 -2.525 1
1 681 . 5 1 1 A 67 67 LYS H H 152 9.480 8.951 0.529 1
1 682 . 5 1 1 A 67 67 LYS HA H 152 5.091 4.709 0.382 1
1 691 . 5 1 1 A 67 67 LYS C C 152 174.079 175.053 -0.974 1
1 692 . 5 1 1 A 67 67 LYS CA C 152 54.728 56.008 -1.280 1
1 693 . 5 1 1 A 67 67 LYS CB C 152 35.256 33.105 2.151 1
1 697 . 5 1 1 A 67 67 LYS N N 152 132.311 128.521 3.790 1
1 698 . 5 1 1 A 68 68 ALA H H 153 8.844 8.939 -0.095 1
1 699 . 5 1 1 A 68 68 ALA HA H 153 5.039 5.306 -0.267 1
1 703 . 5 1 1 A 68 68 ALA C C 153 176.587 176.528 0.059 1
1 704 . 5 1 1 A 68 68 ALA CA C 153 50.484 50.799 -0.315 1
1 705 . 5 1 1 A 68 68 ALA CB C 153 20.570 21.468 -0.898 1
1 706 . 5 1 1 A 68 68 ALA N N 153 129.958 130.265 -0.307 1
1 707 . 5 1 1 A 69 69 VAL H H 154 8.461 8.523 -0.062 1
1 708 . 5 1 1 A 69 69 VAL HA H 154 4.558 4.564 -0.006 1
1 716 . 5 1 1 A 69 69 VAL C C 154 175.331 175.200 0.131 1
1 717 . 5 1 1 A 69 69 VAL CA C 154 60.758 61.066 -0.308 1
1 718 . 5 1 1 A 69 69 VAL CB C 154 34.743 35.154 -0.411 1
1 721 . 5 1 1 A 69 69 VAL N N 154 121.496 121.838 -0.342 1
1 722 . 5 1 1 A 70 70 SER H H 155 8.695 8.565 0.130 1
1 723 . 5 1 1 A 70 70 SER HA H 155 4.646 5.091 -0.445 1
1 726 . 5 1 1 A 70 70 SER C C 155 174.690 173.919 0.771 1
1 727 . 5 1 1 A 70 70 SER CA C 155 58.065 57.109 0.956 1
1 728 . 5 1 1 A 70 70 SER CB C 155 64.062 64.989 -0.927 1
1 729 . 5 1 1 A 70 70 SER N N 155 119.763 122.876 -3.113 1
1 730 . 5 1 1 A 71 71 SER H H 156 8.360 8.819 -0.459 1
1 731 . 5 1 1 A 71 71 SER HA H 156 4.430 5.055 -0.625 1
1 734 . 5 1 1 A 71 71 SER CA C 156 58.491 56.835 1.656 1
1 735 . 5 1 1 A 71 71 SER CB C 156 64.061 66.146 -2.085 1
1 736 . 5 1 1 A 71 71 SER N N 156 118.577 114.683 3.894 1
1 737 . 5 1 1 A 72 72 GLY H H 157 8.542 8.425 0.117 1
1 738 . 5 1 1 A 72 72 GLY HA2 H 157 4.002 4.145 -0.143 1
1 739 . 5 1 1 A 72 72 GLY HA3 H 157 4.002 4.147 -0.145 1
1 740 . 5 1 1 A 72 72 GLY CA C 157 45.565 44.072 1.493 1
1 741 . 5 1 1 A 72 72 GLY N N 157 111.540 108.386 3.154 1
1 742 . 5 1 1 A 73 73 LYS H H 158 8.369 8.422 -0.053 1
1 743 . 5 1 1 A 73 73 LYS CA C 158 56.720 58.914 -2.194 1
1 744 . 5 1 1 A 73 73 LYS CB C 158 32.915 32.903 0.012 1
1 747 . 5 1 1 A 73 73 LYS N N 158 120.293 122.588 -2.295 1
1 748 . 5 1 1 A 74 74 ARG H H 159 8.181 8.025 0.156 1
1 749 . 5 1 1 A 74 74 ARG CA C 159 56.148 54.745 1.403 1
1 751 . 5 1 1 A 74 74 ARG N N 159 119.343 118.881 0.462 1
1 752 . 5 1 1 A 75 75 LYS H H 160 8.443 8.703 -0.260 1
1 753 . 5 1 1 A 75 75 LYS HA H 160 4.067 3.978 0.089 1
1 762 . 5 1 1 A 75 75 LYS C C 160 176.868 176.314 0.554 1
1 763 . 5 1 1 A 75 75 LYS CA C 160 57.711 57.184 0.527 1
1 764 . 5 1 1 A 75 75 LYS CB C 160 31.777 29.638 2.139 1
1 768 . 5 1 1 A 75 75 LYS N N 160 120.467 125.412 -4.945 1
1 769 . 5 1 1 A 76 76 GLU H H 161 8.693 8.062 0.631 1
1 770 . 5 1 1 A 76 76 GLU HA H 161 4.290 4.121 0.169 1
1 771 . 5 1 1 A 76 76 GLU C C 161 176.844 176.449 0.395 1
1 772 . 5 1 1 A 76 76 GLU CA C 161 57.294 59.153 -1.859 1
1 773 . 5 1 1 A 76 76 GLU CB C 161 29.794 30.644 -0.850 1
1 775 . 5 1 1 A 76 76 GLU N N 161 118.767 119.088 -0.321 1
1 776 . 5 1 1 A 77 77 GLY H H 162 8.168 7.683 0.485 1
1 777 . 5 1 1 A 77 77 GLY HA2 H 162 4.010 4.181 -0.171 1
1 778 . 5 1 1 A 77 77 GLY HA3 H 162 3.963 4.186 -0.223 1
1 779 . 5 1 1 A 77 77 GLY C C 162 173.512 171.699 1.813 1
1 780 . 5 1 1 A 77 77 GLY CA C 162 45.362 44.835 0.527 1
1 781 . 5 1 1 A 77 77 GLY N N 162 108.621 106.181 2.440 1
1 782 . 5 1 1 A 78 78 ILE H H 163 7.954 8.771 -0.817 1
1 783 . 5 1 1 A 78 78 ILE HA H 163 4.323 4.816 -0.493 1
1 793 . 5 1 1 A 78 78 ILE C C 163 175.402 175.228 0.174 1
1 794 . 5 1 1 A 78 78 ILE CA C 163 60.632 59.404 1.228 1
1 795 . 5 1 1 A 78 78 ILE CB C 163 39.759 40.831 -1.072 1
1 799 . 5 1 1 A 78 78 ILE N N 163 121.604 124.989 -3.385 1
1 800 . 5 1 1 A 79 79 ILE H H 164 8.514 8.732 -0.218 1
1 801 . 5 1 1 A 79 79 ILE HA H 164 4.341 4.922 -0.581 1
1 811 . 5 1 1 A 79 79 ILE C C 164 175.172 174.644 0.528 1
1 812 . 5 1 1 A 79 79 ILE CA C 164 60.027 59.996 0.031 1
1 813 . 5 1 1 A 79 79 ILE CB C 164 40.153 40.989 -0.836 1
1 817 . 5 1 1 A 79 79 ILE N N 164 127.137 125.880 1.257 1
1 818 . 5 1 1 A 80 80 HIS H H 165 8.492 9.156 -0.664 1
1 819 . 5 1 1 A 80 80 HIS HA H 165 5.676 5.489 0.187 1
1 824 . 5 1 1 A 80 80 HIS C C 165 175.502 174.342 1.160 1
1 825 . 5 1 1 A 80 80 HIS CA C 165 57.043 54.629 2.414 1
1 826 . 5 1 1 A 80 80 HIS CB C 165 32.741 32.262 0.479 1
1 829 . 5 1 1 A 80 80 HIS N N 165 125.422 125.994 -0.572 1
1 830 . 5 1 1 A 81 81 THR H H 166 9.080 9.487 -0.407 1
1 831 . 5 1 1 A 81 81 THR HA H 166 4.999 4.950 0.049 1
1 836 . 5 1 1 A 81 81 THR C C 166 171.877 172.750 -0.873 1
1 837 . 5 1 1 A 81 81 THR CA C 166 59.924 60.810 -0.886 1
1 838 . 5 1 1 A 81 81 THR CB C 166 72.243 71.105 1.138 1
1 840 . 5 1 1 A 81 81 THR N N 166 117.682 115.177 2.505 1
1 841 . 5 1 1 A 82 82 LEU H H 167 8.062 8.056 0.006 1
1 842 . 5 1 1 A 82 82 LEU HA H 167 4.350 4.015 0.335 1
1 852 . 5 1 1 A 82 82 LEU C C 167 172.705 174.866 -2.161 1
1 853 . 5 1 1 A 82 82 LEU CA C 167 53.553 54.867 -1.314 1
1 854 . 5 1 1 A 82 82 LEU CB C 167 39.768 41.632 -1.864 1
1 858 . 5 1 1 A 82 82 LEU N N 167 125.369 127.828 -2.459 1
1 859 . 5 1 1 A 83 83 ILE H H 168 8.657 8.222 0.435 1
1 860 . 5 1 1 A 83 83 ILE HA H 168 4.476 4.989 -0.513 1
1 870 . 5 1 1 A 83 83 ILE C C 168 175.159 174.237 0.922 1
1 871 . 5 1 1 A 83 83 ILE CA C 168 58.529 59.974 -1.445 1
1 872 . 5 1 1 A 83 83 ILE CB C 168 37.410 40.188 -2.778 1
1 876 . 5 1 1 A 83 83 ILE N N 168 128.042 127.556 0.486 1
1 877 . 5 1 1 A 84 84 VAL H H 169 8.464 8.398 0.066 1
1 878 . 5 1 1 A 84 84 VAL HA H 169 4.284 4.406 -0.122 1
1 886 . 5 1 1 A 84 84 VAL C C 169 176.138 175.923 0.215 1
1 887 . 5 1 1 A 84 84 VAL CA C 169 61.029 61.391 -0.362 1
1 888 . 5 1 1 A 84 84 VAL CB C 169 34.714 34.081 0.633 1
1 891 . 5 1 1 A 84 84 VAL N N 169 124.644 126.853 -2.209 1
1 892 . 5 1 1 A 85 85 ASP H H 170 9.158 9.268 -0.110 1
1 893 . 5 1 1 A 85 85 ASP HA H 170 4.362 4.293 0.069 1
1 896 . 5 1 1 A 85 85 ASP C C 170 175.489 175.334 0.155 1
1 897 . 5 1 1 A 85 85 ASP CA C 170 55.868 55.192 0.676 1
1 898 . 5 1 1 A 85 85 ASP CB C 170 38.927 39.453 -0.526 1
1 899 . 5 1 1 A 85 85 ASP N N 170 129.061 127.563 1.498 1
1 900 . 5 1 1 A 86 86 ASN H H 171 8.811 8.452 0.359 1
1 901 . 5 1 1 A 86 86 ASN HA H 171 4.053 4.347 -0.294 1
1 906 . 5 1 1 A 86 86 ASN C C 171 173.802 173.872 -0.070 1
1 907 . 5 1 1 A 86 86 ASN CA C 171 55.173 54.328 0.845 1
1 908 . 5 1 1 A 86 86 ASN CB C 171 38.150 37.376 0.774 1
1 909 . 5 1 1 A 86 86 ASN N N 171 108.418 114.954 -6.536 1
1 911 . 5 1 1 A 87 87 ARG H H 172 7.914 7.474 0.440 1
1 912 . 5 1 1 A 87 87 ARG HA H 172 4.597 4.658 -0.061 1
1 919 . 5 1 1 A 87 87 ARG C C 172 174.025 174.794 -0.769 1
1 920 . 5 1 1 A 87 87 ARG CA C 172 54.846 54.248 0.598 1
1 921 . 5 1 1 A 87 87 ARG CB C 172 32.697 33.428 -0.731 1
1 924 . 5 1 1 A 87 87 ARG N N 172 120.988 117.380 3.608 1
1 925 . 5 1 1 A 88 88 GLU H H 173 8.534 8.727 -0.193 1
1 926 . 5 1 1 A 88 88 GLU HA H 173 4.560 4.350 0.210 1
1 931 . 5 1 1 A 88 88 GLU C C 173 176.187 175.439 0.748 1
1 932 . 5 1 1 A 88 88 GLU CA C 173 56.044 56.852 -0.808 1
1 933 . 5 1 1 A 88 88 GLU CB C 173 30.329 30.395 -0.066 1
1 935 . 5 1 1 A 88 88 GLU N N 173 123.982 124.300 -0.318 1
1 936 . 5 1 1 A 89 89 ILE H H 174 8.897 8.066 0.831 1
1 937 . 5 1 1 A 89 89 ILE HA H 174 4.666 4.549 0.117 1
1 947 . 5 1 1 A 89 89 ILE C C 174 174.110 174.121 -0.011 1
1 948 . 5 1 1 A 89 89 ILE CA C 174 55.255 57.345 -2.090 1
1 949 . 5 1 1 A 89 89 ILE CB C 174 37.851 41.636 -3.785 1
1 953 . 5 1 1 A 89 89 ILE N N 174 130.008 127.279 2.729 1
1 954 . 5 1 1 A 90 90 PRO HA H 175 4.713 4.653 0.060 1
1 961 . 5 1 1 A 90 90 PRO C C 175 176.956 176.342 0.614 1
1 962 . 5 1 1 A 90 90 PRO CA C 175 63.159 62.903 0.256 1
1 963 . 5 1 1 A 90 90 PRO CB C 175 32.428 32.664 -0.236 1
1 966 . 5 1 1 A 91 91 GLU H H 176 8.778 8.699 0.079 1
1 967 . 5 1 1 A 91 91 GLU HA H 176 3.910 4.812 -0.902 1
1 972 . 5 1 1 A 91 91 GLU C C 176 176.426 175.887 0.539 1
1 973 . 5 1 1 A 91 91 GLU CA C 176 56.738 55.607 1.131 1
1 974 . 5 1 1 A 91 91 GLU CB C 176 30.540 30.541 -0.001 1
1 976 . 5 1 1 A 91 91 GLU N N 176 124.561 122.014 2.547 1
1 977 . 5 1 1 A 92 92 LEU H H 177 8.630 8.188 0.442 1
1 978 . 5 1 1 A 92 92 LEU HA H 177 4.419 4.318 0.101 1
1 988 . 5 1 1 A 92 92 LEU C C 177 177.162 176.235 0.927 1
1 989 . 5 1 1 A 92 92 LEU CA C 177 55.350 56.623 -1.273 1
1 990 . 5 1 1 A 92 92 LEU CB C 177 42.390 42.158 0.232 1
1 994 . 5 1 1 A 92 92 LEU N N 177 126.683 128.856 -2.173 1
1 995 . 5 1 1 A 93 93 THR H H 178 8.375 9.047 -0.672 1
1 996 . 5 1 1 A 93 93 THR HA H 178 4.359 4.507 -0.148 1
1 1001 . 5 1 1 A 93 93 THR C C 178 173.589 174.175 -0.586 1
1 1002 . 5 1 1 A 93 93 THR CA C 178 61.621 62.299 -0.678 1
1 1003 . 5 1 1 A 93 93 THR CB C 178 69.724 69.994 -0.270 1
1 1005 . 5 1 1 A 93 93 THR N N 178 119.699 117.097 2.602 1
1 1 . 6 1 1 A 9 9 SER H H 94 8.475 8.502 -0.027 1
1 2 . 6 1 1 A 9 9 SER CA C 94 58.531 57.376 1.155 1
1 3 . 6 1 1 A 9 9 SER N N 94 117.432 113.208 4.224 1
1 4 . 6 1 1 A 10 10 LYS H H 95 8.527 7.757 0.770 1
1 5 . 6 1 1 A 10 10 LYS C C 95 174.594 177.655 -3.061 1
1 6 . 6 1 1 A 10 10 LYS CA C 95 56.603 56.553 0.050 1
1 7 . 6 1 1 A 10 10 LYS N N 95 123.104 120.657 2.447 1
1 8 . 6 1 1 A 11 11 THR H H 96 8.245 7.682 0.563 1
1 9 . 6 1 1 A 11 11 THR C C 96 174.393 173.481 0.912 1
1 10 . 6 1 1 A 11 11 THR CA C 96 62.149 61.403 0.746 1
1 11 . 6 1 1 A 11 11 THR CB C 96 69.183 68.725 0.458 1
1 13 . 6 1 1 A 11 11 THR N N 96 113.245 105.406 7.839 1
1 14 . 6 1 1 A 12 12 THR H H 97 7.769 7.492 0.277 1
1 15 . 6 1 1 A 12 12 THR HA H 97 5.583 4.879 0.704 1
1 20 . 6 1 1 A 12 12 THR C C 97 174.726 172.561 2.165 1
1 21 . 6 1 1 A 12 12 THR CA C 97 59.602 60.837 -1.235 1
1 22 . 6 1 1 A 12 12 THR CB C 97 72.805 71.331 1.474 1
1 24 . 6 1 1 A 12 12 THR N N 97 113.440 112.211 1.229 1
1 25 . 6 1 1 A 13 13 SER H H 98 8.593 8.716 -0.123 1
1 26 . 6 1 1 A 13 13 SER HA H 98 4.448 5.021 -0.573 1
1 29 . 6 1 1 A 13 13 SER C C 98 171.426 172.957 -1.531 1
1 30 . 6 1 1 A 13 13 SER CA C 98 59.056 56.123 2.933 1
1 31 . 6 1 1 A 13 13 SER CB C 98 67.839 65.545 2.294 1
1 32 . 6 1 1 A 13 13 SER N N 98 119.042 120.302 -1.260 1
1 33 . 6 1 1 A 14 14 THR H H 99 8.155 8.131 0.024 1
1 34 . 6 1 1 A 14 14 THR HA H 99 5.383 5.206 0.177 1
1 39 . 6 1 1 A 14 14 THR C C 99 171.565 172.914 -1.349 1
1 40 . 6 1 1 A 14 14 THR CA C 99 61.291 59.455 1.836 1
1 41 . 6 1 1 A 14 14 THR CB C 99 71.654 72.264 -0.610 1
1 43 . 6 1 1 A 14 14 THR N N 99 118.204 113.192 5.012 1
1 44 . 6 1 1 A 15 15 TRP H H 100 9.637 8.844 0.793 1
1 45 . 6 1 1 A 15 15 TRP HA H 100 4.807 5.077 -0.270 1
1 54 . 6 1 1 A 15 15 TRP C C 100 174.399 175.280 -0.881 1
1 55 . 6 1 1 A 15 15 TRP CA C 100 58.302 56.049 2.253 1
1 56 . 6 1 1 A 15 15 TRP CB C 100 34.810 33.501 1.309 1
1 63 . 6 1 1 A 15 15 TRP N N 100 125.132 120.909 4.223 1
1 65 . 6 1 1 A 16 16 VAL H H 101 8.863 9.014 -0.151 1
1 66 . 6 1 1 A 16 16 VAL HA H 101 5.267 4.760 0.507 1
1 74 . 6 1 1 A 16 16 VAL C C 101 174.955 175.340 -0.385 1
1 75 . 6 1 1 A 16 16 VAL CA C 101 60.653 61.752 -1.099 1
1 76 . 6 1 1 A 16 16 VAL CB C 101 34.284 32.957 1.327 1
1 79 . 6 1 1 A 16 16 VAL N N 101 119.527 123.707 -4.180 1
1 80 . 6 1 1 A 17 17 LEU H H 102 8.961 8.914 0.047 1
1 81 . 6 1 1 A 17 17 LEU HA H 102 4.729 5.067 -0.338 1
1 91 . 6 1 1 A 17 17 LEU C C 102 173.559 175.067 -1.508 1
1 92 . 6 1 1 A 17 17 LEU CA C 102 55.144 53.111 2.033 1
1 93 . 6 1 1 A 17 17 LEU CB C 102 42.948 45.908 -2.960 1
1 97 . 6 1 1 A 17 17 LEU N N 102 124.280 123.821 0.459 1
1 98 . 6 1 1 A 18 18 ARG H H 103 8.305 8.401 -0.096 1
1 99 . 6 1 1 A 18 18 ARG HA H 103 5.139 4.628 0.511 1
1 106 . 6 1 1 A 18 18 ARG C C 103 175.347 175.166 0.181 1
1 107 . 6 1 1 A 18 18 ARG CA C 103 54.793 56.103 -1.310 1
1 108 . 6 1 1 A 18 18 ARG CB C 103 31.347 29.645 1.702 1
1 111 . 6 1 1 A 18 18 ARG N N 103 122.020 120.089 1.931 1
1 112 . 6 1 1 A 19 19 LEU H H 104 8.676 8.751 -0.075 1
1 113 . 6 1 1 A 19 19 LEU HA H 104 4.482 4.769 -0.287 1
1 123 . 6 1 1 A 19 19 LEU C C 104 175.957 175.961 -0.004 1
1 124 . 6 1 1 A 19 19 LEU CA C 104 53.581 53.574 0.007 1
1 125 . 6 1 1 A 19 19 LEU CB C 104 45.697 45.225 0.472 1
1 129 . 6 1 1 A 19 19 LEU N N 104 126.378 124.991 1.387 1
1 130 . 6 1 1 A 20 20 ASP H H 105 9.390 9.425 -0.035 1
1 131 . 6 1 1 A 20 20 ASP HA H 105 4.287 4.425 -0.138 1
1 134 . 6 1 1 A 20 20 ASP C C 105 175.947 175.418 0.529 1
1 135 . 6 1 1 A 20 20 ASP CA C 105 55.263 55.108 0.155 1
1 136 . 6 1 1 A 20 20 ASP CB C 105 39.239 39.937 -0.698 1
1 137 . 6 1 1 A 20 20 ASP N N 105 125.208 125.931 -0.723 1
1 138 . 6 1 1 A 21 21 GLY H H 106 8.563 8.610 -0.047 1
1 139 . 6 1 1 A 21 21 GLY HA2 H 106 4.126 3.824 0.302 1
1 140 . 6 1 1 A 21 21 GLY HA3 H 106 3.509 3.833 -0.324 1
1 141 . 6 1 1 A 21 21 GLY C C 106 173.164 173.693 -0.529 1
1 142 . 6 1 1 A 21 21 GLY CA C 106 45.499 45.528 -0.029 1
1 143 . 6 1 1 A 21 21 GLY N N 106 103.331 104.766 -1.435 1
1 144 . 6 1 1 A 22 22 GLU H H 107 7.713 7.988 -0.275 1
1 145 . 6 1 1 A 22 22 GLU HA H 107 4.634 4.915 -0.281 1
1 150 . 6 1 1 A 22 22 GLU C C 107 174.800 174.959 -0.159 1
1 151 . 6 1 1 A 22 22 GLU CA C 107 54.329 54.355 -0.026 1
1 152 . 6 1 1 A 22 22 GLU CB C 107 32.832 34.089 -1.257 1
1 154 . 6 1 1 A 22 22 GLU N N 107 119.470 119.334 0.136 1
1 155 . 6 1 1 A 23 23 ASP H H 108 8.632 8.555 0.077 1
1 156 . 6 1 1 A 23 23 ASP HA H 108 4.872 4.698 0.174 1
1 159 . 6 1 1 A 23 23 ASP C C 108 175.533 175.480 0.053 1
1 160 . 6 1 1 A 23 23 ASP CA C 108 55.180 53.921 1.259 1
1 161 . 6 1 1 A 23 23 ASP CB C 108 41.504 39.501 2.003 1
1 162 . 6 1 1 A 23 23 ASP N N 108 122.815 121.514 1.301 1
1 163 . 6 1 1 A 24 24 LEU H H 109 9.248 8.872 0.376 1
1 164 . 6 1 1 A 24 24 LEU HA H 109 4.836 4.559 0.277 1
1 174 . 6 1 1 A 24 24 LEU C C 109 174.322 175.791 -1.469 1
1 175 . 6 1 1 A 24 24 LEU CA C 109 54.473 55.273 -0.800 1
1 176 . 6 1 1 A 24 24 LEU CB C 109 44.718 42.647 2.071 1
1 180 . 6 1 1 A 24 24 LEU N N 109 125.550 126.628 -1.078 1
1 181 . 6 1 1 A 25 25 ARG H H 110 8.503 8.917 -0.414 1
1 182 . 6 1 1 A 25 25 ARG HA H 110 5.228 4.844 0.384 1
1 189 . 6 1 1 A 25 25 ARG C C 110 175.174 174.459 0.715 1
1 190 . 6 1 1 A 25 25 ARG CA C 110 54.745 54.668 0.077 1
1 191 . 6 1 1 A 25 25 ARG CB C 110 31.701 31.706 -0.005 1
1 194 . 6 1 1 A 25 25 ARG N N 110 125.424 127.472 -2.048 1
1 195 . 6 1 1 A 26 26 VAL H H 111 9.692 9.101 0.591 1
1 196 . 6 1 1 A 26 26 VAL HA H 111 5.091 4.961 0.130 1
1 204 . 6 1 1 A 26 26 VAL C C 111 174.446 175.334 -0.888 1
1 205 . 6 1 1 A 26 26 VAL CA C 111 61.055 61.870 -0.815 1
1 206 . 6 1 1 A 26 26 VAL CB C 111 33.780 33.200 0.580 1
1 209 . 6 1 1 A 26 26 VAL N N 111 130.649 127.418 3.231 1
1 210 . 6 1 1 A 27 27 VAL H H 112 9.401 8.976 0.425 1
1 211 . 6 1 1 A 27 27 VAL HA H 112 5.188 4.700 0.488 1
1 219 . 6 1 1 A 27 27 VAL C C 112 174.214 174.263 -0.049 1
1 220 . 6 1 1 A 27 27 VAL CA C 112 60.722 60.930 -0.208 1
1 221 . 6 1 1 A 27 27 VAL CB C 112 36.082 35.070 1.012 1
1 224 . 6 1 1 A 27 27 VAL N N 112 127.416 127.537 -0.121 1
1 225 . 6 1 1 A 28 28 LEU H H 113 9.265 9.201 0.064 1
1 226 . 6 1 1 A 28 28 LEU HA H 113 5.337 5.312 0.025 1
1 236 . 6 1 1 A 28 28 LEU C C 113 175.915 174.900 1.015 1
1 237 . 6 1 1 A 28 28 LEU CA C 113 52.599 53.293 -0.694 1
1 238 . 6 1 1 A 28 28 LEU CB C 113 47.495 44.754 2.741 1
1 242 . 6 1 1 A 28 28 LEU N N 113 127.527 129.895 -2.368 1
1 243 . 6 1 1 A 29 29 GLU H H 114 8.968 8.670 0.298 1
1 244 . 6 1 1 A 29 29 GLU HA H 114 4.701 4.378 0.323 1
1 249 . 6 1 1 A 29 29 GLU C C 114 176.715 177.422 -0.707 1
1 250 . 6 1 1 A 29 29 GLU CA C 114 55.342 56.272 -0.930 1
1 251 . 6 1 1 A 29 29 GLU CB C 114 30.005 30.606 -0.601 1
1 253 . 6 1 1 A 29 29 GLU N N 114 127.374 127.254 0.120 1
1 254 . 6 1 1 A 30 30 LYS H H 115 8.243 8.592 -0.349 1
1 255 . 6 1 1 A 30 30 LYS HA H 115 3.711 4.164 -0.453 1
1 264 . 6 1 1 A 30 30 LYS C C 115 177.137 178.057 -0.920 1
1 265 . 6 1 1 A 30 30 LYS CA C 115 60.118 58.779 1.339 1
1 266 . 6 1 1 A 30 30 LYS CB C 115 32.656 32.096 0.560 1
1 270 . 6 1 1 A 30 30 LYS N N 115 124.225 125.104 -0.879 1
1 271 . 6 1 1 A 31 31 ASP H H 116 9.200 8.008 1.192 1
1 272 . 6 1 1 A 31 31 ASP HA H 116 4.444 4.382 0.062 1
1 275 . 6 1 1 A 31 31 ASP C C 116 177.774 176.989 0.785 1
1 276 . 6 1 1 A 31 31 ASP CA C 116 56.703 57.356 -0.653 1
1 277 . 6 1 1 A 31 31 ASP CB C 116 40.236 41.204 -0.968 1
1 278 . 6 1 1 A 31 31 ASP N N 116 115.955 119.460 -3.505 1
1 279 . 6 1 1 A 32 32 THR H H 117 7.352 7.609 -0.257 1
1 280 . 6 1 1 A 32 32 THR HA H 117 4.266 4.600 -0.334 1
1 285 . 6 1 1 A 32 32 THR C C 117 175.320 174.004 1.316 1
1 286 . 6 1 1 A 32 32 THR CA C 117 61.171 60.792 0.379 1
1 287 . 6 1 1 A 32 32 THR CB C 117 70.221 69.432 0.789 1
1 289 . 6 1 1 A 32 32 THR N N 117 106.440 108.900 -2.460 1
1 290 . 6 1 1 A 33 33 MET H H 118 8.216 7.918 0.298 1
1 291 . 6 1 1 A 33 33 MET HA H 118 4.184 4.389 -0.205 1
1 299 . 6 1 1 A 33 33 MET C C 118 174.952 175.029 -0.077 1
1 300 . 6 1 1 A 33 33 MET CA C 118 55.195 56.734 -1.539 1
1 301 . 6 1 1 A 33 33 MET CB C 118 25.900 31.507 -5.607 1
1 304 . 6 1 1 A 33 33 MET N N 118 115.956 117.297 -1.341 1
1 305 . 6 1 1 A 34 34 ASP H H 119 7.509 7.884 -0.375 1
1 306 . 6 1 1 A 34 34 ASP HA H 119 4.486 4.548 -0.062 1
1 309 . 6 1 1 A 34 34 ASP C C 119 174.375 175.828 -1.453 1
1 310 . 6 1 1 A 34 34 ASP CA C 119 54.745 55.060 -0.315 1
1 311 . 6 1 1 A 34 34 ASP CB C 119 42.865 41.718 1.147 1
1 312 . 6 1 1 A 34 34 ASP N N 119 118.500 119.859 -1.359 1
1 313 . 6 1 1 A 35 35 VAL H H 120 8.473 8.830 -0.357 1
1 314 . 6 1 1 A 35 35 VAL HA H 120 4.709 4.601 0.108 1
1 322 . 6 1 1 A 35 35 VAL C C 120 173.900 174.414 -0.514 1
1 323 . 6 1 1 A 35 35 VAL CA C 120 60.736 61.217 -0.481 1
1 324 . 6 1 1 A 35 35 VAL CB C 120 34.662 33.035 1.627 1
1 327 . 6 1 1 A 35 35 VAL N N 120 121.116 123.116 -2.000 1
1 328 . 6 1 1 A 36 36 TRP H H 121 9.404 9.590 -0.186 1
1 329 . 6 1 1 A 36 36 TRP HA H 121 5.174 5.249 -0.075 1
1 338 . 6 1 1 A 36 36 TRP C C 121 176.480 174.786 1.694 1
1 339 . 6 1 1 A 36 36 TRP CA C 121 55.070 55.499 -0.429 1
1 340 . 6 1 1 A 36 36 TRP CB C 121 32.179 32.851 -0.672 1
1 348 . 6 1 1 A 36 36 TRP N N 121 126.924 129.781 -2.857 1
1 350 . 6 1 1 A 37 37 CYS H H 122 9.230 9.249 -0.019 1
1 351 . 6 1 1 A 37 37 CYS HA H 122 5.417 4.861 0.556 1
1 354 . 6 1 1 A 37 37 CYS C C 122 175.346 174.444 0.902 1
1 355 . 6 1 1 A 37 37 CYS CA C 122 57.083 57.840 -0.757 1
1 356 . 6 1 1 A 37 37 CYS CB C 122 28.713 29.608 -0.895 1
1 357 . 6 1 1 A 37 37 CYS N N 122 120.375 125.291 -4.916 1
1 358 . 6 1 1 A 38 38 ASN H H 123 9.817 8.930 0.887 1
1 359 . 6 1 1 A 38 38 ASN HA H 123 4.637 4.213 0.424 1
1 364 . 6 1 1 A 38 38 ASN C C 123 175.526 175.180 0.346 1
1 365 . 6 1 1 A 38 38 ASN CA C 123 54.023 54.316 -0.293 1
1 366 . 6 1 1 A 38 38 ASN CB C 123 36.581 37.131 -0.550 1
1 367 . 6 1 1 A 38 38 ASN N N 123 129.408 125.631 3.777 1
1 369 . 6 1 1 A 39 39 GLY H H 124 9.092 7.973 1.119 1
1 370 . 6 1 1 A 39 39 GLY HA2 H 124 4.241 3.453 0.788 1
1 371 . 6 1 1 A 39 39 GLY HA3 H 124 3.705 3.778 -0.073 1
1 372 . 6 1 1 A 39 39 GLY C C 124 173.405 173.893 -0.488 1
1 373 . 6 1 1 A 39 39 GLY CA C 124 45.595 46.666 -1.071 1
1 374 . 6 1 1 A 39 39 GLY N N 124 102.752 103.046 -0.294 1
1 375 . 6 1 1 A 40 40 GLN H H 125 8.006 7.682 0.324 1
1 376 . 6 1 1 A 40 40 GLN HA H 125 4.736 4.869 -0.133 1
1 383 . 6 1 1 A 40 40 GLN C C 125 174.477 174.964 -0.487 1
1 384 . 6 1 1 A 40 40 GLN CA C 125 53.747 55.057 -1.310 1
1 385 . 6 1 1 A 40 40 GLN CB C 125 30.413 31.158 -0.745 1
1 387 . 6 1 1 A 40 40 GLN N N 125 120.627 119.268 1.359 1
1 389 . 6 1 1 A 41 41 LYS H H 126 8.757 8.819 -0.062 1
1 390 . 6 1 1 A 41 41 LYS HA H 126 3.464 4.415 -0.951 1
1 399 . 6 1 1 A 41 41 LYS C C 126 176.870 175.281 1.589 1
1 400 . 6 1 1 A 41 41 LYS CA C 126 57.136 56.860 0.276 1
1 401 . 6 1 1 A 41 41 LYS CB C 126 31.669 33.522 -1.853 1
1 405 . 6 1 1 A 41 41 LYS N N 126 129.107 129.004 0.103 1
1 406 . 6 1 1 A 42 42 MET H H 127 8.682 8.698 -0.016 1
1 407 . 6 1 1 A 42 42 MET HA H 127 4.712 5.271 -0.559 1
1 415 . 6 1 1 A 42 42 MET C C 127 176.816 174.113 2.703 1
1 416 . 6 1 1 A 42 42 MET CA C 127 52.958 53.726 -0.768 1
1 417 . 6 1 1 A 42 42 MET CB C 127 33.023 37.078 -4.055 1
1 420 . 6 1 1 A 42 42 MET N N 127 126.569 121.233 5.336 1
1 421 . 6 1 1 A 43 43 GLU H H 128 8.734 8.973 -0.239 1
1 422 . 6 1 1 A 43 43 GLU HA H 128 4.419 4.985 -0.566 1
1 427 . 6 1 1 A 43 43 GLU C C 128 176.531 176.210 0.321 1
1 428 . 6 1 1 A 43 43 GLU CA C 128 56.475 55.151 1.324 1
1 429 . 6 1 1 A 43 43 GLU CB C 128 29.604 31.847 -2.243 1
1 431 . 6 1 1 A 43 43 GLU N N 128 123.734 122.610 1.124 1
1 432 . 6 1 1 A 44 44 THR H H 129 8.263 8.897 -0.634 1
1 433 . 6 1 1 A 44 44 THR HA H 129 5.385 5.310 0.075 1
1 438 . 6 1 1 A 44 44 THR C C 129 174.205 174.706 -0.501 1
1 439 . 6 1 1 A 44 44 THR CA C 129 59.160 60.420 -1.260 1
1 440 . 6 1 1 A 44 44 THR CB C 129 72.419 71.773 0.646 1
1 442 . 6 1 1 A 44 44 THR N N 129 115.081 117.953 -2.872 1
1 443 . 6 1 1 A 45 45 ALA H H 130 8.727 8.184 0.543 1
1 444 . 6 1 1 A 45 45 ALA HA H 130 4.749 4.361 0.388 1
1 448 . 6 1 1 A 45 45 ALA C C 130 177.017 177.992 -0.975 1
1 449 . 6 1 1 A 45 45 ALA CA C 130 51.645 52.452 -0.807 1
1 450 . 6 1 1 A 45 45 ALA CB C 130 21.364 20.392 0.972 1
1 451 . 6 1 1 A 45 45 ALA N N 130 123.243 122.892 0.351 1
1 452 . 6 1 1 A 46 46 GLY H H 131 8.818 8.122 0.696 1
1 453 . 6 1 1 A 46 46 GLY HA2 H 131 4.941 3.901 1.040 1
1 454 . 6 1 1 A 46 46 GLY HA3 H 131 3.690 3.935 -0.245 1
1 455 . 6 1 1 A 46 46 GLY C C 131 173.528 174.422 -0.894 1
1 456 . 6 1 1 A 46 46 GLY CA C 131 45.060 46.938 -1.878 1
1 457 . 6 1 1 A 46 46 GLY N N 131 112.392 107.429 4.963 1
1 458 . 6 1 1 A 47 47 GLU H H 132 8.746 7.872 0.874 1
1 459 . 6 1 1 A 47 47 GLU HA H 132 4.584 4.717 -0.133 1
1 464 . 6 1 1 A 47 47 GLU C C 132 175.223 174.991 0.232 1
1 465 . 6 1 1 A 47 47 GLU CA C 132 55.008 55.385 -0.377 1
1 466 . 6 1 1 A 47 47 GLU CB C 132 32.939 31.677 1.262 1
1 468 . 6 1 1 A 47 47 GLU N N 132 122.107 119.778 2.329 1
1 469 . 6 1 1 A 48 48 PHE H H 133 8.920 9.141 -0.221 1
1 470 . 6 1 1 A 48 48 PHE HA H 133 4.822 4.864 -0.042 1
1 475 . 6 1 1 A 48 48 PHE C C 133 175.499 175.755 -0.256 1
1 476 . 6 1 1 A 48 48 PHE CA C 133 58.320 57.652 0.668 1
1 477 . 6 1 1 A 48 48 PHE CB C 133 39.175 39.543 -0.368 1
1 479 . 6 1 1 A 48 48 PHE N N 133 124.006 125.397 -1.391 1
1 480 . 6 1 1 A 49 49 VAL H H 134 8.161 8.518 -0.357 1
1 481 . 6 1 1 A 49 49 VAL HA H 134 4.492 4.609 -0.117 1
1 489 . 6 1 1 A 49 49 VAL C C 134 176.241 177.068 -0.827 1
1 490 . 6 1 1 A 49 49 VAL CA C 134 60.328 60.378 -0.050 1
1 491 . 6 1 1 A 49 49 VAL CB C 134 34.542 34.520 0.022 1
1 494 . 6 1 1 A 49 49 VAL N N 134 120.063 123.743 -3.680 1
1 495 . 6 1 1 A 50 50 ASP H H 135 8.596 8.730 -0.134 1
1 496 . 6 1 1 A 50 50 ASP HA H 135 4.278 4.384 -0.106 1
1 499 . 6 1 1 A 50 50 ASP C C 135 176.567 176.733 -0.166 1
1 500 . 6 1 1 A 50 50 ASP CA C 135 57.149 57.051 0.098 1
1 501 . 6 1 1 A 50 50 ASP CB C 135 40.477 40.751 -0.274 1
1 502 . 6 1 1 A 50 50 ASP N N 135 122.137 122.627 -0.490 1
1 503 . 6 1 1 A 51 51 ASP H H 136 8.328 7.723 0.605 1
1 504 . 6 1 1 A 51 51 ASP HA H 136 4.656 5.056 -0.400 1
1 507 . 6 1 1 A 51 51 ASP C C 136 175.798 174.814 0.984 1
1 508 . 6 1 1 A 51 51 ASP CA C 136 53.458 53.387 0.071 1
1 509 . 6 1 1 A 51 51 ASP CB C 136 40.306 42.244 -1.938 1
1 510 . 6 1 1 A 51 51 ASP N N 136 116.158 116.319 -0.161 1
1 511 . 6 1 1 A 52 52 GLY H H 137 7.653 8.576 -0.923 1
1 512 . 6 1 1 A 52 52 GLY HA2 H 137 4.685 4.104 0.581 1
1 513 . 6 1 1 A 52 52 GLY HA3 H 137 4.069 4.134 -0.065 1
1 514 . 6 1 1 A 52 52 GLY C C 137 173.149 172.660 0.489 1
1 515 . 6 1 1 A 52 52 GLY CA C 137 45.860 44.226 1.634 1
1 516 . 6 1 1 A 52 52 GLY N N 137 107.634 112.045 -4.411 1
1 517 . 6 1 1 A 53 53 THR H H 138 8.445 8.094 0.351 1
1 518 . 6 1 1 A 53 53 THR HA H 138 4.996 4.768 0.228 1
1 523 . 6 1 1 A 53 53 THR C C 138 174.163 173.115 1.048 1
1 524 . 6 1 1 A 53 53 THR CA C 138 60.974 61.259 -0.285 1
1 525 . 6 1 1 A 53 53 THR CB C 138 72.266 71.607 0.659 1
1 527 . 6 1 1 A 53 53 THR N N 138 114.976 114.779 0.197 1
1 528 . 6 1 1 A 54 54 GLU H H 139 8.917 8.351 0.566 1
1 529 . 6 1 1 A 54 54 GLU HA H 139 5.205 4.697 0.508 1
1 534 . 6 1 1 A 54 54 GLU C C 139 175.700 175.259 0.441 1
1 535 . 6 1 1 A 54 54 GLU CA C 139 54.731 55.108 -0.377 1
1 536 . 6 1 1 A 54 54 GLU CB C 139 33.250 30.239 3.011 1
1 538 . 6 1 1 A 54 54 GLU N N 139 121.295 125.340 -4.045 1
1 539 . 6 1 1 A 55 55 THR H H 140 9.190 8.381 0.809 1
1 540 . 6 1 1 A 55 55 THR HA H 140 4.744 4.419 0.325 1
1 545 . 6 1 1 A 55 55 THR C C 140 174.537 173.399 1.138 1
1 546 . 6 1 1 A 55 55 THR CA C 140 62.678 61.944 0.734 1
1 547 . 6 1 1 A 55 55 THR CB C 140 69.744 68.710 1.034 1
1 549 . 6 1 1 A 55 55 THR N N 140 122.419 120.586 1.833 1
1 550 . 6 1 1 A 56 56 HIS H H 141 9.395 8.826 0.569 1
1 551 . 6 1 1 A 56 56 HIS HA H 141 5.204 4.974 0.230 1
1 556 . 6 1 1 A 56 56 HIS C C 141 174.675 175.034 -0.359 1
1 557 . 6 1 1 A 56 56 HIS CA C 141 55.557 54.114 1.443 1
1 558 . 6 1 1 A 56 56 HIS CB C 141 31.279 30.360 0.919 1
1 561 . 6 1 1 A 56 56 HIS N N 141 125.732 125.454 0.278 1
1 564 . 6 1 1 A 57 57 PHE H H 142 8.790 8.397 0.393 1
1 565 . 6 1 1 A 57 57 PHE HA H 142 4.918 5.640 -0.722 1
1 571 . 6 1 1 A 57 57 PHE C C 142 172.293 172.958 -0.665 1
1 572 . 6 1 1 A 57 57 PHE CA C 142 56.366 55.283 1.083 1
1 573 . 6 1 1 A 57 57 PHE CB C 142 39.962 41.695 -1.733 1
1 575 . 6 1 1 A 57 57 PHE N N 142 117.009 121.834 -4.825 1
1 576 . 6 1 1 A 58 58 SER H H 143 8.890 9.138 -0.248 1
1 577 . 6 1 1 A 58 58 SER HA H 143 5.286 5.439 -0.153 1
1 580 . 6 1 1 A 58 58 SER C C 143 173.716 173.112 0.604 1
1 581 . 6 1 1 A 58 58 SER CA C 143 57.517 57.190 0.327 1
1 582 . 6 1 1 A 58 58 SER CB C 143 65.448 66.728 -1.280 1
1 583 . 6 1 1 A 58 58 SER N N 143 115.269 112.687 2.582 1
1 584 . 6 1 1 A 59 59 VAL H H 144 7.737 8.726 -0.989 1
1 585 . 6 1 1 A 59 59 VAL HA H 144 4.220 4.436 -0.216 1
1 593 . 6 1 1 A 59 59 VAL C C 144 176.234 176.054 0.180 1
1 594 . 6 1 1 A 59 59 VAL CA C 144 61.741 60.752 0.989 1
1 595 . 6 1 1 A 59 59 VAL CB C 144 33.711 33.431 0.280 1
1 598 . 6 1 1 A 59 59 VAL N N 144 123.186 121.102 2.084 1
1 599 . 6 1 1 A 60 60 GLY H H 145 8.945 9.018 -0.073 1
1 600 . 6 1 1 A 60 60 GLY HA2 H 145 4.027 3.718 0.309 1
1 601 . 6 1 1 A 60 60 GLY HA3 H 145 3.692 3.788 -0.096 1
1 602 . 6 1 1 A 60 60 GLY C C 145 175.182 174.636 0.546 1
1 603 . 6 1 1 A 60 60 GLY CA C 145 47.141 47.267 -0.126 1
1 604 . 6 1 1 A 60 60 GLY N N 145 116.908 118.270 -1.362 1
1 605 . 6 1 1 A 61 61 ASN H H 146 8.929 8.452 0.477 1
1 606 . 6 1 1 A 61 61 ASN HA H 146 4.718 4.822 -0.104 1
1 611 . 6 1 1 A 61 61 ASN C C 146 174.706 174.171 0.535 1
1 612 . 6 1 1 A 61 61 ASN CA C 146 52.802 52.728 0.074 1
1 613 . 6 1 1 A 61 61 ASN CB C 146 37.917 38.693 -0.776 1
1 614 . 6 1 1 A 61 61 ASN N N 146 123.976 124.841 -0.865 1
1 616 . 6 1 1 A 62 62 HIS H H 147 8.400 7.680 0.720 1
1 617 . 6 1 1 A 62 62 HIS HA H 147 4.762 4.978 -0.216 1
1 622 . 6 1 1 A 62 62 HIS C C 147 173.871 173.724 0.147 1
1 623 . 6 1 1 A 62 62 HIS CA C 147 55.374 54.613 0.761 1
1 624 . 6 1 1 A 62 62 HIS CB C 147 28.655 33.665 -5.010 1
1 628 . 6 1 1 A 62 62 HIS N N 147 118.620 117.918 0.702 1
1 631 . 6 1 1 A 63 63 ASP H H 148 8.734 8.882 -0.148 1
1 632 . 6 1 1 A 63 63 ASP HA H 148 4.785 5.186 -0.401 1
1 635 . 6 1 1 A 63 63 ASP C C 148 175.269 174.417 0.852 1
1 636 . 6 1 1 A 63 63 ASP CA C 148 54.390 54.286 0.104 1
1 637 . 6 1 1 A 63 63 ASP CB C 148 42.105 43.089 -0.984 1
1 638 . 6 1 1 A 63 63 ASP N N 148 125.336 119.950 5.386 1
1 639 . 6 1 1 A 64 64 CYS H H 149 8.225 9.235 -1.010 1
1 640 . 6 1 1 A 64 64 CYS HA H 149 5.118 5.384 -0.266 1
1 643 . 6 1 1 A 64 64 CYS C C 149 173.740 172.786 0.954 1
1 644 . 6 1 1 A 64 64 CYS CA C 149 55.423 56.697 -1.274 1
1 645 . 6 1 1 A 64 64 CYS CB C 149 29.972 32.633 -2.661 1
1 646 . 6 1 1 A 64 64 CYS N N 149 124.476 123.265 1.211 1
1 647 . 6 1 1 A 65 65 TYR H H 150 8.916 8.739 0.177 1
1 648 . 6 1 1 A 65 65 TYR HA H 150 5.121 3.506 1.615 1
1 655 . 6 1 1 A 65 65 TYR C C 150 172.821 171.890 0.931 1
1 656 . 6 1 1 A 65 65 TYR CA C 150 56.347 55.483 0.864 1
1 657 . 6 1 1 A 65 65 TYR CB C 150 38.901 40.566 -1.665 1
1 662 . 6 1 1 A 65 65 TYR N N 150 115.313 117.060 -1.747 1
1 663 . 6 1 1 A 66 66 ILE H H 151 8.423 8.182 0.241 1
1 664 . 6 1 1 A 66 66 ILE HA H 151 5.000 4.276 0.724 1
1 674 . 6 1 1 A 66 66 ILE C C 151 176.225 174.763 1.462 1
1 675 . 6 1 1 A 66 66 ILE CA C 151 57.798 59.956 -2.158 1
1 676 . 6 1 1 A 66 66 ILE CB C 151 39.863 38.819 1.044 1
1 680 . 6 1 1 A 66 66 ILE N N 151 118.575 120.640 -2.065 1
1 681 . 6 1 1 A 67 67 LYS H H 152 9.480 8.835 0.645 1
1 682 . 6 1 1 A 67 67 LYS HA H 152 5.091 4.662 0.429 1
1 691 . 6 1 1 A 67 67 LYS C C 152 174.079 175.119 -1.040 1
1 692 . 6 1 1 A 67 67 LYS CA C 152 54.728 56.113 -1.385 1
1 693 . 6 1 1 A 67 67 LYS CB C 152 35.256 33.138 2.118 1
1 697 . 6 1 1 A 67 67 LYS N N 152 132.311 128.411 3.900 1
1 698 . 6 1 1 A 68 68 ALA H H 153 8.844 8.304 0.540 1
1 699 . 6 1 1 A 68 68 ALA HA H 153 5.039 5.462 -0.423 1
1 703 . 6 1 1 A 68 68 ALA C C 153 176.587 176.234 0.353 1
1 704 . 6 1 1 A 68 68 ALA CA C 153 50.484 50.552 -0.068 1
1 705 . 6 1 1 A 68 68 ALA CB C 153 20.570 21.816 -1.246 1
1 706 . 6 1 1 A 68 68 ALA N N 153 129.958 129.365 0.593 1
1 707 . 6 1 1 A 69 69 VAL H H 154 8.461 8.558 -0.097 1
1 708 . 6 1 1 A 69 69 VAL HA H 154 4.558 4.643 -0.085 1
1 716 . 6 1 1 A 69 69 VAL C C 154 175.331 175.030 0.301 1
1 717 . 6 1 1 A 69 69 VAL CA C 154 60.758 60.639 0.119 1
1 718 . 6 1 1 A 69 69 VAL CB C 154 34.743 35.811 -1.068 1
1 721 . 6 1 1 A 69 69 VAL N N 154 121.496 121.238 0.258 1
1 722 . 6 1 1 A 70 70 SER H H 155 8.695 9.004 -0.309 1
1 723 . 6 1 1 A 70 70 SER HA H 155 4.646 5.448 -0.802 1
1 726 . 6 1 1 A 70 70 SER C C 155 174.690 173.667 1.023 1
1 727 . 6 1 1 A 70 70 SER CA C 155 58.065 56.827 1.238 1
1 728 . 6 1 1 A 70 70 SER CB C 155 64.062 64.746 -0.684 1
1 729 . 6 1 1 A 70 70 SER N N 155 119.763 121.691 -1.928 1
1 730 . 6 1 1 A 71 71 SER H H 156 8.360 9.061 -0.701 1
1 731 . 6 1 1 A 71 71 SER HA H 156 4.430 5.122 -0.692 1
1 734 . 6 1 1 A 71 71 SER CA C 156 58.491 56.786 1.705 1
1 735 . 6 1 1 A 71 71 SER CB C 156 64.061 66.169 -2.108 1
1 736 . 6 1 1 A 71 71 SER N N 156 118.577 116.550 2.027 1
1 737 . 6 1 1 A 72 72 GLY H H 157 8.542 8.435 0.107 1
1 738 . 6 1 1 A 72 72 GLY HA2 H 157 4.002 4.197 -0.195 1
1 739 . 6 1 1 A 72 72 GLY HA3 H 157 4.002 4.199 -0.197 1
1 740 . 6 1 1 A 72 72 GLY CA C 157 45.565 43.966 1.599 1
1 741 . 6 1 1 A 72 72 GLY N N 157 111.540 107.518 4.022 1
1 742 . 6 1 1 A 73 73 LYS H H 158 8.369 8.150 0.219 1
1 743 . 6 1 1 A 73 73 LYS CA C 158 56.720 55.879 0.841 1
1 744 . 6 1 1 A 73 73 LYS CB C 158 32.915 31.718 1.197 1
1 747 . 6 1 1 A 73 73 LYS N N 158 120.293 120.794 -0.501 1
1 748 . 6 1 1 A 74 74 ARG H H 159 8.181 9.207 -1.026 1
1 749 . 6 1 1 A 74 74 ARG CA C 159 56.148 57.508 -1.360 1
1 751 . 6 1 1 A 74 74 ARG N N 159 119.343 124.108 -4.765 1
1 752 . 6 1 1 A 75 75 LYS H H 160 8.443 8.360 0.083 1
1 753 . 6 1 1 A 75 75 LYS HA H 160 4.067 3.985 0.082 1
1 762 . 6 1 1 A 75 75 LYS C C 160 176.868 176.184 0.684 1
1 763 . 6 1 1 A 75 75 LYS CA C 160 57.711 57.060 0.651 1
1 764 . 6 1 1 A 75 75 LYS CB C 160 31.777 30.472 1.305 1
1 768 . 6 1 1 A 75 75 LYS N N 160 120.467 110.466 10.001 1
1 769 . 6 1 1 A 76 76 GLU H H 161 8.693 8.108 0.585 1
1 770 . 6 1 1 A 76 76 GLU HA H 161 4.290 4.468 -0.178 1
1 771 . 6 1 1 A 76 76 GLU C C 161 176.844 176.348 0.496 1
1 772 . 6 1 1 A 76 76 GLU CA C 161 57.294 57.618 -0.324 1
1 773 . 6 1 1 A 76 76 GLU CB C 161 29.794 31.413 -1.619 1
1 775 . 6 1 1 A 76 76 GLU N N 161 118.767 123.761 -4.994 1
1 776 . 6 1 1 A 77 77 GLY H H 162 8.168 7.826 0.342 1
1 777 . 6 1 1 A 77 77 GLY HA2 H 162 4.010 4.181 -0.171 1
1 778 . 6 1 1 A 77 77 GLY HA3 H 162 3.963 4.187 -0.224 1
1 779 . 6 1 1 A 77 77 GLY C C 162 173.512 171.806 1.706 1
1 780 . 6 1 1 A 77 77 GLY CA C 162 45.362 44.340 1.022 1
1 781 . 6 1 1 A 77 77 GLY N N 162 108.621 107.403 1.218 1
1 782 . 6 1 1 A 78 78 ILE H H 163 7.954 8.680 -0.726 1
1 783 . 6 1 1 A 78 78 ILE HA H 163 4.323 4.904 -0.581 1
1 793 . 6 1 1 A 78 78 ILE C C 163 175.402 175.076 0.326 1
1 794 . 6 1 1 A 78 78 ILE CA C 163 60.632 59.469 1.163 1
1 795 . 6 1 1 A 78 78 ILE CB C 163 39.759 41.577 -1.818 1
1 799 . 6 1 1 A 78 78 ILE N N 163 121.604 122.577 -0.973 1
1 800 . 6 1 1 A 79 79 ILE H H 164 8.514 8.713 -0.199 1
1 801 . 6 1 1 A 79 79 ILE HA H 164 4.341 4.987 -0.646 1
1 811 . 6 1 1 A 79 79 ILE C C 164 175.172 174.938 0.234 1
1 812 . 6 1 1 A 79 79 ILE CA C 164 60.027 59.842 0.185 1
1 813 . 6 1 1 A 79 79 ILE CB C 164 40.153 41.071 -0.918 1
1 817 . 6 1 1 A 79 79 ILE N N 164 127.137 126.345 0.792 1
1 818 . 6 1 1 A 80 80 HIS H H 165 8.492 9.015 -0.523 1
1 819 . 6 1 1 A 80 80 HIS HA H 165 5.676 5.622 0.054 1
1 824 . 6 1 1 A 80 80 HIS C C 165 175.502 173.957 1.545 1
1 825 . 6 1 1 A 80 80 HIS CA C 165 57.043 54.273 2.770 1
1 826 . 6 1 1 A 80 80 HIS CB C 165 32.741 33.379 -0.638 1
1 829 . 6 1 1 A 80 80 HIS N N 165 125.422 125.417 0.005 1
1 830 . 6 1 1 A 81 81 THR H H 166 9.080 9.235 -0.155 1
1 831 . 6 1 1 A 81 81 THR HA H 166 4.999 5.179 -0.180 1
1 836 . 6 1 1 A 81 81 THR C C 166 171.877 172.661 -0.784 1
1 837 . 6 1 1 A 81 81 THR CA C 166 59.924 60.903 -0.979 1
1 838 . 6 1 1 A 81 81 THR CB C 166 72.243 70.831 1.412 1
1 840 . 6 1 1 A 81 81 THR N N 166 117.682 114.100 3.582 1
1 841 . 6 1 1 A 82 82 LEU H H 167 8.062 7.924 0.138 1
1 842 . 6 1 1 A 82 82 LEU HA H 167 4.350 3.907 0.443 1
1 852 . 6 1 1 A 82 82 LEU C C 167 172.705 174.918 -2.213 1
1 853 . 6 1 1 A 82 82 LEU CA C 167 53.553 55.368 -1.815 1
1 854 . 6 1 1 A 82 82 LEU CB C 167 39.768 41.436 -1.668 1
1 858 . 6 1 1 A 82 82 LEU N N 167 125.369 128.299 -2.930 1
1 859 . 6 1 1 A 83 83 ILE H H 168 8.657 8.253 0.404 1
1 860 . 6 1 1 A 83 83 ILE HA H 168 4.476 4.949 -0.473 1
1 870 . 6 1 1 A 83 83 ILE C C 168 175.159 174.466 0.693 1
1 871 . 6 1 1 A 83 83 ILE CA C 168 58.529 60.102 -1.573 1
1 872 . 6 1 1 A 83 83 ILE CB C 168 37.410 39.943 -2.533 1
1 876 . 6 1 1 A 83 83 ILE N N 168 128.042 127.529 0.513 1
1 877 . 6 1 1 A 84 84 VAL H H 169 8.464 8.395 0.069 1
1 878 . 6 1 1 A 84 84 VAL HA H 169 4.284 4.501 -0.217 1
1 886 . 6 1 1 A 84 84 VAL C C 169 176.138 175.980 0.158 1
1 887 . 6 1 1 A 84 84 VAL CA C 169 61.029 61.383 -0.354 1
1 888 . 6 1 1 A 84 84 VAL CB C 169 34.714 33.999 0.715 1
1 891 . 6 1 1 A 84 84 VAL N N 169 124.644 126.965 -2.321 1
1 892 . 6 1 1 A 85 85 ASP H H 170 9.158 9.291 -0.133 1
1 893 . 6 1 1 A 85 85 ASP HA H 170 4.362 4.298 0.064 1
1 896 . 6 1 1 A 85 85 ASP C C 170 175.489 175.335 0.154 1
1 897 . 6 1 1 A 85 85 ASP CA C 170 55.868 55.186 0.682 1
1 898 . 6 1 1 A 85 85 ASP CB C 170 38.927 39.456 -0.529 1
1 899 . 6 1 1 A 85 85 ASP N N 170 129.061 127.450 1.611 1
1 900 . 6 1 1 A 86 86 ASN H H 171 8.811 8.432 0.379 1
1 901 . 6 1 1 A 86 86 ASN HA H 171 4.053 4.318 -0.265 1
1 906 . 6 1 1 A 86 86 ASN C C 171 173.802 173.904 -0.102 1
1 907 . 6 1 1 A 86 86 ASN CA C 171 55.173 54.321 0.852 1
1 908 . 6 1 1 A 86 86 ASN CB C 171 38.150 37.373 0.777 1
1 909 . 6 1 1 A 86 86 ASN N N 171 108.418 115.143 -6.725 1
1 911 . 6 1 1 A 87 87 ARG H H 172 7.914 7.494 0.420 1
1 912 . 6 1 1 A 87 87 ARG HA H 172 4.597 4.665 -0.068 1
1 919 . 6 1 1 A 87 87 ARG C C 172 174.025 174.846 -0.821 1
1 920 . 6 1 1 A 87 87 ARG CA C 172 54.846 54.260 0.586 1
1 921 . 6 1 1 A 87 87 ARG CB C 172 32.697 33.441 -0.744 1
1 924 . 6 1 1 A 87 87 ARG N N 172 120.988 117.252 3.736 1
1 925 . 6 1 1 A 88 88 GLU H H 173 8.534 8.732 -0.198 1
1 926 . 6 1 1 A 88 88 GLU HA H 173 4.560 4.351 0.209 1
1 931 . 6 1 1 A 88 88 GLU C C 173 176.187 175.430 0.757 1
1 932 . 6 1 1 A 88 88 GLU CA C 173 56.044 56.883 -0.839 1
1 933 . 6 1 1 A 88 88 GLU CB C 173 30.329 30.490 -0.161 1
1 935 . 6 1 1 A 88 88 GLU N N 173 123.982 124.293 -0.311 1
1 936 . 6 1 1 A 89 89 ILE H H 174 8.897 8.036 0.861 1
1 937 . 6 1 1 A 89 89 ILE HA H 174 4.666 4.592 0.074 1
1 947 . 6 1 1 A 89 89 ILE C C 174 174.110 174.109 0.001 1
1 948 . 6 1 1 A 89 89 ILE CA C 174 55.255 57.375 -2.120 1
1 949 . 6 1 1 A 89 89 ILE CB C 174 37.851 41.641 -3.790 1
1 953 . 6 1 1 A 89 89 ILE N N 174 130.008 127.270 2.738 1
1 954 . 6 1 1 A 90 90 PRO HA H 175 4.713 4.722 -0.009 1
1 961 . 6 1 1 A 90 90 PRO C C 175 176.956 176.289 0.667 1
1 962 . 6 1 1 A 90 90 PRO CA C 175 63.159 62.964 0.195 1
1 963 . 6 1 1 A 90 90 PRO CB C 175 32.428 32.572 -0.144 1
1 966 . 6 1 1 A 91 91 GLU H H 176 8.778 8.756 0.022 1
1 967 . 6 1 1 A 91 91 GLU HA H 176 3.910 4.794 -0.884 1
1 972 . 6 1 1 A 91 91 GLU C C 176 176.426 176.603 -0.177 1
1 973 . 6 1 1 A 91 91 GLU CA C 176 56.738 55.899 0.839 1
1 974 . 6 1 1 A 91 91 GLU CB C 176 30.540 31.177 -0.637 1
1 976 . 6 1 1 A 91 91 GLU N N 176 124.561 121.937 2.624 1
1 977 . 6 1 1 A 92 92 LEU H H 177 8.630 8.070 0.560 1
1 978 . 6 1 1 A 92 92 LEU HA H 177 4.419 4.334 0.085 1
1 988 . 6 1 1 A 92 92 LEU C C 177 177.162 176.965 0.197 1
1 989 . 6 1 1 A 92 92 LEU CA C 177 55.350 56.559 -1.209 1
1 990 . 6 1 1 A 92 92 LEU CB C 177 42.390 41.729 0.661 1
1 994 . 6 1 1 A 92 92 LEU N N 177 126.683 127.665 -0.982 1
1 995 . 6 1 1 A 93 93 THR H H 178 8.375 8.829 -0.454 1
1 996 . 6 1 1 A 93 93 THR HA H 178 4.359 4.723 -0.364 1
1 1001 . 6 1 1 A 93 93 THR C C 178 173.589 174.130 -0.541 1
1 1002 . 6 1 1 A 93 93 THR CA C 178 61.621 60.690 0.931 1
1 1003 . 6 1 1 A 93 93 THR CB C 178 69.724 68.463 1.261 1
1 1005 . 6 1 1 A 93 93 THR N N 178 119.699 116.572 3.127 1
1 1 . 7 1 1 A 9 9 SER H H 94 8.475 8.582 -0.107 1
1 2 . 7 1 1 A 9 9 SER CA C 94 58.531 57.541 0.990 1
1 3 . 7 1 1 A 9 9 SER N N 94 117.432 115.551 1.881 1
1 4 . 7 1 1 A 10 10 LYS H H 95 8.527 8.516 0.011 1
1 5 . 7 1 1 A 10 10 LYS C C 95 174.594 176.528 -1.934 1
1 6 . 7 1 1 A 10 10 LYS CA C 95 56.603 55.506 1.097 1
1 7 . 7 1 1 A 10 10 LYS N N 95 123.104 118.264 4.840 1
1 8 . 7 1 1 A 11 11 THR H H 96 8.245 7.857 0.388 1
1 9 . 7 1 1 A 11 11 THR C C 96 174.393 173.680 0.713 1
1 10 . 7 1 1 A 11 11 THR CA C 96 62.149 60.372 1.777 1
1 11 . 7 1 1 A 11 11 THR CB C 96 69.183 68.847 0.336 1
1 13 . 7 1 1 A 11 11 THR N N 96 113.245 110.856 2.389 1
1 14 . 7 1 1 A 12 12 THR H H 97 7.769 7.498 0.271 1
1 15 . 7 1 1 A 12 12 THR HA H 97 5.583 4.817 0.766 1
1 20 . 7 1 1 A 12 12 THR C C 97 174.726 172.102 2.624 1
1 21 . 7 1 1 A 12 12 THR CA C 97 59.602 60.792 -1.190 1
1 22 . 7 1 1 A 12 12 THR CB C 97 72.805 71.461 1.344 1
1 24 . 7 1 1 A 12 12 THR N N 97 113.440 111.852 1.588 1
1 25 . 7 1 1 A 13 13 SER H H 98 8.593 8.805 -0.212 1
1 26 . 7 1 1 A 13 13 SER HA H 98 4.448 5.068 -0.620 1
1 29 . 7 1 1 A 13 13 SER C C 98 171.426 172.554 -1.128 1
1 30 . 7 1 1 A 13 13 SER CA C 98 59.056 56.933 2.123 1
1 31 . 7 1 1 A 13 13 SER CB C 98 67.839 65.144 2.695 1
1 32 . 7 1 1 A 13 13 SER N N 98 119.042 121.267 -2.225 1
1 33 . 7 1 1 A 14 14 THR H H 99 8.155 8.008 0.147 1
1 34 . 7 1 1 A 14 14 THR HA H 99 5.383 5.213 0.170 1
1 39 . 7 1 1 A 14 14 THR C C 99 171.565 172.598 -1.033 1
1 40 . 7 1 1 A 14 14 THR CA C 99 61.291 60.020 1.271 1
1 41 . 7 1 1 A 14 14 THR CB C 99 71.654 72.286 -0.632 1
1 43 . 7 1 1 A 14 14 THR N N 99 118.204 116.048 2.156 1
1 44 . 7 1 1 A 15 15 TRP H H 100 9.637 8.959 0.678 1
1 45 . 7 1 1 A 15 15 TRP HA H 100 4.807 5.160 -0.353 1
1 54 . 7 1 1 A 15 15 TRP C C 100 174.399 175.701 -1.302 1
1 55 . 7 1 1 A 15 15 TRP CA C 100 58.302 55.617 2.685 1
1 56 . 7 1 1 A 15 15 TRP CB C 100 34.810 33.733 1.077 1
1 63 . 7 1 1 A 15 15 TRP N N 100 125.132 123.884 1.248 1
1 65 . 7 1 1 A 16 16 VAL H H 101 8.863 8.678 0.185 1
1 66 . 7 1 1 A 16 16 VAL HA H 101 5.267 4.943 0.324 1
1 74 . 7 1 1 A 16 16 VAL C C 101 174.955 175.019 -0.064 1
1 75 . 7 1 1 A 16 16 VAL CA C 101 60.653 61.429 -0.776 1
1 76 . 7 1 1 A 16 16 VAL CB C 101 34.284 34.464 -0.180 1
1 79 . 7 1 1 A 16 16 VAL N N 101 119.527 120.779 -1.252 1
1 80 . 7 1 1 A 17 17 LEU H H 102 8.961 8.897 0.064 1
1 81 . 7 1 1 A 17 17 LEU HA H 102 4.729 5.077 -0.348 1
1 91 . 7 1 1 A 17 17 LEU C C 102 173.559 175.138 -1.579 1
1 92 . 7 1 1 A 17 17 LEU CA C 102 55.144 53.255 1.889 1
1 93 . 7 1 1 A 17 17 LEU CB C 102 42.948 45.870 -2.922 1
1 97 . 7 1 1 A 17 17 LEU N N 102 124.280 124.080 0.200 1
1 98 . 7 1 1 A 18 18 ARG H H 103 8.305 8.396 -0.091 1
1 99 . 7 1 1 A 18 18 ARG HA H 103 5.139 4.639 0.500 1
1 106 . 7 1 1 A 18 18 ARG C C 103 175.347 175.206 0.141 1
1 107 . 7 1 1 A 18 18 ARG CA C 103 54.793 56.029 -1.236 1
1 108 . 7 1 1 A 18 18 ARG CB C 103 31.347 29.617 1.730 1
1 111 . 7 1 1 A 18 18 ARG N N 103 122.020 119.884 2.136 1
1 112 . 7 1 1 A 19 19 LEU H H 104 8.676 8.687 -0.011 1
1 113 . 7 1 1 A 19 19 LEU HA H 104 4.482 4.818 -0.336 1
1 123 . 7 1 1 A 19 19 LEU C C 104 175.957 176.025 -0.068 1
1 124 . 7 1 1 A 19 19 LEU CA C 104 53.581 53.396 0.185 1
1 125 . 7 1 1 A 19 19 LEU CB C 104 45.697 44.750 0.947 1
1 129 . 7 1 1 A 19 19 LEU N N 104 126.378 125.147 1.231 1
1 130 . 7 1 1 A 20 20 ASP H H 105 9.390 9.532 -0.142 1
1 131 . 7 1 1 A 20 20 ASP HA H 105 4.287 4.410 -0.123 1
1 134 . 7 1 1 A 20 20 ASP C C 105 175.947 175.414 0.533 1
1 135 . 7 1 1 A 20 20 ASP CA C 105 55.263 55.147 0.116 1
1 136 . 7 1 1 A 20 20 ASP CB C 105 39.239 39.743 -0.504 1
1 137 . 7 1 1 A 20 20 ASP N N 105 125.208 125.880 -0.672 1
1 138 . 7 1 1 A 21 21 GLY H H 106 8.563 8.646 -0.083 1
1 139 . 7 1 1 A 21 21 GLY HA2 H 106 4.126 3.843 0.283 1
1 140 . 7 1 1 A 21 21 GLY HA3 H 106 3.509 3.848 -0.339 1
1 141 . 7 1 1 A 21 21 GLY C C 106 173.164 173.732 -0.568 1
1 142 . 7 1 1 A 21 21 GLY CA C 106 45.499 45.505 -0.006 1
1 143 . 7 1 1 A 21 21 GLY N N 106 103.331 104.831 -1.500 1
1 144 . 7 1 1 A 22 22 GLU H H 107 7.713 8.009 -0.296 1
1 145 . 7 1 1 A 22 22 GLU HA H 107 4.634 4.935 -0.301 1
1 150 . 7 1 1 A 22 22 GLU C C 107 174.800 174.797 0.003 1
1 151 . 7 1 1 A 22 22 GLU CA C 107 54.329 54.307 0.022 1
1 152 . 7 1 1 A 22 22 GLU CB C 107 32.832 34.006 -1.174 1
1 154 . 7 1 1 A 22 22 GLU N N 107 119.470 119.422 0.048 1
1 155 . 7 1 1 A 23 23 ASP H H 108 8.632 8.626 0.006 1
1 156 . 7 1 1 A 23 23 ASP HA H 108 4.872 4.715 0.157 1
1 159 . 7 1 1 A 23 23 ASP C C 108 175.533 175.475 0.058 1
1 160 . 7 1 1 A 23 23 ASP CA C 108 55.180 53.969 1.211 1
1 161 . 7 1 1 A 23 23 ASP CB C 108 41.504 39.516 1.988 1
1 162 . 7 1 1 A 23 23 ASP N N 108 122.815 121.563 1.252 1
1 163 . 7 1 1 A 24 24 LEU H H 109 9.248 8.954 0.294 1
1 164 . 7 1 1 A 24 24 LEU HA H 109 4.836 4.664 0.172 1
1 174 . 7 1 1 A 24 24 LEU C C 109 174.322 175.619 -1.297 1
1 175 . 7 1 1 A 24 24 LEU CA C 109 54.473 54.995 -0.522 1
1 176 . 7 1 1 A 24 24 LEU CB C 109 44.718 43.166 1.552 1
1 180 . 7 1 1 A 24 24 LEU N N 109 125.550 126.882 -1.332 1
1 181 . 7 1 1 A 25 25 ARG H H 110 8.503 8.920 -0.417 1
1 182 . 7 1 1 A 25 25 ARG HA H 110 5.228 5.137 0.091 1
1 189 . 7 1 1 A 25 25 ARG C C 110 175.174 174.970 0.204 1
1 190 . 7 1 1 A 25 25 ARG CA C 110 54.745 54.867 -0.122 1
1 191 . 7 1 1 A 25 25 ARG CB C 110 31.701 32.454 -0.753 1
1 194 . 7 1 1 A 25 25 ARG N N 110 125.424 128.522 -3.098 1
1 195 . 7 1 1 A 26 26 VAL H H 111 9.692 9.033 0.659 1
1 196 . 7 1 1 A 26 26 VAL HA H 111 5.091 5.205 -0.114 1
1 204 . 7 1 1 A 26 26 VAL C C 111 174.446 175.416 -0.970 1
1 205 . 7 1 1 A 26 26 VAL CA C 111 61.055 61.509 -0.454 1
1 206 . 7 1 1 A 26 26 VAL CB C 111 33.780 33.829 -0.049 1
1 209 . 7 1 1 A 26 26 VAL N N 111 130.649 127.209 3.440 1
1 210 . 7 1 1 A 27 27 VAL H H 112 9.401 8.939 0.462 1
1 211 . 7 1 1 A 27 27 VAL HA H 112 5.188 5.021 0.167 1
1 219 . 7 1 1 A 27 27 VAL C C 112 174.214 174.567 -0.353 1
1 220 . 7 1 1 A 27 27 VAL CA C 112 60.722 60.524 0.198 1
1 221 . 7 1 1 A 27 27 VAL CB C 112 36.082 35.739 0.343 1
1 224 . 7 1 1 A 27 27 VAL N N 112 127.416 126.344 1.072 1
1 225 . 7 1 1 A 28 28 LEU H H 113 9.265 9.167 0.098 1
1 226 . 7 1 1 A 28 28 LEU HA H 113 5.337 5.198 0.139 1
1 236 . 7 1 1 A 28 28 LEU C C 113 175.915 175.101 0.814 1
1 237 . 7 1 1 A 28 28 LEU CA C 113 52.599 53.790 -1.191 1
1 238 . 7 1 1 A 28 28 LEU CB C 113 47.495 45.016 2.479 1
1 242 . 7 1 1 A 28 28 LEU N N 113 127.527 128.347 -0.820 1
1 243 . 7 1 1 A 29 29 GLU H H 114 8.968 8.669 0.299 1
1 244 . 7 1 1 A 29 29 GLU HA H 114 4.701 4.293 0.408 1
1 249 . 7 1 1 A 29 29 GLU C C 114 176.715 177.517 -0.802 1
1 250 . 7 1 1 A 29 29 GLU CA C 114 55.342 56.712 -1.370 1
1 251 . 7 1 1 A 29 29 GLU CB C 114 30.005 30.655 -0.650 1
1 253 . 7 1 1 A 29 29 GLU N N 114 127.374 127.635 -0.261 1
1 254 . 7 1 1 A 30 30 LYS H H 115 8.243 8.667 -0.424 1
1 255 . 7 1 1 A 30 30 LYS HA H 115 3.711 4.160 -0.449 1
1 264 . 7 1 1 A 30 30 LYS C C 115 177.137 178.050 -0.913 1
1 265 . 7 1 1 A 30 30 LYS CA C 115 60.118 58.812 1.306 1
1 266 . 7 1 1 A 30 30 LYS CB C 115 32.656 32.100 0.556 1
1 270 . 7 1 1 A 30 30 LYS N N 115 124.225 126.610 -2.385 1
1 271 . 7 1 1 A 31 31 ASP H H 116 9.200 8.000 1.200 1
1 272 . 7 1 1 A 31 31 ASP HA H 116 4.444 4.377 0.067 1
1 275 . 7 1 1 A 31 31 ASP C C 116 177.774 177.155 0.619 1
1 276 . 7 1 1 A 31 31 ASP CA C 116 56.703 57.376 -0.673 1
1 277 . 7 1 1 A 31 31 ASP CB C 116 40.236 41.205 -0.969 1
1 278 . 7 1 1 A 31 31 ASP N N 116 115.955 119.456 -3.501 1
1 279 . 7 1 1 A 32 32 THR H H 117 7.352 7.289 0.063 1
1 280 . 7 1 1 A 32 32 THR HA H 117 4.266 4.640 -0.374 1
1 285 . 7 1 1 A 32 32 THR C C 117 175.320 174.126 1.194 1
1 286 . 7 1 1 A 32 32 THR CA C 117 61.171 60.634 0.537 1
1 287 . 7 1 1 A 32 32 THR CB C 117 70.221 69.052 1.169 1
1 289 . 7 1 1 A 32 32 THR N N 117 106.440 107.500 -1.060 1
1 290 . 7 1 1 A 33 33 MET H H 118 8.216 7.964 0.252 1
1 291 . 7 1 1 A 33 33 MET HA H 118 4.184 4.325 -0.141 1
1 299 . 7 1 1 A 33 33 MET C C 118 174.952 175.594 -0.642 1
1 300 . 7 1 1 A 33 33 MET CA C 118 55.195 56.499 -1.304 1
1 301 . 7 1 1 A 33 33 MET CB C 118 25.900 31.898 -5.998 1
1 304 . 7 1 1 A 33 33 MET N N 118 115.956 120.240 -4.284 1
1 305 . 7 1 1 A 34 34 ASP H H 119 7.509 7.906 -0.397 1
1 306 . 7 1 1 A 34 34 ASP HA H 119 4.486 4.794 -0.308 1
1 309 . 7 1 1 A 34 34 ASP C C 119 174.375 175.705 -1.330 1
1 310 . 7 1 1 A 34 34 ASP CA C 119 54.745 54.486 0.259 1
1 311 . 7 1 1 A 34 34 ASP CB C 119 42.865 42.232 0.633 1
1 312 . 7 1 1 A 34 34 ASP N N 119 118.500 119.907 -1.407 1
1 313 . 7 1 1 A 35 35 VAL H H 120 8.473 8.580 -0.107 1
1 314 . 7 1 1 A 35 35 VAL HA H 120 4.709 4.913 -0.204 1
1 322 . 7 1 1 A 35 35 VAL C C 120 173.900 174.503 -0.603 1
1 323 . 7 1 1 A 35 35 VAL CA C 120 60.736 61.390 -0.654 1
1 324 . 7 1 1 A 35 35 VAL CB C 120 34.662 33.204 1.458 1
1 327 . 7 1 1 A 35 35 VAL N N 120 121.116 124.130 -3.014 1
1 328 . 7 1 1 A 36 36 TRP H H 121 9.404 9.137 0.267 1
1 329 . 7 1 1 A 36 36 TRP HA H 121 5.174 5.453 -0.279 1
1 338 . 7 1 1 A 36 36 TRP C C 121 176.480 174.544 1.936 1
1 339 . 7 1 1 A 36 36 TRP CA C 121 55.070 55.379 -0.309 1
1 340 . 7 1 1 A 36 36 TRP CB C 121 32.179 32.556 -0.377 1
1 348 . 7 1 1 A 36 36 TRP N N 121 126.924 128.332 -1.408 1
1 350 . 7 1 1 A 37 37 CYS H H 122 9.230 8.900 0.330 1
1 351 . 7 1 1 A 37 37 CYS HA H 122 5.417 4.914 0.503 1
1 354 . 7 1 1 A 37 37 CYS C C 122 175.346 174.556 0.790 1
1 355 . 7 1 1 A 37 37 CYS CA C 122 57.083 57.409 -0.326 1
1 356 . 7 1 1 A 37 37 CYS CB C 122 28.713 29.389 -0.676 1
1 357 . 7 1 1 A 37 37 CYS N N 122 120.375 125.078 -4.703 1
1 358 . 7 1 1 A 38 38 ASN H H 123 9.817 9.449 0.368 1
1 359 . 7 1 1 A 38 38 ASN HA H 123 4.637 4.490 0.147 1
1 364 . 7 1 1 A 38 38 ASN C C 123 175.526 175.464 0.062 1
1 365 . 7 1 1 A 38 38 ASN CA C 123 54.023 54.563 -0.540 1
1 366 . 7 1 1 A 38 38 ASN CB C 123 36.581 37.195 -0.614 1
1 367 . 7 1 1 A 38 38 ASN N N 123 129.408 125.913 3.495 1
1 369 . 7 1 1 A 39 39 GLY H H 124 9.092 8.892 0.200 1
1 370 . 7 1 1 A 39 39 GLY HA2 H 124 4.241 4.081 0.160 1
1 371 . 7 1 1 A 39 39 GLY HA3 H 124 3.705 4.412 -0.707 1
1 372 . 7 1 1 A 39 39 GLY C C 124 173.405 173.934 -0.529 1
1 373 . 7 1 1 A 39 39 GLY CA C 124 45.595 46.846 -1.251 1
1 374 . 7 1 1 A 39 39 GLY N N 124 102.752 103.636 -0.884 1
1 375 . 7 1 1 A 40 40 GLN H H 125 8.006 7.468 0.538 1
1 376 . 7 1 1 A 40 40 GLN HA H 125 4.736 4.385 0.351 1
1 383 . 7 1 1 A 40 40 GLN C C 125 174.477 173.724 0.753 1
1 384 . 7 1 1 A 40 40 GLN CA C 125 53.747 54.197 -0.450 1
1 385 . 7 1 1 A 40 40 GLN CB C 125 30.413 31.075 -0.662 1
1 387 . 7 1 1 A 40 40 GLN N N 125 120.627 119.117 1.510 1
1 389 . 7 1 1 A 41 41 LYS H H 126 8.757 7.923 0.834 1
1 390 . 7 1 1 A 41 41 LYS HA H 126 3.464 2.870 0.594 1
1 399 . 7 1 1 A 41 41 LYS C C 126 176.870 174.935 1.935 1
1 400 . 7 1 1 A 41 41 LYS CA C 126 57.136 55.940 1.196 1
1 401 . 7 1 1 A 41 41 LYS CB C 126 31.669 32.770 -1.101 1
1 405 . 7 1 1 A 41 41 LYS N N 126 129.107 126.848 2.259 1
1 406 . 7 1 1 A 42 42 MET H H 127 8.682 8.375 0.307 1
1 407 . 7 1 1 A 42 42 MET HA H 127 4.712 5.194 -0.482 1
1 415 . 7 1 1 A 42 42 MET C C 127 176.816 174.211 2.605 1
1 416 . 7 1 1 A 42 42 MET CA C 127 52.958 53.689 -0.731 1
1 417 . 7 1 1 A 42 42 MET CB C 127 33.023 36.573 -3.550 1
1 420 . 7 1 1 A 42 42 MET N N 127 126.569 125.151 1.418 1
1 421 . 7 1 1 A 43 43 GLU H H 128 8.734 8.794 -0.060 1
1 422 . 7 1 1 A 43 43 GLU HA H 128 4.419 5.039 -0.620 1
1 427 . 7 1 1 A 43 43 GLU C C 128 176.531 176.356 0.175 1
1 428 . 7 1 1 A 43 43 GLU CA C 128 56.475 55.133 1.342 1
1 429 . 7 1 1 A 43 43 GLU CB C 128 29.604 31.632 -2.028 1
1 431 . 7 1 1 A 43 43 GLU N N 128 123.734 121.320 2.414 1
1 432 . 7 1 1 A 44 44 THR H H 129 8.263 8.885 -0.622 1
1 433 . 7 1 1 A 44 44 THR HA H 129 5.385 5.315 0.070 1
1 438 . 7 1 1 A 44 44 THR C C 129 174.205 174.974 -0.769 1
1 439 . 7 1 1 A 44 44 THR CA C 129 59.160 60.657 -1.497 1
1 440 . 7 1 1 A 44 44 THR CB C 129 72.419 71.946 0.473 1
1 442 . 7 1 1 A 44 44 THR N N 129 115.081 117.902 -2.821 1
1 443 . 7 1 1 A 45 45 ALA H H 130 8.727 8.147 0.580 1
1 444 . 7 1 1 A 45 45 ALA HA H 130 4.749 4.504 0.245 1
1 448 . 7 1 1 A 45 45 ALA C C 130 177.017 177.934 -0.917 1
1 449 . 7 1 1 A 45 45 ALA CA C 130 51.645 52.296 -0.651 1
1 450 . 7 1 1 A 45 45 ALA CB C 130 21.364 20.341 1.023 1
1 451 . 7 1 1 A 45 45 ALA N N 130 123.243 122.665 0.578 1
1 452 . 7 1 1 A 46 46 GLY H H 131 8.818 8.116 0.702 1
1 453 . 7 1 1 A 46 46 GLY HA2 H 131 4.941 4.026 0.915 1
1 454 . 7 1 1 A 46 46 GLY HA3 H 131 3.690 4.045 -0.355 1
1 455 . 7 1 1 A 46 46 GLY C C 131 173.528 174.495 -0.967 1
1 456 . 7 1 1 A 46 46 GLY CA C 131 45.060 46.973 -1.913 1
1 457 . 7 1 1 A 46 46 GLY N N 131 112.392 107.565 4.827 1
1 458 . 7 1 1 A 47 47 GLU H H 132 8.746 7.877 0.869 1
1 459 . 7 1 1 A 47 47 GLU HA H 132 4.584 4.677 -0.093 1
1 464 . 7 1 1 A 47 47 GLU C C 132 175.223 175.815 -0.592 1
1 465 . 7 1 1 A 47 47 GLU CA C 132 55.008 55.432 -0.424 1
1 466 . 7 1 1 A 47 47 GLU CB C 132 32.939 31.282 1.657 1
1 468 . 7 1 1 A 47 47 GLU N N 132 122.107 119.516 2.591 1
1 469 . 7 1 1 A 48 48 PHE H H 133 8.920 8.898 0.022 1
1 470 . 7 1 1 A 48 48 PHE HA H 133 4.822 4.933 -0.111 1
1 475 . 7 1 1 A 48 48 PHE C C 133 175.499 175.434 0.065 1
1 476 . 7 1 1 A 48 48 PHE CA C 133 58.320 55.973 2.347 1
1 477 . 7 1 1 A 48 48 PHE CB C 133 39.175 40.500 -1.325 1
1 479 . 7 1 1 A 48 48 PHE N N 133 124.006 122.971 1.035 1
1 480 . 7 1 1 A 49 49 VAL H H 134 8.161 8.537 -0.376 1
1 481 . 7 1 1 A 49 49 VAL HA H 134 4.492 4.444 0.048 1
1 489 . 7 1 1 A 49 49 VAL C C 134 176.241 176.731 -0.490 1
1 490 . 7 1 1 A 49 49 VAL CA C 134 60.328 60.617 -0.289 1
1 491 . 7 1 1 A 49 49 VAL CB C 134 34.542 34.332 0.210 1
1 494 . 7 1 1 A 49 49 VAL N N 134 120.063 119.991 0.072 1
1 495 . 7 1 1 A 50 50 ASP H H 135 8.596 8.914 -0.318 1
1 496 . 7 1 1 A 50 50 ASP HA H 135 4.278 4.379 -0.101 1
1 499 . 7 1 1 A 50 50 ASP C C 135 176.567 176.979 -0.412 1
1 500 . 7 1 1 A 50 50 ASP CA C 135 57.149 57.104 0.045 1
1 501 . 7 1 1 A 50 50 ASP CB C 135 40.477 40.766 -0.289 1
1 502 . 7 1 1 A 50 50 ASP N N 135 122.137 122.752 -0.615 1
1 503 . 7 1 1 A 51 51 ASP H H 136 8.328 8.228 0.100 1
1 504 . 7 1 1 A 51 51 ASP HA H 136 4.656 4.937 -0.281 1
1 507 . 7 1 1 A 51 51 ASP C C 136 175.798 176.827 -1.029 1
1 508 . 7 1 1 A 51 51 ASP CA C 136 53.458 54.949 -1.491 1
1 509 . 7 1 1 A 51 51 ASP CB C 136 40.306 41.833 -1.527 1
1 510 . 7 1 1 A 51 51 ASP N N 136 116.158 114.664 1.494 1
1 511 . 7 1 1 A 52 52 GLY H H 137 7.653 7.787 -0.134 1
1 512 . 7 1 1 A 52 52 GLY HA2 H 137 4.685 4.129 0.556 1
1 513 . 7 1 1 A 52 52 GLY HA3 H 137 4.069 4.129 -0.060 1
1 514 . 7 1 1 A 52 52 GLY C C 137 173.149 173.555 -0.406 1
1 515 . 7 1 1 A 52 52 GLY CA C 137 45.860 44.443 1.417 1
1 516 . 7 1 1 A 52 52 GLY N N 137 107.634 108.337 -0.703 1
1 517 . 7 1 1 A 53 53 THR H H 138 8.445 8.864 -0.419 1
1 518 . 7 1 1 A 53 53 THR HA H 138 4.996 5.010 -0.014 1
1 523 . 7 1 1 A 53 53 THR C C 138 174.163 172.932 1.231 1
1 524 . 7 1 1 A 53 53 THR CA C 138 60.974 61.450 -0.476 1
1 525 . 7 1 1 A 53 53 THR CB C 138 72.266 72.356 -0.090 1
1 527 . 7 1 1 A 53 53 THR N N 138 114.976 115.072 -0.096 1
1 528 . 7 1 1 A 54 54 GLU H H 139 8.917 9.337 -0.420 1
1 529 . 7 1 1 A 54 54 GLU HA H 139 5.205 5.084 0.121 1
1 534 . 7 1 1 A 54 54 GLU C C 139 175.700 175.050 0.650 1
1 535 . 7 1 1 A 54 54 GLU CA C 139 54.731 54.864 -0.133 1
1 536 . 7 1 1 A 54 54 GLU CB C 139 33.250 32.544 0.706 1
1 538 . 7 1 1 A 54 54 GLU N N 139 121.295 126.013 -4.718 1
1 539 . 7 1 1 A 55 55 THR H H 140 9.190 8.484 0.706 1
1 540 . 7 1 1 A 55 55 THR HA H 140 4.744 4.889 -0.145 1
1 545 . 7 1 1 A 55 55 THR C C 140 174.537 173.249 1.288 1
1 546 . 7 1 1 A 55 55 THR CA C 140 62.678 61.548 1.130 1
1 547 . 7 1 1 A 55 55 THR CB C 140 69.744 70.184 -0.440 1
1 549 . 7 1 1 A 55 55 THR N N 140 122.419 118.553 3.866 1
1 550 . 7 1 1 A 56 56 HIS H H 141 9.395 9.142 0.253 1
1 551 . 7 1 1 A 56 56 HIS HA H 141 5.204 4.941 0.263 1
1 556 . 7 1 1 A 56 56 HIS C C 141 174.675 174.949 -0.274 1
1 557 . 7 1 1 A 56 56 HIS CA C 141 55.557 53.837 1.720 1
1 558 . 7 1 1 A 56 56 HIS CB C 141 31.279 30.600 0.679 1
1 561 . 7 1 1 A 56 56 HIS N N 141 125.732 125.723 0.009 1
1 564 . 7 1 1 A 57 57 PHE H H 142 8.790 7.907 0.883 1
1 565 . 7 1 1 A 57 57 PHE HA H 142 4.918 5.897 -0.979 1
1 571 . 7 1 1 A 57 57 PHE C C 142 172.293 173.749 -1.456 1
1 572 . 7 1 1 A 57 57 PHE CA C 142 56.366 55.318 1.048 1
1 573 . 7 1 1 A 57 57 PHE CB C 142 39.962 42.697 -2.735 1
1 575 . 7 1 1 A 57 57 PHE N N 142 117.009 121.323 -4.314 1
1 576 . 7 1 1 A 58 58 SER H H 143 8.890 8.990 -0.100 1
1 577 . 7 1 1 A 58 58 SER HA H 143 5.286 5.103 0.183 1
1 580 . 7 1 1 A 58 58 SER C C 143 173.716 174.675 -0.959 1
1 581 . 7 1 1 A 58 58 SER CA C 143 57.517 57.197 0.320 1
1 582 . 7 1 1 A 58 58 SER CB C 143 65.448 64.750 0.698 1
1 583 . 7 1 1 A 58 58 SER N N 143 115.269 115.951 -0.682 1
1 584 . 7 1 1 A 59 59 VAL H H 144 7.737 8.838 -1.101 1
1 585 . 7 1 1 A 59 59 VAL HA H 144 4.220 4.422 -0.202 1
1 593 . 7 1 1 A 59 59 VAL C C 144 176.234 176.044 0.190 1
1 594 . 7 1 1 A 59 59 VAL CA C 144 61.741 60.813 0.928 1
1 595 . 7 1 1 A 59 59 VAL CB C 144 33.711 33.384 0.327 1
1 598 . 7 1 1 A 59 59 VAL N N 144 123.186 122.365 0.821 1
1 599 . 7 1 1 A 60 60 GLY H H 145 8.945 8.992 -0.047 1
1 600 . 7 1 1 A 60 60 GLY HA2 H 145 4.027 3.755 0.272 1
1 601 . 7 1 1 A 60 60 GLY HA3 H 145 3.692 3.786 -0.094 1
1 602 . 7 1 1 A 60 60 GLY C C 145 175.182 174.641 0.541 1
1 603 . 7 1 1 A 60 60 GLY CA C 145 47.141 47.303 -0.162 1
1 604 . 7 1 1 A 60 60 GLY N N 145 116.908 118.089 -1.181 1
1 605 . 7 1 1 A 61 61 ASN H H 146 8.929 8.493 0.436 1
1 606 . 7 1 1 A 61 61 ASN HA H 146 4.718 4.818 -0.100 1
1 611 . 7 1 1 A 61 61 ASN C C 146 174.706 174.467 0.239 1
1 612 . 7 1 1 A 61 61 ASN CA C 146 52.802 51.888 0.914 1
1 613 . 7 1 1 A 61 61 ASN CB C 146 37.917 38.871 -0.954 1
1 614 . 7 1 1 A 61 61 ASN N N 146 123.976 124.592 -0.616 1
1 616 . 7 1 1 A 62 62 HIS H H 147 8.400 7.818 0.582 1
1 617 . 7 1 1 A 62 62 HIS HA H 147 4.762 5.037 -0.275 1
1 622 . 7 1 1 A 62 62 HIS C C 147 173.871 173.701 0.170 1
1 623 . 7 1 1 A 62 62 HIS CA C 147 55.374 54.660 0.714 1
1 624 . 7 1 1 A 62 62 HIS CB C 147 28.655 34.279 -5.624 1
1 628 . 7 1 1 A 62 62 HIS N N 147 118.620 117.852 0.768 1
1 631 . 7 1 1 A 63 63 ASP H H 148 8.734 9.086 -0.352 1
1 632 . 7 1 1 A 63 63 ASP HA H 148 4.785 5.363 -0.578 1
1 635 . 7 1 1 A 63 63 ASP C C 148 175.269 174.898 0.371 1
1 636 . 7 1 1 A 63 63 ASP CA C 148 54.390 53.581 0.809 1
1 637 . 7 1 1 A 63 63 ASP CB C 148 42.105 43.065 -0.960 1
1 638 . 7 1 1 A 63 63 ASP N N 148 125.336 118.603 6.733 1
1 639 . 7 1 1 A 64 64 CYS H H 149 8.225 8.996 -0.771 1
1 640 . 7 1 1 A 64 64 CYS HA H 149 5.118 5.485 -0.367 1
1 643 . 7 1 1 A 64 64 CYS C C 149 173.740 172.788 0.952 1
1 644 . 7 1 1 A 64 64 CYS CA C 149 55.423 57.589 -2.166 1
1 645 . 7 1 1 A 64 64 CYS CB C 149 29.972 32.251 -2.279 1
1 646 . 7 1 1 A 64 64 CYS N N 149 124.476 123.218 1.258 1
1 647 . 7 1 1 A 65 65 TYR H H 150 8.916 8.665 0.251 1
1 648 . 7 1 1 A 65 65 TYR HA H 150 5.121 3.809 1.312 1
1 655 . 7 1 1 A 65 65 TYR C C 150 172.821 172.104 0.717 1
1 656 . 7 1 1 A 65 65 TYR CA C 150 56.347 55.618 0.729 1
1 657 . 7 1 1 A 65 65 TYR CB C 150 38.901 40.722 -1.821 1
1 662 . 7 1 1 A 65 65 TYR N N 150 115.313 118.457 -3.144 1
1 663 . 7 1 1 A 66 66 ILE H H 151 8.423 8.519 -0.096 1
1 664 . 7 1 1 A 66 66 ILE HA H 151 5.000 4.451 0.549 1
1 674 . 7 1 1 A 66 66 ILE C C 151 176.225 174.634 1.591 1
1 675 . 7 1 1 A 66 66 ILE CA C 151 57.798 60.143 -2.345 1
1 676 . 7 1 1 A 66 66 ILE CB C 151 39.863 38.668 1.195 1
1 680 . 7 1 1 A 66 66 ILE N N 151 118.575 121.636 -3.061 1
1 681 . 7 1 1 A 67 67 LYS H H 152 9.480 8.926 0.554 1
1 682 . 7 1 1 A 67 67 LYS HA H 152 5.091 4.765 0.326 1
1 691 . 7 1 1 A 67 67 LYS C C 152 174.079 174.866 -0.787 1
1 692 . 7 1 1 A 67 67 LYS CA C 152 54.728 56.148 -1.420 1
1 693 . 7 1 1 A 67 67 LYS CB C 152 35.256 33.157 2.099 1
1 697 . 7 1 1 A 67 67 LYS N N 152 132.311 128.350 3.961 1
1 698 . 7 1 1 A 68 68 ALA H H 153 8.844 8.814 0.030 1
1 699 . 7 1 1 A 68 68 ALA HA H 153 5.039 5.186 -0.147 1
1 703 . 7 1 1 A 68 68 ALA C C 153 176.587 176.573 0.014 1
1 704 . 7 1 1 A 68 68 ALA CA C 153 50.484 50.850 -0.366 1
1 705 . 7 1 1 A 68 68 ALA CB C 153 20.570 20.984 -0.414 1
1 706 . 7 1 1 A 68 68 ALA N N 153 129.958 130.407 -0.449 1
1 707 . 7 1 1 A 69 69 VAL H H 154 8.461 8.701 -0.240 1
1 708 . 7 1 1 A 69 69 VAL HA H 154 4.558 4.747 -0.189 1
1 716 . 7 1 1 A 69 69 VAL C C 154 175.331 175.086 0.245 1
1 717 . 7 1 1 A 69 69 VAL CA C 154 60.758 60.618 0.140 1
1 718 . 7 1 1 A 69 69 VAL CB C 154 34.743 34.911 -0.168 1
1 721 . 7 1 1 A 69 69 VAL N N 154 121.496 123.030 -1.534 1
1 722 . 7 1 1 A 70 70 SER H H 155 8.695 9.040 -0.345 1
1 723 . 7 1 1 A 70 70 SER HA H 155 4.646 5.182 -0.536 1
1 726 . 7 1 1 A 70 70 SER C C 155 174.690 173.690 1.000 1
1 727 . 7 1 1 A 70 70 SER CA C 155 58.065 56.977 1.088 1
1 728 . 7 1 1 A 70 70 SER CB C 155 64.062 64.557 -0.495 1
1 729 . 7 1 1 A 70 70 SER N N 155 119.763 121.956 -2.193 1
1 730 . 7 1 1 A 71 71 SER H H 156 8.360 8.889 -0.529 1
1 731 . 7 1 1 A 71 71 SER HA H 156 4.430 5.181 -0.751 1
1 734 . 7 1 1 A 71 71 SER CA C 156 58.491 56.625 1.866 1
1 735 . 7 1 1 A 71 71 SER CB C 156 64.061 66.314 -2.253 1
1 736 . 7 1 1 A 71 71 SER N N 156 118.577 116.008 2.569 1
1 737 . 7 1 1 A 72 72 GLY H H 157 8.542 8.491 0.051 1
1 738 . 7 1 1 A 72 72 GLY HA2 H 157 4.002 4.230 -0.228 1
1 739 . 7 1 1 A 72 72 GLY HA3 H 157 4.002 4.230 -0.228 1
1 740 . 7 1 1 A 72 72 GLY CA C 157 45.565 44.390 1.175 1
1 741 . 7 1 1 A 72 72 GLY N N 157 111.540 108.565 2.975 1
1 742 . 7 1 1 A 73 73 LYS H H 158 8.369 8.843 -0.474 1
1 743 . 7 1 1 A 73 73 LYS CA C 158 56.720 59.117 -2.397 1
1 744 . 7 1 1 A 73 73 LYS CB C 158 32.915 32.599 0.316 1
1 747 . 7 1 1 A 73 73 LYS N N 158 120.293 120.674 -0.381 1
1 748 . 7 1 1 A 74 74 ARG H H 159 8.181 7.618 0.563 1
1 749 . 7 1 1 A 74 74 ARG CA C 159 56.148 54.849 1.299 1
1 751 . 7 1 1 A 74 74 ARG N N 159 119.343 116.574 2.769 1
1 752 . 7 1 1 A 75 75 LYS H H 160 8.443 8.055 0.388 1
1 753 . 7 1 1 A 75 75 LYS HA H 160 4.067 3.845 0.222 1
1 762 . 7 1 1 A 75 75 LYS C C 160 176.868 176.106 0.762 1
1 763 . 7 1 1 A 75 75 LYS CA C 160 57.711 57.143 0.568 1
1 764 . 7 1 1 A 75 75 LYS CB C 160 31.777 30.183 1.594 1
1 768 . 7 1 1 A 75 75 LYS N N 160 120.467 115.377 5.090 1
1 769 . 7 1 1 A 76 76 GLU H H 161 8.693 7.951 0.742 1
1 770 . 7 1 1 A 76 76 GLU HA H 161 4.290 4.638 -0.348 1
1 771 . 7 1 1 A 76 76 GLU C C 161 176.844 176.316 0.528 1
1 772 . 7 1 1 A 76 76 GLU CA C 161 57.294 56.939 0.355 1
1 773 . 7 1 1 A 76 76 GLU CB C 161 29.794 31.686 -1.892 1
1 775 . 7 1 1 A 76 76 GLU N N 161 118.767 117.235 1.532 1
1 776 . 7 1 1 A 77 77 GLY H H 162 8.168 7.970 0.198 1
1 777 . 7 1 1 A 77 77 GLY HA2 H 162 4.010 4.149 -0.139 1
1 778 . 7 1 1 A 77 77 GLY HA3 H 162 3.963 4.149 -0.186 1
1 779 . 7 1 1 A 77 77 GLY C C 162 173.512 172.329 1.183 1
1 780 . 7 1 1 A 77 77 GLY CA C 162 45.362 44.826 0.536 1
1 781 . 7 1 1 A 77 77 GLY N N 162 108.621 107.492 1.129 1
1 782 . 7 1 1 A 78 78 ILE H H 163 7.954 9.181 -1.227 1
1 783 . 7 1 1 A 78 78 ILE HA H 163 4.323 4.826 -0.503 1
1 793 . 7 1 1 A 78 78 ILE C C 163 175.402 175.441 -0.039 1
1 794 . 7 1 1 A 78 78 ILE CA C 163 60.632 59.579 1.053 1
1 795 . 7 1 1 A 78 78 ILE CB C 163 39.759 40.705 -0.946 1
1 799 . 7 1 1 A 78 78 ILE N N 163 121.604 126.180 -4.576 1
1 800 . 7 1 1 A 79 79 ILE H H 164 8.514 8.801 -0.287 1
1 801 . 7 1 1 A 79 79 ILE HA H 164 4.341 4.613 -0.272 1
1 811 . 7 1 1 A 79 79 ILE C C 164 175.172 174.668 0.504 1
1 812 . 7 1 1 A 79 79 ILE CA C 164 60.027 59.991 0.036 1
1 813 . 7 1 1 A 79 79 ILE CB C 164 40.153 40.934 -0.781 1
1 817 . 7 1 1 A 79 79 ILE N N 164 127.137 125.704 1.433 1
1 818 . 7 1 1 A 80 80 HIS H H 165 8.492 8.871 -0.379 1
1 819 . 7 1 1 A 80 80 HIS HA H 165 5.676 5.134 0.542 1
1 824 . 7 1 1 A 80 80 HIS C C 165 175.502 174.646 0.856 1
1 825 . 7 1 1 A 80 80 HIS CA C 165 57.043 55.032 2.011 1
1 826 . 7 1 1 A 80 80 HIS CB C 165 32.741 31.285 1.456 1
1 829 . 7 1 1 A 80 80 HIS N N 165 125.422 126.138 -0.716 1
1 830 . 7 1 1 A 81 81 THR H H 166 9.080 9.438 -0.358 1
1 831 . 7 1 1 A 81 81 THR HA H 166 4.999 4.920 0.079 1
1 836 . 7 1 1 A 81 81 THR C C 166 171.877 172.987 -1.110 1
1 837 . 7 1 1 A 81 81 THR CA C 166 59.924 61.053 -1.129 1
1 838 . 7 1 1 A 81 81 THR CB C 166 72.243 70.618 1.625 1
1 840 . 7 1 1 A 81 81 THR N N 166 117.682 115.626 2.056 1
1 841 . 7 1 1 A 82 82 LEU H H 167 8.062 8.253 -0.191 1
1 842 . 7 1 1 A 82 82 LEU HA H 167 4.350 3.986 0.364 1
1 852 . 7 1 1 A 82 82 LEU C C 167 172.705 174.940 -2.235 1
1 853 . 7 1 1 A 82 82 LEU CA C 167 53.553 55.524 -1.971 1
1 854 . 7 1 1 A 82 82 LEU CB C 167 39.768 41.273 -1.505 1
1 858 . 7 1 1 A 82 82 LEU N N 167 125.369 127.392 -2.023 1
1 859 . 7 1 1 A 83 83 ILE H H 168 8.657 8.319 0.338 1
1 860 . 7 1 1 A 83 83 ILE HA H 168 4.476 5.041 -0.565 1
1 870 . 7 1 1 A 83 83 ILE C C 168 175.159 174.179 0.980 1
1 871 . 7 1 1 A 83 83 ILE CA C 168 58.529 60.015 -1.486 1
1 872 . 7 1 1 A 83 83 ILE CB C 168 37.410 40.583 -3.173 1
1 876 . 7 1 1 A 83 83 ILE N N 168 128.042 127.215 0.827 1
1 877 . 7 1 1 A 84 84 VAL H H 169 8.464 8.430 0.034 1
1 878 . 7 1 1 A 84 84 VAL HA H 169 4.284 4.407 -0.123 1
1 886 . 7 1 1 A 84 84 VAL C C 169 176.138 175.827 0.311 1
1 887 . 7 1 1 A 84 84 VAL CA C 169 61.029 61.242 -0.213 1
1 888 . 7 1 1 A 84 84 VAL CB C 169 34.714 33.957 0.757 1
1 891 . 7 1 1 A 84 84 VAL N N 169 124.644 126.820 -2.176 1
1 892 . 7 1 1 A 85 85 ASP H H 170 9.158 8.989 0.169 1
1 893 . 7 1 1 A 85 85 ASP HA H 170 4.362 4.265 0.097 1
1 896 . 7 1 1 A 85 85 ASP C C 170 175.489 175.327 0.162 1
1 897 . 7 1 1 A 85 85 ASP CA C 170 55.868 55.197 0.671 1
1 898 . 7 1 1 A 85 85 ASP CB C 170 38.927 39.465 -0.538 1
1 899 . 7 1 1 A 85 85 ASP N N 170 129.061 127.775 1.286 1
1 900 . 7 1 1 A 86 86 ASN H H 171 8.811 8.432 0.379 1
1 901 . 7 1 1 A 86 86 ASN HA H 171 4.053 4.340 -0.287 1
1 906 . 7 1 1 A 86 86 ASN C C 171 173.802 173.869 -0.067 1
1 907 . 7 1 1 A 86 86 ASN CA C 171 55.173 54.308 0.865 1
1 908 . 7 1 1 A 86 86 ASN CB C 171 38.150 37.379 0.771 1
1 909 . 7 1 1 A 86 86 ASN N N 171 108.418 114.905 -6.487 1
1 911 . 7 1 1 A 87 87 ARG H H 172 7.914 7.529 0.385 1
1 912 . 7 1 1 A 87 87 ARG HA H 172 4.597 4.686 -0.089 1
1 919 . 7 1 1 A 87 87 ARG C C 172 174.025 174.794 -0.769 1
1 920 . 7 1 1 A 87 87 ARG CA C 172 54.846 54.219 0.627 1
1 921 . 7 1 1 A 87 87 ARG CB C 172 32.697 33.073 -0.376 1
1 924 . 7 1 1 A 87 87 ARG N N 172 120.988 117.400 3.588 1
1 925 . 7 1 1 A 88 88 GLU H H 173 8.534 8.757 -0.223 1
1 926 . 7 1 1 A 88 88 GLU HA H 173 4.560 4.351 0.209 1
1 931 . 7 1 1 A 88 88 GLU C C 173 176.187 175.488 0.699 1
1 932 . 7 1 1 A 88 88 GLU CA C 173 56.044 56.861 -0.817 1
1 933 . 7 1 1 A 88 88 GLU CB C 173 30.329 30.401 -0.072 1
1 935 . 7 1 1 A 88 88 GLU N N 173 123.982 125.068 -1.086 1
1 936 . 7 1 1 A 89 89 ILE H H 174 8.897 7.845 1.052 1
1 937 . 7 1 1 A 89 89 ILE HA H 174 4.666 4.541 0.125 1
1 947 . 7 1 1 A 89 89 ILE C C 174 174.110 174.221 -0.111 1
1 948 . 7 1 1 A 89 89 ILE CA C 174 55.255 57.290 -2.035 1
1 949 . 7 1 1 A 89 89 ILE CB C 174 37.851 41.440 -3.589 1
1 953 . 7 1 1 A 89 89 ILE N N 174 130.008 127.280 2.728 1
1 954 . 7 1 1 A 90 90 PRO HA H 175 4.713 4.791 -0.078 1
1 961 . 7 1 1 A 90 90 PRO C C 175 176.956 176.208 0.748 1
1 962 . 7 1 1 A 90 90 PRO CA C 175 63.159 63.023 0.136 1
1 963 . 7 1 1 A 90 90 PRO CB C 175 32.428 32.185 0.243 1
1 966 . 7 1 1 A 91 91 GLU H H 176 8.778 8.755 0.023 1
1 967 . 7 1 1 A 91 91 GLU HA H 176 3.910 4.629 -0.719 1
1 972 . 7 1 1 A 91 91 GLU C C 176 176.426 175.652 0.774 1
1 973 . 7 1 1 A 91 91 GLU CA C 176 56.738 55.858 0.880 1
1 974 . 7 1 1 A 91 91 GLU CB C 176 30.540 31.326 -0.786 1
1 976 . 7 1 1 A 91 91 GLU N N 176 124.561 122.012 2.549 1
1 977 . 7 1 1 A 92 92 LEU H H 177 8.630 8.208 0.422 1
1 978 . 7 1 1 A 92 92 LEU HA H 177 4.419 4.737 -0.318 1
1 988 . 7 1 1 A 92 92 LEU C C 177 177.162 175.523 1.639 1
1 989 . 7 1 1 A 92 92 LEU CA C 177 55.350 54.510 0.840 1
1 990 . 7 1 1 A 92 92 LEU CB C 177 42.390 41.594 0.796 1
1 994 . 7 1 1 A 92 92 LEU N N 177 126.683 127.886 -1.203 1
1 995 . 7 1 1 A 93 93 THR H H 178 8.375 8.544 -0.169 1
1 996 . 7 1 1 A 93 93 THR HA H 178 4.359 4.947 -0.588 1
1 1001 . 7 1 1 A 93 93 THR C C 178 173.589 171.777 1.812 1
1 1002 . 7 1 1 A 93 93 THR CA C 178 61.621 60.045 1.576 1
1 1003 . 7 1 1 A 93 93 THR CB C 178 69.724 70.614 -0.890 1
1 1005 . 7 1 1 A 93 93 THR N N 178 119.699 119.036 0.663 1
1 1 . 8 1 1 A 9 9 SER H H 94 8.475 8.661 -0.186 1
1 2 . 8 1 1 A 9 9 SER CA C 94 58.531 56.847 1.684 1
1 3 . 8 1 1 A 9 9 SER N N 94 117.432 116.414 1.018 1
1 4 . 8 1 1 A 10 10 LYS H H 95 8.527 7.812 0.715 1
1 5 . 8 1 1 A 10 10 LYS C C 95 174.594 177.985 -3.391 1
1 6 . 8 1 1 A 10 10 LYS CA C 95 56.603 57.627 -1.024 1
1 7 . 8 1 1 A 10 10 LYS N N 95 123.104 123.259 -0.155 1
1 8 . 8 1 1 A 11 11 THR H H 96 8.245 7.651 0.594 1
1 9 . 8 1 1 A 11 11 THR C C 96 174.393 173.438 0.955 1
1 10 . 8 1 1 A 11 11 THR CA C 96 62.149 60.644 1.505 1
1 11 . 8 1 1 A 11 11 THR CB C 96 69.183 69.346 -0.163 1
1 13 . 8 1 1 A 11 11 THR N N 96 113.245 104.864 8.381 1
1 14 . 8 1 1 A 12 12 THR H H 97 7.769 7.554 0.215 1
1 15 . 8 1 1 A 12 12 THR HA H 97 5.583 4.920 0.663 1
1 20 . 8 1 1 A 12 12 THR C C 97 174.726 172.228 2.498 1
1 21 . 8 1 1 A 12 12 THR CA C 97 59.602 60.859 -1.257 1
1 22 . 8 1 1 A 12 12 THR CB C 97 72.805 71.378 1.427 1
1 24 . 8 1 1 A 12 12 THR N N 97 113.440 112.297 1.143 1
1 25 . 8 1 1 A 13 13 SER H H 98 8.593 8.695 -0.102 1
1 26 . 8 1 1 A 13 13 SER HA H 98 4.448 5.094 -0.646 1
1 29 . 8 1 1 A 13 13 SER C C 98 171.426 173.274 -1.848 1
1 30 . 8 1 1 A 13 13 SER CA C 98 59.056 57.051 2.005 1
1 31 . 8 1 1 A 13 13 SER CB C 98 67.839 65.180 2.659 1
1 32 . 8 1 1 A 13 13 SER N N 98 119.042 121.286 -2.244 1
1 33 . 8 1 1 A 14 14 THR H H 99 8.155 8.169 -0.014 1
1 34 . 8 1 1 A 14 14 THR HA H 99 5.383 5.149 0.234 1
1 39 . 8 1 1 A 14 14 THR C C 99 171.565 173.253 -1.688 1
1 40 . 8 1 1 A 14 14 THR CA C 99 61.291 59.321 1.970 1
1 41 . 8 1 1 A 14 14 THR CB C 99 71.654 72.112 -0.458 1
1 43 . 8 1 1 A 14 14 THR N N 99 118.204 112.115 6.089 1
1 44 . 8 1 1 A 15 15 TRP H H 100 9.637 9.046 0.591 1
1 45 . 8 1 1 A 15 15 TRP HA H 100 4.807 5.103 -0.296 1
1 54 . 8 1 1 A 15 15 TRP C C 100 174.399 175.311 -0.912 1
1 55 . 8 1 1 A 15 15 TRP CA C 100 58.302 56.169 2.133 1
1 56 . 8 1 1 A 15 15 TRP CB C 100 34.810 33.242 1.568 1
1 63 . 8 1 1 A 15 15 TRP N N 100 125.132 120.922 4.210 1
1 65 . 8 1 1 A 16 16 VAL H H 101 8.863 8.980 -0.117 1
1 66 . 8 1 1 A 16 16 VAL HA H 101 5.267 4.733 0.534 1
1 74 . 8 1 1 A 16 16 VAL C C 101 174.955 175.318 -0.363 1
1 75 . 8 1 1 A 16 16 VAL CA C 101 60.653 61.764 -1.111 1
1 76 . 8 1 1 A 16 16 VAL CB C 101 34.284 32.899 1.385 1
1 79 . 8 1 1 A 16 16 VAL N N 101 119.527 123.809 -4.282 1
1 80 . 8 1 1 A 17 17 LEU H H 102 8.961 8.930 0.031 1
1 81 . 8 1 1 A 17 17 LEU HA H 102 4.729 5.091 -0.362 1
1 91 . 8 1 1 A 17 17 LEU C C 102 173.559 175.074 -1.515 1
1 92 . 8 1 1 A 17 17 LEU CA C 102 55.144 53.139 2.005 1
1 93 . 8 1 1 A 17 17 LEU CB C 102 42.948 45.905 -2.957 1
1 97 . 8 1 1 A 17 17 LEU N N 102 124.280 123.837 0.443 1
1 98 . 8 1 1 A 18 18 ARG H H 103 8.305 8.388 -0.083 1
1 99 . 8 1 1 A 18 18 ARG HA H 103 5.139 4.665 0.474 1
1 106 . 8 1 1 A 18 18 ARG C C 103 175.347 175.232 0.115 1
1 107 . 8 1 1 A 18 18 ARG CA C 103 54.793 56.111 -1.318 1
1 108 . 8 1 1 A 18 18 ARG CB C 103 31.347 29.813 1.534 1
1 111 . 8 1 1 A 18 18 ARG N N 103 122.020 120.124 1.896 1
1 112 . 8 1 1 A 19 19 LEU H H 104 8.676 8.771 -0.095 1
1 113 . 8 1 1 A 19 19 LEU HA H 104 4.482 4.841 -0.359 1
1 123 . 8 1 1 A 19 19 LEU C C 104 175.957 175.977 -0.020 1
1 124 . 8 1 1 A 19 19 LEU CA C 104 53.581 53.787 -0.206 1
1 125 . 8 1 1 A 19 19 LEU CB C 104 45.697 45.224 0.473 1
1 129 . 8 1 1 A 19 19 LEU N N 104 126.378 124.855 1.523 1
1 130 . 8 1 1 A 20 20 ASP H H 105 9.390 9.626 -0.236 1
1 131 . 8 1 1 A 20 20 ASP HA H 105 4.287 4.380 -0.093 1
1 134 . 8 1 1 A 20 20 ASP C C 105 175.947 175.488 0.459 1
1 135 . 8 1 1 A 20 20 ASP CA C 105 55.263 55.171 0.092 1
1 136 . 8 1 1 A 20 20 ASP CB C 105 39.239 39.757 -0.518 1
1 137 . 8 1 1 A 20 20 ASP N N 105 125.208 126.274 -1.066 1
1 138 . 8 1 1 A 21 21 GLY H H 106 8.563 8.655 -0.092 1
1 139 . 8 1 1 A 21 21 GLY HA2 H 106 4.126 3.845 0.281 1
1 140 . 8 1 1 A 21 21 GLY HA3 H 106 3.509 3.845 -0.336 1
1 141 . 8 1 1 A 21 21 GLY C C 106 173.164 173.561 -0.397 1
1 142 . 8 1 1 A 21 21 GLY CA C 106 45.499 45.519 -0.020 1
1 143 . 8 1 1 A 21 21 GLY N N 106 103.331 104.557 -1.226 1
1 144 . 8 1 1 A 22 22 GLU H H 107 7.713 7.977 -0.264 1
1 145 . 8 1 1 A 22 22 GLU HA H 107 4.634 4.903 -0.269 1
1 150 . 8 1 1 A 22 22 GLU C C 107 174.800 175.077 -0.277 1
1 151 . 8 1 1 A 22 22 GLU CA C 107 54.329 54.443 -0.114 1
1 152 . 8 1 1 A 22 22 GLU CB C 107 32.832 33.750 -0.918 1
1 154 . 8 1 1 A 22 22 GLU N N 107 119.470 119.576 -0.106 1
1 155 . 8 1 1 A 23 23 ASP H H 108 8.632 8.531 0.101 1
1 156 . 8 1 1 A 23 23 ASP HA H 108 4.872 4.667 0.205 1
1 159 . 8 1 1 A 23 23 ASP C C 108 175.533 175.639 -0.106 1
1 160 . 8 1 1 A 23 23 ASP CA C 108 55.180 53.870 1.310 1
1 161 . 8 1 1 A 23 23 ASP CB C 108 41.504 39.434 2.070 1
1 162 . 8 1 1 A 23 23 ASP N N 108 122.815 120.694 2.121 1
1 163 . 8 1 1 A 24 24 LEU H H 109 9.248 8.850 0.398 1
1 164 . 8 1 1 A 24 24 LEU HA H 109 4.836 4.576 0.260 1
1 174 . 8 1 1 A 24 24 LEU C C 109 174.322 175.899 -1.577 1
1 175 . 8 1 1 A 24 24 LEU CA C 109 54.473 55.101 -0.628 1
1 176 . 8 1 1 A 24 24 LEU CB C 109 44.718 42.692 2.026 1
1 180 . 8 1 1 A 24 24 LEU N N 109 125.550 127.491 -1.941 1
1 181 . 8 1 1 A 25 25 ARG H H 110 8.503 8.719 -0.216 1
1 182 . 8 1 1 A 25 25 ARG HA H 110 5.228 4.813 0.415 1
1 189 . 8 1 1 A 25 25 ARG C C 110 175.174 174.371 0.803 1
1 190 . 8 1 1 A 25 25 ARG CA C 110 54.745 54.897 -0.152 1
1 191 . 8 1 1 A 25 25 ARG CB C 110 31.701 31.535 0.166 1
1 194 . 8 1 1 A 25 25 ARG N N 110 125.424 127.866 -2.442 1
1 195 . 8 1 1 A 26 26 VAL H H 111 9.692 9.129 0.563 1
1 196 . 8 1 1 A 26 26 VAL HA H 111 5.091 5.042 0.049 1
1 204 . 8 1 1 A 26 26 VAL C C 111 174.446 175.361 -0.915 1
1 205 . 8 1 1 A 26 26 VAL CA C 111 61.055 61.969 -0.914 1
1 206 . 8 1 1 A 26 26 VAL CB C 111 33.780 33.026 0.754 1
1 209 . 8 1 1 A 26 26 VAL N N 111 130.649 127.298 3.351 1
1 210 . 8 1 1 A 27 27 VAL H H 112 9.401 8.986 0.415 1
1 211 . 8 1 1 A 27 27 VAL HA H 112 5.188 4.758 0.430 1
1 219 . 8 1 1 A 27 27 VAL C C 112 174.214 174.180 0.034 1
1 220 . 8 1 1 A 27 27 VAL CA C 112 60.722 60.906 -0.184 1
1 221 . 8 1 1 A 27 27 VAL CB C 112 36.082 35.260 0.822 1
1 224 . 8 1 1 A 27 27 VAL N N 112 127.416 127.535 -0.119 1
1 225 . 8 1 1 A 28 28 LEU H H 113 9.265 9.174 0.091 1
1 226 . 8 1 1 A 28 28 LEU HA H 113 5.337 5.281 0.056 1
1 236 . 8 1 1 A 28 28 LEU C C 113 175.915 174.905 1.010 1
1 237 . 8 1 1 A 28 28 LEU CA C 113 52.599 53.301 -0.702 1
1 238 . 8 1 1 A 28 28 LEU CB C 113 47.495 44.787 2.708 1
1 242 . 8 1 1 A 28 28 LEU N N 113 127.527 129.938 -2.411 1
1 243 . 8 1 1 A 29 29 GLU H H 114 8.968 8.590 0.378 1
1 244 . 8 1 1 A 29 29 GLU HA H 114 4.701 4.465 0.236 1
1 249 . 8 1 1 A 29 29 GLU C C 114 176.715 177.608 -0.893 1
1 250 . 8 1 1 A 29 29 GLU CA C 114 55.342 56.039 -0.697 1
1 251 . 8 1 1 A 29 29 GLU CB C 114 30.005 30.539 -0.534 1
1 253 . 8 1 1 A 29 29 GLU N N 114 127.374 127.434 -0.060 1
1 254 . 8 1 1 A 30 30 LYS H H 115 8.243 8.684 -0.441 1
1 255 . 8 1 1 A 30 30 LYS HA H 115 3.711 4.166 -0.455 1
1 264 . 8 1 1 A 30 30 LYS C C 115 177.137 178.234 -1.097 1
1 265 . 8 1 1 A 30 30 LYS CA C 115 60.118 58.783 1.335 1
1 266 . 8 1 1 A 30 30 LYS CB C 115 32.656 32.101 0.555 1
1 270 . 8 1 1 A 30 30 LYS N N 115 124.225 124.930 -0.705 1
1 271 . 8 1 1 A 31 31 ASP H H 116 9.200 8.151 1.049 1
1 272 . 8 1 1 A 31 31 ASP HA H 116 4.444 4.440 0.004 1
1 275 . 8 1 1 A 31 31 ASP C C 116 177.774 177.383 0.391 1
1 276 . 8 1 1 A 31 31 ASP CA C 116 56.703 57.370 -0.667 1
1 277 . 8 1 1 A 31 31 ASP CB C 116 40.236 40.344 -0.108 1
1 278 . 8 1 1 A 31 31 ASP N N 116 115.955 119.408 -3.453 1
1 279 . 8 1 1 A 32 32 THR H H 117 7.352 7.346 0.006 1
1 280 . 8 1 1 A 32 32 THR HA H 117 4.266 4.626 -0.360 1
1 285 . 8 1 1 A 32 32 THR C C 117 175.320 173.630 1.690 1
1 286 . 8 1 1 A 32 32 THR CA C 117 61.171 60.750 0.421 1
1 287 . 8 1 1 A 32 32 THR CB C 117 70.221 69.164 1.057 1
1 289 . 8 1 1 A 32 32 THR N N 117 106.440 107.594 -1.154 1
1 290 . 8 1 1 A 33 33 MET H H 118 8.216 7.909 0.307 1
1 291 . 8 1 1 A 33 33 MET HA H 118 4.184 4.379 -0.195 1
1 299 . 8 1 1 A 33 33 MET C C 118 174.952 174.806 0.146 1
1 300 . 8 1 1 A 33 33 MET CA C 118 55.195 56.766 -1.571 1
1 301 . 8 1 1 A 33 33 MET CB C 118 25.900 31.226 -5.326 1
1 304 . 8 1 1 A 33 33 MET N N 118 115.956 116.027 -0.071 1
1 305 . 8 1 1 A 34 34 ASP H H 119 7.509 8.053 -0.544 1
1 306 . 8 1 1 A 34 34 ASP HA H 119 4.486 4.715 -0.229 1
1 309 . 8 1 1 A 34 34 ASP C C 119 174.375 175.468 -1.093 1
1 310 . 8 1 1 A 34 34 ASP CA C 119 54.745 54.657 0.088 1
1 311 . 8 1 1 A 34 34 ASP CB C 119 42.865 41.349 1.516 1
1 312 . 8 1 1 A 34 34 ASP N N 119 118.500 118.963 -0.463 1
1 313 . 8 1 1 A 35 35 VAL H H 120 8.473 8.602 -0.129 1
1 314 . 8 1 1 A 35 35 VAL HA H 120 4.709 4.595 0.114 1
1 322 . 8 1 1 A 35 35 VAL C C 120 173.900 174.344 -0.444 1
1 323 . 8 1 1 A 35 35 VAL CA C 120 60.736 61.089 -0.353 1
1 324 . 8 1 1 A 35 35 VAL CB C 120 34.662 32.710 1.952 1
1 327 . 8 1 1 A 35 35 VAL N N 120 121.116 121.466 -0.350 1
1 328 . 8 1 1 A 36 36 TRP H H 121 9.404 9.599 -0.195 1
1 329 . 8 1 1 A 36 36 TRP HA H 121 5.174 5.335 -0.161 1
1 338 . 8 1 1 A 36 36 TRP C C 121 176.480 174.748 1.732 1
1 339 . 8 1 1 A 36 36 TRP CA C 121 55.070 55.513 -0.443 1
1 340 . 8 1 1 A 36 36 TRP CB C 121 32.179 32.873 -0.694 1
1 348 . 8 1 1 A 36 36 TRP N N 121 126.924 129.661 -2.737 1
1 350 . 8 1 1 A 37 37 CYS H H 122 9.230 9.138 0.092 1
1 351 . 8 1 1 A 37 37 CYS HA H 122 5.417 4.946 0.471 1
1 354 . 8 1 1 A 37 37 CYS C C 122 175.346 175.035 0.311 1
1 355 . 8 1 1 A 37 37 CYS CA C 122 57.083 57.761 -0.678 1
1 356 . 8 1 1 A 37 37 CYS CB C 122 28.713 29.820 -1.107 1
1 357 . 8 1 1 A 37 37 CYS N N 122 120.375 125.871 -5.496 1
1 358 . 8 1 1 A 38 38 ASN H H 123 9.817 8.496 1.321 1
1 359 . 8 1 1 A 38 38 ASN HA H 123 4.637 4.246 0.391 1
1 364 . 8 1 1 A 38 38 ASN C C 123 175.526 174.969 0.557 1
1 365 . 8 1 1 A 38 38 ASN CA C 123 54.023 53.631 0.392 1
1 366 . 8 1 1 A 38 38 ASN CB C 123 36.581 36.090 0.491 1
1 367 . 8 1 1 A 38 38 ASN N N 123 129.408 123.301 6.107 1
1 369 . 8 1 1 A 39 39 GLY H H 124 9.092 7.963 1.129 1
1 370 . 8 1 1 A 39 39 GLY HA2 H 124 4.241 3.654 0.587 1
1 371 . 8 1 1 A 39 39 GLY HA3 H 124 3.705 3.828 -0.123 1
1 372 . 8 1 1 A 39 39 GLY C C 124 173.405 173.985 -0.580 1
1 373 . 8 1 1 A 39 39 GLY CA C 124 45.595 46.789 -1.194 1
1 374 . 8 1 1 A 39 39 GLY N N 124 102.752 106.959 -4.207 1
1 375 . 8 1 1 A 40 40 GLN H H 125 8.006 7.753 0.253 1
1 376 . 8 1 1 A 40 40 GLN HA H 125 4.736 4.859 -0.123 1
1 383 . 8 1 1 A 40 40 GLN C C 125 174.477 174.776 -0.299 1
1 384 . 8 1 1 A 40 40 GLN CA C 125 53.747 55.098 -1.351 1
1 385 . 8 1 1 A 40 40 GLN CB C 125 30.413 30.929 -0.516 1
1 387 . 8 1 1 A 40 40 GLN N N 125 120.627 119.213 1.414 1
1 389 . 8 1 1 A 41 41 LYS H H 126 8.757 8.836 -0.079 1
1 390 . 8 1 1 A 41 41 LYS HA H 126 3.464 4.345 -0.881 1
1 399 . 8 1 1 A 41 41 LYS C C 126 176.870 175.405 1.465 1
1 400 . 8 1 1 A 41 41 LYS CA C 126 57.136 56.921 0.215 1
1 401 . 8 1 1 A 41 41 LYS CB C 126 31.669 33.311 -1.642 1
1 405 . 8 1 1 A 41 41 LYS N N 126 129.107 129.226 -0.119 1
1 406 . 8 1 1 A 42 42 MET H H 127 8.682 8.426 0.256 1
1 407 . 8 1 1 A 42 42 MET HA H 127 4.712 5.316 -0.604 1
1 415 . 8 1 1 A 42 42 MET C C 127 176.816 174.334 2.482 1
1 416 . 8 1 1 A 42 42 MET CA C 127 52.958 53.804 -0.846 1
1 417 . 8 1 1 A 42 42 MET CB C 127 33.023 36.999 -3.976 1
1 420 . 8 1 1 A 42 42 MET N N 127 126.569 124.553 2.016 1
1 421 . 8 1 1 A 43 43 GLU H H 128 8.734 8.853 -0.119 1
1 422 . 8 1 1 A 43 43 GLU HA H 128 4.419 5.114 -0.695 1
1 427 . 8 1 1 A 43 43 GLU C C 128 176.531 176.788 -0.257 1
1 428 . 8 1 1 A 43 43 GLU CA C 128 56.475 55.169 1.306 1
1 429 . 8 1 1 A 43 43 GLU CB C 128 29.604 31.247 -1.643 1
1 431 . 8 1 1 A 43 43 GLU N N 128 123.734 120.987 2.747 1
1 432 . 8 1 1 A 44 44 THR H H 129 8.263 8.918 -0.655 1
1 433 . 8 1 1 A 44 44 THR HA H 129 5.385 5.298 0.087 1
1 438 . 8 1 1 A 44 44 THR C C 129 174.205 175.050 -0.845 1
1 439 . 8 1 1 A 44 44 THR CA C 129 59.160 60.478 -1.318 1
1 440 . 8 1 1 A 44 44 THR CB C 129 72.419 72.015 0.404 1
1 442 . 8 1 1 A 44 44 THR N N 129 115.081 117.583 -2.502 1
1 443 . 8 1 1 A 45 45 ALA H H 130 8.727 8.358 0.369 1
1 444 . 8 1 1 A 45 45 ALA HA H 130 4.749 4.296 0.453 1
1 448 . 8 1 1 A 45 45 ALA C C 130 177.017 178.238 -1.221 1
1 449 . 8 1 1 A 45 45 ALA CA C 130 51.645 52.808 -1.163 1
1 450 . 8 1 1 A 45 45 ALA CB C 130 21.364 20.161 1.203 1
1 451 . 8 1 1 A 45 45 ALA N N 130 123.243 123.344 -0.101 1
1 452 . 8 1 1 A 46 46 GLY H H 131 8.818 8.200 0.618 1
1 453 . 8 1 1 A 46 46 GLY HA2 H 131 4.941 3.990 0.951 1
1 454 . 8 1 1 A 46 46 GLY HA3 H 131 3.690 3.994 -0.304 1
1 455 . 8 1 1 A 46 46 GLY C C 131 173.528 174.538 -1.010 1
1 456 . 8 1 1 A 46 46 GLY CA C 131 45.060 46.890 -1.830 1
1 457 . 8 1 1 A 46 46 GLY N N 131 112.392 107.117 5.275 1
1 458 . 8 1 1 A 47 47 GLU H H 132 8.746 8.084 0.662 1
1 459 . 8 1 1 A 47 47 GLU HA H 132 4.584 4.553 0.031 1
1 464 . 8 1 1 A 47 47 GLU C C 132 175.223 176.198 -0.975 1
1 465 . 8 1 1 A 47 47 GLU CA C 132 55.008 55.358 -0.350 1
1 466 . 8 1 1 A 47 47 GLU CB C 132 32.939 31.080 1.859 1
1 468 . 8 1 1 A 47 47 GLU N N 132 122.107 119.789 2.318 1
1 469 . 8 1 1 A 48 48 PHE H H 133 8.920 9.019 -0.099 1
1 470 . 8 1 1 A 48 48 PHE HA H 133 4.822 4.611 0.211 1
1 475 . 8 1 1 A 48 48 PHE C C 133 175.499 175.873 -0.374 1
1 476 . 8 1 1 A 48 48 PHE CA C 133 58.320 57.591 0.729 1
1 477 . 8 1 1 A 48 48 PHE CB C 133 39.175 39.473 -0.298 1
1 479 . 8 1 1 A 48 48 PHE N N 133 124.006 122.915 1.091 1
1 480 . 8 1 1 A 49 49 VAL H H 134 8.161 8.645 -0.484 1
1 481 . 8 1 1 A 49 49 VAL HA H 134 4.492 4.637 -0.145 1
1 489 . 8 1 1 A 49 49 VAL C C 134 176.241 176.979 -0.738 1
1 490 . 8 1 1 A 49 49 VAL CA C 134 60.328 59.635 0.693 1
1 491 . 8 1 1 A 49 49 VAL CB C 134 34.542 34.637 -0.095 1
1 494 . 8 1 1 A 49 49 VAL N N 134 120.063 119.892 0.171 1
1 495 . 8 1 1 A 50 50 ASP H H 135 8.596 8.567 0.029 1
1 496 . 8 1 1 A 50 50 ASP HA H 135 4.278 4.418 -0.140 1
1 499 . 8 1 1 A 50 50 ASP C C 135 176.567 176.737 -0.170 1
1 500 . 8 1 1 A 50 50 ASP CA C 135 57.149 57.117 0.032 1
1 501 . 8 1 1 A 50 50 ASP CB C 135 40.477 40.751 -0.274 1
1 502 . 8 1 1 A 50 50 ASP N N 135 122.137 121.552 0.585 1
1 503 . 8 1 1 A 51 51 ASP H H 136 8.328 7.693 0.635 1
1 504 . 8 1 1 A 51 51 ASP HA H 136 4.656 5.027 -0.371 1
1 507 . 8 1 1 A 51 51 ASP C C 136 175.798 174.850 0.948 1
1 508 . 8 1 1 A 51 51 ASP CA C 136 53.458 53.362 0.096 1
1 509 . 8 1 1 A 51 51 ASP CB C 136 40.306 42.235 -1.929 1
1 510 . 8 1 1 A 51 51 ASP N N 136 116.158 116.278 -0.120 1
1 511 . 8 1 1 A 52 52 GLY H H 137 7.653 8.401 -0.748 1
1 512 . 8 1 1 A 52 52 GLY HA2 H 137 4.685 4.107 0.578 1
1 513 . 8 1 1 A 52 52 GLY HA3 H 137 4.069 4.110 -0.041 1
1 514 . 8 1 1 A 52 52 GLY C C 137 173.149 172.591 0.558 1
1 515 . 8 1 1 A 52 52 GLY CA C 137 45.860 44.075 1.785 1
1 516 . 8 1 1 A 52 52 GLY N N 137 107.634 112.217 -4.583 1
1 517 . 8 1 1 A 53 53 THR H H 138 8.445 7.812 0.633 1
1 518 . 8 1 1 A 53 53 THR HA H 138 4.996 5.047 -0.051 1
1 523 . 8 1 1 A 53 53 THR C C 138 174.163 173.272 0.891 1
1 524 . 8 1 1 A 53 53 THR CA C 138 60.974 61.505 -0.531 1
1 525 . 8 1 1 A 53 53 THR CB C 138 72.266 72.006 0.260 1
1 527 . 8 1 1 A 53 53 THR N N 138 114.976 115.060 -0.084 1
1 528 . 8 1 1 A 54 54 GLU H H 139 8.917 8.469 0.448 1
1 529 . 8 1 1 A 54 54 GLU HA H 139 5.205 4.771 0.434 1
1 534 . 8 1 1 A 54 54 GLU C C 139 175.700 175.280 0.420 1
1 535 . 8 1 1 A 54 54 GLU CA C 139 54.731 55.220 -0.489 1
1 536 . 8 1 1 A 54 54 GLU CB C 139 33.250 30.284 2.966 1
1 538 . 8 1 1 A 54 54 GLU N N 139 121.295 125.719 -4.424 1
1 539 . 8 1 1 A 55 55 THR H H 140 9.190 8.590 0.600 1
1 540 . 8 1 1 A 55 55 THR HA H 140 4.744 4.645 0.099 1
1 545 . 8 1 1 A 55 55 THR C C 140 174.537 173.680 0.857 1
1 546 . 8 1 1 A 55 55 THR CA C 140 62.678 62.062 0.616 1
1 547 . 8 1 1 A 55 55 THR CB C 140 69.744 68.958 0.786 1
1 549 . 8 1 1 A 55 55 THR N N 140 122.419 121.570 0.849 1
1 550 . 8 1 1 A 56 56 HIS H H 141 9.395 9.064 0.331 1
1 551 . 8 1 1 A 56 56 HIS HA H 141 5.204 4.986 0.218 1
1 556 . 8 1 1 A 56 56 HIS C C 141 174.675 174.598 0.077 1
1 557 . 8 1 1 A 56 56 HIS CA C 141 55.557 54.120 1.437 1
1 558 . 8 1 1 A 56 56 HIS CB C 141 31.279 30.496 0.783 1
1 561 . 8 1 1 A 56 56 HIS N N 141 125.732 125.677 0.055 1
1 564 . 8 1 1 A 57 57 PHE H H 142 8.790 8.405 0.385 1
1 565 . 8 1 1 A 57 57 PHE HA H 142 4.918 6.045 -1.127 1
1 571 . 8 1 1 A 57 57 PHE C C 142 172.293 174.070 -1.777 1
1 572 . 8 1 1 A 57 57 PHE CA C 142 56.366 55.233 1.133 1
1 573 . 8 1 1 A 57 57 PHE CB C 142 39.962 42.589 -2.627 1
1 575 . 8 1 1 A 57 57 PHE N N 142 117.009 121.527 -4.518 1
1 576 . 8 1 1 A 58 58 SER H H 143 8.890 8.951 -0.061 1
1 577 . 8 1 1 A 58 58 SER HA H 143 5.286 5.018 0.268 1
1 580 . 8 1 1 A 58 58 SER C C 143 173.716 174.701 -0.985 1
1 581 . 8 1 1 A 58 58 SER CA C 143 57.517 57.183 0.334 1
1 582 . 8 1 1 A 58 58 SER CB C 143 65.448 64.545 0.903 1
1 583 . 8 1 1 A 58 58 SER N N 143 115.269 116.196 -0.927 1
1 584 . 8 1 1 A 59 59 VAL H H 144 7.737 8.439 -0.702 1
1 585 . 8 1 1 A 59 59 VAL HA H 144 4.220 4.484 -0.264 1
1 593 . 8 1 1 A 59 59 VAL C C 144 176.234 176.117 0.117 1
1 594 . 8 1 1 A 59 59 VAL CA C 144 61.741 60.820 0.921 1
1 595 . 8 1 1 A 59 59 VAL CB C 144 33.711 33.503 0.208 1
1 598 . 8 1 1 A 59 59 VAL N N 144 123.186 122.800 0.386 1
1 599 . 8 1 1 A 60 60 GLY H H 145 8.945 9.016 -0.071 1
1 600 . 8 1 1 A 60 60 GLY HA2 H 145 4.027 3.760 0.267 1
1 601 . 8 1 1 A 60 60 GLY HA3 H 145 3.692 3.805 -0.113 1
1 602 . 8 1 1 A 60 60 GLY C C 145 175.182 174.912 0.270 1
1 603 . 8 1 1 A 60 60 GLY CA C 145 47.141 47.182 -0.041 1
1 604 . 8 1 1 A 60 60 GLY N N 145 116.908 118.322 -1.414 1
1 605 . 8 1 1 A 61 61 ASN H H 146 8.929 8.483 0.446 1
1 606 . 8 1 1 A 61 61 ASN HA H 146 4.718 4.786 -0.068 1
1 611 . 8 1 1 A 61 61 ASN C C 146 174.706 174.135 0.571 1
1 612 . 8 1 1 A 61 61 ASN CA C 146 52.802 52.492 0.310 1
1 613 . 8 1 1 A 61 61 ASN CB C 146 37.917 38.431 -0.514 1
1 614 . 8 1 1 A 61 61 ASN N N 146 123.976 124.834 -0.858 1
1 616 . 8 1 1 A 62 62 HIS H H 147 8.400 7.730 0.670 1
1 617 . 8 1 1 A 62 62 HIS HA H 147 4.762 5.070 -0.308 1
1 622 . 8 1 1 A 62 62 HIS C C 147 173.871 173.422 0.449 1
1 623 . 8 1 1 A 62 62 HIS CA C 147 55.374 54.692 0.682 1
1 624 . 8 1 1 A 62 62 HIS CB C 147 28.655 34.283 -5.628 1
1 628 . 8 1 1 A 62 62 HIS N N 147 118.620 117.809 0.811 1
1 631 . 8 1 1 A 63 63 ASP H H 148 8.734 8.846 -0.112 1
1 632 . 8 1 1 A 63 63 ASP HA H 148 4.785 5.022 -0.237 1
1 635 . 8 1 1 A 63 63 ASP C C 148 175.269 174.997 0.272 1
1 636 . 8 1 1 A 63 63 ASP CA C 148 54.390 53.033 1.357 1
1 637 . 8 1 1 A 63 63 ASP CB C 148 42.105 41.558 0.547 1
1 638 . 8 1 1 A 63 63 ASP N N 148 125.336 120.570 4.766 1
1 639 . 8 1 1 A 64 64 CYS H H 149 8.225 9.038 -0.813 1
1 640 . 8 1 1 A 64 64 CYS HA H 149 5.118 5.444 -0.326 1
1 643 . 8 1 1 A 64 64 CYS C C 149 173.740 172.767 0.973 1
1 644 . 8 1 1 A 64 64 CYS CA C 149 55.423 57.969 -2.546 1
1 645 . 8 1 1 A 64 64 CYS CB C 149 29.972 30.665 -0.693 1
1 646 . 8 1 1 A 64 64 CYS N N 149 124.476 124.678 -0.202 1
1 647 . 8 1 1 A 65 65 TYR H H 150 8.916 8.326 0.590 1
1 648 . 8 1 1 A 65 65 TYR HA H 150 5.121 3.788 1.333 1
1 655 . 8 1 1 A 65 65 TYR C C 150 172.821 171.957 0.864 1
1 656 . 8 1 1 A 65 65 TYR CA C 150 56.347 56.012 0.335 1
1 657 . 8 1 1 A 65 65 TYR CB C 150 38.901 40.171 -1.270 1
1 662 . 8 1 1 A 65 65 TYR N N 150 115.313 117.904 -2.591 1
1 663 . 8 1 1 A 66 66 ILE H H 151 8.423 8.872 -0.449 1
1 664 . 8 1 1 A 66 66 ILE HA H 151 5.000 4.435 0.565 1
1 674 . 8 1 1 A 66 66 ILE C C 151 176.225 174.611 1.614 1
1 675 . 8 1 1 A 66 66 ILE CA C 151 57.798 60.096 -2.298 1
1 676 . 8 1 1 A 66 66 ILE CB C 151 39.863 38.829 1.034 1
1 680 . 8 1 1 A 66 66 ILE N N 151 118.575 121.278 -2.703 1
1 681 . 8 1 1 A 67 67 LYS H H 152 9.480 8.883 0.597 1
1 682 . 8 1 1 A 67 67 LYS HA H 152 5.091 4.710 0.381 1
1 691 . 8 1 1 A 67 67 LYS C C 152 174.079 175.049 -0.970 1
1 692 . 8 1 1 A 67 67 LYS CA C 152 54.728 56.057 -1.329 1
1 693 . 8 1 1 A 67 67 LYS CB C 152 35.256 33.129 2.127 1
1 697 . 8 1 1 A 67 67 LYS N N 152 132.311 128.574 3.737 1
1 698 . 8 1 1 A 68 68 ALA H H 153 8.844 8.709 0.135 1
1 699 . 8 1 1 A 68 68 ALA HA H 153 5.039 5.382 -0.343 1
1 703 . 8 1 1 A 68 68 ALA C C 153 176.587 176.645 -0.058 1
1 704 . 8 1 1 A 68 68 ALA CA C 153 50.484 51.070 -0.586 1
1 705 . 8 1 1 A 68 68 ALA CB C 153 20.570 21.200 -0.630 1
1 706 . 8 1 1 A 68 68 ALA N N 153 129.958 130.283 -0.325 1
1 707 . 8 1 1 A 69 69 VAL H H 154 8.461 8.640 -0.179 1
1 708 . 8 1 1 A 69 69 VAL HA H 154 4.558 4.582 -0.024 1
1 716 . 8 1 1 A 69 69 VAL C C 154 175.331 175.106 0.225 1
1 717 . 8 1 1 A 69 69 VAL CA C 154 60.758 61.014 -0.256 1
1 718 . 8 1 1 A 69 69 VAL CB C 154 34.743 35.038 -0.295 1
1 721 . 8 1 1 A 69 69 VAL N N 154 121.496 122.027 -0.531 1
1 722 . 8 1 1 A 70 70 SER H H 155 8.695 8.978 -0.283 1
1 723 . 8 1 1 A 70 70 SER HA H 155 4.646 5.263 -0.617 1
1 726 . 8 1 1 A 70 70 SER C C 155 174.690 173.309 1.381 1
1 727 . 8 1 1 A 70 70 SER CA C 155 58.065 56.971 1.094 1
1 728 . 8 1 1 A 70 70 SER CB C 155 64.062 64.614 -0.552 1
1 729 . 8 1 1 A 70 70 SER N N 155 119.763 122.342 -2.579 1
1 730 . 8 1 1 A 71 71 SER H H 156 8.360 9.267 -0.907 1
1 731 . 8 1 1 A 71 71 SER HA H 156 4.430 5.437 -1.007 1
1 734 . 8 1 1 A 71 71 SER CA C 156 58.491 56.597 1.894 1
1 735 . 8 1 1 A 71 71 SER CB C 156 64.061 66.469 -2.408 1
1 736 . 8 1 1 A 71 71 SER N N 156 118.577 118.152 0.425 1
1 737 . 8 1 1 A 72 72 GLY H H 157 8.542 8.403 0.139 1
1 738 . 8 1 1 A 72 72 GLY HA2 H 157 4.002 4.226 -0.224 1
1 739 . 8 1 1 A 72 72 GLY HA3 H 157 4.002 4.226 -0.224 1
1 740 . 8 1 1 A 72 72 GLY CA C 157 45.565 44.545 1.020 1
1 741 . 8 1 1 A 72 72 GLY N N 157 111.540 113.010 -1.470 1
1 742 . 8 1 1 A 73 73 LYS H H 158 8.369 8.741 -0.372 1
1 743 . 8 1 1 A 73 73 LYS CA C 158 56.720 58.701 -1.981 1
1 744 . 8 1 1 A 73 73 LYS CB C 158 32.915 32.112 0.803 1
1 747 . 8 1 1 A 73 73 LYS N N 158 120.293 118.192 2.101 1
1 748 . 8 1 1 A 74 74 ARG H H 159 8.181 8.015 0.166 1
1 749 . 8 1 1 A 74 74 ARG CA C 159 56.148 56.876 -0.728 1
1 751 . 8 1 1 A 74 74 ARG N N 159 119.343 117.801 1.542 1
1 752 . 8 1 1 A 75 75 LYS H H 160 8.443 7.768 0.675 1
1 753 . 8 1 1 A 75 75 LYS HA H 160 4.067 4.528 -0.461 1
1 762 . 8 1 1 A 75 75 LYS C C 160 176.868 176.288 0.580 1
1 763 . 8 1 1 A 75 75 LYS CA C 160 57.711 55.499 2.212 1
1 764 . 8 1 1 A 75 75 LYS CB C 160 31.777 32.737 -0.960 1
1 768 . 8 1 1 A 75 75 LYS N N 160 120.467 119.361 1.106 1
1 769 . 8 1 1 A 76 76 GLU H H 161 8.693 8.278 0.415 1
1 770 . 8 1 1 A 76 76 GLU HA H 161 4.290 4.236 0.054 1
1 771 . 8 1 1 A 76 76 GLU C C 161 176.844 176.577 0.267 1
1 772 . 8 1 1 A 76 76 GLU CA C 161 57.294 58.904 -1.610 1
1 773 . 8 1 1 A 76 76 GLU CB C 161 29.794 30.544 -0.750 1
1 775 . 8 1 1 A 76 76 GLU N N 161 118.767 124.965 -6.198 1
1 776 . 8 1 1 A 77 77 GLY H H 162 8.168 7.709 0.459 1
1 777 . 8 1 1 A 77 77 GLY HA2 H 162 4.010 4.144 -0.134 1
1 778 . 8 1 1 A 77 77 GLY HA3 H 162 3.963 4.147 -0.184 1
1 779 . 8 1 1 A 77 77 GLY C C 162 173.512 171.902 1.610 1
1 780 . 8 1 1 A 77 77 GLY CA C 162 45.362 44.690 0.672 1
1 781 . 8 1 1 A 77 77 GLY N N 162 108.621 106.367 2.254 1
1 782 . 8 1 1 A 78 78 ILE H H 163 7.954 8.493 -0.539 1
1 783 . 8 1 1 A 78 78 ILE HA H 163 4.323 4.779 -0.456 1
1 793 . 8 1 1 A 78 78 ILE C C 163 175.402 174.938 0.464 1
1 794 . 8 1 1 A 78 78 ILE CA C 163 60.632 59.722 0.910 1
1 795 . 8 1 1 A 78 78 ILE CB C 163 39.759 42.012 -2.253 1
1 799 . 8 1 1 A 78 78 ILE N N 163 121.604 120.901 0.703 1
1 800 . 8 1 1 A 79 79 ILE H H 164 8.514 8.731 -0.217 1
1 801 . 8 1 1 A 79 79 ILE HA H 164 4.341 4.786 -0.445 1
1 811 . 8 1 1 A 79 79 ILE C C 164 175.172 174.708 0.464 1
1 812 . 8 1 1 A 79 79 ILE CA C 164 60.027 59.935 0.092 1
1 813 . 8 1 1 A 79 79 ILE CB C 164 40.153 41.009 -0.856 1
1 817 . 8 1 1 A 79 79 ILE N N 164 127.137 126.350 0.787 1
1 818 . 8 1 1 A 80 80 HIS H H 165 8.492 8.968 -0.476 1
1 819 . 8 1 1 A 80 80 HIS HA H 165 5.676 5.366 0.310 1
1 824 . 8 1 1 A 80 80 HIS C C 165 175.502 174.266 1.236 1
1 825 . 8 1 1 A 80 80 HIS CA C 165 57.043 55.000 2.043 1
1 826 . 8 1 1 A 80 80 HIS CB C 165 32.741 32.557 0.184 1
1 829 . 8 1 1 A 80 80 HIS N N 165 125.422 126.452 -1.030 1
1 830 . 8 1 1 A 81 81 THR H H 166 9.080 9.217 -0.137 1
1 831 . 8 1 1 A 81 81 THR HA H 166 4.999 4.820 0.179 1
1 836 . 8 1 1 A 81 81 THR C C 166 171.877 172.857 -0.980 1
1 837 . 8 1 1 A 81 81 THR CA C 166 59.924 61.137 -1.213 1
1 838 . 8 1 1 A 81 81 THR CB C 166 72.243 70.598 1.645 1
1 840 . 8 1 1 A 81 81 THR N N 166 117.682 114.238 3.444 1
1 841 . 8 1 1 A 82 82 LEU H H 167 8.062 7.983 0.079 1
1 842 . 8 1 1 A 82 82 LEU HA H 167 4.350 3.898 0.452 1
1 852 . 8 1 1 A 82 82 LEU C C 167 172.705 174.949 -2.244 1
1 853 . 8 1 1 A 82 82 LEU CA C 167 53.553 55.534 -1.981 1
1 854 . 8 1 1 A 82 82 LEU CB C 167 39.768 41.331 -1.563 1
1 858 . 8 1 1 A 82 82 LEU N N 167 125.369 127.141 -1.772 1
1 859 . 8 1 1 A 83 83 ILE H H 168 8.657 8.197 0.460 1
1 860 . 8 1 1 A 83 83 ILE HA H 168 4.476 4.926 -0.450 1
1 870 . 8 1 1 A 83 83 ILE C C 168 175.159 174.427 0.732 1
1 871 . 8 1 1 A 83 83 ILE CA C 168 58.529 59.826 -1.297 1
1 872 . 8 1 1 A 83 83 ILE CB C 168 37.410 41.048 -3.638 1
1 876 . 8 1 1 A 83 83 ILE N N 168 128.042 127.184 0.858 1
1 877 . 8 1 1 A 84 84 VAL H H 169 8.464 8.504 -0.040 1
1 878 . 8 1 1 A 84 84 VAL HA H 169 4.284 4.395 -0.111 1
1 886 . 8 1 1 A 84 84 VAL C C 169 176.138 175.690 0.448 1
1 887 . 8 1 1 A 84 84 VAL CA C 169 61.029 61.165 -0.136 1
1 888 . 8 1 1 A 84 84 VAL CB C 169 34.714 34.073 0.641 1
1 891 . 8 1 1 A 84 84 VAL N N 169 124.644 126.768 -2.124 1
1 892 . 8 1 1 A 85 85 ASP H H 170 9.158 8.864 0.294 1
1 893 . 8 1 1 A 85 85 ASP HA H 170 4.362 4.263 0.099 1
1 896 . 8 1 1 A 85 85 ASP C C 170 175.489 175.074 0.415 1
1 897 . 8 1 1 A 85 85 ASP CA C 170 55.868 55.155 0.713 1
1 898 . 8 1 1 A 85 85 ASP CB C 170 38.927 39.447 -0.520 1
1 899 . 8 1 1 A 85 85 ASP N N 170 129.061 127.575 1.486 1
1 900 . 8 1 1 A 86 86 ASN H H 171 8.811 8.510 0.301 1
1 901 . 8 1 1 A 86 86 ASN HA H 171 4.053 4.403 -0.350 1
1 906 . 8 1 1 A 86 86 ASN C C 171 173.802 173.772 0.030 1
1 907 . 8 1 1 A 86 86 ASN CA C 171 55.173 54.685 0.488 1
1 908 . 8 1 1 A 86 86 ASN CB C 171 38.150 36.932 1.218 1
1 909 . 8 1 1 A 86 86 ASN N N 171 108.418 108.749 -0.331 1
1 911 . 8 1 1 A 87 87 ARG H H 172 7.914 7.511 0.403 1
1 912 . 8 1 1 A 87 87 ARG HA H 172 4.597 4.666 -0.069 1
1 919 . 8 1 1 A 87 87 ARG C C 172 174.025 174.721 -0.696 1
1 920 . 8 1 1 A 87 87 ARG CA C 172 54.846 54.314 0.532 1
1 921 . 8 1 1 A 87 87 ARG CB C 172 32.697 33.109 -0.412 1
1 924 . 8 1 1 A 87 87 ARG N N 172 120.988 117.451 3.537 1
1 925 . 8 1 1 A 88 88 GLU H H 173 8.534 8.765 -0.231 1
1 926 . 8 1 1 A 88 88 GLU HA H 173 4.560 4.346 0.214 1
1 931 . 8 1 1 A 88 88 GLU C C 173 176.187 175.445 0.742 1
1 932 . 8 1 1 A 88 88 GLU CA C 173 56.044 56.844 -0.800 1
1 933 . 8 1 1 A 88 88 GLU CB C 173 30.329 30.359 -0.030 1
1 935 . 8 1 1 A 88 88 GLU N N 173 123.982 124.945 -0.963 1
1 936 . 8 1 1 A 89 89 ILE H H 174 8.897 7.936 0.961 1
1 937 . 8 1 1 A 89 89 ILE HA H 174 4.666 4.527 0.139 1
1 947 . 8 1 1 A 89 89 ILE C C 174 174.110 174.159 -0.049 1
1 948 . 8 1 1 A 89 89 ILE CA C 174 55.255 57.267 -2.012 1
1 949 . 8 1 1 A 89 89 ILE CB C 174 37.851 41.440 -3.589 1
1 953 . 8 1 1 A 89 89 ILE N N 174 130.008 127.250 2.758 1
1 954 . 8 1 1 A 90 90 PRO HA H 175 4.713 4.733 -0.020 1
1 961 . 8 1 1 A 90 90 PRO C C 175 176.956 176.288 0.668 1
1 962 . 8 1 1 A 90 90 PRO CA C 175 63.159 62.889 0.270 1
1 963 . 8 1 1 A 90 90 PRO CB C 175 32.428 32.376 0.052 1
1 966 . 8 1 1 A 91 91 GLU H H 176 8.778 8.736 0.042 1
1 967 . 8 1 1 A 91 91 GLU HA H 176 3.910 4.829 -0.919 1
1 972 . 8 1 1 A 91 91 GLU C C 176 176.426 176.340 0.086 1
1 973 . 8 1 1 A 91 91 GLU CA C 176 56.738 55.892 0.846 1
1 974 . 8 1 1 A 91 91 GLU CB C 176 30.540 31.241 -0.701 1
1 976 . 8 1 1 A 91 91 GLU N N 176 124.561 122.044 2.517 1
1 977 . 8 1 1 A 92 92 LEU H H 177 8.630 8.251 0.379 1
1 978 . 8 1 1 A 92 92 LEU HA H 177 4.419 4.453 -0.034 1
1 988 . 8 1 1 A 92 92 LEU C C 177 177.162 176.005 1.157 1
1 989 . 8 1 1 A 92 92 LEU CA C 177 55.350 55.604 -0.254 1
1 990 . 8 1 1 A 92 92 LEU CB C 177 42.390 42.420 -0.030 1
1 994 . 8 1 1 A 92 92 LEU N N 177 126.683 127.198 -0.515 1
1 995 . 8 1 1 A 93 93 THR H H 178 8.375 8.673 -0.298 1
1 996 . 8 1 1 A 93 93 THR HA H 178 4.359 5.310 -0.951 1
1 1001 . 8 1 1 A 93 93 THR C C 178 173.589 172.814 0.775 1
1 1002 . 8 1 1 A 93 93 THR CA C 178 61.621 59.559 2.062 1
1 1003 . 8 1 1 A 93 93 THR CB C 178 69.724 72.914 -3.190 1
1 1005 . 8 1 1 A 93 93 THR N N 178 119.699 113.329 6.370 1
1 1 . 9 1 1 A 9 9 SER H H 94 8.475 7.767 0.708 1
1 2 . 9 1 1 A 9 9 SER CA C 94 58.531 59.158 -0.627 1
1 3 . 9 1 1 A 9 9 SER N N 94 117.432 114.472 2.960 1
1 4 . 9 1 1 A 10 10 LYS H H 95 8.527 8.640 -0.113 1
1 5 . 9 1 1 A 10 10 LYS C C 95 174.594 174.522 0.072 1
1 6 . 9 1 1 A 10 10 LYS CA C 95 56.603 55.317 1.286 1
1 7 . 9 1 1 A 10 10 LYS N N 95 123.104 123.998 -0.894 1
1 8 . 9 1 1 A 11 11 THR H H 96 8.245 8.928 -0.683 1
1 9 . 9 1 1 A 11 11 THR C C 96 174.393 173.954 0.439 1
1 10 . 9 1 1 A 11 11 THR CA C 96 62.149 61.853 0.296 1
1 11 . 9 1 1 A 11 11 THR CB C 96 69.183 70.767 -1.584 1
1 13 . 9 1 1 A 11 11 THR N N 96 113.245 118.949 -5.704 1
1 14 . 9 1 1 A 12 12 THR H H 97 7.769 8.621 -0.852 1
1 15 . 9 1 1 A 12 12 THR HA H 97 5.583 4.981 0.602 1
1 20 . 9 1 1 A 12 12 THR C C 97 174.726 171.916 2.810 1
1 21 . 9 1 1 A 12 12 THR CA C 97 59.602 60.708 -1.106 1
1 22 . 9 1 1 A 12 12 THR CB C 97 72.805 71.562 1.243 1
1 24 . 9 1 1 A 12 12 THR N N 97 113.440 116.593 -3.153 1
1 25 . 9 1 1 A 13 13 SER H H 98 8.593 8.547 0.046 1
1 26 . 9 1 1 A 13 13 SER HA H 98 4.448 5.056 -0.608 1
1 29 . 9 1 1 A 13 13 SER C C 98 171.426 173.177 -1.751 1
1 30 . 9 1 1 A 13 13 SER CA C 98 59.056 57.374 1.682 1
1 31 . 9 1 1 A 13 13 SER CB C 98 67.839 63.888 3.951 1
1 32 . 9 1 1 A 13 13 SER N N 98 119.042 121.560 -2.518 1
1 33 . 9 1 1 A 14 14 THR H H 99 8.155 8.287 -0.132 1
1 34 . 9 1 1 A 14 14 THR HA H 99 5.383 5.249 0.134 1
1 39 . 9 1 1 A 14 14 THR C C 99 171.565 173.014 -1.449 1
1 40 . 9 1 1 A 14 14 THR CA C 99 61.291 58.899 2.392 1
1 41 . 9 1 1 A 14 14 THR CB C 99 71.654 71.743 -0.089 1
1 43 . 9 1 1 A 14 14 THR N N 99 118.204 115.990 2.214 1
1 44 . 9 1 1 A 15 15 TRP H H 100 9.637 9.053 0.584 1
1 45 . 9 1 1 A 15 15 TRP HA H 100 4.807 5.143 -0.336 1
1 54 . 9 1 1 A 15 15 TRP C C 100 174.399 175.444 -1.045 1
1 55 . 9 1 1 A 15 15 TRP CA C 100 58.302 55.825 2.477 1
1 56 . 9 1 1 A 15 15 TRP CB C 100 34.810 33.674 1.136 1
1 63 . 9 1 1 A 15 15 TRP N N 100 125.132 120.612 4.520 1
1 65 . 9 1 1 A 16 16 VAL H H 101 8.863 8.674 0.189 1
1 66 . 9 1 1 A 16 16 VAL HA H 101 5.267 4.864 0.403 1
1 74 . 9 1 1 A 16 16 VAL C C 101 174.955 175.085 -0.130 1
1 75 . 9 1 1 A 16 16 VAL CA C 101 60.653 61.377 -0.724 1
1 76 . 9 1 1 A 16 16 VAL CB C 101 34.284 34.211 0.073 1
1 79 . 9 1 1 A 16 16 VAL N N 101 119.527 121.380 -1.853 1
1 80 . 9 1 1 A 17 17 LEU H H 102 8.961 8.881 0.080 1
1 81 . 9 1 1 A 17 17 LEU HA H 102 4.729 5.113 -0.384 1
1 91 . 9 1 1 A 17 17 LEU C C 102 173.559 175.257 -1.698 1
1 92 . 9 1 1 A 17 17 LEU CA C 102 55.144 53.132 2.012 1
1 93 . 9 1 1 A 17 17 LEU CB C 102 42.948 45.874 -2.926 1
1 97 . 9 1 1 A 17 17 LEU N N 102 124.280 123.894 0.386 1
1 98 . 9 1 1 A 18 18 ARG H H 103 8.305 8.420 -0.115 1
1 99 . 9 1 1 A 18 18 ARG HA H 103 5.139 4.653 0.486 1
1 106 . 9 1 1 A 18 18 ARG C C 103 175.347 175.190 0.157 1
1 107 . 9 1 1 A 18 18 ARG CA C 103 54.793 56.136 -1.343 1
1 108 . 9 1 1 A 18 18 ARG CB C 103 31.347 29.632 1.715 1
1 111 . 9 1 1 A 18 18 ARG N N 103 122.020 120.339 1.681 1
1 112 . 9 1 1 A 19 19 LEU H H 104 8.676 8.794 -0.118 1
1 113 . 9 1 1 A 19 19 LEU HA H 104 4.482 4.838 -0.356 1
1 123 . 9 1 1 A 19 19 LEU C C 104 175.957 175.998 -0.041 1
1 124 . 9 1 1 A 19 19 LEU CA C 104 53.581 53.628 -0.047 1
1 125 . 9 1 1 A 19 19 LEU CB C 104 45.697 45.302 0.395 1
1 129 . 9 1 1 A 19 19 LEU N N 104 126.378 125.055 1.323 1
1 130 . 9 1 1 A 20 20 ASP H H 105 9.390 9.484 -0.094 1
1 131 . 9 1 1 A 20 20 ASP HA H 105 4.287 4.380 -0.093 1
1 134 . 9 1 1 A 20 20 ASP C C 105 175.947 175.423 0.524 1
1 135 . 9 1 1 A 20 20 ASP CA C 105 55.263 55.099 0.164 1
1 136 . 9 1 1 A 20 20 ASP CB C 105 39.239 39.933 -0.694 1
1 137 . 9 1 1 A 20 20 ASP N N 105 125.208 125.969 -0.761 1
1 138 . 9 1 1 A 21 21 GLY H H 106 8.563 8.630 -0.067 1
1 139 . 9 1 1 A 21 21 GLY HA2 H 106 4.126 3.834 0.292 1
1 140 . 9 1 1 A 21 21 GLY HA3 H 106 3.509 3.841 -0.332 1
1 141 . 9 1 1 A 21 21 GLY C C 106 173.164 173.709 -0.545 1
1 142 . 9 1 1 A 21 21 GLY CA C 106 45.499 45.538 -0.039 1
1 143 . 9 1 1 A 21 21 GLY N N 106 103.331 104.774 -1.443 1
1 144 . 9 1 1 A 22 22 GLU H H 107 7.713 8.009 -0.296 1
1 145 . 9 1 1 A 22 22 GLU HA H 107 4.634 4.936 -0.302 1
1 150 . 9 1 1 A 22 22 GLU C C 107 174.800 175.628 -0.828 1
1 151 . 9 1 1 A 22 22 GLU CA C 107 54.329 54.380 -0.051 1
1 152 . 9 1 1 A 22 22 GLU CB C 107 32.832 34.114 -1.282 1
1 154 . 9 1 1 A 22 22 GLU N N 107 119.470 119.352 0.118 1
1 155 . 9 1 1 A 23 23 ASP H H 108 8.632 8.501 0.131 1
1 156 . 9 1 1 A 23 23 ASP HA H 108 4.872 4.709 0.163 1
1 159 . 9 1 1 A 23 23 ASP C C 108 175.533 175.240 0.293 1
1 160 . 9 1 1 A 23 23 ASP CA C 108 55.180 53.672 1.508 1
1 161 . 9 1 1 A 23 23 ASP CB C 108 41.504 39.701 1.803 1
1 162 . 9 1 1 A 23 23 ASP N N 108 122.815 122.386 0.429 1
1 163 . 9 1 1 A 24 24 LEU H H 109 9.248 8.919 0.329 1
1 164 . 9 1 1 A 24 24 LEU HA H 109 4.836 4.913 -0.077 1
1 174 . 9 1 1 A 24 24 LEU C C 109 174.322 175.848 -1.526 1
1 175 . 9 1 1 A 24 24 LEU CA C 109 54.473 55.342 -0.869 1
1 176 . 9 1 1 A 24 24 LEU CB C 109 44.718 42.708 2.010 1
1 180 . 9 1 1 A 24 24 LEU N N 109 125.550 126.923 -1.373 1
1 181 . 9 1 1 A 25 25 ARG H H 110 8.503 8.474 0.029 1
1 182 . 9 1 1 A 25 25 ARG HA H 110 5.228 5.083 0.145 1
1 189 . 9 1 1 A 25 25 ARG C C 110 175.174 174.736 0.438 1
1 190 . 9 1 1 A 25 25 ARG CA C 110 54.745 54.666 0.079 1
1 191 . 9 1 1 A 25 25 ARG CB C 110 31.701 32.005 -0.304 1
1 194 . 9 1 1 A 25 25 ARG N N 110 125.424 127.258 -1.834 1
1 195 . 9 1 1 A 26 26 VAL H H 111 9.692 9.114 0.578 1
1 196 . 9 1 1 A 26 26 VAL HA H 111 5.091 4.978 0.113 1
1 204 . 9 1 1 A 26 26 VAL C C 111 174.446 175.335 -0.889 1
1 205 . 9 1 1 A 26 26 VAL CA C 111 61.055 61.913 -0.858 1
1 206 . 9 1 1 A 26 26 VAL CB C 111 33.780 33.275 0.505 1
1 209 . 9 1 1 A 26 26 VAL N N 111 130.649 127.041 3.608 1
1 210 . 9 1 1 A 27 27 VAL H H 112 9.401 8.950 0.451 1
1 211 . 9 1 1 A 27 27 VAL HA H 112 5.188 4.653 0.535 1
1 219 . 9 1 1 A 27 27 VAL C C 112 174.214 174.408 -0.194 1
1 220 . 9 1 1 A 27 27 VAL CA C 112 60.722 60.927 -0.205 1
1 221 . 9 1 1 A 27 27 VAL CB C 112 36.082 35.084 0.998 1
1 224 . 9 1 1 A 27 27 VAL N N 112 127.416 127.381 0.035 1
1 225 . 9 1 1 A 28 28 LEU H H 113 9.265 9.131 0.134 1
1 226 . 9 1 1 A 28 28 LEU HA H 113 5.337 5.379 -0.042 1
1 236 . 9 1 1 A 28 28 LEU C C 113 175.915 174.874 1.041 1
1 237 . 9 1 1 A 28 28 LEU CA C 113 52.599 53.423 -0.824 1
1 238 . 9 1 1 A 28 28 LEU CB C 113 47.495 44.294 3.201 1
1 242 . 9 1 1 A 28 28 LEU N N 113 127.527 130.057 -2.530 1
1 243 . 9 1 1 A 29 29 GLU H H 114 8.968 8.550 0.418 1
1 244 . 9 1 1 A 29 29 GLU HA H 114 4.701 4.434 0.267 1
1 249 . 9 1 1 A 29 29 GLU C C 114 176.715 177.765 -1.050 1
1 250 . 9 1 1 A 29 29 GLU CA C 114 55.342 56.675 -1.333 1
1 251 . 9 1 1 A 29 29 GLU CB C 114 30.005 30.337 -0.332 1
1 253 . 9 1 1 A 29 29 GLU N N 114 127.374 127.360 0.014 1
1 254 . 9 1 1 A 30 30 LYS H H 115 8.243 8.174 0.069 1
1 255 . 9 1 1 A 30 30 LYS HA H 115 3.711 4.054 -0.343 1
1 264 . 9 1 1 A 30 30 LYS C C 115 177.137 178.353 -1.216 1
1 265 . 9 1 1 A 30 30 LYS CA C 115 60.118 58.654 1.464 1
1 266 . 9 1 1 A 30 30 LYS CB C 115 32.656 32.080 0.576 1
1 270 . 9 1 1 A 30 30 LYS N N 115 124.225 125.561 -1.336 1
1 271 . 9 1 1 A 31 31 ASP H H 116 9.200 8.076 1.124 1
1 272 . 9 1 1 A 31 31 ASP HA H 116 4.444 4.432 0.012 1
1 275 . 9 1 1 A 31 31 ASP C C 116 177.774 177.422 0.352 1
1 276 . 9 1 1 A 31 31 ASP CA C 116 56.703 57.561 -0.858 1
1 277 . 9 1 1 A 31 31 ASP CB C 116 40.236 41.002 -0.766 1
1 278 . 9 1 1 A 31 31 ASP N N 116 115.955 120.799 -4.844 1
1 279 . 9 1 1 A 32 32 THR H H 117 7.352 7.677 -0.325 1
1 280 . 9 1 1 A 32 32 THR HA H 117 4.266 4.623 -0.357 1
1 285 . 9 1 1 A 32 32 THR C C 117 175.320 174.159 1.161 1
1 286 . 9 1 1 A 32 32 THR CA C 117 61.171 60.845 0.326 1
1 287 . 9 1 1 A 32 32 THR CB C 117 70.221 69.368 0.853 1
1 289 . 9 1 1 A 32 32 THR N N 117 106.440 105.481 0.959 1
1 290 . 9 1 1 A 33 33 MET H H 118 8.216 7.959 0.257 1
1 291 . 9 1 1 A 33 33 MET HA H 118 4.184 4.139 0.045 1
1 299 . 9 1 1 A 33 33 MET C C 118 174.952 174.437 0.515 1
1 300 . 9 1 1 A 33 33 MET CA C 118 55.195 56.810 -1.615 1
1 301 . 9 1 1 A 33 33 MET CB C 118 25.900 31.073 -5.173 1
1 304 . 9 1 1 A 33 33 MET N N 118 115.956 116.682 -0.726 1
1 305 . 9 1 1 A 34 34 ASP H H 119 7.509 7.923 -0.414 1
1 306 . 9 1 1 A 34 34 ASP HA H 119 4.486 4.799 -0.313 1
1 309 . 9 1 1 A 34 34 ASP C C 119 174.375 175.662 -1.287 1
1 310 . 9 1 1 A 34 34 ASP CA C 119 54.745 54.385 0.360 1
1 311 . 9 1 1 A 34 34 ASP CB C 119 42.865 42.165 0.700 1
1 312 . 9 1 1 A 34 34 ASP N N 119 118.500 118.699 -0.199 1
1 313 . 9 1 1 A 35 35 VAL H H 120 8.473 8.495 -0.022 1
1 314 . 9 1 1 A 35 35 VAL HA H 120 4.709 4.708 0.001 1
1 322 . 9 1 1 A 35 35 VAL C C 120 173.900 174.143 -0.243 1
1 323 . 9 1 1 A 35 35 VAL CA C 120 60.736 60.969 -0.233 1
1 324 . 9 1 1 A 35 35 VAL CB C 120 34.662 32.783 1.879 1
1 327 . 9 1 1 A 35 35 VAL N N 120 121.116 124.501 -3.385 1
1 328 . 9 1 1 A 36 36 TRP H H 121 9.404 9.216 0.188 1
1 329 . 9 1 1 A 36 36 TRP HA H 121 5.174 5.451 -0.277 1
1 338 . 9 1 1 A 36 36 TRP C C 121 176.480 174.348 2.132 1
1 339 . 9 1 1 A 36 36 TRP CA C 121 55.070 54.433 0.637 1
1 340 . 9 1 1 A 36 36 TRP CB C 121 32.179 31.951 0.228 1
1 348 . 9 1 1 A 36 36 TRP N N 121 126.924 129.017 -2.093 1
1 350 . 9 1 1 A 37 37 CYS H H 122 9.230 8.062 1.168 1
1 351 . 9 1 1 A 37 37 CYS HA H 122 5.417 4.833 0.584 1
1 354 . 9 1 1 A 37 37 CYS C C 122 175.346 175.024 0.322 1
1 355 . 9 1 1 A 37 37 CYS CA C 122 57.083 57.510 -0.427 1
1 356 . 9 1 1 A 37 37 CYS CB C 122 28.713 28.229 0.484 1
1 357 . 9 1 1 A 37 37 CYS N N 122 120.375 127.294 -6.919 1
1 358 . 9 1 1 A 38 38 ASN H H 123 9.817 9.435 0.382 1
1 359 . 9 1 1 A 38 38 ASN HA H 123 4.637 4.432 0.205 1
1 364 . 9 1 1 A 38 38 ASN C C 123 175.526 175.305 0.221 1
1 365 . 9 1 1 A 38 38 ASN CA C 123 54.023 55.440 -1.417 1
1 366 . 9 1 1 A 38 38 ASN CB C 123 36.581 37.435 -0.854 1
1 367 . 9 1 1 A 38 38 ASN N N 123 129.408 121.275 8.133 1
1 369 . 9 1 1 A 39 39 GLY H H 124 9.092 8.387 0.705 1
1 370 . 9 1 1 A 39 39 GLY HA2 H 124 4.241 4.251 -0.010 1
1 371 . 9 1 1 A 39 39 GLY HA3 H 124 3.705 4.535 -0.830 1
1 372 . 9 1 1 A 39 39 GLY C C 124 173.405 173.059 0.346 1
1 373 . 9 1 1 A 39 39 GLY CA C 124 45.595 45.935 -0.340 1
1 374 . 9 1 1 A 39 39 GLY N N 124 102.752 106.596 -3.844 1
1 375 . 9 1 1 A 40 40 GLN H H 125 8.006 6.861 1.145 1
1 376 . 9 1 1 A 40 40 GLN HA H 125 4.736 4.361 0.375 1
1 383 . 9 1 1 A 40 40 GLN C C 125 174.477 172.811 1.666 1
1 384 . 9 1 1 A 40 40 GLN CA C 125 53.747 53.998 -0.251 1
1 385 . 9 1 1 A 40 40 GLN CB C 125 30.413 31.781 -1.368 1
1 387 . 9 1 1 A 40 40 GLN N N 125 120.627 119.627 1.000 1
1 389 . 9 1 1 A 41 41 LYS H H 126 8.757 7.561 1.196 1
1 390 . 9 1 1 A 41 41 LYS HA H 126 3.464 3.366 0.098 1
1 399 . 9 1 1 A 41 41 LYS C C 126 176.870 174.988 1.882 1
1 400 . 9 1 1 A 41 41 LYS CA C 126 57.136 56.042 1.094 1
1 401 . 9 1 1 A 41 41 LYS CB C 126 31.669 33.046 -1.377 1
1 405 . 9 1 1 A 41 41 LYS N N 126 129.107 124.684 4.423 1
1 406 . 9 1 1 A 42 42 MET H H 127 8.682 8.166 0.516 1
1 407 . 9 1 1 A 42 42 MET HA H 127 4.712 5.143 -0.431 1
1 415 . 9 1 1 A 42 42 MET C C 127 176.816 173.986 2.830 1
1 416 . 9 1 1 A 42 42 MET CA C 127 52.958 53.592 -0.634 1
1 417 . 9 1 1 A 42 42 MET CB C 127 33.023 37.010 -3.987 1
1 420 . 9 1 1 A 42 42 MET N N 127 126.569 124.386 2.183 1
1 421 . 9 1 1 A 43 43 GLU H H 128 8.734 8.883 -0.149 1
1 422 . 9 1 1 A 43 43 GLU HA H 128 4.419 4.952 -0.533 1
1 427 . 9 1 1 A 43 43 GLU C C 128 176.531 176.180 0.351 1
1 428 . 9 1 1 A 43 43 GLU CA C 128 56.475 55.122 1.353 1
1 429 . 9 1 1 A 43 43 GLU CB C 128 29.604 31.837 -2.233 1
1 431 . 9 1 1 A 43 43 GLU N N 128 123.734 122.761 0.973 1
1 432 . 9 1 1 A 44 44 THR H H 129 8.263 8.918 -0.655 1
1 433 . 9 1 1 A 44 44 THR HA H 129 5.385 5.332 0.053 1
1 438 . 9 1 1 A 44 44 THR C C 129 174.205 174.510 -0.305 1
1 439 . 9 1 1 A 44 44 THR CA C 129 59.160 60.418 -1.258 1
1 440 . 9 1 1 A 44 44 THR CB C 129 72.419 71.175 1.244 1
1 442 . 9 1 1 A 44 44 THR N N 129 115.081 117.950 -2.869 1
1 443 . 9 1 1 A 45 45 ALA H H 130 8.727 8.231 0.496 1
1 444 . 9 1 1 A 45 45 ALA HA H 130 4.749 4.553 0.196 1
1 448 . 9 1 1 A 45 45 ALA C C 130 177.017 178.503 -1.486 1
1 449 . 9 1 1 A 45 45 ALA CA C 130 51.645 52.318 -0.673 1
1 450 . 9 1 1 A 45 45 ALA CB C 130 21.364 20.756 0.608 1
1 451 . 9 1 1 A 45 45 ALA N N 130 123.243 122.627 0.616 1
1 452 . 9 1 1 A 46 46 GLY H H 131 8.818 8.119 0.699 1
1 453 . 9 1 1 A 46 46 GLY HA2 H 131 4.941 3.971 0.970 1
1 454 . 9 1 1 A 46 46 GLY HA3 H 131 3.690 3.978 -0.288 1
1 455 . 9 1 1 A 46 46 GLY C C 131 173.528 174.866 -1.338 1
1 456 . 9 1 1 A 46 46 GLY CA C 131 45.060 47.009 -1.949 1
1 457 . 9 1 1 A 46 46 GLY N N 131 112.392 108.069 4.323 1
1 458 . 9 1 1 A 47 47 GLU H H 132 8.746 7.727 1.019 1
1 459 . 9 1 1 A 47 47 GLU HA H 132 4.584 4.382 0.202 1
1 464 . 9 1 1 A 47 47 GLU C C 132 175.223 175.761 -0.538 1
1 465 . 9 1 1 A 47 47 GLU CA C 132 55.008 55.803 -0.795 1
1 466 . 9 1 1 A 47 47 GLU CB C 132 32.939 29.892 3.047 1
1 468 . 9 1 1 A 47 47 GLU N N 132 122.107 120.765 1.342 1
1 469 . 9 1 1 A 48 48 PHE H H 133 8.920 8.701 0.219 1
1 470 . 9 1 1 A 48 48 PHE HA H 133 4.822 4.750 0.072 1
1 475 . 9 1 1 A 48 48 PHE C C 133 175.499 175.879 -0.380 1
1 476 . 9 1 1 A 48 48 PHE CA C 133 58.320 56.939 1.381 1
1 477 . 9 1 1 A 48 48 PHE CB C 133 39.175 39.779 -0.604 1
1 479 . 9 1 1 A 48 48 PHE N N 133 124.006 123.795 0.211 1
1 480 . 9 1 1 A 49 49 VAL H H 134 8.161 8.591 -0.430 1
1 481 . 9 1 1 A 49 49 VAL HA H 134 4.492 4.716 -0.224 1
1 489 . 9 1 1 A 49 49 VAL C C 134 176.241 176.863 -0.622 1
1 490 . 9 1 1 A 49 49 VAL CA C 134 60.328 59.414 0.914 1
1 491 . 9 1 1 A 49 49 VAL CB C 134 34.542 34.418 0.124 1
1 494 . 9 1 1 A 49 49 VAL N N 134 120.063 119.005 1.058 1
1 495 . 9 1 1 A 50 50 ASP H H 135 8.596 8.469 0.127 1
1 496 . 9 1 1 A 50 50 ASP HA H 135 4.278 4.427 -0.149 1
1 499 . 9 1 1 A 50 50 ASP C C 135 176.567 176.668 -0.101 1
1 500 . 9 1 1 A 50 50 ASP CA C 135 57.149 56.789 0.360 1
1 501 . 9 1 1 A 50 50 ASP CB C 135 40.477 40.903 -0.426 1
1 502 . 9 1 1 A 50 50 ASP N N 135 122.137 120.949 1.188 1
1 503 . 9 1 1 A 51 51 ASP H H 136 8.328 7.687 0.641 1
1 504 . 9 1 1 A 51 51 ASP HA H 136 4.656 5.096 -0.440 1
1 507 . 9 1 1 A 51 51 ASP C C 136 175.798 174.851 0.947 1
1 508 . 9 1 1 A 51 51 ASP CA C 136 53.458 53.381 0.077 1
1 509 . 9 1 1 A 51 51 ASP CB C 136 40.306 42.988 -2.682 1
1 510 . 9 1 1 A 51 51 ASP N N 136 116.158 116.226 -0.068 1
1 511 . 9 1 1 A 52 52 GLY H H 137 7.653 8.386 -0.733 1
1 512 . 9 1 1 A 52 52 GLY HA2 H 137 4.685 4.120 0.565 1
1 513 . 9 1 1 A 52 52 GLY HA3 H 137 4.069 4.122 -0.053 1
1 514 . 9 1 1 A 52 52 GLY C C 137 173.149 172.680 0.469 1
1 515 . 9 1 1 A 52 52 GLY CA C 137 45.860 44.024 1.836 1
1 516 . 9 1 1 A 52 52 GLY N N 137 107.634 111.913 -4.279 1
1 517 . 9 1 1 A 53 53 THR H H 138 8.445 8.187 0.258 1
1 518 . 9 1 1 A 53 53 THR HA H 138 4.996 5.059 -0.063 1
1 523 . 9 1 1 A 53 53 THR C C 138 174.163 173.266 0.897 1
1 524 . 9 1 1 A 53 53 THR CA C 138 60.974 61.628 -0.654 1
1 525 . 9 1 1 A 53 53 THR CB C 138 72.266 72.007 0.259 1
1 527 . 9 1 1 A 53 53 THR N N 138 114.976 114.491 0.485 1
1 528 . 9 1 1 A 54 54 GLU H H 139 8.917 8.831 0.086 1
1 529 . 9 1 1 A 54 54 GLU HA H 139 5.205 4.719 0.486 1
1 534 . 9 1 1 A 54 54 GLU C C 139 175.700 175.041 0.659 1
1 535 . 9 1 1 A 54 54 GLU CA C 139 54.731 55.360 -0.629 1
1 536 . 9 1 1 A 54 54 GLU CB C 139 33.250 30.084 3.166 1
1 538 . 9 1 1 A 54 54 GLU N N 139 121.295 126.126 -4.831 1
1 539 . 9 1 1 A 55 55 THR H H 140 9.190 8.573 0.617 1
1 540 . 9 1 1 A 55 55 THR HA H 140 4.744 4.631 0.113 1
1 545 . 9 1 1 A 55 55 THR C C 140 174.537 173.698 0.839 1
1 546 . 9 1 1 A 55 55 THR CA C 140 62.678 62.105 0.573 1
1 547 . 9 1 1 A 55 55 THR CB C 140 69.744 68.899 0.845 1
1 549 . 9 1 1 A 55 55 THR N N 140 122.419 122.075 0.344 1
1 550 . 9 1 1 A 56 56 HIS H H 141 9.395 8.947 0.448 1
1 551 . 9 1 1 A 56 56 HIS HA H 141 5.204 5.027 0.177 1
1 556 . 9 1 1 A 56 56 HIS C C 141 174.675 174.499 0.176 1
1 557 . 9 1 1 A 56 56 HIS CA C 141 55.557 53.887 1.670 1
1 558 . 9 1 1 A 56 56 HIS CB C 141 31.279 30.887 0.392 1
1 561 . 9 1 1 A 56 56 HIS N N 141 125.732 125.581 0.151 1
1 564 . 9 1 1 A 57 57 PHE H H 142 8.790 8.349 0.441 1
1 565 . 9 1 1 A 57 57 PHE HA H 142 4.918 5.992 -1.074 1
1 571 . 9 1 1 A 57 57 PHE C C 142 172.293 174.119 -1.826 1
1 572 . 9 1 1 A 57 57 PHE CA C 142 56.366 55.216 1.150 1
1 573 . 9 1 1 A 57 57 PHE CB C 142 39.962 42.317 -2.355 1
1 575 . 9 1 1 A 57 57 PHE N N 142 117.009 121.570 -4.561 1
1 576 . 9 1 1 A 58 58 SER H H 143 8.890 9.016 -0.126 1
1 577 . 9 1 1 A 58 58 SER HA H 143 5.286 5.175 0.111 1
1 580 . 9 1 1 A 58 58 SER C C 143 173.716 174.375 -0.659 1
1 581 . 9 1 1 A 58 58 SER CA C 143 57.517 56.934 0.583 1
1 582 . 9 1 1 A 58 58 SER CB C 143 65.448 65.203 0.245 1
1 583 . 9 1 1 A 58 58 SER N N 143 115.269 116.022 -0.753 1
1 584 . 9 1 1 A 59 59 VAL H H 144 7.737 8.732 -0.995 1
1 585 . 9 1 1 A 59 59 VAL HA H 144 4.220 4.396 -0.176 1
1 593 . 9 1 1 A 59 59 VAL C C 144 176.234 176.044 0.190 1
1 594 . 9 1 1 A 59 59 VAL CA C 144 61.741 60.910 0.831 1
1 595 . 9 1 1 A 59 59 VAL CB C 144 33.711 33.998 -0.287 1
1 598 . 9 1 1 A 59 59 VAL N N 144 123.186 121.380 1.806 1
1 599 . 9 1 1 A 60 60 GLY H H 145 8.945 8.981 -0.036 1
1 600 . 9 1 1 A 60 60 GLY HA2 H 145 4.027 3.683 0.344 1
1 601 . 9 1 1 A 60 60 GLY HA3 H 145 3.692 3.771 -0.079 1
1 602 . 9 1 1 A 60 60 GLY C C 145 175.182 174.581 0.601 1
1 603 . 9 1 1 A 60 60 GLY CA C 145 47.141 47.198 -0.057 1
1 604 . 9 1 1 A 60 60 GLY N N 145 116.908 117.461 -0.553 1
1 605 . 9 1 1 A 61 61 ASN H H 146 8.929 8.409 0.520 1
1 606 . 9 1 1 A 61 61 ASN HA H 146 4.718 4.834 -0.116 1
1 611 . 9 1 1 A 61 61 ASN C C 146 174.706 174.722 -0.016 1
1 612 . 9 1 1 A 61 61 ASN CA C 146 52.802 52.445 0.357 1
1 613 . 9 1 1 A 61 61 ASN CB C 146 37.917 38.626 -0.709 1
1 614 . 9 1 1 A 61 61 ASN N N 146 123.976 124.726 -0.750 1
1 616 . 9 1 1 A 62 62 HIS H H 147 8.400 7.680 0.720 1
1 617 . 9 1 1 A 62 62 HIS HA H 147 4.762 5.031 -0.269 1
1 622 . 9 1 1 A 62 62 HIS C C 147 173.871 173.499 0.372 1
1 623 . 9 1 1 A 62 62 HIS CA C 147 55.374 54.572 0.802 1
1 624 . 9 1 1 A 62 62 HIS CB C 147 28.655 33.680 -5.025 1
1 628 . 9 1 1 A 62 62 HIS N N 147 118.620 118.652 -0.032 1
1 631 . 9 1 1 A 63 63 ASP H H 148 8.734 9.048 -0.314 1
1 632 . 9 1 1 A 63 63 ASP HA H 148 4.785 5.432 -0.647 1
1 635 . 9 1 1 A 63 63 ASP C C 148 175.269 174.628 0.641 1
1 636 . 9 1 1 A 63 63 ASP CA C 148 54.390 53.318 1.072 1
1 637 . 9 1 1 A 63 63 ASP CB C 148 42.105 43.895 -1.790 1
1 638 . 9 1 1 A 63 63 ASP N N 148 125.336 117.748 7.588 1
1 639 . 9 1 1 A 64 64 CYS H H 149 8.225 9.031 -0.806 1
1 640 . 9 1 1 A 64 64 CYS HA H 149 5.118 5.285 -0.167 1
1 643 . 9 1 1 A 64 64 CYS C C 149 173.740 172.412 1.328 1
1 644 . 9 1 1 A 64 64 CYS CA C 149 55.423 56.404 -0.981 1
1 645 . 9 1 1 A 64 64 CYS CB C 149 29.972 32.349 -2.377 1
1 646 . 9 1 1 A 64 64 CYS N N 149 124.476 120.350 4.126 1
1 647 . 9 1 1 A 65 65 TYR H H 150 8.916 8.547 0.369 1
1 648 . 9 1 1 A 65 65 TYR HA H 150 5.121 3.960 1.161 1
1 655 . 9 1 1 A 65 65 TYR C C 150 172.821 171.925 0.896 1
1 656 . 9 1 1 A 65 65 TYR CA C 150 56.347 55.996 0.351 1
1 657 . 9 1 1 A 65 65 TYR CB C 150 38.901 40.395 -1.494 1
1 662 . 9 1 1 A 65 65 TYR N N 150 115.313 116.683 -1.370 1
1 663 . 9 1 1 A 66 66 ILE H H 151 8.423 8.991 -0.568 1
1 664 . 9 1 1 A 66 66 ILE HA H 151 5.000 4.342 0.658 1
1 674 . 9 1 1 A 66 66 ILE C C 151 176.225 174.704 1.521 1
1 675 . 9 1 1 A 66 66 ILE CA C 151 57.798 60.004 -2.206 1
1 676 . 9 1 1 A 66 66 ILE CB C 151 39.863 38.818 1.045 1
1 680 . 9 1 1 A 66 66 ILE N N 151 118.575 121.198 -2.623 1
1 681 . 9 1 1 A 67 67 LYS H H 152 9.480 8.796 0.684 1
1 682 . 9 1 1 A 67 67 LYS HA H 152 5.091 4.744 0.347 1
1 691 . 9 1 1 A 67 67 LYS C C 152 174.079 175.388 -1.309 1
1 692 . 9 1 1 A 67 67 LYS CA C 152 54.728 56.064 -1.336 1
1 693 . 9 1 1 A 67 67 LYS CB C 152 35.256 33.109 2.147 1
1 697 . 9 1 1 A 67 67 LYS N N 152 132.311 128.480 3.831 1
1 698 . 9 1 1 A 68 68 ALA H H 153 8.844 8.624 0.220 1
1 699 . 9 1 1 A 68 68 ALA HA H 153 5.039 5.577 -0.538 1
1 703 . 9 1 1 A 68 68 ALA C C 153 176.587 176.338 0.249 1
1 704 . 9 1 1 A 68 68 ALA CA C 153 50.484 50.606 -0.122 1
1 705 . 9 1 1 A 68 68 ALA CB C 153 20.570 22.177 -1.607 1
1 706 . 9 1 1 A 68 68 ALA N N 153 129.958 129.682 0.276 1
1 707 . 9 1 1 A 69 69 VAL H H 154 8.461 8.611 -0.150 1
1 708 . 9 1 1 A 69 69 VAL HA H 154 4.558 4.668 -0.110 1
1 716 . 9 1 1 A 69 69 VAL C C 154 175.331 175.008 0.323 1
1 717 . 9 1 1 A 69 69 VAL CA C 154 60.758 60.495 0.263 1
1 718 . 9 1 1 A 69 69 VAL CB C 154 34.743 35.748 -1.005 1
1 721 . 9 1 1 A 69 69 VAL N N 154 121.496 121.628 -0.132 1
1 722 . 9 1 1 A 70 70 SER H H 155 8.695 8.976 -0.281 1
1 723 . 9 1 1 A 70 70 SER HA H 155 4.646 5.353 -0.707 1
1 726 . 9 1 1 A 70 70 SER C C 155 174.690 173.991 0.699 1
1 727 . 9 1 1 A 70 70 SER CA C 155 58.065 56.667 1.398 1
1 728 . 9 1 1 A 70 70 SER CB C 155 64.062 65.009 -0.947 1
1 729 . 9 1 1 A 70 70 SER N N 155 119.763 121.609 -1.846 1
1 730 . 9 1 1 A 71 71 SER H H 156 8.360 9.119 -0.759 1
1 731 . 9 1 1 A 71 71 SER HA H 156 4.430 5.343 -0.913 1
1 734 . 9 1 1 A 71 71 SER CA C 156 58.491 57.132 1.359 1
1 735 . 9 1 1 A 71 71 SER CB C 156 64.061 66.785 -2.724 1
1 736 . 9 1 1 A 71 71 SER N N 156 118.577 118.550 0.027 1
1 737 . 9 1 1 A 72 72 GLY H H 157 8.542 8.413 0.129 1
1 738 . 9 1 1 A 72 72 GLY HA2 H 157 4.002 4.203 -0.201 1
1 739 . 9 1 1 A 72 72 GLY HA3 H 157 4.002 4.204 -0.202 1
1 740 . 9 1 1 A 72 72 GLY CA C 157 45.565 44.146 1.419 1
1 741 . 9 1 1 A 72 72 GLY N N 157 111.540 110.674 0.866 1
1 742 . 9 1 1 A 73 73 LYS H H 158 8.369 8.811 -0.442 1
1 743 . 9 1 1 A 73 73 LYS CA C 158 56.720 58.828 -2.108 1
1 744 . 9 1 1 A 73 73 LYS CB C 158 32.915 32.379 0.536 1
1 747 . 9 1 1 A 73 73 LYS N N 158 120.293 120.546 -0.253 1
1 748 . 9 1 1 A 74 74 ARG H H 159 8.181 7.974 0.207 1
1 749 . 9 1 1 A 74 74 ARG CA C 159 56.148 56.983 -0.835 1
1 751 . 9 1 1 A 74 74 ARG N N 159 119.343 116.457 2.886 1
1 752 . 9 1 1 A 75 75 LYS H H 160 8.443 7.641 0.802 1
1 753 . 9 1 1 A 75 75 LYS HA H 160 4.067 4.600 -0.533 1
1 762 . 9 1 1 A 75 75 LYS C C 160 176.868 177.109 -0.241 1
1 763 . 9 1 1 A 75 75 LYS CA C 160 57.711 55.155 2.556 1
1 764 . 9 1 1 A 75 75 LYS CB C 160 31.777 32.490 -0.713 1
1 768 . 9 1 1 A 75 75 LYS N N 160 120.467 114.716 5.751 1
1 769 . 9 1 1 A 76 76 GLU H H 161 8.693 8.317 0.376 1
1 770 . 9 1 1 A 76 76 GLU HA H 161 4.290 4.175 0.115 1
1 771 . 9 1 1 A 76 76 GLU C C 161 176.844 176.668 0.176 1
1 772 . 9 1 1 A 76 76 GLU CA C 161 57.294 59.016 -1.722 1
1 773 . 9 1 1 A 76 76 GLU CB C 161 29.794 30.755 -0.961 1
1 775 . 9 1 1 A 76 76 GLU N N 161 118.767 119.861 -1.094 1
1 776 . 9 1 1 A 77 77 GLY H H 162 8.168 7.764 0.404 1
1 777 . 9 1 1 A 77 77 GLY HA2 H 162 4.010 4.196 -0.186 1
1 778 . 9 1 1 A 77 77 GLY HA3 H 162 3.963 4.199 -0.236 1
1 779 . 9 1 1 A 77 77 GLY C C 162 173.512 171.722 1.790 1
1 780 . 9 1 1 A 77 77 GLY CA C 162 45.362 44.631 0.731 1
1 781 . 9 1 1 A 77 77 GLY N N 162 108.621 106.529 2.092 1
1 782 . 9 1 1 A 78 78 ILE H H 163 7.954 8.748 -0.794 1
1 783 . 9 1 1 A 78 78 ILE HA H 163 4.323 4.991 -0.668 1
1 793 . 9 1 1 A 78 78 ILE C C 163 175.402 174.979 0.423 1
1 794 . 9 1 1 A 78 78 ILE CA C 163 60.632 59.559 1.073 1
1 795 . 9 1 1 A 78 78 ILE CB C 163 39.759 41.185 -1.426 1
1 799 . 9 1 1 A 78 78 ILE N N 163 121.604 123.782 -2.178 1
1 800 . 9 1 1 A 79 79 ILE H H 164 8.514 8.868 -0.354 1
1 801 . 9 1 1 A 79 79 ILE HA H 164 4.341 4.873 -0.532 1
1 811 . 9 1 1 A 79 79 ILE C C 164 175.172 174.638 0.534 1
1 812 . 9 1 1 A 79 79 ILE CA C 164 60.027 59.891 0.136 1
1 813 . 9 1 1 A 79 79 ILE CB C 164 40.153 40.746 -0.593 1
1 817 . 9 1 1 A 79 79 ILE N N 164 127.137 126.816 0.321 1
1 818 . 9 1 1 A 80 80 HIS H H 165 8.492 8.957 -0.465 1
1 819 . 9 1 1 A 80 80 HIS HA H 165 5.676 5.416 0.260 1
1 824 . 9 1 1 A 80 80 HIS C C 165 175.502 174.438 1.064 1
1 825 . 9 1 1 A 80 80 HIS CA C 165 57.043 55.078 1.965 1
1 826 . 9 1 1 A 80 80 HIS CB C 165 32.741 32.937 -0.196 1
1 829 . 9 1 1 A 80 80 HIS N N 165 125.422 126.626 -1.204 1
1 830 . 9 1 1 A 81 81 THR H H 166 9.080 9.046 0.034 1
1 831 . 9 1 1 A 81 81 THR HA H 166 4.999 5.006 -0.007 1
1 836 . 9 1 1 A 81 81 THR C C 166 171.877 172.943 -1.066 1
1 837 . 9 1 1 A 81 81 THR CA C 166 59.924 61.227 -1.303 1
1 838 . 9 1 1 A 81 81 THR CB C 166 72.243 70.893 1.350 1
1 840 . 9 1 1 A 81 81 THR N N 166 117.682 114.121 3.561 1
1 841 . 9 1 1 A 82 82 LEU H H 167 8.062 7.856 0.206 1
1 842 . 9 1 1 A 82 82 LEU HA H 167 4.350 3.827 0.523 1
1 852 . 9 1 1 A 82 82 LEU C C 167 172.705 174.987 -2.282 1
1 853 . 9 1 1 A 82 82 LEU CA C 167 53.553 55.586 -2.033 1
1 854 . 9 1 1 A 82 82 LEU CB C 167 39.768 41.240 -1.472 1
1 858 . 9 1 1 A 82 82 LEU N N 167 125.369 127.457 -2.088 1
1 859 . 9 1 1 A 83 83 ILE H H 168 8.657 8.353 0.304 1
1 860 . 9 1 1 A 83 83 ILE HA H 168 4.476 4.804 -0.328 1
1 870 . 9 1 1 A 83 83 ILE C C 168 175.159 174.320 0.839 1
1 871 . 9 1 1 A 83 83 ILE CA C 168 58.529 60.288 -1.759 1
1 872 . 9 1 1 A 83 83 ILE CB C 168 37.410 39.544 -2.134 1
1 876 . 9 1 1 A 83 83 ILE N N 168 128.042 127.585 0.457 1
1 877 . 9 1 1 A 84 84 VAL H H 169 8.464 8.266 0.198 1
1 878 . 9 1 1 A 84 84 VAL HA H 169 4.284 4.489 -0.205 1
1 886 . 9 1 1 A 84 84 VAL C C 169 176.138 176.057 0.081 1
1 887 . 9 1 1 A 84 84 VAL CA C 169 61.029 60.997 0.032 1
1 888 . 9 1 1 A 84 84 VAL CB C 169 34.714 33.663 1.051 1
1 891 . 9 1 1 A 84 84 VAL N N 169 124.644 127.059 -2.415 1
1 892 . 9 1 1 A 85 85 ASP H H 170 9.158 9.462 -0.304 1
1 893 . 9 1 1 A 85 85 ASP HA H 170 4.362 4.279 0.083 1
1 896 . 9 1 1 A 85 85 ASP C C 170 175.489 175.324 0.165 1
1 897 . 9 1 1 A 85 85 ASP CA C 170 55.868 55.124 0.744 1
1 898 . 9 1 1 A 85 85 ASP CB C 170 38.927 39.471 -0.544 1
1 899 . 9 1 1 A 85 85 ASP N N 170 129.061 127.007 2.054 1
1 900 . 9 1 1 A 86 86 ASN H H 171 8.811 8.430 0.381 1
1 901 . 9 1 1 A 86 86 ASN HA H 171 4.053 4.331 -0.278 1
1 906 . 9 1 1 A 86 86 ASN C C 171 173.802 173.891 -0.089 1
1 907 . 9 1 1 A 86 86 ASN CA C 171 55.173 54.318 0.855 1
1 908 . 9 1 1 A 86 86 ASN CB C 171 38.150 37.367 0.783 1
1 909 . 9 1 1 A 86 86 ASN N N 171 108.418 115.186 -6.768 1
1 911 . 9 1 1 A 87 87 ARG H H 172 7.914 7.483 0.431 1
1 912 . 9 1 1 A 87 87 ARG HA H 172 4.597 4.685 -0.088 1
1 919 . 9 1 1 A 87 87 ARG C C 172 174.025 174.898 -0.873 1
1 920 . 9 1 1 A 87 87 ARG CA C 172 54.846 54.225 0.621 1
1 921 . 9 1 1 A 87 87 ARG CB C 172 32.697 33.568 -0.871 1
1 924 . 9 1 1 A 87 87 ARG N N 172 120.988 117.541 3.447 1
1 925 . 9 1 1 A 88 88 GLU H H 173 8.534 8.693 -0.159 1
1 926 . 9 1 1 A 88 88 GLU HA H 173 4.560 4.321 0.239 1
1 931 . 9 1 1 A 88 88 GLU C C 173 176.187 176.143 0.044 1
1 932 . 9 1 1 A 88 88 GLU CA C 173 56.044 57.190 -1.146 1
1 933 . 9 1 1 A 88 88 GLU CB C 173 30.329 30.240 0.089 1
1 935 . 9 1 1 A 88 88 GLU N N 173 123.982 124.113 -0.131 1
1 936 . 9 1 1 A 89 89 ILE H H 174 8.897 8.074 0.823 1
1 937 . 9 1 1 A 89 89 ILE HA H 174 4.666 4.619 0.047 1
1 947 . 9 1 1 A 89 89 ILE C C 174 174.110 174.128 -0.018 1
1 948 . 9 1 1 A 89 89 ILE CA C 174 55.255 57.368 -2.113 1
1 949 . 9 1 1 A 89 89 ILE CB C 174 37.851 41.724 -3.873 1
1 953 . 9 1 1 A 89 89 ILE N N 174 130.008 125.069 4.939 1
1 954 . 9 1 1 A 90 90 PRO HA H 175 4.713 4.747 -0.034 1
1 961 . 9 1 1 A 90 90 PRO C C 175 176.956 176.357 0.599 1
1 962 . 9 1 1 A 90 90 PRO CA C 175 63.159 63.020 0.139 1
1 963 . 9 1 1 A 90 90 PRO CB C 175 32.428 32.380 0.048 1
1 966 . 9 1 1 A 91 91 GLU H H 176 8.778 8.709 0.069 1
1 967 . 9 1 1 A 91 91 GLU HA H 176 3.910 4.589 -0.679 1
1 972 . 9 1 1 A 91 91 GLU C C 176 176.426 176.116 0.310 1
1 973 . 9 1 1 A 91 91 GLU CA C 176 56.738 55.860 0.878 1
1 974 . 9 1 1 A 91 91 GLU CB C 176 30.540 30.954 -0.414 1
1 976 . 9 1 1 A 91 91 GLU N N 176 124.561 122.037 2.524 1
1 977 . 9 1 1 A 92 92 LEU H H 177 8.630 8.330 0.300 1
1 978 . 9 1 1 A 92 92 LEU HA H 177 4.419 4.843 -0.424 1
1 988 . 9 1 1 A 92 92 LEU C C 177 177.162 175.298 1.864 1
1 989 . 9 1 1 A 92 92 LEU CA C 177 55.350 54.264 1.086 1
1 990 . 9 1 1 A 92 92 LEU CB C 177 42.390 42.269 0.121 1
1 994 . 9 1 1 A 92 92 LEU N N 177 126.683 128.440 -1.757 1
1 995 . 9 1 1 A 93 93 THR H H 178 8.375 8.572 -0.197 1
1 996 . 9 1 1 A 93 93 THR HA H 178 4.359 4.790 -0.431 1
1 1001 . 9 1 1 A 93 93 THR C C 178 173.589 172.939 0.650 1
1 1002 . 9 1 1 A 93 93 THR CA C 178 61.621 60.555 1.066 1
1 1003 . 9 1 1 A 93 93 THR CB C 178 69.724 69.712 0.012 1
1 1005 . 9 1 1 A 93 93 THR N N 178 119.699 118.764 0.935 1
1 1 . 10 1 1 A 9 9 SER H H 94 8.475 8.793 -0.318 1
1 2 . 10 1 1 A 9 9 SER CA C 94 58.531 56.736 1.795 1
1 3 . 10 1 1 A 9 9 SER N N 94 117.432 117.021 0.411 1
1 4 . 10 1 1 A 10 10 LYS H H 95 8.527 8.644 -0.117 1
1 5 . 10 1 1 A 10 10 LYS C C 95 174.594 174.689 -0.095 1
1 6 . 10 1 1 A 10 10 LYS CA C 95 56.603 54.547 2.056 1
1 7 . 10 1 1 A 10 10 LYS N N 95 123.104 126.406 -3.302 1
1 8 . 10 1 1 A 11 11 THR H H 96 8.245 8.672 -0.427 1
1 9 . 10 1 1 A 11 11 THR C C 96 174.393 173.661 0.732 1
1 10 . 10 1 1 A 11 11 THR CA C 96 62.149 61.050 1.099 1
1 11 . 10 1 1 A 11 11 THR CB C 96 69.183 70.415 -1.232 1
1 13 . 10 1 1 A 11 11 THR N N 96 113.245 116.949 -3.704 1
1 14 . 10 1 1 A 12 12 THR H H 97 7.769 7.590 0.179 1
1 15 . 10 1 1 A 12 12 THR HA H 97 5.583 4.858 0.725 1
1 20 . 10 1 1 A 12 12 THR C C 97 174.726 172.121 2.605 1
1 21 . 10 1 1 A 12 12 THR CA C 97 59.602 60.805 -1.203 1
1 22 . 10 1 1 A 12 12 THR CB C 97 72.805 71.367 1.438 1
1 24 . 10 1 1 A 12 12 THR N N 97 113.440 113.952 -0.512 1
1 25 . 10 1 1 A 13 13 SER H H 98 8.593 8.541 0.052 1
1 26 . 10 1 1 A 13 13 SER HA H 98 4.448 5.277 -0.829 1
1 29 . 10 1 1 A 13 13 SER C C 98 171.426 173.337 -1.911 1
1 30 . 10 1 1 A 13 13 SER CA C 98 59.056 57.134 1.922 1
1 31 . 10 1 1 A 13 13 SER CB C 98 67.839 64.685 3.154 1
1 32 . 10 1 1 A 13 13 SER N N 98 119.042 121.370 -2.328 1
1 33 . 10 1 1 A 14 14 THR H H 99 8.155 8.488 -0.333 1
1 34 . 10 1 1 A 14 14 THR HA H 99 5.383 5.205 0.178 1
1 39 . 10 1 1 A 14 14 THR C C 99 171.565 173.334 -1.769 1
1 40 . 10 1 1 A 14 14 THR CA C 99 61.291 59.541 1.750 1
1 41 . 10 1 1 A 14 14 THR CB C 99 71.654 71.306 0.348 1
1 43 . 10 1 1 A 14 14 THR N N 99 118.204 112.719 5.485 1
1 44 . 10 1 1 A 15 15 TRP H H 100 9.637 9.311 0.326 1
1 45 . 10 1 1 A 15 15 TRP HA H 100 4.807 5.230 -0.423 1
1 54 . 10 1 1 A 15 15 TRP C C 100 174.399 175.251 -0.852 1
1 55 . 10 1 1 A 15 15 TRP CA C 100 58.302 55.719 2.583 1
1 56 . 10 1 1 A 15 15 TRP CB C 100 34.810 32.235 2.575 1
1 63 . 10 1 1 A 15 15 TRP N N 100 125.132 121.679 3.453 1
1 65 . 10 1 1 A 16 16 VAL H H 101 8.863 9.015 -0.152 1
1 66 . 10 1 1 A 16 16 VAL HA H 101 5.267 4.644 0.623 1
1 74 . 10 1 1 A 16 16 VAL C C 101 174.955 175.390 -0.435 1
1 75 . 10 1 1 A 16 16 VAL CA C 101 60.653 61.962 -1.309 1
1 76 . 10 1 1 A 16 16 VAL CB C 101 34.284 32.756 1.528 1
1 79 . 10 1 1 A 16 16 VAL N N 101 119.527 123.927 -4.400 1
1 80 . 10 1 1 A 17 17 LEU H H 102 8.961 8.860 0.101 1
1 81 . 10 1 1 A 17 17 LEU HA H 102 4.729 5.086 -0.357 1
1 91 . 10 1 1 A 17 17 LEU C C 102 173.559 175.065 -1.506 1
1 92 . 10 1 1 A 17 17 LEU CA C 102 55.144 53.130 2.014 1
1 93 . 10 1 1 A 17 17 LEU CB C 102 42.948 45.900 -2.952 1
1 97 . 10 1 1 A 17 17 LEU N N 102 124.280 123.835 0.445 1
1 98 . 10 1 1 A 18 18 ARG H H 103 8.305 8.396 -0.091 1
1 99 . 10 1 1 A 18 18 ARG HA H 103 5.139 4.650 0.489 1
1 106 . 10 1 1 A 18 18 ARG C C 103 175.347 175.183 0.164 1
1 107 . 10 1 1 A 18 18 ARG CA C 103 54.793 56.086 -1.293 1
1 108 . 10 1 1 A 18 18 ARG CB C 103 31.347 29.715 1.632 1
1 111 . 10 1 1 A 18 18 ARG N N 103 122.020 120.101 1.919 1
1 112 . 10 1 1 A 19 19 LEU H H 104 8.676 8.736 -0.060 1
1 113 . 10 1 1 A 19 19 LEU HA H 104 4.482 4.815 -0.333 1
1 123 . 10 1 1 A 19 19 LEU C C 104 175.957 175.809 0.148 1
1 124 . 10 1 1 A 19 19 LEU CA C 104 53.581 53.645 -0.064 1
1 125 . 10 1 1 A 19 19 LEU CB C 104 45.697 45.342 0.355 1
1 129 . 10 1 1 A 19 19 LEU N N 104 126.378 125.008 1.370 1
1 130 . 10 1 1 A 20 20 ASP H H 105 9.390 9.622 -0.232 1
1 131 . 10 1 1 A 20 20 ASP HA H 105 4.287 4.388 -0.101 1
1 134 . 10 1 1 A 20 20 ASP C C 105 175.947 175.831 0.116 1
1 135 . 10 1 1 A 20 20 ASP CA C 105 55.263 55.316 -0.053 1
1 136 . 10 1 1 A 20 20 ASP CB C 105 39.239 39.326 -0.087 1
1 137 . 10 1 1 A 20 20 ASP N N 105 125.208 125.906 -0.698 1
1 138 . 10 1 1 A 21 21 GLY H H 106 8.563 8.654 -0.091 1
1 139 . 10 1 1 A 21 21 GLY HA2 H 106 4.126 3.845 0.281 1
1 140 . 10 1 1 A 21 21 GLY HA3 H 106 3.509 3.846 -0.337 1
1 141 . 10 1 1 A 21 21 GLY C C 106 173.164 173.702 -0.538 1
1 142 . 10 1 1 A 21 21 GLY CA C 106 45.499 45.546 -0.047 1
1 143 . 10 1 1 A 21 21 GLY N N 106 103.331 104.159 -0.828 1
1 144 . 10 1 1 A 22 22 GLU H H 107 7.713 7.983 -0.270 1
1 145 . 10 1 1 A 22 22 GLU HA H 107 4.634 4.935 -0.301 1
1 150 . 10 1 1 A 22 22 GLU C C 107 174.800 174.859 -0.059 1
1 151 . 10 1 1 A 22 22 GLU CA C 107 54.329 54.290 0.039 1
1 152 . 10 1 1 A 22 22 GLU CB C 107 32.832 34.091 -1.259 1
1 154 . 10 1 1 A 22 22 GLU N N 107 119.470 119.351 0.119 1
1 155 . 10 1 1 A 23 23 ASP H H 108 8.632 8.473 0.159 1
1 156 . 10 1 1 A 23 23 ASP HA H 108 4.872 4.725 0.147 1
1 159 . 10 1 1 A 23 23 ASP C C 108 175.533 175.454 0.079 1
1 160 . 10 1 1 A 23 23 ASP CA C 108 55.180 54.058 1.122 1
1 161 . 10 1 1 A 23 23 ASP CB C 108 41.504 39.381 2.123 1
1 162 . 10 1 1 A 23 23 ASP N N 108 122.815 121.074 1.741 1
1 163 . 10 1 1 A 24 24 LEU H H 109 9.248 8.849 0.399 1
1 164 . 10 1 1 A 24 24 LEU HA H 109 4.836 4.681 0.155 1
1 174 . 10 1 1 A 24 24 LEU C C 109 174.322 175.846 -1.524 1
1 175 . 10 1 1 A 24 24 LEU CA C 109 54.473 55.055 -0.582 1
1 176 . 10 1 1 A 24 24 LEU CB C 109 44.718 42.660 2.058 1
1 180 . 10 1 1 A 24 24 LEU N N 109 125.550 126.637 -1.087 1
1 181 . 10 1 1 A 25 25 ARG H H 110 8.503 8.694 -0.191 1
1 182 . 10 1 1 A 25 25 ARG HA H 110 5.228 4.765 0.463 1
1 189 . 10 1 1 A 25 25 ARG C C 110 175.174 174.485 0.689 1
1 190 . 10 1 1 A 25 25 ARG CA C 110 54.745 54.889 -0.144 1
1 191 . 10 1 1 A 25 25 ARG CB C 110 31.701 31.479 0.222 1
1 194 . 10 1 1 A 25 25 ARG N N 110 125.424 127.578 -2.154 1
1 195 . 10 1 1 A 26 26 VAL H H 111 9.692 9.045 0.647 1
1 196 . 10 1 1 A 26 26 VAL HA H 111 5.091 4.882 0.209 1
1 204 . 10 1 1 A 26 26 VAL C C 111 174.446 175.358 -0.912 1
1 205 . 10 1 1 A 26 26 VAL CA C 111 61.055 62.005 -0.950 1
1 206 . 10 1 1 A 26 26 VAL CB C 111 33.780 32.974 0.806 1
1 209 . 10 1 1 A 26 26 VAL N N 111 130.649 127.448 3.201 1
1 210 . 10 1 1 A 27 27 VAL H H 112 9.401 8.996 0.405 1
1 211 . 10 1 1 A 27 27 VAL HA H 112 5.188 4.792 0.396 1
1 219 . 10 1 1 A 27 27 VAL C C 112 174.214 174.211 0.003 1
1 220 . 10 1 1 A 27 27 VAL CA C 112 60.722 60.977 -0.255 1
1 221 . 10 1 1 A 27 27 VAL CB C 112 36.082 35.154 0.928 1
1 224 . 10 1 1 A 27 27 VAL N N 112 127.416 127.651 -0.235 1
1 225 . 10 1 1 A 28 28 LEU H H 113 9.265 9.171 0.094 1
1 226 . 10 1 1 A 28 28 LEU HA H 113 5.337 5.373 -0.036 1
1 236 . 10 1 1 A 28 28 LEU C C 113 175.915 174.772 1.143 1
1 237 . 10 1 1 A 28 28 LEU CA C 113 52.599 53.312 -0.713 1
1 238 . 10 1 1 A 28 28 LEU CB C 113 47.495 44.513 2.982 1
1 242 . 10 1 1 A 28 28 LEU N N 113 127.527 129.940 -2.413 1
1 243 . 10 1 1 A 29 29 GLU H H 114 8.968 8.542 0.426 1
1 244 . 10 1 1 A 29 29 GLU HA H 114 4.701 4.437 0.264 1
1 249 . 10 1 1 A 29 29 GLU C C 114 176.715 177.416 -0.701 1
1 250 . 10 1 1 A 29 29 GLU CA C 114 55.342 56.279 -0.937 1
1 251 . 10 1 1 A 29 29 GLU CB C 114 30.005 30.010 -0.005 1
1 253 . 10 1 1 A 29 29 GLU N N 114 127.374 127.445 -0.071 1
1 254 . 10 1 1 A 30 30 LYS H H 115 8.243 8.549 -0.306 1
1 255 . 10 1 1 A 30 30 LYS HA H 115 3.711 4.146 -0.435 1
1 264 . 10 1 1 A 30 30 LYS C C 115 177.137 178.235 -1.098 1
1 265 . 10 1 1 A 30 30 LYS CA C 115 60.118 58.940 1.178 1
1 266 . 10 1 1 A 30 30 LYS CB C 115 32.656 32.100 0.556 1
1 270 . 10 1 1 A 30 30 LYS N N 115 124.225 125.504 -1.279 1
1 271 . 10 1 1 A 31 31 ASP H H 116 9.200 8.123 1.077 1
1 272 . 10 1 1 A 31 31 ASP HA H 116 4.444 4.439 0.005 1
1 275 . 10 1 1 A 31 31 ASP C C 116 177.774 177.235 0.539 1
1 276 . 10 1 1 A 31 31 ASP CA C 116 56.703 57.239 -0.536 1
1 277 . 10 1 1 A 31 31 ASP CB C 116 40.236 40.266 -0.030 1
1 278 . 10 1 1 A 31 31 ASP N N 116 115.955 119.386 -3.431 1
1 279 . 10 1 1 A 32 32 THR H H 117 7.352 7.441 -0.089 1
1 280 . 10 1 1 A 32 32 THR HA H 117 4.266 4.535 -0.269 1
1 285 . 10 1 1 A 32 32 THR C C 117 175.320 174.086 1.234 1
1 286 . 10 1 1 A 32 32 THR CA C 117 61.171 61.311 -0.140 1
1 287 . 10 1 1 A 32 32 THR CB C 117 70.221 69.624 0.597 1
1 289 . 10 1 1 A 32 32 THR N N 117 106.440 108.784 -2.344 1
1 290 . 10 1 1 A 33 33 MET H H 118 8.216 7.980 0.236 1
1 291 . 10 1 1 A 33 33 MET HA H 118 4.184 4.253 -0.069 1
1 299 . 10 1 1 A 33 33 MET C C 118 174.952 174.558 0.394 1
1 300 . 10 1 1 A 33 33 MET CA C 118 55.195 57.006 -1.811 1
1 301 . 10 1 1 A 33 33 MET CB C 118 25.900 31.540 -5.640 1
1 304 . 10 1 1 A 33 33 MET N N 118 115.956 118.277 -2.321 1
1 305 . 10 1 1 A 34 34 ASP H H 119 7.509 8.024 -0.515 1
1 306 . 10 1 1 A 34 34 ASP HA H 119 4.486 4.792 -0.306 1
1 309 . 10 1 1 A 34 34 ASP C C 119 174.375 175.314 -0.939 1
1 310 . 10 1 1 A 34 34 ASP CA C 119 54.745 54.410 0.335 1
1 311 . 10 1 1 A 34 34 ASP CB C 119 42.865 41.934 0.931 1
1 312 . 10 1 1 A 34 34 ASP N N 119 118.500 119.128 -0.628 1
1 313 . 10 1 1 A 35 35 VAL H H 120 8.473 8.509 -0.036 1
1 314 . 10 1 1 A 35 35 VAL HA H 120 4.709 4.842 -0.133 1
1 322 . 10 1 1 A 35 35 VAL C C 120 173.900 174.333 -0.433 1
1 323 . 10 1 1 A 35 35 VAL CA C 120 60.736 61.285 -0.549 1
1 324 . 10 1 1 A 35 35 VAL CB C 120 34.662 33.327 1.335 1
1 327 . 10 1 1 A 35 35 VAL N N 120 121.116 121.456 -0.340 1
1 328 . 10 1 1 A 36 36 TRP H H 121 9.404 9.123 0.281 1
1 329 . 10 1 1 A 36 36 TRP HA H 121 5.174 5.478 -0.304 1
1 338 . 10 1 1 A 36 36 TRP C C 121 176.480 174.476 2.004 1
1 339 . 10 1 1 A 36 36 TRP CA C 121 55.070 54.667 0.403 1
1 340 . 10 1 1 A 36 36 TRP CB C 121 32.179 32.412 -0.233 1
1 348 . 10 1 1 A 36 36 TRP N N 121 126.924 129.133 -2.209 1
1 350 . 10 1 1 A 37 37 CYS H H 122 9.230 8.359 0.871 1
1 351 . 10 1 1 A 37 37 CYS HA H 122 5.417 5.385 0.032 1
1 354 . 10 1 1 A 37 37 CYS C C 122 175.346 173.705 1.641 1
1 355 . 10 1 1 A 37 37 CYS CA C 122 57.083 57.257 -0.174 1
1 356 . 10 1 1 A 37 37 CYS CB C 122 28.713 30.679 -1.966 1
1 357 . 10 1 1 A 37 37 CYS N N 122 120.375 124.780 -4.405 1
1 358 . 10 1 1 A 38 38 ASN H H 123 9.817 8.914 0.903 1
1 359 . 10 1 1 A 38 38 ASN HA H 123 4.637 4.241 0.396 1
1 364 . 10 1 1 A 38 38 ASN C C 123 175.526 175.161 0.365 1
1 365 . 10 1 1 A 38 38 ASN CA C 123 54.023 54.348 -0.325 1
1 366 . 10 1 1 A 38 38 ASN CB C 123 36.581 37.226 -0.645 1
1 367 . 10 1 1 A 38 38 ASN N N 123 129.408 119.391 10.017 1
1 369 . 10 1 1 A 39 39 GLY H H 124 9.092 7.999 1.093 1
1 370 . 10 1 1 A 39 39 GLY HA2 H 124 4.241 2.277 1.964 1
1 371 . 10 1 1 A 39 39 GLY HA3 H 124 3.705 3.489 0.216 1
1 372 . 10 1 1 A 39 39 GLY C C 124 173.405 173.459 -0.054 1
1 373 . 10 1 1 A 39 39 GLY CA C 124 45.595 46.199 -0.604 1
1 374 . 10 1 1 A 39 39 GLY N N 124 102.752 103.175 -0.423 1
1 375 . 10 1 1 A 40 40 GLN H H 125 8.006 7.035 0.971 1
1 376 . 10 1 1 A 40 40 GLN HA H 125 4.736 4.840 -0.104 1
1 383 . 10 1 1 A 40 40 GLN C C 125 174.477 174.641 -0.164 1
1 384 . 10 1 1 A 40 40 GLN CA C 125 53.747 54.581 -0.834 1
1 385 . 10 1 1 A 40 40 GLN CB C 125 30.413 31.398 -0.985 1
1 387 . 10 1 1 A 40 40 GLN N N 125 120.627 118.707 1.920 1
1 389 . 10 1 1 A 41 41 LYS H H 126 8.757 8.909 -0.152 1
1 390 . 10 1 1 A 41 41 LYS HA H 126 3.464 4.557 -1.093 1
1 399 . 10 1 1 A 41 41 LYS C C 126 176.870 175.716 1.154 1
1 400 . 10 1 1 A 41 41 LYS CA C 126 57.136 57.365 -0.229 1
1 401 . 10 1 1 A 41 41 LYS CB C 126 31.669 33.420 -1.751 1
1 405 . 10 1 1 A 41 41 LYS N N 126 129.107 128.277 0.830 1
1 406 . 10 1 1 A 42 42 MET H H 127 8.682 8.677 0.005 1
1 407 . 10 1 1 A 42 42 MET HA H 127 4.712 5.398 -0.686 1
1 415 . 10 1 1 A 42 42 MET C C 127 176.816 174.574 2.242 1
1 416 . 10 1 1 A 42 42 MET CA C 127 52.958 53.911 -0.953 1
1 417 . 10 1 1 A 42 42 MET CB C 127 33.023 36.500 -3.477 1
1 420 . 10 1 1 A 42 42 MET N N 127 126.569 125.086 1.483 1
1 421 . 10 1 1 A 43 43 GLU H H 128 8.734 8.784 -0.050 1
1 422 . 10 1 1 A 43 43 GLU HA H 128 4.419 5.158 -0.739 1
1 427 . 10 1 1 A 43 43 GLU C C 128 176.531 176.451 0.080 1
1 428 . 10 1 1 A 43 43 GLU CA C 128 56.475 55.170 1.305 1
1 429 . 10 1 1 A 43 43 GLU CB C 128 29.604 31.340 -1.736 1
1 431 . 10 1 1 A 43 43 GLU N N 128 123.734 119.951 3.783 1
1 432 . 10 1 1 A 44 44 THR H H 129 8.263 8.877 -0.614 1
1 433 . 10 1 1 A 44 44 THR HA H 129 5.385 5.364 0.021 1
1 438 . 10 1 1 A 44 44 THR C C 129 174.205 174.654 -0.449 1
1 439 . 10 1 1 A 44 44 THR CA C 129 59.160 60.410 -1.250 1
1 440 . 10 1 1 A 44 44 THR CB C 129 72.419 71.058 1.361 1
1 442 . 10 1 1 A 44 44 THR N N 129 115.081 117.711 -2.630 1
1 443 . 10 1 1 A 45 45 ALA H H 130 8.727 8.175 0.552 1
1 444 . 10 1 1 A 45 45 ALA HA H 130 4.749 4.352 0.397 1
1 448 . 10 1 1 A 45 45 ALA C C 130 177.017 178.418 -1.401 1
1 449 . 10 1 1 A 45 45 ALA CA C 130 51.645 52.719 -1.074 1
1 450 . 10 1 1 A 45 45 ALA CB C 130 21.364 20.316 1.048 1
1 451 . 10 1 1 A 45 45 ALA N N 130 123.243 123.299 -0.056 1
1 452 . 10 1 1 A 46 46 GLY H H 131 8.818 8.191 0.627 1
1 453 . 10 1 1 A 46 46 GLY HA2 H 131 4.941 3.972 0.969 1
1 454 . 10 1 1 A 46 46 GLY HA3 H 131 3.690 3.982 -0.292 1
1 455 . 10 1 1 A 46 46 GLY C C 131 173.528 174.735 -1.207 1
1 456 . 10 1 1 A 46 46 GLY CA C 131 45.060 46.742 -1.682 1
1 457 . 10 1 1 A 46 46 GLY N N 131 112.392 107.233 5.159 1
1 458 . 10 1 1 A 47 47 GLU H H 132 8.746 7.911 0.835 1
1 459 . 10 1 1 A 47 47 GLU HA H 132 4.584 4.687 -0.103 1
1 464 . 10 1 1 A 47 47 GLU C C 132 175.223 175.446 -0.223 1
1 465 . 10 1 1 A 47 47 GLU CA C 132 55.008 55.054 -0.046 1
1 466 . 10 1 1 A 47 47 GLU CB C 132 32.939 30.710 2.229 1
1 468 . 10 1 1 A 47 47 GLU N N 132 122.107 119.898 2.209 1
1 469 . 10 1 1 A 48 48 PHE H H 133 8.920 9.147 -0.227 1
1 470 . 10 1 1 A 48 48 PHE HA H 133 4.822 4.771 0.051 1
1 475 . 10 1 1 A 48 48 PHE C C 133 175.499 175.260 0.239 1
1 476 . 10 1 1 A 48 48 PHE CA C 133 58.320 57.246 1.074 1
1 477 . 10 1 1 A 48 48 PHE CB C 133 39.175 39.296 -0.121 1
1 479 . 10 1 1 A 48 48 PHE N N 133 124.006 129.224 -5.218 1
1 480 . 10 1 1 A 49 49 VAL H H 134 8.161 8.092 0.069 1
1 481 . 10 1 1 A 49 49 VAL HA H 134 4.492 4.414 0.078 1
1 489 . 10 1 1 A 49 49 VAL C C 134 176.241 176.419 -0.178 1
1 490 . 10 1 1 A 49 49 VAL CA C 134 60.328 59.821 0.507 1
1 491 . 10 1 1 A 49 49 VAL CB C 134 34.542 34.525 0.017 1
1 494 . 10 1 1 A 49 49 VAL N N 134 120.063 121.860 -1.797 1
1 495 . 10 1 1 A 50 50 ASP H H 135 8.596 8.483 0.113 1
1 496 . 10 1 1 A 50 50 ASP HA H 135 4.278 4.168 0.110 1
1 499 . 10 1 1 A 50 50 ASP C C 135 176.567 176.455 0.112 1
1 500 . 10 1 1 A 50 50 ASP CA C 135 57.149 56.898 0.251 1
1 501 . 10 1 1 A 50 50 ASP CB C 135 40.477 40.639 -0.162 1
1 502 . 10 1 1 A 50 50 ASP N N 135 122.137 121.818 0.319 1
1 503 . 10 1 1 A 51 51 ASP H H 136 8.328 7.473 0.855 1
1 504 . 10 1 1 A 51 51 ASP HA H 136 4.656 4.945 -0.289 1
1 507 . 10 1 1 A 51 51 ASP C C 136 175.798 174.738 1.060 1
1 508 . 10 1 1 A 51 51 ASP CA C 136 53.458 53.281 0.177 1
1 509 . 10 1 1 A 51 51 ASP CB C 136 40.306 43.034 -2.728 1
1 510 . 10 1 1 A 51 51 ASP N N 136 116.158 116.059 0.099 1
1 511 . 10 1 1 A 52 52 GLY H H 137 7.653 8.340 -0.687 1
1 512 . 10 1 1 A 52 52 GLY HA2 H 137 4.685 4.076 0.609 1
1 513 . 10 1 1 A 52 52 GLY HA3 H 137 4.069 4.117 -0.048 1
1 514 . 10 1 1 A 52 52 GLY C C 137 173.149 172.614 0.535 1
1 515 . 10 1 1 A 52 52 GLY CA C 137 45.860 43.973 1.887 1
1 516 . 10 1 1 A 52 52 GLY N N 137 107.634 111.808 -4.174 1
1 517 . 10 1 1 A 53 53 THR H H 138 8.445 8.181 0.264 1
1 518 . 10 1 1 A 53 53 THR HA H 138 4.996 5.048 -0.052 1
1 523 . 10 1 1 A 53 53 THR C C 138 174.163 173.245 0.918 1
1 524 . 10 1 1 A 53 53 THR CA C 138 60.974 61.630 -0.656 1
1 525 . 10 1 1 A 53 53 THR CB C 138 72.266 72.025 0.241 1
1 527 . 10 1 1 A 53 53 THR N N 138 114.976 114.614 0.362 1
1 528 . 10 1 1 A 54 54 GLU H H 139 8.917 8.958 -0.041 1
1 529 . 10 1 1 A 54 54 GLU HA H 139 5.205 4.716 0.489 1
1 534 . 10 1 1 A 54 54 GLU C C 139 175.700 175.022 0.678 1
1 535 . 10 1 1 A 54 54 GLU CA C 139 54.731 55.285 -0.554 1
1 536 . 10 1 1 A 54 54 GLU CB C 139 33.250 30.195 3.055 1
1 538 . 10 1 1 A 54 54 GLU N N 139 121.295 126.009 -4.714 1
1 539 . 10 1 1 A 55 55 THR H H 140 9.190 8.277 0.913 1
1 540 . 10 1 1 A 55 55 THR HA H 140 4.744 4.507 0.237 1
1 545 . 10 1 1 A 55 55 THR C C 140 174.537 173.401 1.136 1
1 546 . 10 1 1 A 55 55 THR CA C 140 62.678 61.914 0.764 1
1 547 . 10 1 1 A 55 55 THR CB C 140 69.744 68.694 1.050 1
1 549 . 10 1 1 A 55 55 THR N N 140 122.419 119.692 2.727 1
1 550 . 10 1 1 A 56 56 HIS H H 141 9.395 8.975 0.420 1
1 551 . 10 1 1 A 56 56 HIS HA H 141 5.204 4.973 0.231 1
1 556 . 10 1 1 A 56 56 HIS C C 141 174.675 175.060 -0.385 1
1 557 . 10 1 1 A 56 56 HIS CA C 141 55.557 54.005 1.552 1
1 558 . 10 1 1 A 56 56 HIS CB C 141 31.279 30.648 0.631 1
1 561 . 10 1 1 A 56 56 HIS N N 141 125.732 124.715 1.017 1
1 564 . 10 1 1 A 57 57 PHE H H 142 8.790 8.427 0.363 1
1 565 . 10 1 1 A 57 57 PHE HA H 142 4.918 5.735 -0.817 1
1 571 . 10 1 1 A 57 57 PHE C C 142 172.293 172.788 -0.495 1
1 572 . 10 1 1 A 57 57 PHE CA C 142 56.366 55.368 0.998 1
1 573 . 10 1 1 A 57 57 PHE CB C 142 39.962 41.904 -1.942 1
1 575 . 10 1 1 A 57 57 PHE N N 142 117.009 121.816 -4.807 1
1 576 . 10 1 1 A 58 58 SER H H 143 8.890 9.264 -0.374 1
1 577 . 10 1 1 A 58 58 SER HA H 143 5.286 5.444 -0.158 1
1 580 . 10 1 1 A 58 58 SER C C 143 173.716 173.470 0.246 1
1 581 . 10 1 1 A 58 58 SER CA C 143 57.517 56.957 0.560 1
1 582 . 10 1 1 A 58 58 SER CB C 143 65.448 66.900 -1.452 1
1 583 . 10 1 1 A 58 58 SER N N 143 115.269 113.522 1.747 1
1 584 . 10 1 1 A 59 59 VAL H H 144 7.737 8.783 -1.046 1
1 585 . 10 1 1 A 59 59 VAL HA H 144 4.220 4.446 -0.226 1
1 593 . 10 1 1 A 59 59 VAL C C 144 176.234 176.094 0.140 1
1 594 . 10 1 1 A 59 59 VAL CA C 144 61.741 60.787 0.954 1
1 595 . 10 1 1 A 59 59 VAL CB C 144 33.711 33.646 0.065 1
1 598 . 10 1 1 A 59 59 VAL N N 144 123.186 120.932 2.254 1
1 599 . 10 1 1 A 60 60 GLY H H 145 8.945 9.045 -0.100 1
1 600 . 10 1 1 A 60 60 GLY HA2 H 145 4.027 3.793 0.234 1
1 601 . 10 1 1 A 60 60 GLY HA3 H 145 3.692 3.828 -0.136 1
1 602 . 10 1 1 A 60 60 GLY C C 145 175.182 174.853 0.329 1
1 603 . 10 1 1 A 60 60 GLY CA C 145 47.141 47.278 -0.137 1
1 604 . 10 1 1 A 60 60 GLY N N 145 116.908 117.680 -0.772 1
1 605 . 10 1 1 A 61 61 ASN H H 146 8.929 8.496 0.433 1
1 606 . 10 1 1 A 61 61 ASN HA H 146 4.718 4.782 -0.064 1
1 611 . 10 1 1 A 61 61 ASN C C 146 174.706 175.236 -0.530 1
1 612 . 10 1 1 A 61 61 ASN CA C 146 52.802 53.441 -0.639 1
1 613 . 10 1 1 A 61 61 ASN CB C 146 37.917 40.295 -2.378 1
1 614 . 10 1 1 A 61 61 ASN N N 146 123.976 124.375 -0.399 1
1 616 . 10 1 1 A 62 62 HIS H H 147 8.400 6.999 1.401 1
1 617 . 10 1 1 A 62 62 HIS HA H 147 4.762 4.596 0.166 1
1 622 . 10 1 1 A 62 62 HIS C C 147 173.871 174.785 -0.914 1
1 623 . 10 1 1 A 62 62 HIS CA C 147 55.374 56.728 -1.354 1
1 624 . 10 1 1 A 62 62 HIS CB C 147 28.655 30.168 -1.513 1
1 628 . 10 1 1 A 62 62 HIS N N 147 118.620 118.549 0.071 1
1 631 . 10 1 1 A 63 63 ASP H H 148 8.734 8.919 -0.185 1
1 632 . 10 1 1 A 63 63 ASP HA H 148 4.785 5.157 -0.372 1
1 635 . 10 1 1 A 63 63 ASP C C 148 175.269 174.576 0.693 1
1 636 . 10 1 1 A 63 63 ASP CA C 148 54.390 54.132 0.258 1
1 637 . 10 1 1 A 63 63 ASP CB C 148 42.105 43.620 -1.515 1
1 638 . 10 1 1 A 63 63 ASP N N 148 125.336 120.050 5.286 1
1 639 . 10 1 1 A 64 64 CYS H H 149 8.225 9.278 -1.053 1
1 640 . 10 1 1 A 64 64 CYS HA H 149 5.118 5.355 -0.237 1
1 643 . 10 1 1 A 64 64 CYS C C 149 173.740 172.747 0.993 1
1 644 . 10 1 1 A 64 64 CYS CA C 149 55.423 56.805 -1.382 1
1 645 . 10 1 1 A 64 64 CYS CB C 149 29.972 32.832 -2.860 1
1 646 . 10 1 1 A 64 64 CYS N N 149 124.476 122.554 1.922 1
1 647 . 10 1 1 A 65 65 TYR H H 150 8.916 8.776 0.140 1
1 648 . 10 1 1 A 65 65 TYR HA H 150 5.121 3.587 1.534 1
1 655 . 10 1 1 A 65 65 TYR C C 150 172.821 171.913 0.908 1
1 656 . 10 1 1 A 65 65 TYR CA C 150 56.347 55.465 0.882 1
1 657 . 10 1 1 A 65 65 TYR CB C 150 38.901 40.403 -1.502 1
1 662 . 10 1 1 A 65 65 TYR N N 150 115.313 117.070 -1.757 1
1 663 . 10 1 1 A 66 66 ILE H H 151 8.423 8.289 0.134 1
1 664 . 10 1 1 A 66 66 ILE HA H 151 5.000 4.341 0.659 1
1 674 . 10 1 1 A 66 66 ILE C C 151 176.225 174.643 1.582 1
1 675 . 10 1 1 A 66 66 ILE CA C 151 57.798 59.966 -2.168 1
1 676 . 10 1 1 A 66 66 ILE CB C 151 39.863 38.691 1.172 1
1 680 . 10 1 1 A 66 66 ILE N N 151 118.575 120.677 -2.102 1
1 681 . 10 1 1 A 67 67 LYS H H 152 9.480 8.841 0.639 1
1 682 . 10 1 1 A 67 67 LYS HA H 152 5.091 4.683 0.408 1
1 691 . 10 1 1 A 67 67 LYS C C 152 174.079 175.452 -1.373 1
1 692 . 10 1 1 A 67 67 LYS CA C 152 54.728 56.067 -1.339 1
1 693 . 10 1 1 A 67 67 LYS CB C 152 35.256 33.128 2.128 1
1 697 . 10 1 1 A 67 67 LYS N N 152 132.311 128.447 3.864 1
1 698 . 10 1 1 A 68 68 ALA H H 153 8.844 8.290 0.554 1
1 699 . 10 1 1 A 68 68 ALA HA H 153 5.039 5.383 -0.344 1
1 703 . 10 1 1 A 68 68 ALA C C 153 176.587 176.206 0.381 1
1 704 . 10 1 1 A 68 68 ALA CA C 153 50.484 50.624 -0.140 1
1 705 . 10 1 1 A 68 68 ALA CB C 153 20.570 21.785 -1.215 1
1 706 . 10 1 1 A 68 68 ALA N N 153 129.958 129.591 0.367 1
1 707 . 10 1 1 A 69 69 VAL H H 154 8.461 8.613 -0.152 1
1 708 . 10 1 1 A 69 69 VAL HA H 154 4.558 4.535 0.023 1
1 716 . 10 1 1 A 69 69 VAL C C 154 175.331 175.023 0.308 1
1 717 . 10 1 1 A 69 69 VAL CA C 154 60.758 60.956 -0.198 1
1 718 . 10 1 1 A 69 69 VAL CB C 154 34.743 35.176 -0.433 1
1 721 . 10 1 1 A 69 69 VAL N N 154 121.496 121.724 -0.228 1
1 722 . 10 1 1 A 70 70 SER H H 155 8.695 9.009 -0.314 1
1 723 . 10 1 1 A 70 70 SER HA H 155 4.646 5.058 -0.412 1
1 726 . 10 1 1 A 70 70 SER C C 155 174.690 173.457 1.233 1
1 727 . 10 1 1 A 70 70 SER CA C 155 58.065 57.240 0.825 1
1 728 . 10 1 1 A 70 70 SER CB C 155 64.062 64.562 -0.500 1
1 729 . 10 1 1 A 70 70 SER N N 155 119.763 122.351 -2.588 1
1 730 . 10 1 1 A 71 71 SER H H 156 8.360 9.044 -0.684 1
1 731 . 10 1 1 A 71 71 SER HA H 156 4.430 5.508 -1.078 1
1 734 . 10 1 1 A 71 71 SER CA C 156 58.491 56.768 1.723 1
1 735 . 10 1 1 A 71 71 SER CB C 156 64.061 66.812 -2.751 1
1 736 . 10 1 1 A 71 71 SER N N 156 118.577 117.409 1.168 1
1 737 . 10 1 1 A 72 72 GLY H H 157 8.542 8.457 0.085 1
1 738 . 10 1 1 A 72 72 GLY HA2 H 157 4.002 4.225 -0.223 1
1 739 . 10 1 1 A 72 72 GLY HA3 H 157 4.002 4.227 -0.225 1
1 740 . 10 1 1 A 72 72 GLY CA C 157 45.565 44.174 1.391 1
1 741 . 10 1 1 A 72 72 GLY N N 157 111.540 113.032 -1.492 1
1 742 . 10 1 1 A 73 73 LYS H H 158 8.369 8.753 -0.384 1
1 743 . 10 1 1 A 73 73 LYS CA C 158 56.720 58.917 -2.197 1
1 744 . 10 1 1 A 73 73 LYS CB C 158 32.915 32.709 0.206 1
1 747 . 10 1 1 A 73 73 LYS N N 158 120.293 120.536 -0.243 1
1 748 . 10 1 1 A 74 74 ARG H H 159 8.181 7.586 0.595 1
1 749 . 10 1 1 A 74 74 ARG CA C 159 56.148 54.470 1.678 1
1 751 . 10 1 1 A 74 74 ARG N N 159 119.343 114.015 5.328 1
1 752 . 10 1 1 A 75 75 LYS H H 160 8.443 8.526 -0.083 1
1 753 . 10 1 1 A 75 75 LYS HA H 160 4.067 3.963 0.104 1
1 762 . 10 1 1 A 75 75 LYS C C 160 176.868 176.569 0.299 1
1 763 . 10 1 1 A 75 75 LYS CA C 160 57.711 57.262 0.449 1
1 764 . 10 1 1 A 75 75 LYS CB C 160 31.777 29.066 2.711 1
1 768 . 10 1 1 A 75 75 LYS N N 160 120.467 116.039 4.428 1
1 769 . 10 1 1 A 76 76 GLU H H 161 8.693 8.054 0.639 1
1 770 . 10 1 1 A 76 76 GLU HA H 161 4.290 4.067 0.223 1
1 771 . 10 1 1 A 76 76 GLU C C 161 176.844 176.379 0.465 1
1 772 . 10 1 1 A 76 76 GLU CA C 161 57.294 59.405 -2.111 1
1 773 . 10 1 1 A 76 76 GLU CB C 161 29.794 29.885 -0.091 1
1 775 . 10 1 1 A 76 76 GLU N N 161 118.767 119.200 -0.433 1
1 776 . 10 1 1 A 77 77 GLY H H 162 8.168 7.708 0.460 1
1 777 . 10 1 1 A 77 77 GLY HA2 H 162 4.010 4.187 -0.177 1
1 778 . 10 1 1 A 77 77 GLY HA3 H 162 3.963 4.192 -0.229 1
1 779 . 10 1 1 A 77 77 GLY C C 162 173.512 171.692 1.820 1
1 780 . 10 1 1 A 77 77 GLY CA C 162 45.362 44.789 0.573 1
1 781 . 10 1 1 A 77 77 GLY N N 162 108.621 106.294 2.327 1
1 782 . 10 1 1 A 78 78 ILE H H 163 7.954 8.764 -0.810 1
1 783 . 10 1 1 A 78 78 ILE HA H 163 4.323 4.886 -0.563 1
1 793 . 10 1 1 A 78 78 ILE C C 163 175.402 175.152 0.250 1
1 794 . 10 1 1 A 78 78 ILE CA C 163 60.632 59.317 1.315 1
1 795 . 10 1 1 A 78 78 ILE CB C 163 39.759 40.958 -1.199 1
1 799 . 10 1 1 A 78 78 ILE N N 163 121.604 124.968 -3.364 1
1 800 . 10 1 1 A 79 79 ILE H H 164 8.514 8.681 -0.167 1
1 801 . 10 1 1 A 79 79 ILE HA H 164 4.341 4.858 -0.517 1
1 811 . 10 1 1 A 79 79 ILE C C 164 175.172 174.634 0.538 1
1 812 . 10 1 1 A 79 79 ILE CA C 164 60.027 59.836 0.191 1
1 813 . 10 1 1 A 79 79 ILE CB C 164 40.153 41.023 -0.870 1
1 817 . 10 1 1 A 79 79 ILE N N 164 127.137 125.908 1.229 1
1 818 . 10 1 1 A 80 80 HIS H H 165 8.492 9.116 -0.624 1
1 819 . 10 1 1 A 80 80 HIS HA H 165 5.676 5.387 0.289 1
1 824 . 10 1 1 A 80 80 HIS C C 165 175.502 174.331 1.171 1
1 825 . 10 1 1 A 80 80 HIS CA C 165 57.043 54.791 2.252 1
1 826 . 10 1 1 A 80 80 HIS CB C 165 32.741 32.465 0.276 1
1 829 . 10 1 1 A 80 80 HIS N N 165 125.422 126.376 -0.954 1
1 830 . 10 1 1 A 81 81 THR H H 166 9.080 9.370 -0.290 1
1 831 . 10 1 1 A 81 81 THR HA H 166 4.999 4.949 0.050 1
1 836 . 10 1 1 A 81 81 THR C C 166 171.877 172.852 -0.975 1
1 837 . 10 1 1 A 81 81 THR CA C 166 59.924 60.863 -0.939 1
1 838 . 10 1 1 A 81 81 THR CB C 166 72.243 71.013 1.230 1
1 840 . 10 1 1 A 81 81 THR N N 166 117.682 114.474 3.208 1
1 841 . 10 1 1 A 82 82 LEU H H 167 8.062 8.000 0.062 1
1 842 . 10 1 1 A 82 82 LEU HA H 167 4.350 3.958 0.392 1
1 852 . 10 1 1 A 82 82 LEU C C 167 172.705 174.893 -2.188 1
1 853 . 10 1 1 A 82 82 LEU CA C 167 53.553 55.236 -1.683 1
1 854 . 10 1 1 A 82 82 LEU CB C 167 39.768 41.454 -1.686 1
1 858 . 10 1 1 A 82 82 LEU N N 167 125.369 127.849 -2.480 1
1 859 . 10 1 1 A 83 83 ILE H H 168 8.657 8.289 0.368 1
1 860 . 10 1 1 A 83 83 ILE HA H 168 4.476 5.064 -0.588 1
1 870 . 10 1 1 A 83 83 ILE C C 168 175.159 174.349 0.810 1
1 871 . 10 1 1 A 83 83 ILE CA C 168 58.529 60.237 -1.708 1
1 872 . 10 1 1 A 83 83 ILE CB C 168 37.410 40.733 -3.323 1
1 876 . 10 1 1 A 83 83 ILE N N 168 128.042 127.421 0.621 1
1 877 . 10 1 1 A 84 84 VAL H H 169 8.464 8.460 0.004 1
1 878 . 10 1 1 A 84 84 VAL HA H 169 4.284 4.491 -0.207 1
1 886 . 10 1 1 A 84 84 VAL C C 169 176.138 175.917 0.221 1
1 887 . 10 1 1 A 84 84 VAL CA C 169 61.029 61.409 -0.380 1
1 888 . 10 1 1 A 84 84 VAL CB C 169 34.714 34.113 0.601 1
1 891 . 10 1 1 A 84 84 VAL N N 169 124.644 126.886 -2.242 1
1 892 . 10 1 1 A 85 85 ASP H H 170 9.158 9.130 0.028 1
1 893 . 10 1 1 A 85 85 ASP HA H 170 4.362 4.280 0.082 1
1 896 . 10 1 1 A 85 85 ASP C C 170 175.489 175.340 0.149 1
1 897 . 10 1 1 A 85 85 ASP CA C 170 55.868 55.211 0.657 1
1 898 . 10 1 1 A 85 85 ASP CB C 170 38.927 39.465 -0.538 1
1 899 . 10 1 1 A 85 85 ASP N N 170 129.061 127.697 1.364 1
1 900 . 10 1 1 A 86 86 ASN H H 171 8.811 8.438 0.373 1
1 901 . 10 1 1 A 86 86 ASN HA H 171 4.053 4.332 -0.279 1
1 906 . 10 1 1 A 86 86 ASN C C 171 173.802 173.889 -0.087 1
1 907 . 10 1 1 A 86 86 ASN CA C 171 55.173 54.320 0.853 1
1 908 . 10 1 1 A 86 86 ASN CB C 171 38.150 37.376 0.774 1
1 909 . 10 1 1 A 86 86 ASN N N 171 108.418 114.933 -6.515 1
1 911 . 10 1 1 A 87 87 ARG H H 172 7.914 7.523 0.391 1
1 912 . 10 1 1 A 87 87 ARG HA H 172 4.597 4.691 -0.094 1
1 919 . 10 1 1 A 87 87 ARG C C 172 174.025 174.803 -0.778 1
1 920 . 10 1 1 A 87 87 ARG CA C 172 54.846 54.129 0.717 1
1 921 . 10 1 1 A 87 87 ARG CB C 172 32.697 33.302 -0.605 1
1 924 . 10 1 1 A 87 87 ARG N N 172 120.988 117.588 3.400 1
1 925 . 10 1 1 A 88 88 GLU H H 173 8.534 8.732 -0.198 1
1 926 . 10 1 1 A 88 88 GLU HA H 173 4.560 4.357 0.203 1
1 931 . 10 1 1 A 88 88 GLU C C 173 176.187 175.463 0.724 1
1 932 . 10 1 1 A 88 88 GLU CA C 173 56.044 56.856 -0.812 1
1 933 . 10 1 1 A 88 88 GLU CB C 173 30.329 30.348 -0.019 1
1 935 . 10 1 1 A 88 88 GLU N N 173 123.982 124.324 -0.342 1
1 936 . 10 1 1 A 89 89 ILE H H 174 8.897 7.999 0.898 1
1 937 . 10 1 1 A 89 89 ILE HA H 174 4.666 4.550 0.116 1
1 947 . 10 1 1 A 89 89 ILE C C 174 174.110 174.116 -0.006 1
1 948 . 10 1 1 A 89 89 ILE CA C 174 55.255 57.344 -2.089 1
1 949 . 10 1 1 A 89 89 ILE CB C 174 37.851 41.629 -3.778 1
1 953 . 10 1 1 A 89 89 ILE N N 174 130.008 127.276 2.732 1
1 954 . 10 1 1 A 90 90 PRO HA H 175 4.713 4.754 -0.041 1
1 961 . 10 1 1 A 90 90 PRO C C 175 176.956 176.969 -0.013 1
1 962 . 10 1 1 A 90 90 PRO CA C 175 63.159 62.834 0.325 1
1 963 . 10 1 1 A 90 90 PRO CB C 175 32.428 32.490 -0.062 1
1 966 . 10 1 1 A 91 91 GLU H H 176 8.778 8.676 0.102 1
1 967 . 10 1 1 A 91 91 GLU HA H 176 3.910 4.644 -0.734 1
1 972 . 10 1 1 A 91 91 GLU C C 176 176.426 177.078 -0.652 1
1 973 . 10 1 1 A 91 91 GLU CA C 176 56.738 55.358 1.380 1
1 974 . 10 1 1 A 91 91 GLU CB C 176 30.540 32.113 -1.573 1
1 976 . 10 1 1 A 91 91 GLU N N 176 124.561 121.468 3.093 1
1 977 . 10 1 1 A 92 92 LEU H H 177 8.630 8.607 0.023 1
1 978 . 10 1 1 A 92 92 LEU HA H 177 4.419 4.171 0.248 1
1 988 . 10 1 1 A 92 92 LEU C C 177 177.162 177.238 -0.076 1
1 989 . 10 1 1 A 92 92 LEU CA C 177 55.350 57.697 -2.347 1
1 990 . 10 1 1 A 92 92 LEU CB C 177 42.390 42.178 0.212 1
1 994 . 10 1 1 A 92 92 LEU N N 177 126.683 124.177 2.506 1
1 995 . 10 1 1 A 93 93 THR H H 178 8.375 7.682 0.693 1
1 996 . 10 1 1 A 93 93 THR HA H 178 4.359 4.246 0.113 1
1 1001 . 10 1 1 A 93 93 THR C C 178 173.589 174.597 -1.008 1
1 1002 . 10 1 1 A 93 93 THR CA C 178 61.621 62.571 -0.950 1
1 1003 . 10 1 1 A 93 93 THR CB C 178 69.724 69.686 0.038 1
1 1005 . 10 1 1 A 93 93 THR N N 178 119.699 113.894 5.805 1
1 1 . 11 1 1 A 9 9 SER H H 94 8.475 9.019 -0.544 1
1 2 . 11 1 1 A 9 9 SER CA C 94 58.531 61.639 -3.108 1
1 3 . 11 1 1 A 9 9 SER N N 94 117.432 116.520 0.912 1
1 4 . 11 1 1 A 10 10 LYS H H 95 8.527 7.906 0.621 1
1 5 . 11 1 1 A 10 10 LYS C C 95 174.594 176.081 -1.487 1
1 6 . 11 1 1 A 10 10 LYS CA C 95 56.603 58.350 -1.747 1
1 7 . 11 1 1 A 10 10 LYS N N 95 123.104 119.463 3.641 1
1 8 . 11 1 1 A 11 11 THR H H 96 8.245 8.545 -0.300 1
1 9 . 11 1 1 A 11 11 THR C C 96 174.393 173.596 0.797 1
1 10 . 11 1 1 A 11 11 THR CA C 96 62.149 61.342 0.807 1
1 11 . 11 1 1 A 11 11 THR CB C 96 69.183 68.159 1.024 1
1 13 . 11 1 1 A 11 11 THR N N 96 113.245 114.184 -0.939 1
1 14 . 11 1 1 A 12 12 THR H H 97 7.769 7.735 0.034 1
1 15 . 11 1 1 A 12 12 THR HA H 97 5.583 4.969 0.614 1
1 20 . 11 1 1 A 12 12 THR C C 97 174.726 172.502 2.224 1
1 21 . 11 1 1 A 12 12 THR CA C 97 59.602 60.876 -1.274 1
1 22 . 11 1 1 A 12 12 THR CB C 97 72.805 71.234 1.571 1
1 24 . 11 1 1 A 12 12 THR N N 97 113.440 112.719 0.721 1
1 25 . 11 1 1 A 13 13 SER H H 98 8.593 8.954 -0.361 1
1 26 . 11 1 1 A 13 13 SER HA H 98 4.448 5.268 -0.820 1
1 29 . 11 1 1 A 13 13 SER C C 98 171.426 172.879 -1.453 1
1 30 . 11 1 1 A 13 13 SER CA C 98 59.056 56.104 2.952 1
1 31 . 11 1 1 A 13 13 SER CB C 98 67.839 65.699 2.140 1
1 32 . 11 1 1 A 13 13 SER N N 98 119.042 120.669 -1.627 1
1 33 . 11 1 1 A 14 14 THR H H 99 8.155 8.058 0.097 1
1 34 . 11 1 1 A 14 14 THR HA H 99 5.383 5.183 0.200 1
1 39 . 11 1 1 A 14 14 THR C C 99 171.565 172.636 -1.071 1
1 40 . 11 1 1 A 14 14 THR CA C 99 61.291 59.896 1.395 1
1 41 . 11 1 1 A 14 14 THR CB C 99 71.654 72.137 -0.483 1
1 43 . 11 1 1 A 14 14 THR N N 99 118.204 112.965 5.239 1
1 44 . 11 1 1 A 15 15 TRP H H 100 9.637 9.098 0.539 1
1 45 . 11 1 1 A 15 15 TRP HA H 100 4.807 5.062 -0.255 1
1 54 . 11 1 1 A 15 15 TRP C C 100 174.399 175.510 -1.111 1
1 55 . 11 1 1 A 15 15 TRP CA C 100 58.302 56.091 2.211 1
1 56 . 11 1 1 A 15 15 TRP CB C 100 34.810 33.567 1.243 1
1 63 . 11 1 1 A 15 15 TRP N N 100 125.132 120.814 4.318 1
1 65 . 11 1 1 A 16 16 VAL H H 101 8.863 9.037 -0.174 1
1 66 . 11 1 1 A 16 16 VAL HA H 101 5.267 4.705 0.562 1
1 74 . 11 1 1 A 16 16 VAL C C 101 174.955 175.207 -0.252 1
1 75 . 11 1 1 A 16 16 VAL CA C 101 60.653 61.670 -1.017 1
1 76 . 11 1 1 A 16 16 VAL CB C 101 34.284 32.919 1.365 1
1 79 . 11 1 1 A 16 16 VAL N N 101 119.527 123.138 -3.611 1
1 80 . 11 1 1 A 17 17 LEU H H 102 8.961 8.934 0.027 1
1 81 . 11 1 1 A 17 17 LEU HA H 102 4.729 5.137 -0.408 1
1 91 . 11 1 1 A 17 17 LEU C C 102 173.559 175.120 -1.561 1
1 92 . 11 1 1 A 17 17 LEU CA C 102 55.144 52.961 2.183 1
1 93 . 11 1 1 A 17 17 LEU CB C 102 42.948 45.941 -2.993 1
1 97 . 11 1 1 A 17 17 LEU N N 102 124.280 123.883 0.397 1
1 98 . 11 1 1 A 18 18 ARG H H 103 8.305 8.496 -0.191 1
1 99 . 11 1 1 A 18 18 ARG HA H 103 5.139 4.599 0.540 1
1 106 . 11 1 1 A 18 18 ARG C C 103 175.347 175.305 0.042 1
1 107 . 11 1 1 A 18 18 ARG CA C 103 54.793 55.893 -1.100 1
1 108 . 11 1 1 A 18 18 ARG CB C 103 31.347 29.893 1.454 1
1 111 . 11 1 1 A 18 18 ARG N N 103 122.020 122.834 -0.814 1
1 112 . 11 1 1 A 19 19 LEU H H 104 8.676 8.713 -0.037 1
1 113 . 11 1 1 A 19 19 LEU HA H 104 4.482 4.755 -0.273 1
1 123 . 11 1 1 A 19 19 LEU C C 104 175.957 175.786 0.171 1
1 124 . 11 1 1 A 19 19 LEU CA C 104 53.581 53.792 -0.211 1
1 125 . 11 1 1 A 19 19 LEU CB C 104 45.697 45.236 0.461 1
1 129 . 11 1 1 A 19 19 LEU N N 104 126.378 127.854 -1.476 1
1 130 . 11 1 1 A 20 20 ASP H H 105 9.390 9.556 -0.166 1
1 131 . 11 1 1 A 20 20 ASP HA H 105 4.287 4.389 -0.102 1
1 134 . 11 1 1 A 20 20 ASP C C 105 175.947 175.414 0.533 1
1 135 . 11 1 1 A 20 20 ASP CA C 105 55.263 55.159 0.104 1
1 136 . 11 1 1 A 20 20 ASP CB C 105 39.239 39.781 -0.542 1
1 137 . 11 1 1 A 20 20 ASP N N 105 125.208 125.886 -0.678 1
1 138 . 11 1 1 A 21 21 GLY H H 106 8.563 8.648 -0.085 1
1 139 . 11 1 1 A 21 21 GLY HA2 H 106 4.126 3.846 0.280 1
1 140 . 11 1 1 A 21 21 GLY HA3 H 106 3.509 3.849 -0.340 1
1 141 . 11 1 1 A 21 21 GLY C C 106 173.164 173.735 -0.571 1
1 142 . 11 1 1 A 21 21 GLY CA C 106 45.499 45.482 0.017 1
1 143 . 11 1 1 A 21 21 GLY N N 106 103.331 104.792 -1.461 1
1 144 . 11 1 1 A 22 22 GLU H H 107 7.713 7.997 -0.284 1
1 145 . 11 1 1 A 22 22 GLU HA H 107 4.634 4.917 -0.283 1
1 150 . 11 1 1 A 22 22 GLU C C 107 174.800 174.998 -0.198 1
1 151 . 11 1 1 A 22 22 GLU CA C 107 54.329 54.293 0.036 1
1 152 . 11 1 1 A 22 22 GLU CB C 107 32.832 34.059 -1.227 1
1 154 . 11 1 1 A 22 22 GLU N N 107 119.470 119.389 0.081 1
1 155 . 11 1 1 A 23 23 ASP H H 108 8.632 8.543 0.089 1
1 156 . 11 1 1 A 23 23 ASP HA H 108 4.872 4.687 0.185 1
1 159 . 11 1 1 A 23 23 ASP C C 108 175.533 175.543 -0.010 1
1 160 . 11 1 1 A 23 23 ASP CA C 108 55.180 53.904 1.276 1
1 161 . 11 1 1 A 23 23 ASP CB C 108 41.504 39.559 1.945 1
1 162 . 11 1 1 A 23 23 ASP N N 108 122.815 121.222 1.593 1
1 163 . 11 1 1 A 24 24 LEU H H 109 9.248 8.817 0.431 1
1 164 . 11 1 1 A 24 24 LEU HA H 109 4.836 4.452 0.384 1
1 174 . 11 1 1 A 24 24 LEU C C 109 174.322 175.678 -1.356 1
1 175 . 11 1 1 A 24 24 LEU CA C 109 54.473 55.554 -1.081 1
1 176 . 11 1 1 A 24 24 LEU CB C 109 44.718 42.287 2.431 1
1 180 . 11 1 1 A 24 24 LEU N N 109 125.550 126.973 -1.423 1
1 181 . 11 1 1 A 25 25 ARG H H 110 8.503 8.691 -0.188 1
1 182 . 11 1 1 A 25 25 ARG HA H 110 5.228 4.845 0.383 1
1 189 . 11 1 1 A 25 25 ARG C C 110 175.174 174.597 0.577 1
1 190 . 11 1 1 A 25 25 ARG CA C 110 54.745 54.757 -0.012 1
1 191 . 11 1 1 A 25 25 ARG CB C 110 31.701 31.658 0.043 1
1 194 . 11 1 1 A 25 25 ARG N N 110 125.424 128.300 -2.876 1
1 195 . 11 1 1 A 26 26 VAL H H 111 9.692 9.218 0.474 1
1 196 . 11 1 1 A 26 26 VAL HA H 111 5.091 5.073 0.018 1
1 204 . 11 1 1 A 26 26 VAL C C 111 174.446 175.400 -0.954 1
1 205 . 11 1 1 A 26 26 VAL CA C 111 61.055 61.385 -0.330 1
1 206 . 11 1 1 A 26 26 VAL CB C 111 33.780 33.727 0.053 1
1 209 . 11 1 1 A 26 26 VAL N N 111 130.649 127.584 3.065 1
1 210 . 11 1 1 A 27 27 VAL H H 112 9.401 9.096 0.305 1
1 211 . 11 1 1 A 27 27 VAL HA H 112 5.188 4.811 0.377 1
1 219 . 11 1 1 A 27 27 VAL C C 112 174.214 174.358 -0.144 1
1 220 . 11 1 1 A 27 27 VAL CA C 112 60.722 60.616 0.106 1
1 221 . 11 1 1 A 27 27 VAL CB C 112 36.082 35.954 0.128 1
1 224 . 11 1 1 A 27 27 VAL N N 112 127.416 127.122 0.294 1
1 225 . 11 1 1 A 28 28 LEU H H 113 9.265 9.135 0.130 1
1 226 . 11 1 1 A 28 28 LEU HA H 113 5.337 5.266 0.071 1
1 236 . 11 1 1 A 28 28 LEU C C 113 175.915 174.936 0.979 1
1 237 . 11 1 1 A 28 28 LEU CA C 113 52.599 53.422 -0.823 1
1 238 . 11 1 1 A 28 28 LEU CB C 113 47.495 44.441 3.054 1
1 242 . 11 1 1 A 28 28 LEU N N 113 127.527 129.050 -1.523 1
1 243 . 11 1 1 A 29 29 GLU H H 114 8.968 8.571 0.397 1
1 244 . 11 1 1 A 29 29 GLU HA H 114 4.701 4.303 0.398 1
1 249 . 11 1 1 A 29 29 GLU C C 114 176.715 177.613 -0.898 1
1 250 . 11 1 1 A 29 29 GLU CA C 114 55.342 56.448 -1.106 1
1 251 . 11 1 1 A 29 29 GLU CB C 114 30.005 30.139 -0.134 1
1 253 . 11 1 1 A 29 29 GLU N N 114 127.374 127.483 -0.109 1
1 254 . 11 1 1 A 30 30 LYS H H 115 8.243 8.645 -0.402 1
1 255 . 11 1 1 A 30 30 LYS HA H 115 3.711 4.177 -0.466 1
1 264 . 11 1 1 A 30 30 LYS C C 115 177.137 178.082 -0.945 1
1 265 . 11 1 1 A 30 30 LYS CA C 115 60.118 58.806 1.312 1
1 266 . 11 1 1 A 30 30 LYS CB C 115 32.656 32.117 0.539 1
1 270 . 11 1 1 A 30 30 LYS N N 115 124.225 125.126 -0.901 1
1 271 . 11 1 1 A 31 31 ASP H H 116 9.200 8.086 1.114 1
1 272 . 11 1 1 A 31 31 ASP HA H 116 4.444 4.424 0.020 1
1 275 . 11 1 1 A 31 31 ASP C C 116 177.774 177.448 0.326 1
1 276 . 11 1 1 A 31 31 ASP CA C 116 56.703 57.364 -0.661 1
1 277 . 11 1 1 A 31 31 ASP CB C 116 40.236 41.021 -0.785 1
1 278 . 11 1 1 A 31 31 ASP N N 116 115.955 120.445 -4.490 1
1 279 . 11 1 1 A 32 32 THR H H 117 7.352 7.527 -0.175 1
1 280 . 11 1 1 A 32 32 THR HA H 117 4.266 4.626 -0.360 1
1 285 . 11 1 1 A 32 32 THR C C 117 175.320 174.227 1.093 1
1 286 . 11 1 1 A 32 32 THR CA C 117 61.171 61.069 0.102 1
1 287 . 11 1 1 A 32 32 THR CB C 117 70.221 69.232 0.989 1
1 289 . 11 1 1 A 32 32 THR N N 117 106.440 108.525 -2.085 1
1 290 . 11 1 1 A 33 33 MET H H 118 8.216 7.939 0.277 1
1 291 . 11 1 1 A 33 33 MET HA H 118 4.184 4.335 -0.151 1
1 299 . 11 1 1 A 33 33 MET C C 118 174.952 174.485 0.467 1
1 300 . 11 1 1 A 33 33 MET CA C 118 55.195 56.408 -1.213 1
1 301 . 11 1 1 A 33 33 MET CB C 118 25.900 31.967 -6.067 1
1 304 . 11 1 1 A 33 33 MET N N 118 115.956 120.150 -4.194 1
1 305 . 11 1 1 A 34 34 ASP H H 119 7.509 8.073 -0.564 1
1 306 . 11 1 1 A 34 34 ASP HA H 119 4.486 4.775 -0.289 1
1 309 . 11 1 1 A 34 34 ASP C C 119 174.375 175.408 -1.033 1
1 310 . 11 1 1 A 34 34 ASP CA C 119 54.745 54.388 0.357 1
1 311 . 11 1 1 A 34 34 ASP CB C 119 42.865 41.829 1.036 1
1 312 . 11 1 1 A 34 34 ASP N N 119 118.500 119.273 -0.773 1
1 313 . 11 1 1 A 35 35 VAL H H 120 8.473 8.517 -0.044 1
1 314 . 11 1 1 A 35 35 VAL HA H 120 4.709 4.830 -0.121 1
1 322 . 11 1 1 A 35 35 VAL C C 120 173.900 174.428 -0.528 1
1 323 . 11 1 1 A 35 35 VAL CA C 120 60.736 61.066 -0.330 1
1 324 . 11 1 1 A 35 35 VAL CB C 120 34.662 33.013 1.649 1
1 327 . 11 1 1 A 35 35 VAL N N 120 121.116 121.360 -0.244 1
1 328 . 11 1 1 A 36 36 TRP H H 121 9.404 9.467 -0.063 1
1 329 . 11 1 1 A 36 36 TRP HA H 121 5.174 5.473 -0.299 1
1 338 . 11 1 1 A 36 36 TRP C C 121 176.480 174.768 1.712 1
1 339 . 11 1 1 A 36 36 TRP CA C 121 55.070 55.059 0.011 1
1 340 . 11 1 1 A 36 36 TRP CB C 121 32.179 32.781 -0.602 1
1 348 . 11 1 1 A 36 36 TRP N N 121 126.924 129.525 -2.601 1
1 350 . 11 1 1 A 37 37 CYS H H 122 9.230 8.500 0.730 1
1 351 . 11 1 1 A 37 37 CYS HA H 122 5.417 4.805 0.612 1
1 354 . 11 1 1 A 37 37 CYS C C 122 175.346 173.351 1.995 1
1 355 . 11 1 1 A 37 37 CYS CA C 122 57.083 58.069 -0.986 1
1 356 . 11 1 1 A 37 37 CYS CB C 122 28.713 30.194 -1.481 1
1 357 . 11 1 1 A 37 37 CYS N N 122 120.375 126.757 -6.382 1
1 358 . 11 1 1 A 38 38 ASN H H 123 9.817 9.173 0.644 1
1 359 . 11 1 1 A 38 38 ASN HA H 123 4.637 4.276 0.361 1
1 364 . 11 1 1 A 38 38 ASN C C 123 175.526 175.214 0.312 1
1 365 . 11 1 1 A 38 38 ASN CA C 123 54.023 54.389 -0.366 1
1 366 . 11 1 1 A 38 38 ASN CB C 123 36.581 37.341 -0.760 1
1 367 . 11 1 1 A 38 38 ASN N N 123 129.408 126.084 3.324 1
1 369 . 11 1 1 A 39 39 GLY H H 124 9.092 8.092 1.000 1
1 370 . 11 1 1 A 39 39 GLY HA2 H 124 4.241 3.460 0.781 1
1 371 . 11 1 1 A 39 39 GLY HA3 H 124 3.705 3.813 -0.108 1
1 372 . 11 1 1 A 39 39 GLY C C 124 173.405 173.891 -0.486 1
1 373 . 11 1 1 A 39 39 GLY CA C 124 45.595 46.719 -1.124 1
1 374 . 11 1 1 A 39 39 GLY N N 124 102.752 103.587 -0.835 1
1 375 . 11 1 1 A 40 40 GLN H H 125 8.006 7.654 0.352 1
1 376 . 11 1 1 A 40 40 GLN HA H 125 4.736 4.813 -0.077 1
1 383 . 11 1 1 A 40 40 GLN C C 125 174.477 174.990 -0.513 1
1 384 . 11 1 1 A 40 40 GLN CA C 125 53.747 55.019 -1.272 1
1 385 . 11 1 1 A 40 40 GLN CB C 125 30.413 30.872 -0.459 1
1 387 . 11 1 1 A 40 40 GLN N N 125 120.627 119.080 1.547 1
1 389 . 11 1 1 A 41 41 LYS H H 126 8.757 8.703 0.054 1
1 390 . 11 1 1 A 41 41 LYS HA H 126 3.464 4.491 -1.027 1
1 399 . 11 1 1 A 41 41 LYS C C 126 176.870 176.318 0.552 1
1 400 . 11 1 1 A 41 41 LYS CA C 126 57.136 57.005 0.131 1
1 401 . 11 1 1 A 41 41 LYS CB C 126 31.669 32.856 -1.187 1
1 405 . 11 1 1 A 41 41 LYS N N 126 129.107 127.924 1.183 1
1 406 . 11 1 1 A 42 42 MET H H 127 8.682 8.696 -0.014 1
1 407 . 11 1 1 A 42 42 MET HA H 127 4.712 4.386 0.326 1
1 415 . 11 1 1 A 42 42 MET C C 127 176.816 175.798 1.018 1
1 416 . 11 1 1 A 42 42 MET CA C 127 52.958 56.200 -3.242 1
1 417 . 11 1 1 A 42 42 MET CB C 127 33.023 33.721 -0.698 1
1 420 . 11 1 1 A 42 42 MET N N 127 126.569 126.375 0.194 1
1 421 . 11 1 1 A 43 43 GLU H H 128 8.734 8.790 -0.056 1
1 422 . 11 1 1 A 43 43 GLU HA H 128 4.419 4.908 -0.489 1
1 427 . 11 1 1 A 43 43 GLU C C 128 176.531 176.607 -0.076 1
1 428 . 11 1 1 A 43 43 GLU CA C 128 56.475 55.155 1.320 1
1 429 . 11 1 1 A 43 43 GLU CB C 128 29.604 30.579 -0.975 1
1 431 . 11 1 1 A 43 43 GLU N N 128 123.734 122.370 1.364 1
1 432 . 11 1 1 A 44 44 THR H H 129 8.263 8.853 -0.590 1
1 433 . 11 1 1 A 44 44 THR HA H 129 5.385 5.397 -0.012 1
1 438 . 11 1 1 A 44 44 THR C C 129 174.205 174.137 0.068 1
1 439 . 11 1 1 A 44 44 THR CA C 129 59.160 60.520 -1.360 1
1 440 . 11 1 1 A 44 44 THR CB C 129 72.419 70.955 1.464 1
1 442 . 11 1 1 A 44 44 THR N N 129 115.081 117.907 -2.826 1
1 443 . 11 1 1 A 45 45 ALA H H 130 8.727 8.263 0.464 1
1 444 . 11 1 1 A 45 45 ALA HA H 130 4.749 4.574 0.175 1
1 448 . 11 1 1 A 45 45 ALA C C 130 177.017 178.576 -1.559 1
1 449 . 11 1 1 A 45 45 ALA CA C 130 51.645 52.759 -1.114 1
1 450 . 11 1 1 A 45 45 ALA CB C 130 21.364 21.221 0.143 1
1 451 . 11 1 1 A 45 45 ALA N N 130 123.243 122.924 0.319 1
1 452 . 11 1 1 A 46 46 GLY H H 131 8.818 8.222 0.596 1
1 453 . 11 1 1 A 46 46 GLY HA2 H 131 4.941 3.981 0.960 1
1 454 . 11 1 1 A 46 46 GLY HA3 H 131 3.690 4.056 -0.366 1
1 455 . 11 1 1 A 46 46 GLY C C 131 173.528 174.682 -1.154 1
1 456 . 11 1 1 A 46 46 GLY CA C 131 45.060 46.533 -1.473 1
1 457 . 11 1 1 A 46 46 GLY N N 131 112.392 107.599 4.793 1
1 458 . 11 1 1 A 47 47 GLU H H 132 8.746 7.848 0.898 1
1 459 . 11 1 1 A 47 47 GLU HA H 132 4.584 4.416 0.168 1
1 464 . 11 1 1 A 47 47 GLU C C 132 175.223 176.213 -0.990 1
1 465 . 11 1 1 A 47 47 GLU CA C 132 55.008 56.323 -1.315 1
1 466 . 11 1 1 A 47 47 GLU CB C 132 32.939 30.211 2.728 1
1 468 . 11 1 1 A 47 47 GLU N N 132 122.107 120.135 1.972 1
1 469 . 11 1 1 A 48 48 PHE H H 133 8.920 9.210 -0.290 1
1 470 . 11 1 1 A 48 48 PHE HA H 133 4.822 4.932 -0.110 1
1 475 . 11 1 1 A 48 48 PHE C C 133 175.499 175.731 -0.232 1
1 476 . 11 1 1 A 48 48 PHE CA C 133 58.320 58.083 0.237 1
1 477 . 11 1 1 A 48 48 PHE CB C 133 39.175 39.706 -0.531 1
1 479 . 11 1 1 A 48 48 PHE N N 133 124.006 124.935 -0.929 1
1 480 . 11 1 1 A 49 49 VAL H H 134 8.161 8.539 -0.378 1
1 481 . 11 1 1 A 49 49 VAL HA H 134 4.492 4.790 -0.298 1
1 489 . 11 1 1 A 49 49 VAL C C 134 176.241 176.776 -0.535 1
1 490 . 11 1 1 A 49 49 VAL CA C 134 60.328 59.700 0.628 1
1 491 . 11 1 1 A 49 49 VAL CB C 134 34.542 34.542 0.000 1
1 494 . 11 1 1 A 49 49 VAL N N 134 120.063 119.763 0.300 1
1 495 . 11 1 1 A 50 50 ASP H H 135 8.596 8.574 0.022 1
1 496 . 11 1 1 A 50 50 ASP HA H 135 4.278 4.416 -0.138 1
1 499 . 11 1 1 A 50 50 ASP C C 135 176.567 176.120 0.447 1
1 500 . 11 1 1 A 50 50 ASP CA C 135 57.149 57.131 0.018 1
1 501 . 11 1 1 A 50 50 ASP CB C 135 40.477 40.972 -0.495 1
1 502 . 11 1 1 A 50 50 ASP N N 135 122.137 121.380 0.757 1
1 503 . 11 1 1 A 51 51 ASP H H 136 8.328 7.908 0.420 1
1 504 . 11 1 1 A 51 51 ASP HA H 136 4.656 5.081 -0.425 1
1 507 . 11 1 1 A 51 51 ASP C C 136 175.798 174.688 1.110 1
1 508 . 11 1 1 A 51 51 ASP CA C 136 53.458 53.413 0.045 1
1 509 . 11 1 1 A 51 51 ASP CB C 136 40.306 42.569 -2.263 1
1 510 . 11 1 1 A 51 51 ASP N N 136 116.158 115.785 0.373 1
1 511 . 11 1 1 A 52 52 GLY H H 137 7.653 8.313 -0.660 1
1 512 . 11 1 1 A 52 52 GLY HA2 H 137 4.685 4.002 0.683 1
1 513 . 11 1 1 A 52 52 GLY HA3 H 137 4.069 4.021 0.048 1
1 514 . 11 1 1 A 52 52 GLY C C 137 173.149 172.433 0.716 1
1 515 . 11 1 1 A 52 52 GLY CA C 137 45.860 44.095 1.765 1
1 516 . 11 1 1 A 52 52 GLY N N 137 107.634 109.176 -1.542 1
1 517 . 11 1 1 A 53 53 THR H H 138 8.445 7.731 0.714 1
1 518 . 11 1 1 A 53 53 THR HA H 138 4.996 4.882 0.114 1
1 523 . 11 1 1 A 53 53 THR C C 138 174.163 173.242 0.921 1
1 524 . 11 1 1 A 53 53 THR CA C 138 60.974 61.396 -0.422 1
1 525 . 11 1 1 A 53 53 THR CB C 138 72.266 71.796 0.470 1
1 527 . 11 1 1 A 53 53 THR N N 138 114.976 114.702 0.274 1
1 528 . 11 1 1 A 54 54 GLU H H 139 8.917 8.852 0.065 1
1 529 . 11 1 1 A 54 54 GLU HA H 139 5.205 4.594 0.611 1
1 534 . 11 1 1 A 54 54 GLU C C 139 175.700 175.133 0.567 1
1 535 . 11 1 1 A 54 54 GLU CA C 139 54.731 55.340 -0.609 1
1 536 . 11 1 1 A 54 54 GLU CB C 139 33.250 29.969 3.281 1
1 538 . 11 1 1 A 54 54 GLU N N 139 121.295 126.311 -5.016 1
1 539 . 11 1 1 A 55 55 THR H H 140 9.190 8.288 0.902 1
1 540 . 11 1 1 A 55 55 THR HA H 140 4.744 4.601 0.143 1
1 545 . 11 1 1 A 55 55 THR C C 140 174.537 173.692 0.845 1
1 546 . 11 1 1 A 55 55 THR CA C 140 62.678 62.148 0.530 1
1 547 . 11 1 1 A 55 55 THR CB C 140 69.744 68.982 0.762 1
1 549 . 11 1 1 A 55 55 THR N N 140 122.419 121.651 0.768 1
1 550 . 11 1 1 A 56 56 HIS H H 141 9.395 9.008 0.387 1
1 551 . 11 1 1 A 56 56 HIS HA H 141 5.204 4.954 0.250 1
1 556 . 11 1 1 A 56 56 HIS C C 141 174.675 174.979 -0.304 1
1 557 . 11 1 1 A 56 56 HIS CA C 141 55.557 53.752 1.805 1
1 558 . 11 1 1 A 56 56 HIS CB C 141 31.279 30.775 0.504 1
1 561 . 11 1 1 A 56 56 HIS N N 141 125.732 125.994 -0.262 1
1 564 . 11 1 1 A 57 57 PHE H H 142 8.790 8.299 0.491 1
1 565 . 11 1 1 A 57 57 PHE HA H 142 4.918 5.905 -0.987 1
1 571 . 11 1 1 A 57 57 PHE C C 142 172.293 172.883 -0.590 1
1 572 . 11 1 1 A 57 57 PHE CA C 142 56.366 55.549 0.817 1
1 573 . 11 1 1 A 57 57 PHE CB C 142 39.962 42.794 -2.832 1
1 575 . 11 1 1 A 57 57 PHE N N 142 117.009 121.152 -4.143 1
1 576 . 11 1 1 A 58 58 SER H H 143 8.890 9.231 -0.341 1
1 577 . 11 1 1 A 58 58 SER HA H 143 5.286 5.497 -0.211 1
1 580 . 11 1 1 A 58 58 SER C C 143 173.716 174.009 -0.293 1
1 581 . 11 1 1 A 58 58 SER CA C 143 57.517 55.943 1.574 1
1 582 . 11 1 1 A 58 58 SER CB C 143 65.448 66.129 -0.681 1
1 583 . 11 1 1 A 58 58 SER N N 143 115.269 114.224 1.045 1
1 584 . 11 1 1 A 59 59 VAL H H 144 7.737 8.785 -1.048 1
1 585 . 11 1 1 A 59 59 VAL HA H 144 4.220 4.422 -0.202 1
1 593 . 11 1 1 A 59 59 VAL C C 144 176.234 176.105 0.129 1
1 594 . 11 1 1 A 59 59 VAL CA C 144 61.741 60.941 0.800 1
1 595 . 11 1 1 A 59 59 VAL CB C 144 33.711 33.797 -0.086 1
1 598 . 11 1 1 A 59 59 VAL N N 144 123.186 119.870 3.316 1
1 599 . 11 1 1 A 60 60 GLY H H 145 8.945 9.041 -0.096 1
1 600 . 11 1 1 A 60 60 GLY HA2 H 145 4.027 3.814 0.213 1
1 601 . 11 1 1 A 60 60 GLY HA3 H 145 3.692 3.830 -0.138 1
1 602 . 11 1 1 A 60 60 GLY C C 145 175.182 174.596 0.586 1
1 603 . 11 1 1 A 60 60 GLY CA C 145 47.141 47.325 -0.184 1
1 604 . 11 1 1 A 60 60 GLY N N 145 116.908 118.203 -1.295 1
1 605 . 11 1 1 A 61 61 ASN H H 146 8.929 8.639 0.290 1
1 606 . 11 1 1 A 61 61 ASN HA H 146 4.718 4.878 -0.160 1
1 611 . 11 1 1 A 61 61 ASN C C 146 174.706 174.021 0.685 1
1 612 . 11 1 1 A 61 61 ASN CA C 146 52.802 52.371 0.431 1
1 613 . 11 1 1 A 61 61 ASN CB C 146 37.917 39.042 -1.125 1
1 614 . 11 1 1 A 61 61 ASN N N 146 123.976 124.567 -0.591 1
1 616 . 11 1 1 A 62 62 HIS H H 147 8.400 7.602 0.798 1
1 617 . 11 1 1 A 62 62 HIS HA H 147 4.762 5.070 -0.308 1
1 622 . 11 1 1 A 62 62 HIS C C 147 173.871 173.488 0.383 1
1 623 . 11 1 1 A 62 62 HIS CA C 147 55.374 54.433 0.941 1
1 624 . 11 1 1 A 62 62 HIS CB C 147 28.655 34.330 -5.675 1
1 628 . 11 1 1 A 62 62 HIS N N 147 118.620 118.238 0.382 1
1 631 . 11 1 1 A 63 63 ASP H H 148 8.734 8.855 -0.121 1
1 632 . 11 1 1 A 63 63 ASP HA H 148 4.785 5.199 -0.414 1
1 635 . 11 1 1 A 63 63 ASP C C 148 175.269 174.477 0.792 1
1 636 . 11 1 1 A 63 63 ASP CA C 148 54.390 53.679 0.711 1
1 637 . 11 1 1 A 63 63 ASP CB C 148 42.105 43.628 -1.523 1
1 638 . 11 1 1 A 63 63 ASP N N 148 125.336 119.646 5.690 1
1 639 . 11 1 1 A 64 64 CYS H H 149 8.225 9.284 -1.059 1
1 640 . 11 1 1 A 64 64 CYS HA H 149 5.118 5.387 -0.269 1
1 643 . 11 1 1 A 64 64 CYS C C 149 173.740 172.920 0.820 1
1 644 . 11 1 1 A 64 64 CYS CA C 149 55.423 56.864 -1.441 1
1 645 . 11 1 1 A 64 64 CYS CB C 149 29.972 32.512 -2.540 1
1 646 . 11 1 1 A 64 64 CYS N N 149 124.476 122.775 1.701 1
1 647 . 11 1 1 A 65 65 TYR H H 150 8.916 8.875 0.041 1
1 648 . 11 1 1 A 65 65 TYR HA H 150 5.121 3.929 1.192 1
1 655 . 11 1 1 A 65 65 TYR C C 150 172.821 172.118 0.703 1
1 656 . 11 1 1 A 65 65 TYR CA C 150 56.347 55.491 0.856 1
1 657 . 11 1 1 A 65 65 TYR CB C 150 38.901 41.156 -2.255 1
1 662 . 11 1 1 A 65 65 TYR N N 150 115.313 117.025 -1.712 1
1 663 . 11 1 1 A 66 66 ILE H H 151 8.423 8.233 0.190 1
1 664 . 11 1 1 A 66 66 ILE HA H 151 5.000 4.352 0.648 1
1 674 . 11 1 1 A 66 66 ILE C C 151 176.225 174.710 1.515 1
1 675 . 11 1 1 A 66 66 ILE CA C 151 57.798 59.995 -2.197 1
1 676 . 11 1 1 A 66 66 ILE CB C 151 39.863 38.630 1.233 1
1 680 . 11 1 1 A 66 66 ILE N N 151 118.575 121.249 -2.674 1
1 681 . 11 1 1 A 67 67 LYS H H 152 9.480 8.753 0.727 1
1 682 . 11 1 1 A 67 67 LYS HA H 152 5.091 4.649 0.442 1
1 691 . 11 1 1 A 67 67 LYS C C 152 174.079 175.035 -0.956 1
1 692 . 11 1 1 A 67 67 LYS CA C 152 54.728 56.082 -1.354 1
1 693 . 11 1 1 A 67 67 LYS CB C 152 35.256 32.991 2.265 1
1 697 . 11 1 1 A 67 67 LYS N N 152 132.311 128.417 3.894 1
1 698 . 11 1 1 A 68 68 ALA H H 153 8.844 8.375 0.469 1
1 699 . 11 1 1 A 68 68 ALA HA H 153 5.039 5.266 -0.227 1
1 703 . 11 1 1 A 68 68 ALA C C 153 176.587 176.307 0.280 1
1 704 . 11 1 1 A 68 68 ALA CA C 153 50.484 50.848 -0.364 1
1 705 . 11 1 1 A 68 68 ALA CB C 153 20.570 21.195 -0.625 1
1 706 . 11 1 1 A 68 68 ALA N N 153 129.958 129.686 0.272 1
1 707 . 11 1 1 A 69 69 VAL H H 154 8.461 8.688 -0.227 1
1 708 . 11 1 1 A 69 69 VAL HA H 154 4.558 4.573 -0.015 1
1 716 . 11 1 1 A 69 69 VAL C C 154 175.331 175.278 0.053 1
1 717 . 11 1 1 A 69 69 VAL CA C 154 60.758 60.809 -0.051 1
1 718 . 11 1 1 A 69 69 VAL CB C 154 34.743 35.107 -0.364 1
1 721 . 11 1 1 A 69 69 VAL N N 154 121.496 122.693 -1.197 1
1 722 . 11 1 1 A 70 70 SER H H 155 8.695 8.998 -0.303 1
1 723 . 11 1 1 A 70 70 SER HA H 155 4.646 5.119 -0.473 1
1 726 . 11 1 1 A 70 70 SER C C 155 174.690 173.947 0.743 1
1 727 . 11 1 1 A 70 70 SER CA C 155 58.065 56.968 1.097 1
1 728 . 11 1 1 A 70 70 SER CB C 155 64.062 64.866 -0.804 1
1 729 . 11 1 1 A 70 70 SER N N 155 119.763 121.933 -2.170 1
1 730 . 11 1 1 A 71 71 SER H H 156 8.360 8.895 -0.535 1
1 731 . 11 1 1 A 71 71 SER HA H 156 4.430 5.199 -0.769 1
1 734 . 11 1 1 A 71 71 SER CA C 156 58.491 56.891 1.600 1
1 735 . 11 1 1 A 71 71 SER CB C 156 64.061 66.178 -2.117 1
1 736 . 11 1 1 A 71 71 SER N N 156 118.577 114.941 3.636 1
1 737 . 11 1 1 A 72 72 GLY H H 157 8.542 8.307 0.235 1
1 738 . 11 1 1 A 72 72 GLY HA2 H 157 4.002 4.181 -0.179 1
1 739 . 11 1 1 A 72 72 GLY HA3 H 157 4.002 4.182 -0.180 1
1 740 . 11 1 1 A 72 72 GLY CA C 157 45.565 44.346 1.219 1
1 741 . 11 1 1 A 72 72 GLY N N 157 111.540 108.325 3.215 1
1 742 . 11 1 1 A 73 73 LYS H H 158 8.369 8.644 -0.275 1
1 743 . 11 1 1 A 73 73 LYS CA C 158 56.720 58.623 -1.903 1
1 744 . 11 1 1 A 73 73 LYS CB C 158 32.915 33.031 -0.116 1
1 747 . 11 1 1 A 73 73 LYS N N 158 120.293 123.690 -3.397 1
1 748 . 11 1 1 A 74 74 ARG H H 159 8.181 7.913 0.268 1
1 749 . 11 1 1 A 74 74 ARG CA C 159 56.148 56.686 -0.538 1
1 751 . 11 1 1 A 74 74 ARG N N 159 119.343 115.794 3.549 1
1 752 . 11 1 1 A 75 75 LYS H H 160 8.443 7.733 0.710 1
1 753 . 11 1 1 A 75 75 LYS HA H 160 4.067 4.519 -0.452 1
1 762 . 11 1 1 A 75 75 LYS C C 160 176.868 176.283 0.585 1
1 763 . 11 1 1 A 75 75 LYS CA C 160 57.711 55.575 2.136 1
1 764 . 11 1 1 A 75 75 LYS CB C 160 31.777 32.545 -0.768 1
1 768 . 11 1 1 A 75 75 LYS N N 160 120.467 118.596 1.871 1
1 769 . 11 1 1 A 76 76 GLU H H 161 8.693 8.386 0.307 1
1 770 . 11 1 1 A 76 76 GLU HA H 161 4.290 4.151 0.139 1
1 771 . 11 1 1 A 76 76 GLU C C 161 176.844 176.608 0.236 1
1 772 . 11 1 1 A 76 76 GLU CA C 161 57.294 59.170 -1.876 1
1 773 . 11 1 1 A 76 76 GLU CB C 161 29.794 30.648 -0.854 1
1 775 . 11 1 1 A 76 76 GLU N N 161 118.767 124.313 -5.546 1
1 776 . 11 1 1 A 77 77 GLY H H 162 8.168 7.702 0.466 1
1 777 . 11 1 1 A 77 77 GLY HA2 H 162 4.010 4.180 -0.170 1
1 778 . 11 1 1 A 77 77 GLY HA3 H 162 3.963 4.184 -0.221 1
1 779 . 11 1 1 A 77 77 GLY C C 162 173.512 171.716 1.796 1
1 780 . 11 1 1 A 77 77 GLY CA C 162 45.362 44.824 0.538 1
1 781 . 11 1 1 A 77 77 GLY N N 162 108.621 106.121 2.500 1
1 782 . 11 1 1 A 78 78 ILE H H 163 7.954 8.728 -0.774 1
1 783 . 11 1 1 A 78 78 ILE HA H 163 4.323 4.822 -0.499 1
1 793 . 11 1 1 A 78 78 ILE C C 163 175.402 175.074 0.328 1
1 794 . 11 1 1 A 78 78 ILE CA C 163 60.632 59.202 1.430 1
1 795 . 11 1 1 A 78 78 ILE CB C 163 39.759 40.993 -1.234 1
1 799 . 11 1 1 A 78 78 ILE N N 163 121.604 124.248 -2.644 1
1 800 . 11 1 1 A 79 79 ILE H H 164 8.514 8.730 -0.216 1
1 801 . 11 1 1 A 79 79 ILE HA H 164 4.341 4.689 -0.348 1
1 811 . 11 1 1 A 79 79 ILE C C 164 175.172 174.564 0.608 1
1 812 . 11 1 1 A 79 79 ILE CA C 164 60.027 59.880 0.147 1
1 813 . 11 1 1 A 79 79 ILE CB C 164 40.153 40.930 -0.777 1
1 817 . 11 1 1 A 79 79 ILE N N 164 127.137 125.791 1.346 1
1 818 . 11 1 1 A 80 80 HIS H H 165 8.492 8.922 -0.430 1
1 819 . 11 1 1 A 80 80 HIS HA H 165 5.676 5.268 0.408 1
1 824 . 11 1 1 A 80 80 HIS C C 165 175.502 174.083 1.419 1
1 825 . 11 1 1 A 80 80 HIS CA C 165 57.043 55.263 1.780 1
1 826 . 11 1 1 A 80 80 HIS CB C 165 32.741 31.943 0.798 1
1 829 . 11 1 1 A 80 80 HIS N N 165 125.422 126.432 -1.010 1
1 830 . 11 1 1 A 81 81 THR H H 166 9.080 9.223 -0.143 1
1 831 . 11 1 1 A 81 81 THR HA H 166 4.999 5.212 -0.213 1
1 836 . 11 1 1 A 81 81 THR C C 166 171.877 172.746 -0.869 1
1 837 . 11 1 1 A 81 81 THR CA C 166 59.924 60.933 -1.009 1
1 838 . 11 1 1 A 81 81 THR CB C 166 72.243 70.591 1.652 1
1 840 . 11 1 1 A 81 81 THR N N 166 117.682 113.927 3.755 1
1 841 . 11 1 1 A 82 82 LEU H H 167 8.062 7.937 0.125 1
1 842 . 11 1 1 A 82 82 LEU HA H 167 4.350 3.847 0.503 1
1 852 . 11 1 1 A 82 82 LEU C C 167 172.705 174.948 -2.243 1
1 853 . 11 1 1 A 82 82 LEU CA C 167 53.553 55.576 -2.023 1
1 854 . 11 1 1 A 82 82 LEU CB C 167 39.768 41.252 -1.484 1
1 858 . 11 1 1 A 82 82 LEU N N 167 125.369 128.082 -2.713 1
1 859 . 11 1 1 A 83 83 ILE H H 168 8.657 8.250 0.407 1
1 860 . 11 1 1 A 83 83 ILE HA H 168 4.476 4.856 -0.380 1
1 870 . 11 1 1 A 83 83 ILE C C 168 175.159 174.297 0.862 1
1 871 . 11 1 1 A 83 83 ILE CA C 168 58.529 60.029 -1.500 1
1 872 . 11 1 1 A 83 83 ILE CB C 168 37.410 39.951 -2.541 1
1 876 . 11 1 1 A 83 83 ILE N N 168 128.042 127.686 0.356 1
1 877 . 11 1 1 A 84 84 VAL H H 169 8.464 8.371 0.093 1
1 878 . 11 1 1 A 84 84 VAL HA H 169 4.284 4.503 -0.219 1
1 886 . 11 1 1 A 84 84 VAL C C 169 176.138 175.995 0.143 1
1 887 . 11 1 1 A 84 84 VAL CA C 169 61.029 61.163 -0.134 1
1 888 . 11 1 1 A 84 84 VAL CB C 169 34.714 33.688 1.026 1
1 891 . 11 1 1 A 84 84 VAL N N 169 124.644 127.227 -2.583 1
1 892 . 11 1 1 A 85 85 ASP H H 170 9.158 9.060 0.098 1
1 893 . 11 1 1 A 85 85 ASP HA H 170 4.362 4.274 0.088 1
1 896 . 11 1 1 A 85 85 ASP C C 170 175.489 175.090 0.399 1
1 897 . 11 1 1 A 85 85 ASP CA C 170 55.868 55.190 0.678 1
1 898 . 11 1 1 A 85 85 ASP CB C 170 38.927 39.485 -0.558 1
1 899 . 11 1 1 A 85 85 ASP N N 170 129.061 127.569 1.492 1
1 900 . 11 1 1 A 86 86 ASN H H 171 8.811 8.485 0.326 1
1 901 . 11 1 1 A 86 86 ASN HA H 171 4.053 4.387 -0.334 1
1 906 . 11 1 1 A 86 86 ASN C C 171 173.802 173.765 0.037 1
1 907 . 11 1 1 A 86 86 ASN CA C 171 55.173 54.702 0.471 1
1 908 . 11 1 1 A 86 86 ASN CB C 171 38.150 36.952 1.198 1
1 909 . 11 1 1 A 86 86 ASN N N 171 108.418 108.825 -0.407 1
1 911 . 11 1 1 A 87 87 ARG H H 172 7.914 7.567 0.347 1
1 912 . 11 1 1 A 87 87 ARG HA H 172 4.597 4.666 -0.069 1
1 919 . 11 1 1 A 87 87 ARG C C 172 174.025 174.927 -0.902 1
1 920 . 11 1 1 A 87 87 ARG CA C 172 54.846 54.301 0.545 1
1 921 . 11 1 1 A 87 87 ARG CB C 172 32.697 33.100 -0.403 1
1 924 . 11 1 1 A 87 87 ARG N N 172 120.988 117.507 3.481 1
1 925 . 11 1 1 A 88 88 GLU H H 173 8.534 8.722 -0.188 1
1 926 . 11 1 1 A 88 88 GLU HA H 173 4.560 4.296 0.264 1
1 931 . 11 1 1 A 88 88 GLU C C 173 176.187 175.654 0.533 1
1 932 . 11 1 1 A 88 88 GLU CA C 173 56.044 57.172 -1.128 1
1 933 . 11 1 1 A 88 88 GLU CB C 173 30.329 30.348 -0.019 1
1 935 . 11 1 1 A 88 88 GLU N N 173 123.982 124.507 -0.525 1
1 936 . 11 1 1 A 89 89 ILE H H 174 8.897 8.006 0.891 1
1 937 . 11 1 1 A 89 89 ILE HA H 174 4.666 4.567 0.099 1
1 947 . 11 1 1 A 89 89 ILE C C 174 174.110 174.111 -0.001 1
1 948 . 11 1 1 A 89 89 ILE CA C 174 55.255 57.375 -2.120 1
1 949 . 11 1 1 A 89 89 ILE CB C 174 37.851 41.635 -3.784 1
1 953 . 11 1 1 A 89 89 ILE N N 174 130.008 126.120 3.888 1
1 954 . 11 1 1 A 90 90 PRO HA H 175 4.713 4.672 0.041 1
1 961 . 11 1 1 A 90 90 PRO C C 175 176.956 176.261 0.695 1
1 962 . 11 1 1 A 90 90 PRO CA C 175 63.159 62.977 0.182 1
1 963 . 11 1 1 A 90 90 PRO CB C 175 32.428 32.611 -0.183 1
1 966 . 11 1 1 A 91 91 GLU H H 176 8.778 8.706 0.072 1
1 967 . 11 1 1 A 91 91 GLU HA H 176 3.910 4.801 -0.891 1
1 972 . 11 1 1 A 91 91 GLU C C 176 176.426 176.106 0.320 1
1 973 . 11 1 1 A 91 91 GLU CA C 176 56.738 55.885 0.853 1
1 974 . 11 1 1 A 91 91 GLU CB C 176 30.540 30.886 -0.346 1
1 976 . 11 1 1 A 91 91 GLU N N 176 124.561 121.770 2.791 1
1 977 . 11 1 1 A 92 92 LEU H H 177 8.630 8.395 0.235 1
1 978 . 11 1 1 A 92 92 LEU HA H 177 4.419 4.634 -0.215 1
1 988 . 11 1 1 A 92 92 LEU C C 177 177.162 176.272 0.890 1
1 989 . 11 1 1 A 92 92 LEU CA C 177 55.350 55.512 -0.162 1
1 990 . 11 1 1 A 92 92 LEU CB C 177 42.390 41.660 0.730 1
1 994 . 11 1 1 A 92 92 LEU N N 177 126.683 127.521 -0.838 1
1 995 . 11 1 1 A 93 93 THR H H 178 8.375 8.524 -0.149 1
1 996 . 11 1 1 A 93 93 THR HA H 178 4.359 4.748 -0.389 1
1 1001 . 11 1 1 A 93 93 THR C C 178 173.589 172.063 1.526 1
1 1002 . 11 1 1 A 93 93 THR CA C 178 61.621 60.901 0.720 1
1 1003 . 11 1 1 A 93 93 THR CB C 178 69.724 69.785 -0.061 1
1 1005 . 11 1 1 A 93 93 THR N N 178 119.699 118.368 1.331 1
1 1 . 12 1 1 A 9 9 SER H H 94 8.475 8.989 -0.514 1
1 2 . 12 1 1 A 9 9 SER CA C 94 58.531 60.322 -1.791 1
1 3 . 12 1 1 A 9 9 SER N N 94 117.432 115.231 2.201 1
1 4 . 12 1 1 A 10 10 LYS H H 95 8.527 7.675 0.852 1
1 5 . 12 1 1 A 10 10 LYS C C 95 174.594 175.975 -1.381 1
1 6 . 12 1 1 A 10 10 LYS CA C 95 56.603 54.988 1.615 1
1 7 . 12 1 1 A 10 10 LYS N N 95 123.104 114.779 8.325 1
1 8 . 12 1 1 A 11 11 THR H H 96 8.245 8.304 -0.059 1
1 9 . 12 1 1 A 11 11 THR C C 96 174.393 173.428 0.965 1
1 10 . 12 1 1 A 11 11 THR CA C 96 62.149 61.059 1.090 1
1 11 . 12 1 1 A 11 11 THR CB C 96 69.183 68.650 0.533 1
1 13 . 12 1 1 A 11 11 THR N N 96 113.245 111.127 2.118 1
1 14 . 12 1 1 A 12 12 THR H H 97 7.769 7.493 0.276 1
1 15 . 12 1 1 A 12 12 THR HA H 97 5.583 5.015 0.568 1
1 20 . 12 1 1 A 12 12 THR C C 97 174.726 172.218 2.508 1
1 21 . 12 1 1 A 12 12 THR CA C 97 59.602 60.838 -1.236 1
1 22 . 12 1 1 A 12 12 THR CB C 97 72.805 71.346 1.459 1
1 24 . 12 1 1 A 12 12 THR N N 97 113.440 112.117 1.323 1
1 25 . 12 1 1 A 13 13 SER H H 98 8.593 8.541 0.052 1
1 26 . 12 1 1 A 13 13 SER HA H 98 4.448 5.097 -0.649 1
1 29 . 12 1 1 A 13 13 SER C C 98 171.426 172.505 -1.079 1
1 30 . 12 1 1 A 13 13 SER CA C 98 59.056 56.971 2.085 1
1 31 . 12 1 1 A 13 13 SER CB C 98 67.839 65.178 2.661 1
1 32 . 12 1 1 A 13 13 SER N N 98 119.042 121.294 -2.252 1
1 33 . 12 1 1 A 14 14 THR H H 99 8.155 8.010 0.145 1
1 34 . 12 1 1 A 14 14 THR HA H 99 5.383 5.157 0.226 1
1 39 . 12 1 1 A 14 14 THR C C 99 171.565 172.754 -1.189 1
1 40 . 12 1 1 A 14 14 THR CA C 99 61.291 60.320 0.971 1
1 41 . 12 1 1 A 14 14 THR CB C 99 71.654 72.489 -0.835 1
1 43 . 12 1 1 A 14 14 THR N N 99 118.204 115.742 2.462 1
1 44 . 12 1 1 A 15 15 TRP H H 100 9.637 9.063 0.574 1
1 45 . 12 1 1 A 15 15 TRP HA H 100 4.807 5.102 -0.295 1
1 54 . 12 1 1 A 15 15 TRP C C 100 174.399 175.571 -1.172 1
1 55 . 12 1 1 A 15 15 TRP CA C 100 58.302 56.249 2.053 1
1 56 . 12 1 1 A 15 15 TRP CB C 100 34.810 33.565 1.245 1
1 63 . 12 1 1 A 15 15 TRP N N 100 125.132 123.467 1.665 1
1 65 . 12 1 1 A 16 16 VAL H H 101 8.863 9.055 -0.192 1
1 66 . 12 1 1 A 16 16 VAL HA H 101 5.267 4.749 0.518 1
1 74 . 12 1 1 A 16 16 VAL C C 101 174.955 175.236 -0.281 1
1 75 . 12 1 1 A 16 16 VAL CA C 101 60.653 61.684 -1.031 1
1 76 . 12 1 1 A 16 16 VAL CB C 101 34.284 32.961 1.323 1
1 79 . 12 1 1 A 16 16 VAL N N 101 119.527 123.228 -3.701 1
1 80 . 12 1 1 A 17 17 LEU H H 102 8.961 8.982 -0.021 1
1 81 . 12 1 1 A 17 17 LEU HA H 102 4.729 5.144 -0.415 1
1 91 . 12 1 1 A 17 17 LEU C C 102 173.559 175.083 -1.524 1
1 92 . 12 1 1 A 17 17 LEU CA C 102 55.144 53.097 2.047 1
1 93 . 12 1 1 A 17 17 LEU CB C 102 42.948 45.875 -2.927 1
1 97 . 12 1 1 A 17 17 LEU N N 102 124.280 123.907 0.373 1
1 98 . 12 1 1 A 18 18 ARG H H 103 8.305 8.385 -0.080 1
1 99 . 12 1 1 A 18 18 ARG HA H 103 5.139 4.632 0.507 1
1 106 . 12 1 1 A 18 18 ARG C C 103 175.347 175.277 0.070 1
1 107 . 12 1 1 A 18 18 ARG CA C 103 54.793 56.108 -1.315 1
1 108 . 12 1 1 A 18 18 ARG CB C 103 31.347 29.829 1.518 1
1 111 . 12 1 1 A 18 18 ARG N N 103 122.020 120.116 1.904 1
1 112 . 12 1 1 A 19 19 LEU H H 104 8.676 8.744 -0.068 1
1 113 . 12 1 1 A 19 19 LEU HA H 104 4.482 4.805 -0.323 1
1 123 . 12 1 1 A 19 19 LEU C C 104 175.957 175.814 0.143 1
1 124 . 12 1 1 A 19 19 LEU CA C 104 53.581 53.744 -0.163 1
1 125 . 12 1 1 A 19 19 LEU CB C 104 45.697 45.277 0.420 1
1 129 . 12 1 1 A 19 19 LEU N N 104 126.378 125.021 1.357 1
1 130 . 12 1 1 A 20 20 ASP H H 105 9.390 9.507 -0.117 1
1 131 . 12 1 1 A 20 20 ASP HA H 105 4.287 4.355 -0.068 1
1 134 . 12 1 1 A 20 20 ASP C C 105 175.947 175.419 0.528 1
1 135 . 12 1 1 A 20 20 ASP CA C 105 55.263 55.116 0.147 1
1 136 . 12 1 1 A 20 20 ASP CB C 105 39.239 39.897 -0.658 1
1 137 . 12 1 1 A 20 20 ASP N N 105 125.208 125.676 -0.468 1
1 138 . 12 1 1 A 21 21 GLY H H 106 8.563 8.626 -0.063 1
1 139 . 12 1 1 A 21 21 GLY HA2 H 106 4.126 3.831 0.295 1
1 140 . 12 1 1 A 21 21 GLY HA3 H 106 3.509 3.836 -0.327 1
1 141 . 12 1 1 A 21 21 GLY C C 106 173.164 173.729 -0.565 1
1 142 . 12 1 1 A 21 21 GLY CA C 106 45.499 45.449 0.050 1
1 143 . 12 1 1 A 21 21 GLY N N 106 103.331 104.711 -1.380 1
1 144 . 12 1 1 A 22 22 GLU H H 107 7.713 8.003 -0.290 1
1 145 . 12 1 1 A 22 22 GLU HA H 107 4.634 4.926 -0.292 1
1 150 . 12 1 1 A 22 22 GLU C C 107 174.800 175.005 -0.205 1
1 151 . 12 1 1 A 22 22 GLU CA C 107 54.329 54.368 -0.039 1
1 152 . 12 1 1 A 22 22 GLU CB C 107 32.832 34.071 -1.239 1
1 154 . 12 1 1 A 22 22 GLU N N 107 119.470 119.393 0.077 1
1 155 . 12 1 1 A 23 23 ASP H H 108 8.632 8.489 0.143 1
1 156 . 12 1 1 A 23 23 ASP HA H 108 4.872 4.728 0.144 1
1 159 . 12 1 1 A 23 23 ASP C C 108 175.533 175.692 -0.159 1
1 160 . 12 1 1 A 23 23 ASP CA C 108 55.180 54.087 1.093 1
1 161 . 12 1 1 A 23 23 ASP CB C 108 41.504 39.559 1.945 1
1 162 . 12 1 1 A 23 23 ASP N N 108 122.815 121.387 1.428 1
1 163 . 12 1 1 A 24 24 LEU H H 109 9.248 8.878 0.370 1
1 164 . 12 1 1 A 24 24 LEU HA H 109 4.836 4.573 0.263 1
1 174 . 12 1 1 A 24 24 LEU C C 109 174.322 175.575 -1.253 1
1 175 . 12 1 1 A 24 24 LEU CA C 109 54.473 55.372 -0.899 1
1 176 . 12 1 1 A 24 24 LEU CB C 109 44.718 42.770 1.948 1
1 180 . 12 1 1 A 24 24 LEU N N 109 125.550 126.609 -1.059 1
1 181 . 12 1 1 A 25 25 ARG H H 110 8.503 8.812 -0.309 1
1 182 . 12 1 1 A 25 25 ARG HA H 110 5.228 5.008 0.220 1
1 189 . 12 1 1 A 25 25 ARG C C 110 175.174 174.811 0.363 1
1 190 . 12 1 1 A 25 25 ARG CA C 110 54.745 54.789 -0.044 1
1 191 . 12 1 1 A 25 25 ARG CB C 110 31.701 32.476 -0.775 1
1 194 . 12 1 1 A 25 25 ARG N N 110 125.424 128.476 -3.052 1
1 195 . 12 1 1 A 26 26 VAL H H 111 9.692 9.388 0.304 1
1 196 . 12 1 1 A 26 26 VAL HA H 111 5.091 5.090 0.001 1
1 204 . 12 1 1 A 26 26 VAL C C 111 174.446 175.223 -0.777 1
1 205 . 12 1 1 A 26 26 VAL CA C 111 61.055 61.469 -0.414 1
1 206 . 12 1 1 A 26 26 VAL CB C 111 33.780 33.995 -0.215 1
1 209 . 12 1 1 A 26 26 VAL N N 111 130.649 127.242 3.407 1
1 210 . 12 1 1 A 27 27 VAL H H 112 9.401 8.928 0.473 1
1 211 . 12 1 1 A 27 27 VAL HA H 112 5.188 5.101 0.087 1
1 219 . 12 1 1 A 27 27 VAL C C 112 174.214 174.727 -0.513 1
1 220 . 12 1 1 A 27 27 VAL CA C 112 60.722 60.356 0.366 1
1 221 . 12 1 1 A 27 27 VAL CB C 112 36.082 35.736 0.346 1
1 224 . 12 1 1 A 27 27 VAL N N 112 127.416 126.191 1.225 1
1 225 . 12 1 1 A 28 28 LEU H H 113 9.265 9.029 0.236 1
1 226 . 12 1 1 A 28 28 LEU HA H 113 5.337 5.121 0.216 1
1 236 . 12 1 1 A 28 28 LEU C C 113 175.915 174.751 1.164 1
1 237 . 12 1 1 A 28 28 LEU CA C 113 52.599 53.826 -1.227 1
1 238 . 12 1 1 A 28 28 LEU CB C 113 47.495 45.142 2.353 1
1 242 . 12 1 1 A 28 28 LEU N N 113 127.527 127.068 0.459 1
1 243 . 12 1 1 A 29 29 GLU H H 114 8.968 8.628 0.340 1
1 244 . 12 1 1 A 29 29 GLU HA H 114 4.701 4.367 0.334 1
1 249 . 12 1 1 A 29 29 GLU C C 114 176.715 177.301 -0.586 1
1 250 . 12 1 1 A 29 29 GLU CA C 114 55.342 56.289 -0.947 1
1 251 . 12 1 1 A 29 29 GLU CB C 114 30.005 30.737 -0.732 1
1 253 . 12 1 1 A 29 29 GLU N N 114 127.374 127.363 0.011 1
1 254 . 12 1 1 A 30 30 LYS H H 115 8.243 8.615 -0.372 1
1 255 . 12 1 1 A 30 30 LYS HA H 115 3.711 4.148 -0.437 1
1 264 . 12 1 1 A 30 30 LYS C C 115 177.137 178.010 -0.873 1
1 265 . 12 1 1 A 30 30 LYS CA C 115 60.118 58.847 1.271 1
1 266 . 12 1 1 A 30 30 LYS CB C 115 32.656 32.129 0.527 1
1 270 . 12 1 1 A 30 30 LYS N N 115 124.225 125.338 -1.113 1
1 271 . 12 1 1 A 31 31 ASP H H 116 9.200 8.078 1.122 1
1 272 . 12 1 1 A 31 31 ASP HA H 116 4.444 4.405 0.039 1
1 275 . 12 1 1 A 31 31 ASP C C 116 177.774 177.486 0.288 1
1 276 . 12 1 1 A 31 31 ASP CA C 116 56.703 57.527 -0.824 1
1 277 . 12 1 1 A 31 31 ASP CB C 116 40.236 41.072 -0.836 1
1 278 . 12 1 1 A 31 31 ASP N N 116 115.955 120.757 -4.802 1
1 279 . 12 1 1 A 32 32 THR H H 117 7.352 7.555 -0.203 1
1 280 . 12 1 1 A 32 32 THR HA H 117 4.266 4.622 -0.356 1
1 285 . 12 1 1 A 32 32 THR C C 117 175.320 173.806 1.514 1
1 286 . 12 1 1 A 32 32 THR CA C 117 61.171 60.721 0.450 1
1 287 . 12 1 1 A 32 32 THR CB C 117 70.221 69.086 1.135 1
1 289 . 12 1 1 A 32 32 THR N N 117 106.440 108.234 -1.794 1
1 290 . 12 1 1 A 33 33 MET H H 118 8.216 7.966 0.250 1
1 291 . 12 1 1 A 33 33 MET HA H 118 4.184 4.352 -0.168 1
1 299 . 12 1 1 A 33 33 MET C C 118 174.952 174.851 0.101 1
1 300 . 12 1 1 A 33 33 MET CA C 118 55.195 56.907 -1.712 1
1 301 . 12 1 1 A 33 33 MET CB C 118 25.900 31.597 -5.697 1
1 304 . 12 1 1 A 33 33 MET N N 118 115.956 117.497 -1.541 1
1 305 . 12 1 1 A 34 34 ASP H H 119 7.509 8.056 -0.547 1
1 306 . 12 1 1 A 34 34 ASP HA H 119 4.486 4.737 -0.251 1
1 309 . 12 1 1 A 34 34 ASP C C 119 174.375 175.286 -0.911 1
1 310 . 12 1 1 A 34 34 ASP CA C 119 54.745 54.800 -0.055 1
1 311 . 12 1 1 A 34 34 ASP CB C 119 42.865 41.675 1.190 1
1 312 . 12 1 1 A 34 34 ASP N N 119 118.500 119.499 -0.999 1
1 313 . 12 1 1 A 35 35 VAL H H 120 8.473 8.579 -0.106 1
1 314 . 12 1 1 A 35 35 VAL HA H 120 4.709 4.750 -0.041 1
1 322 . 12 1 1 A 35 35 VAL C C 120 173.900 174.488 -0.588 1
1 323 . 12 1 1 A 35 35 VAL CA C 120 60.736 60.966 -0.230 1
1 324 . 12 1 1 A 35 35 VAL CB C 120 34.662 32.683 1.979 1
1 327 . 12 1 1 A 35 35 VAL N N 120 121.116 121.586 -0.470 1
1 328 . 12 1 1 A 36 36 TRP H H 121 9.404 9.456 -0.052 1
1 329 . 12 1 1 A 36 36 TRP HA H 121 5.174 5.111 0.063 1
1 338 . 12 1 1 A 36 36 TRP C C 121 176.480 175.191 1.289 1
1 339 . 12 1 1 A 36 36 TRP CA C 121 55.070 55.677 -0.607 1
1 340 . 12 1 1 A 36 36 TRP CB C 121 32.179 30.803 1.376 1
1 348 . 12 1 1 A 36 36 TRP N N 121 126.924 129.727 -2.803 1
1 350 . 12 1 1 A 37 37 CYS H H 122 9.230 7.951 1.279 1
1 351 . 12 1 1 A 37 37 CYS HA H 122 5.417 4.749 0.668 1
1 354 . 12 1 1 A 37 37 CYS C C 122 175.346 173.579 1.767 1
1 355 . 12 1 1 A 37 37 CYS CA C 122 57.083 57.789 -0.706 1
1 356 . 12 1 1 A 37 37 CYS CB C 122 28.713 30.383 -1.670 1
1 357 . 12 1 1 A 37 37 CYS N N 122 120.375 126.976 -6.601 1
1 358 . 12 1 1 A 38 38 ASN H H 123 9.817 9.313 0.504 1
1 359 . 12 1 1 A 38 38 ASN HA H 123 4.637 4.379 0.258 1
1 364 . 12 1 1 A 38 38 ASN C C 123 175.526 175.163 0.363 1
1 365 . 12 1 1 A 38 38 ASN CA C 123 54.023 54.218 -0.195 1
1 366 . 12 1 1 A 38 38 ASN CB C 123 36.581 37.217 -0.636 1
1 367 . 12 1 1 A 38 38 ASN N N 123 129.408 126.172 3.236 1
1 369 . 12 1 1 A 39 39 GLY H H 124 9.092 8.357 0.735 1
1 370 . 12 1 1 A 39 39 GLY HA2 H 124 4.241 3.681 0.560 1
1 371 . 12 1 1 A 39 39 GLY HA3 H 124 3.705 3.858 -0.153 1
1 372 . 12 1 1 A 39 39 GLY C C 124 173.405 172.992 0.413 1
1 373 . 12 1 1 A 39 39 GLY CA C 124 45.595 46.451 -0.856 1
1 374 . 12 1 1 A 39 39 GLY N N 124 102.752 103.547 -0.795 1
1 375 . 12 1 1 A 40 40 GLN H H 125 8.006 6.522 1.484 1
1 376 . 12 1 1 A 40 40 GLN HA H 125 4.736 4.176 0.560 1
1 383 . 12 1 1 A 40 40 GLN C C 125 174.477 174.041 0.436 1
1 384 . 12 1 1 A 40 40 GLN CA C 125 53.747 54.678 -0.931 1
1 385 . 12 1 1 A 40 40 GLN CB C 125 30.413 31.137 -0.724 1
1 387 . 12 1 1 A 40 40 GLN N N 125 120.627 117.868 2.759 1
1 389 . 12 1 1 A 41 41 LYS H H 126 8.757 8.419 0.338 1
1 390 . 12 1 1 A 41 41 LYS HA H 126 3.464 4.522 -1.058 1
1 399 . 12 1 1 A 41 41 LYS C C 126 176.870 176.484 0.386 1
1 400 . 12 1 1 A 41 41 LYS CA C 126 57.136 56.836 0.300 1
1 401 . 12 1 1 A 41 41 LYS CB C 126 31.669 33.140 -1.471 1
1 405 . 12 1 1 A 41 41 LYS N N 126 129.107 127.251 1.856 1
1 406 . 12 1 1 A 42 42 MET H H 127 8.682 8.699 -0.017 1
1 407 . 12 1 1 A 42 42 MET HA H 127 4.712 4.358 0.354 1
1 415 . 12 1 1 A 42 42 MET C C 127 176.816 175.632 1.184 1
1 416 . 12 1 1 A 42 42 MET CA C 127 52.958 56.041 -3.083 1
1 417 . 12 1 1 A 42 42 MET CB C 127 33.023 33.261 -0.238 1
1 420 . 12 1 1 A 42 42 MET N N 127 126.569 126.279 0.290 1
1 421 . 12 1 1 A 43 43 GLU H H 128 8.734 8.573 0.161 1
1 422 . 12 1 1 A 43 43 GLU HA H 128 4.419 4.930 -0.511 1
1 427 . 12 1 1 A 43 43 GLU C C 128 176.531 176.095 0.436 1
1 428 . 12 1 1 A 43 43 GLU CA C 128 56.475 55.143 1.332 1
1 429 . 12 1 1 A 43 43 GLU CB C 128 29.604 31.862 -2.258 1
1 431 . 12 1 1 A 43 43 GLU N N 128 123.734 122.227 1.507 1
1 432 . 12 1 1 A 44 44 THR H H 129 8.263 8.873 -0.610 1
1 433 . 12 1 1 A 44 44 THR HA H 129 5.385 5.340 0.045 1
1 438 . 12 1 1 A 44 44 THR C C 129 174.205 174.428 -0.223 1
1 439 . 12 1 1 A 44 44 THR CA C 129 59.160 60.401 -1.241 1
1 440 . 12 1 1 A 44 44 THR CB C 129 72.419 71.097 1.322 1
1 442 . 12 1 1 A 44 44 THR N N 129 115.081 117.806 -2.725 1
1 443 . 12 1 1 A 45 45 ALA H H 130 8.727 8.248 0.479 1
1 444 . 12 1 1 A 45 45 ALA HA H 130 4.749 4.484 0.265 1
1 448 . 12 1 1 A 45 45 ALA C C 130 177.017 178.421 -1.404 1
1 449 . 12 1 1 A 45 45 ALA CA C 130 51.645 52.607 -0.962 1
1 450 . 12 1 1 A 45 45 ALA CB C 130 21.364 20.723 0.641 1
1 451 . 12 1 1 A 45 45 ALA N N 130 123.243 123.145 0.098 1
1 452 . 12 1 1 A 46 46 GLY H H 131 8.818 8.204 0.614 1
1 453 . 12 1 1 A 46 46 GLY HA2 H 131 4.941 3.917 1.024 1
1 454 . 12 1 1 A 46 46 GLY HA3 H 131 3.690 3.959 -0.269 1
1 455 . 12 1 1 A 46 46 GLY C C 131 173.528 174.652 -1.124 1
1 456 . 12 1 1 A 46 46 GLY CA C 131 45.060 46.542 -1.482 1
1 457 . 12 1 1 A 46 46 GLY N N 131 112.392 107.707 4.685 1
1 458 . 12 1 1 A 47 47 GLU H H 132 8.746 7.732 1.014 1
1 459 . 12 1 1 A 47 47 GLU HA H 132 4.584 4.374 0.210 1
1 464 . 12 1 1 A 47 47 GLU C C 132 175.223 176.235 -1.012 1
1 465 . 12 1 1 A 47 47 GLU CA C 132 55.008 56.419 -1.411 1
1 466 . 12 1 1 A 47 47 GLU CB C 132 32.939 30.347 2.592 1
1 468 . 12 1 1 A 47 47 GLU N N 132 122.107 119.593 2.514 1
1 469 . 12 1 1 A 48 48 PHE H H 133 8.920 9.091 -0.171 1
1 470 . 12 1 1 A 48 48 PHE HA H 133 4.822 5.099 -0.277 1
1 475 . 12 1 1 A 48 48 PHE C C 133 175.499 175.698 -0.199 1
1 476 . 12 1 1 A 48 48 PHE CA C 133 58.320 57.468 0.852 1
1 477 . 12 1 1 A 48 48 PHE CB C 133 39.175 40.473 -1.298 1
1 479 . 12 1 1 A 48 48 PHE N N 133 124.006 124.007 -0.001 1
1 480 . 12 1 1 A 49 49 VAL H H 134 8.161 8.629 -0.468 1
1 481 . 12 1 1 A 49 49 VAL HA H 134 4.492 4.849 -0.357 1
1 489 . 12 1 1 A 49 49 VAL C C 134 176.241 176.971 -0.730 1
1 490 . 12 1 1 A 49 49 VAL CA C 134 60.328 59.786 0.542 1
1 491 . 12 1 1 A 49 49 VAL CB C 134 34.542 34.983 -0.441 1
1 494 . 12 1 1 A 49 49 VAL N N 134 120.063 120.852 -0.789 1
1 495 . 12 1 1 A 50 50 ASP H H 135 8.596 8.641 -0.045 1
1 496 . 12 1 1 A 50 50 ASP HA H 135 4.278 4.407 -0.129 1
1 499 . 12 1 1 A 50 50 ASP C C 135 176.567 176.067 0.500 1
1 500 . 12 1 1 A 50 50 ASP CA C 135 57.149 57.068 0.081 1
1 501 . 12 1 1 A 50 50 ASP CB C 135 40.477 40.760 -0.283 1
1 502 . 12 1 1 A 50 50 ASP N N 135 122.137 122.324 -0.187 1
1 503 . 12 1 1 A 51 51 ASP H H 136 8.328 7.909 0.419 1
1 504 . 12 1 1 A 51 51 ASP HA H 136 4.656 5.210 -0.554 1
1 507 . 12 1 1 A 51 51 ASP C C 136 175.798 174.746 1.052 1
1 508 . 12 1 1 A 51 51 ASP CA C 136 53.458 53.565 -0.107 1
1 509 . 12 1 1 A 51 51 ASP CB C 136 40.306 42.641 -2.335 1
1 510 . 12 1 1 A 51 51 ASP N N 136 116.158 115.597 0.561 1
1 511 . 12 1 1 A 52 52 GLY H H 137 7.653 8.447 -0.794 1
1 512 . 12 1 1 A 52 52 GLY HA2 H 137 4.685 4.066 0.619 1
1 513 . 12 1 1 A 52 52 GLY HA3 H 137 4.069 4.067 0.002 1
1 514 . 12 1 1 A 52 52 GLY C C 137 173.149 172.574 0.575 1
1 515 . 12 1 1 A 52 52 GLY CA C 137 45.860 44.152 1.708 1
1 516 . 12 1 1 A 52 52 GLY N N 137 107.634 108.975 -1.341 1
1 517 . 12 1 1 A 53 53 THR H H 138 8.445 8.121 0.324 1
1 518 . 12 1 1 A 53 53 THR HA H 138 4.996 4.759 0.237 1
1 523 . 12 1 1 A 53 53 THR C C 138 174.163 173.078 1.085 1
1 524 . 12 1 1 A 53 53 THR CA C 138 60.974 61.393 -0.419 1
1 525 . 12 1 1 A 53 53 THR CB C 138 72.266 71.684 0.582 1
1 527 . 12 1 1 A 53 53 THR N N 138 114.976 114.720 0.256 1
1 528 . 12 1 1 A 54 54 GLU H H 139 8.917 8.799 0.118 1
1 529 . 12 1 1 A 54 54 GLU HA H 139 5.205 4.648 0.557 1
1 534 . 12 1 1 A 54 54 GLU C C 139 175.700 175.080 0.620 1
1 535 . 12 1 1 A 54 54 GLU CA C 139 54.731 55.300 -0.569 1
1 536 . 12 1 1 A 54 54 GLU CB C 139 33.250 29.933 3.317 1
1 538 . 12 1 1 A 54 54 GLU N N 139 121.295 125.954 -4.659 1
1 539 . 12 1 1 A 55 55 THR H H 140 9.190 8.410 0.780 1
1 540 . 12 1 1 A 55 55 THR HA H 140 4.744 4.600 0.144 1
1 545 . 12 1 1 A 55 55 THR C C 140 174.537 173.434 1.103 1
1 546 . 12 1 1 A 55 55 THR CA C 140 62.678 61.243 1.435 1
1 547 . 12 1 1 A 55 55 THR CB C 140 69.744 68.992 0.752 1
1 549 . 12 1 1 A 55 55 THR N N 140 122.419 120.297 2.122 1
1 550 . 12 1 1 A 56 56 HIS H H 141 9.395 9.066 0.329 1
1 551 . 12 1 1 A 56 56 HIS HA H 141 5.204 4.973 0.231 1
1 556 . 12 1 1 A 56 56 HIS C C 141 174.675 174.780 -0.105 1
1 557 . 12 1 1 A 56 56 HIS CA C 141 55.557 54.202 1.355 1
1 558 . 12 1 1 A 56 56 HIS CB C 141 31.279 30.047 1.232 1
1 561 . 12 1 1 A 56 56 HIS N N 141 125.732 125.126 0.606 1
1 564 . 12 1 1 A 57 57 PHE H H 142 8.790 8.389 0.401 1
1 565 . 12 1 1 A 57 57 PHE HA H 142 4.918 6.072 -1.154 1
1 571 . 12 1 1 A 57 57 PHE C C 142 172.293 173.821 -1.528 1
1 572 . 12 1 1 A 57 57 PHE CA C 142 56.366 55.161 1.205 1
1 573 . 12 1 1 A 57 57 PHE CB C 142 39.962 42.687 -2.725 1
1 575 . 12 1 1 A 57 57 PHE N N 142 117.009 121.323 -4.314 1
1 576 . 12 1 1 A 58 58 SER H H 143 8.890 9.225 -0.335 1
1 577 . 12 1 1 A 58 58 SER HA H 143 5.286 5.530 -0.244 1
1 580 . 12 1 1 A 58 58 SER C C 143 173.716 174.313 -0.597 1
1 581 . 12 1 1 A 58 58 SER CA C 143 57.517 55.745 1.772 1
1 582 . 12 1 1 A 58 58 SER CB C 143 65.448 66.099 -0.651 1
1 583 . 12 1 1 A 58 58 SER N N 143 115.269 115.878 -0.609 1
1 584 . 12 1 1 A 59 59 VAL H H 144 7.737 8.351 -0.614 1
1 585 . 12 1 1 A 59 59 VAL HA H 144 4.220 4.427 -0.207 1
1 593 . 12 1 1 A 59 59 VAL C C 144 176.234 176.043 0.191 1
1 594 . 12 1 1 A 59 59 VAL CA C 144 61.741 60.836 0.905 1
1 595 . 12 1 1 A 59 59 VAL CB C 144 33.711 33.702 0.009 1
1 598 . 12 1 1 A 59 59 VAL N N 144 123.186 121.328 1.858 1
1 599 . 12 1 1 A 60 60 GLY H H 145 8.945 8.994 -0.049 1
1 600 . 12 1 1 A 60 60 GLY HA2 H 145 4.027 3.689 0.338 1
1 601 . 12 1 1 A 60 60 GLY HA3 H 145 3.692 3.763 -0.071 1
1 602 . 12 1 1 A 60 60 GLY C C 145 175.182 174.557 0.625 1
1 603 . 12 1 1 A 60 60 GLY CA C 145 47.141 47.252 -0.111 1
1 604 . 12 1 1 A 60 60 GLY N N 145 116.908 117.674 -0.766 1
1 605 . 12 1 1 A 61 61 ASN H H 146 8.929 8.392 0.537 1
1 606 . 12 1 1 A 61 61 ASN HA H 146 4.718 4.797 -0.079 1
1 611 . 12 1 1 A 61 61 ASN C C 146 174.706 173.840 0.866 1
1 612 . 12 1 1 A 61 61 ASN CA C 146 52.802 52.563 0.239 1
1 613 . 12 1 1 A 61 61 ASN CB C 146 37.917 39.039 -1.122 1
1 614 . 12 1 1 A 61 61 ASN N N 146 123.976 124.769 -0.793 1
1 616 . 12 1 1 A 62 62 HIS H H 147 8.400 7.702 0.698 1
1 617 . 12 1 1 A 62 62 HIS HA H 147 4.762 4.994 -0.232 1
1 622 . 12 1 1 A 62 62 HIS C C 147 173.871 173.560 0.311 1
1 623 . 12 1 1 A 62 62 HIS CA C 147 55.374 54.755 0.619 1
1 624 . 12 1 1 A 62 62 HIS CB C 147 28.655 33.701 -5.046 1
1 628 . 12 1 1 A 62 62 HIS N N 147 118.620 118.264 0.356 1
1 631 . 12 1 1 A 63 63 ASP H H 148 8.734 8.844 -0.110 1
1 632 . 12 1 1 A 63 63 ASP HA H 148 4.785 5.482 -0.697 1
1 635 . 12 1 1 A 63 63 ASP C C 148 175.269 175.169 0.100 1
1 636 . 12 1 1 A 63 63 ASP CA C 148 54.390 53.075 1.315 1
1 637 . 12 1 1 A 63 63 ASP CB C 148 42.105 44.102 -1.997 1
1 638 . 12 1 1 A 63 63 ASP N N 148 125.336 120.167 5.169 1
1 639 . 12 1 1 A 64 64 CYS H H 149 8.225 9.138 -0.913 1
1 640 . 12 1 1 A 64 64 CYS HA H 149 5.118 5.283 -0.165 1
1 643 . 12 1 1 A 64 64 CYS C C 149 173.740 172.575 1.165 1
1 644 . 12 1 1 A 64 64 CYS CA C 149 55.423 56.250 -0.827 1
1 645 . 12 1 1 A 64 64 CYS CB C 149 29.972 32.458 -2.486 1
1 646 . 12 1 1 A 64 64 CYS N N 149 124.476 122.103 2.373 1
1 647 . 12 1 1 A 65 65 TYR H H 150 8.916 8.272 0.644 1
1 648 . 12 1 1 A 65 65 TYR HA H 150 5.121 3.645 1.476 1
1 655 . 12 1 1 A 65 65 TYR C C 150 172.821 171.846 0.975 1
1 656 . 12 1 1 A 65 65 TYR CA C 150 56.347 55.938 0.409 1
1 657 . 12 1 1 A 65 65 TYR CB C 150 38.901 39.631 -0.730 1
1 662 . 12 1 1 A 65 65 TYR N N 150 115.313 116.663 -1.350 1
1 663 . 12 1 1 A 66 66 ILE H H 151 8.423 8.707 -0.284 1
1 664 . 12 1 1 A 66 66 ILE HA H 151 5.000 4.421 0.579 1
1 674 . 12 1 1 A 66 66 ILE C C 151 176.225 174.536 1.689 1
1 675 . 12 1 1 A 66 66 ILE CA C 151 57.798 60.097 -2.299 1
1 676 . 12 1 1 A 66 66 ILE CB C 151 39.863 38.856 1.007 1
1 680 . 12 1 1 A 66 66 ILE N N 151 118.575 121.031 -2.456 1
1 681 . 12 1 1 A 67 67 LYS H H 152 9.480 9.020 0.460 1
1 682 . 12 1 1 A 67 67 LYS HA H 152 5.091 4.690 0.401 1
1 691 . 12 1 1 A 67 67 LYS C C 152 174.079 175.083 -1.004 1
1 692 . 12 1 1 A 67 67 LYS CA C 152 54.728 56.031 -1.303 1
1 693 . 12 1 1 A 67 67 LYS CB C 152 35.256 33.057 2.199 1
1 697 . 12 1 1 A 67 67 LYS N N 152 132.311 128.589 3.722 1
1 698 . 12 1 1 A 68 68 ALA H H 153 8.844 8.555 0.289 1
1 699 . 12 1 1 A 68 68 ALA HA H 153 5.039 5.427 -0.388 1
1 703 . 12 1 1 A 68 68 ALA C C 153 176.587 176.371 0.216 1
1 704 . 12 1 1 A 68 68 ALA CA C 153 50.484 50.859 -0.375 1
1 705 . 12 1 1 A 68 68 ALA CB C 153 20.570 21.276 -0.706 1
1 706 . 12 1 1 A 68 68 ALA N N 153 129.958 130.261 -0.303 1
1 707 . 12 1 1 A 69 69 VAL H H 154 8.461 8.683 -0.222 1
1 708 . 12 1 1 A 69 69 VAL HA H 154 4.558 4.516 0.042 1
1 716 . 12 1 1 A 69 69 VAL C C 154 175.331 175.133 0.198 1
1 717 . 12 1 1 A 69 69 VAL CA C 154 60.758 61.027 -0.269 1
1 718 . 12 1 1 A 69 69 VAL CB C 154 34.743 35.175 -0.432 1
1 721 . 12 1 1 A 69 69 VAL N N 154 121.496 122.000 -0.504 1
1 722 . 12 1 1 A 70 70 SER H H 155 8.695 8.998 -0.303 1
1 723 . 12 1 1 A 70 70 SER HA H 155 4.646 5.029 -0.383 1
1 726 . 12 1 1 A 70 70 SER C C 155 174.690 173.738 0.952 1
1 727 . 12 1 1 A 70 70 SER CA C 155 58.065 57.570 0.495 1
1 728 . 12 1 1 A 70 70 SER CB C 155 64.062 64.455 -0.393 1
1 729 . 12 1 1 A 70 70 SER N N 155 119.763 122.835 -3.072 1
1 730 . 12 1 1 A 71 71 SER H H 156 8.360 8.775 -0.415 1
1 731 . 12 1 1 A 71 71 SER HA H 156 4.430 5.417 -0.987 1
1 734 . 12 1 1 A 71 71 SER CA C 156 58.491 56.623 1.868 1
1 735 . 12 1 1 A 71 71 SER CB C 156 64.061 67.022 -2.961 1
1 736 . 12 1 1 A 71 71 SER N N 156 118.577 118.150 0.427 1
1 737 . 12 1 1 A 72 72 GLY H H 157 8.542 8.337 0.205 1
1 738 . 12 1 1 A 72 72 GLY HA2 H 157 4.002 4.076 -0.074 1
1 739 . 12 1 1 A 72 72 GLY HA3 H 157 4.002 4.078 -0.076 1
1 740 . 12 1 1 A 72 72 GLY CA C 157 45.565 44.815 0.750 1
1 741 . 12 1 1 A 72 72 GLY N N 157 111.540 112.875 -1.335 1
1 742 . 12 1 1 A 73 73 LYS H H 158 8.369 8.531 -0.162 1
1 743 . 12 1 1 A 73 73 LYS CA C 158 56.720 57.122 -0.402 1
1 744 . 12 1 1 A 73 73 LYS CB C 158 32.915 34.869 -1.954 1
1 747 . 12 1 1 A 73 73 LYS N N 158 120.293 125.567 -5.274 1
1 748 . 12 1 1 A 74 74 ARG H H 159 8.181 7.927 0.254 1
1 749 . 12 1 1 A 74 74 ARG CA C 159 56.148 54.791 1.357 1
1 751 . 12 1 1 A 74 74 ARG N N 159 119.343 119.063 0.280 1
1 752 . 12 1 1 A 75 75 LYS H H 160 8.443 9.000 -0.557 1
1 753 . 12 1 1 A 75 75 LYS HA H 160 4.067 4.101 -0.034 1
1 762 . 12 1 1 A 75 75 LYS C C 160 176.868 176.694 0.174 1
1 763 . 12 1 1 A 75 75 LYS CA C 160 57.711 57.524 0.187 1
1 764 . 12 1 1 A 75 75 LYS CB C 160 31.777 31.911 -0.134 1
1 768 . 12 1 1 A 75 75 LYS N N 160 120.467 123.378 -2.911 1
1 769 . 12 1 1 A 76 76 GLU H H 161 8.693 8.133 0.560 1
1 770 . 12 1 1 A 76 76 GLU HA H 161 4.290 4.199 0.091 1
1 771 . 12 1 1 A 76 76 GLU C C 161 176.844 177.280 -0.436 1
1 772 . 12 1 1 A 76 76 GLU CA C 161 57.294 59.577 -2.283 1
1 773 . 12 1 1 A 76 76 GLU CB C 161 29.794 30.276 -0.482 1
1 775 . 12 1 1 A 76 76 GLU N N 161 118.767 119.166 -0.399 1
1 776 . 12 1 1 A 77 77 GLY H H 162 8.168 7.738 0.430 1
1 777 . 12 1 1 A 77 77 GLY HA2 H 162 4.010 4.264 -0.254 1
1 778 . 12 1 1 A 77 77 GLY HA3 H 162 3.963 4.268 -0.305 1
1 779 . 12 1 1 A 77 77 GLY C C 162 173.512 171.815 1.697 1
1 780 . 12 1 1 A 77 77 GLY CA C 162 45.362 44.671 0.691 1
1 781 . 12 1 1 A 77 77 GLY N N 162 108.621 105.266 3.355 1
1 782 . 12 1 1 A 78 78 ILE H H 163 7.954 8.969 -1.015 1
1 783 . 12 1 1 A 78 78 ILE HA H 163 4.323 4.793 -0.470 1
1 793 . 12 1 1 A 78 78 ILE C C 163 175.402 175.491 -0.089 1
1 794 . 12 1 1 A 78 78 ILE CA C 163 60.632 59.582 1.050 1
1 795 . 12 1 1 A 78 78 ILE CB C 163 39.759 40.286 -0.527 1
1 799 . 12 1 1 A 78 78 ILE N N 163 121.604 126.033 -4.429 1
1 800 . 12 1 1 A 79 79 ILE H H 164 8.514 8.771 -0.257 1
1 801 . 12 1 1 A 79 79 ILE HA H 164 4.341 4.804 -0.463 1
1 811 . 12 1 1 A 79 79 ILE C C 164 175.172 174.608 0.564 1
1 812 . 12 1 1 A 79 79 ILE CA C 164 60.027 59.806 0.221 1
1 813 . 12 1 1 A 79 79 ILE CB C 164 40.153 40.970 -0.817 1
1 817 . 12 1 1 A 79 79 ILE N N 164 127.137 125.733 1.404 1
1 818 . 12 1 1 A 80 80 HIS H H 165 8.492 9.006 -0.514 1
1 819 . 12 1 1 A 80 80 HIS HA H 165 5.676 5.377 0.299 1
1 824 . 12 1 1 A 80 80 HIS C C 165 175.502 174.156 1.346 1
1 825 . 12 1 1 A 80 80 HIS CA C 165 57.043 54.813 2.230 1
1 826 . 12 1 1 A 80 80 HIS CB C 165 32.741 32.406 0.335 1
1 829 . 12 1 1 A 80 80 HIS N N 165 125.422 126.390 -0.968 1
1 830 . 12 1 1 A 81 81 THR H H 166 9.080 9.410 -0.330 1
1 831 . 12 1 1 A 81 81 THR HA H 166 4.999 5.079 -0.080 1
1 836 . 12 1 1 A 81 81 THR C C 166 171.877 173.005 -1.128 1
1 837 . 12 1 1 A 81 81 THR CA C 166 59.924 61.041 -1.117 1
1 838 . 12 1 1 A 81 81 THR CB C 166 72.243 70.546 1.697 1
1 840 . 12 1 1 A 81 81 THR N N 166 117.682 115.294 2.388 1
1 841 . 12 1 1 A 82 82 LEU H H 167 8.062 8.108 -0.046 1
1 842 . 12 1 1 A 82 82 LEU HA H 167 4.350 3.923 0.427 1
1 852 . 12 1 1 A 82 82 LEU C C 167 172.705 175.028 -2.323 1
1 853 . 12 1 1 A 82 82 LEU CA C 167 53.553 55.507 -1.954 1
1 854 . 12 1 1 A 82 82 LEU CB C 167 39.768 41.284 -1.516 1
1 858 . 12 1 1 A 82 82 LEU N N 167 125.369 127.926 -2.557 1
1 859 . 12 1 1 A 83 83 ILE H H 168 8.657 8.365 0.292 1
1 860 . 12 1 1 A 83 83 ILE HA H 168 4.476 4.827 -0.351 1
1 870 . 12 1 1 A 83 83 ILE C C 168 175.159 174.229 0.930 1
1 871 . 12 1 1 A 83 83 ILE CA C 168 58.529 60.174 -1.645 1
1 872 . 12 1 1 A 83 83 ILE CB C 168 37.410 40.002 -2.592 1
1 876 . 12 1 1 A 83 83 ILE N N 168 128.042 127.396 0.646 1
1 877 . 12 1 1 A 84 84 VAL H H 169 8.464 8.289 0.175 1
1 878 . 12 1 1 A 84 84 VAL HA H 169 4.284 4.384 -0.100 1
1 886 . 12 1 1 A 84 84 VAL C C 169 176.138 175.921 0.217 1
1 887 . 12 1 1 A 84 84 VAL CA C 169 61.029 61.217 -0.188 1
1 888 . 12 1 1 A 84 84 VAL CB C 169 34.714 33.809 0.905 1
1 891 . 12 1 1 A 84 84 VAL N N 169 124.644 127.056 -2.412 1
1 892 . 12 1 1 A 85 85 ASP H H 170 9.158 9.811 -0.653 1
1 893 . 12 1 1 A 85 85 ASP HA H 170 4.362 4.270 0.092 1
1 896 . 12 1 1 A 85 85 ASP C C 170 175.489 175.310 0.179 1
1 897 . 12 1 1 A 85 85 ASP CA C 170 55.868 55.172 0.696 1
1 898 . 12 1 1 A 85 85 ASP CB C 170 38.927 39.453 -0.526 1
1 899 . 12 1 1 A 85 85 ASP N N 170 129.061 127.480 1.581 1
1 900 . 12 1 1 A 86 86 ASN H H 171 8.811 8.392 0.419 1
1 901 . 12 1 1 A 86 86 ASN HA H 171 4.053 4.327 -0.274 1
1 906 . 12 1 1 A 86 86 ASN C C 171 173.802 173.953 -0.151 1
1 907 . 12 1 1 A 86 86 ASN CA C 171 55.173 54.303 0.870 1
1 908 . 12 1 1 A 86 86 ASN CB C 171 38.150 37.446 0.704 1
1 909 . 12 1 1 A 86 86 ASN N N 171 108.418 114.879 -6.461 1
1 911 . 12 1 1 A 87 87 ARG H H 172 7.914 7.514 0.400 1
1 912 . 12 1 1 A 87 87 ARG HA H 172 4.597 4.656 -0.059 1
1 919 . 12 1 1 A 87 87 ARG C C 172 174.025 174.769 -0.744 1
1 920 . 12 1 1 A 87 87 ARG CA C 172 54.846 54.306 0.540 1
1 921 . 12 1 1 A 87 87 ARG CB C 172 32.697 33.040 -0.343 1
1 924 . 12 1 1 A 87 87 ARG N N 172 120.988 117.320 3.668 1
1 925 . 12 1 1 A 88 88 GLU H H 173 8.534 8.753 -0.219 1
1 926 . 12 1 1 A 88 88 GLU HA H 173 4.560 4.356 0.204 1
1 931 . 12 1 1 A 88 88 GLU C C 173 176.187 175.440 0.747 1
1 932 . 12 1 1 A 88 88 GLU CA C 173 56.044 57.082 -1.038 1
1 933 . 12 1 1 A 88 88 GLU CB C 173 30.329 30.561 -0.232 1
1 935 . 12 1 1 A 88 88 GLU N N 173 123.982 125.160 -1.178 1
1 936 . 12 1 1 A 89 89 ILE H H 174 8.897 8.069 0.828 1
1 937 . 12 1 1 A 89 89 ILE HA H 174 4.666 4.554 0.112 1
1 947 . 12 1 1 A 89 89 ILE C C 174 174.110 174.203 -0.093 1
1 948 . 12 1 1 A 89 89 ILE CA C 174 55.255 57.329 -2.074 1
1 949 . 12 1 1 A 89 89 ILE CB C 174 37.851 41.336 -3.485 1
1 953 . 12 1 1 A 89 89 ILE N N 174 130.008 127.460 2.548 1
1 954 . 12 1 1 A 90 90 PRO HA H 175 4.713 4.718 -0.005 1
1 961 . 12 1 1 A 90 90 PRO C C 175 176.956 176.299 0.657 1
1 962 . 12 1 1 A 90 90 PRO CA C 175 63.159 62.984 0.175 1
1 963 . 12 1 1 A 90 90 PRO CB C 175 32.428 32.516 -0.088 1
1 966 . 12 1 1 A 91 91 GLU H H 176 8.778 8.707 0.071 1
1 967 . 12 1 1 A 91 91 GLU HA H 176 3.910 4.733 -0.823 1
1 972 . 12 1 1 A 91 91 GLU C C 176 176.426 176.313 0.113 1
1 973 . 12 1 1 A 91 91 GLU CA C 176 56.738 55.952 0.786 1
1 974 . 12 1 1 A 91 91 GLU CB C 176 30.540 31.031 -0.491 1
1 976 . 12 1 1 A 91 91 GLU N N 176 124.561 122.063 2.498 1
1 977 . 12 1 1 A 92 92 LEU H H 177 8.630 8.373 0.257 1
1 978 . 12 1 1 A 92 92 LEU HA H 177 4.419 4.519 -0.100 1
1 988 . 12 1 1 A 92 92 LEU C C 177 177.162 175.831 1.331 1
1 989 . 12 1 1 A 92 92 LEU CA C 177 55.350 55.529 -0.179 1
1 990 . 12 1 1 A 92 92 LEU CB C 177 42.390 42.569 -0.179 1
1 994 . 12 1 1 A 92 92 LEU N N 177 126.683 128.770 -2.087 1
1 995 . 12 1 1 A 93 93 THR H H 178 8.375 8.571 -0.196 1
1 996 . 12 1 1 A 93 93 THR HA H 178 4.359 4.917 -0.558 1
1 1001 . 12 1 1 A 93 93 THR C C 178 173.589 174.203 -0.614 1
1 1002 . 12 1 1 A 93 93 THR CA C 178 61.621 59.370 2.251 1
1 1003 . 12 1 1 A 93 93 THR CB C 178 69.724 72.183 -2.459 1
1 1005 . 12 1 1 A 93 93 THR N N 178 119.699 113.943 5.756 1
1 1 . 13 1 1 A 9 9 SER H H 94 8.475 9.003 -0.528 1
1 2 . 13 1 1 A 9 9 SER CA C 94 58.531 59.031 -0.500 1
1 3 . 13 1 1 A 9 9 SER N N 94 117.432 118.243 -0.811 1
1 4 . 13 1 1 A 10 10 LYS H H 95 8.527 7.708 0.819 1
1 5 . 13 1 1 A 10 10 LYS C C 95 174.594 175.760 -1.166 1
1 6 . 13 1 1 A 10 10 LYS CA C 95 56.603 55.973 0.630 1
1 7 . 13 1 1 A 10 10 LYS N N 95 123.104 121.076 2.028 1
1 8 . 13 1 1 A 11 11 THR H H 96 8.245 8.740 -0.495 1
1 9 . 13 1 1 A 11 11 THR C C 96 174.393 173.466 0.927 1
1 10 . 13 1 1 A 11 11 THR CA C 96 62.149 60.805 1.344 1
1 11 . 13 1 1 A 11 11 THR CB C 96 69.183 68.955 0.228 1
1 13 . 13 1 1 A 11 11 THR N N 96 113.245 117.169 -3.924 1
1 14 . 13 1 1 A 12 12 THR H H 97 7.769 7.549 0.220 1
1 15 . 13 1 1 A 12 12 THR HA H 97 5.583 4.934 0.649 1
1 20 . 13 1 1 A 12 12 THR C C 97 174.726 172.214 2.512 1
1 21 . 13 1 1 A 12 12 THR CA C 97 59.602 60.852 -1.250 1
1 22 . 13 1 1 A 12 12 THR CB C 97 72.805 71.362 1.443 1
1 24 . 13 1 1 A 12 12 THR N N 97 113.440 112.103 1.337 1
1 25 . 13 1 1 A 13 13 SER H H 98 8.593 8.642 -0.049 1
1 26 . 13 1 1 A 13 13 SER HA H 98 4.448 5.085 -0.637 1
1 29 . 13 1 1 A 13 13 SER C C 98 171.426 172.473 -1.047 1
1 30 . 13 1 1 A 13 13 SER CA C 98 59.056 57.010 2.046 1
1 31 . 13 1 1 A 13 13 SER CB C 98 67.839 65.120 2.719 1
1 32 . 13 1 1 A 13 13 SER N N 98 119.042 121.387 -2.345 1
1 33 . 13 1 1 A 14 14 THR H H 99 8.155 8.024 0.131 1
1 34 . 13 1 1 A 14 14 THR HA H 99 5.383 4.845 0.538 1
1 39 . 13 1 1 A 14 14 THR C C 99 171.565 173.078 -1.513 1
1 40 . 13 1 1 A 14 14 THR CA C 99 61.291 60.465 0.826 1
1 41 . 13 1 1 A 14 14 THR CB C 99 71.654 71.792 -0.138 1
1 43 . 13 1 1 A 14 14 THR N N 99 118.204 116.063 2.141 1
1 44 . 13 1 1 A 15 15 TRP H H 100 9.637 8.783 0.854 1
1 45 . 13 1 1 A 15 15 TRP HA H 100 4.807 5.177 -0.370 1
1 54 . 13 1 1 A 15 15 TRP C C 100 174.399 175.471 -1.072 1
1 55 . 13 1 1 A 15 15 TRP CA C 100 58.302 56.134 2.168 1
1 56 . 13 1 1 A 15 15 TRP CB C 100 34.810 33.044 1.766 1
1 63 . 13 1 1 A 15 15 TRP N N 100 125.132 123.049 2.083 1
1 65 . 13 1 1 A 16 16 VAL H H 101 8.863 9.026 -0.163 1
1 66 . 13 1 1 A 16 16 VAL HA H 101 5.267 4.797 0.470 1
1 74 . 13 1 1 A 16 16 VAL C C 101 174.955 175.235 -0.280 1
1 75 . 13 1 1 A 16 16 VAL CA C 101 60.653 61.585 -0.932 1
1 76 . 13 1 1 A 16 16 VAL CB C 101 34.284 32.817 1.467 1
1 79 . 13 1 1 A 16 16 VAL N N 101 119.527 123.727 -4.200 1
1 80 . 13 1 1 A 17 17 LEU H H 102 8.961 8.971 -0.010 1
1 81 . 13 1 1 A 17 17 LEU HA H 102 4.729 5.099 -0.370 1
1 91 . 13 1 1 A 17 17 LEU C C 102 173.559 175.136 -1.577 1
1 92 . 13 1 1 A 17 17 LEU CA C 102 55.144 53.090 2.054 1
1 93 . 13 1 1 A 17 17 LEU CB C 102 42.948 45.974 -3.026 1
1 97 . 13 1 1 A 17 17 LEU N N 102 124.280 123.617 0.663 1
1 98 . 13 1 1 A 18 18 ARG H H 103 8.305 8.500 -0.195 1
1 99 . 13 1 1 A 18 18 ARG HA H 103 5.139 4.609 0.530 1
1 106 . 13 1 1 A 18 18 ARG C C 103 175.347 175.372 -0.025 1
1 107 . 13 1 1 A 18 18 ARG CA C 103 54.793 55.944 -1.151 1
1 108 . 13 1 1 A 18 18 ARG CB C 103 31.347 29.733 1.614 1
1 111 . 13 1 1 A 18 18 ARG N N 103 122.020 122.770 -0.750 1
1 112 . 13 1 1 A 19 19 LEU H H 104 8.676 8.792 -0.116 1
1 113 . 13 1 1 A 19 19 LEU HA H 104 4.482 4.816 -0.334 1
1 123 . 13 1 1 A 19 19 LEU C C 104 175.957 175.770 0.187 1
1 124 . 13 1 1 A 19 19 LEU CA C 104 53.581 53.753 -0.172 1
1 125 . 13 1 1 A 19 19 LEU CB C 104 45.697 45.231 0.466 1
1 129 . 13 1 1 A 19 19 LEU N N 104 126.378 127.337 -0.959 1
1 130 . 13 1 1 A 20 20 ASP H H 105 9.390 9.520 -0.130 1
1 131 . 13 1 1 A 20 20 ASP HA H 105 4.287 4.416 -0.129 1
1 134 . 13 1 1 A 20 20 ASP C C 105 175.947 176.040 -0.093 1
1 135 . 13 1 1 A 20 20 ASP CA C 105 55.263 55.331 -0.068 1
1 136 . 13 1 1 A 20 20 ASP CB C 105 39.239 39.444 -0.205 1
1 137 . 13 1 1 A 20 20 ASP N N 105 125.208 125.742 -0.534 1
1 138 . 13 1 1 A 21 21 GLY H H 106 8.563 8.641 -0.078 1
1 139 . 13 1 1 A 21 21 GLY HA2 H 106 4.126 3.839 0.287 1
1 140 . 13 1 1 A 21 21 GLY HA3 H 106 3.509 3.846 -0.337 1
1 141 . 13 1 1 A 21 21 GLY C C 106 173.164 173.131 0.033 1
1 142 . 13 1 1 A 21 21 GLY CA C 106 45.499 45.458 0.041 1
1 143 . 13 1 1 A 21 21 GLY N N 106 103.331 103.929 -0.598 1
1 144 . 13 1 1 A 22 22 GLU H H 107 7.713 7.699 0.014 1
1 145 . 13 1 1 A 22 22 GLU HA H 107 4.634 4.816 -0.182 1
1 150 . 13 1 1 A 22 22 GLU C C 107 174.800 174.601 0.199 1
1 151 . 13 1 1 A 22 22 GLU CA C 107 54.329 54.828 -0.499 1
1 152 . 13 1 1 A 22 22 GLU CB C 107 32.832 33.112 -0.280 1
1 154 . 13 1 1 A 22 22 GLU N N 107 119.470 119.736 -0.266 1
1 155 . 13 1 1 A 23 23 ASP H H 108 8.632 8.562 0.070 1
1 156 . 13 1 1 A 23 23 ASP HA H 108 4.872 4.748 0.124 1
1 159 . 13 1 1 A 23 23 ASP C C 108 175.533 175.485 0.048 1
1 160 . 13 1 1 A 23 23 ASP CA C 108 55.180 53.947 1.233 1
1 161 . 13 1 1 A 23 23 ASP CB C 108 41.504 39.592 1.912 1
1 162 . 13 1 1 A 23 23 ASP N N 108 122.815 121.774 1.041 1
1 163 . 13 1 1 A 24 24 LEU H H 109 9.248 8.906 0.342 1
1 164 . 13 1 1 A 24 24 LEU HA H 109 4.836 4.605 0.231 1
1 174 . 13 1 1 A 24 24 LEU C C 109 174.322 175.748 -1.426 1
1 175 . 13 1 1 A 24 24 LEU CA C 109 54.473 55.279 -0.806 1
1 176 . 13 1 1 A 24 24 LEU CB C 109 44.718 42.737 1.981 1
1 180 . 13 1 1 A 24 24 LEU N N 109 125.550 126.749 -1.199 1
1 181 . 13 1 1 A 25 25 ARG H H 110 8.503 8.645 -0.142 1
1 182 . 13 1 1 A 25 25 ARG HA H 110 5.228 5.057 0.171 1
1 189 . 13 1 1 A 25 25 ARG C C 110 175.174 174.986 0.188 1
1 190 . 13 1 1 A 25 25 ARG CA C 110 54.745 54.646 0.099 1
1 191 . 13 1 1 A 25 25 ARG CB C 110 31.701 32.327 -0.626 1
1 194 . 13 1 1 A 25 25 ARG N N 110 125.424 127.321 -1.897 1
1 195 . 13 1 1 A 26 26 VAL H H 111 9.692 9.560 0.132 1
1 196 . 13 1 1 A 26 26 VAL HA H 111 5.091 5.045 0.046 1
1 204 . 13 1 1 A 26 26 VAL C C 111 174.446 175.056 -0.610 1
1 205 . 13 1 1 A 26 26 VAL CA C 111 61.055 61.394 -0.339 1
1 206 . 13 1 1 A 26 26 VAL CB C 111 33.780 33.271 0.509 1
1 209 . 13 1 1 A 26 26 VAL N N 111 130.649 126.816 3.833 1
1 210 . 13 1 1 A 27 27 VAL H H 112 9.401 9.135 0.266 1
1 211 . 13 1 1 A 27 27 VAL HA H 112 5.188 4.893 0.295 1
1 219 . 13 1 1 A 27 27 VAL C C 112 174.214 173.915 0.299 1
1 220 . 13 1 1 A 27 27 VAL CA C 112 60.722 60.871 -0.149 1
1 221 . 13 1 1 A 27 27 VAL CB C 112 36.082 34.525 1.557 1
1 224 . 13 1 1 A 27 27 VAL N N 112 127.416 128.685 -1.269 1
1 225 . 13 1 1 A 28 28 LEU H H 113 9.265 9.162 0.103 1
1 226 . 13 1 1 A 28 28 LEU HA H 113 5.337 5.335 0.002 1
1 236 . 13 1 1 A 28 28 LEU C C 113 175.915 174.911 1.004 1
1 237 . 13 1 1 A 28 28 LEU CA C 113 52.599 53.273 -0.674 1
1 238 . 13 1 1 A 28 28 LEU CB C 113 47.495 44.998 2.497 1
1 242 . 13 1 1 A 28 28 LEU N N 113 127.527 129.309 -1.782 1
1 243 . 13 1 1 A 29 29 GLU H H 114 8.968 8.602 0.366 1
1 244 . 13 1 1 A 29 29 GLU HA H 114 4.701 4.393 0.308 1
1 249 . 13 1 1 A 29 29 GLU C C 114 176.715 177.496 -0.781 1
1 250 . 13 1 1 A 29 29 GLU CA C 114 55.342 56.319 -0.977 1
1 251 . 13 1 1 A 29 29 GLU CB C 114 30.005 30.831 -0.826 1
1 253 . 13 1 1 A 29 29 GLU N N 114 127.374 127.557 -0.183 1
1 254 . 13 1 1 A 30 30 LYS H H 115 8.243 8.622 -0.379 1
1 255 . 13 1 1 A 30 30 LYS HA H 115 3.711 4.155 -0.444 1
1 264 . 13 1 1 A 30 30 LYS C C 115 177.137 178.151 -1.014 1
1 265 . 13 1 1 A 30 30 LYS CA C 115 60.118 58.770 1.348 1
1 266 . 13 1 1 A 30 30 LYS CB C 115 32.656 32.124 0.532 1
1 270 . 13 1 1 A 30 30 LYS N N 115 124.225 126.610 -2.385 1
1 271 . 13 1 1 A 31 31 ASP H H 116 9.200 8.131 1.069 1
1 272 . 13 1 1 A 31 31 ASP HA H 116 4.444 4.443 0.001 1
1 275 . 13 1 1 A 31 31 ASP C C 116 177.774 177.537 0.237 1
1 276 . 13 1 1 A 31 31 ASP CA C 116 56.703 57.295 -0.592 1
1 277 . 13 1 1 A 31 31 ASP CB C 116 40.236 40.605 -0.369 1
1 278 . 13 1 1 A 31 31 ASP N N 116 115.955 119.404 -3.449 1
1 279 . 13 1 1 A 32 32 THR H H 117 7.352 7.252 0.100 1
1 280 . 13 1 1 A 32 32 THR HA H 117 4.266 4.604 -0.338 1
1 285 . 13 1 1 A 32 32 THR C C 117 175.320 173.767 1.553 1
1 286 . 13 1 1 A 32 32 THR CA C 117 61.171 60.585 0.586 1
1 287 . 13 1 1 A 32 32 THR CB C 117 70.221 69.273 0.948 1
1 289 . 13 1 1 A 32 32 THR N N 117 106.440 107.078 -0.638 1
1 290 . 13 1 1 A 33 33 MET H H 118 8.216 7.875 0.341 1
1 291 . 13 1 1 A 33 33 MET HA H 118 4.184 4.369 -0.185 1
1 299 . 13 1 1 A 33 33 MET C C 118 174.952 174.614 0.338 1
1 300 . 13 1 1 A 33 33 MET CA C 118 55.195 56.833 -1.638 1
1 301 . 13 1 1 A 33 33 MET CB C 118 25.900 30.846 -4.946 1
1 304 . 13 1 1 A 33 33 MET N N 118 115.956 116.640 -0.684 1
1 305 . 13 1 1 A 34 34 ASP H H 119 7.509 8.018 -0.509 1
1 306 . 13 1 1 A 34 34 ASP HA H 119 4.486 4.837 -0.351 1
1 309 . 13 1 1 A 34 34 ASP C C 119 174.375 175.250 -0.875 1
1 310 . 13 1 1 A 34 34 ASP CA C 119 54.745 53.866 0.879 1
1 311 . 13 1 1 A 34 34 ASP CB C 119 42.865 42.166 0.699 1
1 312 . 13 1 1 A 34 34 ASP N N 119 118.500 118.500 0.000 1
1 313 . 13 1 1 A 35 35 VAL H H 120 8.473 8.331 0.142 1
1 314 . 13 1 1 A 35 35 VAL HA H 120 4.709 4.781 -0.072 1
1 322 . 13 1 1 A 35 35 VAL C C 120 173.900 174.316 -0.416 1
1 323 . 13 1 1 A 35 35 VAL CA C 120 60.736 61.071 -0.335 1
1 324 . 13 1 1 A 35 35 VAL CB C 120 34.662 32.988 1.674 1
1 327 . 13 1 1 A 35 35 VAL N N 120 121.116 120.902 0.214 1
1 328 . 13 1 1 A 36 36 TRP H H 121 9.404 9.371 0.033 1
1 329 . 13 1 1 A 36 36 TRP HA H 121 5.174 5.437 -0.263 1
1 338 . 13 1 1 A 36 36 TRP C C 121 176.480 174.569 1.911 1
1 339 . 13 1 1 A 36 36 TRP CA C 121 55.070 54.956 0.114 1
1 340 . 13 1 1 A 36 36 TRP CB C 121 32.179 32.791 -0.612 1
1 348 . 13 1 1 A 36 36 TRP N N 121 126.924 129.158 -2.234 1
1 350 . 13 1 1 A 37 37 CYS H H 122 9.230 8.793 0.437 1
1 351 . 13 1 1 A 37 37 CYS HA H 122 5.417 5.180 0.237 1
1 354 . 13 1 1 A 37 37 CYS C C 122 175.346 173.505 1.841 1
1 355 . 13 1 1 A 37 37 CYS CA C 122 57.083 57.460 -0.377 1
1 356 . 13 1 1 A 37 37 CYS CB C 122 28.713 29.562 -0.849 1
1 357 . 13 1 1 A 37 37 CYS N N 122 120.375 128.173 -7.798 1
1 358 . 13 1 1 A 38 38 ASN H H 123 9.817 8.812 1.005 1
1 359 . 13 1 1 A 38 38 ASN HA H 123 4.637 4.218 0.419 1
1 364 . 13 1 1 A 38 38 ASN C C 123 175.526 175.187 0.339 1
1 365 . 13 1 1 A 38 38 ASN CA C 123 54.023 54.321 -0.298 1
1 366 . 13 1 1 A 38 38 ASN CB C 123 36.581 37.058 -0.477 1
1 367 . 13 1 1 A 38 38 ASN N N 123 129.408 126.735 2.673 1
1 369 . 13 1 1 A 39 39 GLY H H 124 9.092 8.003 1.089 1
1 370 . 13 1 1 A 39 39 GLY HA2 H 124 4.241 3.526 0.715 1
1 371 . 13 1 1 A 39 39 GLY HA3 H 124 3.705 3.795 -0.090 1
1 372 . 13 1 1 A 39 39 GLY C C 124 173.405 174.152 -0.747 1
1 373 . 13 1 1 A 39 39 GLY CA C 124 45.595 46.691 -1.096 1
1 374 . 13 1 1 A 39 39 GLY N N 124 102.752 103.254 -0.502 1
1 375 . 13 1 1 A 40 40 GLN H H 125 8.006 7.731 0.275 1
1 376 . 13 1 1 A 40 40 GLN HA H 125 4.736 4.831 -0.095 1
1 383 . 13 1 1 A 40 40 GLN C C 125 174.477 175.129 -0.652 1
1 384 . 13 1 1 A 40 40 GLN CA C 125 53.747 55.282 -1.535 1
1 385 . 13 1 1 A 40 40 GLN CB C 125 30.413 30.795 -0.382 1
1 387 . 13 1 1 A 40 40 GLN N N 125 120.627 119.174 1.453 1
1 389 . 13 1 1 A 41 41 LYS H H 126 8.757 8.819 -0.062 1
1 390 . 13 1 1 A 41 41 LYS HA H 126 3.464 4.340 -0.876 1
1 399 . 13 1 1 A 41 41 LYS C C 126 176.870 176.560 0.310 1
1 400 . 13 1 1 A 41 41 LYS CA C 126 57.136 56.971 0.165 1
1 401 . 13 1 1 A 41 41 LYS CB C 126 31.669 32.795 -1.126 1
1 405 . 13 1 1 A 41 41 LYS N N 126 129.107 128.929 0.178 1
1 406 . 13 1 1 A 42 42 MET H H 127 8.682 8.673 0.009 1
1 407 . 13 1 1 A 42 42 MET HA H 127 4.712 4.476 0.236 1
1 415 . 13 1 1 A 42 42 MET C C 127 176.816 175.474 1.342 1
1 416 . 13 1 1 A 42 42 MET CA C 127 52.958 55.689 -2.731 1
1 417 . 13 1 1 A 42 42 MET CB C 127 33.023 33.712 -0.689 1
1 420 . 13 1 1 A 42 42 MET N N 127 126.569 126.439 0.130 1
1 421 . 13 1 1 A 43 43 GLU H H 128 8.734 8.750 -0.016 1
1 422 . 13 1 1 A 43 43 GLU HA H 128 4.419 5.009 -0.590 1
1 427 . 13 1 1 A 43 43 GLU C C 128 176.531 176.891 -0.360 1
1 428 . 13 1 1 A 43 43 GLU CA C 128 56.475 55.023 1.452 1
1 429 . 13 1 1 A 43 43 GLU CB C 128 29.604 31.443 -1.839 1
1 431 . 13 1 1 A 43 43 GLU N N 128 123.734 120.395 3.339 1
1 432 . 13 1 1 A 44 44 THR H H 129 8.263 8.850 -0.587 1
1 433 . 13 1 1 A 44 44 THR HA H 129 5.385 5.469 -0.084 1
1 438 . 13 1 1 A 44 44 THR C C 129 174.205 173.981 0.224 1
1 439 . 13 1 1 A 44 44 THR CA C 129 59.160 60.522 -1.362 1
1 440 . 13 1 1 A 44 44 THR CB C 129 72.419 71.373 1.046 1
1 442 . 13 1 1 A 44 44 THR N N 129 115.081 116.697 -1.616 1
1 443 . 13 1 1 A 45 45 ALA H H 130 8.727 9.051 -0.324 1
1 444 . 13 1 1 A 45 45 ALA HA H 130 4.749 4.834 -0.085 1
1 448 . 13 1 1 A 45 45 ALA C C 130 177.017 176.943 0.074 1
1 449 . 13 1 1 A 45 45 ALA CA C 130 51.645 50.634 1.011 1
1 450 . 13 1 1 A 45 45 ALA CB C 130 21.364 19.998 1.366 1
1 451 . 13 1 1 A 45 45 ALA N N 130 123.243 123.055 0.188 1
1 452 . 13 1 1 A 46 46 GLY H H 131 8.818 8.804 0.014 1
1 453 . 13 1 1 A 46 46 GLY HA2 H 131 4.941 4.038 0.903 1
1 454 . 13 1 1 A 46 46 GLY HA3 H 131 3.690 4.040 -0.350 1
1 455 . 13 1 1 A 46 46 GLY C C 131 173.528 172.789 0.739 1
1 456 . 13 1 1 A 46 46 GLY CA C 131 45.060 45.926 -0.866 1
1 457 . 13 1 1 A 46 46 GLY N N 131 112.392 110.788 1.604 1
1 458 . 13 1 1 A 47 47 GLU H H 132 8.746 8.898 -0.152 1
1 459 . 13 1 1 A 47 47 GLU HA H 132 4.584 4.997 -0.413 1
1 464 . 13 1 1 A 47 47 GLU C C 132 175.223 175.556 -0.333 1
1 465 . 13 1 1 A 47 47 GLU CA C 132 55.008 55.434 -0.426 1
1 466 . 13 1 1 A 47 47 GLU CB C 132 32.939 33.020 -0.081 1
1 468 . 13 1 1 A 47 47 GLU N N 132 122.107 124.674 -2.567 1
1 469 . 13 1 1 A 48 48 PHE H H 133 8.920 9.172 -0.252 1
1 470 . 13 1 1 A 48 48 PHE HA H 133 4.822 4.674 0.148 1
1 475 . 13 1 1 A 48 48 PHE C C 133 175.499 175.364 0.135 1
1 476 . 13 1 1 A 48 48 PHE CA C 133 58.320 58.615 -0.295 1
1 477 . 13 1 1 A 48 48 PHE CB C 133 39.175 39.005 0.170 1
1 479 . 13 1 1 A 48 48 PHE N N 133 124.006 128.856 -4.850 1
1 480 . 13 1 1 A 49 49 VAL H H 134 8.161 8.021 0.140 1
1 481 . 13 1 1 A 49 49 VAL HA H 134 4.492 4.750 -0.258 1
1 489 . 13 1 1 A 49 49 VAL C C 134 176.241 176.742 -0.501 1
1 490 . 13 1 1 A 49 49 VAL CA C 134 60.328 59.700 0.628 1
1 491 . 13 1 1 A 49 49 VAL CB C 134 34.542 34.682 -0.140 1
1 494 . 13 1 1 A 49 49 VAL N N 134 120.063 121.267 -1.204 1
1 495 . 13 1 1 A 50 50 ASP H H 135 8.596 8.520 0.076 1
1 496 . 13 1 1 A 50 50 ASP HA H 135 4.278 4.403 -0.125 1
1 499 . 13 1 1 A 50 50 ASP C C 135 176.567 176.430 0.137 1
1 500 . 13 1 1 A 50 50 ASP CA C 135 57.149 57.301 -0.152 1
1 501 . 13 1 1 A 50 50 ASP CB C 135 40.477 41.090 -0.613 1
1 502 . 13 1 1 A 50 50 ASP N N 135 122.137 121.585 0.552 1
1 503 . 13 1 1 A 51 51 ASP H H 136 8.328 7.683 0.645 1
1 504 . 13 1 1 A 51 51 ASP HA H 136 4.656 5.000 -0.344 1
1 507 . 13 1 1 A 51 51 ASP C C 136 175.798 174.903 0.895 1
1 508 . 13 1 1 A 51 51 ASP CA C 136 53.458 53.149 0.309 1
1 509 . 13 1 1 A 51 51 ASP CB C 136 40.306 43.059 -2.753 1
1 510 . 13 1 1 A 51 51 ASP N N 136 116.158 117.481 -1.323 1
1 511 . 13 1 1 A 52 52 GLY H H 137 7.653 8.139 -0.486 1
1 512 . 13 1 1 A 52 52 GLY HA2 H 137 4.685 3.968 0.717 1
1 513 . 13 1 1 A 52 52 GLY HA3 H 137 4.069 3.998 0.071 1
1 514 . 13 1 1 A 52 52 GLY C C 137 173.149 172.598 0.551 1
1 515 . 13 1 1 A 52 52 GLY CA C 137 45.860 43.911 1.949 1
1 516 . 13 1 1 A 52 52 GLY N N 137 107.634 111.761 -4.127 1
1 517 . 13 1 1 A 53 53 THR H H 138 8.445 8.063 0.382 1
1 518 . 13 1 1 A 53 53 THR HA H 138 4.996 4.891 0.105 1
1 523 . 13 1 1 A 53 53 THR C C 138 174.163 173.309 0.854 1
1 524 . 13 1 1 A 53 53 THR CA C 138 60.974 61.488 -0.514 1
1 525 . 13 1 1 A 53 53 THR CB C 138 72.266 71.698 0.568 1
1 527 . 13 1 1 A 53 53 THR N N 138 114.976 114.738 0.238 1
1 528 . 13 1 1 A 54 54 GLU H H 139 8.917 8.295 0.622 1
1 529 . 13 1 1 A 54 54 GLU HA H 139 5.205 4.638 0.567 1
1 534 . 13 1 1 A 54 54 GLU C C 139 175.700 175.225 0.475 1
1 535 . 13 1 1 A 54 54 GLU CA C 139 54.731 55.313 -0.582 1
1 536 . 13 1 1 A 54 54 GLU CB C 139 33.250 29.933 3.317 1
1 538 . 13 1 1 A 54 54 GLU N N 139 121.295 126.299 -5.004 1
1 539 . 13 1 1 A 55 55 THR H H 140 9.190 8.502 0.688 1
1 540 . 13 1 1 A 55 55 THR HA H 140 4.744 4.581 0.163 1
1 545 . 13 1 1 A 55 55 THR C C 140 174.537 173.656 0.881 1
1 546 . 13 1 1 A 55 55 THR CA C 140 62.678 61.798 0.880 1
1 547 . 13 1 1 A 55 55 THR CB C 140 69.744 69.081 0.663 1
1 549 . 13 1 1 A 55 55 THR N N 140 122.419 120.661 1.758 1
1 550 . 13 1 1 A 56 56 HIS H H 141 9.395 9.075 0.320 1
1 551 . 13 1 1 A 56 56 HIS HA H 141 5.204 4.938 0.266 1
1 556 . 13 1 1 A 56 56 HIS C C 141 174.675 174.452 0.223 1
1 557 . 13 1 1 A 56 56 HIS CA C 141 55.557 53.950 1.607 1
1 558 . 13 1 1 A 56 56 HIS CB C 141 31.279 30.604 0.675 1
1 561 . 13 1 1 A 56 56 HIS N N 141 125.732 125.316 0.416 1
1 564 . 13 1 1 A 57 57 PHE H H 142 8.790 7.943 0.847 1
1 565 . 13 1 1 A 57 57 PHE HA H 142 4.918 5.919 -1.001 1
1 571 . 13 1 1 A 57 57 PHE C C 142 172.293 174.174 -1.881 1
1 572 . 13 1 1 A 57 57 PHE CA C 142 56.366 55.322 1.044 1
1 573 . 13 1 1 A 57 57 PHE CB C 142 39.962 42.219 -2.257 1
1 575 . 13 1 1 A 57 57 PHE N N 142 117.009 121.589 -4.580 1
1 576 . 13 1 1 A 58 58 SER H H 143 8.890 9.100 -0.210 1
1 577 . 13 1 1 A 58 58 SER HA H 143 5.286 5.135 0.151 1
1 580 . 13 1 1 A 58 58 SER C C 143 173.716 174.491 -0.775 1
1 581 . 13 1 1 A 58 58 SER CA C 143 57.517 57.250 0.267 1
1 582 . 13 1 1 A 58 58 SER CB C 143 65.448 65.064 0.384 1
1 583 . 13 1 1 A 58 58 SER N N 143 115.269 117.597 -2.328 1
1 584 . 13 1 1 A 59 59 VAL H H 144 7.737 8.420 -0.683 1
1 585 . 13 1 1 A 59 59 VAL HA H 144 4.220 4.426 -0.206 1
1 593 . 13 1 1 A 59 59 VAL C C 144 176.234 176.100 0.134 1
1 594 . 13 1 1 A 59 59 VAL CA C 144 61.741 60.963 0.778 1
1 595 . 13 1 1 A 59 59 VAL CB C 144 33.711 33.999 -0.288 1
1 598 . 13 1 1 A 59 59 VAL N N 144 123.186 121.580 1.606 1
1 599 . 13 1 1 A 60 60 GLY H H 145 8.945 9.027 -0.082 1
1 600 . 13 1 1 A 60 60 GLY HA2 H 145 4.027 3.736 0.291 1
1 601 . 13 1 1 A 60 60 GLY HA3 H 145 3.692 3.791 -0.099 1
1 602 . 13 1 1 A 60 60 GLY C C 145 175.182 174.679 0.503 1
1 603 . 13 1 1 A 60 60 GLY CA C 145 47.141 47.275 -0.134 1
1 604 . 13 1 1 A 60 60 GLY N N 145 116.908 117.789 -0.881 1
1 605 . 13 1 1 A 61 61 ASN H H 146 8.929 8.259 0.670 1
1 606 . 13 1 1 A 61 61 ASN HA H 146 4.718 4.766 -0.048 1
1 611 . 13 1 1 A 61 61 ASN C C 146 174.706 173.483 1.223 1
1 612 . 13 1 1 A 61 61 ASN CA C 146 52.802 52.679 0.123 1
1 613 . 13 1 1 A 61 61 ASN CB C 146 37.917 38.976 -1.059 1
1 614 . 13 1 1 A 61 61 ASN N N 146 123.976 124.461 -0.485 1
1 616 . 13 1 1 A 62 62 HIS H H 147 8.400 7.774 0.626 1
1 617 . 13 1 1 A 62 62 HIS HA H 147 4.762 5.182 -0.420 1
1 622 . 13 1 1 A 62 62 HIS C C 147 173.871 173.190 0.681 1
1 623 . 13 1 1 A 62 62 HIS CA C 147 55.374 54.892 0.482 1
1 624 . 13 1 1 A 62 62 HIS CB C 147 28.655 34.318 -5.663 1
1 628 . 13 1 1 A 62 62 HIS N N 147 118.620 118.061 0.559 1
1 631 . 13 1 1 A 63 63 ASP H H 148 8.734 8.908 -0.174 1
1 632 . 13 1 1 A 63 63 ASP HA H 148 4.785 5.445 -0.660 1
1 635 . 13 1 1 A 63 63 ASP C C 148 175.269 175.061 0.208 1
1 636 . 13 1 1 A 63 63 ASP CA C 148 54.390 52.757 1.633 1
1 637 . 13 1 1 A 63 63 ASP CB C 148 42.105 44.242 -2.137 1
1 638 . 13 1 1 A 63 63 ASP N N 148 125.336 120.238 5.098 1
1 639 . 13 1 1 A 64 64 CYS H H 149 8.225 9.080 -0.855 1
1 640 . 13 1 1 A 64 64 CYS HA H 149 5.118 5.206 -0.088 1
1 643 . 13 1 1 A 64 64 CYS C C 149 173.740 172.348 1.392 1
1 644 . 13 1 1 A 64 64 CYS CA C 149 55.423 56.629 -1.206 1
1 645 . 13 1 1 A 64 64 CYS CB C 149 29.972 32.384 -2.412 1
1 646 . 13 1 1 A 64 64 CYS N N 149 124.476 123.773 0.703 1
1 647 . 13 1 1 A 65 65 TYR H H 150 8.916 8.367 0.549 1
1 648 . 13 1 1 A 65 65 TYR HA H 150 5.121 4.041 1.080 1
1 655 . 13 1 1 A 65 65 TYR C C 150 172.821 171.991 0.830 1
1 656 . 13 1 1 A 65 65 TYR CA C 150 56.347 55.505 0.842 1
1 657 . 13 1 1 A 65 65 TYR CB C 150 38.901 40.705 -1.804 1
1 662 . 13 1 1 A 65 65 TYR N N 150 115.313 116.950 -1.637 1
1 663 . 13 1 1 A 66 66 ILE H H 151 8.423 9.102 -0.679 1
1 664 . 13 1 1 A 66 66 ILE HA H 151 5.000 4.462 0.538 1
1 674 . 13 1 1 A 66 66 ILE C C 151 176.225 174.670 1.555 1
1 675 . 13 1 1 A 66 66 ILE CA C 151 57.798 60.187 -2.389 1
1 676 . 13 1 1 A 66 66 ILE CB C 151 39.863 38.947 0.916 1
1 680 . 13 1 1 A 66 66 ILE N N 151 118.575 121.007 -2.432 1
1 681 . 13 1 1 A 67 67 LYS H H 152 9.480 8.974 0.506 1
1 682 . 13 1 1 A 67 67 LYS HA H 152 5.091 4.704 0.387 1
1 691 . 13 1 1 A 67 67 LYS C C 152 174.079 175.087 -1.008 1
1 692 . 13 1 1 A 67 67 LYS CA C 152 54.728 56.127 -1.399 1
1 693 . 13 1 1 A 67 67 LYS CB C 152 35.256 33.172 2.084 1
1 697 . 13 1 1 A 67 67 LYS N N 152 132.311 128.700 3.611 1
1 698 . 13 1 1 A 68 68 ALA H H 153 8.844 8.451 0.393 1
1 699 . 13 1 1 A 68 68 ALA HA H 153 5.039 5.471 -0.432 1
1 703 . 13 1 1 A 68 68 ALA C C 153 176.587 176.253 0.334 1
1 704 . 13 1 1 A 68 68 ALA CA C 153 50.484 50.746 -0.262 1
1 705 . 13 1 1 A 68 68 ALA CB C 153 20.570 21.752 -1.182 1
1 706 . 13 1 1 A 68 68 ALA N N 153 129.958 130.198 -0.240 1
1 707 . 13 1 1 A 69 69 VAL H H 154 8.461 8.598 -0.137 1
1 708 . 13 1 1 A 69 69 VAL HA H 154 4.558 4.550 0.008 1
1 716 . 13 1 1 A 69 69 VAL C C 154 175.331 175.136 0.195 1
1 717 . 13 1 1 A 69 69 VAL CA C 154 60.758 60.970 -0.212 1
1 718 . 13 1 1 A 69 69 VAL CB C 154 34.743 35.148 -0.405 1
1 721 . 13 1 1 A 69 69 VAL N N 154 121.496 121.731 -0.235 1
1 722 . 13 1 1 A 70 70 SER H H 155 8.695 8.916 -0.221 1
1 723 . 13 1 1 A 70 70 SER HA H 155 4.646 5.185 -0.539 1
1 726 . 13 1 1 A 70 70 SER C C 155 174.690 173.888 0.802 1
1 727 . 13 1 1 A 70 70 SER CA C 155 58.065 56.935 1.130 1
1 728 . 13 1 1 A 70 70 SER CB C 155 64.062 64.584 -0.522 1
1 729 . 13 1 1 A 70 70 SER N N 155 119.763 121.927 -2.164 1
1 730 . 13 1 1 A 71 71 SER H H 156 8.360 8.947 -0.587 1
1 731 . 13 1 1 A 71 71 SER HA H 156 4.430 5.307 -0.877 1
1 734 . 13 1 1 A 71 71 SER CA C 156 58.491 56.702 1.789 1
1 735 . 13 1 1 A 71 71 SER CB C 156 64.061 67.012 -2.951 1
1 736 . 13 1 1 A 71 71 SER N N 156 118.577 117.483 1.094 1
1 737 . 13 1 1 A 72 72 GLY H H 157 8.542 8.436 0.106 1
1 738 . 13 1 1 A 72 72 GLY HA2 H 157 4.002 4.202 -0.200 1
1 739 . 13 1 1 A 72 72 GLY HA3 H 157 4.002 4.203 -0.201 1
1 740 . 13 1 1 A 72 72 GLY CA C 157 45.565 44.021 1.544 1
1 741 . 13 1 1 A 72 72 GLY N N 157 111.540 110.369 1.171 1
1 742 . 13 1 1 A 73 73 LYS H H 158 8.369 8.768 -0.399 1
1 743 . 13 1 1 A 73 73 LYS CA C 158 56.720 59.057 -2.337 1
1 744 . 13 1 1 A 73 73 LYS CB C 158 32.915 32.868 0.047 1
1 747 . 13 1 1 A 73 73 LYS N N 158 120.293 120.582 -0.289 1
1 748 . 13 1 1 A 74 74 ARG H H 159 8.181 7.571 0.610 1
1 749 . 13 1 1 A 74 74 ARG CA C 159 56.148 54.695 1.453 1
1 751 . 13 1 1 A 74 74 ARG N N 159 119.343 114.381 4.962 1
1 752 . 13 1 1 A 75 75 LYS H H 160 8.443 8.527 -0.084 1
1 753 . 13 1 1 A 75 75 LYS HA H 160 4.067 4.029 0.038 1
1 762 . 13 1 1 A 75 75 LYS C C 160 176.868 176.554 0.314 1
1 763 . 13 1 1 A 75 75 LYS CA C 160 57.711 57.121 0.590 1
1 764 . 13 1 1 A 75 75 LYS CB C 160 31.777 30.873 0.904 1
1 768 . 13 1 1 A 75 75 LYS N N 160 120.467 117.599 2.868 1
1 769 . 13 1 1 A 76 76 GLU H H 161 8.693 8.121 0.572 1
1 770 . 13 1 1 A 76 76 GLU HA H 161 4.290 4.401 -0.111 1
1 771 . 13 1 1 A 76 76 GLU C C 161 176.844 176.581 0.263 1
1 772 . 13 1 1 A 76 76 GLU CA C 161 57.294 58.001 -0.707 1
1 773 . 13 1 1 A 76 76 GLU CB C 161 29.794 30.819 -1.025 1
1 775 . 13 1 1 A 76 76 GLU N N 161 118.767 117.841 0.926 1
1 776 . 13 1 1 A 77 77 GLY H H 162 8.168 7.884 0.284 1
1 777 . 13 1 1 A 77 77 GLY HA2 H 162 4.010 4.140 -0.130 1
1 778 . 13 1 1 A 77 77 GLY HA3 H 162 3.963 4.144 -0.181 1
1 779 . 13 1 1 A 77 77 GLY C C 162 173.512 171.934 1.578 1
1 780 . 13 1 1 A 77 77 GLY CA C 162 45.362 44.602 0.760 1
1 781 . 13 1 1 A 77 77 GLY N N 162 108.621 107.270 1.351 1
1 782 . 13 1 1 A 78 78 ILE H H 163 7.954 8.869 -0.915 1
1 783 . 13 1 1 A 78 78 ILE HA H 163 4.323 4.893 -0.570 1
1 793 . 13 1 1 A 78 78 ILE C C 163 175.402 175.267 0.135 1
1 794 . 13 1 1 A 78 78 ILE CA C 163 60.632 59.461 1.171 1
1 795 . 13 1 1 A 78 78 ILE CB C 163 39.759 40.708 -0.949 1
1 799 . 13 1 1 A 78 78 ILE N N 163 121.604 125.480 -3.876 1
1 800 . 13 1 1 A 79 79 ILE H H 164 8.514 8.649 -0.135 1
1 801 . 13 1 1 A 79 79 ILE HA H 164 4.341 4.780 -0.439 1
1 811 . 13 1 1 A 79 79 ILE C C 164 175.172 174.746 0.426 1
1 812 . 13 1 1 A 79 79 ILE CA C 164 60.027 59.876 0.151 1
1 813 . 13 1 1 A 79 79 ILE CB C 164 40.153 41.784 -1.631 1
1 817 . 13 1 1 A 79 79 ILE N N 164 127.137 125.859 1.278 1
1 818 . 13 1 1 A 80 80 HIS H H 165 8.492 8.820 -0.328 1
1 819 . 13 1 1 A 80 80 HIS HA H 165 5.676 5.637 0.039 1
1 824 . 13 1 1 A 80 80 HIS C C 165 175.502 173.899 1.603 1
1 825 . 13 1 1 A 80 80 HIS CA C 165 57.043 54.547 2.496 1
1 826 . 13 1 1 A 80 80 HIS CB C 165 32.741 33.644 -0.903 1
1 829 . 13 1 1 A 80 80 HIS N N 165 125.422 125.076 0.346 1
1 830 . 13 1 1 A 81 81 THR H H 166 9.080 9.544 -0.464 1
1 831 . 13 1 1 A 81 81 THR HA H 166 4.999 5.251 -0.252 1
1 836 . 13 1 1 A 81 81 THR C C 166 171.877 172.978 -1.101 1
1 837 . 13 1 1 A 81 81 THR CA C 166 59.924 60.908 -0.984 1
1 838 . 13 1 1 A 81 81 THR CB C 166 72.243 70.801 1.442 1
1 840 . 13 1 1 A 81 81 THR N N 166 117.682 115.902 1.780 1
1 841 . 13 1 1 A 82 82 LEU H H 167 8.062 8.078 -0.016 1
1 842 . 13 1 1 A 82 82 LEU HA H 167 4.350 3.968 0.382 1
1 852 . 13 1 1 A 82 82 LEU C C 167 172.705 174.907 -2.202 1
1 853 . 13 1 1 A 82 82 LEU CA C 167 53.553 55.477 -1.924 1
1 854 . 13 1 1 A 82 82 LEU CB C 167 39.768 41.389 -1.621 1
1 858 . 13 1 1 A 82 82 LEU N N 167 125.369 128.203 -2.834 1
1 859 . 13 1 1 A 83 83 ILE H H 168 8.657 8.318 0.339 1
1 860 . 13 1 1 A 83 83 ILE HA H 168 4.476 4.890 -0.414 1
1 870 . 13 1 1 A 83 83 ILE C C 168 175.159 174.180 0.979 1
1 871 . 13 1 1 A 83 83 ILE CA C 168 58.529 60.173 -1.644 1
1 872 . 13 1 1 A 83 83 ILE CB C 168 37.410 40.208 -2.798 1
1 876 . 13 1 1 A 83 83 ILE N N 168 128.042 127.645 0.397 1
1 877 . 13 1 1 A 84 84 VAL H H 169 8.464 8.326 0.138 1
1 878 . 13 1 1 A 84 84 VAL HA H 169 4.284 4.358 -0.074 1
1 886 . 13 1 1 A 84 84 VAL C C 169 176.138 175.891 0.247 1
1 887 . 13 1 1 A 84 84 VAL CA C 169 61.029 61.268 -0.239 1
1 888 . 13 1 1 A 84 84 VAL CB C 169 34.714 33.881 0.833 1
1 891 . 13 1 1 A 84 84 VAL N N 169 124.644 126.793 -2.149 1
1 892 . 13 1 1 A 85 85 ASP H H 170 9.158 9.326 -0.168 1
1 893 . 13 1 1 A 85 85 ASP HA H 170 4.362 4.272 0.090 1
1 896 . 13 1 1 A 85 85 ASP C C 170 175.489 175.308 0.181 1
1 897 . 13 1 1 A 85 85 ASP CA C 170 55.868 55.169 0.699 1
1 898 . 13 1 1 A 85 85 ASP CB C 170 38.927 39.438 -0.511 1
1 899 . 13 1 1 A 85 85 ASP N N 170 129.061 127.518 1.543 1
1 900 . 13 1 1 A 86 86 ASN H H 171 8.811 8.352 0.459 1
1 901 . 13 1 1 A 86 86 ASN HA H 171 4.053 4.293 -0.240 1
1 906 . 13 1 1 A 86 86 ASN C C 171 173.802 173.847 -0.045 1
1 907 . 13 1 1 A 86 86 ASN CA C 171 55.173 54.283 0.890 1
1 908 . 13 1 1 A 86 86 ASN CB C 171 38.150 37.408 0.742 1
1 909 . 13 1 1 A 86 86 ASN N N 171 108.418 114.889 -6.471 1
1 911 . 13 1 1 A 87 87 ARG H H 172 7.914 7.455 0.459 1
1 912 . 13 1 1 A 87 87 ARG HA H 172 4.597 4.681 -0.084 1
1 919 . 13 1 1 A 87 87 ARG C C 172 174.025 174.775 -0.750 1
1 920 . 13 1 1 A 87 87 ARG CA C 172 54.846 54.083 0.763 1
1 921 . 13 1 1 A 87 87 ARG CB C 172 32.697 33.291 -0.594 1
1 924 . 13 1 1 A 87 87 ARG N N 172 120.988 117.322 3.666 1
1 925 . 13 1 1 A 88 88 GLU H H 173 8.534 8.716 -0.182 1
1 926 . 13 1 1 A 88 88 GLU HA H 173 4.560 4.354 0.206 1
1 931 . 13 1 1 A 88 88 GLU C C 173 176.187 175.451 0.736 1
1 932 . 13 1 1 A 88 88 GLU CA C 173 56.044 56.852 -0.808 1
1 933 . 13 1 1 A 88 88 GLU CB C 173 30.329 30.388 -0.059 1
1 935 . 13 1 1 A 88 88 GLU N N 173 123.982 124.274 -0.292 1
1 936 . 13 1 1 A 89 89 ILE H H 174 8.897 7.941 0.956 1
1 937 . 13 1 1 A 89 89 ILE HA H 174 4.666 4.562 0.104 1
1 947 . 13 1 1 A 89 89 ILE C C 174 174.110 174.112 -0.002 1
1 948 . 13 1 1 A 89 89 ILE CA C 174 55.255 57.333 -2.078 1
1 949 . 13 1 1 A 89 89 ILE CB C 174 37.851 41.685 -3.834 1
1 953 . 13 1 1 A 89 89 ILE N N 174 130.008 127.272 2.736 1
1 954 . 13 1 1 A 90 90 PRO HA H 175 4.713 4.732 -0.019 1
1 961 . 13 1 1 A 90 90 PRO C C 175 176.956 176.180 0.776 1
1 962 . 13 1 1 A 90 90 PRO CA C 175 63.159 62.971 0.188 1
1 963 . 13 1 1 A 90 90 PRO CB C 175 32.428 32.462 -0.034 1
1 966 . 13 1 1 A 91 91 GLU H H 176 8.778 8.731 0.047 1
1 967 . 13 1 1 A 91 91 GLU HA H 176 3.910 4.882 -0.972 1
1 972 . 13 1 1 A 91 91 GLU C C 176 176.426 176.645 -0.219 1
1 973 . 13 1 1 A 91 91 GLU CA C 176 56.738 55.719 1.019 1
1 974 . 13 1 1 A 91 91 GLU CB C 176 30.540 31.469 -0.929 1
1 976 . 13 1 1 A 91 91 GLU N N 176 124.561 121.981 2.580 1
1 977 . 13 1 1 A 92 92 LEU H H 177 8.630 8.303 0.327 1
1 978 . 13 1 1 A 92 92 LEU HA H 177 4.419 4.363 0.056 1
1 988 . 13 1 1 A 92 92 LEU C C 177 177.162 175.720 1.442 1
1 989 . 13 1 1 A 92 92 LEU CA C 177 55.350 56.601 -1.251 1
1 990 . 13 1 1 A 92 92 LEU CB C 177 42.390 41.968 0.422 1
1 994 . 13 1 1 A 92 92 LEU N N 177 126.683 128.424 -1.741 1
1 995 . 13 1 1 A 93 93 THR H H 178 8.375 8.732 -0.357 1
1 996 . 13 1 1 A 93 93 THR HA H 178 4.359 5.230 -0.871 1
1 1001 . 13 1 1 A 93 93 THR C C 178 173.589 173.411 0.178 1
1 1002 . 13 1 1 A 93 93 THR CA C 178 61.621 60.341 1.280 1
1 1003 . 13 1 1 A 93 93 THR CB C 178 69.724 71.139 -1.415 1
1 1005 . 13 1 1 A 93 93 THR N N 178 119.699 116.139 3.560 1
1 1 . 14 1 1 A 9 9 SER H H 94 8.475 8.538 -0.063 1
1 2 . 14 1 1 A 9 9 SER CA C 94 58.531 57.219 1.312 1
1 3 . 14 1 1 A 9 9 SER N N 94 117.432 120.043 -2.611 1
1 4 . 14 1 1 A 10 10 LYS H H 95 8.527 8.753 -0.226 1
1 5 . 14 1 1 A 10 10 LYS C C 95 174.594 175.761 -1.167 1
1 6 . 14 1 1 A 10 10 LYS CA C 95 56.603 55.083 1.520 1
1 7 . 14 1 1 A 10 10 LYS N N 95 123.104 124.909 -1.805 1
1 8 . 14 1 1 A 11 11 THR H H 96 8.245 8.721 -0.476 1
1 9 . 14 1 1 A 11 11 THR C C 96 174.393 174.493 -0.100 1
1 10 . 14 1 1 A 11 11 THR CA C 96 62.149 62.647 -0.498 1
1 11 . 14 1 1 A 11 11 THR CB C 96 69.183 69.966 -0.783 1
1 13 . 14 1 1 A 11 11 THR N N 96 113.245 120.737 -7.492 1
1 14 . 14 1 1 A 12 12 THR H H 97 7.769 8.551 -0.782 1
1 15 . 14 1 1 A 12 12 THR HA H 97 5.583 5.006 0.577 1
1 20 . 14 1 1 A 12 12 THR C C 97 174.726 172.194 2.532 1
1 21 . 14 1 1 A 12 12 THR CA C 97 59.602 60.792 -1.190 1
1 22 . 14 1 1 A 12 12 THR CB C 97 72.805 71.537 1.268 1
1 24 . 14 1 1 A 12 12 THR N N 97 113.440 117.648 -4.208 1
1 25 . 14 1 1 A 13 13 SER H H 98 8.593 8.705 -0.112 1
1 26 . 14 1 1 A 13 13 SER HA H 98 4.448 5.452 -1.004 1
1 29 . 14 1 1 A 13 13 SER C C 98 171.426 173.128 -1.702 1
1 30 . 14 1 1 A 13 13 SER CA C 98 59.056 57.085 1.971 1
1 31 . 14 1 1 A 13 13 SER CB C 98 67.839 65.323 2.516 1
1 32 . 14 1 1 A 13 13 SER N N 98 119.042 121.339 -2.297 1
1 33 . 14 1 1 A 14 14 THR H H 99 8.155 8.137 0.018 1
1 34 . 14 1 1 A 14 14 THR HA H 99 5.383 5.165 0.218 1
1 39 . 14 1 1 A 14 14 THR C C 99 171.565 172.891 -1.326 1
1 40 . 14 1 1 A 14 14 THR CA C 99 61.291 59.639 1.652 1
1 41 . 14 1 1 A 14 14 THR CB C 99 71.654 72.284 -0.630 1
1 43 . 14 1 1 A 14 14 THR N N 99 118.204 112.102 6.102 1
1 44 . 14 1 1 A 15 15 TRP H H 100 9.637 9.085 0.552 1
1 45 . 14 1 1 A 15 15 TRP HA H 100 4.807 5.088 -0.281 1
1 54 . 14 1 1 A 15 15 TRP C C 100 174.399 175.393 -0.994 1
1 55 . 14 1 1 A 15 15 TRP CA C 100 58.302 56.139 2.163 1
1 56 . 14 1 1 A 15 15 TRP CB C 100 34.810 33.552 1.258 1
1 63 . 14 1 1 A 15 15 TRP N N 100 125.132 120.889 4.243 1
1 65 . 14 1 1 A 16 16 VAL H H 101 8.863 9.015 -0.152 1
1 66 . 14 1 1 A 16 16 VAL HA H 101 5.267 4.736 0.531 1
1 74 . 14 1 1 A 16 16 VAL C C 101 174.955 175.171 -0.216 1
1 75 . 14 1 1 A 16 16 VAL CA C 101 60.653 61.687 -1.034 1
1 76 . 14 1 1 A 16 16 VAL CB C 101 34.284 32.954 1.330 1
1 79 . 14 1 1 A 16 16 VAL N N 101 119.527 123.416 -3.889 1
1 80 . 14 1 1 A 17 17 LEU H H 102 8.961 8.945 0.016 1
1 81 . 14 1 1 A 17 17 LEU HA H 102 4.729 5.077 -0.348 1
1 91 . 14 1 1 A 17 17 LEU C C 102 173.559 175.073 -1.514 1
1 92 . 14 1 1 A 17 17 LEU CA C 102 55.144 53.122 2.022 1
1 93 . 14 1 1 A 17 17 LEU CB C 102 42.948 45.948 -3.000 1
1 97 . 14 1 1 A 17 17 LEU N N 102 124.280 123.625 0.655 1
1 98 . 14 1 1 A 18 18 ARG H H 103 8.305 8.353 -0.048 1
1 99 . 14 1 1 A 18 18 ARG HA H 103 5.139 4.649 0.490 1
1 106 . 14 1 1 A 18 18 ARG C C 103 175.347 175.138 0.209 1
1 107 . 14 1 1 A 18 18 ARG CA C 103 54.793 56.078 -1.285 1
1 108 . 14 1 1 A 18 18 ARG CB C 103 31.347 29.797 1.550 1
1 111 . 14 1 1 A 18 18 ARG N N 103 122.020 120.135 1.885 1
1 112 . 14 1 1 A 19 19 LEU H H 104 8.676 8.766 -0.090 1
1 113 . 14 1 1 A 19 19 LEU HA H 104 4.482 4.787 -0.305 1
1 123 . 14 1 1 A 19 19 LEU C C 104 175.957 175.823 0.134 1
1 124 . 14 1 1 A 19 19 LEU CA C 104 53.581 53.591 -0.010 1
1 125 . 14 1 1 A 19 19 LEU CB C 104 45.697 45.279 0.418 1
1 129 . 14 1 1 A 19 19 LEU N N 104 126.378 124.936 1.442 1
1 130 . 14 1 1 A 20 20 ASP H H 105 9.390 9.483 -0.093 1
1 131 . 14 1 1 A 20 20 ASP HA H 105 4.287 4.350 -0.063 1
1 134 . 14 1 1 A 20 20 ASP C C 105 175.947 175.809 0.138 1
1 135 . 14 1 1 A 20 20 ASP CA C 105 55.263 55.280 -0.017 1
1 136 . 14 1 1 A 20 20 ASP CB C 105 39.239 39.303 -0.064 1
1 137 . 14 1 1 A 20 20 ASP N N 105 125.208 125.943 -0.735 1
1 138 . 14 1 1 A 21 21 GLY H H 106 8.563 8.611 -0.048 1
1 139 . 14 1 1 A 21 21 GLY HA2 H 106 4.126 3.823 0.303 1
1 140 . 14 1 1 A 21 21 GLY HA3 H 106 3.509 3.832 -0.323 1
1 141 . 14 1 1 A 21 21 GLY C C 106 173.164 173.700 -0.536 1
1 142 . 14 1 1 A 21 21 GLY CA C 106 45.499 45.503 -0.004 1
1 143 . 14 1 1 A 21 21 GLY N N 106 103.331 104.115 -0.784 1
1 144 . 14 1 1 A 22 22 GLU H H 107 7.713 7.999 -0.286 1
1 145 . 14 1 1 A 22 22 GLU HA H 107 4.634 4.918 -0.284 1
1 150 . 14 1 1 A 22 22 GLU C C 107 174.800 175.601 -0.801 1
1 151 . 14 1 1 A 22 22 GLU CA C 107 54.329 54.359 -0.030 1
1 152 . 14 1 1 A 22 22 GLU CB C 107 32.832 34.094 -1.262 1
1 154 . 14 1 1 A 22 22 GLU N N 107 119.470 119.378 0.092 1
1 155 . 14 1 1 A 23 23 ASP H H 108 8.632 8.491 0.141 1
1 156 . 14 1 1 A 23 23 ASP HA H 108 4.872 4.682 0.190 1
1 159 . 14 1 1 A 23 23 ASP C C 108 175.533 175.200 0.333 1
1 160 . 14 1 1 A 23 23 ASP CA C 108 55.180 53.648 1.532 1
1 161 . 14 1 1 A 23 23 ASP CB C 108 41.504 39.692 1.812 1
1 162 . 14 1 1 A 23 23 ASP N N 108 122.815 122.360 0.455 1
1 163 . 14 1 1 A 24 24 LEU H H 109 9.248 8.882 0.366 1
1 164 . 14 1 1 A 24 24 LEU HA H 109 4.836 4.618 0.218 1
1 174 . 14 1 1 A 24 24 LEU C C 109 174.322 175.741 -1.419 1
1 175 . 14 1 1 A 24 24 LEU CA C 109 54.473 55.010 -0.537 1
1 176 . 14 1 1 A 24 24 LEU CB C 109 44.718 43.069 1.649 1
1 180 . 14 1 1 A 24 24 LEU N N 109 125.550 126.955 -1.405 1
1 181 . 14 1 1 A 25 25 ARG H H 110 8.503 8.728 -0.225 1
1 182 . 14 1 1 A 25 25 ARG HA H 110 5.228 5.046 0.182 1
1 189 . 14 1 1 A 25 25 ARG C C 110 175.174 174.827 0.347 1
1 190 . 14 1 1 A 25 25 ARG CA C 110 54.745 54.617 0.128 1
1 191 . 14 1 1 A 25 25 ARG CB C 110 31.701 32.462 -0.761 1
1 194 . 14 1 1 A 25 25 ARG N N 110 125.424 127.366 -1.942 1
1 195 . 14 1 1 A 26 26 VAL H H 111 9.692 9.349 0.343 1
1 196 . 14 1 1 A 26 26 VAL HA H 111 5.091 5.094 -0.003 1
1 204 . 14 1 1 A 26 26 VAL C C 111 174.446 175.320 -0.874 1
1 205 . 14 1 1 A 26 26 VAL CA C 111 61.055 61.486 -0.431 1
1 206 . 14 1 1 A 26 26 VAL CB C 111 33.780 33.884 -0.104 1
1 209 . 14 1 1 A 26 26 VAL N N 111 130.649 126.655 3.994 1
1 210 . 14 1 1 A 27 27 VAL H H 112 9.401 8.959 0.442 1
1 211 . 14 1 1 A 27 27 VAL HA H 112 5.188 5.056 0.132 1
1 219 . 14 1 1 A 27 27 VAL C C 112 174.214 174.678 -0.464 1
1 220 . 14 1 1 A 27 27 VAL CA C 112 60.722 60.575 0.147 1
1 221 . 14 1 1 A 27 27 VAL CB C 112 36.082 35.694 0.388 1
1 224 . 14 1 1 A 27 27 VAL N N 112 127.416 126.283 1.133 1
1 225 . 14 1 1 A 28 28 LEU H H 113 9.265 9.169 0.096 1
1 226 . 14 1 1 A 28 28 LEU HA H 113 5.337 5.190 0.147 1
1 236 . 14 1 1 A 28 28 LEU C C 113 175.915 174.887 1.028 1
1 237 . 14 1 1 A 28 28 LEU CA C 113 52.599 53.858 -1.259 1
1 238 . 14 1 1 A 28 28 LEU CB C 113 47.495 44.698 2.797 1
1 242 . 14 1 1 A 28 28 LEU N N 113 127.527 128.120 -0.593 1
1 243 . 14 1 1 A 29 29 GLU H H 114 8.968 8.540 0.428 1
1 244 . 14 1 1 A 29 29 GLU HA H 114 4.701 4.498 0.203 1
1 249 . 14 1 1 A 29 29 GLU C C 114 176.715 177.732 -1.017 1
1 250 . 14 1 1 A 29 29 GLU CA C 114 55.342 56.640 -1.298 1
1 251 . 14 1 1 A 29 29 GLU CB C 114 30.005 30.422 -0.417 1
1 253 . 14 1 1 A 29 29 GLU N N 114 127.374 127.271 0.103 1
1 254 . 14 1 1 A 30 30 LYS H H 115 8.243 8.338 -0.095 1
1 255 . 14 1 1 A 30 30 LYS HA H 115 3.711 4.067 -0.356 1
1 264 . 14 1 1 A 30 30 LYS C C 115 177.137 178.105 -0.968 1
1 265 . 14 1 1 A 30 30 LYS CA C 115 60.118 58.666 1.452 1
1 266 . 14 1 1 A 30 30 LYS CB C 115 32.656 32.098 0.558 1
1 270 . 14 1 1 A 30 30 LYS N N 115 124.225 125.587 -1.362 1
1 271 . 14 1 1 A 31 31 ASP H H 116 9.200 8.077 1.123 1
1 272 . 14 1 1 A 31 31 ASP HA H 116 4.444 4.440 0.004 1
1 275 . 14 1 1 A 31 31 ASP C C 116 177.774 177.453 0.321 1
1 276 . 14 1 1 A 31 31 ASP CA C 116 56.703 57.442 -0.739 1
1 277 . 14 1 1 A 31 31 ASP CB C 116 40.236 40.517 -0.281 1
1 278 . 14 1 1 A 31 31 ASP N N 116 115.955 120.438 -4.483 1
1 279 . 14 1 1 A 32 32 THR H H 117 7.352 7.648 -0.296 1
1 280 . 14 1 1 A 32 32 THR HA H 117 4.266 4.589 -0.323 1
1 285 . 14 1 1 A 32 32 THR C C 117 175.320 174.203 1.117 1
1 286 . 14 1 1 A 32 32 THR CA C 117 61.171 60.735 0.436 1
1 287 . 14 1 1 A 32 32 THR CB C 117 70.221 69.359 0.862 1
1 289 . 14 1 1 A 32 32 THR N N 117 106.440 106.701 -0.261 1
1 290 . 14 1 1 A 33 33 MET H H 118 8.216 7.997 0.219 1
1 291 . 14 1 1 A 33 33 MET HA H 118 4.184 4.097 0.087 1
1 299 . 14 1 1 A 33 33 MET C C 118 174.952 174.612 0.340 1
1 300 . 14 1 1 A 33 33 MET CA C 118 55.195 56.788 -1.593 1
1 301 . 14 1 1 A 33 33 MET CB C 118 25.900 31.154 -5.254 1
1 304 . 14 1 1 A 33 33 MET N N 118 115.956 116.635 -0.679 1
1 305 . 14 1 1 A 34 34 ASP H H 119 7.509 7.842 -0.333 1
1 306 . 14 1 1 A 34 34 ASP HA H 119 4.486 4.738 -0.252 1
1 309 . 14 1 1 A 34 34 ASP C C 119 174.375 175.795 -1.420 1
1 310 . 14 1 1 A 34 34 ASP CA C 119 54.745 54.417 0.328 1
1 311 . 14 1 1 A 34 34 ASP CB C 119 42.865 42.098 0.767 1
1 312 . 14 1 1 A 34 34 ASP N N 119 118.500 118.874 -0.374 1
1 313 . 14 1 1 A 35 35 VAL H H 120 8.473 8.718 -0.245 1
1 314 . 14 1 1 A 35 35 VAL HA H 120 4.709 4.855 -0.146 1
1 322 . 14 1 1 A 35 35 VAL C C 120 173.900 174.526 -0.626 1
1 323 . 14 1 1 A 35 35 VAL CA C 120 60.736 61.185 -0.449 1
1 324 . 14 1 1 A 35 35 VAL CB C 120 34.662 32.807 1.855 1
1 327 . 14 1 1 A 35 35 VAL N N 120 121.116 124.913 -3.797 1
1 328 . 14 1 1 A 36 36 TRP H H 121 9.404 9.561 -0.157 1
1 329 . 14 1 1 A 36 36 TRP HA H 121 5.174 5.173 0.001 1
1 338 . 14 1 1 A 36 36 TRP C C 121 176.480 174.891 1.589 1
1 339 . 14 1 1 A 36 36 TRP CA C 121 55.070 55.621 -0.551 1
1 340 . 14 1 1 A 36 36 TRP CB C 121 32.179 32.618 -0.439 1
1 348 . 14 1 1 A 36 36 TRP N N 121 126.924 129.680 -2.756 1
1 350 . 14 1 1 A 37 37 CYS H H 122 9.230 9.129 0.101 1
1 351 . 14 1 1 A 37 37 CYS HA H 122 5.417 4.867 0.550 1
1 354 . 14 1 1 A 37 37 CYS C C 122 175.346 174.385 0.961 1
1 355 . 14 1 1 A 37 37 CYS CA C 122 57.083 57.902 -0.819 1
1 356 . 14 1 1 A 37 37 CYS CB C 122 28.713 29.711 -0.998 1
1 357 . 14 1 1 A 37 37 CYS N N 122 120.375 126.482 -6.107 1
1 358 . 14 1 1 A 38 38 ASN H H 123 9.817 8.851 0.966 1
1 359 . 14 1 1 A 38 38 ASN HA H 123 4.637 4.206 0.431 1
1 364 . 14 1 1 A 38 38 ASN C C 123 175.526 175.180 0.346 1
1 365 . 14 1 1 A 38 38 ASN CA C 123 54.023 54.310 -0.287 1
1 366 . 14 1 1 A 38 38 ASN CB C 123 36.581 37.130 -0.549 1
1 367 . 14 1 1 A 38 38 ASN N N 123 129.408 125.560 3.848 1
1 369 . 14 1 1 A 39 39 GLY H H 124 9.092 7.956 1.136 1
1 370 . 14 1 1 A 39 39 GLY HA2 H 124 4.241 3.623 0.618 1
1 371 . 14 1 1 A 39 39 GLY HA3 H 124 3.705 3.817 -0.112 1
1 372 . 14 1 1 A 39 39 GLY C C 124 173.405 173.860 -0.455 1
1 373 . 14 1 1 A 39 39 GLY CA C 124 45.595 46.730 -1.135 1
1 374 . 14 1 1 A 39 39 GLY N N 124 102.752 103.246 -0.494 1
1 375 . 14 1 1 A 40 40 GLN H H 125 8.006 7.697 0.309 1
1 376 . 14 1 1 A 40 40 GLN HA H 125 4.736 4.862 -0.126 1
1 383 . 14 1 1 A 40 40 GLN C C 125 174.477 174.437 0.040 1
1 384 . 14 1 1 A 40 40 GLN CA C 125 53.747 55.019 -1.272 1
1 385 . 14 1 1 A 40 40 GLN CB C 125 30.413 31.053 -0.640 1
1 387 . 14 1 1 A 40 40 GLN N N 125 120.627 119.241 1.386 1
1 389 . 14 1 1 A 41 41 LYS H H 126 8.757 8.720 0.037 1
1 390 . 14 1 1 A 41 41 LYS HA H 126 3.464 4.452 -0.988 1
1 399 . 14 1 1 A 41 41 LYS C C 126 176.870 175.466 1.404 1
1 400 . 14 1 1 A 41 41 LYS CA C 126 57.136 57.150 -0.014 1
1 401 . 14 1 1 A 41 41 LYS CB C 126 31.669 33.120 -1.451 1
1 405 . 14 1 1 A 41 41 LYS N N 126 129.107 126.994 2.113 1
1 406 . 14 1 1 A 42 42 MET H H 127 8.682 8.696 -0.014 1
1 407 . 14 1 1 A 42 42 MET HA H 127 4.712 5.247 -0.535 1
1 415 . 14 1 1 A 42 42 MET C C 127 176.816 174.305 2.511 1
1 416 . 14 1 1 A 42 42 MET CA C 127 52.958 53.685 -0.727 1
1 417 . 14 1 1 A 42 42 MET CB C 127 33.023 37.108 -4.085 1
1 420 . 14 1 1 A 42 42 MET N N 127 126.569 117.846 8.723 1
1 421 . 14 1 1 A 43 43 GLU H H 128 8.734 8.796 -0.062 1
1 422 . 14 1 1 A 43 43 GLU HA H 128 4.419 5.147 -0.728 1
1 427 . 14 1 1 A 43 43 GLU C C 128 176.531 176.760 -0.229 1
1 428 . 14 1 1 A 43 43 GLU CA C 128 56.475 55.153 1.322 1
1 429 . 14 1 1 A 43 43 GLU CB C 128 29.604 31.445 -1.841 1
1 431 . 14 1 1 A 43 43 GLU N N 128 123.734 120.066 3.668 1
1 432 . 14 1 1 A 44 44 THR H H 129 8.263 8.927 -0.664 1
1 433 . 14 1 1 A 44 44 THR HA H 129 5.385 5.335 0.050 1
1 438 . 14 1 1 A 44 44 THR C C 129 174.205 174.624 -0.419 1
1 439 . 14 1 1 A 44 44 THR CA C 129 59.160 60.445 -1.285 1
1 440 . 14 1 1 A 44 44 THR CB C 129 72.419 71.180 1.239 1
1 442 . 14 1 1 A 44 44 THR N N 129 115.081 117.843 -2.762 1
1 443 . 14 1 1 A 45 45 ALA H H 130 8.727 8.234 0.493 1
1 444 . 14 1 1 A 45 45 ALA HA H 130 4.749 4.357 0.392 1
1 448 . 14 1 1 A 45 45 ALA C C 130 177.017 178.240 -1.223 1
1 449 . 14 1 1 A 45 45 ALA CA C 130 51.645 52.532 -0.887 1
1 450 . 14 1 1 A 45 45 ALA CB C 130 21.364 20.193 1.171 1
1 451 . 14 1 1 A 45 45 ALA N N 130 123.243 123.312 -0.069 1
1 452 . 14 1 1 A 46 46 GLY H H 131 8.818 8.123 0.695 1
1 453 . 14 1 1 A 46 46 GLY HA2 H 131 4.941 3.973 0.968 1
1 454 . 14 1 1 A 46 46 GLY HA3 H 131 3.690 3.975 -0.285 1
1 455 . 14 1 1 A 46 46 GLY C C 131 173.528 174.784 -1.256 1
1 456 . 14 1 1 A 46 46 GLY CA C 131 45.060 46.389 -1.329 1
1 457 . 14 1 1 A 46 46 GLY N N 131 112.392 107.837 4.555 1
1 458 . 14 1 1 A 47 47 GLU H H 132 8.746 7.441 1.305 1
1 459 . 14 1 1 A 47 47 GLU HA H 132 4.584 4.321 0.263 1
1 464 . 14 1 1 A 47 47 GLU C C 132 175.223 175.894 -0.671 1
1 465 . 14 1 1 A 47 47 GLU CA C 132 55.008 56.407 -1.399 1
1 466 . 14 1 1 A 47 47 GLU CB C 132 32.939 30.227 2.712 1
1 468 . 14 1 1 A 47 47 GLU N N 132 122.107 119.301 2.806 1
1 469 . 14 1 1 A 48 48 PHE H H 133 8.920 8.688 0.232 1
1 470 . 14 1 1 A 48 48 PHE HA H 133 4.822 5.742 -0.920 1
1 475 . 14 1 1 A 48 48 PHE C C 133 175.499 174.520 0.979 1
1 476 . 14 1 1 A 48 48 PHE CA C 133 58.320 55.370 2.950 1
1 477 . 14 1 1 A 48 48 PHE CB C 133 39.175 41.711 -2.536 1
1 479 . 14 1 1 A 48 48 PHE N N 133 124.006 120.904 3.102 1
1 480 . 14 1 1 A 49 49 VAL H H 134 8.161 8.743 -0.582 1
1 481 . 14 1 1 A 49 49 VAL HA H 134 4.492 4.696 -0.204 1
1 489 . 14 1 1 A 49 49 VAL C C 134 176.241 177.035 -0.794 1
1 490 . 14 1 1 A 49 49 VAL CA C 134 60.328 59.636 0.692 1
1 491 . 14 1 1 A 49 49 VAL CB C 134 34.542 34.434 0.108 1
1 494 . 14 1 1 A 49 49 VAL N N 134 120.063 119.398 0.665 1
1 495 . 14 1 1 A 50 50 ASP H H 135 8.596 8.496 0.100 1
1 496 . 14 1 1 A 50 50 ASP HA H 135 4.278 4.408 -0.130 1
1 499 . 14 1 1 A 50 50 ASP C C 135 176.567 176.588 -0.021 1
1 500 . 14 1 1 A 50 50 ASP CA C 135 57.149 57.030 0.119 1
1 501 . 14 1 1 A 50 50 ASP CB C 135 40.477 40.742 -0.265 1
1 502 . 14 1 1 A 50 50 ASP N N 135 122.137 121.589 0.548 1
1 503 . 14 1 1 A 51 51 ASP H H 136 8.328 7.685 0.643 1
1 504 . 14 1 1 A 51 51 ASP HA H 136 4.656 5.136 -0.480 1
1 507 . 14 1 1 A 51 51 ASP C C 136 175.798 174.655 1.143 1
1 508 . 14 1 1 A 51 51 ASP CA C 136 53.458 53.322 0.136 1
1 509 . 14 1 1 A 51 51 ASP CB C 136 40.306 42.080 -1.774 1
1 510 . 14 1 1 A 51 51 ASP N N 136 116.158 116.817 -0.659 1
1 511 . 14 1 1 A 52 52 GLY H H 137 7.653 8.388 -0.735 1
1 512 . 14 1 1 A 52 52 GLY HA2 H 137 4.685 4.108 0.577 1
1 513 . 14 1 1 A 52 52 GLY HA3 H 137 4.069 4.114 -0.045 1
1 514 . 14 1 1 A 52 52 GLY C C 137 173.149 172.736 0.413 1
1 515 . 14 1 1 A 52 52 GLY CA C 137 45.860 44.199 1.661 1
1 516 . 14 1 1 A 52 52 GLY N N 137 107.634 111.641 -4.007 1
1 517 . 14 1 1 A 53 53 THR H H 138 8.445 8.241 0.204 1
1 518 . 14 1 1 A 53 53 THR HA H 138 4.996 5.113 -0.117 1
1 523 . 14 1 1 A 53 53 THR C C 138 174.163 173.293 0.870 1
1 524 . 14 1 1 A 53 53 THR CA C 138 60.974 61.625 -0.651 1
1 525 . 14 1 1 A 53 53 THR CB C 138 72.266 72.125 0.141 1
1 527 . 14 1 1 A 53 53 THR N N 138 114.976 114.899 0.077 1
1 528 . 14 1 1 A 54 54 GLU H H 139 8.917 8.972 -0.055 1
1 529 . 14 1 1 A 54 54 GLU HA H 139 5.205 4.825 0.380 1
1 534 . 14 1 1 A 54 54 GLU C C 139 175.700 175.201 0.499 1
1 535 . 14 1 1 A 54 54 GLU CA C 139 54.731 55.444 -0.713 1
1 536 . 14 1 1 A 54 54 GLU CB C 139 33.250 30.005 3.245 1
1 538 . 14 1 1 A 54 54 GLU N N 139 121.295 126.176 -4.881 1
1 539 . 14 1 1 A 55 55 THR H H 140 9.190 8.593 0.597 1
1 540 . 14 1 1 A 55 55 THR HA H 140 4.744 4.670 0.074 1
1 545 . 14 1 1 A 55 55 THR C C 140 174.537 173.896 0.641 1
1 546 . 14 1 1 A 55 55 THR CA C 140 62.678 61.440 1.238 1
1 547 . 14 1 1 A 55 55 THR CB C 140 69.744 68.982 0.762 1
1 549 . 14 1 1 A 55 55 THR N N 140 122.419 120.913 1.506 1
1 550 . 14 1 1 A 56 56 HIS H H 141 9.395 8.941 0.454 1
1 551 . 14 1 1 A 56 56 HIS HA H 141 5.204 5.053 0.151 1
1 556 . 14 1 1 A 56 56 HIS C C 141 174.675 174.800 -0.125 1
1 557 . 14 1 1 A 56 56 HIS CA C 141 55.557 53.913 1.644 1
1 558 . 14 1 1 A 56 56 HIS CB C 141 31.279 30.937 0.342 1
1 561 . 14 1 1 A 56 56 HIS N N 141 125.732 125.063 0.669 1
1 564 . 14 1 1 A 57 57 PHE H H 142 8.790 7.938 0.852 1
1 565 . 14 1 1 A 57 57 PHE HA H 142 4.918 6.068 -1.150 1
1 571 . 14 1 1 A 57 57 PHE C C 142 172.293 173.560 -1.267 1
1 572 . 14 1 1 A 57 57 PHE CA C 142 56.366 55.146 1.220 1
1 573 . 14 1 1 A 57 57 PHE CB C 142 39.962 42.798 -2.836 1
1 575 . 14 1 1 A 57 57 PHE N N 142 117.009 121.607 -4.598 1
1 576 . 14 1 1 A 58 58 SER H H 143 8.890 8.949 -0.059 1
1 577 . 14 1 1 A 58 58 SER HA H 143 5.286 5.331 -0.045 1
1 580 . 14 1 1 A 58 58 SER C C 143 173.716 174.469 -0.753 1
1 581 . 14 1 1 A 58 58 SER CA C 143 57.517 56.607 0.910 1
1 582 . 14 1 1 A 58 58 SER CB C 143 65.448 64.850 0.598 1
1 583 . 14 1 1 A 58 58 SER N N 143 115.269 115.002 0.267 1
1 584 . 14 1 1 A 59 59 VAL H H 144 7.737 8.865 -1.128 1
1 585 . 14 1 1 A 59 59 VAL HA H 144 4.220 4.510 -0.290 1
1 593 . 14 1 1 A 59 59 VAL C C 144 176.234 176.561 -0.327 1
1 594 . 14 1 1 A 59 59 VAL CA C 144 61.741 61.128 0.613 1
1 595 . 14 1 1 A 59 59 VAL CB C 144 33.711 33.996 -0.285 1
1 598 . 14 1 1 A 59 59 VAL N N 144 123.186 122.546 0.640 1
1 599 . 14 1 1 A 60 60 GLY H H 145 8.945 9.538 -0.593 1
1 600 . 14 1 1 A 60 60 GLY HA2 H 145 4.027 3.726 0.301 1
1 601 . 14 1 1 A 60 60 GLY HA3 H 145 3.692 3.778 -0.086 1
1 602 . 14 1 1 A 60 60 GLY C C 145 175.182 173.928 1.254 1
1 603 . 14 1 1 A 60 60 GLY CA C 145 47.141 46.452 0.689 1
1 604 . 14 1 1 A 60 60 GLY N N 145 116.908 117.147 -0.239 1
1 605 . 14 1 1 A 61 61 ASN H H 146 8.929 8.462 0.467 1
1 606 . 14 1 1 A 61 61 ASN HA H 146 4.718 4.446 0.272 1
1 611 . 14 1 1 A 61 61 ASN C C 146 174.706 175.524 -0.818 1
1 612 . 14 1 1 A 61 61 ASN CA C 146 52.802 54.634 -1.832 1
1 613 . 14 1 1 A 61 61 ASN CB C 146 37.917 38.096 -0.179 1
1 614 . 14 1 1 A 61 61 ASN N N 146 123.976 114.069 9.907 1
1 616 . 14 1 1 A 62 62 HIS H H 147 8.400 8.489 -0.089 1
1 617 . 14 1 1 A 62 62 HIS HA H 147 4.762 4.636 0.126 1
1 622 . 14 1 1 A 62 62 HIS C C 147 173.871 174.348 -0.477 1
1 623 . 14 1 1 A 62 62 HIS CA C 147 55.374 55.606 -0.232 1
1 624 . 14 1 1 A 62 62 HIS CB C 147 28.655 30.134 -1.479 1
1 628 . 14 1 1 A 62 62 HIS N N 147 118.620 115.229 3.391 1
1 631 . 14 1 1 A 63 63 ASP H H 148 8.734 8.179 0.555 1
1 632 . 14 1 1 A 63 63 ASP HA H 148 4.785 4.200 0.585 1
1 635 . 14 1 1 A 63 63 ASP C C 148 175.269 175.042 0.227 1
1 636 . 14 1 1 A 63 63 ASP CA C 148 54.390 55.226 -0.836 1
1 637 . 14 1 1 A 63 63 ASP CB C 148 42.105 39.719 2.386 1
1 638 . 14 1 1 A 63 63 ASP N N 148 125.336 118.882 6.454 1
1 639 . 14 1 1 A 64 64 CYS H H 149 8.225 8.086 0.139 1
1 640 . 14 1 1 A 64 64 CYS HA H 149 5.118 5.604 -0.486 1
1 643 . 14 1 1 A 64 64 CYS C C 149 173.740 172.783 0.957 1
1 644 . 14 1 1 A 64 64 CYS CA C 149 55.423 57.614 -2.191 1
1 645 . 14 1 1 A 64 64 CYS CB C 149 29.972 33.513 -3.541 1
1 646 . 14 1 1 A 64 64 CYS N N 149 124.476 122.405 2.071 1
1 647 . 14 1 1 A 65 65 TYR H H 150 8.916 8.467 0.449 1
1 648 . 14 1 1 A 65 65 TYR HA H 150 5.121 4.318 0.803 1
1 655 . 14 1 1 A 65 65 TYR C C 150 172.821 171.896 0.925 1
1 656 . 14 1 1 A 65 65 TYR CA C 150 56.347 56.119 0.228 1
1 657 . 14 1 1 A 65 65 TYR CB C 150 38.901 39.997 -1.096 1
1 662 . 14 1 1 A 65 65 TYR N N 150 115.313 118.131 -2.818 1
1 663 . 14 1 1 A 66 66 ILE H H 151 8.423 8.856 -0.433 1
1 664 . 14 1 1 A 66 66 ILE HA H 151 5.000 4.380 0.620 1
1 674 . 14 1 1 A 66 66 ILE C C 151 176.225 174.634 1.591 1
1 675 . 14 1 1 A 66 66 ILE CA C 151 57.798 60.017 -2.219 1
1 676 . 14 1 1 A 66 66 ILE CB C 151 39.863 38.760 1.103 1
1 680 . 14 1 1 A 66 66 ILE N N 151 118.575 121.550 -2.975 1
1 681 . 14 1 1 A 67 67 LYS H H 152 9.480 8.952 0.528 1
1 682 . 14 1 1 A 67 67 LYS HA H 152 5.091 4.726 0.365 1
1 691 . 14 1 1 A 67 67 LYS C C 152 174.079 175.270 -1.191 1
1 692 . 14 1 1 A 67 67 LYS CA C 152 54.728 56.091 -1.363 1
1 693 . 14 1 1 A 67 67 LYS CB C 152 35.256 33.162 2.094 1
1 697 . 14 1 1 A 67 67 LYS N N 152 132.311 128.656 3.655 1
1 698 . 14 1 1 A 68 68 ALA H H 153 8.844 8.458 0.386 1
1 699 . 14 1 1 A 68 68 ALA HA H 153 5.039 5.635 -0.596 1
1 703 . 14 1 1 A 68 68 ALA C C 153 176.587 176.239 0.348 1
1 704 . 14 1 1 A 68 68 ALA CA C 153 50.484 50.724 -0.240 1
1 705 . 14 1 1 A 68 68 ALA CB C 153 20.570 21.976 -1.406 1
1 706 . 14 1 1 A 68 68 ALA N N 153 129.958 130.245 -0.287 1
1 707 . 14 1 1 A 69 69 VAL H H 154 8.461 8.697 -0.236 1
1 708 . 14 1 1 A 69 69 VAL HA H 154 4.558 4.596 -0.038 1
1 716 . 14 1 1 A 69 69 VAL C C 154 175.331 175.019 0.312 1
1 717 . 14 1 1 A 69 69 VAL CA C 154 60.758 61.033 -0.275 1
1 718 . 14 1 1 A 69 69 VAL CB C 154 34.743 35.217 -0.474 1
1 721 . 14 1 1 A 69 69 VAL N N 154 121.496 121.753 -0.257 1
1 722 . 14 1 1 A 70 70 SER H H 155 8.695 8.981 -0.286 1
1 723 . 14 1 1 A 70 70 SER HA H 155 4.646 5.266 -0.620 1
1 726 . 14 1 1 A 70 70 SER C C 155 174.690 174.111 0.579 1
1 727 . 14 1 1 A 70 70 SER CA C 155 58.065 57.050 1.015 1
1 728 . 14 1 1 A 70 70 SER CB C 155 64.062 64.601 -0.539 1
1 729 . 14 1 1 A 70 70 SER N N 155 119.763 122.131 -2.368 1
1 730 . 14 1 1 A 71 71 SER H H 156 8.360 8.779 -0.419 1
1 731 . 14 1 1 A 71 71 SER HA H 156 4.430 5.158 -0.728 1
1 734 . 14 1 1 A 71 71 SER CA C 156 58.491 56.080 2.411 1
1 735 . 14 1 1 A 71 71 SER CB C 156 64.061 66.372 -2.311 1
1 736 . 14 1 1 A 71 71 SER N N 156 118.577 116.769 1.808 1
1 737 . 14 1 1 A 72 72 GLY H H 157 8.542 8.633 -0.091 1
1 738 . 14 1 1 A 72 72 GLY HA2 H 157 4.002 3.993 0.009 1
1 739 . 14 1 1 A 72 72 GLY HA3 H 157 4.002 3.994 0.008 1
1 740 . 14 1 1 A 72 72 GLY CA C 157 45.565 46.291 -0.726 1
1 741 . 14 1 1 A 72 72 GLY N N 157 111.540 111.178 0.362 1
1 742 . 14 1 1 A 73 73 LYS H H 158 8.369 8.515 -0.146 1
1 743 . 14 1 1 A 73 73 LYS CA C 158 56.720 58.502 -1.782 1
1 744 . 14 1 1 A 73 73 LYS CB C 158 32.915 31.814 1.101 1
1 747 . 14 1 1 A 73 73 LYS N N 158 120.293 121.879 -1.586 1
1 748 . 14 1 1 A 74 74 ARG H H 159 8.181 8.700 -0.519 1
1 749 . 14 1 1 A 74 74 ARG CA C 159 56.148 58.963 -2.815 1
1 751 . 14 1 1 A 74 74 ARG N N 159 119.343 122.476 -3.133 1
1 752 . 14 1 1 A 75 75 LYS H H 160 8.443 7.591 0.852 1
1 753 . 14 1 1 A 75 75 LYS HA H 160 4.067 4.715 -0.648 1
1 762 . 14 1 1 A 75 75 LYS C C 160 176.868 174.634 2.234 1
1 763 . 14 1 1 A 75 75 LYS CA C 160 57.711 55.578 2.133 1
1 764 . 14 1 1 A 75 75 LYS CB C 160 31.777 35.615 -3.838 1
1 768 . 14 1 1 A 75 75 LYS N N 160 120.467 114.740 5.727 1
1 769 . 14 1 1 A 76 76 GLU H H 161 8.693 8.662 0.031 1
1 770 . 14 1 1 A 76 76 GLU HA H 161 4.290 4.557 -0.267 1
1 771 . 14 1 1 A 76 76 GLU C C 161 176.844 175.639 1.205 1
1 772 . 14 1 1 A 76 76 GLU CA C 161 57.294 57.881 -0.587 1
1 773 . 14 1 1 A 76 76 GLU CB C 161 29.794 32.200 -2.406 1
1 775 . 14 1 1 A 76 76 GLU N N 161 118.767 120.847 -2.080 1
1 776 . 14 1 1 A 77 77 GLY H H 162 8.168 8.115 0.053 1
1 777 . 14 1 1 A 77 77 GLY HA2 H 162 4.010 4.324 -0.314 1
1 778 . 14 1 1 A 77 77 GLY HA3 H 162 3.963 4.324 -0.361 1
1 779 . 14 1 1 A 77 77 GLY C C 162 173.512 172.088 1.424 1
1 780 . 14 1 1 A 77 77 GLY CA C 162 45.362 44.821 0.541 1
1 781 . 14 1 1 A 77 77 GLY N N 162 108.621 107.329 1.292 1
1 782 . 14 1 1 A 78 78 ILE H H 163 7.954 9.257 -1.303 1
1 783 . 14 1 1 A 78 78 ILE HA H 163 4.323 4.940 -0.617 1
1 793 . 14 1 1 A 78 78 ILE C C 163 175.402 175.280 0.122 1
1 794 . 14 1 1 A 78 78 ILE CA C 163 60.632 59.946 0.686 1
1 795 . 14 1 1 A 78 78 ILE CB C 163 39.759 39.616 0.143 1
1 799 . 14 1 1 A 78 78 ILE N N 163 121.604 126.861 -5.257 1
1 800 . 14 1 1 A 79 79 ILE H H 164 8.514 9.055 -0.541 1
1 801 . 14 1 1 A 79 79 ILE HA H 164 4.341 4.867 -0.526 1
1 811 . 14 1 1 A 79 79 ILE C C 164 175.172 174.645 0.527 1
1 812 . 14 1 1 A 79 79 ILE CA C 164 60.027 59.885 0.142 1
1 813 . 14 1 1 A 79 79 ILE CB C 164 40.153 40.833 -0.680 1
1 817 . 14 1 1 A 79 79 ILE N N 164 127.137 126.767 0.370 1
1 818 . 14 1 1 A 80 80 HIS H H 165 8.492 8.997 -0.505 1
1 819 . 14 1 1 A 80 80 HIS HA H 165 5.676 5.436 0.240 1
1 824 . 14 1 1 A 80 80 HIS C C 165 175.502 174.752 0.750 1
1 825 . 14 1 1 A 80 80 HIS CA C 165 57.043 54.837 2.206 1
1 826 . 14 1 1 A 80 80 HIS CB C 165 32.741 32.503 0.238 1
1 829 . 14 1 1 A 80 80 HIS N N 165 125.422 126.276 -0.854 1
1 830 . 14 1 1 A 81 81 THR H H 166 9.080 9.105 -0.025 1
1 831 . 14 1 1 A 81 81 THR HA H 166 4.999 5.036 -0.037 1
1 836 . 14 1 1 A 81 81 THR C C 166 171.877 173.637 -1.760 1
1 837 . 14 1 1 A 81 81 THR CA C 166 59.924 61.437 -1.513 1
1 838 . 14 1 1 A 81 81 THR CB C 166 72.243 70.838 1.405 1
1 840 . 14 1 1 A 81 81 THR N N 166 117.682 115.987 1.695 1
1 841 . 14 1 1 A 82 82 LEU H H 167 8.062 8.076 -0.014 1
1 842 . 14 1 1 A 82 82 LEU HA H 167 4.350 3.914 0.436 1
1 852 . 14 1 1 A 82 82 LEU C C 167 172.705 174.895 -2.190 1
1 853 . 14 1 1 A 82 82 LEU CA C 167 53.553 55.583 -2.030 1
1 854 . 14 1 1 A 82 82 LEU CB C 167 39.768 41.345 -1.577 1
1 858 . 14 1 1 A 82 82 LEU N N 167 125.369 128.775 -3.406 1
1 859 . 14 1 1 A 83 83 ILE H H 168 8.657 8.221 0.436 1
1 860 . 14 1 1 A 83 83 ILE HA H 168 4.476 4.974 -0.498 1
1 870 . 14 1 1 A 83 83 ILE C C 168 175.159 174.187 0.972 1
1 871 . 14 1 1 A 83 83 ILE CA C 168 58.529 59.989 -1.460 1
1 872 . 14 1 1 A 83 83 ILE CB C 168 37.410 40.054 -2.644 1
1 876 . 14 1 1 A 83 83 ILE N N 168 128.042 127.197 0.845 1
1 877 . 14 1 1 A 84 84 VAL H H 169 8.464 8.498 -0.034 1
1 878 . 14 1 1 A 84 84 VAL HA H 169 4.284 4.487 -0.203 1
1 886 . 14 1 1 A 84 84 VAL C C 169 176.138 176.012 0.126 1
1 887 . 14 1 1 A 84 84 VAL CA C 169 61.029 61.172 -0.143 1
1 888 . 14 1 1 A 84 84 VAL CB C 169 34.714 34.044 0.670 1
1 891 . 14 1 1 A 84 84 VAL N N 169 124.644 126.800 -2.156 1
1 892 . 14 1 1 A 85 85 ASP H H 170 9.158 9.602 -0.444 1
1 893 . 14 1 1 A 85 85 ASP HA H 170 4.362 4.279 0.083 1
1 896 . 14 1 1 A 85 85 ASP C C 170 175.489 175.338 0.151 1
1 897 . 14 1 1 A 85 85 ASP CA C 170 55.868 55.185 0.683 1
1 898 . 14 1 1 A 85 85 ASP CB C 170 38.927 39.477 -0.550 1
1 899 . 14 1 1 A 85 85 ASP N N 170 129.061 127.858 1.203 1
1 900 . 14 1 1 A 86 86 ASN H H 171 8.811 8.416 0.395 1
1 901 . 14 1 1 A 86 86 ASN HA H 171 4.053 4.370 -0.317 1
1 906 . 14 1 1 A 86 86 ASN C C 171 173.802 173.897 -0.095 1
1 907 . 14 1 1 A 86 86 ASN CA C 171 55.173 54.325 0.848 1
1 908 . 14 1 1 A 86 86 ASN CB C 171 38.150 37.369 0.781 1
1 909 . 14 1 1 A 86 86 ASN N N 171 108.418 115.110 -6.692 1
1 911 . 14 1 1 A 87 87 ARG H H 172 7.914 7.504 0.410 1
1 912 . 14 1 1 A 87 87 ARG HA H 172 4.597 4.712 -0.115 1
1 919 . 14 1 1 A 87 87 ARG C C 172 174.025 174.891 -0.866 1
1 920 . 14 1 1 A 87 87 ARG CA C 172 54.846 54.086 0.760 1
1 921 . 14 1 1 A 87 87 ARG CB C 172 32.697 33.451 -0.754 1
1 924 . 14 1 1 A 87 87 ARG N N 172 120.988 117.522 3.466 1
1 925 . 14 1 1 A 88 88 GLU H H 173 8.534 8.635 -0.101 1
1 926 . 14 1 1 A 88 88 GLU HA H 173 4.560 4.280 0.280 1
1 931 . 14 1 1 A 88 88 GLU C C 173 176.187 175.677 0.510 1
1 932 . 14 1 1 A 88 88 GLU CA C 173 56.044 57.068 -1.024 1
1 933 . 14 1 1 A 88 88 GLU CB C 173 30.329 30.412 -0.083 1
1 935 . 14 1 1 A 88 88 GLU N N 173 123.982 123.668 0.314 1
1 936 . 14 1 1 A 89 89 ILE H H 174 8.897 8.029 0.868 1
1 937 . 14 1 1 A 89 89 ILE HA H 174 4.666 4.602 0.064 1
1 947 . 14 1 1 A 89 89 ILE C C 174 174.110 174.137 -0.027 1
1 948 . 14 1 1 A 89 89 ILE CA C 174 55.255 57.390 -2.135 1
1 949 . 14 1 1 A 89 89 ILE CB C 174 37.851 41.651 -3.800 1
1 953 . 14 1 1 A 89 89 ILE N N 174 130.008 126.219 3.789 1
1 954 . 14 1 1 A 90 90 PRO HA H 175 4.713 4.722 -0.009 1
1 961 . 14 1 1 A 90 90 PRO C C 175 176.956 176.477 0.479 1
1 962 . 14 1 1 A 90 90 PRO CA C 175 63.159 63.006 0.153 1
1 963 . 14 1 1 A 90 90 PRO CB C 175 32.428 32.520 -0.092 1
1 966 . 14 1 1 A 91 91 GLU H H 176 8.778 8.797 -0.019 1
1 967 . 14 1 1 A 91 91 GLU HA H 176 3.910 4.555 -0.645 1
1 972 . 14 1 1 A 91 91 GLU C C 176 176.426 177.239 -0.813 1
1 973 . 14 1 1 A 91 91 GLU CA C 176 56.738 56.276 0.462 1
1 974 . 14 1 1 A 91 91 GLU CB C 176 30.540 31.427 -0.887 1
1 976 . 14 1 1 A 91 91 GLU N N 176 124.561 122.109 2.452 1
1 977 . 14 1 1 A 92 92 LEU H H 177 8.630 8.184 0.446 1
1 978 . 14 1 1 A 92 92 LEU HA H 177 4.419 3.975 0.444 1
1 988 . 14 1 1 A 92 92 LEU C C 177 177.162 176.746 0.416 1
1 989 . 14 1 1 A 92 92 LEU CA C 177 55.350 57.984 -2.634 1
1 990 . 14 1 1 A 92 92 LEU CB C 177 42.390 41.564 0.826 1
1 994 . 14 1 1 A 92 92 LEU N N 177 126.683 126.940 -0.257 1
1 995 . 14 1 1 A 93 93 THR H H 178 8.375 7.395 0.980 1
1 996 . 14 1 1 A 93 93 THR HA H 178 4.359 4.168 0.191 1
1 1001 . 14 1 1 A 93 93 THR C C 178 173.589 174.703 -1.114 1
1 1002 . 14 1 1 A 93 93 THR CA C 178 61.621 62.154 -0.533 1
1 1003 . 14 1 1 A 93 93 THR CB C 178 69.724 69.670 0.054 1
1 1005 . 14 1 1 A 93 93 THR N N 178 119.699 110.178 9.521 1
1 1 . 15 1 1 A 9 9 SER H H 94 8.475 7.652 0.823 1
1 2 . 15 1 1 A 9 9 SER CA C 94 58.531 56.918 1.613 1
1 3 . 15 1 1 A 9 9 SER N N 94 117.432 113.173 4.259 1
1 4 . 15 1 1 A 10 10 LYS H H 95 8.527 8.641 -0.114 1
1 5 . 15 1 1 A 10 10 LYS C C 95 174.594 177.553 -2.959 1
1 6 . 15 1 1 A 10 10 LYS CA C 95 56.603 58.674 -2.071 1
1 7 . 15 1 1 A 10 10 LYS N N 95 123.104 127.219 -4.115 1
1 8 . 15 1 1 A 11 11 THR H H 96 8.245 7.833 0.412 1
1 9 . 15 1 1 A 11 11 THR C C 96 174.393 173.664 0.729 1
1 10 . 15 1 1 A 11 11 THR CA C 96 62.149 60.849 1.300 1
1 11 . 15 1 1 A 11 11 THR CB C 96 69.183 69.972 -0.789 1
1 13 . 15 1 1 A 11 11 THR N N 96 113.245 109.805 3.440 1
1 14 . 15 1 1 A 12 12 THR H H 97 7.769 7.041 0.728 1
1 15 . 15 1 1 A 12 12 THR HA H 97 5.583 4.856 0.727 1
1 20 . 15 1 1 A 12 12 THR C C 97 174.726 172.209 2.517 1
1 21 . 15 1 1 A 12 12 THR CA C 97 59.602 60.839 -1.237 1
1 22 . 15 1 1 A 12 12 THR CB C 97 72.805 71.369 1.436 1
1 24 . 15 1 1 A 12 12 THR N N 97 113.440 113.399 0.041 1
1 25 . 15 1 1 A 13 13 SER H H 98 8.593 8.600 -0.007 1
1 26 . 15 1 1 A 13 13 SER HA H 98 4.448 5.118 -0.670 1
1 29 . 15 1 1 A 13 13 SER C C 98 171.426 172.421 -0.995 1
1 30 . 15 1 1 A 13 13 SER CA C 98 59.056 57.004 2.052 1
1 31 . 15 1 1 A 13 13 SER CB C 98 67.839 65.184 2.655 1
1 32 . 15 1 1 A 13 13 SER N N 98 119.042 121.250 -2.208 1
1 33 . 15 1 1 A 14 14 THR H H 99 8.155 7.984 0.171 1
1 34 . 15 1 1 A 14 14 THR HA H 99 5.383 4.873 0.510 1
1 39 . 15 1 1 A 14 14 THR C C 99 171.565 173.078 -1.513 1
1 40 . 15 1 1 A 14 14 THR CA C 99 61.291 60.530 0.761 1
1 41 . 15 1 1 A 14 14 THR CB C 99 71.654 72.001 -0.347 1
1 43 . 15 1 1 A 14 14 THR N N 99 118.204 116.325 1.879 1
1 44 . 15 1 1 A 15 15 TRP H H 100 9.637 9.153 0.484 1
1 45 . 15 1 1 A 15 15 TRP HA H 100 4.807 5.214 -0.407 1
1 54 . 15 1 1 A 15 15 TRP C C 100 174.399 175.292 -0.893 1
1 55 . 15 1 1 A 15 15 TRP CA C 100 58.302 56.146 2.156 1
1 56 . 15 1 1 A 15 15 TRP CB C 100 34.810 33.012 1.798 1
1 63 . 15 1 1 A 15 15 TRP N N 100 125.132 123.067 2.065 1
1 65 . 15 1 1 A 16 16 VAL H H 101 8.863 9.025 -0.162 1
1 66 . 15 1 1 A 16 16 VAL HA H 101 5.267 4.713 0.554 1
1 74 . 15 1 1 A 16 16 VAL C C 101 174.955 175.402 -0.447 1
1 75 . 15 1 1 A 16 16 VAL CA C 101 60.653 61.927 -1.274 1
1 76 . 15 1 1 A 16 16 VAL CB C 101 34.284 32.757 1.527 1
1 79 . 15 1 1 A 16 16 VAL N N 101 119.527 124.056 -4.529 1
1 80 . 15 1 1 A 17 17 LEU H H 102 8.961 8.926 0.035 1
1 81 . 15 1 1 A 17 17 LEU HA H 102 4.729 5.076 -0.347 1
1 91 . 15 1 1 A 17 17 LEU C C 102 173.559 175.072 -1.513 1
1 92 . 15 1 1 A 17 17 LEU CA C 102 55.144 53.126 2.018 1
1 93 . 15 1 1 A 17 17 LEU CB C 102 42.948 45.921 -2.973 1
1 97 . 15 1 1 A 17 17 LEU N N 102 124.280 123.839 0.441 1
1 98 . 15 1 1 A 18 18 ARG H H 103 8.305 8.361 -0.056 1
1 99 . 15 1 1 A 18 18 ARG HA H 103 5.139 4.638 0.501 1
1 106 . 15 1 1 A 18 18 ARG C C 103 175.347 175.181 0.166 1
1 107 . 15 1 1 A 18 18 ARG CA C 103 54.793 56.091 -1.298 1
1 108 . 15 1 1 A 18 18 ARG CB C 103 31.347 29.718 1.629 1
1 111 . 15 1 1 A 18 18 ARG N N 103 122.020 120.123 1.897 1
1 112 . 15 1 1 A 19 19 LEU H H 104 8.676 8.758 -0.082 1
1 113 . 15 1 1 A 19 19 LEU HA H 104 4.482 4.802 -0.320 1
1 123 . 15 1 1 A 19 19 LEU C C 104 175.957 175.987 -0.030 1
1 124 . 15 1 1 A 19 19 LEU CA C 104 53.581 53.677 -0.096 1
1 125 . 15 1 1 A 19 19 LEU CB C 104 45.697 45.385 0.312 1
1 129 . 15 1 1 A 19 19 LEU N N 104 126.378 125.052 1.326 1
1 130 . 15 1 1 A 20 20 ASP H H 105 9.390 9.560 -0.170 1
1 131 . 15 1 1 A 20 20 ASP HA H 105 4.287 4.412 -0.125 1
1 134 . 15 1 1 A 20 20 ASP C C 105 175.947 175.438 0.509 1
1 135 . 15 1 1 A 20 20 ASP CA C 105 55.263 55.126 0.137 1
1 136 . 15 1 1 A 20 20 ASP CB C 105 39.239 39.940 -0.701 1
1 137 . 15 1 1 A 20 20 ASP N N 105 125.208 125.930 -0.722 1
1 138 . 15 1 1 A 21 21 GLY H H 106 8.563 8.650 -0.087 1
1 139 . 15 1 1 A 21 21 GLY HA2 H 106 4.126 3.841 0.285 1
1 140 . 15 1 1 A 21 21 GLY HA3 H 106 3.509 3.846 -0.337 1
1 141 . 15 1 1 A 21 21 GLY C C 106 173.164 173.703 -0.539 1
1 142 . 15 1 1 A 21 21 GLY CA C 106 45.499 45.545 -0.046 1
1 143 . 15 1 1 A 21 21 GLY N N 106 103.331 104.796 -1.465 1
1 144 . 15 1 1 A 22 22 GLU H H 107 7.713 8.000 -0.287 1
1 145 . 15 1 1 A 22 22 GLU HA H 107 4.634 4.922 -0.288 1
1 150 . 15 1 1 A 22 22 GLU C C 107 174.800 175.039 -0.239 1
1 151 . 15 1 1 A 22 22 GLU CA C 107 54.329 54.299 0.030 1
1 152 . 15 1 1 A 22 22 GLU CB C 107 32.832 34.062 -1.230 1
1 154 . 15 1 1 A 22 22 GLU N N 107 119.470 119.344 0.126 1
1 155 . 15 1 1 A 23 23 ASP H H 108 8.632 8.559 0.073 1
1 156 . 15 1 1 A 23 23 ASP HA H 108 4.872 4.712 0.160 1
1 159 . 15 1 1 A 23 23 ASP C C 108 175.533 175.605 -0.072 1
1 160 . 15 1 1 A 23 23 ASP CA C 108 55.180 53.930 1.250 1
1 161 . 15 1 1 A 23 23 ASP CB C 108 41.504 39.345 2.159 1
1 162 . 15 1 1 A 23 23 ASP N N 108 122.815 121.529 1.286 1
1 163 . 15 1 1 A 24 24 LEU H H 109 9.248 8.835 0.413 1
1 164 . 15 1 1 A 24 24 LEU HA H 109 4.836 4.547 0.289 1
1 174 . 15 1 1 A 24 24 LEU C C 109 174.322 175.784 -1.462 1
1 175 . 15 1 1 A 24 24 LEU CA C 109 54.473 55.148 -0.675 1
1 176 . 15 1 1 A 24 24 LEU CB C 109 44.718 42.642 2.076 1
1 180 . 15 1 1 A 24 24 LEU N N 109 125.550 126.626 -1.076 1
1 181 . 15 1 1 A 25 25 ARG H H 110 8.503 8.704 -0.201 1
1 182 . 15 1 1 A 25 25 ARG HA H 110 5.228 4.761 0.467 1
1 189 . 15 1 1 A 25 25 ARG C C 110 175.174 174.520 0.654 1
1 190 . 15 1 1 A 25 25 ARG CA C 110 54.745 54.932 -0.187 1
1 191 . 15 1 1 A 25 25 ARG CB C 110 31.701 31.476 0.225 1
1 194 . 15 1 1 A 25 25 ARG N N 110 125.424 127.447 -2.023 1
1 195 . 15 1 1 A 26 26 VAL H H 111 9.692 9.072 0.620 1
1 196 . 15 1 1 A 26 26 VAL HA H 111 5.091 4.977 0.114 1
1 204 . 15 1 1 A 26 26 VAL C C 111 174.446 175.270 -0.824 1
1 205 . 15 1 1 A 26 26 VAL CA C 111 61.055 61.995 -0.940 1
1 206 . 15 1 1 A 26 26 VAL CB C 111 33.780 33.046 0.734 1
1 209 . 15 1 1 A 26 26 VAL N N 111 130.649 127.387 3.262 1
1 210 . 15 1 1 A 27 27 VAL H H 112 9.401 8.990 0.411 1
1 211 . 15 1 1 A 27 27 VAL HA H 112 5.188 4.741 0.447 1
1 219 . 15 1 1 A 27 27 VAL C C 112 174.214 174.239 -0.025 1
1 220 . 15 1 1 A 27 27 VAL CA C 112 60.722 60.871 -0.149 1
1 221 . 15 1 1 A 27 27 VAL CB C 112 36.082 35.435 0.647 1
1 224 . 15 1 1 A 27 27 VAL N N 112 127.416 127.567 -0.151 1
1 225 . 15 1 1 A 28 28 LEU H H 113 9.265 9.172 0.093 1
1 226 . 15 1 1 A 28 28 LEU HA H 113 5.337 5.358 -0.021 1
1 236 . 15 1 1 A 28 28 LEU C C 113 175.915 174.895 1.020 1
1 237 . 15 1 1 A 28 28 LEU CA C 113 52.599 53.366 -0.767 1
1 238 . 15 1 1 A 28 28 LEU CB C 113 47.495 44.376 3.119 1
1 242 . 15 1 1 A 28 28 LEU N N 113 127.527 129.896 -2.369 1
1 243 . 15 1 1 A 29 29 GLU H H 114 8.968 8.529 0.439 1
1 244 . 15 1 1 A 29 29 GLU HA H 114 4.701 4.333 0.368 1
1 249 . 15 1 1 A 29 29 GLU C C 114 176.715 177.659 -0.944 1
1 250 . 15 1 1 A 29 29 GLU CA C 114 55.342 56.209 -0.867 1
1 251 . 15 1 1 A 29 29 GLU CB C 114 30.005 30.194 -0.189 1
1 253 . 15 1 1 A 29 29 GLU N N 114 127.374 127.363 0.011 1
1 254 . 15 1 1 A 30 30 LYS H H 115 8.243 8.548 -0.305 1
1 255 . 15 1 1 A 30 30 LYS HA H 115 3.711 4.125 -0.414 1
1 264 . 15 1 1 A 30 30 LYS C C 115 177.137 178.003 -0.866 1
1 265 . 15 1 1 A 30 30 LYS CA C 115 60.118 58.759 1.359 1
1 266 . 15 1 1 A 30 30 LYS CB C 115 32.656 32.063 0.593 1
1 270 . 15 1 1 A 30 30 LYS N N 115 124.225 124.777 -0.552 1
1 271 . 15 1 1 A 31 31 ASP H H 116 9.200 7.985 1.215 1
1 272 . 15 1 1 A 31 31 ASP HA H 116 4.444 4.417 0.027 1
1 275 . 15 1 1 A 31 31 ASP C C 116 177.774 177.117 0.657 1
1 276 . 15 1 1 A 31 31 ASP CA C 116 56.703 57.472 -0.769 1
1 277 . 15 1 1 A 31 31 ASP CB C 116 40.236 41.086 -0.850 1
1 278 . 15 1 1 A 31 31 ASP N N 116 115.955 119.840 -3.885 1
1 279 . 15 1 1 A 32 32 THR H H 117 7.352 7.268 0.084 1
1 280 . 15 1 1 A 32 32 THR HA H 117 4.266 4.613 -0.347 1
1 285 . 15 1 1 A 32 32 THR C C 117 175.320 174.173 1.147 1
1 286 . 15 1 1 A 32 32 THR CA C 117 61.171 60.569 0.602 1
1 287 . 15 1 1 A 32 32 THR CB C 117 70.221 69.178 1.043 1
1 289 . 15 1 1 A 32 32 THR N N 117 106.440 107.271 -0.831 1
1 290 . 15 1 1 A 33 33 MET H H 118 8.216 7.889 0.327 1
1 291 . 15 1 1 A 33 33 MET HA H 118 4.184 4.321 -0.137 1
1 299 . 15 1 1 A 33 33 MET C C 118 174.952 175.021 -0.069 1
1 300 . 15 1 1 A 33 33 MET CA C 118 55.195 57.051 -1.856 1
1 301 . 15 1 1 A 33 33 MET CB C 118 25.900 31.604 -5.704 1
1 304 . 15 1 1 A 33 33 MET N N 118 115.956 119.509 -3.553 1
1 305 . 15 1 1 A 34 34 ASP H H 119 7.509 7.897 -0.388 1
1 306 . 15 1 1 A 34 34 ASP HA H 119 4.486 4.830 -0.344 1
1 309 . 15 1 1 A 34 34 ASP C C 119 174.375 175.754 -1.379 1
1 310 . 15 1 1 A 34 34 ASP CA C 119 54.745 53.834 0.911 1
1 311 . 15 1 1 A 34 34 ASP CB C 119 42.865 42.567 0.298 1
1 312 . 15 1 1 A 34 34 ASP N N 119 118.500 118.522 -0.022 1
1 313 . 15 1 1 A 35 35 VAL H H 120 8.473 8.310 0.163 1
1 314 . 15 1 1 A 35 35 VAL HA H 120 4.709 4.790 -0.081 1
1 322 . 15 1 1 A 35 35 VAL C C 120 173.900 174.495 -0.595 1
1 323 . 15 1 1 A 35 35 VAL CA C 120 60.736 61.344 -0.608 1
1 324 . 15 1 1 A 35 35 VAL CB C 120 34.662 33.314 1.348 1
1 327 . 15 1 1 A 35 35 VAL N N 120 121.116 122.168 -1.052 1
1 328 . 15 1 1 A 36 36 TRP H H 121 9.404 9.054 0.350 1
1 329 . 15 1 1 A 36 36 TRP HA H 121 5.174 5.539 -0.365 1
1 338 . 15 1 1 A 36 36 TRP C C 121 176.480 174.449 2.031 1
1 339 . 15 1 1 A 36 36 TRP CA C 121 55.070 55.097 -0.027 1
1 340 . 15 1 1 A 36 36 TRP CB C 121 32.179 32.576 -0.397 1
1 348 . 15 1 1 A 36 36 TRP N N 121 126.924 129.047 -2.123 1
1 350 . 15 1 1 A 37 37 CYS H H 122 9.230 8.492 0.738 1
1 351 . 15 1 1 A 37 37 CYS HA H 122 5.417 5.177 0.240 1
1 354 . 15 1 1 A 37 37 CYS C C 122 175.346 174.252 1.094 1
1 355 . 15 1 1 A 37 37 CYS CA C 122 57.083 57.800 -0.717 1
1 356 . 15 1 1 A 37 37 CYS CB C 122 28.713 30.633 -1.920 1
1 357 . 15 1 1 A 37 37 CYS N N 122 120.375 124.895 -4.520 1
1 358 . 15 1 1 A 38 38 ASN H H 123 9.817 9.190 0.627 1
1 359 . 15 1 1 A 38 38 ASN HA H 123 4.637 4.268 0.369 1
1 364 . 15 1 1 A 38 38 ASN C C 123 175.526 175.133 0.393 1
1 365 . 15 1 1 A 38 38 ASN CA C 123 54.023 54.361 -0.338 1
1 366 . 15 1 1 A 38 38 ASN CB C 123 36.581 37.320 -0.739 1
1 367 . 15 1 1 A 38 38 ASN N N 123 129.408 124.395 5.013 1
1 369 . 15 1 1 A 39 39 GLY H H 124 9.092 8.018 1.074 1
1 370 . 15 1 1 A 39 39 GLY HA2 H 124 4.241 2.686 1.555 1
1 371 . 15 1 1 A 39 39 GLY HA3 H 124 3.705 3.607 0.098 1
1 372 . 15 1 1 A 39 39 GLY C C 124 173.405 173.602 -0.197 1
1 373 . 15 1 1 A 39 39 GLY CA C 124 45.595 46.378 -0.783 1
1 374 . 15 1 1 A 39 39 GLY N N 124 102.752 103.431 -0.679 1
1 375 . 15 1 1 A 40 40 GLN H H 125 8.006 6.975 1.031 1
1 376 . 15 1 1 A 40 40 GLN HA H 125 4.736 4.830 -0.094 1
1 383 . 15 1 1 A 40 40 GLN C C 125 174.477 174.686 -0.209 1
1 384 . 15 1 1 A 40 40 GLN CA C 125 53.747 54.834 -1.087 1
1 385 . 15 1 1 A 40 40 GLN CB C 125 30.413 31.344 -0.931 1
1 387 . 15 1 1 A 40 40 GLN N N 125 120.627 118.929 1.698 1
1 389 . 15 1 1 A 41 41 LYS H H 126 8.757 8.709 0.048 1
1 390 . 15 1 1 A 41 41 LYS HA H 126 3.464 4.528 -1.064 1
1 399 . 15 1 1 A 41 41 LYS C C 126 176.870 176.696 0.174 1
1 400 . 15 1 1 A 41 41 LYS CA C 126 57.136 56.830 0.306 1
1 401 . 15 1 1 A 41 41 LYS CB C 126 31.669 32.443 -0.774 1
1 405 . 15 1 1 A 41 41 LYS N N 126 129.107 126.847 2.260 1
1 406 . 15 1 1 A 42 42 MET H H 127 8.682 8.719 -0.037 1
1 407 . 15 1 1 A 42 42 MET HA H 127 4.712 4.472 0.240 1
1 415 . 15 1 1 A 42 42 MET C C 127 176.816 175.532 1.284 1
1 416 . 15 1 1 A 42 42 MET CA C 127 52.958 55.735 -2.777 1
1 417 . 15 1 1 A 42 42 MET CB C 127 33.023 33.605 -0.582 1
1 420 . 15 1 1 A 42 42 MET N N 127 126.569 124.673 1.896 1
1 421 . 15 1 1 A 43 43 GLU H H 128 8.734 8.746 -0.012 1
1 422 . 15 1 1 A 43 43 GLU HA H 128 4.419 5.047 -0.628 1
1 427 . 15 1 1 A 43 43 GLU C C 128 176.531 176.283 0.248 1
1 428 . 15 1 1 A 43 43 GLU CA C 128 56.475 55.071 1.404 1
1 429 . 15 1 1 A 43 43 GLU CB C 128 29.604 31.532 -1.928 1
1 431 . 15 1 1 A 43 43 GLU N N 128 123.734 120.780 2.954 1
1 432 . 15 1 1 A 44 44 THR H H 129 8.263 8.829 -0.566 1
1 433 . 15 1 1 A 44 44 THR HA H 129 5.385 5.560 -0.175 1
1 438 . 15 1 1 A 44 44 THR C C 129 174.205 173.855 0.350 1
1 439 . 15 1 1 A 44 44 THR CA C 129 59.160 60.353 -1.193 1
1 440 . 15 1 1 A 44 44 THR CB C 129 72.419 71.435 0.984 1
1 442 . 15 1 1 A 44 44 THR N N 129 115.081 116.703 -1.622 1
1 443 . 15 1 1 A 45 45 ALA H H 130 8.727 9.007 -0.280 1
1 444 . 15 1 1 A 45 45 ALA HA H 130 4.749 4.911 -0.162 1
1 448 . 15 1 1 A 45 45 ALA C C 130 177.017 176.762 0.255 1
1 449 . 15 1 1 A 45 45 ALA CA C 130 51.645 50.578 1.067 1
1 450 . 15 1 1 A 45 45 ALA CB C 130 21.364 20.132 1.232 1
1 451 . 15 1 1 A 45 45 ALA N N 130 123.243 123.064 0.179 1
1 452 . 15 1 1 A 46 46 GLY H H 131 8.818 8.729 0.089 1
1 453 . 15 1 1 A 46 46 GLY HA2 H 131 4.941 3.976 0.965 1
1 454 . 15 1 1 A 46 46 GLY HA3 H 131 3.690 3.983 -0.293 1
1 455 . 15 1 1 A 46 46 GLY C C 131 173.528 172.760 0.768 1
1 456 . 15 1 1 A 46 46 GLY CA C 131 45.060 45.752 -0.692 1
1 457 . 15 1 1 A 46 46 GLY N N 131 112.392 110.847 1.545 1
1 458 . 15 1 1 A 47 47 GLU H H 132 8.746 8.692 0.054 1
1 459 . 15 1 1 A 47 47 GLU HA H 132 4.584 4.588 -0.004 1
1 464 . 15 1 1 A 47 47 GLU C C 132 175.223 175.376 -0.153 1
1 465 . 15 1 1 A 47 47 GLU CA C 132 55.008 55.703 -0.695 1
1 466 . 15 1 1 A 47 47 GLU CB C 132 32.939 32.538 0.401 1
1 468 . 15 1 1 A 47 47 GLU N N 132 122.107 123.684 -1.577 1
1 469 . 15 1 1 A 48 48 PHE H H 133 8.920 8.629 0.291 1
1 470 . 15 1 1 A 48 48 PHE HA H 133 4.822 4.718 0.104 1
1 475 . 15 1 1 A 48 48 PHE C C 133 175.499 175.509 -0.010 1
1 476 . 15 1 1 A 48 48 PHE CA C 133 58.320 56.646 1.674 1
1 477 . 15 1 1 A 48 48 PHE CB C 133 39.175 39.856 -0.681 1
1 479 . 15 1 1 A 48 48 PHE N N 133 124.006 123.935 0.071 1
1 480 . 15 1 1 A 49 49 VAL H H 134 8.161 8.934 -0.773 1
1 481 . 15 1 1 A 49 49 VAL HA H 134 4.492 4.630 -0.138 1
1 489 . 15 1 1 A 49 49 VAL C C 134 176.241 175.839 0.402 1
1 490 . 15 1 1 A 49 49 VAL CA C 134 60.328 59.221 1.107 1
1 491 . 15 1 1 A 49 49 VAL CB C 134 34.542 35.658 -1.116 1
1 494 . 15 1 1 A 49 49 VAL N N 134 120.063 115.970 4.093 1
1 495 . 15 1 1 A 50 50 ASP H H 135 8.596 8.810 -0.214 1
1 496 . 15 1 1 A 50 50 ASP HA H 135 4.278 4.477 -0.199 1
1 499 . 15 1 1 A 50 50 ASP C C 135 176.567 176.584 -0.017 1
1 500 . 15 1 1 A 50 50 ASP CA C 135 57.149 56.735 0.414 1
1 501 . 15 1 1 A 50 50 ASP CB C 135 40.477 40.449 0.028 1
1 502 . 15 1 1 A 50 50 ASP N N 135 122.137 121.688 0.449 1
1 503 . 15 1 1 A 51 51 ASP H H 136 8.328 7.891 0.437 1
1 504 . 15 1 1 A 51 51 ASP HA H 136 4.656 4.780 -0.124 1
1 507 . 15 1 1 A 51 51 ASP C C 136 175.798 176.668 -0.870 1
1 508 . 15 1 1 A 51 51 ASP CA C 136 53.458 55.698 -2.240 1
1 509 . 15 1 1 A 51 51 ASP CB C 136 40.306 42.087 -1.781 1
1 510 . 15 1 1 A 51 51 ASP N N 136 116.158 117.544 -1.386 1
1 511 . 15 1 1 A 52 52 GLY H H 137 7.653 7.748 -0.095 1
1 512 . 15 1 1 A 52 52 GLY HA2 H 137 4.685 4.141 0.544 1
1 513 . 15 1 1 A 52 52 GLY HA3 H 137 4.069 4.149 -0.080 1
1 514 . 15 1 1 A 52 52 GLY C C 137 173.149 172.467 0.682 1
1 515 . 15 1 1 A 52 52 GLY CA C 137 45.860 45.411 0.449 1
1 516 . 15 1 1 A 52 52 GLY N N 137 107.634 104.697 2.937 1
1 517 . 15 1 1 A 53 53 THR H H 138 8.445 8.171 0.274 1
1 518 . 15 1 1 A 53 53 THR HA H 138 4.996 5.240 -0.244 1
1 523 . 15 1 1 A 53 53 THR C C 138 174.163 173.495 0.668 1
1 524 . 15 1 1 A 53 53 THR CA C 138 60.974 61.490 -0.516 1
1 525 . 15 1 1 A 53 53 THR CB C 138 72.266 71.761 0.505 1
1 527 . 15 1 1 A 53 53 THR N N 138 114.976 116.003 -1.027 1
1 528 . 15 1 1 A 54 54 GLU H H 139 8.917 9.124 -0.207 1
1 529 . 15 1 1 A 54 54 GLU HA H 139 5.205 4.815 0.390 1
1 534 . 15 1 1 A 54 54 GLU C C 139 175.700 175.448 0.252 1
1 535 . 15 1 1 A 54 54 GLU CA C 139 54.731 55.704 -0.973 1
1 536 . 15 1 1 A 54 54 GLU CB C 139 33.250 29.898 3.352 1
1 538 . 15 1 1 A 54 54 GLU N N 139 121.295 126.563 -5.268 1
1 539 . 15 1 1 A 55 55 THR H H 140 9.190 8.790 0.400 1
1 540 . 15 1 1 A 55 55 THR HA H 140 4.744 4.645 0.099 1
1 545 . 15 1 1 A 55 55 THR C C 140 174.537 174.070 0.467 1
1 546 . 15 1 1 A 55 55 THR CA C 140 62.678 62.071 0.607 1
1 547 . 15 1 1 A 55 55 THR CB C 140 69.744 68.862 0.882 1
1 549 . 15 1 1 A 55 55 THR N N 140 122.419 120.195 2.224 1
1 550 . 15 1 1 A 56 56 HIS H H 141 9.395 9.109 0.286 1
1 551 . 15 1 1 A 56 56 HIS HA H 141 5.204 4.989 0.215 1
1 556 . 15 1 1 A 56 56 HIS C C 141 174.675 174.417 0.258 1
1 557 . 15 1 1 A 56 56 HIS CA C 141 55.557 53.881 1.676 1
1 558 . 15 1 1 A 56 56 HIS CB C 141 31.279 30.849 0.430 1
1 561 . 15 1 1 A 56 56 HIS N N 141 125.732 125.055 0.677 1
1 564 . 15 1 1 A 57 57 PHE H H 142 8.790 8.147 0.643 1
1 565 . 15 1 1 A 57 57 PHE HA H 142 4.918 5.853 -0.935 1
1 571 . 15 1 1 A 57 57 PHE C C 142 172.293 174.408 -2.115 1
1 572 . 15 1 1 A 57 57 PHE CA C 142 56.366 55.494 0.872 1
1 573 . 15 1 1 A 57 57 PHE CB C 142 39.962 41.767 -1.805 1
1 575 . 15 1 1 A 57 57 PHE N N 142 117.009 121.287 -4.278 1
1 576 . 15 1 1 A 58 58 SER H H 143 8.890 8.982 -0.092 1
1 577 . 15 1 1 A 58 58 SER HA H 143 5.286 4.848 0.438 1
1 580 . 15 1 1 A 58 58 SER C C 143 173.716 174.552 -0.836 1
1 581 . 15 1 1 A 58 58 SER CA C 143 57.517 57.755 -0.238 1
1 582 . 15 1 1 A 58 58 SER CB C 143 65.448 64.648 0.800 1
1 583 . 15 1 1 A 58 58 SER N N 143 115.269 118.553 -3.284 1
1 584 . 15 1 1 A 59 59 VAL H H 144 7.737 8.387 -0.650 1
1 585 . 15 1 1 A 59 59 VAL HA H 144 4.220 4.443 -0.223 1
1 593 . 15 1 1 A 59 59 VAL C C 144 176.234 176.108 0.126 1
1 594 . 15 1 1 A 59 59 VAL CA C 144 61.741 60.926 0.815 1
1 595 . 15 1 1 A 59 59 VAL CB C 144 33.711 33.998 -0.287 1
1 598 . 15 1 1 A 59 59 VAL N N 144 123.186 122.140 1.046 1
1 599 . 15 1 1 A 60 60 GLY H H 145 8.945 9.013 -0.068 1
1 600 . 15 1 1 A 60 60 GLY HA2 H 145 4.027 3.728 0.299 1
1 601 . 15 1 1 A 60 60 GLY HA3 H 145 3.692 3.782 -0.090 1
1 602 . 15 1 1 A 60 60 GLY C C 145 175.182 174.789 0.393 1
1 603 . 15 1 1 A 60 60 GLY CA C 145 47.141 47.301 -0.160 1
1 604 . 15 1 1 A 60 60 GLY N N 145 116.908 117.529 -0.621 1
1 605 . 15 1 1 A 61 61 ASN H H 146 8.929 8.442 0.487 1
1 606 . 15 1 1 A 61 61 ASN HA H 146 4.718 4.813 -0.095 1
1 611 . 15 1 1 A 61 61 ASN C C 146 174.706 174.057 0.649 1
1 612 . 15 1 1 A 61 61 ASN CA C 146 52.802 52.159 0.643 1
1 613 . 15 1 1 A 61 61 ASN CB C 146 37.917 38.580 -0.663 1
1 614 . 15 1 1 A 61 61 ASN N N 146 123.976 124.540 -0.564 1
1 616 . 15 1 1 A 62 62 HIS H H 147 8.400 7.749 0.651 1
1 617 . 15 1 1 A 62 62 HIS HA H 147 4.762 5.130 -0.368 1
1 622 . 15 1 1 A 62 62 HIS C C 147 173.871 173.075 0.796 1
1 623 . 15 1 1 A 62 62 HIS CA C 147 55.374 54.853 0.521 1
1 624 . 15 1 1 A 62 62 HIS CB C 147 28.655 34.112 -5.457 1
1 628 . 15 1 1 A 62 62 HIS N N 147 118.620 118.566 0.054 1
1 631 . 15 1 1 A 63 63 ASP H H 148 8.734 8.896 -0.162 1
1 632 . 15 1 1 A 63 63 ASP HA H 148 4.785 5.434 -0.649 1
1 635 . 15 1 1 A 63 63 ASP C C 148 175.269 174.819 0.450 1
1 636 . 15 1 1 A 63 63 ASP CA C 148 54.390 52.655 1.735 1
1 637 . 15 1 1 A 63 63 ASP CB C 148 42.105 44.219 -2.114 1
1 638 . 15 1 1 A 63 63 ASP N N 148 125.336 120.282 5.054 1
1 639 . 15 1 1 A 64 64 CYS H H 149 8.225 9.025 -0.800 1
1 640 . 15 1 1 A 64 64 CYS HA H 149 5.118 5.289 -0.171 1
1 643 . 15 1 1 A 64 64 CYS C C 149 173.740 172.613 1.127 1
1 644 . 15 1 1 A 64 64 CYS CA C 149 55.423 56.664 -1.241 1
1 645 . 15 1 1 A 64 64 CYS CB C 149 29.972 31.868 -1.896 1
1 646 . 15 1 1 A 64 64 CYS N N 149 124.476 123.671 0.805 1
1 647 . 15 1 1 A 65 65 TYR H H 150 8.916 8.677 0.239 1
1 648 . 15 1 1 A 65 65 TYR HA H 150 5.121 4.478 0.643 1
1 655 . 15 1 1 A 65 65 TYR C C 150 172.821 172.203 0.618 1
1 656 . 15 1 1 A 65 65 TYR CA C 150 56.347 55.357 0.990 1
1 657 . 15 1 1 A 65 65 TYR CB C 150 38.901 41.190 -2.289 1
1 662 . 15 1 1 A 65 65 TYR N N 150 115.313 117.820 -2.507 1
1 663 . 15 1 1 A 66 66 ILE H H 151 8.423 9.337 -0.914 1
1 664 . 15 1 1 A 66 66 ILE HA H 151 5.000 4.408 0.592 1
1 674 . 15 1 1 A 66 66 ILE C C 151 176.225 174.651 1.574 1
1 675 . 15 1 1 A 66 66 ILE CA C 151 57.798 60.146 -2.348 1
1 676 . 15 1 1 A 66 66 ILE CB C 151 39.863 38.892 0.971 1
1 680 . 15 1 1 A 66 66 ILE N N 151 118.575 120.907 -2.332 1
1 681 . 15 1 1 A 67 67 LYS H H 152 9.480 8.780 0.700 1
1 682 . 15 1 1 A 67 67 LYS HA H 152 5.091 4.768 0.323 1
1 691 . 15 1 1 A 67 67 LYS C C 152 174.079 175.304 -1.225 1
1 692 . 15 1 1 A 67 67 LYS CA C 152 54.728 56.133 -1.405 1
1 693 . 15 1 1 A 67 67 LYS CB C 152 35.256 33.169 2.087 1
1 697 . 15 1 1 A 67 67 LYS N N 152 132.311 128.636 3.675 1
1 698 . 15 1 1 A 68 68 ALA H H 153 8.844 8.611 0.233 1
1 699 . 15 1 1 A 68 68 ALA HA H 153 5.039 5.459 -0.420 1
1 703 . 15 1 1 A 68 68 ALA C C 153 176.587 176.133 0.454 1
1 704 . 15 1 1 A 68 68 ALA CA C 153 50.484 50.633 -0.149 1
1 705 . 15 1 1 A 68 68 ALA CB C 153 20.570 21.941 -1.371 1
1 706 . 15 1 1 A 68 68 ALA N N 153 129.958 130.105 -0.147 1
1 707 . 15 1 1 A 69 69 VAL H H 154 8.461 8.580 -0.119 1
1 708 . 15 1 1 A 69 69 VAL HA H 154 4.558 4.581 -0.023 1
1 716 . 15 1 1 A 69 69 VAL C C 154 175.331 175.199 0.132 1
1 717 . 15 1 1 A 69 69 VAL CA C 154 60.758 61.045 -0.287 1
1 718 . 15 1 1 A 69 69 VAL CB C 154 34.743 35.243 -0.500 1
1 721 . 15 1 1 A 69 69 VAL N N 154 121.496 121.550 -0.054 1
1 722 . 15 1 1 A 70 70 SER H H 155 8.695 9.024 -0.329 1
1 723 . 15 1 1 A 70 70 SER HA H 155 4.646 5.128 -0.482 1
1 726 . 15 1 1 A 70 70 SER C C 155 174.690 173.830 0.860 1
1 727 . 15 1 1 A 70 70 SER CA C 155 58.065 56.938 1.127 1
1 728 . 15 1 1 A 70 70 SER CB C 155 64.062 64.841 -0.779 1
1 729 . 15 1 1 A 70 70 SER N N 155 119.763 122.125 -2.362 1
1 730 . 15 1 1 A 71 71 SER H H 156 8.360 8.922 -0.562 1
1 731 . 15 1 1 A 71 71 SER HA H 156 4.430 5.364 -0.934 1
1 734 . 15 1 1 A 71 71 SER CA C 156 58.491 57.256 1.235 1
1 735 . 15 1 1 A 71 71 SER CB C 156 64.061 67.046 -2.985 1
1 736 . 15 1 1 A 71 71 SER N N 156 118.577 117.908 0.669 1
1 737 . 15 1 1 A 72 72 GLY H H 157 8.542 8.356 0.186 1
1 738 . 15 1 1 A 72 72 GLY HA2 H 157 4.002 4.186 -0.184 1
1 739 . 15 1 1 A 72 72 GLY HA3 H 157 4.002 4.186 -0.184 1
1 740 . 15 1 1 A 72 72 GLY CA C 157 45.565 44.027 1.538 1
1 741 . 15 1 1 A 72 72 GLY N N 157 111.540 110.723 0.817 1
1 742 . 15 1 1 A 73 73 LYS H H 158 8.369 8.785 -0.416 1
1 743 . 15 1 1 A 73 73 LYS CA C 158 56.720 58.969 -2.249 1
1 744 . 15 1 1 A 73 73 LYS CB C 158 32.915 32.197 0.718 1
1 747 . 15 1 1 A 73 73 LYS N N 158 120.293 121.164 -0.871 1
1 748 . 15 1 1 A 74 74 ARG H H 159 8.181 7.868 0.313 1
1 749 . 15 1 1 A 74 74 ARG CA C 159 56.148 57.195 -1.047 1
1 751 . 15 1 1 A 74 74 ARG N N 159 119.343 116.838 2.505 1
1 752 . 15 1 1 A 75 75 LYS H H 160 8.443 7.847 0.596 1
1 753 . 15 1 1 A 75 75 LYS HA H 160 4.067 4.598 -0.531 1
1 762 . 15 1 1 A 75 75 LYS C C 160 176.868 176.864 0.004 1
1 763 . 15 1 1 A 75 75 LYS CA C 160 57.711 55.303 2.408 1
1 764 . 15 1 1 A 75 75 LYS CB C 160 31.777 33.516 -1.739 1
1 768 . 15 1 1 A 75 75 LYS N N 160 120.467 117.469 2.998 1
1 769 . 15 1 1 A 76 76 GLU H H 161 8.693 8.152 0.541 1
1 770 . 15 1 1 A 76 76 GLU HA H 161 4.290 3.994 0.296 1
1 771 . 15 1 1 A 76 76 GLU C C 161 176.844 176.366 0.478 1
1 772 . 15 1 1 A 76 76 GLU CA C 161 57.294 59.711 -2.417 1
1 773 . 15 1 1 A 76 76 GLU CB C 161 29.794 30.298 -0.504 1
1 775 . 15 1 1 A 76 76 GLU N N 161 118.767 120.953 -2.186 1
1 776 . 15 1 1 A 77 77 GLY H H 162 8.168 7.654 0.514 1
1 777 . 15 1 1 A 77 77 GLY HA2 H 162 4.010 4.161 -0.151 1
1 778 . 15 1 1 A 77 77 GLY HA3 H 162 3.963 4.167 -0.204 1
1 779 . 15 1 1 A 77 77 GLY C C 162 173.512 171.725 1.787 1
1 780 . 15 1 1 A 77 77 GLY CA C 162 45.362 44.761 0.601 1
1 781 . 15 1 1 A 77 77 GLY N N 162 108.621 106.199 2.422 1
1 782 . 15 1 1 A 78 78 ILE H H 163 7.954 8.737 -0.783 1
1 783 . 15 1 1 A 78 78 ILE HA H 163 4.323 4.861 -0.538 1
1 793 . 15 1 1 A 78 78 ILE C C 163 175.402 175.149 0.253 1
1 794 . 15 1 1 A 78 78 ILE CA C 163 60.632 59.167 1.465 1
1 795 . 15 1 1 A 78 78 ILE CB C 163 39.759 41.464 -1.705 1
1 799 . 15 1 1 A 78 78 ILE N N 163 121.604 123.383 -1.779 1
1 800 . 15 1 1 A 79 79 ILE H H 164 8.514 8.590 -0.076 1
1 801 . 15 1 1 A 79 79 ILE HA H 164 4.341 4.936 -0.595 1
1 811 . 15 1 1 A 79 79 ILE C C 164 175.172 174.726 0.446 1
1 812 . 15 1 1 A 79 79 ILE CA C 164 60.027 59.978 0.049 1
1 813 . 15 1 1 A 79 79 ILE CB C 164 40.153 41.457 -1.304 1
1 817 . 15 1 1 A 79 79 ILE N N 164 127.137 125.782 1.355 1
1 818 . 15 1 1 A 80 80 HIS H H 165 8.492 9.047 -0.555 1
1 819 . 15 1 1 A 80 80 HIS HA H 165 5.676 5.687 -0.011 1
1 824 . 15 1 1 A 80 80 HIS C C 165 175.502 174.198 1.304 1
1 825 . 15 1 1 A 80 80 HIS CA C 165 57.043 54.622 2.421 1
1 826 . 15 1 1 A 80 80 HIS CB C 165 32.741 33.791 -1.050 1
1 829 . 15 1 1 A 80 80 HIS N N 165 125.422 125.349 0.073 1
1 830 . 15 1 1 A 81 81 THR H H 166 9.080 9.484 -0.404 1
1 831 . 15 1 1 A 81 81 THR HA H 166 4.999 4.987 0.012 1
1 836 . 15 1 1 A 81 81 THR C C 166 171.877 172.776 -0.899 1
1 837 . 15 1 1 A 81 81 THR CA C 166 59.924 60.785 -0.861 1
1 838 . 15 1 1 A 81 81 THR CB C 166 72.243 71.021 1.222 1
1 840 . 15 1 1 A 81 81 THR N N 166 117.682 115.630 2.052 1
1 841 . 15 1 1 A 82 82 LEU H H 167 8.062 8.049 0.013 1
1 842 . 15 1 1 A 82 82 LEU HA H 167 4.350 4.015 0.335 1
1 852 . 15 1 1 A 82 82 LEU C C 167 172.705 174.857 -2.152 1
1 853 . 15 1 1 A 82 82 LEU CA C 167 53.553 55.116 -1.563 1
1 854 . 15 1 1 A 82 82 LEU CB C 167 39.768 41.489 -1.721 1
1 858 . 15 1 1 A 82 82 LEU N N 167 125.369 127.673 -2.304 1
1 859 . 15 1 1 A 83 83 ILE H H 168 8.657 8.264 0.393 1
1 860 . 15 1 1 A 83 83 ILE HA H 168 4.476 5.017 -0.541 1
1 870 . 15 1 1 A 83 83 ILE C C 168 175.159 174.362 0.797 1
1 871 . 15 1 1 A 83 83 ILE CA C 168 58.529 60.166 -1.637 1
1 872 . 15 1 1 A 83 83 ILE CB C 168 37.410 40.257 -2.847 1
1 876 . 15 1 1 A 83 83 ILE N N 168 128.042 127.561 0.481 1
1 877 . 15 1 1 A 84 84 VAL H H 169 8.464 8.428 0.036 1
1 878 . 15 1 1 A 84 84 VAL HA H 169 4.284 4.452 -0.168 1
1 886 . 15 1 1 A 84 84 VAL C C 169 176.138 175.951 0.187 1
1 887 . 15 1 1 A 84 84 VAL CA C 169 61.029 61.394 -0.365 1
1 888 . 15 1 1 A 84 84 VAL CB C 169 34.714 34.005 0.709 1
1 891 . 15 1 1 A 84 84 VAL N N 169 124.644 126.972 -2.328 1
1 892 . 15 1 1 A 85 85 ASP H H 170 9.158 9.210 -0.052 1
1 893 . 15 1 1 A 85 85 ASP HA H 170 4.362 4.264 0.098 1
1 896 . 15 1 1 A 85 85 ASP C C 170 175.489 175.075 0.414 1
1 897 . 15 1 1 A 85 85 ASP CA C 170 55.868 55.163 0.705 1
1 898 . 15 1 1 A 85 85 ASP CB C 170 38.927 39.437 -0.510 1
1 899 . 15 1 1 A 85 85 ASP N N 170 129.061 127.475 1.586 1
1 900 . 15 1 1 A 86 86 ASN H H 171 8.811 8.476 0.335 1
1 901 . 15 1 1 A 86 86 ASN HA H 171 4.053 4.352 -0.299 1
1 906 . 15 1 1 A 86 86 ASN C C 171 173.802 173.768 0.034 1
1 907 . 15 1 1 A 86 86 ASN CA C 171 55.173 54.605 0.568 1
1 908 . 15 1 1 A 86 86 ASN CB C 171 38.150 36.680 1.470 1
1 909 . 15 1 1 A 86 86 ASN N N 171 108.418 109.196 -0.778 1
1 911 . 15 1 1 A 87 87 ARG H H 172 7.914 7.495 0.419 1
1 912 . 15 1 1 A 87 87 ARG HA H 172 4.597 4.672 -0.075 1
1 919 . 15 1 1 A 87 87 ARG C C 172 174.025 174.815 -0.790 1
1 920 . 15 1 1 A 87 87 ARG CA C 172 54.846 54.120 0.726 1
1 921 . 15 1 1 A 87 87 ARG CB C 172 32.697 33.473 -0.776 1
1 924 . 15 1 1 A 87 87 ARG N N 172 120.988 117.545 3.443 1
1 925 . 15 1 1 A 88 88 GLU H H 173 8.534 8.730 -0.196 1
1 926 . 15 1 1 A 88 88 GLU HA H 173 4.560 4.358 0.202 1
1 931 . 15 1 1 A 88 88 GLU C C 173 176.187 175.454 0.733 1
1 932 . 15 1 1 A 88 88 GLU CA C 173 56.044 56.860 -0.816 1
1 933 . 15 1 1 A 88 88 GLU CB C 173 30.329 30.370 -0.041 1
1 935 . 15 1 1 A 88 88 GLU N N 173 123.982 124.279 -0.297 1
1 936 . 15 1 1 A 89 89 ILE H H 174 8.897 8.075 0.822 1
1 937 . 15 1 1 A 89 89 ILE HA H 174 4.666 4.543 0.123 1
1 947 . 15 1 1 A 89 89 ILE C C 174 174.110 174.259 -0.149 1
1 948 . 15 1 1 A 89 89 ILE CA C 174 55.255 57.342 -2.087 1
1 949 . 15 1 1 A 89 89 ILE CB C 174 37.851 41.580 -3.729 1
1 953 . 15 1 1 A 89 89 ILE N N 174 130.008 127.280 2.728 1
1 954 . 15 1 1 A 90 90 PRO HA H 175 4.713 4.683 0.030 1
1 961 . 15 1 1 A 90 90 PRO C C 175 176.956 176.406 0.550 1
1 962 . 15 1 1 A 90 90 PRO CA C 175 63.159 62.826 0.333 1
1 963 . 15 1 1 A 90 90 PRO CB C 175 32.428 32.159 0.269 1
1 966 . 15 1 1 A 91 91 GLU H H 176 8.778 8.804 -0.026 1
1 967 . 15 1 1 A 91 91 GLU HA H 176 3.910 4.825 -0.915 1
1 972 . 15 1 1 A 91 91 GLU C C 176 176.426 177.216 -0.790 1
1 973 . 15 1 1 A 91 91 GLU CA C 176 56.738 56.234 0.504 1
1 974 . 15 1 1 A 91 91 GLU CB C 176 30.540 31.632 -1.092 1
1 976 . 15 1 1 A 91 91 GLU N N 176 124.561 122.040 2.521 1
1 977 . 15 1 1 A 92 92 LEU H H 177 8.630 8.624 0.006 1
1 978 . 15 1 1 A 92 92 LEU HA H 177 4.419 3.991 0.428 1
1 988 . 15 1 1 A 92 92 LEU C C 177 177.162 176.772 0.390 1
1 989 . 15 1 1 A 92 92 LEU CA C 177 55.350 58.229 -2.879 1
1 990 . 15 1 1 A 92 92 LEU CB C 177 42.390 41.584 0.806 1
1 994 . 15 1 1 A 92 92 LEU N N 177 126.683 127.474 -0.791 1
1 995 . 15 1 1 A 93 93 THR H H 178 8.375 7.340 1.035 1
1 996 . 15 1 1 A 93 93 THR HA H 178 4.359 4.263 0.096 1
1 1001 . 15 1 1 A 93 93 THR C C 178 173.589 174.635 -1.046 1
1 1002 . 15 1 1 A 93 93 THR CA C 178 61.621 62.250 -0.629 1
1 1003 . 15 1 1 A 93 93 THR CB C 178 69.724 69.078 0.646 1
1 1005 . 15 1 1 A 93 93 THR N N 178 119.699 108.558 11.141 1
1 1 . 16 1 1 A 9 9 SER H H 94 8.475 7.709 0.766 1
1 2 . 16 1 1 A 9 9 SER CA C 94 58.531 57.052 1.479 1
1 3 . 16 1 1 A 9 9 SER N N 94 117.432 115.740 1.692 1
1 4 . 16 1 1 A 10 10 LYS H H 95 8.527 7.655 0.872 1
1 5 . 16 1 1 A 10 10 LYS C C 95 174.594 174.223 0.371 1
1 6 . 16 1 1 A 10 10 LYS CA C 95 56.603 55.586 1.017 1
1 7 . 16 1 1 A 10 10 LYS N N 95 123.104 117.779 5.325 1
1 8 . 16 1 1 A 11 11 THR H H 96 8.245 8.972 -0.727 1
1 9 . 16 1 1 A 11 11 THR C C 96 174.393 172.418 1.975 1
1 10 . 16 1 1 A 11 11 THR CA C 96 62.149 60.732 1.417 1
1 11 . 16 1 1 A 11 11 THR CB C 96 69.183 71.444 -2.261 1
1 13 . 16 1 1 A 11 11 THR N N 96 113.245 119.835 -6.590 1
1 14 . 16 1 1 A 12 12 THR H H 97 7.769 8.868 -1.099 1
1 15 . 16 1 1 A 12 12 THR HA H 97 5.583 4.996 0.587 1
1 20 . 16 1 1 A 12 12 THR C C 97 174.726 172.099 2.627 1
1 21 . 16 1 1 A 12 12 THR CA C 97 59.602 60.876 -1.274 1
1 22 . 16 1 1 A 12 12 THR CB C 97 72.805 71.591 1.214 1
1 24 . 16 1 1 A 12 12 THR N N 97 113.440 119.694 -6.254 1
1 25 . 16 1 1 A 13 13 SER H H 98 8.593 8.740 -0.147 1
1 26 . 16 1 1 A 13 13 SER HA H 98 4.448 5.063 -0.615 1
1 29 . 16 1 1 A 13 13 SER C C 98 171.426 172.537 -1.111 1
1 30 . 16 1 1 A 13 13 SER CA C 98 59.056 56.976 2.080 1
1 31 . 16 1 1 A 13 13 SER CB C 98 67.839 64.819 3.020 1
1 32 . 16 1 1 A 13 13 SER N N 98 119.042 120.805 -1.763 1
1 33 . 16 1 1 A 14 14 THR H H 99 8.155 7.996 0.159 1
1 34 . 16 1 1 A 14 14 THR HA H 99 5.383 4.963 0.420 1
1 39 . 16 1 1 A 14 14 THR C C 99 171.565 172.734 -1.169 1
1 40 . 16 1 1 A 14 14 THR CA C 99 61.291 60.307 0.984 1
1 41 . 16 1 1 A 14 14 THR CB C 99 71.654 72.218 -0.564 1
1 43 . 16 1 1 A 14 14 THR N N 99 118.204 115.916 2.288 1
1 44 . 16 1 1 A 15 15 TRP H H 100 9.637 8.991 0.646 1
1 45 . 16 1 1 A 15 15 TRP HA H 100 4.807 5.085 -0.278 1
1 54 . 16 1 1 A 15 15 TRP C C 100 174.399 175.280 -0.881 1
1 55 . 16 1 1 A 15 15 TRP CA C 100 58.302 56.197 2.105 1
1 56 . 16 1 1 A 15 15 TRP CB C 100 34.810 33.535 1.275 1
1 63 . 16 1 1 A 15 15 TRP N N 100 125.132 122.837 2.295 1
1 65 . 16 1 1 A 16 16 VAL H H 101 8.863 9.013 -0.150 1
1 66 . 16 1 1 A 16 16 VAL HA H 101 5.267 4.795 0.472 1
1 74 . 16 1 1 A 16 16 VAL C C 101 174.955 175.335 -0.380 1
1 75 . 16 1 1 A 16 16 VAL CA C 101 60.653 61.617 -0.964 1
1 76 . 16 1 1 A 16 16 VAL CB C 101 34.284 32.811 1.473 1
1 79 . 16 1 1 A 16 16 VAL N N 101 119.527 123.466 -3.939 1
1 80 . 16 1 1 A 17 17 LEU H H 102 8.961 8.925 0.036 1
1 81 . 16 1 1 A 17 17 LEU HA H 102 4.729 5.085 -0.356 1
1 91 . 16 1 1 A 17 17 LEU C C 102 173.559 175.025 -1.466 1
1 92 . 16 1 1 A 17 17 LEU CA C 102 55.144 53.135 2.009 1
1 93 . 16 1 1 A 17 17 LEU CB C 102 42.948 45.886 -2.938 1
1 97 . 16 1 1 A 17 17 LEU N N 102 124.280 123.619 0.661 1
1 98 . 16 1 1 A 18 18 ARG H H 103 8.305 8.340 -0.035 1
1 99 . 16 1 1 A 18 18 ARG HA H 103 5.139 4.616 0.523 1
1 106 . 16 1 1 A 18 18 ARG C C 103 175.347 175.221 0.126 1
1 107 . 16 1 1 A 18 18 ARG CA C 103 54.793 56.267 -1.474 1
1 108 . 16 1 1 A 18 18 ARG CB C 103 31.347 29.462 1.885 1
1 111 . 16 1 1 A 18 18 ARG N N 103 122.020 120.897 1.123 1
1 112 . 16 1 1 A 19 19 LEU H H 104 8.676 8.734 -0.058 1
1 113 . 16 1 1 A 19 19 LEU HA H 104 4.482 4.773 -0.291 1
1 123 . 16 1 1 A 19 19 LEU C C 104 175.957 175.787 0.170 1
1 124 . 16 1 1 A 19 19 LEU CA C 104 53.581 53.752 -0.171 1
1 125 . 16 1 1 A 19 19 LEU CB C 104 45.697 45.294 0.403 1
1 129 . 16 1 1 A 19 19 LEU N N 104 126.378 125.395 0.983 1
1 130 . 16 1 1 A 20 20 ASP H H 105 9.390 9.588 -0.198 1
1 131 . 16 1 1 A 20 20 ASP HA H 105 4.287 4.385 -0.098 1
1 134 . 16 1 1 A 20 20 ASP C C 105 175.947 175.895 0.052 1
1 135 . 16 1 1 A 20 20 ASP CA C 105 55.263 55.302 -0.039 1
1 136 . 16 1 1 A 20 20 ASP CB C 105 39.239 39.334 -0.095 1
1 137 . 16 1 1 A 20 20 ASP N N 105 125.208 125.905 -0.697 1
1 138 . 16 1 1 A 21 21 GLY H H 106 8.563 8.651 -0.088 1
1 139 . 16 1 1 A 21 21 GLY HA2 H 106 4.126 3.842 0.284 1
1 140 . 16 1 1 A 21 21 GLY HA3 H 106 3.509 3.846 -0.337 1
1 141 . 16 1 1 A 21 21 GLY C C 106 173.164 173.716 -0.552 1
1 142 . 16 1 1 A 21 21 GLY CA C 106 45.499 45.500 -0.001 1
1 143 . 16 1 1 A 21 21 GLY N N 106 103.331 104.126 -0.795 1
1 144 . 16 1 1 A 22 22 GLU H H 107 7.713 7.992 -0.279 1
1 145 . 16 1 1 A 22 22 GLU HA H 107 4.634 4.919 -0.285 1
1 150 . 16 1 1 A 22 22 GLU C C 107 174.800 174.847 -0.047 1
1 151 . 16 1 1 A 22 22 GLU CA C 107 54.329 54.297 0.032 1
1 152 . 16 1 1 A 22 22 GLU CB C 107 32.832 34.093 -1.261 1
1 154 . 16 1 1 A 22 22 GLU N N 107 119.470 119.385 0.085 1
1 155 . 16 1 1 A 23 23 ASP H H 108 8.632 8.516 0.116 1
1 156 . 16 1 1 A 23 23 ASP HA H 108 4.872 4.705 0.167 1
1 159 . 16 1 1 A 23 23 ASP C C 108 175.533 175.736 -0.203 1
1 160 . 16 1 1 A 23 23 ASP CA C 108 55.180 53.814 1.366 1
1 161 . 16 1 1 A 23 23 ASP CB C 108 41.504 39.374 2.130 1
1 162 . 16 1 1 A 23 23 ASP N N 108 122.815 120.998 1.817 1
1 163 . 16 1 1 A 24 24 LEU H H 109 9.248 8.809 0.439 1
1 164 . 16 1 1 A 24 24 LEU HA H 109 4.836 4.431 0.405 1
1 174 . 16 1 1 A 24 24 LEU C C 109 174.322 175.860 -1.538 1
1 175 . 16 1 1 A 24 24 LEU CA C 109 54.473 55.525 -1.052 1
1 176 . 16 1 1 A 24 24 LEU CB C 109 44.718 42.494 2.224 1
1 180 . 16 1 1 A 24 24 LEU N N 109 125.550 126.859 -1.309 1
1 181 . 16 1 1 A 25 25 ARG H H 110 8.503 8.696 -0.193 1
1 182 . 16 1 1 A 25 25 ARG HA H 110 5.228 4.749 0.479 1
1 189 . 16 1 1 A 25 25 ARG C C 110 175.174 174.391 0.783 1
1 190 . 16 1 1 A 25 25 ARG CA C 110 54.745 54.887 -0.142 1
1 191 . 16 1 1 A 25 25 ARG CB C 110 31.701 31.507 0.194 1
1 194 . 16 1 1 A 25 25 ARG N N 110 125.424 127.805 -2.381 1
1 195 . 16 1 1 A 26 26 VAL H H 111 9.692 9.114 0.578 1
1 196 . 16 1 1 A 26 26 VAL HA H 111 5.091 4.956 0.135 1
1 204 . 16 1 1 A 26 26 VAL C C 111 174.446 175.385 -0.939 1
1 205 . 16 1 1 A 26 26 VAL CA C 111 61.055 61.987 -0.932 1
1 206 . 16 1 1 A 26 26 VAL CB C 111 33.780 33.038 0.742 1
1 209 . 16 1 1 A 26 26 VAL N N 111 130.649 127.285 3.364 1
1 210 . 16 1 1 A 27 27 VAL H H 112 9.401 8.978 0.423 1
1 211 . 16 1 1 A 27 27 VAL HA H 112 5.188 4.733 0.455 1
1 219 . 16 1 1 A 27 27 VAL C C 112 174.214 174.134 0.080 1
1 220 . 16 1 1 A 27 27 VAL CA C 112 60.722 61.023 -0.301 1
1 221 . 16 1 1 A 27 27 VAL CB C 112 36.082 35.001 1.081 1
1 224 . 16 1 1 A 27 27 VAL N N 112 127.416 127.593 -0.177 1
1 225 . 16 1 1 A 28 28 LEU H H 113 9.265 9.219 0.046 1
1 226 . 16 1 1 A 28 28 LEU HA H 113 5.337 5.359 -0.022 1
1 236 . 16 1 1 A 28 28 LEU C C 113 175.915 174.856 1.059 1
1 237 . 16 1 1 A 28 28 LEU CA C 113 52.599 53.305 -0.706 1
1 238 . 16 1 1 A 28 28 LEU CB C 113 47.495 44.992 2.503 1
1 242 . 16 1 1 A 28 28 LEU N N 113 127.527 129.978 -2.451 1
1 243 . 16 1 1 A 29 29 GLU H H 114 8.968 8.614 0.354 1
1 244 . 16 1 1 A 29 29 GLU HA H 114 4.701 4.471 0.230 1
1 249 . 16 1 1 A 29 29 GLU C C 114 176.715 177.871 -1.156 1
1 250 . 16 1 1 A 29 29 GLU CA C 114 55.342 56.077 -0.735 1
1 251 . 16 1 1 A 29 29 GLU CB C 114 30.005 30.979 -0.974 1
1 253 . 16 1 1 A 29 29 GLU N N 114 127.374 127.390 -0.016 1
1 254 . 16 1 1 A 30 30 LYS H H 115 8.243 8.508 -0.265 1
1 255 . 16 1 1 A 30 30 LYS HA H 115 3.711 4.171 -0.460 1
1 264 . 16 1 1 A 30 30 LYS C C 115 177.137 178.110 -0.973 1
1 265 . 16 1 1 A 30 30 LYS CA C 115 60.118 58.718 1.400 1
1 266 . 16 1 1 A 30 30 LYS CB C 115 32.656 32.256 0.400 1
1 270 . 16 1 1 A 30 30 LYS N N 115 124.225 126.398 -2.173 1
1 271 . 16 1 1 A 31 31 ASP H H 116 9.200 8.170 1.030 1
1 272 . 16 1 1 A 31 31 ASP HA H 116 4.444 4.476 -0.032 1
1 275 . 16 1 1 A 31 31 ASP C C 116 177.774 177.334 0.440 1
1 276 . 16 1 1 A 31 31 ASP CA C 116 56.703 57.390 -0.687 1
1 277 . 16 1 1 A 31 31 ASP CB C 116 40.236 40.236 0.000 1
1 278 . 16 1 1 A 31 31 ASP N N 116 115.955 118.799 -2.844 1
1 279 . 16 1 1 A 32 32 THR H H 117 7.352 7.544 -0.192 1
1 280 . 16 1 1 A 32 32 THR HA H 117 4.266 4.617 -0.351 1
1 285 . 16 1 1 A 32 32 THR C C 117 175.320 173.921 1.399 1
1 286 . 16 1 1 A 32 32 THR CA C 117 61.171 61.306 -0.135 1
1 287 . 16 1 1 A 32 32 THR CB C 117 70.221 69.810 0.411 1
1 289 . 16 1 1 A 32 32 THR N N 117 106.440 108.834 -2.394 1
1 290 . 16 1 1 A 33 33 MET H H 118 8.216 7.934 0.282 1
1 291 . 16 1 1 A 33 33 MET HA H 118 4.184 4.419 -0.235 1
1 299 . 16 1 1 A 33 33 MET C C 118 174.952 174.924 0.028 1
1 300 . 16 1 1 A 33 33 MET CA C 118 55.195 56.864 -1.669 1
1 301 . 16 1 1 A 33 33 MET CB C 118 25.900 31.248 -5.348 1
1 304 . 16 1 1 A 33 33 MET N N 118 115.956 117.027 -1.071 1
1 305 . 16 1 1 A 34 34 ASP H H 119 7.509 8.079 -0.570 1
1 306 . 16 1 1 A 34 34 ASP HA H 119 4.486 4.737 -0.251 1
1 309 . 16 1 1 A 34 34 ASP C C 119 174.375 175.659 -1.284 1
1 310 . 16 1 1 A 34 34 ASP CA C 119 54.745 54.821 -0.076 1
1 311 . 16 1 1 A 34 34 ASP CB C 119 42.865 41.726 1.139 1
1 312 . 16 1 1 A 34 34 ASP N N 119 118.500 119.084 -0.584 1
1 313 . 16 1 1 A 35 35 VAL H H 120 8.473 8.753 -0.280 1
1 314 . 16 1 1 A 35 35 VAL HA H 120 4.709 4.630 0.079 1
1 322 . 16 1 1 A 35 35 VAL C C 120 173.900 174.427 -0.527 1
1 323 . 16 1 1 A 35 35 VAL CA C 120 60.736 61.273 -0.537 1
1 324 . 16 1 1 A 35 35 VAL CB C 120 34.662 33.090 1.572 1
1 327 . 16 1 1 A 35 35 VAL N N 120 121.116 122.218 -1.102 1
1 328 . 16 1 1 A 36 36 TRP H H 121 9.404 9.618 -0.214 1
1 329 . 16 1 1 A 36 36 TRP HA H 121 5.174 5.302 -0.128 1
1 338 . 16 1 1 A 36 36 TRP C C 121 176.480 174.744 1.736 1
1 339 . 16 1 1 A 36 36 TRP CA C 121 55.070 55.534 -0.464 1
1 340 . 16 1 1 A 36 36 TRP CB C 121 32.179 32.948 -0.769 1
1 348 . 16 1 1 A 36 36 TRP N N 121 126.924 129.741 -2.817 1
1 350 . 16 1 1 A 37 37 CYS H H 122 9.230 9.281 -0.051 1
1 351 . 16 1 1 A 37 37 CYS HA H 122 5.417 4.841 0.576 1
1 354 . 16 1 1 A 37 37 CYS C C 122 175.346 174.847 0.499 1
1 355 . 16 1 1 A 37 37 CYS CA C 122 57.083 57.793 -0.710 1
1 356 . 16 1 1 A 37 37 CYS CB C 122 28.713 29.607 -0.894 1
1 357 . 16 1 1 A 37 37 CYS N N 122 120.375 126.163 -5.788 1
1 358 . 16 1 1 A 38 38 ASN H H 123 9.817 8.467 1.350 1
1 359 . 16 1 1 A 38 38 ASN HA H 123 4.637 4.221 0.416 1
1 364 . 16 1 1 A 38 38 ASN C C 123 175.526 174.952 0.574 1
1 365 . 16 1 1 A 38 38 ASN CA C 123 54.023 53.593 0.430 1
1 366 . 16 1 1 A 38 38 ASN CB C 123 36.581 36.066 0.515 1
1 367 . 16 1 1 A 38 38 ASN N N 123 129.408 123.495 5.913 1
1 369 . 16 1 1 A 39 39 GLY H H 124 9.092 7.907 1.185 1
1 370 . 16 1 1 A 39 39 GLY HA2 H 124 4.241 3.704 0.537 1
1 371 . 16 1 1 A 39 39 GLY HA3 H 124 3.705 3.826 -0.121 1
1 372 . 16 1 1 A 39 39 GLY C C 124 173.405 173.889 -0.484 1
1 373 . 16 1 1 A 39 39 GLY CA C 124 45.595 46.766 -1.171 1
1 374 . 16 1 1 A 39 39 GLY N N 124 102.752 107.107 -4.355 1
1 375 . 16 1 1 A 40 40 GLN H H 125 8.006 7.716 0.290 1
1 376 . 16 1 1 A 40 40 GLN HA H 125 4.736 4.839 -0.103 1
1 383 . 16 1 1 A 40 40 GLN C C 125 174.477 174.468 0.009 1
1 384 . 16 1 1 A 40 40 GLN CA C 125 53.747 55.130 -1.383 1
1 385 . 16 1 1 A 40 40 GLN CB C 125 30.413 30.927 -0.514 1
1 387 . 16 1 1 A 40 40 GLN N N 125 120.627 119.091 1.536 1
1 389 . 16 1 1 A 41 41 LYS H H 126 8.757 8.823 -0.066 1
1 390 . 16 1 1 A 41 41 LYS HA H 126 3.464 4.428 -0.964 1
1 399 . 16 1 1 A 41 41 LYS C C 126 176.870 175.514 1.356 1
1 400 . 16 1 1 A 41 41 LYS CA C 126 57.136 57.172 -0.036 1
1 401 . 16 1 1 A 41 41 LYS CB C 126 31.669 33.088 -1.419 1
1 405 . 16 1 1 A 41 41 LYS N N 126 129.107 126.705 2.402 1
1 406 . 16 1 1 A 42 42 MET H H 127 8.682 8.710 -0.028 1
1 407 . 16 1 1 A 42 42 MET HA H 127 4.712 5.274 -0.562 1
1 415 . 16 1 1 A 42 42 MET C C 127 176.816 174.324 2.492 1
1 416 . 16 1 1 A 42 42 MET CA C 127 52.958 53.725 -0.767 1
1 417 . 16 1 1 A 42 42 MET CB C 127 33.023 37.117 -4.094 1
1 420 . 16 1 1 A 42 42 MET N N 127 126.569 117.878 8.691 1
1 421 . 16 1 1 A 43 43 GLU H H 128 8.734 8.752 -0.018 1
1 422 . 16 1 1 A 43 43 GLU HA H 128 4.419 5.130 -0.711 1
1 427 . 16 1 1 A 43 43 GLU C C 128 176.531 176.767 -0.236 1
1 428 . 16 1 1 A 43 43 GLU CA C 128 56.475 55.132 1.343 1
1 429 . 16 1 1 A 43 43 GLU CB C 128 29.604 31.517 -1.913 1
1 431 . 16 1 1 A 43 43 GLU N N 128 123.734 120.370 3.364 1
1 432 . 16 1 1 A 44 44 THR H H 129 8.263 8.941 -0.678 1
1 433 . 16 1 1 A 44 44 THR HA H 129 5.385 5.304 0.081 1
1 438 . 16 1 1 A 44 44 THR C C 129 174.205 174.929 -0.724 1
1 439 . 16 1 1 A 44 44 THR CA C 129 59.160 60.429 -1.269 1
1 440 . 16 1 1 A 44 44 THR CB C 129 72.419 71.459 0.960 1
1 442 . 16 1 1 A 44 44 THR N N 129 115.081 118.109 -3.028 1
1 443 . 16 1 1 A 45 45 ALA H H 130 8.727 8.280 0.447 1
1 444 . 16 1 1 A 45 45 ALA HA H 130 4.749 4.261 0.488 1
1 448 . 16 1 1 A 45 45 ALA C C 130 177.017 178.059 -1.042 1
1 449 . 16 1 1 A 45 45 ALA CA C 130 51.645 52.612 -0.967 1
1 450 . 16 1 1 A 45 45 ALA CB C 130 21.364 20.134 1.230 1
1 451 . 16 1 1 A 45 45 ALA N N 130 123.243 123.165 0.078 1
1 452 . 16 1 1 A 46 46 GLY H H 131 8.818 8.354 0.464 1
1 453 . 16 1 1 A 46 46 GLY HA2 H 131 4.941 3.984 0.957 1
1 454 . 16 1 1 A 46 46 GLY HA3 H 131 3.690 4.001 -0.311 1
1 455 . 16 1 1 A 46 46 GLY C C 131 173.528 174.388 -0.860 1
1 456 . 16 1 1 A 46 46 GLY CA C 131 45.060 46.943 -1.883 1
1 457 . 16 1 1 A 46 46 GLY N N 131 112.392 106.905 5.487 1
1 458 . 16 1 1 A 47 47 GLU H H 132 8.746 7.857 0.889 1
1 459 . 16 1 1 A 47 47 GLU HA H 132 4.584 4.873 -0.289 1
1 464 . 16 1 1 A 47 47 GLU C C 132 175.223 175.251 -0.028 1
1 465 . 16 1 1 A 47 47 GLU CA C 132 55.008 54.873 0.135 1
1 466 . 16 1 1 A 47 47 GLU CB C 132 32.939 32.400 0.539 1
1 468 . 16 1 1 A 47 47 GLU N N 132 122.107 119.437 2.670 1
1 469 . 16 1 1 A 48 48 PHE H H 133 8.920 9.193 -0.273 1
1 470 . 16 1 1 A 48 48 PHE HA H 133 4.822 5.108 -0.286 1
1 475 . 16 1 1 A 48 48 PHE C C 133 175.499 175.874 -0.375 1
1 476 . 16 1 1 A 48 48 PHE CA C 133 58.320 57.449 0.871 1
1 477 . 16 1 1 A 48 48 PHE CB C 133 39.175 40.368 -1.193 1
1 479 . 16 1 1 A 48 48 PHE N N 133 124.006 122.620 1.386 1
1 480 . 16 1 1 A 49 49 VAL H H 134 8.161 8.356 -0.195 1
1 481 . 16 1 1 A 49 49 VAL HA H 134 4.492 4.550 -0.058 1
1 489 . 16 1 1 A 49 49 VAL C C 134 176.241 176.893 -0.652 1
1 490 . 16 1 1 A 49 49 VAL CA C 134 60.328 60.488 -0.160 1
1 491 . 16 1 1 A 49 49 VAL CB C 134 34.542 34.375 0.167 1
1 494 . 16 1 1 A 49 49 VAL N N 134 120.063 122.723 -2.660 1
1 495 . 16 1 1 A 50 50 ASP H H 135 8.596 8.666 -0.070 1
1 496 . 16 1 1 A 50 50 ASP HA H 135 4.278 4.385 -0.107 1
1 499 . 16 1 1 A 50 50 ASP C C 135 176.567 176.120 0.447 1
1 500 . 16 1 1 A 50 50 ASP CA C 135 57.149 56.923 0.226 1
1 501 . 16 1 1 A 50 50 ASP CB C 135 40.477 40.737 -0.260 1
1 502 . 16 1 1 A 50 50 ASP N N 135 122.137 122.803 -0.666 1
1 503 . 16 1 1 A 51 51 ASP H H 136 8.328 7.787 0.541 1
1 504 . 16 1 1 A 51 51 ASP HA H 136 4.656 5.057 -0.401 1
1 507 . 16 1 1 A 51 51 ASP C C 136 175.798 174.598 1.200 1
1 508 . 16 1 1 A 51 51 ASP CA C 136 53.458 53.471 -0.013 1
1 509 . 16 1 1 A 51 51 ASP CB C 136 40.306 42.180 -1.874 1
1 510 . 16 1 1 A 51 51 ASP N N 136 116.158 115.546 0.612 1
1 511 . 16 1 1 A 52 52 GLY H H 137 7.653 8.393 -0.740 1
1 512 . 16 1 1 A 52 52 GLY HA2 H 137 4.685 4.028 0.657 1
1 513 . 16 1 1 A 52 52 GLY HA3 H 137 4.069 4.033 0.036 1
1 514 . 16 1 1 A 52 52 GLY C C 137 173.149 172.395 0.754 1
1 515 . 16 1 1 A 52 52 GLY CA C 137 45.860 44.386 1.474 1
1 516 . 16 1 1 A 52 52 GLY N N 137 107.634 109.337 -1.703 1
1 517 . 16 1 1 A 53 53 THR H H 138 8.445 8.079 0.366 1
1 518 . 16 1 1 A 53 53 THR HA H 138 4.996 4.651 0.345 1
1 523 . 16 1 1 A 53 53 THR C C 138 174.163 173.098 1.065 1
1 524 . 16 1 1 A 53 53 THR CA C 138 60.974 61.189 -0.215 1
1 525 . 16 1 1 A 53 53 THR CB C 138 72.266 71.560 0.706 1
1 527 . 16 1 1 A 53 53 THR N N 138 114.976 114.953 0.023 1
1 528 . 16 1 1 A 54 54 GLU H H 139 8.917 8.404 0.513 1
1 529 . 16 1 1 A 54 54 GLU HA H 139 5.205 4.699 0.506 1
1 534 . 16 1 1 A 54 54 GLU C C 139 175.700 174.990 0.710 1
1 535 . 16 1 1 A 54 54 GLU CA C 139 54.731 55.113 -0.382 1
1 536 . 16 1 1 A 54 54 GLU CB C 139 33.250 30.287 2.963 1
1 538 . 16 1 1 A 54 54 GLU N N 139 121.295 125.313 -4.018 1
1 539 . 16 1 1 A 55 55 THR H H 140 9.190 8.366 0.824 1
1 540 . 16 1 1 A 55 55 THR HA H 140 4.744 4.475 0.269 1
1 545 . 16 1 1 A 55 55 THR C C 140 174.537 173.679 0.858 1
1 546 . 16 1 1 A 55 55 THR CA C 140 62.678 61.902 0.776 1
1 547 . 16 1 1 A 55 55 THR CB C 140 69.744 68.729 1.015 1
1 549 . 16 1 1 A 55 55 THR N N 140 122.419 121.921 0.498 1
1 550 . 16 1 1 A 56 56 HIS H H 141 9.395 8.859 0.536 1
1 551 . 16 1 1 A 56 56 HIS HA H 141 5.204 4.995 0.209 1
1 556 . 16 1 1 A 56 56 HIS C C 141 174.675 175.021 -0.346 1
1 557 . 16 1 1 A 56 56 HIS CA C 141 55.557 53.873 1.684 1
1 558 . 16 1 1 A 56 56 HIS CB C 141 31.279 30.899 0.380 1
1 561 . 16 1 1 A 56 56 HIS N N 141 125.732 125.778 -0.046 1
1 564 . 16 1 1 A 57 57 PHE H H 142 8.790 8.312 0.478 1
1 565 . 16 1 1 A 57 57 PHE HA H 142 4.918 5.694 -0.776 1
1 571 . 16 1 1 A 57 57 PHE C C 142 172.293 172.990 -0.697 1
1 572 . 16 1 1 A 57 57 PHE CA C 142 56.366 55.128 1.238 1
1 573 . 16 1 1 A 57 57 PHE CB C 142 39.962 41.890 -1.928 1
1 575 . 16 1 1 A 57 57 PHE N N 142 117.009 122.007 -4.998 1
1 576 . 16 1 1 A 58 58 SER H H 143 8.890 9.167 -0.277 1
1 577 . 16 1 1 A 58 58 SER HA H 143 5.286 5.491 -0.205 1
1 580 . 16 1 1 A 58 58 SER C C 143 173.716 173.330 0.386 1
1 581 . 16 1 1 A 58 58 SER CA C 143 57.517 56.783 0.734 1
1 582 . 16 1 1 A 58 58 SER CB C 143 65.448 67.113 -1.665 1
1 583 . 16 1 1 A 58 58 SER N N 143 115.269 113.176 2.093 1
1 584 . 16 1 1 A 59 59 VAL H H 144 7.737 8.744 -1.007 1
1 585 . 16 1 1 A 59 59 VAL HA H 144 4.220 4.424 -0.204 1
1 593 . 16 1 1 A 59 59 VAL C C 144 176.234 176.089 0.145 1
1 594 . 16 1 1 A 59 59 VAL CA C 144 61.741 60.918 0.823 1
1 595 . 16 1 1 A 59 59 VAL CB C 144 33.711 33.745 -0.034 1
1 598 . 16 1 1 A 59 59 VAL N N 144 123.186 120.291 2.895 1
1 599 . 16 1 1 A 60 60 GLY H H 145 8.945 9.034 -0.089 1
1 600 . 16 1 1 A 60 60 GLY HA2 H 145 4.027 3.794 0.233 1
1 601 . 16 1 1 A 60 60 GLY HA3 H 145 3.692 3.827 -0.135 1
1 602 . 16 1 1 A 60 60 GLY C C 145 175.182 175.048 0.134 1
1 603 . 16 1 1 A 60 60 GLY CA C 145 47.141 47.300 -0.159 1
1 604 . 16 1 1 A 60 60 GLY N N 145 116.908 118.078 -1.170 1
1 605 . 16 1 1 A 61 61 ASN H H 146 8.929 8.709 0.220 1
1 606 . 16 1 1 A 61 61 ASN HA H 146 4.718 4.769 -0.051 1
1 611 . 16 1 1 A 61 61 ASN C C 146 174.706 175.445 -0.739 1
1 612 . 16 1 1 A 61 61 ASN CA C 146 52.802 54.079 -1.277 1
1 613 . 16 1 1 A 61 61 ASN CB C 146 37.917 39.539 -1.622 1
1 614 . 16 1 1 A 61 61 ASN N N 146 123.976 124.653 -0.677 1
1 616 . 16 1 1 A 62 62 HIS H H 147 8.400 7.054 1.346 1
1 617 . 16 1 1 A 62 62 HIS HA H 147 4.762 4.626 0.136 1
1 622 . 16 1 1 A 62 62 HIS C C 147 173.871 174.730 -0.859 1
1 623 . 16 1 1 A 62 62 HIS CA C 147 55.374 56.532 -1.158 1
1 624 . 16 1 1 A 62 62 HIS CB C 147 28.655 30.061 -1.406 1
1 628 . 16 1 1 A 62 62 HIS N N 147 118.620 117.788 0.832 1
1 631 . 16 1 1 A 63 63 ASP H H 148 8.734 8.820 -0.086 1
1 632 . 16 1 1 A 63 63 ASP HA H 148 4.785 5.212 -0.427 1
1 635 . 16 1 1 A 63 63 ASP C C 148 175.269 174.657 0.612 1
1 636 . 16 1 1 A 63 63 ASP CA C 148 54.390 54.195 0.195 1
1 637 . 16 1 1 A 63 63 ASP CB C 148 42.105 43.725 -1.620 1
1 638 . 16 1 1 A 63 63 ASP N N 148 125.336 120.081 5.255 1
1 639 . 16 1 1 A 64 64 CYS H H 149 8.225 9.227 -1.002 1
1 640 . 16 1 1 A 64 64 CYS HA H 149 5.118 5.329 -0.211 1
1 643 . 16 1 1 A 64 64 CYS C C 149 173.740 172.852 0.888 1
1 644 . 16 1 1 A 64 64 CYS CA C 149 55.423 56.735 -1.312 1
1 645 . 16 1 1 A 64 64 CYS CB C 149 29.972 32.623 -2.651 1
1 646 . 16 1 1 A 64 64 CYS N N 149 124.476 123.401 1.075 1
1 647 . 16 1 1 A 65 65 TYR H H 150 8.916 8.696 0.220 1
1 648 . 16 1 1 A 65 65 TYR HA H 150 5.121 3.496 1.625 1
1 655 . 16 1 1 A 65 65 TYR C C 150 172.821 171.719 1.102 1
1 656 . 16 1 1 A 65 65 TYR CA C 150 56.347 55.461 0.886 1
1 657 . 16 1 1 A 65 65 TYR CB C 150 38.901 40.371 -1.470 1
1 662 . 16 1 1 A 65 65 TYR N N 150 115.313 117.197 -1.884 1
1 663 . 16 1 1 A 66 66 ILE H H 151 8.423 8.267 0.156 1
1 664 . 16 1 1 A 66 66 ILE HA H 151 5.000 4.287 0.713 1
1 674 . 16 1 1 A 66 66 ILE C C 151 176.225 174.288 1.937 1
1 675 . 16 1 1 A 66 66 ILE CA C 151 57.798 59.773 -1.975 1
1 676 . 16 1 1 A 66 66 ILE CB C 151 39.863 39.003 0.860 1
1 680 . 16 1 1 A 66 66 ILE N N 151 118.575 120.490 -1.915 1
1 681 . 16 1 1 A 67 67 LYS H H 152 9.480 9.007 0.473 1
1 682 . 16 1 1 A 67 67 LYS HA H 152 5.091 4.723 0.368 1
1 691 . 16 1 1 A 67 67 LYS C C 152 174.079 175.206 -1.127 1
1 692 . 16 1 1 A 67 67 LYS CA C 152 54.728 55.676 -0.948 1
1 693 . 16 1 1 A 67 67 LYS CB C 152 35.256 33.204 2.052 1
1 697 . 16 1 1 A 67 67 LYS N N 152 132.311 128.372 3.939 1
1 698 . 16 1 1 A 68 68 ALA H H 153 8.844 8.393 0.451 1
1 699 . 16 1 1 A 68 68 ALA HA H 153 5.039 5.485 -0.446 1
1 703 . 16 1 1 A 68 68 ALA C C 153 176.587 176.208 0.379 1
1 704 . 16 1 1 A 68 68 ALA CA C 153 50.484 50.569 -0.085 1
1 705 . 16 1 1 A 68 68 ALA CB C 153 20.570 21.765 -1.195 1
1 706 . 16 1 1 A 68 68 ALA N N 153 129.958 129.086 0.872 1
1 707 . 16 1 1 A 69 69 VAL H H 154 8.461 8.609 -0.148 1
1 708 . 16 1 1 A 69 69 VAL HA H 154 4.558 4.582 -0.024 1
1 716 . 16 1 1 A 69 69 VAL C C 154 175.331 175.093 0.238 1
1 717 . 16 1 1 A 69 69 VAL CA C 154 60.758 60.605 0.153 1
1 718 . 16 1 1 A 69 69 VAL CB C 154 34.743 35.630 -0.887 1
1 721 . 16 1 1 A 69 69 VAL N N 154 121.496 121.295 0.201 1
1 722 . 16 1 1 A 70 70 SER H H 155 8.695 8.961 -0.266 1
1 723 . 16 1 1 A 70 70 SER HA H 155 4.646 5.426 -0.780 1
1 726 . 16 1 1 A 70 70 SER C C 155 174.690 173.762 0.928 1
1 727 . 16 1 1 A 70 70 SER CA C 155 58.065 56.188 1.877 1
1 728 . 16 1 1 A 70 70 SER CB C 155 64.062 65.497 -1.435 1
1 729 . 16 1 1 A 70 70 SER N N 155 119.763 121.422 -1.659 1
1 730 . 16 1 1 A 71 71 SER H H 156 8.360 9.006 -0.646 1
1 731 . 16 1 1 A 71 71 SER HA H 156 4.430 5.006 -0.576 1
1 734 . 16 1 1 A 71 71 SER CA C 156 58.491 56.897 1.594 1
1 735 . 16 1 1 A 71 71 SER CB C 156 64.061 65.868 -1.807 1
1 736 . 16 1 1 A 71 71 SER N N 156 118.577 114.363 4.214 1
1 737 . 16 1 1 A 72 72 GLY H H 157 8.542 8.489 0.053 1
1 738 . 16 1 1 A 72 72 GLY HA2 H 157 4.002 3.977 0.025 1
1 739 . 16 1 1 A 72 72 GLY HA3 H 157 4.002 3.979 0.023 1
1 740 . 16 1 1 A 72 72 GLY CA C 157 45.565 45.579 -0.014 1
1 741 . 16 1 1 A 72 72 GLY N N 157 111.540 109.139 2.401 1
1 742 . 16 1 1 A 73 73 LYS H H 158 8.369 8.125 0.244 1
1 743 . 16 1 1 A 73 73 LYS CA C 158 56.720 57.281 -0.561 1
1 744 . 16 1 1 A 73 73 LYS CB C 158 32.915 34.855 -1.940 1
1 747 . 16 1 1 A 73 73 LYS N N 158 120.293 119.871 0.422 1
1 748 . 16 1 1 A 74 74 ARG H H 159 8.181 8.287 -0.106 1
1 749 . 16 1 1 A 74 74 ARG CA C 159 56.148 57.119 -0.971 1
1 751 . 16 1 1 A 74 74 ARG N N 159 119.343 116.959 2.384 1
1 752 . 16 1 1 A 75 75 LYS H H 160 8.443 7.956 0.487 1
1 753 . 16 1 1 A 75 75 LYS HA H 160 4.067 4.599 -0.532 1
1 762 . 16 1 1 A 75 75 LYS C C 160 176.868 176.713 0.155 1
1 763 . 16 1 1 A 75 75 LYS CA C 160 57.711 55.291 2.420 1
1 764 . 16 1 1 A 75 75 LYS CB C 160 31.777 33.804 -2.027 1
1 768 . 16 1 1 A 75 75 LYS N N 160 120.467 118.879 1.588 1
1 769 . 16 1 1 A 76 76 GLU H H 161 8.693 8.163 0.530 1
1 770 . 16 1 1 A 76 76 GLU HA H 161 4.290 4.111 0.179 1
1 771 . 16 1 1 A 76 76 GLU C C 161 176.844 176.830 0.014 1
1 772 . 16 1 1 A 76 76 GLU CA C 161 57.294 59.047 -1.753 1
1 773 . 16 1 1 A 76 76 GLU CB C 161 29.794 30.229 -0.435 1
1 775 . 16 1 1 A 76 76 GLU N N 161 118.767 120.644 -1.877 1
1 776 . 16 1 1 A 77 77 GLY H H 162 8.168 7.800 0.368 1
1 777 . 16 1 1 A 77 77 GLY HA2 H 162 4.010 4.224 -0.214 1
1 778 . 16 1 1 A 77 77 GLY HA3 H 162 3.963 4.230 -0.267 1
1 779 . 16 1 1 A 77 77 GLY C C 162 173.512 171.982 1.530 1
1 780 . 16 1 1 A 77 77 GLY CA C 162 45.362 44.154 1.208 1
1 781 . 16 1 1 A 77 77 GLY N N 162 108.621 104.192 4.429 1
1 782 . 16 1 1 A 78 78 ILE H H 163 7.954 8.599 -0.645 1
1 783 . 16 1 1 A 78 78 ILE HA H 163 4.323 4.896 -0.573 1
1 793 . 16 1 1 A 78 78 ILE C C 163 175.402 174.981 0.421 1
1 794 . 16 1 1 A 78 78 ILE CA C 163 60.632 59.792 0.840 1
1 795 . 16 1 1 A 78 78 ILE CB C 163 39.759 42.162 -2.403 1
1 799 . 16 1 1 A 78 78 ILE N N 163 121.604 122.976 -1.372 1
1 800 . 16 1 1 A 79 79 ILE H H 164 8.514 8.663 -0.149 1
1 801 . 16 1 1 A 79 79 ILE HA H 164 4.341 4.877 -0.536 1
1 811 . 16 1 1 A 79 79 ILE C C 164 175.172 174.815 0.357 1
1 812 . 16 1 1 A 79 79 ILE CA C 164 60.027 59.924 0.103 1
1 813 . 16 1 1 A 79 79 ILE CB C 164 40.153 41.434 -1.281 1
1 817 . 16 1 1 A 79 79 ILE N N 164 127.137 126.592 0.545 1
1 818 . 16 1 1 A 80 80 HIS H H 165 8.492 8.959 -0.467 1
1 819 . 16 1 1 A 80 80 HIS HA H 165 5.676 5.451 0.225 1
1 824 . 16 1 1 A 80 80 HIS C C 165 175.502 173.974 1.528 1
1 825 . 16 1 1 A 80 80 HIS CA C 165 57.043 54.498 2.545 1
1 826 . 16 1 1 A 80 80 HIS CB C 165 32.741 33.287 -0.546 1
1 829 . 16 1 1 A 80 80 HIS N N 165 125.422 125.430 -0.008 1
1 830 . 16 1 1 A 81 81 THR H H 166 9.080 9.166 -0.086 1
1 831 . 16 1 1 A 81 81 THR HA H 166 4.999 5.133 -0.134 1
1 836 . 16 1 1 A 81 81 THR C C 166 171.877 172.781 -0.904 1
1 837 . 16 1 1 A 81 81 THR CA C 166 59.924 60.953 -1.029 1
1 838 . 16 1 1 A 81 81 THR CB C 166 72.243 70.918 1.325 1
1 840 . 16 1 1 A 81 81 THR N N 166 117.682 113.863 3.819 1
1 841 . 16 1 1 A 82 82 LEU H H 167 8.062 7.888 0.174 1
1 842 . 16 1 1 A 82 82 LEU HA H 167 4.350 3.858 0.492 1
1 852 . 16 1 1 A 82 82 LEU C C 167 172.705 174.936 -2.231 1
1 853 . 16 1 1 A 82 82 LEU CA C 167 53.553 55.459 -1.906 1
1 854 . 16 1 1 A 82 82 LEU CB C 167 39.768 41.335 -1.567 1
1 858 . 16 1 1 A 82 82 LEU N N 167 125.369 128.283 -2.914 1
1 859 . 16 1 1 A 83 83 ILE H H 168 8.657 8.271 0.386 1
1 860 . 16 1 1 A 83 83 ILE HA H 168 4.476 5.034 -0.558 1
1 870 . 16 1 1 A 83 83 ILE C C 168 175.159 174.326 0.833 1
1 871 . 16 1 1 A 83 83 ILE CA C 168 58.529 60.214 -1.685 1
1 872 . 16 1 1 A 83 83 ILE CB C 168 37.410 40.746 -3.336 1
1 876 . 16 1 1 A 83 83 ILE N N 168 128.042 127.278 0.764 1
1 877 . 16 1 1 A 84 84 VAL H H 169 8.464 8.423 0.041 1
1 878 . 16 1 1 A 84 84 VAL HA H 169 4.284 4.469 -0.185 1
1 886 . 16 1 1 A 84 84 VAL C C 169 176.138 175.917 0.221 1
1 887 . 16 1 1 A 84 84 VAL CA C 169 61.029 61.411 -0.382 1
1 888 . 16 1 1 A 84 84 VAL CB C 169 34.714 34.129 0.585 1
1 891 . 16 1 1 A 84 84 VAL N N 169 124.644 126.859 -2.215 1
1 892 . 16 1 1 A 85 85 ASP H H 170 9.158 9.157 0.001 1
1 893 . 16 1 1 A 85 85 ASP HA H 170 4.362 4.298 0.064 1
1 896 . 16 1 1 A 85 85 ASP C C 170 175.489 175.331 0.158 1
1 897 . 16 1 1 A 85 85 ASP CA C 170 55.868 55.193 0.675 1
1 898 . 16 1 1 A 85 85 ASP CB C 170 38.927 39.457 -0.530 1
1 899 . 16 1 1 A 85 85 ASP N N 170 129.061 127.626 1.435 1
1 900 . 16 1 1 A 86 86 ASN H H 171 8.811 8.415 0.396 1
1 901 . 16 1 1 A 86 86 ASN HA H 171 4.053 4.299 -0.246 1
1 906 . 16 1 1 A 86 86 ASN C C 171 173.802 173.865 -0.063 1
1 907 . 16 1 1 A 86 86 ASN CA C 171 55.173 54.304 0.869 1
1 908 . 16 1 1 A 86 86 ASN CB C 171 38.150 37.370 0.780 1
1 909 . 16 1 1 A 86 86 ASN N N 171 108.418 114.938 -6.520 1
1 911 . 16 1 1 A 87 87 ARG H H 172 7.914 7.469 0.445 1
1 912 . 16 1 1 A 87 87 ARG HA H 172 4.597 4.693 -0.096 1
1 919 . 16 1 1 A 87 87 ARG C C 172 174.025 174.944 -0.919 1
1 920 . 16 1 1 A 87 87 ARG CA C 172 54.846 54.099 0.747 1
1 921 . 16 1 1 A 87 87 ARG CB C 172 32.697 33.313 -0.616 1
1 924 . 16 1 1 A 87 87 ARG N N 172 120.988 117.355 3.633 1
1 925 . 16 1 1 A 88 88 GLU H H 173 8.534 8.697 -0.163 1
1 926 . 16 1 1 A 88 88 GLU HA H 173 4.560 4.313 0.247 1
1 931 . 16 1 1 A 88 88 GLU C C 173 176.187 175.391 0.796 1
1 932 . 16 1 1 A 88 88 GLU CA C 173 56.044 56.812 -0.768 1
1 933 . 16 1 1 A 88 88 GLU CB C 173 30.329 30.344 -0.015 1
1 935 . 16 1 1 A 88 88 GLU N N 173 123.982 124.359 -0.377 1
1 936 . 16 1 1 A 89 89 ILE H H 174 8.897 7.967 0.930 1
1 937 . 16 1 1 A 89 89 ILE HA H 174 4.666 4.566 0.100 1
1 947 . 16 1 1 A 89 89 ILE C C 174 174.110 174.110 0.000 1
1 948 . 16 1 1 A 89 89 ILE CA C 174 55.255 57.371 -2.116 1
1 949 . 16 1 1 A 89 89 ILE CB C 174 37.851 41.696 -3.845 1
1 953 . 16 1 1 A 89 89 ILE N N 174 130.008 126.339 3.669 1
1 954 . 16 1 1 A 90 90 PRO HA H 175 4.713 4.784 -0.071 1
1 961 . 16 1 1 A 90 90 PRO C C 175 176.956 176.697 0.259 1
1 962 . 16 1 1 A 90 90 PRO CA C 175 63.159 62.896 0.263 1
1 963 . 16 1 1 A 90 90 PRO CB C 175 32.428 32.357 0.071 1
1 966 . 16 1 1 A 91 91 GLU H H 176 8.778 8.787 -0.009 1
1 967 . 16 1 1 A 91 91 GLU HA H 176 3.910 4.649 -0.739 1
1 972 . 16 1 1 A 91 91 GLU C C 176 176.426 176.005 0.421 1
1 973 . 16 1 1 A 91 91 GLU CA C 176 56.738 55.211 1.527 1
1 974 . 16 1 1 A 91 91 GLU CB C 176 30.540 28.228 2.312 1
1 976 . 16 1 1 A 91 91 GLU N N 176 124.561 123.669 0.892 1
1 977 . 16 1 1 A 92 92 LEU H H 177 8.630 8.177 0.453 1
1 978 . 16 1 1 A 92 92 LEU HA H 177 4.419 4.221 0.198 1
1 988 . 16 1 1 A 92 92 LEU C C 177 177.162 177.423 -0.261 1
1 989 . 16 1 1 A 92 92 LEU CA C 177 55.350 57.127 -1.777 1
1 990 . 16 1 1 A 92 92 LEU CB C 177 42.390 41.659 0.731 1
1 994 . 16 1 1 A 92 92 LEU N N 177 126.683 124.828 1.855 1
1 995 . 16 1 1 A 93 93 THR H H 178 8.375 8.647 -0.272 1
1 996 . 16 1 1 A 93 93 THR HA H 178 4.359 3.880 0.479 1
1 1001 . 16 1 1 A 93 93 THR C C 178 173.589 175.838 -2.249 1
1 1002 . 16 1 1 A 93 93 THR CA C 178 61.621 65.358 -3.737 1
1 1003 . 16 1 1 A 93 93 THR CB C 178 69.724 68.980 0.744 1
1 1005 . 16 1 1 A 93 93 THR N N 178 119.699 114.233 5.466 1
1 1 . 17 1 1 A 9 9 SER H H 94 8.475 8.009 0.466 1
1 2 . 17 1 1 A 9 9 SER CA C 94 58.531 59.542 -1.011 1
1 3 . 17 1 1 A 9 9 SER N N 94 117.432 114.626 2.806 1
1 4 . 17 1 1 A 10 10 LYS H H 95 8.527 8.913 -0.386 1
1 5 . 17 1 1 A 10 10 LYS C C 95 174.594 178.090 -3.496 1
1 6 . 17 1 1 A 10 10 LYS CA C 95 56.603 58.447 -1.844 1
1 7 . 17 1 1 A 10 10 LYS N N 95 123.104 127.648 -4.544 1
1 8 . 17 1 1 A 11 11 THR H H 96 8.245 7.750 0.495 1
1 9 . 17 1 1 A 11 11 THR C C 96 174.393 173.692 0.701 1
1 10 . 17 1 1 A 11 11 THR CA C 96 62.149 60.880 1.269 1
1 11 . 17 1 1 A 11 11 THR CB C 96 69.183 69.975 -0.792 1
1 13 . 17 1 1 A 11 11 THR N N 96 113.245 106.883 6.362 1
1 14 . 17 1 1 A 12 12 THR H H 97 7.769 7.559 0.210 1
1 15 . 17 1 1 A 12 12 THR HA H 97 5.583 4.808 0.775 1
1 20 . 17 1 1 A 12 12 THR C C 97 174.726 172.615 2.111 1
1 21 . 17 1 1 A 12 12 THR CA C 97 59.602 60.860 -1.258 1
1 22 . 17 1 1 A 12 12 THR CB C 97 72.805 71.447 1.358 1
1 24 . 17 1 1 A 12 12 THR N N 97 113.440 112.224 1.216 1
1 25 . 17 1 1 A 13 13 SER H H 98 8.593 8.979 -0.386 1
1 26 . 17 1 1 A 13 13 SER HA H 98 4.448 5.333 -0.885 1
1 29 . 17 1 1 A 13 13 SER C C 98 171.426 173.134 -1.708 1
1 30 . 17 1 1 A 13 13 SER CA C 98 59.056 56.208 2.848 1
1 31 . 17 1 1 A 13 13 SER CB C 98 67.839 65.470 2.369 1
1 32 . 17 1 1 A 13 13 SER N N 98 119.042 120.312 -1.270 1
1 33 . 17 1 1 A 14 14 THR H H 99 8.155 7.989 0.166 1
1 34 . 17 1 1 A 14 14 THR HA H 99 5.383 4.956 0.427 1
1 39 . 17 1 1 A 14 14 THR C C 99 171.565 172.735 -1.170 1
1 40 . 17 1 1 A 14 14 THR CA C 99 61.291 60.451 0.840 1
1 41 . 17 1 1 A 14 14 THR CB C 99 71.654 72.151 -0.497 1
1 43 . 17 1 1 A 14 14 THR N N 99 118.204 117.042 1.162 1
1 44 . 17 1 1 A 15 15 TRP H H 100 9.637 8.994 0.643 1
1 45 . 17 1 1 A 15 15 TRP HA H 100 4.807 5.070 -0.263 1
1 54 . 17 1 1 A 15 15 TRP C C 100 174.399 175.277 -0.878 1
1 55 . 17 1 1 A 15 15 TRP CA C 100 58.302 56.056 2.246 1
1 56 . 17 1 1 A 15 15 TRP CB C 100 34.810 33.524 1.286 1
1 63 . 17 1 1 A 15 15 TRP N N 100 125.132 122.860 2.272 1
1 65 . 17 1 1 A 16 16 VAL H H 101 8.863 9.013 -0.150 1
1 66 . 17 1 1 A 16 16 VAL HA H 101 5.267 4.799 0.468 1
1 74 . 17 1 1 A 16 16 VAL C C 101 174.955 175.351 -0.396 1
1 75 . 17 1 1 A 16 16 VAL CA C 101 60.653 61.619 -0.966 1
1 76 . 17 1 1 A 16 16 VAL CB C 101 34.284 32.935 1.349 1
1 79 . 17 1 1 A 16 16 VAL N N 101 119.527 123.685 -4.158 1
1 80 . 17 1 1 A 17 17 LEU H H 102 8.961 8.937 0.024 1
1 81 . 17 1 1 A 17 17 LEU HA H 102 4.729 5.075 -0.346 1
1 91 . 17 1 1 A 17 17 LEU C C 102 173.559 175.078 -1.519 1
1 92 . 17 1 1 A 17 17 LEU CA C 102 55.144 53.110 2.034 1
1 93 . 17 1 1 A 17 17 LEU CB C 102 42.948 45.886 -2.938 1
1 97 . 17 1 1 A 17 17 LEU N N 102 124.280 123.631 0.649 1
1 98 . 17 1 1 A 18 18 ARG H H 103 8.305 8.407 -0.102 1
1 99 . 17 1 1 A 18 18 ARG HA H 103 5.139 4.634 0.505 1
1 106 . 17 1 1 A 18 18 ARG C C 103 175.347 175.179 0.168 1
1 107 . 17 1 1 A 18 18 ARG CA C 103 54.793 56.112 -1.319 1
1 108 . 17 1 1 A 18 18 ARG CB C 103 31.347 29.745 1.602 1
1 111 . 17 1 1 A 18 18 ARG N N 103 122.020 120.098 1.922 1
1 112 . 17 1 1 A 19 19 LEU H H 104 8.676 8.777 -0.101 1
1 113 . 17 1 1 A 19 19 LEU HA H 104 4.482 4.829 -0.347 1
1 123 . 17 1 1 A 19 19 LEU C C 104 175.957 175.839 0.118 1
1 124 . 17 1 1 A 19 19 LEU CA C 104 53.581 53.663 -0.082 1
1 125 . 17 1 1 A 19 19 LEU CB C 104 45.697 45.306 0.391 1
1 129 . 17 1 1 A 19 19 LEU N N 104 126.378 124.828 1.550 1
1 130 . 17 1 1 A 20 20 ASP H H 105 9.390 9.616 -0.226 1
1 131 . 17 1 1 A 20 20 ASP HA H 105 4.287 4.385 -0.098 1
1 134 . 17 1 1 A 20 20 ASP C C 105 175.947 175.834 0.113 1
1 135 . 17 1 1 A 20 20 ASP CA C 105 55.263 55.315 -0.052 1
1 136 . 17 1 1 A 20 20 ASP CB C 105 39.239 39.302 -0.063 1
1 137 . 17 1 1 A 20 20 ASP N N 105 125.208 126.034 -0.826 1
1 138 . 17 1 1 A 21 21 GLY H H 106 8.563 8.654 -0.091 1
1 139 . 17 1 1 A 21 21 GLY HA2 H 106 4.126 3.842 0.284 1
1 140 . 17 1 1 A 21 21 GLY HA3 H 106 3.509 3.846 -0.337 1
1 141 . 17 1 1 A 21 21 GLY C C 106 173.164 173.707 -0.543 1
1 142 . 17 1 1 A 21 21 GLY CA C 106 45.499 45.523 -0.024 1
1 143 . 17 1 1 A 21 21 GLY N N 106 103.331 104.151 -0.820 1
1 144 . 17 1 1 A 22 22 GLU H H 107 7.713 8.009 -0.296 1
1 145 . 17 1 1 A 22 22 GLU HA H 107 4.634 4.920 -0.286 1
1 150 . 17 1 1 A 22 22 GLU C C 107 174.800 174.995 -0.195 1
1 151 . 17 1 1 A 22 22 GLU CA C 107 54.329 54.297 0.032 1
1 152 . 17 1 1 A 22 22 GLU CB C 107 32.832 34.032 -1.200 1
1 154 . 17 1 1 A 22 22 GLU N N 107 119.470 119.384 0.086 1
1 155 . 17 1 1 A 23 23 ASP H H 108 8.632 8.560 0.072 1
1 156 . 17 1 1 A 23 23 ASP HA H 108 4.872 4.705 0.167 1
1 159 . 17 1 1 A 23 23 ASP C C 108 175.533 175.631 -0.098 1
1 160 . 17 1 1 A 23 23 ASP CA C 108 55.180 53.944 1.236 1
1 161 . 17 1 1 A 23 23 ASP CB C 108 41.504 39.419 2.085 1
1 162 . 17 1 1 A 23 23 ASP N N 108 122.815 121.519 1.296 1
1 163 . 17 1 1 A 24 24 LEU H H 109 9.248 8.857 0.391 1
1 164 . 17 1 1 A 24 24 LEU HA H 109 4.836 4.563 0.273 1
1 174 . 17 1 1 A 24 24 LEU C C 109 174.322 175.909 -1.587 1
1 175 . 17 1 1 A 24 24 LEU CA C 109 54.473 55.264 -0.791 1
1 176 . 17 1 1 A 24 24 LEU CB C 109 44.718 42.608 2.110 1
1 180 . 17 1 1 A 24 24 LEU N N 109 125.550 126.840 -1.290 1
1 181 . 17 1 1 A 25 25 ARG H H 110 8.503 8.700 -0.197 1
1 182 . 17 1 1 A 25 25 ARG HA H 110 5.228 4.838 0.390 1
1 189 . 17 1 1 A 25 25 ARG C C 110 175.174 174.404 0.770 1
1 190 . 17 1 1 A 25 25 ARG CA C 110 54.745 54.849 -0.104 1
1 191 . 17 1 1 A 25 25 ARG CB C 110 31.701 31.670 0.031 1
1 194 . 17 1 1 A 25 25 ARG N N 110 125.424 127.901 -2.477 1
1 195 . 17 1 1 A 26 26 VAL H H 111 9.692 9.091 0.601 1
1 196 . 17 1 1 A 26 26 VAL HA H 111 5.091 4.962 0.129 1
1 204 . 17 1 1 A 26 26 VAL C C 111 174.446 175.145 -0.699 1
1 205 . 17 1 1 A 26 26 VAL CA C 111 61.055 61.867 -0.812 1
1 206 . 17 1 1 A 26 26 VAL CB C 111 33.780 33.247 0.533 1
1 209 . 17 1 1 A 26 26 VAL N N 111 130.649 127.267 3.382 1
1 210 . 17 1 1 A 27 27 VAL H H 112 9.401 9.002 0.399 1
1 211 . 17 1 1 A 27 27 VAL HA H 112 5.188 4.797 0.391 1
1 219 . 17 1 1 A 27 27 VAL C C 112 174.214 174.339 -0.125 1
1 220 . 17 1 1 A 27 27 VAL CA C 112 60.722 60.938 -0.216 1
1 221 . 17 1 1 A 27 27 VAL CB C 112 36.082 35.483 0.599 1
1 224 . 17 1 1 A 27 27 VAL N N 112 127.416 127.297 0.119 1
1 225 . 17 1 1 A 28 28 LEU H H 113 9.265 9.193 0.072 1
1 226 . 17 1 1 A 28 28 LEU HA H 113 5.337 5.371 -0.034 1
1 236 . 17 1 1 A 28 28 LEU C C 113 175.915 174.818 1.097 1
1 237 . 17 1 1 A 28 28 LEU CA C 113 52.599 53.363 -0.764 1
1 238 . 17 1 1 A 28 28 LEU CB C 113 47.495 44.607 2.888 1
1 242 . 17 1 1 A 28 28 LEU N N 113 127.527 129.635 -2.108 1
1 243 . 17 1 1 A 29 29 GLU H H 114 8.968 8.496 0.472 1
1 244 . 17 1 1 A 29 29 GLU HA H 114 4.701 4.448 0.253 1
1 249 . 17 1 1 A 29 29 GLU C C 114 176.715 177.761 -1.046 1
1 250 . 17 1 1 A 29 29 GLU CA C 114 55.342 56.574 -1.232 1
1 251 . 17 1 1 A 29 29 GLU CB C 114 30.005 30.170 -0.165 1
1 253 . 17 1 1 A 29 29 GLU N N 114 127.374 127.424 -0.050 1
1 254 . 17 1 1 A 30 30 LYS H H 115 8.243 8.214 0.029 1
1 255 . 17 1 1 A 30 30 LYS HA H 115 3.711 4.064 -0.353 1
1 264 . 17 1 1 A 30 30 LYS C C 115 177.137 178.029 -0.892 1
1 265 . 17 1 1 A 30 30 LYS CA C 115 60.118 58.658 1.460 1
1 266 . 17 1 1 A 30 30 LYS CB C 115 32.656 32.059 0.597 1
1 270 . 17 1 1 A 30 30 LYS N N 115 124.225 125.520 -1.295 1
1 271 . 17 1 1 A 31 31 ASP H H 116 9.200 8.084 1.116 1
1 272 . 17 1 1 A 31 31 ASP HA H 116 4.444 4.400 0.044 1
1 275 . 17 1 1 A 31 31 ASP C C 116 177.774 177.512 0.262 1
1 276 . 17 1 1 A 31 31 ASP CA C 116 56.703 57.389 -0.686 1
1 277 . 17 1 1 A 31 31 ASP CB C 116 40.236 40.355 -0.119 1
1 278 . 17 1 1 A 31 31 ASP N N 116 115.955 120.099 -4.144 1
1 279 . 17 1 1 A 32 32 THR H H 117 7.352 7.498 -0.146 1
1 280 . 17 1 1 A 32 32 THR HA H 117 4.266 4.574 -0.308 1
1 285 . 17 1 1 A 32 32 THR C C 117 175.320 173.910 1.410 1
1 286 . 17 1 1 A 32 32 THR CA C 117 61.171 61.426 -0.255 1
1 287 . 17 1 1 A 32 32 THR CB C 117 70.221 69.515 0.706 1
1 289 . 17 1 1 A 32 32 THR N N 117 106.440 108.888 -2.448 1
1 290 . 17 1 1 A 33 33 MET H H 118 8.216 7.960 0.256 1
1 291 . 17 1 1 A 33 33 MET HA H 118 4.184 4.139 0.045 1
1 299 . 17 1 1 A 33 33 MET C C 118 174.952 174.354 0.598 1
1 300 . 17 1 1 A 33 33 MET CA C 118 55.195 56.836 -1.641 1
1 301 . 17 1 1 A 33 33 MET CB C 118 25.900 31.041 -5.141 1
1 304 . 17 1 1 A 33 33 MET N N 118 115.956 117.664 -1.708 1
1 305 . 17 1 1 A 34 34 ASP H H 119 7.509 7.921 -0.412 1
1 306 . 17 1 1 A 34 34 ASP HA H 119 4.486 4.843 -0.357 1
1 309 . 17 1 1 A 34 34 ASP C C 119 174.375 175.725 -1.350 1
1 310 . 17 1 1 A 34 34 ASP CA C 119 54.745 54.023 0.722 1
1 311 . 17 1 1 A 34 34 ASP CB C 119 42.865 42.254 0.611 1
1 312 . 17 1 1 A 34 34 ASP N N 119 118.500 118.569 -0.069 1
1 313 . 17 1 1 A 35 35 VAL H H 120 8.473 8.552 -0.079 1
1 314 . 17 1 1 A 35 35 VAL HA H 120 4.709 4.950 -0.241 1
1 322 . 17 1 1 A 35 35 VAL C C 120 173.900 174.691 -0.791 1
1 323 . 17 1 1 A 35 35 VAL CA C 120 60.736 61.400 -0.664 1
1 324 . 17 1 1 A 35 35 VAL CB C 120 34.662 33.410 1.252 1
1 327 . 17 1 1 A 35 35 VAL N N 120 121.116 124.669 -3.553 1
1 328 . 17 1 1 A 36 36 TRP H H 121 9.404 8.995 0.409 1
1 329 . 17 1 1 A 36 36 TRP HA H 121 5.174 5.502 -0.328 1
1 338 . 17 1 1 A 36 36 TRP C C 121 176.480 174.487 1.993 1
1 339 . 17 1 1 A 36 36 TRP CA C 121 55.070 55.234 -0.164 1
1 340 . 17 1 1 A 36 36 TRP CB C 121 32.179 32.542 -0.363 1
1 348 . 17 1 1 A 36 36 TRP N N 121 126.924 129.130 -2.206 1
1 350 . 17 1 1 A 37 37 CYS H H 122 9.230 8.276 0.954 1
1 351 . 17 1 1 A 37 37 CYS HA H 122 5.417 5.202 0.215 1
1 354 . 17 1 1 A 37 37 CYS C C 122 175.346 173.306 2.040 1
1 355 . 17 1 1 A 37 37 CYS CA C 122 57.083 57.006 0.077 1
1 356 . 17 1 1 A 37 37 CYS CB C 122 28.713 30.940 -2.227 1
1 357 . 17 1 1 A 37 37 CYS N N 122 120.375 124.725 -4.350 1
1 358 . 17 1 1 A 38 38 ASN H H 123 9.817 9.154 0.663 1
1 359 . 17 1 1 A 38 38 ASN HA H 123 4.637 4.252 0.385 1
1 364 . 17 1 1 A 38 38 ASN C C 123 175.526 175.186 0.340 1
1 365 . 17 1 1 A 38 38 ASN CA C 123 54.023 54.342 -0.319 1
1 366 . 17 1 1 A 38 38 ASN CB C 123 36.581 37.272 -0.691 1
1 367 . 17 1 1 A 38 38 ASN N N 123 129.408 119.339 10.069 1
1 369 . 17 1 1 A 39 39 GLY H H 124 9.092 8.017 1.075 1
1 370 . 17 1 1 A 39 39 GLY HA2 H 124 4.241 2.634 1.607 1
1 371 . 17 1 1 A 39 39 GLY HA3 H 124 3.705 3.590 0.115 1
1 372 . 17 1 1 A 39 39 GLY C C 124 173.405 173.514 -0.109 1
1 373 . 17 1 1 A 39 39 GLY CA C 124 45.595 46.339 -0.744 1
1 374 . 17 1 1 A 39 39 GLY N N 124 102.752 103.401 -0.649 1
1 375 . 17 1 1 A 40 40 GLN H H 125 8.006 7.154 0.852 1
1 376 . 17 1 1 A 40 40 GLN HA H 125 4.736 4.935 -0.199 1
1 383 . 17 1 1 A 40 40 GLN C C 125 174.477 174.989 -0.512 1
1 384 . 17 1 1 A 40 40 GLN CA C 125 53.747 54.727 -0.980 1
1 385 . 17 1 1 A 40 40 GLN CB C 125 30.413 31.236 -0.823 1
1 387 . 17 1 1 A 40 40 GLN N N 125 120.627 118.735 1.892 1
1 389 . 17 1 1 A 41 41 LYS H H 126 8.757 8.837 -0.080 1
1 390 . 17 1 1 A 41 41 LYS HA H 126 3.464 4.543 -1.079 1
1 399 . 17 1 1 A 41 41 LYS C C 126 176.870 176.384 0.486 1
1 400 . 17 1 1 A 41 41 LYS CA C 126 57.136 57.584 -0.448 1
1 401 . 17 1 1 A 41 41 LYS CB C 126 31.669 33.047 -1.378 1
1 405 . 17 1 1 A 41 41 LYS N N 126 129.107 125.166 3.941 1
1 406 . 17 1 1 A 42 42 MET H H 127 8.682 8.940 -0.258 1
1 407 . 17 1 1 A 42 42 MET HA H 127 4.712 5.066 -0.354 1
1 415 . 17 1 1 A 42 42 MET C C 127 176.816 174.948 1.868 1
1 416 . 17 1 1 A 42 42 MET CA C 127 52.958 54.475 -1.517 1
1 417 . 17 1 1 A 42 42 MET CB C 127 33.023 34.887 -1.864 1
1 420 . 17 1 1 A 42 42 MET N N 127 126.569 122.321 4.248 1
1 421 . 17 1 1 A 43 43 GLU H H 128 8.734 8.700 0.034 1
1 422 . 17 1 1 A 43 43 GLU HA H 128 4.419 5.048 -0.629 1
1 427 . 17 1 1 A 43 43 GLU C C 128 176.531 176.587 -0.056 1
1 428 . 17 1 1 A 43 43 GLU CA C 128 56.475 55.288 1.187 1
1 429 . 17 1 1 A 43 43 GLU CB C 128 29.604 30.979 -1.375 1
1 431 . 17 1 1 A 43 43 GLU N N 128 123.734 120.175 3.559 1
1 432 . 17 1 1 A 44 44 THR H H 129 8.263 8.874 -0.611 1
1 433 . 17 1 1 A 44 44 THR HA H 129 5.385 5.381 0.004 1
1 438 . 17 1 1 A 44 44 THR C C 129 174.205 174.265 -0.060 1
1 439 . 17 1 1 A 44 44 THR CA C 129 59.160 60.509 -1.349 1
1 440 . 17 1 1 A 44 44 THR CB C 129 72.419 70.808 1.611 1
1 442 . 17 1 1 A 44 44 THR N N 129 115.081 117.868 -2.787 1
1 443 . 17 1 1 A 45 45 ALA H H 130 8.727 8.219 0.508 1
1 444 . 17 1 1 A 45 45 ALA HA H 130 4.749 4.566 0.183 1
1 448 . 17 1 1 A 45 45 ALA C C 130 177.017 178.615 -1.598 1
1 449 . 17 1 1 A 45 45 ALA CA C 130 51.645 52.406 -0.761 1
1 450 . 17 1 1 A 45 45 ALA CB C 130 21.364 21.447 -0.083 1
1 451 . 17 1 1 A 45 45 ALA N N 130 123.243 122.662 0.581 1
1 452 . 17 1 1 A 46 46 GLY H H 131 8.818 8.210 0.608 1
1 453 . 17 1 1 A 46 46 GLY HA2 H 131 4.941 3.942 0.999 1
1 454 . 17 1 1 A 46 46 GLY HA3 H 131 3.690 3.970 -0.280 1
1 455 . 17 1 1 A 46 46 GLY C C 131 173.528 174.753 -1.225 1
1 456 . 17 1 1 A 46 46 GLY CA C 131 45.060 46.857 -1.797 1
1 457 . 17 1 1 A 46 46 GLY N N 131 112.392 108.275 4.117 1
1 458 . 17 1 1 A 47 47 GLU H H 132 8.746 7.848 0.898 1
1 459 . 17 1 1 A 47 47 GLU HA H 132 4.584 4.341 0.243 1
1 464 . 17 1 1 A 47 47 GLU C C 132 175.223 175.667 -0.444 1
1 465 . 17 1 1 A 47 47 GLU CA C 132 55.008 57.296 -2.288 1
1 466 . 17 1 1 A 47 47 GLU CB C 132 32.939 30.577 2.362 1
1 468 . 17 1 1 A 47 47 GLU N N 132 122.107 121.311 0.796 1
1 469 . 17 1 1 A 48 48 PHE H H 133 8.920 9.078 -0.158 1
1 470 . 17 1 1 A 48 48 PHE HA H 133 4.822 4.782 0.040 1
1 475 . 17 1 1 A 48 48 PHE C C 133 175.499 174.908 0.591 1
1 476 . 17 1 1 A 48 48 PHE CA C 133 58.320 57.248 1.072 1
1 477 . 17 1 1 A 48 48 PHE CB C 133 39.175 39.638 -0.463 1
1 479 . 17 1 1 A 48 48 PHE N N 133 124.006 128.493 -4.487 1
1 480 . 17 1 1 A 49 49 VAL H H 134 8.161 8.215 -0.054 1
1 481 . 17 1 1 A 49 49 VAL HA H 134 4.492 4.830 -0.338 1
1 489 . 17 1 1 A 49 49 VAL C C 134 176.241 176.884 -0.643 1
1 490 . 17 1 1 A 49 49 VAL CA C 134 60.328 59.752 0.576 1
1 491 . 17 1 1 A 49 49 VAL CB C 134 34.542 34.743 -0.201 1
1 494 . 17 1 1 A 49 49 VAL N N 134 120.063 122.336 -2.273 1
1 495 . 17 1 1 A 50 50 ASP H H 135 8.596 8.615 -0.019 1
1 496 . 17 1 1 A 50 50 ASP HA H 135 4.278 4.431 -0.153 1
1 499 . 17 1 1 A 50 50 ASP C C 135 176.567 176.023 0.544 1
1 500 . 17 1 1 A 50 50 ASP CA C 135 57.149 57.110 0.039 1
1 501 . 17 1 1 A 50 50 ASP CB C 135 40.477 40.748 -0.271 1
1 502 . 17 1 1 A 50 50 ASP N N 135 122.137 121.820 0.317 1
1 503 . 17 1 1 A 51 51 ASP H H 136 8.328 7.794 0.534 1
1 504 . 17 1 1 A 51 51 ASP HA H 136 4.656 5.088 -0.432 1
1 507 . 17 1 1 A 51 51 ASP C C 136 175.798 174.580 1.218 1
1 508 . 17 1 1 A 51 51 ASP CA C 136 53.458 53.461 -0.003 1
1 509 . 17 1 1 A 51 51 ASP CB C 136 40.306 42.578 -2.272 1
1 510 . 17 1 1 A 51 51 ASP N N 136 116.158 115.493 0.665 1
1 511 . 17 1 1 A 52 52 GLY H H 137 7.653 8.071 -0.418 1
1 512 . 17 1 1 A 52 52 GLY HA2 H 137 4.685 3.902 0.783 1
1 513 . 17 1 1 A 52 52 GLY HA3 H 137 4.069 3.943 0.126 1
1 514 . 17 1 1 A 52 52 GLY C C 137 173.149 172.367 0.782 1
1 515 . 17 1 1 A 52 52 GLY CA C 137 45.860 43.965 1.895 1
1 516 . 17 1 1 A 52 52 GLY N N 137 107.634 108.709 -1.075 1
1 517 . 17 1 1 A 53 53 THR H H 138 8.445 8.058 0.387 1
1 518 . 17 1 1 A 53 53 THR HA H 138 4.996 4.880 0.116 1
1 523 . 17 1 1 A 53 53 THR C C 138 174.163 173.094 1.069 1
1 524 . 17 1 1 A 53 53 THR CA C 138 60.974 61.434 -0.460 1
1 525 . 17 1 1 A 53 53 THR CB C 138 72.266 71.848 0.418 1
1 527 . 17 1 1 A 53 53 THR N N 138 114.976 114.657 0.319 1
1 528 . 17 1 1 A 54 54 GLU H H 139 8.917 8.954 -0.037 1
1 529 . 17 1 1 A 54 54 GLU HA H 139 5.205 4.657 0.548 1
1 534 . 17 1 1 A 54 54 GLU C C 139 175.700 174.907 0.793 1
1 535 . 17 1 1 A 54 54 GLU CA C 139 54.731 55.282 -0.551 1
1 536 . 17 1 1 A 54 54 GLU CB C 139 33.250 29.923 3.327 1
1 538 . 17 1 1 A 54 54 GLU N N 139 121.295 125.914 -4.619 1
1 539 . 17 1 1 A 55 55 THR H H 140 9.190 8.269 0.921 1
1 540 . 17 1 1 A 55 55 THR HA H 140 4.744 4.533 0.211 1
1 545 . 17 1 1 A 55 55 THR C C 140 174.537 173.215 1.322 1
1 546 . 17 1 1 A 55 55 THR CA C 140 62.678 61.754 0.924 1
1 547 . 17 1 1 A 55 55 THR CB C 140 69.744 69.040 0.704 1
1 549 . 17 1 1 A 55 55 THR N N 140 122.419 118.929 3.490 1
1 550 . 17 1 1 A 56 56 HIS H H 141 9.395 8.956 0.439 1
1 551 . 17 1 1 A 56 56 HIS HA H 141 5.204 5.024 0.180 1
1 556 . 17 1 1 A 56 56 HIS C C 141 174.675 175.158 -0.483 1
1 557 . 17 1 1 A 56 56 HIS CA C 141 55.557 53.764 1.793 1
1 558 . 17 1 1 A 56 56 HIS CB C 141 31.279 31.145 0.134 1
1 561 . 17 1 1 A 56 56 HIS N N 141 125.732 124.607 1.125 1
1 564 . 17 1 1 A 57 57 PHE H H 142 8.790 8.554 0.236 1
1 565 . 17 1 1 A 57 57 PHE HA H 142 4.918 5.729 -0.811 1
1 571 . 17 1 1 A 57 57 PHE C C 142 172.293 172.799 -0.506 1
1 572 . 17 1 1 A 57 57 PHE CA C 142 56.366 55.349 1.017 1
1 573 . 17 1 1 A 57 57 PHE CB C 142 39.962 41.912 -1.950 1
1 575 . 17 1 1 A 57 57 PHE N N 142 117.009 121.906 -4.897 1
1 576 . 17 1 1 A 58 58 SER H H 143 8.890 9.195 -0.305 1
1 577 . 17 1 1 A 58 58 SER HA H 143 5.286 5.541 -0.255 1
1 580 . 17 1 1 A 58 58 SER C C 143 173.716 173.381 0.335 1
1 581 . 17 1 1 A 58 58 SER CA C 143 57.517 56.818 0.699 1
1 582 . 17 1 1 A 58 58 SER CB C 143 65.448 66.995 -1.547 1
1 583 . 17 1 1 A 58 58 SER N N 143 115.269 113.185 2.084 1
1 584 . 17 1 1 A 59 59 VAL H H 144 7.737 8.744 -1.007 1
1 585 . 17 1 1 A 59 59 VAL HA H 144 4.220 4.452 -0.232 1
1 593 . 17 1 1 A 59 59 VAL C C 144 176.234 176.042 0.192 1
1 594 . 17 1 1 A 59 59 VAL CA C 144 61.741 60.864 0.877 1
1 595 . 17 1 1 A 59 59 VAL CB C 144 33.711 33.709 0.002 1
1 598 . 17 1 1 A 59 59 VAL N N 144 123.186 120.382 2.804 1
1 599 . 17 1 1 A 60 60 GLY H H 145 8.945 9.028 -0.083 1
1 600 . 17 1 1 A 60 60 GLY HA2 H 145 4.027 3.764 0.263 1
1 601 . 17 1 1 A 60 60 GLY HA3 H 145 3.692 3.812 -0.120 1
1 602 . 17 1 1 A 60 60 GLY C C 145 175.182 175.129 0.053 1
1 603 . 17 1 1 A 60 60 GLY CA C 145 47.141 47.252 -0.111 1
1 604 . 17 1 1 A 60 60 GLY N N 145 116.908 118.027 -1.119 1
1 605 . 17 1 1 A 61 61 ASN H H 146 8.929 8.620 0.309 1
1 606 . 17 1 1 A 61 61 ASN HA H 146 4.718 4.844 -0.126 1
1 611 . 17 1 1 A 61 61 ASN C C 146 174.706 175.276 -0.570 1
1 612 . 17 1 1 A 61 61 ASN CA C 146 52.802 53.406 -0.604 1
1 613 . 17 1 1 A 61 61 ASN CB C 146 37.917 39.926 -2.009 1
1 614 . 17 1 1 A 61 61 ASN N N 146 123.976 124.651 -0.675 1
1 616 . 17 1 1 A 62 62 HIS H H 147 8.400 6.914 1.486 1
1 617 . 17 1 1 A 62 62 HIS HA H 147 4.762 4.645 0.117 1
1 622 . 17 1 1 A 62 62 HIS C C 147 173.871 174.715 -0.844 1
1 623 . 17 1 1 A 62 62 HIS CA C 147 55.374 56.393 -1.019 1
1 624 . 17 1 1 A 62 62 HIS CB C 147 28.655 30.065 -1.410 1
1 628 . 17 1 1 A 62 62 HIS N N 147 118.620 117.300 1.320 1
1 631 . 17 1 1 A 63 63 ASP H H 148 8.734 8.820 -0.086 1
1 632 . 17 1 1 A 63 63 ASP HA H 148 4.785 5.163 -0.378 1
1 635 . 17 1 1 A 63 63 ASP C C 148 175.269 174.723 0.546 1
1 636 . 17 1 1 A 63 63 ASP CA C 148 54.390 54.027 0.363 1
1 637 . 17 1 1 A 63 63 ASP CB C 148 42.105 43.613 -1.508 1
1 638 . 17 1 1 A 63 63 ASP N N 148 125.336 120.094 5.242 1
1 639 . 17 1 1 A 64 64 CYS H H 149 8.225 9.254 -1.029 1
1 640 . 17 1 1 A 64 64 CYS HA H 149 5.118 5.371 -0.253 1
1 643 . 17 1 1 A 64 64 CYS C C 149 173.740 172.746 0.994 1
1 644 . 17 1 1 A 64 64 CYS CA C 149 55.423 56.693 -1.270 1
1 645 . 17 1 1 A 64 64 CYS CB C 149 29.972 32.638 -2.666 1
1 646 . 17 1 1 A 64 64 CYS N N 149 124.476 123.539 0.937 1
1 647 . 17 1 1 A 65 65 TYR H H 150 8.916 8.773 0.143 1
1 648 . 17 1 1 A 65 65 TYR HA H 150 5.121 3.504 1.617 1
1 655 . 17 1 1 A 65 65 TYR C C 150 172.821 171.913 0.908 1
1 656 . 17 1 1 A 65 65 TYR CA C 150 56.347 55.477 0.870 1
1 657 . 17 1 1 A 65 65 TYR CB C 150 38.901 40.680 -1.779 1
1 662 . 17 1 1 A 65 65 TYR N N 150 115.313 117.072 -1.759 1
1 663 . 17 1 1 A 66 66 ILE H H 151 8.423 8.247 0.176 1
1 664 . 17 1 1 A 66 66 ILE HA H 151 5.000 4.257 0.743 1
1 674 . 17 1 1 A 66 66 ILE C C 151 176.225 174.706 1.519 1
1 675 . 17 1 1 A 66 66 ILE CA C 151 57.798 59.945 -2.147 1
1 676 . 17 1 1 A 66 66 ILE CB C 151 39.863 38.730 1.133 1
1 680 . 17 1 1 A 66 66 ILE N N 151 118.575 120.592 -2.017 1
1 681 . 17 1 1 A 67 67 LYS H H 152 9.480 8.743 0.737 1
1 682 . 17 1 1 A 67 67 LYS HA H 152 5.091 4.695 0.396 1
1 691 . 17 1 1 A 67 67 LYS C C 152 174.079 175.392 -1.313 1
1 692 . 17 1 1 A 67 67 LYS CA C 152 54.728 56.065 -1.337 1
1 693 . 17 1 1 A 67 67 LYS CB C 152 35.256 33.113 2.143 1
1 697 . 17 1 1 A 67 67 LYS N N 152 132.311 128.429 3.882 1
1 698 . 17 1 1 A 68 68 ALA H H 153 8.844 8.272 0.572 1
1 699 . 17 1 1 A 68 68 ALA HA H 153 5.039 5.391 -0.352 1
1 703 . 17 1 1 A 68 68 ALA C C 153 176.587 176.190 0.397 1
1 704 . 17 1 1 A 68 68 ALA CA C 153 50.484 50.675 -0.191 1
1 705 . 17 1 1 A 68 68 ALA CB C 153 20.570 21.725 -1.155 1
1 706 . 17 1 1 A 68 68 ALA N N 153 129.958 129.582 0.376 1
1 707 . 17 1 1 A 69 69 VAL H H 154 8.461 8.584 -0.123 1
1 708 . 17 1 1 A 69 69 VAL HA H 154 4.558 4.540 0.018 1
1 716 . 17 1 1 A 69 69 VAL C C 154 175.331 174.873 0.458 1
1 717 . 17 1 1 A 69 69 VAL CA C 154 60.758 60.823 -0.065 1
1 718 . 17 1 1 A 69 69 VAL CB C 154 34.743 35.322 -0.579 1
1 721 . 17 1 1 A 69 69 VAL N N 154 121.496 121.633 -0.137 1
1 722 . 17 1 1 A 70 70 SER H H 155 8.695 8.896 -0.201 1
1 723 . 17 1 1 A 70 70 SER HA H 155 4.646 5.237 -0.591 1
1 726 . 17 1 1 A 70 70 SER C C 155 174.690 173.634 1.056 1
1 727 . 17 1 1 A 70 70 SER CA C 155 58.065 56.869 1.196 1
1 728 . 17 1 1 A 70 70 SER CB C 155 64.062 64.564 -0.502 1
1 729 . 17 1 1 A 70 70 SER N N 155 119.763 121.648 -1.885 1
1 730 . 17 1 1 A 71 71 SER H H 156 8.360 9.073 -0.713 1
1 731 . 17 1 1 A 71 71 SER HA H 156 4.430 5.234 -0.804 1
1 734 . 17 1 1 A 71 71 SER CA C 156 58.491 56.236 2.255 1
1 735 . 17 1 1 A 71 71 SER CB C 156 64.061 66.039 -1.978 1
1 736 . 17 1 1 A 71 71 SER N N 156 118.577 116.926 1.651 1
1 737 . 17 1 1 A 72 72 GLY H H 157 8.542 8.400 0.142 1
1 738 . 17 1 1 A 72 72 GLY HA2 H 157 4.002 4.200 -0.198 1
1 739 . 17 1 1 A 72 72 GLY HA3 H 157 4.002 4.202 -0.200 1
1 740 . 17 1 1 A 72 72 GLY CA C 157 45.565 44.185 1.380 1
1 741 . 17 1 1 A 72 72 GLY N N 157 111.540 108.835 2.705 1
1 742 . 17 1 1 A 73 73 LYS H H 158 8.369 8.667 -0.298 1
1 743 . 17 1 1 A 73 73 LYS CA C 158 56.720 58.378 -1.658 1
1 744 . 17 1 1 A 73 73 LYS CB C 158 32.915 33.100 -0.185 1
1 747 . 17 1 1 A 73 73 LYS N N 158 120.293 120.481 -0.188 1
1 748 . 17 1 1 A 74 74 ARG H H 159 8.181 7.661 0.520 1
1 749 . 17 1 1 A 74 74 ARG CA C 159 56.148 54.986 1.162 1
1 751 . 17 1 1 A 74 74 ARG N N 159 119.343 116.980 2.363 1
1 752 . 17 1 1 A 75 75 LYS H H 160 8.443 8.175 0.268 1
1 753 . 17 1 1 A 75 75 LYS HA H 160 4.067 3.923 0.144 1
1 762 . 17 1 1 A 75 75 LYS C C 160 176.868 176.228 0.640 1
1 763 . 17 1 1 A 75 75 LYS CA C 160 57.711 57.156 0.555 1
1 764 . 17 1 1 A 75 75 LYS CB C 160 31.777 29.709 2.068 1
1 768 . 17 1 1 A 75 75 LYS N N 160 120.467 118.722 1.745 1
1 769 . 17 1 1 A 76 76 GLU H H 161 8.693 8.182 0.511 1
1 770 . 17 1 1 A 76 76 GLU HA H 161 4.290 4.339 -0.049 1
1 771 . 17 1 1 A 76 76 GLU C C 161 176.844 177.285 -0.441 1
1 772 . 17 1 1 A 76 76 GLU CA C 161 57.294 58.761 -1.467 1
1 773 . 17 1 1 A 76 76 GLU CB C 161 29.794 30.455 -0.661 1
1 775 . 17 1 1 A 76 76 GLU N N 161 118.767 117.609 1.158 1
1 776 . 17 1 1 A 77 77 GLY H H 162 8.168 7.766 0.402 1
1 777 . 17 1 1 A 77 77 GLY HA2 H 162 4.010 4.194 -0.184 1
1 778 . 17 1 1 A 77 77 GLY HA3 H 162 3.963 4.200 -0.237 1
1 779 . 17 1 1 A 77 77 GLY C C 162 173.512 171.737 1.775 1
1 780 . 17 1 1 A 77 77 GLY CA C 162 45.362 44.348 1.014 1
1 781 . 17 1 1 A 77 77 GLY N N 162 108.621 103.854 4.767 1
1 782 . 17 1 1 A 78 78 ILE H H 163 7.954 8.640 -0.686 1
1 783 . 17 1 1 A 78 78 ILE HA H 163 4.323 4.844 -0.521 1
1 793 . 17 1 1 A 78 78 ILE C C 163 175.402 175.139 0.263 1
1 794 . 17 1 1 A 78 78 ILE CA C 163 60.632 59.321 1.311 1
1 795 . 17 1 1 A 78 78 ILE CB C 163 39.759 41.240 -1.481 1
1 799 . 17 1 1 A 78 78 ILE N N 163 121.604 123.081 -1.477 1
1 800 . 17 1 1 A 79 79 ILE H H 164 8.514 8.740 -0.226 1
1 801 . 17 1 1 A 79 79 ILE HA H 164 4.341 4.753 -0.412 1
1 811 . 17 1 1 A 79 79 ILE C C 164 175.172 174.735 0.437 1
1 812 . 17 1 1 A 79 79 ILE CA C 164 60.027 59.812 0.215 1
1 813 . 17 1 1 A 79 79 ILE CB C 164 40.153 41.230 -1.077 1
1 817 . 17 1 1 A 79 79 ILE N N 164 127.137 126.314 0.823 1
1 818 . 17 1 1 A 80 80 HIS H H 165 8.492 8.989 -0.497 1
1 819 . 17 1 1 A 80 80 HIS HA H 165 5.676 5.402 0.274 1
1 824 . 17 1 1 A 80 80 HIS C C 165 175.502 174.111 1.391 1
1 825 . 17 1 1 A 80 80 HIS CA C 165 57.043 54.962 2.081 1
1 826 . 17 1 1 A 80 80 HIS CB C 165 32.741 32.713 0.028 1
1 829 . 17 1 1 A 80 80 HIS N N 165 125.422 126.200 -0.778 1
1 830 . 17 1 1 A 81 81 THR H H 166 9.080 9.144 -0.064 1
1 831 . 17 1 1 A 81 81 THR HA H 166 4.999 4.999 0.000 1
1 836 . 17 1 1 A 81 81 THR C C 166 171.877 172.807 -0.930 1
1 837 . 17 1 1 A 81 81 THR CA C 166 59.924 61.118 -1.194 1
1 838 . 17 1 1 A 81 81 THR CB C 166 72.243 70.860 1.383 1
1 840 . 17 1 1 A 81 81 THR N N 166 117.682 113.963 3.719 1
1 841 . 17 1 1 A 82 82 LEU H H 167 8.062 7.841 0.221 1
1 842 . 17 1 1 A 82 82 LEU HA H 167 4.350 3.848 0.502 1
1 852 . 17 1 1 A 82 82 LEU C C 167 172.705 174.959 -2.254 1
1 853 . 17 1 1 A 82 82 LEU CA C 167 53.553 55.588 -2.035 1
1 854 . 17 1 1 A 82 82 LEU CB C 167 39.768 41.268 -1.500 1
1 858 . 17 1 1 A 82 82 LEU N N 167 125.369 128.236 -2.867 1
1 859 . 17 1 1 A 83 83 ILE H H 168 8.657 8.321 0.336 1
1 860 . 17 1 1 A 83 83 ILE HA H 168 4.476 4.939 -0.463 1
1 870 . 17 1 1 A 83 83 ILE C C 168 175.159 174.413 0.746 1
1 871 . 17 1 1 A 83 83 ILE CA C 168 58.529 60.247 -1.718 1
1 872 . 17 1 1 A 83 83 ILE CB C 168 37.410 40.252 -2.842 1
1 876 . 17 1 1 A 83 83 ILE N N 168 128.042 127.660 0.382 1
1 877 . 17 1 1 A 84 84 VAL H H 169 8.464 8.401 0.063 1
1 878 . 17 1 1 A 84 84 VAL HA H 169 4.284 4.498 -0.214 1
1 886 . 17 1 1 A 84 84 VAL C C 169 176.138 175.964 0.174 1
1 887 . 17 1 1 A 84 84 VAL CA C 169 61.029 61.422 -0.393 1
1 888 . 17 1 1 A 84 84 VAL CB C 169 34.714 34.026 0.688 1
1 891 . 17 1 1 A 84 84 VAL N N 169 124.644 126.959 -2.315 1
1 892 . 17 1 1 A 85 85 ASP H H 170 9.158 9.104 0.054 1
1 893 . 17 1 1 A 85 85 ASP HA H 170 4.362 4.299 0.063 1
1 896 . 17 1 1 A 85 85 ASP C C 170 175.489 175.337 0.152 1
1 897 . 17 1 1 A 85 85 ASP CA C 170 55.868 55.190 0.678 1
1 898 . 17 1 1 A 85 85 ASP CB C 170 38.927 39.453 -0.526 1
1 899 . 17 1 1 A 85 85 ASP N N 170 129.061 127.541 1.520 1
1 900 . 17 1 1 A 86 86 ASN H H 171 8.811 8.439 0.372 1
1 901 . 17 1 1 A 86 86 ASN HA H 171 4.053 4.322 -0.269 1
1 906 . 17 1 1 A 86 86 ASN C C 171 173.802 173.889 -0.087 1
1 907 . 17 1 1 A 86 86 ASN CA C 171 55.173 54.324 0.849 1
1 908 . 17 1 1 A 86 86 ASN CB C 171 38.150 37.373 0.777 1
1 909 . 17 1 1 A 86 86 ASN N N 171 108.418 115.137 -6.719 1
1 911 . 17 1 1 A 87 87 ARG H H 172 7.914 7.516 0.398 1
1 912 . 17 1 1 A 87 87 ARG HA H 172 4.597 4.689 -0.092 1
1 919 . 17 1 1 A 87 87 ARG C C 172 174.025 174.873 -0.848 1
1 920 . 17 1 1 A 87 87 ARG CA C 172 54.846 54.085 0.761 1
1 921 . 17 1 1 A 87 87 ARG CB C 172 32.697 33.404 -0.707 1
1 924 . 17 1 1 A 87 87 ARG N N 172 120.988 117.541 3.447 1
1 925 . 17 1 1 A 88 88 GLU H H 173 8.534 8.722 -0.188 1
1 926 . 17 1 1 A 88 88 GLU HA H 173 4.560 4.351 0.209 1
1 931 . 17 1 1 A 88 88 GLU C C 173 176.187 175.454 0.733 1
1 932 . 17 1 1 A 88 88 GLU CA C 173 56.044 56.853 -0.809 1
1 933 . 17 1 1 A 88 88 GLU CB C 173 30.329 30.420 -0.091 1
1 935 . 17 1 1 A 88 88 GLU N N 173 123.982 124.256 -0.274 1
1 936 . 17 1 1 A 89 89 ILE H H 174 8.897 7.963 0.934 1
1 937 . 17 1 1 A 89 89 ILE HA H 174 4.666 4.568 0.098 1
1 947 . 17 1 1 A 89 89 ILE C C 174 174.110 174.108 0.002 1
1 948 . 17 1 1 A 89 89 ILE CA C 174 55.255 57.370 -2.115 1
1 949 . 17 1 1 A 89 89 ILE CB C 174 37.851 41.691 -3.840 1
1 953 . 17 1 1 A 89 89 ILE N N 174 130.008 127.264 2.744 1
1 954 . 17 1 1 A 90 90 PRO HA H 175 4.713 4.707 0.006 1
1 961 . 17 1 1 A 90 90 PRO C C 175 176.956 176.467 0.489 1
1 962 . 17 1 1 A 90 90 PRO CA C 175 63.159 62.809 0.350 1
1 963 . 17 1 1 A 90 90 PRO CB C 175 32.428 32.494 -0.066 1
1 966 . 17 1 1 A 91 91 GLU H H 176 8.778 8.769 0.009 1
1 967 . 17 1 1 A 91 91 GLU HA H 176 3.910 4.750 -0.840 1
1 972 . 17 1 1 A 91 91 GLU C C 176 176.426 176.964 -0.538 1
1 973 . 17 1 1 A 91 91 GLU CA C 176 56.738 56.047 0.691 1
1 974 . 17 1 1 A 91 91 GLU CB C 176 30.540 31.411 -0.871 1
1 976 . 17 1 1 A 91 91 GLU N N 176 124.561 122.020 2.541 1
1 977 . 17 1 1 A 92 92 LEU H H 177 8.630 8.383 0.247 1
1 978 . 17 1 1 A 92 92 LEU HA H 177 4.419 3.952 0.467 1
1 988 . 17 1 1 A 92 92 LEU C C 177 177.162 176.720 0.442 1
1 989 . 17 1 1 A 92 92 LEU CA C 177 55.350 58.777 -3.427 1
1 990 . 17 1 1 A 92 92 LEU CB C 177 42.390 41.808 0.582 1
1 994 . 17 1 1 A 92 92 LEU N N 177 126.683 128.754 -2.071 1
1 995 . 17 1 1 A 93 93 THR H H 178 8.375 8.026 0.349 1
1 996 . 17 1 1 A 93 93 THR HA H 178 4.359 3.997 0.362 1
1 1001 . 17 1 1 A 93 93 THR C C 178 173.589 174.885 -1.296 1
1 1002 . 17 1 1 A 93 93 THR CA C 178 61.621 62.904 -1.283 1
1 1003 . 17 1 1 A 93 93 THR CB C 178 69.724 66.526 3.198 1
1 1005 . 17 1 1 A 93 93 THR N N 178 119.699 111.418 8.281 1
1 1 . 18 1 1 A 9 9 SER H H 94 8.475 8.182 0.293 1
1 2 . 18 1 1 A 9 9 SER CA C 94 58.531 59.482 -0.951 1
1 3 . 18 1 1 A 9 9 SER N N 94 117.432 111.706 5.726 1
1 4 . 18 1 1 A 10 10 LYS H H 95 8.527 8.169 0.358 1
1 5 . 18 1 1 A 10 10 LYS C C 95 174.594 175.668 -1.074 1
1 6 . 18 1 1 A 10 10 LYS CA C 95 56.603 58.058 -1.455 1
1 7 . 18 1 1 A 10 10 LYS N N 95 123.104 120.538 2.566 1
1 8 . 18 1 1 A 11 11 THR H H 96 8.245 8.447 -0.202 1
1 9 . 18 1 1 A 11 11 THR C C 96 174.393 173.660 0.733 1
1 10 . 18 1 1 A 11 11 THR CA C 96 62.149 61.325 0.824 1
1 11 . 18 1 1 A 11 11 THR CB C 96 69.183 70.654 -1.471 1
1 13 . 18 1 1 A 11 11 THR N N 96 113.245 116.471 -3.226 1
1 14 . 18 1 1 A 12 12 THR H H 97 7.769 7.556 0.213 1
1 15 . 18 1 1 A 12 12 THR HA H 97 5.583 4.878 0.705 1
1 20 . 18 1 1 A 12 12 THR C C 97 174.726 172.211 2.515 1
1 21 . 18 1 1 A 12 12 THR CA C 97 59.602 60.805 -1.203 1
1 22 . 18 1 1 A 12 12 THR CB C 97 72.805 71.368 1.437 1
1 24 . 18 1 1 A 12 12 THR N N 97 113.440 114.074 -0.634 1
1 25 . 18 1 1 A 13 13 SER H H 98 8.593 8.572 0.021 1
1 26 . 18 1 1 A 13 13 SER HA H 98 4.448 5.337 -0.889 1
1 29 . 18 1 1 A 13 13 SER C C 98 171.426 172.531 -1.105 1
1 30 . 18 1 1 A 13 13 SER CA C 98 59.056 56.950 2.106 1
1 31 . 18 1 1 A 13 13 SER CB C 98 67.839 64.664 3.175 1
1 32 . 18 1 1 A 13 13 SER N N 98 119.042 121.381 -2.339 1
1 33 . 18 1 1 A 14 14 THR H H 99 8.155 8.082 0.073 1
1 34 . 18 1 1 A 14 14 THR HA H 99 5.383 4.937 0.446 1
1 39 . 18 1 1 A 14 14 THR C C 99 171.565 172.912 -1.347 1
1 40 . 18 1 1 A 14 14 THR CA C 99 61.291 60.723 0.568 1
1 41 . 18 1 1 A 14 14 THR CB C 99 71.654 72.164 -0.510 1
1 43 . 18 1 1 A 14 14 THR N N 99 118.204 116.440 1.764 1
1 44 . 18 1 1 A 15 15 TRP H H 100 9.637 9.323 0.314 1
1 45 . 18 1 1 A 15 15 TRP HA H 100 4.807 5.269 -0.462 1
1 54 . 18 1 1 A 15 15 TRP C C 100 174.399 175.556 -1.157 1
1 55 . 18 1 1 A 15 15 TRP CA C 100 58.302 56.207 2.095 1
1 56 . 18 1 1 A 15 15 TRP CB C 100 34.810 33.537 1.273 1
1 63 . 18 1 1 A 15 15 TRP N N 100 125.132 125.673 -0.541 1
1 65 . 18 1 1 A 16 16 VAL H H 101 8.863 9.060 -0.197 1
1 66 . 18 1 1 A 16 16 VAL HA H 101 5.267 4.746 0.521 1
1 74 . 18 1 1 A 16 16 VAL C C 101 174.955 175.236 -0.281 1
1 75 . 18 1 1 A 16 16 VAL CA C 101 60.653 61.674 -1.021 1
1 76 . 18 1 1 A 16 16 VAL CB C 101 34.284 32.878 1.406 1
1 79 . 18 1 1 A 16 16 VAL N N 101 119.527 123.146 -3.619 1
1 80 . 18 1 1 A 17 17 LEU H H 102 8.961 8.946 0.015 1
1 81 . 18 1 1 A 17 17 LEU HA H 102 4.729 5.089 -0.360 1
1 91 . 18 1 1 A 17 17 LEU C C 102 173.559 175.085 -1.526 1
1 92 . 18 1 1 A 17 17 LEU CA C 102 55.144 53.122 2.022 1
1 93 . 18 1 1 A 17 17 LEU CB C 102 42.948 45.916 -2.968 1
1 97 . 18 1 1 A 17 17 LEU N N 102 124.280 123.911 0.369 1
1 98 . 18 1 1 A 18 18 ARG H H 103 8.305 8.418 -0.113 1
1 99 . 18 1 1 A 18 18 ARG HA H 103 5.139 4.650 0.489 1
1 106 . 18 1 1 A 18 18 ARG C C 103 175.347 175.204 0.143 1
1 107 . 18 1 1 A 18 18 ARG CA C 103 54.793 56.112 -1.319 1
1 108 . 18 1 1 A 18 18 ARG CB C 103 31.347 29.764 1.583 1
1 111 . 18 1 1 A 18 18 ARG N N 103 122.020 120.136 1.884 1
1 112 . 18 1 1 A 19 19 LEU H H 104 8.676 8.782 -0.106 1
1 113 . 18 1 1 A 19 19 LEU HA H 104 4.482 4.861 -0.379 1
1 123 . 18 1 1 A 19 19 LEU C C 104 175.957 175.766 0.191 1
1 124 . 18 1 1 A 19 19 LEU CA C 104 53.581 53.704 -0.123 1
1 125 . 18 1 1 A 19 19 LEU CB C 104 45.697 45.236 0.461 1
1 129 . 18 1 1 A 19 19 LEU N N 104 126.378 125.072 1.306 1
1 130 . 18 1 1 A 20 20 ASP H H 105 9.390 9.563 -0.173 1
1 131 . 18 1 1 A 20 20 ASP HA H 105 4.287 4.395 -0.108 1
1 134 . 18 1 1 A 20 20 ASP C C 105 175.947 175.976 -0.029 1
1 135 . 18 1 1 A 20 20 ASP CA C 105 55.263 55.339 -0.076 1
1 136 . 18 1 1 A 20 20 ASP CB C 105 39.239 39.388 -0.149 1
1 137 . 18 1 1 A 20 20 ASP N N 105 125.208 125.899 -0.691 1
1 138 . 18 1 1 A 21 21 GLY H H 106 8.563 8.637 -0.074 1
1 139 . 18 1 1 A 21 21 GLY HA2 H 106 4.126 3.833 0.293 1
1 140 . 18 1 1 A 21 21 GLY HA3 H 106 3.509 3.835 -0.326 1
1 141 . 18 1 1 A 21 21 GLY C C 106 173.164 173.743 -0.579 1
1 142 . 18 1 1 A 21 21 GLY CA C 106 45.499 45.512 -0.013 1
1 143 . 18 1 1 A 21 21 GLY N N 106 103.331 104.503 -1.172 1
1 144 . 18 1 1 A 22 22 GLU H H 107 7.713 7.990 -0.277 1
1 145 . 18 1 1 A 22 22 GLU HA H 107 4.634 4.939 -0.305 1
1 150 . 18 1 1 A 22 22 GLU C C 107 174.800 174.905 -0.105 1
1 151 . 18 1 1 A 22 22 GLU CA C 107 54.329 54.296 0.033 1
1 152 . 18 1 1 A 22 22 GLU CB C 107 32.832 34.063 -1.231 1
1 154 . 18 1 1 A 22 22 GLU N N 107 119.470 119.385 0.085 1
1 155 . 18 1 1 A 23 23 ASP H H 108 8.632 8.569 0.063 1
1 156 . 18 1 1 A 23 23 ASP HA H 108 4.872 4.729 0.143 1
1 159 . 18 1 1 A 23 23 ASP C C 108 175.533 175.613 -0.080 1
1 160 . 18 1 1 A 23 23 ASP CA C 108 55.180 53.931 1.249 1
1 161 . 18 1 1 A 23 23 ASP CB C 108 41.504 39.353 2.151 1
1 162 . 18 1 1 A 23 23 ASP N N 108 122.815 121.547 1.268 1
1 163 . 18 1 1 A 24 24 LEU H H 109 9.248 8.838 0.410 1
1 164 . 18 1 1 A 24 24 LEU HA H 109 4.836 4.501 0.335 1
1 174 . 18 1 1 A 24 24 LEU C C 109 174.322 175.823 -1.501 1
1 175 . 18 1 1 A 24 24 LEU CA C 109 54.473 55.306 -0.833 1
1 176 . 18 1 1 A 24 24 LEU CB C 109 44.718 42.620 2.098 1
1 180 . 18 1 1 A 24 24 LEU N N 109 125.550 126.628 -1.078 1
1 181 . 18 1 1 A 25 25 ARG H H 110 8.503 8.593 -0.090 1
1 182 . 18 1 1 A 25 25 ARG HA H 110 5.228 4.925 0.303 1
1 189 . 18 1 1 A 25 25 ARG C C 110 175.174 174.869 0.305 1
1 190 . 18 1 1 A 25 25 ARG CA C 110 54.745 54.669 0.076 1
1 191 . 18 1 1 A 25 25 ARG CB C 110 31.701 32.100 -0.399 1
1 194 . 18 1 1 A 25 25 ARG N N 110 125.424 127.483 -2.059 1
1 195 . 18 1 1 A 26 26 VAL H H 111 9.692 9.294 0.398 1
1 196 . 18 1 1 A 26 26 VAL HA H 111 5.091 5.174 -0.083 1
1 204 . 18 1 1 A 26 26 VAL C C 111 174.446 175.170 -0.724 1
1 205 . 18 1 1 A 26 26 VAL CA C 111 61.055 61.474 -0.419 1
1 206 . 18 1 1 A 26 26 VAL CB C 111 33.780 33.978 -0.198 1
1 209 . 18 1 1 A 26 26 VAL N N 111 130.649 126.987 3.662 1
1 210 . 18 1 1 A 27 27 VAL H H 112 9.401 8.843 0.558 1
1 211 . 18 1 1 A 27 27 VAL HA H 112 5.188 5.112 0.076 1
1 219 . 18 1 1 A 27 27 VAL C C 112 174.214 174.876 -0.662 1
1 220 . 18 1 1 A 27 27 VAL CA C 112 60.722 60.383 0.339 1
1 221 . 18 1 1 A 27 27 VAL CB C 112 36.082 35.868 0.214 1
1 224 . 18 1 1 A 27 27 VAL N N 112 127.416 126.144 1.272 1
1 225 . 18 1 1 A 28 28 LEU H H 113 9.265 8.977 0.288 1
1 226 . 18 1 1 A 28 28 LEU HA H 113 5.337 5.170 0.167 1
1 236 . 18 1 1 A 28 28 LEU C C 113 175.915 175.251 0.664 1
1 237 . 18 1 1 A 28 28 LEU CA C 113 52.599 53.922 -1.323 1
1 238 . 18 1 1 A 28 28 LEU CB C 113 47.495 44.713 2.782 1
1 242 . 18 1 1 A 28 28 LEU N N 113 127.527 127.069 0.458 1
1 243 . 18 1 1 A 29 29 GLU H H 114 8.968 8.570 0.398 1
1 244 . 18 1 1 A 29 29 GLU HA H 114 4.701 4.257 0.444 1
1 249 . 18 1 1 A 29 29 GLU C C 114 176.715 177.467 -0.752 1
1 250 . 18 1 1 A 29 29 GLU CA C 114 55.342 56.607 -1.265 1
1 251 . 18 1 1 A 29 29 GLU CB C 114 30.005 30.300 -0.295 1
1 253 . 18 1 1 A 29 29 GLU N N 114 127.374 127.321 0.053 1
1 254 . 18 1 1 A 30 30 LYS H H 115 8.243 8.540 -0.297 1
1 255 . 18 1 1 A 30 30 LYS HA H 115 3.711 4.133 -0.422 1
1 264 . 18 1 1 A 30 30 LYS C C 115 177.137 178.234 -1.097 1
1 265 . 18 1 1 A 30 30 LYS CA C 115 60.118 58.818 1.300 1
1 266 . 18 1 1 A 30 30 LYS CB C 115 32.656 32.107 0.549 1
1 270 . 18 1 1 A 30 30 LYS N N 115 124.225 125.311 -1.086 1
1 271 . 18 1 1 A 31 31 ASP H H 116 9.200 7.971 1.229 1
1 272 . 18 1 1 A 31 31 ASP HA H 116 4.444 4.388 0.056 1
1 275 . 18 1 1 A 31 31 ASP C C 116 177.774 177.009 0.765 1
1 276 . 18 1 1 A 31 31 ASP CA C 116 56.703 57.482 -0.779 1
1 277 . 18 1 1 A 31 31 ASP CB C 116 40.236 41.099 -0.863 1
1 278 . 18 1 1 A 31 31 ASP N N 116 115.955 119.845 -3.890 1
1 279 . 18 1 1 A 32 32 THR H H 117 7.352 7.608 -0.256 1
1 280 . 18 1 1 A 32 32 THR HA H 117 4.266 4.604 -0.338 1
1 285 . 18 1 1 A 32 32 THR C C 117 175.320 173.961 1.359 1
1 286 . 18 1 1 A 32 32 THR CA C 117 61.171 60.828 0.343 1
1 287 . 18 1 1 A 32 32 THR CB C 117 70.221 69.234 0.987 1
1 289 . 18 1 1 A 32 32 THR N N 117 106.440 108.854 -2.414 1
1 290 . 18 1 1 A 33 33 MET H H 118 8.216 7.886 0.330 1
1 291 . 18 1 1 A 33 33 MET HA H 118 4.184 4.324 -0.140 1
1 299 . 18 1 1 A 33 33 MET C C 118 174.952 174.809 0.143 1
1 300 . 18 1 1 A 33 33 MET CA C 118 55.195 56.563 -1.368 1
1 301 . 18 1 1 A 33 33 MET CB C 118 25.900 32.063 -6.163 1
1 304 . 18 1 1 A 33 33 MET N N 118 115.956 119.763 -3.807 1
1 305 . 18 1 1 A 34 34 ASP H H 119 7.509 7.982 -0.473 1
1 306 . 18 1 1 A 34 34 ASP HA H 119 4.486 4.800 -0.314 1
1 309 . 18 1 1 A 34 34 ASP C C 119 174.375 175.220 -0.845 1
1 310 . 18 1 1 A 34 34 ASP CA C 119 54.745 54.137 0.608 1
1 311 . 18 1 1 A 34 34 ASP CB C 119 42.865 42.209 0.656 1
1 312 . 18 1 1 A 34 34 ASP N N 119 118.500 118.918 -0.418 1
1 313 . 18 1 1 A 35 35 VAL H H 120 8.473 8.261 0.212 1
1 314 . 18 1 1 A 35 35 VAL HA H 120 4.709 4.951 -0.242 1
1 322 . 18 1 1 A 35 35 VAL C C 120 173.900 174.364 -0.464 1
1 323 . 18 1 1 A 35 35 VAL CA C 120 60.736 61.294 -0.558 1
1 324 . 18 1 1 A 35 35 VAL CB C 120 34.662 33.128 1.534 1
1 327 . 18 1 1 A 35 35 VAL N N 120 121.116 120.519 0.597 1
1 328 . 18 1 1 A 36 36 TRP H H 121 9.404 9.131 0.273 1
1 329 . 18 1 1 A 36 36 TRP HA H 121 5.174 5.500 -0.326 1
1 338 . 18 1 1 A 36 36 TRP C C 121 176.480 174.444 2.036 1
1 339 . 18 1 1 A 36 36 TRP CA C 121 55.070 55.084 -0.014 1
1 340 . 18 1 1 A 36 36 TRP CB C 121 32.179 32.631 -0.452 1
1 348 . 18 1 1 A 36 36 TRP N N 121 126.924 128.797 -1.873 1
1 350 . 18 1 1 A 37 37 CYS H H 122 9.230 8.453 0.777 1
1 351 . 18 1 1 A 37 37 CYS HA H 122 5.417 4.751 0.666 1
1 354 . 18 1 1 A 37 37 CYS C C 122 175.346 173.443 1.903 1
1 355 . 18 1 1 A 37 37 CYS CA C 122 57.083 57.849 -0.766 1
1 356 . 18 1 1 A 37 37 CYS CB C 122 28.713 30.292 -1.579 1
1 357 . 18 1 1 A 37 37 CYS N N 122 120.375 127.020 -6.645 1
1 358 . 18 1 1 A 38 38 ASN H H 123 9.817 9.166 0.651 1
1 359 . 18 1 1 A 38 38 ASN HA H 123 4.637 4.276 0.361 1
1 364 . 18 1 1 A 38 38 ASN C C 123 175.526 175.164 0.362 1
1 365 . 18 1 1 A 38 38 ASN CA C 123 54.023 54.357 -0.334 1
1 366 . 18 1 1 A 38 38 ASN CB C 123 36.581 37.297 -0.716 1
1 367 . 18 1 1 A 38 38 ASN N N 123 129.408 126.018 3.390 1
1 369 . 18 1 1 A 39 39 GLY H H 124 9.092 8.035 1.057 1
1 370 . 18 1 1 A 39 39 GLY HA2 H 124 4.241 3.037 1.204 1
1 371 . 18 1 1 A 39 39 GLY HA3 H 124 3.705 3.702 0.003 1
1 372 . 18 1 1 A 39 39 GLY C C 124 173.405 173.568 -0.163 1
1 373 . 18 1 1 A 39 39 GLY CA C 124 45.595 46.524 -0.929 1
1 374 . 18 1 1 A 39 39 GLY N N 124 102.752 103.498 -0.746 1
1 375 . 18 1 1 A 40 40 GLN H H 125 8.006 7.428 0.578 1
1 376 . 18 1 1 A 40 40 GLN HA H 125 4.736 4.864 -0.128 1
1 383 . 18 1 1 A 40 40 GLN C C 125 174.477 174.841 -0.364 1
1 384 . 18 1 1 A 40 40 GLN CA C 125 53.747 54.901 -1.154 1
1 385 . 18 1 1 A 40 40 GLN CB C 125 30.413 31.390 -0.977 1
1 387 . 18 1 1 A 40 40 GLN N N 125 120.627 119.430 1.197 1
1 389 . 18 1 1 A 41 41 LYS H H 126 8.757 8.664 0.093 1
1 390 . 18 1 1 A 41 41 LYS HA H 126 3.464 4.523 -1.059 1
1 399 . 18 1 1 A 41 41 LYS C C 126 176.870 176.506 0.364 1
1 400 . 18 1 1 A 41 41 LYS CA C 126 57.136 57.042 0.094 1
1 401 . 18 1 1 A 41 41 LYS CB C 126 31.669 32.969 -1.300 1
1 405 . 18 1 1 A 41 41 LYS N N 126 129.107 127.369 1.738 1
1 406 . 18 1 1 A 42 42 MET H H 127 8.682 8.667 0.015 1
1 407 . 18 1 1 A 42 42 MET HA H 127 4.712 4.454 0.258 1
1 415 . 18 1 1 A 42 42 MET C C 127 176.816 175.322 1.494 1
1 416 . 18 1 1 A 42 42 MET CA C 127 52.958 56.085 -3.127 1
1 417 . 18 1 1 A 42 42 MET CB C 127 33.023 33.160 -0.137 1
1 420 . 18 1 1 A 42 42 MET N N 127 126.569 126.540 0.029 1
1 421 . 18 1 1 A 43 43 GLU H H 128 8.734 8.750 -0.016 1
1 422 . 18 1 1 A 43 43 GLU HA H 128 4.419 5.061 -0.642 1
1 427 . 18 1 1 A 43 43 GLU C C 128 176.531 176.542 -0.011 1
1 428 . 18 1 1 A 43 43 GLU CA C 128 56.475 55.174 1.301 1
1 429 . 18 1 1 A 43 43 GLU CB C 128 29.604 31.228 -1.624 1
1 431 . 18 1 1 A 43 43 GLU N N 128 123.734 119.500 4.234 1
1 432 . 18 1 1 A 44 44 THR H H 129 8.263 8.878 -0.615 1
1 433 . 18 1 1 A 44 44 THR HA H 129 5.385 5.383 0.002 1
1 438 . 18 1 1 A 44 44 THR C C 129 174.205 174.261 -0.056 1
1 439 . 18 1 1 A 44 44 THR CA C 129 59.160 60.457 -1.297 1
1 440 . 18 1 1 A 44 44 THR CB C 129 72.419 71.010 1.409 1
1 442 . 18 1 1 A 44 44 THR N N 129 115.081 117.676 -2.595 1
1 443 . 18 1 1 A 45 45 ALA H H 130 8.727 8.308 0.419 1
1 444 . 18 1 1 A 45 45 ALA HA H 130 4.749 4.496 0.253 1
1 448 . 18 1 1 A 45 45 ALA C C 130 177.017 178.527 -1.510 1
1 449 . 18 1 1 A 45 45 ALA CA C 130 51.645 52.622 -0.977 1
1 450 . 18 1 1 A 45 45 ALA CB C 130 21.364 21.031 0.333 1
1 451 . 18 1 1 A 45 45 ALA N N 130 123.243 123.174 0.069 1
1 452 . 18 1 1 A 46 46 GLY H H 131 8.818 8.254 0.564 1
1 453 . 18 1 1 A 46 46 GLY HA2 H 131 4.941 4.014 0.927 1
1 454 . 18 1 1 A 46 46 GLY HA3 H 131 3.690 4.038 -0.348 1
1 455 . 18 1 1 A 46 46 GLY C C 131 173.528 174.652 -1.124 1
1 456 . 18 1 1 A 46 46 GLY CA C 131 45.060 46.557 -1.497 1
1 457 . 18 1 1 A 46 46 GLY N N 131 112.392 107.426 4.966 1
1 458 . 18 1 1 A 47 47 GLU H H 132 8.746 8.127 0.619 1
1 459 . 18 1 1 A 47 47 GLU HA H 132 4.584 4.455 0.129 1
1 464 . 18 1 1 A 47 47 GLU C C 132 175.223 175.086 0.137 1
1 465 . 18 1 1 A 47 47 GLU CA C 132 55.008 56.012 -1.004 1
1 466 . 18 1 1 A 47 47 GLU CB C 132 32.939 30.131 2.808 1
1 468 . 18 1 1 A 47 47 GLU N N 132 122.107 119.352 2.755 1
1 469 . 18 1 1 A 48 48 PHE H H 133 8.920 9.091 -0.171 1
1 470 . 18 1 1 A 48 48 PHE HA H 133 4.822 4.898 -0.076 1
1 475 . 18 1 1 A 48 48 PHE C C 133 175.499 174.929 0.570 1
1 476 . 18 1 1 A 48 48 PHE CA C 133 58.320 57.490 0.830 1
1 477 . 18 1 1 A 48 48 PHE CB C 133 39.175 40.616 -1.441 1
1 479 . 18 1 1 A 48 48 PHE N N 133 124.006 126.352 -2.346 1
1 480 . 18 1 1 A 49 49 VAL H H 134 8.161 8.192 -0.031 1
1 481 . 18 1 1 A 49 49 VAL HA H 134 4.492 4.676 -0.184 1
1 489 . 18 1 1 A 49 49 VAL C C 134 176.241 176.462 -0.221 1
1 490 . 18 1 1 A 49 49 VAL CA C 134 60.328 59.295 1.033 1
1 491 . 18 1 1 A 49 49 VAL CB C 134 34.542 34.321 0.221 1
1 494 . 18 1 1 A 49 49 VAL N N 134 120.063 120.226 -0.163 1
1 495 . 18 1 1 A 50 50 ASP H H 135 8.596 8.365 0.231 1
1 496 . 18 1 1 A 50 50 ASP HA H 135 4.278 4.308 -0.030 1
1 499 . 18 1 1 A 50 50 ASP C C 135 176.567 176.375 0.192 1
1 500 . 18 1 1 A 50 50 ASP CA C 135 57.149 57.121 0.028 1
1 501 . 18 1 1 A 50 50 ASP CB C 135 40.477 40.861 -0.384 1
1 502 . 18 1 1 A 50 50 ASP N N 135 122.137 121.384 0.753 1
1 503 . 18 1 1 A 51 51 ASP H H 136 8.328 7.579 0.749 1
1 504 . 18 1 1 A 51 51 ASP HA H 136 4.656 4.953 -0.297 1
1 507 . 18 1 1 A 51 51 ASP C C 136 175.798 174.758 1.040 1
1 508 . 18 1 1 A 51 51 ASP CA C 136 53.458 53.093 0.365 1
1 509 . 18 1 1 A 51 51 ASP CB C 136 40.306 42.941 -2.635 1
1 510 . 18 1 1 A 51 51 ASP N N 136 116.158 116.493 -0.335 1
1 511 . 18 1 1 A 52 52 GLY H H 137 7.653 8.099 -0.446 1
1 512 . 18 1 1 A 52 52 GLY HA2 H 137 4.685 4.017 0.668 1
1 513 . 18 1 1 A 52 52 GLY HA3 H 137 4.069 4.031 0.038 1
1 514 . 18 1 1 A 52 52 GLY C C 137 173.149 172.506 0.643 1
1 515 . 18 1 1 A 52 52 GLY CA C 137 45.860 43.907 1.953 1
1 516 . 18 1 1 A 52 52 GLY N N 137 107.634 111.679 -4.045 1
1 517 . 18 1 1 A 53 53 THR H H 138 8.445 7.723 0.722 1
1 518 . 18 1 1 A 53 53 THR HA H 138 4.996 4.985 0.011 1
1 523 . 18 1 1 A 53 53 THR C C 138 174.163 173.367 0.796 1
1 524 . 18 1 1 A 53 53 THR CA C 138 60.974 61.603 -0.629 1
1 525 . 18 1 1 A 53 53 THR CB C 138 72.266 72.093 0.173 1
1 527 . 18 1 1 A 53 53 THR N N 138 114.976 114.297 0.679 1
1 528 . 18 1 1 A 54 54 GLU H H 139 8.917 8.750 0.167 1
1 529 . 18 1 1 A 54 54 GLU HA H 139 5.205 4.607 0.598 1
1 534 . 18 1 1 A 54 54 GLU C C 139 175.700 174.967 0.733 1
1 535 . 18 1 1 A 54 54 GLU CA C 139 54.731 55.639 -0.908 1
1 536 . 18 1 1 A 54 54 GLU CB C 139 33.250 29.920 3.330 1
1 538 . 18 1 1 A 54 54 GLU N N 139 121.295 126.523 -5.228 1
1 539 . 18 1 1 A 55 55 THR H H 140 9.190 8.423 0.767 1
1 540 . 18 1 1 A 55 55 THR HA H 140 4.744 4.656 0.088 1
1 545 . 18 1 1 A 55 55 THR C C 140 174.537 173.843 0.694 1
1 546 . 18 1 1 A 55 55 THR CA C 140 62.678 62.060 0.618 1
1 547 . 18 1 1 A 55 55 THR CB C 140 69.744 69.052 0.692 1
1 549 . 18 1 1 A 55 55 THR N N 140 122.419 122.188 0.231 1
1 550 . 18 1 1 A 56 56 HIS H H 141 9.395 9.159 0.236 1
1 551 . 18 1 1 A 56 56 HIS HA H 141 5.204 5.042 0.162 1
1 556 . 18 1 1 A 56 56 HIS C C 141 174.675 175.076 -0.401 1
1 557 . 18 1 1 A 56 56 HIS CA C 141 55.557 54.205 1.352 1
1 558 . 18 1 1 A 56 56 HIS CB C 141 31.279 30.113 1.166 1
1 561 . 18 1 1 A 56 56 HIS N N 141 125.732 126.126 -0.394 1
1 564 . 18 1 1 A 57 57 PHE H H 142 8.790 7.943 0.847 1
1 565 . 18 1 1 A 57 57 PHE HA H 142 4.918 5.794 -0.876 1
1 571 . 18 1 1 A 57 57 PHE C C 142 172.293 172.910 -0.617 1
1 572 . 18 1 1 A 57 57 PHE CA C 142 56.366 55.372 0.994 1
1 573 . 18 1 1 A 57 57 PHE CB C 142 39.962 42.687 -2.725 1
1 575 . 18 1 1 A 57 57 PHE N N 142 117.009 121.114 -4.105 1
1 576 . 18 1 1 A 58 58 SER H H 143 8.890 9.372 -0.482 1
1 577 . 18 1 1 A 58 58 SER HA H 143 5.286 5.480 -0.194 1
1 580 . 18 1 1 A 58 58 SER C C 143 173.716 173.353 0.363 1
1 581 . 18 1 1 A 58 58 SER CA C 143 57.517 56.886 0.631 1
1 582 . 18 1 1 A 58 58 SER CB C 143 65.448 64.766 0.682 1
1 583 . 18 1 1 A 58 58 SER N N 143 115.269 114.566 0.703 1
1 584 . 18 1 1 A 59 59 VAL H H 144 7.737 8.868 -1.131 1
1 585 . 18 1 1 A 59 59 VAL HA H 144 4.220 4.577 -0.357 1
1 593 . 18 1 1 A 59 59 VAL C C 144 176.234 176.461 -0.227 1
1 594 . 18 1 1 A 59 59 VAL CA C 144 61.741 61.425 0.316 1
1 595 . 18 1 1 A 59 59 VAL CB C 144 33.711 33.747 -0.036 1
1 598 . 18 1 1 A 59 59 VAL N N 144 123.186 125.057 -1.871 1
1 599 . 18 1 1 A 60 60 GLY H H 145 8.945 9.129 -0.184 1
1 600 . 18 1 1 A 60 60 GLY HA2 H 145 4.027 3.643 0.384 1
1 601 . 18 1 1 A 60 60 GLY HA3 H 145 3.692 3.723 -0.031 1
1 602 . 18 1 1 A 60 60 GLY C C 145 175.182 173.817 1.365 1
1 603 . 18 1 1 A 60 60 GLY CA C 145 47.141 46.494 0.647 1
1 604 . 18 1 1 A 60 60 GLY N N 145 116.908 116.288 0.620 1
1 605 . 18 1 1 A 61 61 ASN H H 146 8.929 8.339 0.590 1
1 606 . 18 1 1 A 61 61 ASN HA H 146 4.718 4.268 0.450 1
1 611 . 18 1 1 A 61 61 ASN C C 146 174.706 173.981 0.725 1
1 612 . 18 1 1 A 61 61 ASN CA C 146 52.802 54.311 -1.509 1
1 613 . 18 1 1 A 61 61 ASN CB C 146 37.917 37.562 0.355 1
1 614 . 18 1 1 A 61 61 ASN N N 146 123.976 113.305 10.671 1
1 616 . 18 1 1 A 62 62 HIS H H 147 8.400 7.623 0.777 1
1 617 . 18 1 1 A 62 62 HIS HA H 147 4.762 5.016 -0.254 1
1 622 . 18 1 1 A 62 62 HIS C C 147 173.871 172.991 0.880 1
1 623 . 18 1 1 A 62 62 HIS CA C 147 55.374 54.864 0.510 1
1 624 . 18 1 1 A 62 62 HIS CB C 147 28.655 33.583 -4.928 1
1 628 . 18 1 1 A 62 62 HIS N N 147 118.620 117.524 1.096 1
1 631 . 18 1 1 A 63 63 ASP H H 148 8.734 9.079 -0.345 1
1 632 . 18 1 1 A 63 63 ASP HA H 148 4.785 5.443 -0.658 1
1 635 . 18 1 1 A 63 63 ASP C C 148 175.269 174.785 0.484 1
1 636 . 18 1 1 A 63 63 ASP CA C 148 54.390 52.600 1.790 1
1 637 . 18 1 1 A 63 63 ASP CB C 148 42.105 42.237 -0.132 1
1 638 . 18 1 1 A 63 63 ASP N N 148 125.336 117.767 7.569 1
1 639 . 18 1 1 A 64 64 CYS H H 149 8.225 8.267 -0.042 1
1 640 . 18 1 1 A 64 64 CYS HA H 149 5.118 5.356 -0.238 1
1 643 . 18 1 1 A 64 64 CYS C C 149 173.740 172.698 1.042 1
1 644 . 18 1 1 A 64 64 CYS CA C 149 55.423 57.528 -2.105 1
1 645 . 18 1 1 A 64 64 CYS CB C 149 29.972 33.615 -3.643 1
1 646 . 18 1 1 A 64 64 CYS N N 149 124.476 121.740 2.736 1
1 647 . 18 1 1 A 65 65 TYR H H 150 8.916 8.337 0.579 1
1 648 . 18 1 1 A 65 65 TYR HA H 150 5.121 4.167 0.954 1
1 655 . 18 1 1 A 65 65 TYR C C 150 172.821 171.909 0.912 1
1 656 . 18 1 1 A 65 65 TYR CA C 150 56.347 56.061 0.286 1
1 657 . 18 1 1 A 65 65 TYR CB C 150 38.901 39.766 -0.865 1
1 662 . 18 1 1 A 65 65 TYR N N 150 115.313 118.109 -2.796 1
1 663 . 18 1 1 A 66 66 ILE H H 151 8.423 8.527 -0.104 1
1 664 . 18 1 1 A 66 66 ILE HA H 151 5.000 4.387 0.613 1
1 674 . 18 1 1 A 66 66 ILE C C 151 176.225 174.615 1.610 1
1 675 . 18 1 1 A 66 66 ILE CA C 151 57.798 60.087 -2.289 1
1 676 . 18 1 1 A 66 66 ILE CB C 151 39.863 38.919 0.944 1
1 680 . 18 1 1 A 66 66 ILE N N 151 118.575 121.390 -2.815 1
1 681 . 18 1 1 A 67 67 LYS H H 152 9.480 8.839 0.641 1
1 682 . 18 1 1 A 67 67 LYS HA H 152 5.091 4.692 0.399 1
1 691 . 18 1 1 A 67 67 LYS C C 152 174.079 174.799 -0.720 1
1 692 . 18 1 1 A 67 67 LYS CA C 152 54.728 56.089 -1.361 1
1 693 . 18 1 1 A 67 67 LYS CB C 152 35.256 33.028 2.228 1
1 697 . 18 1 1 A 67 67 LYS N N 152 132.311 128.610 3.701 1
1 698 . 18 1 1 A 68 68 ALA H H 153 8.844 8.385 0.459 1
1 699 . 18 1 1 A 68 68 ALA HA H 153 5.039 5.297 -0.258 1
1 703 . 18 1 1 A 68 68 ALA C C 153 176.587 176.399 0.188 1
1 704 . 18 1 1 A 68 68 ALA CA C 153 50.484 50.759 -0.275 1
1 705 . 18 1 1 A 68 68 ALA CB C 153 20.570 21.136 -0.566 1
1 706 . 18 1 1 A 68 68 ALA N N 153 129.958 130.286 -0.328 1
1 707 . 18 1 1 A 69 69 VAL H H 154 8.461 8.729 -0.268 1
1 708 . 18 1 1 A 69 69 VAL HA H 154 4.558 4.561 -0.003 1
1 716 . 18 1 1 A 69 69 VAL C C 154 175.331 175.055 0.276 1
1 717 . 18 1 1 A 69 69 VAL CA C 154 60.758 60.818 -0.060 1
1 718 . 18 1 1 A 69 69 VAL CB C 154 34.743 34.853 -0.110 1
1 721 . 18 1 1 A 69 69 VAL N N 154 121.496 123.075 -1.579 1
1 722 . 18 1 1 A 70 70 SER H H 155 8.695 8.988 -0.293 1
1 723 . 18 1 1 A 70 70 SER HA H 155 4.646 5.150 -0.504 1
1 726 . 18 1 1 A 70 70 SER C C 155 174.690 173.269 1.421 1
1 727 . 18 1 1 A 70 70 SER CA C 155 58.065 56.744 1.321 1
1 728 . 18 1 1 A 70 70 SER CB C 155 64.062 64.785 -0.723 1
1 729 . 18 1 1 A 70 70 SER N N 155 119.763 121.863 -2.100 1
1 730 . 18 1 1 A 71 71 SER H H 156 8.360 9.253 -0.893 1
1 731 . 18 1 1 A 71 71 SER HA H 156 4.430 5.457 -1.027 1
1 734 . 18 1 1 A 71 71 SER CA C 156 58.491 56.660 1.831 1
1 735 . 18 1 1 A 71 71 SER CB C 156 64.061 66.441 -2.380 1
1 736 . 18 1 1 A 71 71 SER N N 156 118.577 117.496 1.081 1
1 737 . 18 1 1 A 72 72 GLY H H 157 8.542 8.418 0.124 1
1 738 . 18 1 1 A 72 72 GLY HA2 H 157 4.002 4.222 -0.220 1
1 739 . 18 1 1 A 72 72 GLY HA3 H 157 4.002 4.225 -0.223 1
1 740 . 18 1 1 A 72 72 GLY CA C 157 45.565 44.298 1.267 1
1 741 . 18 1 1 A 72 72 GLY N N 157 111.540 113.063 -1.523 1
1 742 . 18 1 1 A 73 73 LYS H H 158 8.369 8.853 -0.484 1
1 743 . 18 1 1 A 73 73 LYS CA C 158 56.720 59.020 -2.300 1
1 744 . 18 1 1 A 73 73 LYS CB C 158 32.915 32.222 0.693 1
1 747 . 18 1 1 A 73 73 LYS N N 158 120.293 120.363 -0.070 1
1 748 . 18 1 1 A 74 74 ARG H H 159 8.181 8.104 0.077 1
1 749 . 18 1 1 A 74 74 ARG CA C 159 56.148 57.084 -0.936 1
1 751 . 18 1 1 A 74 74 ARG N N 159 119.343 115.837 3.506 1
1 752 . 18 1 1 A 75 75 LYS H H 160 8.443 7.953 0.490 1
1 753 . 18 1 1 A 75 75 LYS HA H 160 4.067 4.590 -0.523 1
1 762 . 18 1 1 A 75 75 LYS C C 160 176.868 176.621 0.247 1
1 763 . 18 1 1 A 75 75 LYS CA C 160 57.711 55.422 2.289 1
1 764 . 18 1 1 A 75 75 LYS CB C 160 31.777 33.173 -1.396 1
1 768 . 18 1 1 A 75 75 LYS N N 160 120.467 118.207 2.260 1
1 769 . 18 1 1 A 76 76 GLU H H 161 8.693 8.289 0.404 1
1 770 . 18 1 1 A 76 76 GLU HA H 161 4.290 3.950 0.340 1
1 771 . 18 1 1 A 76 76 GLU C C 161 176.844 176.492 0.352 1
1 772 . 18 1 1 A 76 76 GLU CA C 161 57.294 59.725 -2.431 1
1 773 . 18 1 1 A 76 76 GLU CB C 161 29.794 30.429 -0.635 1
1 775 . 18 1 1 A 76 76 GLU N N 161 118.767 123.531 -4.764 1
1 776 . 18 1 1 A 77 77 GLY H H 162 8.168 7.678 0.490 1
1 777 . 18 1 1 A 77 77 GLY HA2 H 162 4.010 4.085 -0.075 1
1 778 . 18 1 1 A 77 77 GLY HA3 H 162 3.963 4.092 -0.129 1
1 779 . 18 1 1 A 77 77 GLY C C 162 173.512 171.917 1.595 1
1 780 . 18 1 1 A 77 77 GLY CA C 162 45.362 44.956 0.406 1
1 781 . 18 1 1 A 77 77 GLY N N 162 108.621 106.151 2.470 1
1 782 . 18 1 1 A 78 78 ILE H H 163 7.954 8.441 -0.487 1
1 783 . 18 1 1 A 78 78 ILE HA H 163 4.323 4.841 -0.518 1
1 793 . 18 1 1 A 78 78 ILE C C 163 175.402 174.863 0.539 1
1 794 . 18 1 1 A 78 78 ILE CA C 163 60.632 59.797 0.835 1
1 795 . 18 1 1 A 78 78 ILE CB C 163 39.759 41.974 -2.215 1
1 799 . 18 1 1 A 78 78 ILE N N 163 121.604 120.489 1.115 1
1 800 . 18 1 1 A 79 79 ILE H H 164 8.514 8.684 -0.170 1
1 801 . 18 1 1 A 79 79 ILE HA H 164 4.341 4.752 -0.411 1
1 811 . 18 1 1 A 79 79 ILE C C 164 175.172 174.629 0.543 1
1 812 . 18 1 1 A 79 79 ILE CA C 164 60.027 59.958 0.069 1
1 813 . 18 1 1 A 79 79 ILE CB C 164 40.153 41.047 -0.894 1
1 817 . 18 1 1 A 79 79 ILE N N 164 127.137 126.079 1.058 1
1 818 . 18 1 1 A 80 80 HIS H H 165 8.492 9.092 -0.600 1
1 819 . 18 1 1 A 80 80 HIS HA H 165 5.676 5.350 0.326 1
1 824 . 18 1 1 A 80 80 HIS C C 165 175.502 175.069 0.433 1
1 825 . 18 1 1 A 80 80 HIS CA C 165 57.043 55.109 1.934 1
1 826 . 18 1 1 A 80 80 HIS CB C 165 32.741 32.230 0.511 1
1 829 . 18 1 1 A 80 80 HIS N N 165 125.422 126.554 -1.132 1
1 830 . 18 1 1 A 81 81 THR H H 166 9.080 9.414 -0.334 1
1 831 . 18 1 1 A 81 81 THR HA H 166 4.999 4.972 0.027 1
1 836 . 18 1 1 A 81 81 THR C C 166 171.877 173.801 -1.924 1
1 837 . 18 1 1 A 81 81 THR CA C 166 59.924 61.558 -1.634 1
1 838 . 18 1 1 A 81 81 THR CB C 166 72.243 70.802 1.441 1
1 840 . 18 1 1 A 81 81 THR N N 166 117.682 117.593 0.089 1
1 841 . 18 1 1 A 82 82 LEU H H 167 8.062 8.092 -0.030 1
1 842 . 18 1 1 A 82 82 LEU HA H 167 4.350 3.929 0.421 1
1 852 . 18 1 1 A 82 82 LEU C C 167 172.705 174.839 -2.134 1
1 853 . 18 1 1 A 82 82 LEU CA C 167 53.553 55.499 -1.946 1
1 854 . 18 1 1 A 82 82 LEU CB C 167 39.768 41.398 -1.630 1
1 858 . 18 1 1 A 82 82 LEU N N 167 125.369 129.646 -4.277 1
1 859 . 18 1 1 A 83 83 ILE H H 168 8.657 8.181 0.476 1
1 860 . 18 1 1 A 83 83 ILE HA H 168 4.476 5.062 -0.586 1
1 870 . 18 1 1 A 83 83 ILE C C 168 175.159 174.470 0.689 1
1 871 . 18 1 1 A 83 83 ILE CA C 168 58.529 59.839 -1.310 1
1 872 . 18 1 1 A 83 83 ILE CB C 168 37.410 40.980 -3.570 1
1 876 . 18 1 1 A 83 83 ILE N N 168 128.042 127.169 0.873 1
1 877 . 18 1 1 A 84 84 VAL H H 169 8.464 8.482 -0.018 1
1 878 . 18 1 1 A 84 84 VAL HA H 169 4.284 4.385 -0.101 1
1 886 . 18 1 1 A 84 84 VAL C C 169 176.138 175.692 0.446 1
1 887 . 18 1 1 A 84 84 VAL CA C 169 61.029 61.221 -0.192 1
1 888 . 18 1 1 A 84 84 VAL CB C 169 34.714 34.157 0.557 1
1 891 . 18 1 1 A 84 84 VAL N N 169 124.644 126.915 -2.271 1
1 892 . 18 1 1 A 85 85 ASP H H 170 9.158 9.089 0.069 1
1 893 . 18 1 1 A 85 85 ASP HA H 170 4.362 4.259 0.103 1
1 896 . 18 1 1 A 85 85 ASP C C 170 175.489 175.352 0.137 1
1 897 . 18 1 1 A 85 85 ASP CA C 170 55.868 55.201 0.667 1
1 898 . 18 1 1 A 85 85 ASP CB C 170 38.927 39.468 -0.541 1
1 899 . 18 1 1 A 85 85 ASP N N 170 129.061 127.868 1.193 1
1 900 . 18 1 1 A 86 86 ASN H H 171 8.811 8.427 0.384 1
1 901 . 18 1 1 A 86 86 ASN HA H 171 4.053 4.330 -0.277 1
1 906 . 18 1 1 A 86 86 ASN C C 171 173.802 173.918 -0.116 1
1 907 . 18 1 1 A 86 86 ASN CA C 171 55.173 54.302 0.871 1
1 908 . 18 1 1 A 86 86 ASN CB C 171 38.150 37.374 0.776 1
1 909 . 18 1 1 A 86 86 ASN N N 171 108.418 114.872 -6.454 1
1 911 . 18 1 1 A 87 87 ARG H H 172 7.914 7.507 0.407 1
1 912 . 18 1 1 A 87 87 ARG HA H 172 4.597 4.653 -0.056 1
1 919 . 18 1 1 A 87 87 ARG C C 172 174.025 174.737 -0.712 1
1 920 . 18 1 1 A 87 87 ARG CA C 172 54.846 54.209 0.637 1
1 921 . 18 1 1 A 87 87 ARG CB C 172 32.697 33.137 -0.440 1
1 924 . 18 1 1 A 87 87 ARG N N 172 120.988 117.635 3.353 1
1 925 . 18 1 1 A 88 88 GLU H H 173 8.534 8.813 -0.279 1
1 926 . 18 1 1 A 88 88 GLU HA H 173 4.560 4.358 0.202 1
1 931 . 18 1 1 A 88 88 GLU C C 173 176.187 175.450 0.737 1
1 932 . 18 1 1 A 88 88 GLU CA C 173 56.044 56.852 -0.808 1
1 933 . 18 1 1 A 88 88 GLU CB C 173 30.329 30.452 -0.123 1
1 935 . 18 1 1 A 88 88 GLU N N 173 123.982 125.456 -1.474 1
1 936 . 18 1 1 A 89 89 ILE H H 174 8.897 7.989 0.908 1
1 937 . 18 1 1 A 89 89 ILE HA H 174 4.666 4.606 0.060 1
1 947 . 18 1 1 A 89 89 ILE C C 174 174.110 174.120 -0.010 1
1 948 . 18 1 1 A 89 89 ILE CA C 174 55.255 57.392 -2.137 1
1 949 . 18 1 1 A 89 89 ILE CB C 174 37.851 41.713 -3.862 1
1 953 . 18 1 1 A 89 89 ILE N N 174 130.008 127.353 2.655 1
1 954 . 18 1 1 A 90 90 PRO HA H 175 4.713 4.738 -0.025 1
1 961 . 18 1 1 A 90 90 PRO C C 175 176.956 176.613 0.343 1
1 962 . 18 1 1 A 90 90 PRO CA C 175 63.159 62.986 0.173 1
1 963 . 18 1 1 A 90 90 PRO CB C 175 32.428 32.338 0.090 1
1 966 . 18 1 1 A 91 91 GLU H H 176 8.778 8.772 0.006 1
1 967 . 18 1 1 A 91 91 GLU HA H 176 3.910 4.535 -0.625 1
1 972 . 18 1 1 A 91 91 GLU C C 176 176.426 176.861 -0.435 1
1 973 . 18 1 1 A 91 91 GLU CA C 176 56.738 55.660 1.078 1
1 974 . 18 1 1 A 91 91 GLU CB C 176 30.540 31.414 -0.874 1
1 976 . 18 1 1 A 91 91 GLU N N 176 124.561 121.933 2.628 1
1 977 . 18 1 1 A 92 92 LEU H H 177 8.630 8.524 0.106 1
1 978 . 18 1 1 A 92 92 LEU HA H 177 4.419 3.973 0.446 1
1 988 . 18 1 1 A 92 92 LEU C C 177 177.162 176.749 0.413 1
1 989 . 18 1 1 A 92 92 LEU CA C 177 55.350 58.706 -3.356 1
1 990 . 18 1 1 A 92 92 LEU CB C 177 42.390 41.828 0.562 1
1 994 . 18 1 1 A 92 92 LEU N N 177 126.683 127.142 -0.459 1
1 995 . 18 1 1 A 93 93 THR H H 178 8.375 8.047 0.328 1
1 996 . 18 1 1 A 93 93 THR HA H 178 4.359 4.038 0.321 1
1 1001 . 18 1 1 A 93 93 THR C C 178 173.589 174.227 -0.638 1
1 1002 . 18 1 1 A 93 93 THR CA C 178 61.621 62.822 -1.201 1
1 1003 . 18 1 1 A 93 93 THR CB C 178 69.724 66.478 3.246 1
1 1005 . 18 1 1 A 93 93 THR N N 178 119.699 110.834 8.865 1
1 1 . 19 1 1 A 9 9 SER H H 94 8.475 8.590 -0.115 1
1 2 . 19 1 1 A 9 9 SER CA C 94 58.531 59.355 -0.824 1
1 3 . 19 1 1 A 9 9 SER N N 94 117.432 118.357 -0.925 1
1 4 . 19 1 1 A 10 10 LYS H H 95 8.527 8.458 0.069 1
1 5 . 19 1 1 A 10 10 LYS C C 95 174.594 176.301 -1.707 1
1 6 . 19 1 1 A 10 10 LYS CA C 95 56.603 55.376 1.227 1
1 7 . 19 1 1 A 10 10 LYS N N 95 123.104 126.292 -3.188 1
1 8 . 19 1 1 A 11 11 THR H H 96 8.245 8.766 -0.521 1
1 9 . 19 1 1 A 11 11 THR C C 96 174.393 173.500 0.893 1
1 10 . 19 1 1 A 11 11 THR CA C 96 62.149 60.869 1.280 1
1 11 . 19 1 1 A 11 11 THR CB C 96 69.183 68.467 0.716 1
1 13 . 19 1 1 A 11 11 THR N N 96 113.245 116.371 -3.126 1
1 14 . 19 1 1 A 12 12 THR H H 97 7.769 7.644 0.125 1
1 15 . 19 1 1 A 12 12 THR HA H 97 5.583 4.994 0.589 1
1 20 . 19 1 1 A 12 12 THR C C 97 174.726 171.817 2.909 1
1 21 . 19 1 1 A 12 12 THR CA C 97 59.602 60.843 -1.241 1
1 22 . 19 1 1 A 12 12 THR CB C 97 72.805 71.344 1.461 1
1 24 . 19 1 1 A 12 12 THR N N 97 113.440 112.342 1.098 1
1 25 . 19 1 1 A 13 13 SER H H 98 8.593 8.584 0.009 1
1 26 . 19 1 1 A 13 13 SER HA H 98 4.448 4.820 -0.372 1
1 29 . 19 1 1 A 13 13 SER C C 98 171.426 173.132 -1.706 1
1 30 . 19 1 1 A 13 13 SER CA C 98 59.056 57.685 1.371 1
1 31 . 19 1 1 A 13 13 SER CB C 98 67.839 63.645 4.194 1
1 32 . 19 1 1 A 13 13 SER N N 98 119.042 121.549 -2.507 1
1 33 . 19 1 1 A 14 14 THR H H 99 8.155 8.245 -0.090 1
1 34 . 19 1 1 A 14 14 THR HA H 99 5.383 5.065 0.318 1
1 39 . 19 1 1 A 14 14 THR C C 99 171.565 172.906 -1.341 1
1 40 . 19 1 1 A 14 14 THR CA C 99 61.291 58.816 2.475 1
1 41 . 19 1 1 A 14 14 THR CB C 99 71.654 71.718 -0.064 1
1 43 . 19 1 1 A 14 14 THR N N 99 118.204 116.206 1.998 1
1 44 . 19 1 1 A 15 15 TRP H H 100 9.637 9.066 0.571 1
1 45 . 19 1 1 A 15 15 TRP HA H 100 4.807 5.135 -0.328 1
1 54 . 19 1 1 A 15 15 TRP C C 100 174.399 175.481 -1.082 1
1 55 . 19 1 1 A 15 15 TRP CA C 100 58.302 55.689 2.613 1
1 56 . 19 1 1 A 15 15 TRP CB C 100 34.810 33.731 1.079 1
1 63 . 19 1 1 A 15 15 TRP N N 100 125.132 120.923 4.209 1
1 65 . 19 1 1 A 16 16 VAL H H 101 8.863 8.664 0.199 1
1 66 . 19 1 1 A 16 16 VAL HA H 101 5.267 4.874 0.393 1
1 74 . 19 1 1 A 16 16 VAL C C 101 174.955 175.059 -0.104 1
1 75 . 19 1 1 A 16 16 VAL CA C 101 60.653 61.425 -0.772 1
1 76 . 19 1 1 A 16 16 VAL CB C 101 34.284 34.249 0.035 1
1 79 . 19 1 1 A 16 16 VAL N N 101 119.527 120.949 -1.422 1
1 80 . 19 1 1 A 17 17 LEU H H 102 8.961 8.880 0.081 1
1 81 . 19 1 1 A 17 17 LEU HA H 102 4.729 5.095 -0.366 1
1 91 . 19 1 1 A 17 17 LEU C C 102 173.559 175.001 -1.442 1
1 92 . 19 1 1 A 17 17 LEU CA C 102 55.144 53.107 2.037 1
1 93 . 19 1 1 A 17 17 LEU CB C 102 42.948 45.895 -2.947 1
1 97 . 19 1 1 A 17 17 LEU N N 102 124.280 123.852 0.428 1
1 98 . 19 1 1 A 18 18 ARG H H 103 8.305 8.362 -0.057 1
1 99 . 19 1 1 A 18 18 ARG HA H 103 5.139 4.677 0.462 1
1 106 . 19 1 1 A 18 18 ARG C C 103 175.347 175.183 0.164 1
1 107 . 19 1 1 A 18 18 ARG CA C 103 54.793 56.152 -1.359 1
1 108 . 19 1 1 A 18 18 ARG CB C 103 31.347 29.801 1.546 1
1 111 . 19 1 1 A 18 18 ARG N N 103 122.020 120.117 1.903 1
1 112 . 19 1 1 A 19 19 LEU H H 104 8.676 8.754 -0.078 1
1 113 . 19 1 1 A 19 19 LEU HA H 104 4.482 4.831 -0.349 1
1 123 . 19 1 1 A 19 19 LEU C C 104 175.957 175.850 0.107 1
1 124 . 19 1 1 A 19 19 LEU CA C 104 53.581 53.781 -0.200 1
1 125 . 19 1 1 A 19 19 LEU CB C 104 45.697 45.477 0.220 1
1 129 . 19 1 1 A 19 19 LEU N N 104 126.378 125.044 1.334 1
1 130 . 19 1 1 A 20 20 ASP H H 105 9.390 9.554 -0.164 1
1 131 . 19 1 1 A 20 20 ASP HA H 105 4.287 4.376 -0.089 1
1 134 . 19 1 1 A 20 20 ASP C C 105 175.947 175.434 0.513 1
1 135 . 19 1 1 A 20 20 ASP CA C 105 55.263 55.148 0.115 1
1 136 . 19 1 1 A 20 20 ASP CB C 105 39.239 39.922 -0.683 1
1 137 . 19 1 1 A 20 20 ASP N N 105 125.208 125.648 -0.440 1
1 138 . 19 1 1 A 21 21 GLY H H 106 8.563 8.661 -0.098 1
1 139 . 19 1 1 A 21 21 GLY HA2 H 106 4.126 3.847 0.279 1
1 140 . 19 1 1 A 21 21 GLY HA3 H 106 3.509 3.849 -0.340 1
1 141 . 19 1 1 A 21 21 GLY C C 106 173.164 173.561 -0.397 1
1 142 . 19 1 1 A 21 21 GLY CA C 106 45.499 45.524 -0.025 1
1 143 . 19 1 1 A 21 21 GLY N N 106 103.331 104.769 -1.438 1
1 144 . 19 1 1 A 22 22 GLU H H 107 7.713 7.757 -0.044 1
1 145 . 19 1 1 A 22 22 GLU HA H 107 4.634 4.886 -0.252 1
1 150 . 19 1 1 A 22 22 GLU C C 107 174.800 174.775 0.025 1
1 151 . 19 1 1 A 22 22 GLU CA C 107 54.329 54.669 -0.340 1
1 152 . 19 1 1 A 22 22 GLU CB C 107 32.832 32.809 0.023 1
1 154 . 19 1 1 A 22 22 GLU N N 107 119.470 115.684 3.786 1
1 155 . 19 1 1 A 23 23 ASP H H 108 8.632 8.566 0.066 1
1 156 . 19 1 1 A 23 23 ASP HA H 108 4.872 4.717 0.155 1
1 159 . 19 1 1 A 23 23 ASP C C 108 175.533 175.472 0.061 1
1 160 . 19 1 1 A 23 23 ASP CA C 108 55.180 53.934 1.246 1
1 161 . 19 1 1 A 23 23 ASP CB C 108 41.504 39.423 2.081 1
1 162 . 19 1 1 A 23 23 ASP N N 108 122.815 120.114 2.701 1
1 163 . 19 1 1 A 24 24 LEU H H 109 9.248 8.867 0.381 1
1 164 . 19 1 1 A 24 24 LEU HA H 109 4.836 4.603 0.233 1
1 174 . 19 1 1 A 24 24 LEU C C 109 174.322 175.854 -1.532 1
1 175 . 19 1 1 A 24 24 LEU CA C 109 54.473 55.030 -0.557 1
1 176 . 19 1 1 A 24 24 LEU CB C 109 44.718 42.781 1.937 1
1 180 . 19 1 1 A 24 24 LEU N N 109 125.550 126.663 -1.113 1
1 181 . 19 1 1 A 25 25 ARG H H 110 8.503 8.765 -0.262 1
1 182 . 19 1 1 A 25 25 ARG HA H 110 5.228 4.847 0.381 1
1 189 . 19 1 1 A 25 25 ARG C C 110 175.174 174.713 0.461 1
1 190 . 19 1 1 A 25 25 ARG CA C 110 54.745 54.858 -0.113 1
1 191 . 19 1 1 A 25 25 ARG CB C 110 31.701 31.657 0.044 1
1 194 . 19 1 1 A 25 25 ARG N N 110 125.424 128.130 -2.706 1
1 195 . 19 1 1 A 26 26 VAL H H 111 9.692 8.891 0.801 1
1 196 . 19 1 1 A 26 26 VAL HA H 111 5.091 5.014 0.077 1
1 204 . 19 1 1 A 26 26 VAL C C 111 174.446 175.544 -1.098 1
1 205 . 19 1 1 A 26 26 VAL CA C 111 61.055 61.585 -0.530 1
1 206 . 19 1 1 A 26 26 VAL CB C 111 33.780 33.524 0.256 1
1 209 . 19 1 1 A 26 26 VAL N N 111 130.649 127.467 3.182 1
1 210 . 19 1 1 A 27 27 VAL H H 112 9.401 9.075 0.326 1
1 211 . 19 1 1 A 27 27 VAL HA H 112 5.188 4.570 0.618 1
1 219 . 19 1 1 A 27 27 VAL C C 112 174.214 174.250 -0.036 1
1 220 . 19 1 1 A 27 27 VAL CA C 112 60.722 60.928 -0.206 1
1 221 . 19 1 1 A 27 27 VAL CB C 112 36.082 35.257 0.825 1
1 224 . 19 1 1 A 27 27 VAL N N 112 127.416 127.301 0.115 1
1 225 . 19 1 1 A 28 28 LEU H H 113 9.265 9.140 0.125 1
1 226 . 19 1 1 A 28 28 LEU HA H 113 5.337 5.379 -0.042 1
1 236 . 19 1 1 A 28 28 LEU C C 113 175.915 174.865 1.050 1
1 237 . 19 1 1 A 28 28 LEU CA C 113 52.599 53.521 -0.922 1
1 238 . 19 1 1 A 28 28 LEU CB C 113 47.495 44.302 3.193 1
1 242 . 19 1 1 A 28 28 LEU N N 113 127.527 129.919 -2.392 1
1 243 . 19 1 1 A 29 29 GLU H H 114 8.968 8.533 0.435 1
1 244 . 19 1 1 A 29 29 GLU HA H 114 4.701 4.318 0.383 1
1 249 . 19 1 1 A 29 29 GLU C C 114 176.715 177.329 -0.614 1
1 250 . 19 1 1 A 29 29 GLU CA C 114 55.342 56.326 -0.984 1
1 251 . 19 1 1 A 29 29 GLU CB C 114 30.005 30.331 -0.326 1
1 253 . 19 1 1 A 29 29 GLU N N 114 127.374 127.371 0.003 1
1 254 . 19 1 1 A 30 30 LYS H H 115 8.243 8.521 -0.278 1
1 255 . 19 1 1 A 30 30 LYS HA H 115 3.711 4.160 -0.449 1
1 264 . 19 1 1 A 30 30 LYS C C 115 177.137 178.308 -1.171 1
1 265 . 19 1 1 A 30 30 LYS CA C 115 60.118 58.810 1.308 1
1 266 . 19 1 1 A 30 30 LYS CB C 115 32.656 32.102 0.554 1
1 270 . 19 1 1 A 30 30 LYS N N 115 124.225 124.807 -0.582 1
1 271 . 19 1 1 A 31 31 ASP H H 116 9.200 8.042 1.158 1
1 272 . 19 1 1 A 31 31 ASP HA H 116 4.444 4.439 0.005 1
1 275 . 19 1 1 A 31 31 ASP C C 116 177.774 177.348 0.426 1
1 276 . 19 1 1 A 31 31 ASP CA C 116 56.703 57.364 -0.661 1
1 277 . 19 1 1 A 31 31 ASP CB C 116 40.236 40.943 -0.707 1
1 278 . 19 1 1 A 31 31 ASP N N 116 115.955 120.098 -4.143 1
1 279 . 19 1 1 A 32 32 THR H H 117 7.352 7.648 -0.296 1
1 280 . 19 1 1 A 32 32 THR HA H 117 4.266 4.632 -0.366 1
1 285 . 19 1 1 A 32 32 THR C C 117 175.320 174.233 1.087 1
1 286 . 19 1 1 A 32 32 THR CA C 117 61.171 60.862 0.309 1
1 287 . 19 1 1 A 32 32 THR CB C 117 70.221 69.304 0.917 1
1 289 . 19 1 1 A 32 32 THR N N 117 106.440 107.361 -0.921 1
1 290 . 19 1 1 A 33 33 MET H H 118 8.216 7.851 0.365 1
1 291 . 19 1 1 A 33 33 MET HA H 118 4.184 4.409 -0.225 1
1 299 . 19 1 1 A 33 33 MET C C 118 174.952 174.548 0.404 1
1 300 . 19 1 1 A 33 33 MET CA C 118 55.195 56.839 -1.644 1
1 301 . 19 1 1 A 33 33 MET CB C 118 25.900 31.039 -5.139 1
1 304 . 19 1 1 A 33 33 MET N N 118 115.956 116.918 -0.962 1
1 305 . 19 1 1 A 34 34 ASP H H 119 7.509 7.915 -0.406 1
1 306 . 19 1 1 A 34 34 ASP HA H 119 4.486 4.764 -0.278 1
1 309 . 19 1 1 A 34 34 ASP C C 119 174.375 175.082 -0.707 1
1 310 . 19 1 1 A 34 34 ASP CA C 119 54.745 53.376 1.369 1
1 311 . 19 1 1 A 34 34 ASP CB C 119 42.865 42.218 0.647 1
1 312 . 19 1 1 A 34 34 ASP N N 119 118.500 117.867 0.633 1
1 313 . 19 1 1 A 35 35 VAL H H 120 8.473 8.374 0.099 1
1 314 . 19 1 1 A 35 35 VAL HA H 120 4.709 4.619 0.090 1
1 322 . 19 1 1 A 35 35 VAL C C 120 173.900 174.332 -0.432 1
1 323 . 19 1 1 A 35 35 VAL CA C 120 60.736 60.997 -0.261 1
1 324 . 19 1 1 A 35 35 VAL CB C 120 34.662 32.643 2.019 1
1 327 . 19 1 1 A 35 35 VAL N N 120 121.116 121.966 -0.850 1
1 328 . 19 1 1 A 36 36 TRP H H 121 9.404 9.594 -0.190 1
1 329 . 19 1 1 A 36 36 TRP HA H 121 5.174 5.320 -0.146 1
1 338 . 19 1 1 A 36 36 TRP C C 121 176.480 174.679 1.801 1
1 339 . 19 1 1 A 36 36 TRP CA C 121 55.070 55.529 -0.459 1
1 340 . 19 1 1 A 36 36 TRP CB C 121 32.179 32.921 -0.742 1
1 348 . 19 1 1 A 36 36 TRP N N 121 126.924 129.630 -2.706 1
1 350 . 19 1 1 A 37 37 CYS H H 122 9.230 8.876 0.354 1
1 351 . 19 1 1 A 37 37 CYS HA H 122 5.417 4.938 0.479 1
1 354 . 19 1 1 A 37 37 CYS C C 122 175.346 173.485 1.861 1
1 355 . 19 1 1 A 37 37 CYS CA C 122 57.083 57.516 -0.433 1
1 356 . 19 1 1 A 37 37 CYS CB C 122 28.713 29.483 -0.770 1
1 357 . 19 1 1 A 37 37 CYS N N 122 120.375 128.003 -7.628 1
1 358 . 19 1 1 A 38 38 ASN H H 123 9.817 8.842 0.975 1
1 359 . 19 1 1 A 38 38 ASN HA H 123 4.637 4.212 0.425 1
1 364 . 19 1 1 A 38 38 ASN C C 123 175.526 175.181 0.345 1
1 365 . 19 1 1 A 38 38 ASN CA C 123 54.023 54.316 -0.293 1
1 366 . 19 1 1 A 38 38 ASN CB C 123 36.581 37.133 -0.552 1
1 367 . 19 1 1 A 38 38 ASN N N 123 129.408 126.723 2.685 1
1 369 . 19 1 1 A 39 39 GLY H H 124 9.092 7.966 1.126 1
1 370 . 19 1 1 A 39 39 GLY HA2 H 124 4.241 3.504 0.737 1
1 371 . 19 1 1 A 39 39 GLY HA3 H 124 3.705 3.791 -0.086 1
1 372 . 19 1 1 A 39 39 GLY C C 124 173.405 173.982 -0.577 1
1 373 . 19 1 1 A 39 39 GLY CA C 124 45.595 46.691 -1.096 1
1 374 . 19 1 1 A 39 39 GLY N N 124 102.752 103.233 -0.481 1
1 375 . 19 1 1 A 40 40 GLN H H 125 8.006 7.710 0.296 1
1 376 . 19 1 1 A 40 40 GLN HA H 125 4.736 4.920 -0.184 1
1 383 . 19 1 1 A 40 40 GLN C C 125 174.477 174.796 -0.319 1
1 384 . 19 1 1 A 40 40 GLN CA C 125 53.747 55.169 -1.422 1
1 385 . 19 1 1 A 40 40 GLN CB C 125 30.413 31.241 -0.828 1
1 387 . 19 1 1 A 40 40 GLN N N 125 120.627 119.243 1.384 1
1 389 . 19 1 1 A 41 41 LYS H H 126 8.757 8.913 -0.156 1
1 390 . 19 1 1 A 41 41 LYS HA H 126 3.464 4.300 -0.836 1
1 399 . 19 1 1 A 41 41 LYS C C 126 176.870 176.078 0.792 1
1 400 . 19 1 1 A 41 41 LYS CA C 126 57.136 57.418 -0.282 1
1 401 . 19 1 1 A 41 41 LYS CB C 126 31.669 33.224 -1.555 1
1 405 . 19 1 1 A 41 41 LYS N N 126 129.107 128.430 0.677 1
1 406 . 19 1 1 A 42 42 MET H H 127 8.682 8.628 0.054 1
1 407 . 19 1 1 A 42 42 MET HA H 127 4.712 5.269 -0.557 1
1 415 . 19 1 1 A 42 42 MET C C 127 176.816 174.421 2.395 1
1 416 . 19 1 1 A 42 42 MET CA C 127 52.958 53.779 -0.821 1
1 417 . 19 1 1 A 42 42 MET CB C 127 33.023 35.831 -2.808 1
1 420 . 19 1 1 A 42 42 MET N N 127 126.569 124.015 2.554 1
1 421 . 19 1 1 A 43 43 GLU H H 128 8.734 8.772 -0.038 1
1 422 . 19 1 1 A 43 43 GLU HA H 128 4.419 5.121 -0.702 1
1 427 . 19 1 1 A 43 43 GLU C C 128 176.531 176.625 -0.094 1
1 428 . 19 1 1 A 43 43 GLU CA C 128 56.475 55.198 1.277 1
1 429 . 19 1 1 A 43 43 GLU CB C 128 29.604 31.229 -1.625 1
1 431 . 19 1 1 A 43 43 GLU N N 128 123.734 119.772 3.962 1
1 432 . 19 1 1 A 44 44 THR H H 129 8.263 8.889 -0.626 1
1 433 . 19 1 1 A 44 44 THR HA H 129 5.385 5.278 0.107 1
1 438 . 19 1 1 A 44 44 THR C C 129 174.205 174.729 -0.524 1
1 439 . 19 1 1 A 44 44 THR CA C 129 59.160 60.517 -1.357 1
1 440 . 19 1 1 A 44 44 THR CB C 129 72.419 72.046 0.373 1
1 442 . 19 1 1 A 44 44 THR N N 129 115.081 117.686 -2.605 1
1 443 . 19 1 1 A 45 45 ALA H H 130 8.727 8.269 0.458 1
1 444 . 19 1 1 A 45 45 ALA HA H 130 4.749 4.392 0.357 1
1 448 . 19 1 1 A 45 45 ALA C C 130 177.017 178.180 -1.163 1
1 449 . 19 1 1 A 45 45 ALA CA C 130 51.645 52.472 -0.827 1
1 450 . 19 1 1 A 45 45 ALA CB C 130 21.364 20.371 0.993 1
1 451 . 19 1 1 A 45 45 ALA N N 130 123.243 123.182 0.061 1
1 452 . 19 1 1 A 46 46 GLY H H 131 8.818 8.090 0.728 1
1 453 . 19 1 1 A 46 46 GLY HA2 H 131 4.941 3.818 1.123 1
1 454 . 19 1 1 A 46 46 GLY HA3 H 131 3.690 3.959 -0.269 1
1 455 . 19 1 1 A 46 46 GLY C C 131 173.528 174.721 -1.193 1
1 456 . 19 1 1 A 46 46 GLY CA C 131 45.060 46.825 -1.765 1
1 457 . 19 1 1 A 46 46 GLY N N 131 112.392 107.837 4.555 1
1 458 . 19 1 1 A 47 47 GLU H H 132 8.746 7.387 1.359 1
1 459 . 19 1 1 A 47 47 GLU HA H 132 4.584 4.586 -0.002 1
1 464 . 19 1 1 A 47 47 GLU C C 132 175.223 175.177 0.046 1
1 465 . 19 1 1 A 47 47 GLU CA C 132 55.008 55.370 -0.362 1
1 466 . 19 1 1 A 47 47 GLU CB C 132 32.939 30.494 2.445 1
1 468 . 19 1 1 A 47 47 GLU N N 132 122.107 120.182 1.925 1
1 469 . 19 1 1 A 48 48 PHE H H 133 8.920 9.194 -0.274 1
1 470 . 19 1 1 A 48 48 PHE HA H 133 4.822 4.971 -0.149 1
1 475 . 19 1 1 A 48 48 PHE C C 133 175.499 175.909 -0.410 1
1 476 . 19 1 1 A 48 48 PHE CA C 133 58.320 57.918 0.402 1
1 477 . 19 1 1 A 48 48 PHE CB C 133 39.175 39.598 -0.423 1
1 479 . 19 1 1 A 48 48 PHE N N 133 124.006 127.099 -3.093 1
1 480 . 19 1 1 A 49 49 VAL H H 134 8.161 8.364 -0.203 1
1 481 . 19 1 1 A 49 49 VAL HA H 134 4.492 4.802 -0.310 1
1 489 . 19 1 1 A 49 49 VAL C C 134 176.241 176.916 -0.675 1
1 490 . 19 1 1 A 49 49 VAL CA C 134 60.328 59.791 0.537 1
1 491 . 19 1 1 A 49 49 VAL CB C 134 34.542 34.628 -0.086 1
1 494 . 19 1 1 A 49 49 VAL N N 134 120.063 121.954 -1.891 1
1 495 . 19 1 1 A 50 50 ASP H H 135 8.596 8.575 0.021 1
1 496 . 19 1 1 A 50 50 ASP HA H 135 4.278 4.433 -0.155 1
1 499 . 19 1 1 A 50 50 ASP C C 135 176.567 175.879 0.688 1
1 500 . 19 1 1 A 50 50 ASP CA C 135 57.149 56.667 0.482 1
1 501 . 19 1 1 A 50 50 ASP CB C 135 40.477 41.255 -0.778 1
1 502 . 19 1 1 A 50 50 ASP N N 135 122.137 121.381 0.756 1
1 503 . 19 1 1 A 51 51 ASP H H 136 8.328 7.951 0.377 1
1 504 . 19 1 1 A 51 51 ASP HA H 136 4.656 5.160 -0.504 1
1 507 . 19 1 1 A 51 51 ASP C C 136 175.798 174.732 1.066 1
1 508 . 19 1 1 A 51 51 ASP CA C 136 53.458 53.680 -0.222 1
1 509 . 19 1 1 A 51 51 ASP CB C 136 40.306 43.192 -2.886 1
1 510 . 19 1 1 A 51 51 ASP N N 136 116.158 115.704 0.454 1
1 511 . 19 1 1 A 52 52 GLY H H 137 7.653 8.365 -0.712 1
1 512 . 19 1 1 A 52 52 GLY HA2 H 137 4.685 4.097 0.588 1
1 513 . 19 1 1 A 52 52 GLY HA3 H 137 4.069 4.100 -0.031 1
1 514 . 19 1 1 A 52 52 GLY C C 137 173.149 172.635 0.514 1
1 515 . 19 1 1 A 52 52 GLY CA C 137 45.860 44.112 1.748 1
1 516 . 19 1 1 A 52 52 GLY N N 137 107.634 109.536 -1.902 1
1 517 . 19 1 1 A 53 53 THR H H 138 8.445 8.130 0.315 1
1 518 . 19 1 1 A 53 53 THR HA H 138 4.996 4.863 0.133 1
1 523 . 19 1 1 A 53 53 THR C C 138 174.163 173.128 1.035 1
1 524 . 19 1 1 A 53 53 THR CA C 138 60.974 61.466 -0.492 1
1 525 . 19 1 1 A 53 53 THR CB C 138 72.266 71.763 0.503 1
1 527 . 19 1 1 A 53 53 THR N N 138 114.976 114.261 0.715 1
1 528 . 19 1 1 A 54 54 GLU H H 139 8.917 8.523 0.394 1
1 529 . 19 1 1 A 54 54 GLU HA H 139 5.205 4.686 0.519 1
1 534 . 19 1 1 A 54 54 GLU C C 139 175.700 175.026 0.674 1
1 535 . 19 1 1 A 54 54 GLU CA C 139 54.731 55.335 -0.604 1
1 536 . 19 1 1 A 54 54 GLU CB C 139 33.250 30.022 3.228 1
1 538 . 19 1 1 A 54 54 GLU N N 139 121.295 125.912 -4.617 1
1 539 . 19 1 1 A 55 55 THR H H 140 9.190 8.516 0.674 1
1 540 . 19 1 1 A 55 55 THR HA H 140 4.744 4.634 0.110 1
1 545 . 19 1 1 A 55 55 THR C C 140 174.537 173.780 0.757 1
1 546 . 19 1 1 A 55 55 THR CA C 140 62.678 61.868 0.810 1
1 547 . 19 1 1 A 55 55 THR CB C 140 69.744 68.867 0.877 1
1 549 . 19 1 1 A 55 55 THR N N 140 122.419 122.136 0.283 1
1 550 . 19 1 1 A 56 56 HIS H H 141 9.395 9.038 0.357 1
1 551 . 19 1 1 A 56 56 HIS HA H 141 5.204 5.030 0.174 1
1 556 . 19 1 1 A 56 56 HIS C C 141 174.675 174.475 0.200 1
1 557 . 19 1 1 A 56 56 HIS CA C 141 55.557 53.954 1.603 1
1 558 . 19 1 1 A 56 56 HIS CB C 141 31.279 30.753 0.526 1
1 561 . 19 1 1 A 56 56 HIS N N 141 125.732 125.723 0.009 1
1 564 . 19 1 1 A 57 57 PHE H H 142 8.790 8.333 0.457 1
1 565 . 19 1 1 A 57 57 PHE HA H 142 4.918 6.049 -1.131 1
1 571 . 19 1 1 A 57 57 PHE C C 142 172.293 174.200 -1.907 1
1 572 . 19 1 1 A 57 57 PHE CA C 142 56.366 55.227 1.139 1
1 573 . 19 1 1 A 57 57 PHE CB C 142 39.962 42.568 -2.606 1
1 575 . 19 1 1 A 57 57 PHE N N 142 117.009 121.682 -4.673 1
1 576 . 19 1 1 A 58 58 SER H H 143 8.890 8.968 -0.078 1
1 577 . 19 1 1 A 58 58 SER HA H 143 5.286 5.035 0.251 1
1 580 . 19 1 1 A 58 58 SER C C 143 173.716 174.717 -1.001 1
1 581 . 19 1 1 A 58 58 SER CA C 143 57.517 57.258 0.259 1
1 582 . 19 1 1 A 58 58 SER CB C 143 65.448 64.705 0.743 1
1 583 . 19 1 1 A 58 58 SER N N 143 115.269 116.426 -1.157 1
1 584 . 19 1 1 A 59 59 VAL H H 144 7.737 8.835 -1.098 1
1 585 . 19 1 1 A 59 59 VAL HA H 144 4.220 4.485 -0.265 1
1 593 . 19 1 1 A 59 59 VAL C C 144 176.234 176.125 0.109 1
1 594 . 19 1 1 A 59 59 VAL CA C 144 61.741 60.899 0.842 1
1 595 . 19 1 1 A 59 59 VAL CB C 144 33.711 33.632 0.079 1
1 598 . 19 1 1 A 59 59 VAL N N 144 123.186 122.587 0.599 1
1 599 . 19 1 1 A 60 60 GLY H H 145 8.945 9.057 -0.112 1
1 600 . 19 1 1 A 60 60 GLY HA2 H 145 4.027 3.804 0.223 1
1 601 . 19 1 1 A 60 60 GLY HA3 H 145 3.692 3.824 -0.132 1
1 602 . 19 1 1 A 60 60 GLY C C 145 175.182 174.780 0.402 1
1 603 . 19 1 1 A 60 60 GLY CA C 145 47.141 47.330 -0.189 1
1 604 . 19 1 1 A 60 60 GLY N N 145 116.908 118.223 -1.315 1
1 605 . 19 1 1 A 61 61 ASN H H 146 8.929 8.633 0.296 1
1 606 . 19 1 1 A 61 61 ASN HA H 146 4.718 4.819 -0.101 1
1 611 . 19 1 1 A 61 61 ASN C C 146 174.706 174.614 0.092 1
1 612 . 19 1 1 A 61 61 ASN CA C 146 52.802 52.133 0.669 1
1 613 . 19 1 1 A 61 61 ASN CB C 146 37.917 38.796 -0.879 1
1 614 . 19 1 1 A 61 61 ASN N N 146 123.976 124.764 -0.788 1
1 616 . 19 1 1 A 62 62 HIS H H 147 8.400 7.816 0.584 1
1 617 . 19 1 1 A 62 62 HIS HA H 147 4.762 5.040 -0.278 1
1 622 . 19 1 1 A 62 62 HIS C C 147 173.871 173.564 0.307 1
1 623 . 19 1 1 A 62 62 HIS CA C 147 55.374 54.298 1.076 1
1 624 . 19 1 1 A 62 62 HIS CB C 147 28.655 34.024 -5.369 1
1 628 . 19 1 1 A 62 62 HIS N N 147 118.620 118.035 0.585 1
1 631 . 19 1 1 A 63 63 ASP H H 148 8.734 8.757 -0.023 1
1 632 . 19 1 1 A 63 63 ASP HA H 148 4.785 4.996 -0.211 1
1 635 . 19 1 1 A 63 63 ASP C C 148 175.269 175.027 0.242 1
1 636 . 19 1 1 A 63 63 ASP CA C 148 54.390 53.555 0.835 1
1 637 . 19 1 1 A 63 63 ASP CB C 148 42.105 41.083 1.022 1
1 638 . 19 1 1 A 63 63 ASP N N 148 125.336 119.723 5.613 1
1 639 . 19 1 1 A 64 64 CYS H H 149 8.225 8.818 -0.593 1
1 640 . 19 1 1 A 64 64 CYS HA H 149 5.118 5.328 -0.210 1
1 643 . 19 1 1 A 64 64 CYS C C 149 173.740 172.782 0.958 1
1 644 . 19 1 1 A 64 64 CYS CA C 149 55.423 58.008 -2.585 1
1 645 . 19 1 1 A 64 64 CYS CB C 149 29.972 30.465 -0.493 1
1 646 . 19 1 1 A 64 64 CYS N N 149 124.476 124.584 -0.108 1
1 647 . 19 1 1 A 65 65 TYR H H 150 8.916 8.381 0.535 1
1 648 . 19 1 1 A 65 65 TYR HA H 150 5.121 3.915 1.206 1
1 655 . 19 1 1 A 65 65 TYR C C 150 172.821 171.900 0.921 1
1 656 . 19 1 1 A 65 65 TYR CA C 150 56.347 55.874 0.473 1
1 657 . 19 1 1 A 65 65 TYR CB C 150 38.901 40.260 -1.359 1
1 662 . 19 1 1 A 65 65 TYR N N 150 115.313 117.901 -2.588 1
1 663 . 19 1 1 A 66 66 ILE H H 151 8.423 8.730 -0.307 1
1 664 . 19 1 1 A 66 66 ILE HA H 151 5.000 4.324 0.676 1
1 674 . 19 1 1 A 66 66 ILE C C 151 176.225 174.455 1.770 1
1 675 . 19 1 1 A 66 66 ILE CA C 151 57.798 59.977 -2.179 1
1 676 . 19 1 1 A 66 66 ILE CB C 151 39.863 38.675 1.188 1
1 680 . 19 1 1 A 66 66 ILE N N 151 118.575 121.159 -2.584 1
1 681 . 19 1 1 A 67 67 LYS H H 152 9.480 8.809 0.671 1
1 682 . 19 1 1 A 67 67 LYS HA H 152 5.091 4.686 0.405 1
1 691 . 19 1 1 A 67 67 LYS C C 152 174.079 175.158 -1.079 1
1 692 . 19 1 1 A 67 67 LYS CA C 152 54.728 55.932 -1.204 1
1 693 . 19 1 1 A 67 67 LYS CB C 152 35.256 33.128 2.128 1
1 697 . 19 1 1 A 67 67 LYS N N 152 132.311 128.352 3.959 1
1 698 . 19 1 1 A 68 68 ALA H H 153 8.844 8.607 0.237 1
1 699 . 19 1 1 A 68 68 ALA HA H 153 5.039 5.363 -0.324 1
1 703 . 19 1 1 A 68 68 ALA C C 153 176.587 176.428 0.159 1
1 704 . 19 1 1 A 68 68 ALA CA C 153 50.484 50.913 -0.429 1
1 705 . 19 1 1 A 68 68 ALA CB C 153 20.570 21.258 -0.688 1
1 706 . 19 1 1 A 68 68 ALA N N 153 129.958 130.088 -0.130 1
1 707 . 19 1 1 A 69 69 VAL H H 154 8.461 8.650 -0.189 1
1 708 . 19 1 1 A 69 69 VAL HA H 154 4.558 4.611 -0.053 1
1 716 . 19 1 1 A 69 69 VAL C C 154 175.331 175.209 0.122 1
1 717 . 19 1 1 A 69 69 VAL CA C 154 60.758 60.771 -0.013 1
1 718 . 19 1 1 A 69 69 VAL CB C 154 34.743 35.017 -0.274 1
1 721 . 19 1 1 A 69 69 VAL N N 154 121.496 122.098 -0.602 1
1 722 . 19 1 1 A 70 70 SER H H 155 8.695 9.014 -0.319 1
1 723 . 19 1 1 A 70 70 SER HA H 155 4.646 5.312 -0.666 1
1 726 . 19 1 1 A 70 70 SER C C 155 174.690 173.822 0.868 1
1 727 . 19 1 1 A 70 70 SER CA C 155 58.065 56.245 1.820 1
1 728 . 19 1 1 A 70 70 SER CB C 155 64.062 65.417 -1.355 1
1 729 . 19 1 1 A 70 70 SER N N 155 119.763 121.775 -2.012 1
1 730 . 19 1 1 A 71 71 SER H H 156 8.360 8.735 -0.375 1
1 731 . 19 1 1 A 71 71 SER HA H 156 4.430 5.131 -0.701 1
1 734 . 19 1 1 A 71 71 SER CA C 156 58.491 56.876 1.615 1
1 735 . 19 1 1 A 71 71 SER CB C 156 64.061 66.297 -2.236 1
1 736 . 19 1 1 A 71 71 SER N N 156 118.577 115.010 3.567 1
1 737 . 19 1 1 A 72 72 GLY H H 157 8.542 8.685 -0.143 1
1 738 . 19 1 1 A 72 72 GLY HA2 H 157 4.002 3.963 0.039 1
1 739 . 19 1 1 A 72 72 GLY HA3 H 157 4.002 3.964 0.038 1
1 740 . 19 1 1 A 72 72 GLY CA C 157 45.565 46.369 -0.804 1
1 741 . 19 1 1 A 72 72 GLY N N 157 111.540 111.550 -0.010 1
1 742 . 19 1 1 A 73 73 LYS H H 158 8.369 8.406 -0.037 1
1 743 . 19 1 1 A 73 73 LYS CA C 158 56.720 58.588 -1.868 1
1 744 . 19 1 1 A 73 73 LYS CB C 158 32.915 31.331 1.584 1
1 747 . 19 1 1 A 73 73 LYS N N 158 120.293 112.734 7.559 1
1 748 . 19 1 1 A 74 74 ARG H H 159 8.181 8.567 -0.386 1
1 749 . 19 1 1 A 74 74 ARG CA C 159 56.148 56.975 -0.827 1
1 751 . 19 1 1 A 74 74 ARG N N 159 119.343 117.994 1.349 1
1 752 . 19 1 1 A 75 75 LYS H H 160 8.443 7.987 0.456 1
1 753 . 19 1 1 A 75 75 LYS HA H 160 4.067 4.737 -0.670 1
1 762 . 19 1 1 A 75 75 LYS C C 160 176.868 175.420 1.448 1
1 763 . 19 1 1 A 75 75 LYS CA C 160 57.711 55.421 2.290 1
1 764 . 19 1 1 A 75 75 LYS CB C 160 31.777 34.576 -2.799 1
1 768 . 19 1 1 A 75 75 LYS N N 160 120.467 118.238 2.229 1
1 769 . 19 1 1 A 76 76 GLU H H 161 8.693 8.672 0.021 1
1 770 . 19 1 1 A 76 76 GLU HA H 161 4.290 4.523 -0.233 1
1 771 . 19 1 1 A 76 76 GLU C C 161 176.844 175.720 1.124 1
1 772 . 19 1 1 A 76 76 GLU CA C 161 57.294 58.021 -0.727 1
1 773 . 19 1 1 A 76 76 GLU CB C 161 29.794 32.235 -2.441 1
1 775 . 19 1 1 A 76 76 GLU N N 161 118.767 128.382 -9.615 1
1 776 . 19 1 1 A 77 77 GLY H H 162 8.168 7.981 0.187 1
1 777 . 19 1 1 A 77 77 GLY HA2 H 162 4.010 4.247 -0.237 1
1 778 . 19 1 1 A 77 77 GLY HA3 H 162 3.963 4.249 -0.286 1
1 779 . 19 1 1 A 77 77 GLY C C 162 173.512 171.741 1.771 1
1 780 . 19 1 1 A 77 77 GLY CA C 162 45.362 44.647 0.715 1
1 781 . 19 1 1 A 77 77 GLY N N 162 108.621 106.852 1.769 1
1 782 . 19 1 1 A 78 78 ILE H H 163 7.954 8.916 -0.962 1
1 783 . 19 1 1 A 78 78 ILE HA H 163 4.323 4.999 -0.676 1
1 793 . 19 1 1 A 78 78 ILE C C 163 175.402 175.019 0.383 1
1 794 . 19 1 1 A 78 78 ILE CA C 163 60.632 59.587 1.045 1
1 795 . 19 1 1 A 78 78 ILE CB C 163 39.759 40.792 -1.033 1
1 799 . 19 1 1 A 78 78 ILE N N 163 121.604 125.518 -3.914 1
1 800 . 19 1 1 A 79 79 ILE H H 164 8.514 8.875 -0.361 1
1 801 . 19 1 1 A 79 79 ILE HA H 164 4.341 4.780 -0.439 1
1 811 . 19 1 1 A 79 79 ILE C C 164 175.172 174.505 0.667 1
1 812 . 19 1 1 A 79 79 ILE CA C 164 60.027 59.906 0.121 1
1 813 . 19 1 1 A 79 79 ILE CB C 164 40.153 41.094 -0.941 1
1 817 . 19 1 1 A 79 79 ILE N N 164 127.137 126.447 0.690 1
1 818 . 19 1 1 A 80 80 HIS H H 165 8.492 8.985 -0.493 1
1 819 . 19 1 1 A 80 80 HIS HA H 165 5.676 5.259 0.417 1
1 824 . 19 1 1 A 80 80 HIS C C 165 175.502 174.791 0.711 1
1 825 . 19 1 1 A 80 80 HIS CA C 165 57.043 55.197 1.846 1
1 826 . 19 1 1 A 80 80 HIS CB C 165 32.741 31.699 1.042 1
1 829 . 19 1 1 A 80 80 HIS N N 165 125.422 126.967 -1.545 1
1 830 . 19 1 1 A 81 81 THR H H 166 9.080 9.283 -0.203 1
1 831 . 19 1 1 A 81 81 THR HA H 166 4.999 4.947 0.052 1
1 836 . 19 1 1 A 81 81 THR C C 166 171.877 173.312 -1.435 1
1 837 . 19 1 1 A 81 81 THR CA C 166 59.924 61.112 -1.188 1
1 838 . 19 1 1 A 81 81 THR CB C 166 72.243 70.805 1.438 1
1 840 . 19 1 1 A 81 81 THR N N 166 117.682 114.577 3.105 1
1 841 . 19 1 1 A 82 82 LEU H H 167 8.062 8.025 0.037 1
1 842 . 19 1 1 A 82 82 LEU HA H 167 4.350 3.835 0.515 1
1 852 . 19 1 1 A 82 82 LEU C C 167 172.705 174.959 -2.254 1
1 853 . 19 1 1 A 82 82 LEU CA C 167 53.553 55.434 -1.881 1
1 854 . 19 1 1 A 82 82 LEU CB C 167 39.768 41.334 -1.566 1
1 858 . 19 1 1 A 82 82 LEU N N 167 125.369 128.262 -2.893 1
1 859 . 19 1 1 A 83 83 ILE H H 168 8.657 8.162 0.495 1
1 860 . 19 1 1 A 83 83 ILE HA H 168 4.476 4.958 -0.482 1
1 870 . 19 1 1 A 83 83 ILE C C 168 175.159 174.587 0.572 1
1 871 . 19 1 1 A 83 83 ILE CA C 168 58.529 59.893 -1.364 1
1 872 . 19 1 1 A 83 83 ILE CB C 168 37.410 41.023 -3.613 1
1 876 . 19 1 1 A 83 83 ILE N N 168 128.042 127.080 0.962 1
1 877 . 19 1 1 A 84 84 VAL H H 169 8.464 8.508 -0.044 1
1 878 . 19 1 1 A 84 84 VAL HA H 169 4.284 4.417 -0.133 1
1 886 . 19 1 1 A 84 84 VAL C C 169 176.138 175.762 0.376 1
1 887 . 19 1 1 A 84 84 VAL CA C 169 61.029 61.303 -0.274 1
1 888 . 19 1 1 A 84 84 VAL CB C 169 34.714 34.287 0.427 1
1 891 . 19 1 1 A 84 84 VAL N N 169 124.644 126.861 -2.217 1
1 892 . 19 1 1 A 85 85 ASP H H 170 9.158 9.482 -0.324 1
1 893 . 19 1 1 A 85 85 ASP HA H 170 4.362 4.262 0.100 1
1 896 . 19 1 1 A 85 85 ASP C C 170 175.489 175.332 0.157 1
1 897 . 19 1 1 A 85 85 ASP CA C 170 55.868 55.196 0.672 1
1 898 . 19 1 1 A 85 85 ASP CB C 170 38.927 39.445 -0.518 1
1 899 . 19 1 1 A 85 85 ASP N N 170 129.061 127.757 1.304 1
1 900 . 19 1 1 A 86 86 ASN H H 171 8.811 8.463 0.348 1
1 901 . 19 1 1 A 86 86 ASN HA H 171 4.053 4.351 -0.298 1
1 906 . 19 1 1 A 86 86 ASN C C 171 173.802 173.910 -0.108 1
1 907 . 19 1 1 A 86 86 ASN CA C 171 55.173 54.329 0.844 1
1 908 . 19 1 1 A 86 86 ASN CB C 171 38.150 37.373 0.777 1
1 909 . 19 1 1 A 86 86 ASN N N 171 108.418 114.931 -6.513 1
1 911 . 19 1 1 A 87 87 ARG H H 172 7.914 7.502 0.412 1
1 912 . 19 1 1 A 87 87 ARG HA H 172 4.597 4.725 -0.128 1
1 919 . 19 1 1 A 87 87 ARG C C 172 174.025 174.827 -0.802 1
1 920 . 19 1 1 A 87 87 ARG CA C 172 54.846 54.097 0.749 1
1 921 . 19 1 1 A 87 87 ARG CB C 172 32.697 33.470 -0.773 1
1 924 . 19 1 1 A 87 87 ARG N N 172 120.988 117.387 3.601 1
1 925 . 19 1 1 A 88 88 GLU H H 173 8.534 8.718 -0.184 1
1 926 . 19 1 1 A 88 88 GLU HA H 173 4.560 4.345 0.215 1
1 931 . 19 1 1 A 88 88 GLU C C 173 176.187 175.448 0.739 1
1 932 . 19 1 1 A 88 88 GLU CA C 173 56.044 56.855 -0.811 1
1 933 . 19 1 1 A 88 88 GLU CB C 173 30.329 30.427 -0.098 1
1 935 . 19 1 1 A 88 88 GLU N N 173 123.982 124.194 -0.212 1
1 936 . 19 1 1 A 89 89 ILE H H 174 8.897 8.062 0.835 1
1 937 . 19 1 1 A 89 89 ILE HA H 174 4.666 4.589 0.077 1
1 947 . 19 1 1 A 89 89 ILE C C 174 174.110 174.111 -0.001 1
1 948 . 19 1 1 A 89 89 ILE CA C 174 55.255 57.355 -2.100 1
1 949 . 19 1 1 A 89 89 ILE CB C 174 37.851 41.643 -3.792 1
1 953 . 19 1 1 A 89 89 ILE N N 174 130.008 127.241 2.767 1
1 954 . 19 1 1 A 90 90 PRO HA H 175 4.713 4.705 0.008 1
1 961 . 19 1 1 A 90 90 PRO C C 175 176.956 177.163 -0.207 1
1 962 . 19 1 1 A 90 90 PRO CA C 175 63.159 62.802 0.357 1
1 963 . 19 1 1 A 90 90 PRO CB C 175 32.428 32.089 0.339 1
1 966 . 19 1 1 A 91 91 GLU H H 176 8.778 8.702 0.076 1
1 967 . 19 1 1 A 91 91 GLU HA H 176 3.910 5.022 -1.112 1
1 972 . 19 1 1 A 91 91 GLU C C 176 176.426 176.136 0.290 1
1 973 . 19 1 1 A 91 91 GLU CA C 176 56.738 55.276 1.462 1
1 974 . 19 1 1 A 91 91 GLU CB C 176 30.540 31.294 -0.754 1
1 976 . 19 1 1 A 91 91 GLU N N 176 124.561 120.183 4.378 1
1 977 . 19 1 1 A 92 92 LEU H H 177 8.630 7.880 0.750 1
1 978 . 19 1 1 A 92 92 LEU HA H 177 4.419 4.277 0.142 1
1 988 . 19 1 1 A 92 92 LEU C C 177 177.162 176.348 0.814 1
1 989 . 19 1 1 A 92 92 LEU CA C 177 55.350 55.156 0.194 1
1 990 . 19 1 1 A 92 92 LEU CB C 177 42.390 41.922 0.468 1
1 994 . 19 1 1 A 92 92 LEU N N 177 126.683 123.168 3.515 1
1 995 . 19 1 1 A 93 93 THR H H 178 8.375 8.814 -0.439 1
1 996 . 19 1 1 A 93 93 THR HA H 178 4.359 4.569 -0.210 1
1 1001 . 19 1 1 A 93 93 THR C C 178 173.589 174.759 -1.170 1
1 1002 . 19 1 1 A 93 93 THR CA C 178 61.621 62.167 -0.546 1
1 1003 . 19 1 1 A 93 93 THR CB C 178 69.724 70.340 -0.616 1
1 1005 . 19 1 1 A 93 93 THR N N 178 119.699 116.116 3.583 1
1 1 . 20 1 1 A 9 9 SER H H 94 8.475 8.154 0.321 1
1 2 . 20 1 1 A 9 9 SER CA C 94 58.531 59.268 -0.737 1
1 3 . 20 1 1 A 9 9 SER N N 94 117.432 113.207 4.225 1
1 4 . 20 1 1 A 10 10 LYS H H 95 8.527 7.832 0.695 1
1 5 . 20 1 1 A 10 10 LYS C C 95 174.594 175.856 -1.262 1
1 6 . 20 1 1 A 10 10 LYS CA C 95 56.603 55.118 1.485 1
1 7 . 20 1 1 A 10 10 LYS N N 95 123.104 121.109 1.995 1
1 8 . 20 1 1 A 11 11 THR H H 96 8.245 8.740 -0.495 1
1 9 . 20 1 1 A 11 11 THR C C 96 174.393 173.128 1.265 1
1 10 . 20 1 1 A 11 11 THR CA C 96 62.149 65.696 -3.547 1
1 11 . 20 1 1 A 11 11 THR CB C 96 69.183 67.236 1.947 1
1 13 . 20 1 1 A 11 11 THR N N 96 113.245 112.568 0.677 1
1 14 . 20 1 1 A 12 12 THR H H 97 7.769 7.883 -0.114 1
1 15 . 20 1 1 A 12 12 THR HA H 97 5.583 4.617 0.966 1
1 20 . 20 1 1 A 12 12 THR C C 97 174.726 172.440 2.286 1
1 21 . 20 1 1 A 12 12 THR CA C 97 59.602 60.846 -1.244 1
1 22 . 20 1 1 A 12 12 THR CB C 97 72.805 71.452 1.353 1
1 24 . 20 1 1 A 12 12 THR N N 97 113.440 109.875 3.565 1
1 25 . 20 1 1 A 13 13 SER H H 98 8.593 8.904 -0.311 1
1 26 . 20 1 1 A 13 13 SER HA H 98 4.448 5.247 -0.799 1
1 29 . 20 1 1 A 13 13 SER C C 98 171.426 172.647 -1.221 1
1 30 . 20 1 1 A 13 13 SER CA C 98 59.056 57.007 2.049 1
1 31 . 20 1 1 A 13 13 SER CB C 98 67.839 65.136 2.703 1
1 32 . 20 1 1 A 13 13 SER N N 98 119.042 121.388 -2.346 1
1 33 . 20 1 1 A 14 14 THR H H 99 8.155 7.812 0.343 1
1 34 . 20 1 1 A 14 14 THR HA H 99 5.383 4.888 0.495 1
1 39 . 20 1 1 A 14 14 THR C C 99 171.565 172.775 -1.210 1
1 40 . 20 1 1 A 14 14 THR CA C 99 61.291 60.761 0.530 1
1 41 . 20 1 1 A 14 14 THR CB C 99 71.654 72.007 -0.353 1
1 43 . 20 1 1 A 14 14 THR N N 99 118.204 116.368 1.836 1
1 44 . 20 1 1 A 15 15 TRP H H 100 9.637 9.242 0.395 1
1 45 . 20 1 1 A 15 15 TRP HA H 100 4.807 5.365 -0.558 1
1 54 . 20 1 1 A 15 15 TRP C C 100 174.399 175.651 -1.252 1
1 55 . 20 1 1 A 15 15 TRP CA C 100 58.302 55.461 2.841 1
1 56 . 20 1 1 A 15 15 TRP CB C 100 34.810 34.142 0.668 1
1 63 . 20 1 1 A 15 15 TRP N N 100 125.132 125.114 0.018 1
1 65 . 20 1 1 A 16 16 VAL H H 101 8.863 8.700 0.163 1
1 66 . 20 1 1 A 16 16 VAL HA H 101 5.267 4.913 0.354 1
1 74 . 20 1 1 A 16 16 VAL C C 101 174.955 174.990 -0.035 1
1 75 . 20 1 1 A 16 16 VAL CA C 101 60.653 61.456 -0.803 1
1 76 . 20 1 1 A 16 16 VAL CB C 101 34.284 34.289 -0.005 1
1 79 . 20 1 1 A 16 16 VAL N N 101 119.527 120.738 -1.211 1
1 80 . 20 1 1 A 17 17 LEU H H 102 8.961 8.858 0.103 1
1 81 . 20 1 1 A 17 17 LEU HA H 102 4.729 5.088 -0.359 1
1 91 . 20 1 1 A 17 17 LEU C C 102 173.559 175.093 -1.534 1
1 92 . 20 1 1 A 17 17 LEU CA C 102 55.144 53.104 2.040 1
1 93 . 20 1 1 A 17 17 LEU CB C 102 42.948 45.828 -2.880 1
1 97 . 20 1 1 A 17 17 LEU N N 102 124.280 124.143 0.137 1
1 98 . 20 1 1 A 18 18 ARG H H 103 8.305 8.399 -0.094 1
1 99 . 20 1 1 A 18 18 ARG HA H 103 5.139 4.650 0.489 1
1 106 . 20 1 1 A 18 18 ARG C C 103 175.347 175.175 0.172 1
1 107 . 20 1 1 A 18 18 ARG CA C 103 54.793 56.103 -1.310 1
1 108 . 20 1 1 A 18 18 ARG CB C 103 31.347 29.759 1.588 1
1 111 . 20 1 1 A 18 18 ARG N N 103 122.020 120.084 1.936 1
1 112 . 20 1 1 A 19 19 LEU H H 104 8.676 8.757 -0.081 1
1 113 . 20 1 1 A 19 19 LEU HA H 104 4.482 4.813 -0.331 1
1 123 . 20 1 1 A 19 19 LEU C C 104 175.957 175.818 0.139 1
1 124 . 20 1 1 A 19 19 LEU CA C 104 53.581 53.597 -0.016 1
1 125 . 20 1 1 A 19 19 LEU CB C 104 45.697 45.143 0.554 1
1 129 . 20 1 1 A 19 19 LEU N N 104 126.378 125.006 1.372 1
1 130 . 20 1 1 A 20 20 ASP H H 105 9.390 9.526 -0.136 1
1 131 . 20 1 1 A 20 20 ASP HA H 105 4.287 4.383 -0.096 1
1 134 . 20 1 1 A 20 20 ASP C C 105 175.947 175.974 -0.027 1
1 135 . 20 1 1 A 20 20 ASP CA C 105 55.263 55.306 -0.043 1
1 136 . 20 1 1 A 20 20 ASP CB C 105 39.239 39.412 -0.173 1
1 137 . 20 1 1 A 20 20 ASP N N 105 125.208 125.817 -0.609 1
1 138 . 20 1 1 A 21 21 GLY H H 106 8.563 8.631 -0.068 1
1 139 . 20 1 1 A 21 21 GLY HA2 H 106 4.126 3.833 0.293 1
1 140 . 20 1 1 A 21 21 GLY HA3 H 106 3.509 3.834 -0.325 1
1 141 . 20 1 1 A 21 21 GLY C C 106 173.164 173.502 -0.338 1
1 142 . 20 1 1 A 21 21 GLY CA C 106 45.499 45.508 -0.009 1
1 143 . 20 1 1 A 21 21 GLY N N 106 103.331 104.016 -0.685 1
1 144 . 20 1 1 A 22 22 GLU H H 107 7.713 7.899 -0.186 1
1 145 . 20 1 1 A 22 22 GLU HA H 107 4.634 4.865 -0.231 1
1 150 . 20 1 1 A 22 22 GLU C C 107 174.800 174.745 0.055 1
1 151 . 20 1 1 A 22 22 GLU CA C 107 54.329 54.538 -0.209 1
1 152 . 20 1 1 A 22 22 GLU CB C 107 32.832 33.987 -1.155 1
1 154 . 20 1 1 A 22 22 GLU N N 107 119.470 120.012 -0.542 1
1 155 . 20 1 1 A 23 23 ASP H H 108 8.632 8.557 0.075 1
1 156 . 20 1 1 A 23 23 ASP HA H 108 4.872 4.704 0.168 1
1 159 . 20 1 1 A 23 23 ASP C C 108 175.533 175.514 0.019 1
1 160 . 20 1 1 A 23 23 ASP CA C 108 55.180 54.040 1.140 1
1 161 . 20 1 1 A 23 23 ASP CB C 108 41.504 39.540 1.964 1
1 162 . 20 1 1 A 23 23 ASP N N 108 122.815 120.902 1.913 1
1 163 . 20 1 1 A 24 24 LEU H H 109 9.248 8.901 0.347 1
1 164 . 20 1 1 A 24 24 LEU HA H 109 4.836 4.516 0.320 1
1 174 . 20 1 1 A 24 24 LEU C C 109 174.322 175.542 -1.220 1
1 175 . 20 1 1 A 24 24 LEU CA C 109 54.473 55.213 -0.740 1
1 176 . 20 1 1 A 24 24 LEU CB C 109 44.718 42.853 1.865 1
1 180 . 20 1 1 A 24 24 LEU N N 109 125.550 126.758 -1.208 1
1 181 . 20 1 1 A 25 25 ARG H H 110 8.503 8.725 -0.222 1
1 182 . 20 1 1 A 25 25 ARG HA H 110 5.228 4.999 0.229 1
1 189 . 20 1 1 A 25 25 ARG C C 110 175.174 174.658 0.516 1
1 190 . 20 1 1 A 25 25 ARG CA C 110 54.745 54.689 0.056 1
1 191 . 20 1 1 A 25 25 ARG CB C 110 31.701 32.681 -0.980 1
1 194 . 20 1 1 A 25 25 ARG N N 110 125.424 128.354 -2.930 1
1 195 . 20 1 1 A 26 26 VAL H H 111 9.692 8.933 0.759 1
1 196 . 20 1 1 A 26 26 VAL HA H 111 5.091 4.792 0.299 1
1 204 . 20 1 1 A 26 26 VAL C C 111 174.446 175.427 -0.981 1
1 205 . 20 1 1 A 26 26 VAL CA C 111 61.055 61.327 -0.272 1
1 206 . 20 1 1 A 26 26 VAL CB C 111 33.780 33.685 0.095 1
1 209 . 20 1 1 A 26 26 VAL N N 111 130.649 127.153 3.496 1
1 210 . 20 1 1 A 27 27 VAL H H 112 9.401 8.847 0.554 1
1 211 . 20 1 1 A 27 27 VAL HA H 112 5.188 5.073 0.115 1
1 219 . 20 1 1 A 27 27 VAL C C 112 174.214 174.890 -0.676 1
1 220 . 20 1 1 A 27 27 VAL CA C 112 60.722 60.614 0.108 1
1 221 . 20 1 1 A 27 27 VAL CB C 112 36.082 35.687 0.395 1
1 224 . 20 1 1 A 27 27 VAL N N 112 127.416 126.332 1.084 1
1 225 . 20 1 1 A 28 28 LEU H H 113 9.265 9.213 0.052 1
1 226 . 20 1 1 A 28 28 LEU HA H 113 5.337 5.208 0.129 1
1 236 . 20 1 1 A 28 28 LEU C C 113 175.915 175.128 0.787 1
1 237 . 20 1 1 A 28 28 LEU CA C 113 52.599 53.925 -1.326 1
1 238 . 20 1 1 A 28 28 LEU CB C 113 47.495 44.993 2.502 1
1 242 . 20 1 1 A 28 28 LEU N N 113 127.527 128.170 -0.643 1
1 243 . 20 1 1 A 29 29 GLU H H 114 8.968 8.667 0.301 1
1 244 . 20 1 1 A 29 29 GLU HA H 114 4.701 4.309 0.392 1
1 249 . 20 1 1 A 29 29 GLU C C 114 176.715 177.818 -1.103 1
1 250 . 20 1 1 A 29 29 GLU CA C 114 55.342 56.517 -1.175 1
1 251 . 20 1 1 A 29 29 GLU CB C 114 30.005 30.212 -0.207 1
1 253 . 20 1 1 A 29 29 GLU N N 114 127.374 127.345 0.029 1
1 254 . 20 1 1 A 30 30 LYS H H 115 8.243 8.660 -0.417 1
1 255 . 20 1 1 A 30 30 LYS HA H 115 3.711 4.075 -0.364 1
1 264 . 20 1 1 A 30 30 LYS C C 115 177.137 178.029 -0.892 1
1 265 . 20 1 1 A 30 30 LYS CA C 115 60.118 58.681 1.437 1
1 266 . 20 1 1 A 30 30 LYS CB C 115 32.656 32.700 -0.044 1
1 270 . 20 1 1 A 30 30 LYS N N 115 124.225 126.923 -2.698 1
1 271 . 20 1 1 A 31 31 ASP H H 116 9.200 7.984 1.216 1
1 272 . 20 1 1 A 31 31 ASP HA H 116 4.444 4.415 0.029 1
1 275 . 20 1 1 A 31 31 ASP C C 116 177.774 177.014 0.760 1
1 276 . 20 1 1 A 31 31 ASP CA C 116 56.703 57.418 -0.715 1
1 277 . 20 1 1 A 31 31 ASP CB C 116 40.236 41.216 -0.980 1
1 278 . 20 1 1 A 31 31 ASP N N 116 115.955 119.303 -3.348 1
1 279 . 20 1 1 A 32 32 THR H H 117 7.352 7.551 -0.199 1
1 280 . 20 1 1 A 32 32 THR HA H 117 4.266 4.597 -0.331 1
1 285 . 20 1 1 A 32 32 THR C C 117 175.320 173.916 1.404 1
1 286 . 20 1 1 A 32 32 THR CA C 117 61.171 60.736 0.435 1
1 287 . 20 1 1 A 32 32 THR CB C 117 70.221 69.069 1.152 1
1 289 . 20 1 1 A 32 32 THR N N 117 106.440 108.854 -2.414 1
1 290 . 20 1 1 A 33 33 MET H H 118 8.216 7.895 0.321 1
1 291 . 20 1 1 A 33 33 MET HA H 118 4.184 4.390 -0.206 1
1 299 . 20 1 1 A 33 33 MET C C 118 174.952 174.677 0.275 1
1 300 . 20 1 1 A 33 33 MET CA C 118 55.195 56.793 -1.598 1
1 301 . 20 1 1 A 33 33 MET CB C 118 25.900 31.008 -5.108 1
1 304 . 20 1 1 A 33 33 MET N N 118 115.956 116.253 -0.297 1
1 305 . 20 1 1 A 34 34 ASP H H 119 7.509 7.888 -0.379 1
1 306 . 20 1 1 A 34 34 ASP HA H 119 4.486 4.763 -0.277 1
1 309 . 20 1 1 A 34 34 ASP C C 119 174.375 175.545 -1.170 1
1 310 . 20 1 1 A 34 34 ASP CA C 119 54.745 53.983 0.762 1
1 311 . 20 1 1 A 34 34 ASP CB C 119 42.865 41.760 1.105 1
1 312 . 20 1 1 A 34 34 ASP N N 119 118.500 118.096 0.404 1
1 313 . 20 1 1 A 35 35 VAL H H 120 8.473 8.660 -0.187 1
1 314 . 20 1 1 A 35 35 VAL HA H 120 4.709 4.879 -0.170 1
1 322 . 20 1 1 A 35 35 VAL C C 120 173.900 174.246 -0.346 1
1 323 . 20 1 1 A 35 35 VAL CA C 120 60.736 61.031 -0.295 1
1 324 . 20 1 1 A 35 35 VAL CB C 120 34.662 32.936 1.726 1
1 327 . 20 1 1 A 35 35 VAL N N 120 121.116 122.679 -1.563 1
1 328 . 20 1 1 A 36 36 TRP H H 121 9.404 9.328 0.076 1
1 329 . 20 1 1 A 36 36 TRP HA H 121 5.174 5.472 -0.298 1
1 338 . 20 1 1 A 36 36 TRP C C 121 176.480 174.240 2.240 1
1 339 . 20 1 1 A 36 36 TRP CA C 121 55.070 54.543 0.527 1
1 340 . 20 1 1 A 36 36 TRP CB C 121 32.179 32.212 -0.033 1
1 348 . 20 1 1 A 36 36 TRP N N 121 126.924 129.196 -2.272 1
1 350 . 20 1 1 A 37 37 CYS H H 122 9.230 8.247 0.983 1
1 351 . 20 1 1 A 37 37 CYS HA H 122 5.417 4.648 0.769 1
1 354 . 20 1 1 A 37 37 CYS C C 122 175.346 174.208 1.138 1
1 355 . 20 1 1 A 37 37 CYS CA C 122 57.083 57.249 -0.166 1
1 356 . 20 1 1 A 37 37 CYS CB C 122 28.713 28.716 -0.003 1
1 357 . 20 1 1 A 37 37 CYS N N 122 120.375 127.712 -7.337 1
1 358 . 20 1 1 A 38 38 ASN H H 123 9.817 8.717 1.100 1
1 359 . 20 1 1 A 38 38 ASN HA H 123 4.637 4.086 0.551 1
1 364 . 20 1 1 A 38 38 ASN C C 123 175.526 174.712 0.814 1
1 365 . 20 1 1 A 38 38 ASN CA C 123 54.023 55.025 -1.002 1
1 366 . 20 1 1 A 38 38 ASN CB C 123 36.581 37.219 -0.638 1
1 367 . 20 1 1 A 38 38 ASN N N 123 129.408 124.181 5.227 1
1 369 . 20 1 1 A 39 39 GLY H H 124 9.092 8.320 0.772 1
1 370 . 20 1 1 A 39 39 GLY HA2 H 124 4.241 3.449 0.792 1
1 371 . 20 1 1 A 39 39 GLY HA3 H 124 3.705 3.943 -0.238 1
1 372 . 20 1 1 A 39 39 GLY C C 124 173.405 173.028 0.377 1
1 373 . 20 1 1 A 39 39 GLY CA C 124 45.595 45.415 0.180 1
1 374 . 20 1 1 A 39 39 GLY N N 124 102.752 105.283 -2.531 1
1 375 . 20 1 1 A 40 40 GLN H H 125 8.006 7.494 0.512 1
1 376 . 20 1 1 A 40 40 GLN HA H 125 4.736 4.926 -0.190 1
1 383 . 20 1 1 A 40 40 GLN C C 125 174.477 174.926 -0.449 1
1 384 . 20 1 1 A 40 40 GLN CA C 125 53.747 55.215 -1.468 1
1 385 . 20 1 1 A 40 40 GLN CB C 125 30.413 31.188 -0.775 1
1 387 . 20 1 1 A 40 40 GLN N N 125 120.627 120.595 0.032 1
1 389 . 20 1 1 A 41 41 LYS H H 126 8.757 8.599 0.158 1
1 390 . 20 1 1 A 41 41 LYS HA H 126 3.464 4.521 -1.057 1
1 399 . 20 1 1 A 41 41 LYS C C 126 176.870 176.668 0.202 1
1 400 . 20 1 1 A 41 41 LYS CA C 126 57.136 57.011 0.125 1
1 401 . 20 1 1 A 41 41 LYS CB C 126 31.669 33.008 -1.339 1
1 405 . 20 1 1 A 41 41 LYS N N 126 129.107 127.277 1.830 1
1 406 . 20 1 1 A 42 42 MET H H 127 8.682 8.638 0.044 1
1 407 . 20 1 1 A 42 42 MET HA H 127 4.712 4.396 0.316 1
1 415 . 20 1 1 A 42 42 MET C C 127 176.816 175.771 1.045 1
1 416 . 20 1 1 A 42 42 MET CA C 127 52.958 56.108 -3.150 1
1 417 . 20 1 1 A 42 42 MET CB C 127 33.023 33.866 -0.843 1
1 420 . 20 1 1 A 42 42 MET N N 127 126.569 125.809 0.760 1
1 421 . 20 1 1 A 43 43 GLU H H 128 8.734 8.702 0.032 1
1 422 . 20 1 1 A 43 43 GLU HA H 128 4.419 4.860 -0.441 1
1 427 . 20 1 1 A 43 43 GLU C C 128 176.531 176.584 -0.053 1
1 428 . 20 1 1 A 43 43 GLU CA C 128 56.475 55.122 1.353 1
1 429 . 20 1 1 A 43 43 GLU CB C 128 29.604 30.859 -1.255 1
1 431 . 20 1 1 A 43 43 GLU N N 128 123.734 122.863 0.871 1
1 432 . 20 1 1 A 44 44 THR H H 129 8.263 8.774 -0.511 1
1 433 . 20 1 1 A 44 44 THR HA H 129 5.385 5.363 0.022 1
1 438 . 20 1 1 A 44 44 THR C C 129 174.205 174.568 -0.363 1
1 439 . 20 1 1 A 44 44 THR CA C 129 59.160 60.520 -1.360 1
1 440 . 20 1 1 A 44 44 THR CB C 129 72.419 71.130 1.289 1
1 442 . 20 1 1 A 44 44 THR N N 129 115.081 118.010 -2.929 1
1 443 . 20 1 1 A 45 45 ALA H H 130 8.727 8.747 -0.020 1
1 444 . 20 1 1 A 45 45 ALA HA H 130 4.749 4.435 0.314 1
1 448 . 20 1 1 A 45 45 ALA C C 130 177.017 178.345 -1.328 1
1 449 . 20 1 1 A 45 45 ALA CA C 130 51.645 53.907 -2.262 1
1 450 . 20 1 1 A 45 45 ALA CB C 130 21.364 20.364 1.000 1
1 451 . 20 1 1 A 45 45 ALA N N 130 123.243 123.196 0.047 1
1 452 . 20 1 1 A 46 46 GLY H H 131 8.818 8.231 0.587 1
1 453 . 20 1 1 A 46 46 GLY HA2 H 131 4.941 3.919 1.022 1
1 454 . 20 1 1 A 46 46 GLY HA3 H 131 3.690 3.944 -0.254 1
1 455 . 20 1 1 A 46 46 GLY C C 131 173.528 173.807 -0.279 1
1 456 . 20 1 1 A 46 46 GLY CA C 131 45.060 46.049 -0.989 1
1 457 . 20 1 1 A 46 46 GLY N N 131 112.392 104.916 7.476 1
1 458 . 20 1 1 A 47 47 GLU H H 132 8.746 7.878 0.868 1
1 459 . 20 1 1 A 47 47 GLU HA H 132 4.584 4.782 -0.198 1
1 464 . 20 1 1 A 47 47 GLU C C 132 175.223 175.060 0.163 1
1 465 . 20 1 1 A 47 47 GLU CA C 132 55.008 55.202 -0.194 1
1 466 . 20 1 1 A 47 47 GLU CB C 132 32.939 33.674 -0.735 1
1 468 . 20 1 1 A 47 47 GLU N N 132 122.107 121.524 0.583 1
1 469 . 20 1 1 A 48 48 PHE H H 133 8.920 8.786 0.134 1
1 470 . 20 1 1 A 48 48 PHE HA H 133 4.822 4.984 -0.162 1
1 475 . 20 1 1 A 48 48 PHE C C 133 175.499 175.791 -0.292 1
1 476 . 20 1 1 A 48 48 PHE CA C 133 58.320 58.730 -0.410 1
1 477 . 20 1 1 A 48 48 PHE CB C 133 39.175 40.085 -0.910 1
1 479 . 20 1 1 A 48 48 PHE N N 133 124.006 125.516 -1.510 1
1 480 . 20 1 1 A 49 49 VAL H H 134 8.161 8.964 -0.803 1
1 481 . 20 1 1 A 49 49 VAL HA H 134 4.492 4.633 -0.141 1
1 489 . 20 1 1 A 49 49 VAL C C 134 176.241 176.122 0.119 1
1 490 . 20 1 1 A 49 49 VAL CA C 134 60.328 59.186 1.142 1
1 491 . 20 1 1 A 49 49 VAL CB C 134 34.542 35.296 -0.754 1
1 494 . 20 1 1 A 49 49 VAL N N 134 120.063 114.776 5.287 1
1 495 . 20 1 1 A 50 50 ASP H H 135 8.596 8.883 -0.287 1
1 496 . 20 1 1 A 50 50 ASP HA H 135 4.278 4.356 -0.078 1
1 499 . 20 1 1 A 50 50 ASP C C 135 176.567 177.058 -0.491 1
1 500 . 20 1 1 A 50 50 ASP CA C 135 57.149 57.087 0.062 1
1 501 . 20 1 1 A 50 50 ASP CB C 135 40.477 40.601 -0.124 1
1 502 . 20 1 1 A 50 50 ASP N N 135 122.137 121.363 0.774 1
1 503 . 20 1 1 A 51 51 ASP H H 136 8.328 8.148 0.180 1
1 504 . 20 1 1 A 51 51 ASP HA H 136 4.656 4.866 -0.210 1
1 507 . 20 1 1 A 51 51 ASP C C 136 175.798 177.907 -2.109 1
1 508 . 20 1 1 A 51 51 ASP CA C 136 53.458 55.470 -2.012 1
1 509 . 20 1 1 A 51 51 ASP CB C 136 40.306 41.351 -1.045 1
1 510 . 20 1 1 A 51 51 ASP N N 136 116.158 118.000 -1.842 1
1 511 . 20 1 1 A 52 52 GLY H H 137 7.653 7.807 -0.154 1
1 512 . 20 1 1 A 52 52 GLY HA2 H 137 4.685 4.108 0.577 1
1 513 . 20 1 1 A 52 52 GLY HA3 H 137 4.069 4.168 -0.099 1
1 514 . 20 1 1 A 52 52 GLY C C 137 173.149 172.616 0.533 1
1 515 . 20 1 1 A 52 52 GLY CA C 137 45.860 45.410 0.450 1
1 516 . 20 1 1 A 52 52 GLY N N 137 107.634 108.127 -0.493 1
1 517 . 20 1 1 A 53 53 THR H H 138 8.445 8.023 0.422 1
1 518 . 20 1 1 A 53 53 THR HA H 138 4.996 5.242 -0.246 1
1 523 . 20 1 1 A 53 53 THR C C 138 174.163 173.213 0.950 1
1 524 . 20 1 1 A 53 53 THR CA C 138 60.974 61.379 -0.405 1
1 525 . 20 1 1 A 53 53 THR CB C 138 72.266 71.660 0.606 1
1 527 . 20 1 1 A 53 53 THR N N 138 114.976 114.679 0.297 1
1 528 . 20 1 1 A 54 54 GLU H H 139 8.917 9.164 -0.247 1
1 529 . 20 1 1 A 54 54 GLU HA H 139 5.205 4.541 0.664 1
1 534 . 20 1 1 A 54 54 GLU C C 139 175.700 174.973 0.727 1
1 535 . 20 1 1 A 54 54 GLU CA C 139 54.731 55.616 -0.885 1
1 536 . 20 1 1 A 54 54 GLU CB C 139 33.250 29.842 3.408 1
1 538 . 20 1 1 A 54 54 GLU N N 139 121.295 126.916 -5.621 1
1 539 . 20 1 1 A 55 55 THR H H 140 9.190 8.115 1.075 1
1 540 . 20 1 1 A 55 55 THR HA H 140 4.744 4.506 0.238 1
1 545 . 20 1 1 A 55 55 THR C C 140 174.537 173.869 0.668 1
1 546 . 20 1 1 A 55 55 THR CA C 140 62.678 62.364 0.314 1
1 547 . 20 1 1 A 55 55 THR CB C 140 69.744 68.840 0.904 1
1 549 . 20 1 1 A 55 55 THR N N 140 122.419 122.067 0.352 1
1 550 . 20 1 1 A 56 56 HIS H H 141 9.395 9.073 0.322 1
1 551 . 20 1 1 A 56 56 HIS HA H 141 5.204 4.931 0.273 1
1 556 . 20 1 1 A 56 56 HIS C C 141 174.675 174.738 -0.063 1
1 557 . 20 1 1 A 56 56 HIS CA C 141 55.557 53.855 1.702 1
1 558 . 20 1 1 A 56 56 HIS CB C 141 31.279 30.675 0.604 1
1 561 . 20 1 1 A 56 56 HIS N N 141 125.732 126.500 -0.768 1
1 564 . 20 1 1 A 57 57 PHE H H 142 8.790 8.201 0.589 1
1 565 . 20 1 1 A 57 57 PHE HA H 142 4.918 5.806 -0.888 1
1 571 . 20 1 1 A 57 57 PHE C C 142 172.293 172.808 -0.515 1
1 572 . 20 1 1 A 57 57 PHE CA C 142 56.366 55.691 0.675 1
1 573 . 20 1 1 A 57 57 PHE CB C 142 39.962 42.657 -2.695 1
1 575 . 20 1 1 A 57 57 PHE N N 142 117.009 121.048 -4.039 1
1 576 . 20 1 1 A 58 58 SER H H 143 8.890 9.282 -0.392 1
1 577 . 20 1 1 A 58 58 SER HA H 143 5.286 5.394 -0.108 1
1 580 . 20 1 1 A 58 58 SER C C 143 173.716 173.863 -0.147 1
1 581 . 20 1 1 A 58 58 SER CA C 143 57.517 56.058 1.459 1
1 582 . 20 1 1 A 58 58 SER CB C 143 65.448 66.468 -1.020 1
1 583 . 20 1 1 A 58 58 SER N N 143 115.269 113.965 1.304 1
1 584 . 20 1 1 A 59 59 VAL H H 144 7.737 8.778 -1.041 1
1 585 . 20 1 1 A 59 59 VAL HA H 144 4.220 4.417 -0.197 1
1 593 . 20 1 1 A 59 59 VAL C C 144 176.234 176.114 0.120 1
1 594 . 20 1 1 A 59 59 VAL CA C 144 61.741 60.877 0.864 1
1 595 . 20 1 1 A 59 59 VAL CB C 144 33.711 33.680 0.031 1
1 598 . 20 1 1 A 59 59 VAL N N 144 123.186 120.051 3.135 1
1 599 . 20 1 1 A 60 60 GLY H H 145 8.945 9.050 -0.105 1
1 600 . 20 1 1 A 60 60 GLY HA2 H 145 4.027 3.813 0.214 1
1 601 . 20 1 1 A 60 60 GLY HA3 H 145 3.692 3.831 -0.139 1
1 602 . 20 1 1 A 60 60 GLY C C 145 175.182 174.410 0.772 1
1 603 . 20 1 1 A 60 60 GLY CA C 145 47.141 47.325 -0.184 1
1 604 . 20 1 1 A 60 60 GLY N N 145 116.908 118.144 -1.236 1
1 605 . 20 1 1 A 61 61 ASN H H 146 8.929 8.341 0.588 1
1 606 . 20 1 1 A 61 61 ASN HA H 146 4.718 4.874 -0.156 1
1 611 . 20 1 1 A 61 61 ASN C C 146 174.706 174.345 0.361 1
1 612 . 20 1 1 A 61 61 ASN CA C 146 52.802 52.361 0.441 1
1 613 . 20 1 1 A 61 61 ASN CB C 146 37.917 39.347 -1.430 1
1 614 . 20 1 1 A 61 61 ASN N N 146 123.976 123.275 0.701 1
1 616 . 20 1 1 A 62 62 HIS H H 147 8.400 7.378 1.022 1
1 617 . 20 1 1 A 62 62 HIS HA H 147 4.762 5.036 -0.274 1
1 622 . 20 1 1 A 62 62 HIS C C 147 173.871 173.500 0.371 1
1 623 . 20 1 1 A 62 62 HIS CA C 147 55.374 54.506 0.868 1
1 624 . 20 1 1 A 62 62 HIS CB C 147 28.655 34.008 -5.353 1
1 628 . 20 1 1 A 62 62 HIS N N 147 118.620 118.719 -0.099 1
1 631 . 20 1 1 A 63 63 ASP H H 148 8.734 8.921 -0.187 1
1 632 . 20 1 1 A 63 63 ASP HA H 148 4.785 5.271 -0.486 1
1 635 . 20 1 1 A 63 63 ASP C C 148 175.269 174.529 0.740 1
1 636 . 20 1 1 A 63 63 ASP CA C 148 54.390 53.520 0.870 1
1 637 . 20 1 1 A 63 63 ASP CB C 148 42.105 43.877 -1.772 1
1 638 . 20 1 1 A 63 63 ASP N N 148 125.336 119.660 5.676 1
1 639 . 20 1 1 A 64 64 CYS H H 149 8.225 9.327 -1.102 1
1 640 . 20 1 1 A 64 64 CYS HA H 149 5.118 5.379 -0.261 1
1 643 . 20 1 1 A 64 64 CYS C C 149 173.740 172.964 0.776 1
1 644 . 20 1 1 A 64 64 CYS CA C 149 55.423 56.828 -1.405 1
1 645 . 20 1 1 A 64 64 CYS CB C 149 29.972 32.539 -2.567 1
1 646 . 20 1 1 A 64 64 CYS N N 149 124.476 122.836 1.640 1
1 647 . 20 1 1 A 65 65 TYR H H 150 8.916 8.921 -0.005 1
1 648 . 20 1 1 A 65 65 TYR HA H 150 5.121 4.114 1.007 1
1 655 . 20 1 1 A 65 65 TYR C C 150 172.821 172.167 0.654 1
1 656 . 20 1 1 A 65 65 TYR CA C 150 56.347 55.621 0.726 1
1 657 . 20 1 1 A 65 65 TYR CB C 150 38.901 41.220 -2.319 1
1 662 . 20 1 1 A 65 65 TYR N N 150 115.313 116.959 -1.646 1
1 663 . 20 1 1 A 66 66 ILE H H 151 8.423 8.225 0.198 1
1 664 . 20 1 1 A 66 66 ILE HA H 151 5.000 4.385 0.615 1
1 674 . 20 1 1 A 66 66 ILE C C 151 176.225 174.794 1.431 1
1 675 . 20 1 1 A 66 66 ILE CA C 151 57.798 60.028 -2.230 1
1 676 . 20 1 1 A 66 66 ILE CB C 151 39.863 38.728 1.135 1
1 680 . 20 1 1 A 66 66 ILE N N 151 118.575 121.318 -2.743 1
1 681 . 20 1 1 A 67 67 LYS H H 152 9.480 8.755 0.725 1
1 682 . 20 1 1 A 67 67 LYS HA H 152 5.091 4.682 0.409 1
1 691 . 20 1 1 A 67 67 LYS C C 152 174.079 175.258 -1.179 1
1 692 . 20 1 1 A 67 67 LYS CA C 152 54.728 56.120 -1.392 1
1 693 . 20 1 1 A 67 67 LYS CB C 152 35.256 33.081 2.175 1
1 697 . 20 1 1 A 67 67 LYS N N 152 132.311 128.471 3.840 1
1 698 . 20 1 1 A 68 68 ALA H H 153 8.844 8.312 0.532 1
1 699 . 20 1 1 A 68 68 ALA HA H 153 5.039 5.337 -0.298 1
1 703 . 20 1 1 A 68 68 ALA C C 153 176.587 176.270 0.317 1
1 704 . 20 1 1 A 68 68 ALA CA C 153 50.484 50.625 -0.141 1
1 705 . 20 1 1 A 68 68 ALA CB C 153 20.570 21.692 -1.122 1
1 706 . 20 1 1 A 68 68 ALA N N 153 129.958 129.602 0.356 1
1 707 . 20 1 1 A 69 69 VAL H H 154 8.461 8.566 -0.105 1
1 708 . 20 1 1 A 69 69 VAL HA H 154 4.558 4.604 -0.046 1
1 716 . 20 1 1 A 69 69 VAL C C 154 175.331 175.134 0.197 1
1 717 . 20 1 1 A 69 69 VAL CA C 154 60.758 60.875 -0.117 1
1 718 . 20 1 1 A 69 69 VAL CB C 154 34.743 35.148 -0.405 1
1 721 . 20 1 1 A 69 69 VAL N N 154 121.496 121.724 -0.228 1
1 722 . 20 1 1 A 70 70 SER H H 155 8.695 8.976 -0.281 1
1 723 . 20 1 1 A 70 70 SER HA H 155 4.646 5.195 -0.549 1
1 726 . 20 1 1 A 70 70 SER C C 155 174.690 173.361 1.329 1
1 727 . 20 1 1 A 70 70 SER CA C 155 58.065 56.881 1.184 1
1 728 . 20 1 1 A 70 70 SER CB C 155 64.062 64.662 -0.600 1
1 729 . 20 1 1 A 70 70 SER N N 155 119.763 121.902 -2.139 1
1 730 . 20 1 1 A 71 71 SER H H 156 8.360 9.097 -0.737 1
1 731 . 20 1 1 A 71 71 SER HA H 156 4.430 5.461 -1.031 1
1 734 . 20 1 1 A 71 71 SER CA C 156 58.491 56.608 1.883 1
1 735 . 20 1 1 A 71 71 SER CB C 156 64.061 66.451 -2.390 1
1 736 . 20 1 1 A 71 71 SER N N 156 118.577 118.215 0.362 1
1 737 . 20 1 1 A 72 72 GLY H H 157 8.542 8.415 0.127 1
1 738 . 20 1 1 A 72 72 GLY HA2 H 157 4.002 4.177 -0.175 1
1 739 . 20 1 1 A 72 72 GLY HA3 H 157 4.002 4.179 -0.177 1
1 740 . 20 1 1 A 72 72 GLY CA C 157 45.565 44.297 1.268 1
1 741 . 20 1 1 A 72 72 GLY N N 157 111.540 113.409 -1.869 1
1 742 . 20 1 1 A 73 73 LYS H H 158 8.369 8.876 -0.507 1
1 743 . 20 1 1 A 73 73 LYS CA C 158 56.720 57.796 -1.076 1
1 744 . 20 1 1 A 73 73 LYS CB C 158 32.915 33.373 -0.458 1
1 747 . 20 1 1 A 73 73 LYS N N 158 120.293 123.833 -3.540 1
1 748 . 20 1 1 A 74 74 ARG H H 159 8.181 7.971 0.210 1
1 749 . 20 1 1 A 74 74 ARG CA C 159 56.148 57.170 -1.022 1
1 751 . 20 1 1 A 74 74 ARG N N 159 119.343 116.667 2.676 1
1 752 . 20 1 1 A 75 75 LYS H H 160 8.443 7.864 0.579 1
1 753 . 20 1 1 A 75 75 LYS HA H 160 4.067 4.652 -0.585 1
1 762 . 20 1 1 A 75 75 LYS C C 160 176.868 177.286 -0.418 1
1 763 . 20 1 1 A 75 75 LYS CA C 160 57.711 55.309 2.402 1
1 764 . 20 1 1 A 75 75 LYS CB C 160 31.777 32.913 -1.136 1
1 768 . 20 1 1 A 75 75 LYS N N 160 120.467 114.592 5.875 1
1 769 . 20 1 1 A 76 76 GLU H H 161 8.693 8.198 0.495 1
1 770 . 20 1 1 A 76 76 GLU HA H 161 4.290 3.996 0.294 1
1 771 . 20 1 1 A 76 76 GLU C C 161 176.844 176.203 0.641 1
1 772 . 20 1 1 A 76 76 GLU CA C 161 57.294 59.563 -2.269 1
1 773 . 20 1 1 A 76 76 GLU CB C 161 29.794 30.477 -0.683 1
1 775 . 20 1 1 A 76 76 GLU N N 161 118.767 119.899 -1.132 1
1 776 . 20 1 1 A 77 77 GLY H H 162 8.168 7.793 0.375 1
1 777 . 20 1 1 A 77 77 GLY HA2 H 162 4.010 4.246 -0.236 1
1 778 . 20 1 1 A 77 77 GLY HA3 H 162 3.963 4.252 -0.289 1
1 779 . 20 1 1 A 77 77 GLY C C 162 173.512 171.747 1.765 1
1 780 . 20 1 1 A 77 77 GLY CA C 162 45.362 44.592 0.770 1
1 781 . 20 1 1 A 77 77 GLY N N 162 108.621 106.774 1.847 1
1 782 . 20 1 1 A 78 78 ILE H H 163 7.954 8.866 -0.912 1
1 783 . 20 1 1 A 78 78 ILE HA H 163 4.323 4.890 -0.567 1
1 793 . 20 1 1 A 78 78 ILE C C 163 175.402 175.183 0.219 1
1 794 . 20 1 1 A 78 78 ILE CA C 163 60.632 59.385 1.247 1
1 795 . 20 1 1 A 78 78 ILE CB C 163 39.759 40.966 -1.207 1
1 799 . 20 1 1 A 78 78 ILE N N 163 121.604 125.427 -3.823 1
1 800 . 20 1 1 A 79 79 ILE H H 164 8.514 8.753 -0.239 1
1 801 . 20 1 1 A 79 79 ILE HA H 164 4.341 4.865 -0.524 1
1 811 . 20 1 1 A 79 79 ILE C C 164 175.172 174.566 0.606 1
1 812 . 20 1 1 A 79 79 ILE CA C 164 60.027 59.987 0.040 1
1 813 . 20 1 1 A 79 79 ILE CB C 164 40.153 41.232 -1.079 1
1 817 . 20 1 1 A 79 79 ILE N N 164 127.137 125.862 1.275 1
1 818 . 20 1 1 A 80 80 HIS H H 165 8.492 9.147 -0.655 1
1 819 . 20 1 1 A 80 80 HIS HA H 165 5.676 5.350 0.326 1
1 824 . 20 1 1 A 80 80 HIS C C 165 175.502 174.347 1.155 1
1 825 . 20 1 1 A 80 80 HIS CA C 165 57.043 54.734 2.309 1
1 826 . 20 1 1 A 80 80 HIS CB C 165 32.741 32.177 0.564 1
1 829 . 20 1 1 A 80 80 HIS N N 165 125.422 126.289 -0.867 1
1 830 . 20 1 1 A 81 81 THR H H 166 9.080 9.497 -0.417 1
1 831 . 20 1 1 A 81 81 THR HA H 166 4.999 4.997 0.002 1
1 836 . 20 1 1 A 81 81 THR C C 166 171.877 173.545 -1.668 1
1 837 . 20 1 1 A 81 81 THR CA C 166 59.924 61.146 -1.222 1
1 838 . 20 1 1 A 81 81 THR CB C 166 72.243 70.656 1.587 1
1 840 . 20 1 1 A 81 81 THR N N 166 117.682 116.519 1.163 1
1 841 . 20 1 1 A 82 82 LEU H H 167 8.062 8.257 -0.195 1
1 842 . 20 1 1 A 82 82 LEU HA H 167 4.350 3.967 0.383 1
1 852 . 20 1 1 A 82 82 LEU C C 167 172.705 175.046 -2.341 1
1 853 . 20 1 1 A 82 82 LEU CA C 167 53.553 55.582 -2.029 1
1 854 . 20 1 1 A 82 82 LEU CB C 167 39.768 41.369 -1.601 1
1 858 . 20 1 1 A 82 82 LEU N N 167 125.369 128.491 -3.122 1
1 859 . 20 1 1 A 83 83 ILE H H 168 8.657 8.278 0.379 1
1 860 . 20 1 1 A 83 83 ILE HA H 168 4.476 4.806 -0.330 1
1 870 . 20 1 1 A 83 83 ILE C C 168 175.159 174.268 0.891 1
1 871 . 20 1 1 A 83 83 ILE CA C 168 58.529 60.056 -1.527 1
1 872 . 20 1 1 A 83 83 ILE CB C 168 37.410 39.697 -2.287 1
1 876 . 20 1 1 A 83 83 ILE N N 168 128.042 127.620 0.422 1
1 877 . 20 1 1 A 84 84 VAL H H 169 8.464 8.308 0.156 1
1 878 . 20 1 1 A 84 84 VAL HA H 169 4.284 4.539 -0.255 1
1 886 . 20 1 1 A 84 84 VAL C C 169 176.138 176.038 0.100 1
1 887 . 20 1 1 A 84 84 VAL CA C 169 61.029 61.075 -0.046 1
1 888 . 20 1 1 A 84 84 VAL CB C 169 34.714 33.539 1.175 1
1 891 . 20 1 1 A 84 84 VAL N N 169 124.644 127.327 -2.683 1
1 892 . 20 1 1 A 85 85 ASP H H 170 9.158 9.149 0.009 1
1 893 . 20 1 1 A 85 85 ASP HA H 170 4.362 4.285 0.077 1
1 896 . 20 1 1 A 85 85 ASP C C 170 175.489 175.344 0.145 1
1 897 . 20 1 1 A 85 85 ASP CA C 170 55.868 55.173 0.695 1
1 898 . 20 1 1 A 85 85 ASP CB C 170 38.927 39.466 -0.539 1
1 899 . 20 1 1 A 85 85 ASP N N 170 129.061 127.298 1.763 1
1 900 . 20 1 1 A 86 86 ASN H H 171 8.811 8.424 0.387 1
1 901 . 20 1 1 A 86 86 ASN HA H 171 4.053 4.369 -0.316 1
1 906 . 20 1 1 A 86 86 ASN C C 171 173.802 173.940 -0.138 1
1 907 . 20 1 1 A 86 86 ASN CA C 171 55.173 54.300 0.873 1
1 908 . 20 1 1 A 86 86 ASN CB C 171 38.150 37.404 0.746 1
1 909 . 20 1 1 A 86 86 ASN N N 171 108.418 114.900 -6.482 1
1 911 . 20 1 1 A 87 87 ARG H H 172 7.914 7.573 0.341 1
1 912 . 20 1 1 A 87 87 ARG HA H 172 4.597 4.701 -0.104 1
1 919 . 20 1 1 A 87 87 ARG C C 172 174.025 174.744 -0.719 1
1 920 . 20 1 1 A 87 87 ARG CA C 172 54.846 54.168 0.678 1
1 921 . 20 1 1 A 87 87 ARG CB C 172 32.697 33.134 -0.437 1
1 924 . 20 1 1 A 87 87 ARG N N 172 120.988 117.317 3.671 1
1 925 . 20 1 1 A 88 88 GLU H H 173 8.534 8.791 -0.257 1
1 926 . 20 1 1 A 88 88 GLU HA H 173 4.560 4.370 0.190 1
1 931 . 20 1 1 A 88 88 GLU C C 173 176.187 175.450 0.737 1
1 932 . 20 1 1 A 88 88 GLU CA C 173 56.044 56.883 -0.839 1
1 933 . 20 1 1 A 88 88 GLU CB C 173 30.329 30.445 -0.116 1
1 935 . 20 1 1 A 88 88 GLU N N 173 123.982 124.699 -0.717 1
1 936 . 20 1 1 A 89 89 ILE H H 174 8.897 8.020 0.877 1
1 937 . 20 1 1 A 89 89 ILE HA H 174 4.666 4.608 0.058 1
1 947 . 20 1 1 A 89 89 ILE C C 174 174.110 174.131 -0.021 1
1 948 . 20 1 1 A 89 89 ILE CA C 174 55.255 57.402 -2.147 1
1 949 . 20 1 1 A 89 89 ILE CB C 174 37.851 41.720 -3.869 1
1 953 . 20 1 1 A 89 89 ILE N N 174 130.008 127.403 2.605 1
1 954 . 20 1 1 A 90 90 PRO HA H 175 4.713 4.821 -0.108 1
1 961 . 20 1 1 A 90 90 PRO C C 175 176.956 176.462 0.494 1
1 962 . 20 1 1 A 90 90 PRO CA C 175 63.159 63.008 0.151 1
1 963 . 20 1 1 A 90 90 PRO CB C 175 32.428 32.286 0.142 1
1 966 . 20 1 1 A 91 91 GLU H H 176 8.778 8.738 0.040 1
1 967 . 20 1 1 A 91 91 GLU HA H 176 3.910 4.264 -0.354 1
1 972 . 20 1 1 A 91 91 GLU C C 176 176.426 175.935 0.491 1
1 973 . 20 1 1 A 91 91 GLU CA C 176 56.738 55.637 1.101 1
1 974 . 20 1 1 A 91 91 GLU CB C 176 30.540 30.806 -0.266 1
1 976 . 20 1 1 A 91 91 GLU N N 176 124.561 121.992 2.569 1
1 977 . 20 1 1 A 92 92 LEU H H 177 8.630 8.296 0.334 1
1 978 . 20 1 1 A 92 92 LEU HA H 177 4.419 4.402 0.017 1
1 988 . 20 1 1 A 92 92 LEU C C 177 177.162 177.293 -0.131 1
1 989 . 20 1 1 A 92 92 LEU CA C 177 55.350 54.541 0.809 1
1 990 . 20 1 1 A 92 92 LEU CB C 177 42.390 40.870 1.520 1
1 994 . 20 1 1 A 92 92 LEU N N 177 126.683 124.927 1.756 1
1 995 . 20 1 1 A 93 93 THR H H 178 8.375 8.413 -0.038 1
1 996 . 20 1 1 A 93 93 THR HA H 178 4.359 4.709 -0.350 1
1 1001 . 20 1 1 A 93 93 THR C C 178 173.589 175.252 -1.663 1
1 1002 . 20 1 1 A 93 93 THR CA C 178 61.621 60.737 0.884 1
1 1003 . 20 1 1 A 93 93 THR CB C 178 69.724 68.588 1.136 1
1 1005 . 20 1 1 A 93 93 THR N N 178 119.699 114.178 5.521 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 80 1.010 1
2 1 1 1 "RMS(OBS, PRED)" CA 85 1.293 1
3 1 1 1 "RMS(OBS, PRED)" CB 75 1.735 1
4 1 1 1 "RMS(OBS, PRED)" H 84 0.471 1
5 1 1 1 "RMS(OBS, PRED)" HA 87 0.416 1
6 1 1 1 "RMS(OBS, PRED)" N 84 2.821 1
7 1 2 1 "RMS(OBS, PRED)" C 80 1.020 1
8 1 2 1 "RMS(OBS, PRED)" CA 85 1.146 1
9 1 2 1 "RMS(OBS, PRED)" CB 75 1.720 1
10 1 2 1 "RMS(OBS, PRED)" H 84 0.471 1
11 1 2 1 "RMS(OBS, PRED)" HA 87 0.424 1
12 1 2 1 "RMS(OBS, PRED)" N 84 2.877 1
13 1 3 1 "RMS(OBS, PRED)" C 80 1.036 1
14 1 3 1 "RMS(OBS, PRED)" CA 85 1.184 1
15 1 3 1 "RMS(OBS, PRED)" CB 75 1.820 1
16 1 3 1 "RMS(OBS, PRED)" H 84 0.512 1
17 1 3 1 "RMS(OBS, PRED)" HA 87 0.405 1
18 1 3 1 "RMS(OBS, PRED)" N 84 3.072 1
19 1 4 1 "RMS(OBS, PRED)" C 80 1.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 85 1.222 1
21 1 4 1 "RMS(OBS, PRED)" CB 75 1.861 1
22 1 4 1 "RMS(OBS, PRED)" H 84 0.477 1
23 1 4 1 "RMS(OBS, PRED)" HA 87 0.400 1
24 1 4 1 "RMS(OBS, PRED)" N 84 2.558 1
25 1 5 1 "RMS(OBS, PRED)" C 80 0.970 1
26 1 5 1 "RMS(OBS, PRED)" CA 85 1.196 1
27 1 5 1 "RMS(OBS, PRED)" CB 75 1.776 1
28 1 5 1 "RMS(OBS, PRED)" H 84 0.468 1
29 1 5 1 "RMS(OBS, PRED)" HA 87 0.376 1
30 1 5 1 "RMS(OBS, PRED)" N 84 2.759 1
31 1 6 1 "RMS(OBS, PRED)" C 80 0.988 1
32 1 6 1 "RMS(OBS, PRED)" CA 85 1.110 1
33 1 6 1 "RMS(OBS, PRED)" CB 75 1.726 1
34 1 6 1 "RMS(OBS, PRED)" H 84 0.495 1
35 1 6 1 "RMS(OBS, PRED)" HA 87 0.425 1
36 1 6 1 "RMS(OBS, PRED)" N 84 3.023 1
37 1 7 1 "RMS(OBS, PRED)" C 80 1.003 1
38 1 7 1 "RMS(OBS, PRED)" CA 85 1.179 1
39 1 7 1 "RMS(OBS, PRED)" CB 75 1.689 1
40 1 7 1 "RMS(OBS, PRED)" H 84 0.459 1
41 1 7 1 "RMS(OBS, PRED)" HA 87 0.391 1
42 1 7 1 "RMS(OBS, PRED)" N 84 2.548 1
43 1 8 1 "RMS(OBS, PRED)" C 80 1.052 1
44 1 8 1 "RMS(OBS, PRED)" CA 85 1.177 1
45 1 8 1 "RMS(OBS, PRED)" CB 75 1.757 1
46 1 8 1 "RMS(OBS, PRED)" H 84 0.467 1
47 1 8 1 "RMS(OBS, PRED)" HA 87 0.431 1
48 1 8 1 "RMS(OBS, PRED)" N 84 2.740 1
49 1 9 1 "RMS(OBS, PRED)" C 80 1.040 1
50 1 9 1 "RMS(OBS, PRED)" CA 85 1.180 1
51 1 9 1 "RMS(OBS, PRED)" CB 75 1.773 1
52 1 9 1 "RMS(OBS, PRED)" H 84 0.513 1
53 1 9 1 "RMS(OBS, PRED)" HA 87 0.404 1
54 1 9 1 "RMS(OBS, PRED)" N 84 2.887 1
55 1 10 1 "RMS(OBS, PRED)" C 80 0.960 1
56 1 10 1 "RMS(OBS, PRED)" CA 85 1.192 1
57 1 10 1 "RMS(OBS, PRED)" CB 75 1.745 1
58 1 10 1 "RMS(OBS, PRED)" H 84 0.507 1
59 1 10 1 "RMS(OBS, PRED)" HA 87 0.460 1
60 1 10 1 "RMS(OBS, PRED)" N 84 2.925 1
61 1 11 1 "RMS(OBS, PRED)" C 80 0.918 1
62 1 11 1 "RMS(OBS, PRED)" CA 85 1.246 1
63 1 11 1 "RMS(OBS, PRED)" CB 75 1.729 1
64 1 11 1 "RMS(OBS, PRED)" H 84 0.463 1
65 1 11 1 "RMS(OBS, PRED)" HA 87 0.414 1
66 1 11 1 "RMS(OBS, PRED)" N 84 2.564 1
67 1 12 1 "RMS(OBS, PRED)" C 80 0.934 1
68 1 12 1 "RMS(OBS, PRED)" CA 85 1.187 1
69 1 12 1 "RMS(OBS, PRED)" CB 75 1.730 1
70 1 12 1 "RMS(OBS, PRED)" H 84 0.495 1
71 1 12 1 "RMS(OBS, PRED)" HA 87 0.429 1
72 1 12 1 "RMS(OBS, PRED)" N 84 2.692 1
73 1 13 1 "RMS(OBS, PRED)" C 80 0.929 1
74 1 13 1 "RMS(OBS, PRED)" CA 85 1.156 1
75 1 13 1 "RMS(OBS, PRED)" CB 75 1.683 1
76 1 13 1 "RMS(OBS, PRED)" H 84 0.456 1
77 1 13 1 "RMS(OBS, PRED)" HA 87 0.410 1
78 1 13 1 "RMS(OBS, PRED)" N 84 2.487 1
79 1 14 1 "RMS(OBS, PRED)" C 80 1.005 1
80 1 14 1 "RMS(OBS, PRED)" CA 85 1.275 1
81 1 14 1 "RMS(OBS, PRED)" CB 75 1.737 1
82 1 14 1 "RMS(OBS, PRED)" H 84 0.500 1
83 1 14 1 "RMS(OBS, PRED)" HA 87 0.427 1
84 1 14 1 "RMS(OBS, PRED)" N 84 3.398 1
85 1 15 1 "RMS(OBS, PRED)" C 80 0.950 1
86 1 15 1 "RMS(OBS, PRED)" CA 85 1.274 1
87 1 15 1 "RMS(OBS, PRED)" CB 75 1.730 1
88 1 15 1 "RMS(OBS, PRED)" H 84 0.468 1
89 1 15 1 "RMS(OBS, PRED)" HA 87 0.422 1
90 1 15 1 "RMS(OBS, PRED)" N 84 2.623 1
91 1 16 1 "RMS(OBS, PRED)" C 80 0.986 1
92 1 16 1 "RMS(OBS, PRED)" CA 85 1.223 1
93 1 16 1 "RMS(OBS, PRED)" CB 75 1.712 1
94 1 16 1 "RMS(OBS, PRED)" H 84 0.514 1
95 1 16 1 "RMS(OBS, PRED)" HA 87 0.433 1
96 1 16 1 "RMS(OBS, PRED)" N 84 3.003 1
97 1 17 1 "RMS(OBS, PRED)" C 80 1.039 1
98 1 17 1 "RMS(OBS, PRED)" CA 85 1.244 1
99 1 17 1 "RMS(OBS, PRED)" CB 75 1.625 1
100 1 17 1 "RMS(OBS, PRED)" H 84 0.492 1
101 1 17 1 "RMS(OBS, PRED)" HA 87 0.450 1
102 1 17 1 "RMS(OBS, PRED)" N 84 2.999 1
103 1 18 1 "RMS(OBS, PRED)" C 80 0.923 1
104 1 18 1 "RMS(OBS, PRED)" CA 85 1.283 1
105 1 18 1 "RMS(OBS, PRED)" CB 75 1.819 1
106 1 18 1 "RMS(OBS, PRED)" H 84 0.463 1
107 1 18 1 "RMS(OBS, PRED)" HA 87 0.427 1
108 1 18 1 "RMS(OBS, PRED)" N 84 3.055 1
109 1 19 1 "RMS(OBS, PRED)" C 80 1.014 1
110 1 19 1 "RMS(OBS, PRED)" CA 85 1.159 1
111 1 19 1 "RMS(OBS, PRED)" CB 75 1.783 1
112 1 19 1 "RMS(OBS, PRED)" H 84 0.467 1
113 1 19 1 "RMS(OBS, PRED)" HA 87 0.424 1
114 1 19 1 "RMS(OBS, PRED)" N 84 2.923 1
115 1 20 1 "RMS(OBS, PRED)" C 80 0.940 1
116 1 20 1 "RMS(OBS, PRED)" CA 85 1.288 1
117 1 20 1 "RMS(OBS, PRED)" CB 75 1.649 1
118 1 20 1 "RMS(OBS, PRED)" H 84 0.501 1
119 1 20 1 "RMS(OBS, PRED)" HA 87 0.417 1
120 1 20 1 "RMS(OBS, PRED)" N 84 2.764 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 1 . 1 1 A 9 9 SER H H 94 8.475 8.406 0.069 2
1 2 . 1 1 A 9 9 SER CA C 94 58.531 58.375 0.156 2
1 3 . 1 1 A 9 9 SER N N 94 117.432 116.236 1.196 2
1 4 . 1 1 A 10 10 LYS H H 95 8.527 8.168 0.359 2
1 5 . 1 1 A 10 10 LYS C C 95 174.594 176.333 -1.739 2
1 6 . 1 1 A 10 10 LYS CA C 95 56.603 56.426 0.177 2
1 7 . 1 1 A 10 10 LYS N N 95 123.104 122.274 0.830 2
1 8 . 1 1 A 11 11 THR H H 96 8.245 8.341 -0.096 2
1 9 . 1 1 A 11 11 THR C C 96 174.393 173.609 0.784 2
1 10 . 1 1 A 11 11 THR CA C 96 62.149 61.529 0.620 2
1 11 . 1 1 A 11 11 THR CB C 96 69.183 69.314 -0.131 2
1 13 . 1 1 A 11 11 THR N N 96 113.245 113.442 -0.197 2
1 14 . 1 1 A 12 12 THR H H 97 7.769 7.732 0.037 2
1 15 . 1 1 A 12 12 THR HA H 97 5.583 4.884 0.699 2
1 20 . 1 1 A 12 12 THR C C 97 174.726 172.244 2.482 2
1 21 . 1 1 A 12 12 THR CA C 97 59.602 60.838 -1.236 2
1 22 . 1 1 A 12 12 THR CB C 97 72.805 71.359 1.446 2
1 24 . 1 1 A 12 12 THR N N 97 113.440 113.229 0.211 2
1 25 . 1 1 A 13 13 SER H H 98 8.593 8.701 -0.108 2
1 26 . 1 1 A 13 13 SER HA H 98 4.448 5.168 -0.720 2
1 29 . 1 1 A 13 13 SER C C 98 171.426 172.799 -1.373 2
1 30 . 1 1 A 13 13 SER CA C 98 59.056 56.922 2.134 2
1 31 . 1 1 A 13 13 SER CB C 98 67.839 64.991 2.848 2
1 32 . 1 1 A 13 13 SER N N 98 119.042 121.193 -2.151 2
1 33 . 1 1 A 14 14 THR H H 99 8.155 8.115 0.040 2
1 34 . 1 1 A 14 14 THR HA H 99 5.383 5.046 0.337 2
1 39 . 1 1 A 14 14 THR C C 99 171.565 172.912 -1.347 2
1 40 . 1 1 A 14 14 THR CA C 99 61.291 60.068 1.223 2
1 41 . 1 1 A 14 14 THR CB C 99 71.654 72.052 -0.398 2
1 43 . 1 1 A 14 14 THR N N 99 118.204 115.131 3.073 2
1 44 . 1 1 A 15 15 TRP H H 100 9.637 9.108 0.529 2
1 45 . 1 1 A 15 15 TRP HA H 100 4.807 5.164 -0.357 2
1 54 . 1 1 A 15 15 TRP C C 100 174.399 175.439 -1.040 2
1 55 . 1 1 A 15 15 TRP CA C 100 58.302 55.965 2.337 2
1 56 . 1 1 A 15 15 TRP CB C 100 34.810 33.368 1.442 2
1 63 . 1 1 A 15 15 TRP N N 100 125.132 122.865 2.267 2
1 65 . 1 1 A 16 16 VAL H H 101 8.863 8.948 -0.085 2
1 66 . 1 1 A 16 16 VAL HA H 101 5.267 4.776 0.491 2
1 74 . 1 1 A 16 16 VAL C C 101 174.955 175.233 -0.278 2
1 75 . 1 1 A 16 16 VAL CA C 101 60.653 61.661 -1.008 2
1 76 . 1 1 A 16 16 VAL CB C 101 34.284 33.226 1.058 2
1 79 . 1 1 A 16 16 VAL N N 101 119.527 122.907 -3.381 2
1 80 . 1 1 A 17 17 LEU H H 102 8.961 8.921 0.040 2
1 81 . 1 1 A 17 17 LEU HA H 102 4.729 5.100 -0.371 2
1 91 . 1 1 A 17 17 LEU C C 102 173.559 175.092 -1.533 2
1 92 . 1 1 A 17 17 LEU CA C 102 55.144 53.113 2.031 2
1 93 . 1 1 A 17 17 LEU CB C 102 42.948 45.909 -2.961 2
1 97 . 1 1 A 17 17 LEU N N 102 124.280 123.845 0.435 2
1 98 . 1 1 A 18 18 ARG H H 103 8.305 8.415 -0.110 2
1 99 . 1 1 A 18 18 ARG HA H 103 5.139 4.646 0.493 2
1 106 . 1 1 A 18 18 ARG C C 103 175.347 175.229 0.118 2
1 107 . 1 1 A 18 18 ARG CA C 103 54.793 56.060 -1.267 2
1 108 . 1 1 A 18 18 ARG CB C 103 31.347 29.747 1.600 2
1 111 . 1 1 A 18 18 ARG N N 103 122.020 120.858 1.162 2
1 112 . 1 1 A 19 19 LEU H H 104 8.676 8.755 -0.079 2
1 113 . 1 1 A 19 19 LEU HA H 104 4.482 4.817 -0.335 2
1 123 . 1 1 A 19 19 LEU C C 104 175.957 175.858 0.099 2
1 124 . 1 1 A 19 19 LEU CA C 104 53.581 53.692 -0.111 2
1 125 . 1 1 A 19 19 LEU CB C 104 45.697 45.266 0.431 2
1 129 . 1 1 A 19 19 LEU N N 104 126.378 125.660 0.718 2
1 130 . 1 1 A 20 20 ASP H H 105 9.390 9.547 -0.157 2
1 131 . 1 1 A 20 20 ASP HA H 105 4.287 4.383 -0.096 2
1 134 . 1 1 A 20 20 ASP C C 105 175.947 175.642 0.305 2
1 135 . 1 1 A 20 20 ASP CA C 105 55.263 55.210 0.053 2
1 136 . 1 1 A 20 20 ASP CB C 105 39.239 39.633 -0.394 2
1 137 . 1 1 A 20 20 ASP N N 105 125.208 125.911 -0.703 2
1 138 . 1 1 A 21 21 GLY H H 106 8.563 8.644 -0.081 2
1 139 . 1 1 A 21 21 GLY HA2 H 106 4.126 3.840 0.286 2
1 140 . 1 1 A 21 21 GLY HA3 H 106 3.509 3.844 -0.335 2
1 141 . 1 1 A 21 21 GLY C C 106 173.164 173.647 -0.483 2
1 142 . 1 1 A 21 21 GLY CA C 106 45.499 45.508 -0.008 2
1 143 . 1 1 A 21 21 GLY N N 106 103.331 104.460 -1.129 2
1 144 . 1 1 A 22 22 GLU H H 107 7.713 7.942 -0.229 2
1 145 . 1 1 A 22 22 GLU HA H 107 4.634 4.912 -0.278 2
1 150 . 1 1 A 22 22 GLU C C 107 174.800 174.996 -0.196 2
1 151 . 1 1 A 22 22 GLU CA C 107 54.329 54.414 -0.085 2
1 152 . 1 1 A 22 22 GLU CB C 107 32.832 33.816 -0.984 2
1 154 . 1 1 A 22 22 GLU N N 107 119.470 118.881 0.589 2
1 155 . 1 1 A 23 23 ASP H H 108 8.632 8.540 0.092 2
1 156 . 1 1 A 23 23 ASP HA H 108 4.872 4.713 0.159 2
1 159 . 1 1 A 23 23 ASP C C 108 175.533 175.504 0.029 2
1 160 . 1 1 A 23 23 ASP CA C 108 55.180 53.879 1.301 2
1 161 . 1 1 A 23 23 ASP CB C 108 41.504 39.497 2.007 2
1 162 . 1 1 A 23 23 ASP N N 108 122.815 121.314 1.501 2
1 163 . 1 1 A 24 24 LEU H H 109 9.248 8.866 0.382 2
1 164 . 1 1 A 24 24 LEU HA H 109 4.836 4.579 0.258 2
1 174 . 1 1 A 24 24 LEU C C 109 174.322 175.792 -1.470 2
1 175 . 1 1 A 24 24 LEU CA C 109 54.473 55.257 -0.784 2
1 176 . 1 1 A 24 24 LEU CB C 109 44.718 42.700 2.018 2
1 180 . 1 1 A 24 24 LEU N N 109 125.550 126.775 -1.225 2
1 181 . 1 1 A 25 25 ARG H H 110 8.503 8.720 -0.217 2
1 182 . 1 1 A 25 25 ARG HA H 110 5.228 4.910 0.318 2
1 189 . 1 1 A 25 25 ARG C C 110 175.174 174.656 0.518 2
1 190 . 1 1 A 25 25 ARG CA C 110 54.745 54.797 -0.052 2
1 191 . 1 1 A 25 25 ARG CB C 110 31.701 31.915 -0.214 2
1 194 . 1 1 A 25 25 ARG N N 110 125.424 127.864 -2.440 2
1 195 . 1 1 A 26 26 VAL H H 111 9.692 9.149 0.543 2
1 196 . 1 1 A 26 26 VAL HA H 111 5.091 5.034 0.057 2
1 204 . 1 1 A 26 26 VAL C C 111 174.446 175.348 -0.902 2
1 205 . 1 1 A 26 26 VAL CA C 111 61.055 61.692 -0.637 2
1 206 . 1 1 A 26 26 VAL CB C 111 33.780 33.476 0.304 2
1 209 . 1 1 A 26 26 VAL N N 111 130.649 127.290 3.359 2
1 210 . 1 1 A 27 27 VAL H H 112 9.401 8.998 0.403 2
1 211 . 1 1 A 27 27 VAL HA H 112 5.188 4.844 0.344 2
1 219 . 1 1 A 27 27 VAL C C 112 174.214 174.356 -0.142 2
1 220 . 1 1 A 27 27 VAL CA C 112 60.722 60.787 -0.065 2
1 221 . 1 1 A 27 27 VAL CB C 112 36.082 35.393 0.689 2
1 224 . 1 1 A 27 27 VAL N N 112 127.416 127.157 0.259 2
1 225 . 1 1 A 28 28 LEU H H 113 9.265 9.154 0.111 2
1 226 . 1 1 A 28 28 LEU HA H 113 5.337 5.305 0.032 2
1 236 . 1 1 A 28 28 LEU C C 113 175.915 174.924 0.991 2
1 237 . 1 1 A 28 28 LEU CA C 113 52.599 53.484 -0.885 2
1 238 . 1 1 A 28 28 LEU CB C 113 47.495 44.705 2.790 2
1 242 . 1 1 A 28 28 LEU N N 113 127.527 129.259 -1.732 2
1 243 . 1 1 A 29 29 GLU H H 114 8.968 8.581 0.387 2
1 244 . 1 1 A 29 29 GLU HA H 114 4.701 4.378 0.323 2
1 249 . 1 1 A 29 29 GLU C C 114 176.715 177.555 -0.840 2
1 250 . 1 1 A 29 29 GLU CA C 114 55.342 56.370 -1.028 2
1 251 . 1 1 A 29 29 GLU CB C 114 30.005 30.499 -0.494 2
1 253 . 1 1 A 29 29 GLU N N 114 127.374 127.382 -0.008 2
1 254 . 1 1 A 30 30 LYS H H 115 8.243 8.529 -0.286 2
1 255 . 1 1 A 30 30 LYS HA H 115 3.711 4.133 -0.422 2
1 264 . 1 1 A 30 30 LYS C C 115 177.137 178.155 -1.018 2
1 265 . 1 1 A 30 30 LYS CA C 115 60.118 58.768 1.350 2
1 266 . 1 1 A 30 30 LYS CB C 115 32.656 32.127 0.529 2
1 270 . 1 1 A 30 30 LYS N N 115 124.225 125.523 -1.298 2
1 271 . 1 1 A 31 31 ASP H H 116 9.200 8.062 1.137 2
1 272 . 1 1 A 31 31 ASP HA H 116 4.444 4.423 0.021 2
1 275 . 1 1 A 31 31 ASP C C 116 177.774 177.278 0.496 2
1 276 . 1 1 A 31 31 ASP CA C 116 56.703 57.391 -0.688 2
1 277 . 1 1 A 31 31 ASP CB C 116 40.236 40.841 -0.605 2
1 278 . 1 1 A 31 31 ASP N N 116 115.955 119.849 -3.894 2
1 279 . 1 1 A 32 32 THR H H 117 7.352 7.507 -0.155 2
1 280 . 1 1 A 32 32 THR HA H 117 4.266 4.603 -0.337 2
1 285 . 1 1 A 32 32 THR C C 117 175.320 174.025 1.295 2
1 286 . 1 1 A 32 32 THR CA C 117 61.171 60.910 0.261 2
1 287 . 1 1 A 32 32 THR CB C 117 70.221 69.367 0.854 2
1 289 . 1 1 A 32 32 THR N N 117 106.440 107.919 -1.479 2
1 290 . 1 1 A 33 33 MET H H 118 8.216 7.926 0.290 2
1 291 . 1 1 A 33 33 MET HA H 118 4.184 4.321 -0.137 2
1 299 . 1 1 A 33 33 MET C C 118 174.952 174.744 0.208 2
1 300 . 1 1 A 33 33 MET CA C 118 55.195 56.794 -1.599 2
1 301 . 1 1 A 33 33 MET CB C 118 25.900 31.404 -5.504 2
1 304 . 1 1 A 33 33 MET N N 118 115.956 117.968 -2.012 2
1 305 . 1 1 A 34 34 ASP H H 119 7.509 7.971 -0.462 2
1 306 . 1 1 A 34 34 ASP HA H 119 4.486 4.774 -0.288 2
1 309 . 1 1 A 34 34 ASP C C 119 174.375 175.516 -1.141 2
1 310 . 1 1 A 34 34 ASP CA C 119 54.745 54.275 0.470 2
1 311 . 1 1 A 34 34 ASP CB C 119 42.865 42.040 0.825 2
1 312 . 1 1 A 34 34 ASP N N 119 118.500 118.900 -0.400 2
1 313 . 1 1 A 35 35 VAL H H 120 8.473 8.507 -0.034 2
1 314 . 1 1 A 35 35 VAL HA H 120 4.709 4.763 -0.054 2
1 322 . 1 1 A 35 35 VAL C C 120 173.900 174.403 -0.503 2
1 323 . 1 1 A 35 35 VAL CA C 120 60.736 61.158 -0.422 2
1 324 . 1 1 A 35 35 VAL CB C 120 34.662 33.007 1.655 2
1 327 . 1 1 A 35 35 VAL N N 120 121.116 122.390 -1.274 2
1 328 . 1 1 A 36 36 TRP H H 121 9.404 9.344 0.060 2
1 329 . 1 1 A 36 36 TRP HA H 121 5.174 5.434 -0.260 2
1 338 . 1 1 A 36 36 TRP C C 121 176.480 174.633 1.847 2
1 339 . 1 1 A 36 36 TRP CA C 121 55.070 55.194 -0.124 2
1 340 . 1 1 A 36 36 TRP CB C 121 32.179 32.567 -0.388 2
1 348 . 1 1 A 36 36 TRP N N 121 126.924 129.275 -2.351 2
1 350 . 1 1 A 37 37 CYS H H 122 9.230 8.642 0.588 2
1 351 . 1 1 A 37 37 CYS HA H 122 5.417 4.977 0.440 2
1 354 . 1 1 A 37 37 CYS C C 122 175.346 174.071 1.275 2
1 355 . 1 1 A 37 37 CYS CA C 122 57.083 57.669 -0.586 2
1 356 . 1 1 A 37 37 CYS CB C 122 28.713 29.931 -1.218 2
1 357 . 1 1 A 37 37 CYS N N 122 120.375 126.201 -5.827 2
1 358 . 1 1 A 38 38 ASN H H 123 9.817 9.029 0.788 2
1 359 . 1 1 A 38 38 ASN HA H 123 4.637 4.296 0.341 2
1 364 . 1 1 A 38 38 ASN C C 123 175.526 175.192 0.334 2
1 365 . 1 1 A 38 38 ASN CA C 123 54.023 54.395 -0.372 2
1 366 . 1 1 A 38 38 ASN CB C 123 36.581 37.121 -0.540 2
1 367 . 1 1 A 38 38 ASN N N 123 129.408 124.563 4.845 2
1 369 . 1 1 A 39 39 GLY H H 124 9.092 8.216 0.876 2
1 370 . 1 1 A 39 39 GLY HA2 H 124 4.241 3.509 0.732 2
1 371 . 1 1 A 39 39 GLY HA3 H 124 3.705 3.920 -0.215 2
1 372 . 1 1 A 39 39 GLY C C 124 173.405 173.691 -0.286 2
1 373 . 1 1 A 39 39 GLY CA C 124 45.595 46.569 -0.974 2
1 374 . 1 1 A 39 39 GLY N N 124 102.752 104.064 -1.312 2
1 375 . 1 1 A 40 40 GLN H H 125 8.006 7.357 0.649 2
1 376 . 1 1 A 40 40 GLN HA H 125 4.736 4.711 0.025 2
1 383 . 1 1 A 40 40 GLN C C 125 174.477 174.329 0.148 2
1 384 . 1 1 A 40 40 GLN CA C 125 53.747 54.643 -0.896 2
1 385 . 1 1 A 40 40 GLN CB C 125 30.413 31.409 -0.996 2
1 387 . 1 1 A 40 40 GLN N N 125 120.627 119.031 1.596 2
1 389 . 1 1 A 41 41 LYS H H 126 8.757 8.503 0.254 2
1 390 . 1 1 A 41 41 LYS HA H 126 3.464 4.186 -0.722 2
1 399 . 1 1 A 41 41 LYS C C 126 176.870 175.832 1.038 2
1 400 . 1 1 A 41 41 LYS CA C 126 57.136 56.747 0.389 2
1 401 . 1 1 A 41 41 LYS CB C 126 31.669 33.060 -1.391 2
1 405 . 1 1 A 41 41 LYS N N 126 129.107 126.608 2.499 2
1 406 . 1 1 A 42 42 MET H H 127 8.682 8.572 0.110 2
1 407 . 1 1 A 42 42 MET HA H 127 4.712 4.947 -0.235 2
1 415 . 1 1 A 42 42 MET C C 127 176.816 174.799 2.017 2
1 416 . 1 1 A 42 42 MET CA C 127 52.958 54.534 -1.576 2
1 417 . 1 1 A 42 42 MET CB C 127 33.023 35.586 -2.562 2
1 420 . 1 1 A 42 42 MET N N 127 126.569 123.861 2.708 2
1 421 . 1 1 A 43 43 GLU H H 128 8.734 8.770 -0.036 2
1 422 . 1 1 A 43 43 GLU HA H 128 4.419 5.045 -0.626 2
1 427 . 1 1 A 43 43 GLU C C 128 176.531 176.540 -0.009 2
1 428 . 1 1 A 43 43 GLU CA C 128 56.475 55.137 1.338 2
1 429 . 1 1 A 43 43 GLU CB C 128 29.604 31.424 -1.820 2
1 431 . 1 1 A 43 43 GLU N N 128 123.734 120.946 2.788 2
1 432 . 1 1 A 44 44 THR H H 129 8.263 8.880 -0.617 2
1 433 . 1 1 A 44 44 THR HA H 129 5.385 5.374 0.011 2
1 438 . 1 1 A 44 44 THR C C 129 174.205 174.450 -0.245 2
1 439 . 1 1 A 44 44 THR CA C 129 59.160 60.467 -1.307 2
1 440 . 1 1 A 44 44 THR CB C 129 72.419 71.346 1.073 2
1 442 . 1 1 A 44 44 THR N N 129 115.081 117.648 -2.567 2
1 443 . 1 1 A 45 45 ALA H H 130 8.727 8.378 0.349 2
1 444 . 1 1 A 45 45 ALA HA H 130 4.749 4.502 0.247 2
1 448 . 1 1 A 45 45 ALA C C 130 177.017 178.038 -1.021 2
1 449 . 1 1 A 45 45 ALA CA C 130 51.645 52.353 -0.708 2
1 450 . 1 1 A 45 45 ALA CB C 130 21.364 20.619 0.745 2
1 451 . 1 1 A 45 45 ALA N N 130 123.243 122.906 0.337 2
1 452 . 1 1 A 46 46 GLY H H 131 8.818 8.261 0.557 2
1 453 . 1 1 A 46 46 GLY HA2 H 131 4.941 3.972 0.969 2
1 454 . 1 1 A 46 46 GLY HA3 H 131 3.690 4.009 -0.319 2
1 455 . 1 1 A 46 46 GLY C C 131 173.528 174.271 -0.743 2
1 456 . 1 1 A 46 46 GLY CA C 131 45.060 46.552 -1.492 2
1 457 . 1 1 A 46 46 GLY N N 131 112.392 107.650 4.742 2
1 458 . 1 1 A 47 47 GLU H H 132 8.746 7.970 0.776 2
1 459 . 1 1 A 47 47 GLU HA H 132 4.584 4.586 -0.002 2
1 464 . 1 1 A 47 47 GLU C C 132 175.223 175.536 -0.313 2
1 465 . 1 1 A 47 47 GLU CA C 132 55.008 55.808 -0.800 2
1 466 . 1 1 A 47 47 GLU CB C 132 32.939 31.230 1.709 2
1 468 . 1 1 A 47 47 GLU N N 132 122.107 120.808 1.299 2
1 469 . 1 1 A 48 48 PHE H H 133 8.920 8.978 -0.058 2
1 470 . 1 1 A 48 48 PHE HA H 133 4.822 5.021 -0.199 2
1 475 . 1 1 A 48 48 PHE C C 133 175.499 175.391 0.108 2
1 476 . 1 1 A 48 48 PHE CA C 133 58.320 57.227 1.093 2
1 477 . 1 1 A 48 48 PHE CB C 133 39.175 40.181 -1.006 2
1 479 . 1 1 A 48 48 PHE N N 133 124.006 124.961 -0.955 2
1 480 . 1 1 A 49 49 VAL H H 134 8.161 8.454 -0.293 2
1 481 . 1 1 A 49 49 VAL HA H 134 4.492 4.656 -0.164 2
1 489 . 1 1 A 49 49 VAL C C 134 176.241 176.709 -0.468 2
1 490 . 1 1 A 49 49 VAL CA C 134 60.328 59.722 0.606 2
1 491 . 1 1 A 49 49 VAL CB C 134 34.542 34.693 -0.151 2
1 494 . 1 1 A 49 49 VAL N N 134 120.063 120.210 -0.147 2
1 495 . 1 1 A 50 50 ASP H H 135 8.596 8.627 -0.031 2
1 496 . 1 1 A 50 50 ASP HA H 135 4.278 4.388 -0.110 2
1 499 . 1 1 A 50 50 ASP C C 135 176.567 176.420 0.147 2
1 500 . 1 1 A 50 50 ASP CA C 135 57.149 56.964 0.185 2
1 501 . 1 1 A 50 50 ASP CB C 135 40.477 40.779 -0.302 2
1 502 . 1 1 A 50 50 ASP N N 135 122.137 121.724 0.413 2
1 503 . 1 1 A 51 51 ASP H H 136 8.328 7.806 0.522 2
1 504 . 1 1 A 51 51 ASP HA H 136 4.656 5.021 -0.364 2
1 507 . 1 1 A 51 51 ASP C C 136 175.798 175.195 0.603 2
1 508 . 1 1 A 51 51 ASP CA C 136 53.458 53.797 -0.339 2
1 509 . 1 1 A 51 51 ASP CB C 136 40.306 42.459 -2.153 2
1 510 . 1 1 A 51 51 ASP N N 136 116.158 116.310 -0.152 2
1 511 . 1 1 A 52 52 GLY H H 137 7.653 8.198 -0.545 2
1 512 . 1 1 A 52 52 GLY HA2 H 137 4.685 4.074 0.611 2
1 513 . 1 1 A 52 52 GLY HA3 H 137 4.069 4.090 -0.021 2
1 514 . 1 1 A 52 52 GLY C C 137 173.149 172.580 0.569 2
1 515 . 1 1 A 52 52 GLY CA C 137 45.860 44.319 1.541 2
1 516 . 1 1 A 52 52 GLY N N 137 107.634 109.709 -2.075 2
1 517 . 1 1 A 53 53 THR H H 138 8.445 8.091 0.354 2
1 518 . 1 1 A 53 53 THR HA H 138 4.996 4.978 0.018 2
1 523 . 1 1 A 53 53 THR C C 138 174.163 173.214 0.949 2
1 524 . 1 1 A 53 53 THR CA C 138 60.974 61.481 -0.507 2
1 525 . 1 1 A 53 53 THR CB C 138 72.266 71.885 0.381 2
1 527 . 1 1 A 53 53 THR N N 138 114.976 114.839 0.137 2
1 528 . 1 1 A 54 54 GLU H H 139 8.917 8.779 0.138 2
1 529 . 1 1 A 54 54 GLU HA H 139 5.205 4.704 0.501 2
1 534 . 1 1 A 54 54 GLU C C 139 175.700 175.109 0.591 2
1 535 . 1 1 A 54 54 GLU CA C 139 54.731 55.355 -0.624 2
1 536 . 1 1 A 54 54 GLU CB C 139 33.250 30.157 3.093 2
1 538 . 1 1 A 54 54 GLU N N 139 121.295 126.127 -4.832 2
1 539 . 1 1 A 55 55 THR H H 140 9.190 8.466 0.725 2
1 540 . 1 1 A 55 55 THR HA H 140 4.744 4.604 0.140 2
1 545 . 1 1 A 55 55 THR C C 140 174.537 173.635 0.902 2
1 546 . 1 1 A 55 55 THR CA C 140 62.678 61.857 0.821 2
1 547 . 1 1 A 55 55 THR CB C 140 69.744 68.983 0.761 2
1 549 . 1 1 A 55 55 THR N N 140 122.419 120.885 1.534 2
1 550 . 1 1 A 56 56 HIS H H 141 9.395 9.026 0.369 2
1 551 . 1 1 A 56 56 HIS HA H 141 5.204 5.001 0.203 2
1 556 . 1 1 A 56 56 HIS C C 141 174.675 174.754 -0.078 2
1 557 . 1 1 A 56 56 HIS CA C 141 55.557 53.971 1.586 2
1 558 . 1 1 A 56 56 HIS CB C 141 31.279 30.662 0.617 2
1 561 . 1 1 A 56 56 HIS N N 141 125.732 125.506 0.226 2
1 564 . 1 1 A 57 57 PHE H H 142 8.790 8.189 0.601 2
1 565 . 1 1 A 57 57 PHE HA H 142 4.918 5.912 -0.994 2
1 571 . 1 1 A 57 57 PHE C C 142 172.293 173.639 -1.346 2
1 572 . 1 1 A 57 57 PHE CA C 142 56.366 55.297 1.069 2
1 573 . 1 1 A 57 57 PHE CB C 142 39.962 42.389 -2.427 2
1 575 . 1 1 A 57 57 PHE N N 142 117.009 121.517 -4.508 2
1 576 . 1 1 A 58 58 SER H H 143 8.890 9.073 -0.183 2
1 577 . 1 1 A 58 58 SER HA H 143 5.286 5.204 0.082 2
1 580 . 1 1 A 58 58 SER C C 143 173.716 174.187 -0.471 2
1 581 . 1 1 A 58 58 SER CA C 143 57.517 57.062 0.455 2
1 582 . 1 1 A 58 58 SER CB C 143 65.448 65.337 0.111 2
1 583 . 1 1 A 58 58 SER N N 143 115.269 115.607 -0.338 2
1 584 . 1 1 A 59 59 VAL H H 144 7.737 8.695 -0.958 2
1 585 . 1 1 A 59 59 VAL HA H 144 4.220 4.451 -0.231 2
1 593 . 1 1 A 59 59 VAL C C 144 176.234 176.133 0.101 2
1 594 . 1 1 A 59 59 VAL CA C 144 61.741 60.912 0.829 2
1 595 . 1 1 A 59 59 VAL CB C 144 33.711 33.689 0.022 2
1 598 . 1 1 A 59 59 VAL N N 144 123.186 122.110 1.076 2
1 599 . 1 1 A 60 60 GLY H H 145 8.945 9.055 -0.110 2
1 600 . 1 1 A 60 60 GLY HA2 H 145 4.027 3.752 0.275 2
1 601 . 1 1 A 60 60 GLY HA3 H 145 3.692 3.797 -0.105 2
1 602 . 1 1 A 60 60 GLY C C 145 175.182 174.633 0.549 2
1 603 . 1 1 A 60 60 GLY CA C 145 47.141 47.193 -0.052 2
1 604 . 1 1 A 60 60 GLY N N 145 116.908 117.861 -0.953 2
1 605 . 1 1 A 61 61 ASN H H 146 8.929 8.463 0.466 2
1 606 . 1 1 A 61 61 ASN HA H 146 4.718 4.760 -0.042 2
1 611 . 1 1 A 61 61 ASN C C 146 174.706 174.401 0.305 2
1 612 . 1 1 A 61 61 ASN CA C 146 52.802 52.782 0.020 2
1 613 . 1 1 A 61 61 ASN CB C 146 37.917 38.836 -0.919 2
1 614 . 1 1 A 61 61 ASN N N 146 123.976 123.449 0.527 2
1 616 . 1 1 A 62 62 HIS H H 147 8.400 7.627 0.773 2
1 617 . 1 1 A 62 62 HIS HA H 147 4.762 4.973 -0.211 2
1 622 . 1 1 A 62 62 HIS C C 147 173.871 173.753 0.118 2
1 623 . 1 1 A 62 62 HIS CA C 147 55.374 54.977 0.397 2
1 624 . 1 1 A 62 62 HIS CB C 147 28.655 33.289 -4.634 2
1 628 . 1 1 A 62 62 HIS N N 147 118.620 117.974 0.646 2
1 631 . 1 1 A 63 63 ASP H H 148 8.734 8.893 -0.160 2
1 632 . 1 1 A 63 63 ASP HA H 148 4.785 5.191 -0.406 2
1 635 . 1 1 A 63 63 ASP C C 148 175.269 174.865 0.404 2
1 636 . 1 1 A 63 63 ASP CA C 148 54.390 53.448 0.942 2
1 637 . 1 1 A 63 63 ASP CB C 148 42.105 42.845 -0.740 2
1 638 . 1 1 A 63 63 ASP N N 148 125.336 119.505 5.831 2
1 639 . 1 1 A 64 64 CYS H H 149 8.225 8.959 -0.734 2
1 640 . 1 1 A 64 64 CYS HA H 149 5.118 5.339 -0.221 2
1 643 . 1 1 A 64 64 CYS C C 149 173.740 172.770 0.970 2
1 644 . 1 1 A 64 64 CYS CA C 149 55.423 57.219 -1.796 2
1 645 . 1 1 A 64 64 CYS CB C 149 29.972 31.867 -1.895 2
1 646 . 1 1 A 64 64 CYS N N 149 124.476 123.218 1.258 2
1 647 . 1 1 A 65 65 TYR H H 150 8.916 8.525 0.391 2
1 648 . 1 1 A 65 65 TYR HA H 150 5.121 3.940 1.181 2
1 655 . 1 1 A 65 65 TYR C C 150 172.821 171.972 0.849 2
1 656 . 1 1 A 65 65 TYR CA C 150 56.347 55.723 0.624 2
1 657 . 1 1 A 65 65 TYR CB C 150 38.901 40.509 -1.608 2
1 662 . 1 1 A 65 65 TYR N N 150 115.313 117.570 -2.257 2
1 663 . 1 1 A 66 66 ILE H H 151 8.423 8.682 -0.259 2
1 664 . 1 1 A 66 66 ILE HA H 151 5.000 4.379 0.621 2
1 674 . 1 1 A 66 66 ILE C C 151 176.225 174.626 1.599 2
1 675 . 1 1 A 66 66 ILE CA C 151 57.798 60.040 -2.242 2
1 676 . 1 1 A 66 66 ILE CB C 151 39.863 38.780 1.083 2
1 680 . 1 1 A 66 66 ILE N N 151 118.575 121.151 -2.576 2
1 681 . 1 1 A 67 67 LYS H H 152 9.480 8.862 0.618 2
1 682 . 1 1 A 67 67 LYS HA H 152 5.091 4.703 0.388 2
1 691 . 1 1 A 67 67 LYS C C 152 174.079 175.134 -1.055 2
1 692 . 1 1 A 67 67 LYS CA C 152 54.728 56.062 -1.334 2
1 693 . 1 1 A 67 67 LYS CB C 152 35.256 33.117 2.139 2
1 697 . 1 1 A 67 67 LYS N N 152 132.311 128.512 3.799 2
1 698 . 1 1 A 68 68 ALA H H 153 8.844 8.514 0.329 2
1 699 . 1 1 A 68 68 ALA HA H 153 5.039 5.397 -0.358 2
1 703 . 1 1 A 68 68 ALA C C 153 176.587 176.361 0.226 2
1 704 . 1 1 A 68 68 ALA CA C 153 50.484 50.773 -0.289 2
1 705 . 1 1 A 68 68 ALA CB C 153 20.570 21.514 -0.944 2
1 706 . 1 1 A 68 68 ALA N N 153 129.958 129.965 -0.007 2
1 707 . 1 1 A 69 69 VAL H H 154 8.461 8.631 -0.170 2
1 708 . 1 1 A 69 69 VAL HA H 154 4.558 4.590 -0.032 2
1 716 . 1 1 A 69 69 VAL C C 154 175.331 175.093 0.238 2
1 717 . 1 1 A 69 69 VAL CA C 154 60.758 60.855 -0.097 2
1 718 . 1 1 A 69 69 VAL CB C 154 34.743 35.194 -0.451 2
1 721 . 1 1 A 69 69 VAL N N 154 121.496 122.000 -0.504 2
1 722 . 1 1 A 70 70 SER H H 155 8.695 8.967 -0.272 2
1 723 . 1 1 A 70 70 SER HA H 155 4.646 5.194 -0.548 2
1 726 . 1 1 A 70 70 SER C C 155 174.690 173.745 0.945 2
1 727 . 1 1 A 70 70 SER CA C 155 58.065 56.939 1.126 2
1 728 . 1 1 A 70 70 SER CB C 155 64.062 64.748 -0.686 2
1 729 . 1 1 A 70 70 SER N N 155 119.763 122.049 -2.286 2
1 730 . 1 1 A 71 71 SER H H 156 8.360 8.961 -0.601 2
1 731 . 1 1 A 71 71 SER HA H 156 4.430 5.266 -0.836 2
1 734 . 1 1 A 71 71 SER CA C 156 58.491 56.713 1.778 2
1 735 . 1 1 A 71 71 SER CB C 156 64.061 66.434 -2.373 2
1 736 . 1 1 A 71 71 SER N N 156 118.577 116.811 1.766 2
1 737 . 1 1 A 72 72 GLY H H 157 8.542 8.427 0.115 2
1 738 . 1 1 A 72 72 GLY HA2 H 157 4.002 4.150 -0.148 2
1 739 . 1 1 A 72 72 GLY HA3 H 157 4.002 4.152 -0.150 2
1 740 . 1 1 A 72 72 GLY CA C 157 45.565 44.525 1.040 2
1 741 . 1 1 A 72 72 GLY N N 157 111.540 110.560 0.980 2
1 742 . 1 1 A 73 73 LYS H H 158 8.369 8.592 -0.223 2
1 743 . 1 1 A 73 73 LYS CA C 158 56.720 58.221 -1.501 2
1 744 . 1 1 A 73 73 LYS CB C 158 32.915 32.905 0.010 2
1 747 . 1 1 A 73 73 LYS N N 158 120.293 121.269 -0.976 2
1 748 . 1 1 A 74 74 ARG H H 159 8.181 8.139 0.042 2
1 749 . 1 1 A 74 74 ARG CA C 159 56.148 56.497 -0.349 2
1 751 . 1 1 A 74 74 ARG N N 159 119.343 117.781 1.562 2
1 752 . 1 1 A 75 75 LYS H H 160 8.443 8.081 0.362 2
1 753 . 1 1 A 75 75 LYS HA H 160 4.067 4.347 -0.280 2
1 762 . 1 1 A 75 75 LYS C C 160 176.868 176.406 0.462 2
1 763 . 1 1 A 75 75 LYS CA C 160 57.711 56.126 1.585 2
1 764 . 1 1 A 75 75 LYS CB C 160 31.777 32.129 -0.352 2
1 768 . 1 1 A 75 75 LYS N N 160 120.467 117.356 3.111 2
1 769 . 1 1 A 76 76 GLU H H 161 8.693 8.217 0.476 2
1 770 . 1 1 A 76 76 GLU HA H 161 4.290 4.213 0.077 2
1 771 . 1 1 A 76 76 GLU C C 161 176.844 176.526 0.318 2
1 772 . 1 1 A 76 76 GLU CA C 161 57.294 58.905 -1.611 2
1 773 . 1 1 A 76 76 GLU CB C 161 29.794 30.727 -0.933 2
1 775 . 1 1 A 76 76 GLU N N 161 118.767 121.088 -2.321 2
1 776 . 1 1 A 77 77 GLY H H 162 8.168 7.803 0.365 2
1 777 . 1 1 A 77 77 GLY HA2 H 162 4.010 4.198 -0.188 2
1 778 . 1 1 A 77 77 GLY HA3 H 162 3.963 4.202 -0.239 2
1 779 . 1 1 A 77 77 GLY C C 162 173.512 171.874 1.638 2
1 780 . 1 1 A 77 77 GLY CA C 162 45.362 44.642 0.720 2
1 781 . 1 1 A 77 77 GLY N N 162 108.621 106.266 2.355 2
1 782 . 1 1 A 78 78 ILE H H 163 7.954 8.814 -0.860 2
1 783 . 1 1 A 78 78 ILE HA H 163 4.323 4.871 -0.548 2
1 793 . 1 1 A 78 78 ILE C C 163 175.402 175.163 0.239 2
1 794 . 1 1 A 78 78 ILE CA C 163 60.632 59.539 1.093 2
1 795 . 1 1 A 78 78 ILE CB C 163 39.759 41.034 -1.275 2
1 799 . 1 1 A 78 78 ILE N N 163 121.604 124.281 -2.677 2
1 800 . 1 1 A 79 79 ILE H H 164 8.514 8.776 -0.262 2
1 801 . 1 1 A 79 79 ILE HA H 164 4.341 4.811 -0.470 2
1 811 . 1 1 A 79 79 ILE C C 164 175.172 174.674 0.498 2
1 812 . 1 1 A 79 79 ILE CA C 164 60.027 59.915 0.112 2
1 813 . 1 1 A 79 79 ILE CB C 164 40.153 41.094 -0.941 2
1 817 . 1 1 A 79 79 ILE N N 164 127.137 126.080 1.057 2
1 818 . 1 1 A 80 80 HIS H H 165 8.492 8.990 -0.498 2
1 819 . 1 1 A 80 80 HIS HA H 165 5.676 5.385 0.291 2
1 824 . 1 1 A 80 80 HIS C C 165 175.502 174.400 1.102 2
1 825 . 1 1 A 80 80 HIS CA C 165 57.043 54.892 2.151 2
1 826 . 1 1 A 80 80 HIS CB C 165 32.741 32.465 0.276 2
1 829 . 1 1 A 80 80 HIS N N 165 125.422 126.216 -0.794 2
1 830 . 1 1 A 81 81 THR H H 166 9.080 9.292 -0.212 2
1 831 . 1 1 A 81 81 THR HA H 166 4.999 5.000 -0.001 2
1 836 . 1 1 A 81 81 THR C C 166 171.877 173.112 -1.235 2
1 837 . 1 1 A 81 81 THR CA C 166 59.924 61.082 -1.158 2
1 838 . 1 1 A 81 81 THR CB C 166 72.243 70.835 1.408 2
1 840 . 1 1 A 81 81 THR N N 166 117.682 115.236 2.446 2
1 841 . 1 1 A 82 82 LEU H H 167 8.062 8.024 0.038 2
1 842 . 1 1 A 82 82 LEU HA H 167 4.350 3.915 0.435 2
1 852 . 1 1 A 82 82 LEU C C 167 172.705 174.937 -2.232 2
1 853 . 1 1 A 82 82 LEU CA C 167 53.553 55.452 -1.899 2
1 854 . 1 1 A 82 82 LEU CB C 167 39.768 41.358 -1.590 2
1 858 . 1 1 A 82 82 LEU N N 167 125.369 128.198 -2.829 2
1 859 . 1 1 A 83 83 ILE H H 168 8.657 8.260 0.397 2
1 860 . 1 1 A 83 83 ILE HA H 168 4.476 4.939 -0.463 2
1 870 . 1 1 A 83 83 ILE C C 168 175.159 174.331 0.828 2
1 871 . 1 1 A 83 83 ILE CA C 168 58.529 60.042 -1.513 2
1 872 . 1 1 A 83 83 ILE CB C 168 37.410 40.443 -3.033 2
1 876 . 1 1 A 83 83 ILE N N 168 128.042 127.391 0.651 2
1 877 . 1 1 A 84 84 VAL H H 169 8.464 8.417 0.047 2
1 878 . 1 1 A 84 84 VAL HA H 169 4.284 4.433 -0.149 2
1 886 . 1 1 A 84 84 VAL C C 169 176.138 175.869 0.269 2
1 887 . 1 1 A 84 84 VAL CA C 169 61.029 61.258 -0.229 2
1 888 . 1 1 A 84 84 VAL CB C 169 34.714 33.994 0.720 2
1 891 . 1 1 A 84 84 VAL N N 169 124.644 126.909 -2.265 2
1 892 . 1 1 A 85 85 ASP H H 170 9.158 9.286 -0.128 2
1 893 . 1 1 A 85 85 ASP HA H 170 4.362 4.282 0.080 2
1 896 . 1 1 A 85 85 ASP C C 170 175.489 175.315 0.174 2
1 897 . 1 1 A 85 85 ASP CA C 170 55.868 55.232 0.636 2
1 898 . 1 1 A 85 85 ASP CB C 170 38.927 39.435 -0.508 2
1 899 . 1 1 A 85 85 ASP N N 170 129.061 127.731 1.330 2
1 900 . 1 1 A 86 86 ASN H H 171 8.811 8.434 0.377 2
1 901 . 1 1 A 86 86 ASN HA H 171 4.053 4.346 -0.293 2
1 906 . 1 1 A 86 86 ASN C C 171 173.802 173.871 -0.069 2
1 907 . 1 1 A 86 86 ASN CA C 171 55.173 54.383 0.790 2
1 908 . 1 1 A 86 86 ASN CB C 171 38.150 37.281 0.869 2
1 909 . 1 1 A 86 86 ASN N N 171 108.418 113.303 -4.885 2
1 911 . 1 1 A 87 87 ARG H H 172 7.914 7.503 0.411 2
1 912 . 1 1 A 87 87 ARG HA H 172 4.597 4.675 -0.078 2
1 919 . 1 1 A 87 87 ARG C C 172 174.025 174.817 -0.792 2
1 920 . 1 1 A 87 87 ARG CA C 172 54.846 54.200 0.646 2
1 921 . 1 1 A 87 87 ARG CB C 172 32.697 33.264 -0.567 2
1 924 . 1 1 A 87 87 ARG N N 172 120.988 117.456 3.532 2
1 925 . 1 1 A 88 88 GLU H H 173 8.534 8.737 -0.203 2
1 926 . 1 1 A 88 88 GLU HA H 173 4.560 4.342 0.218 2
1 931 . 1 1 A 88 88 GLU C C 173 176.187 175.500 0.687 2
1 932 . 1 1 A 88 88 GLU CA C 173 56.044 56.911 -0.867 2
1 933 . 1 1 A 88 88 GLU CB C 173 30.329 30.406 -0.077 2
1 935 . 1 1 A 88 88 GLU N N 173 123.982 124.611 -0.629 2
1 936 . 1 1 A 89 89 ILE H H 174 8.897 7.999 0.898 2
1 937 . 1 1 A 89 89 ILE HA H 174 4.666 4.569 0.097 2
1 947 . 1 1 A 89 89 ILE C C 174 174.110 174.142 -0.032 2
1 948 . 1 1 A 89 89 ILE CA C 174 55.255 57.354 -2.099 2
1 949 . 1 1 A 89 89 ILE CB C 174 37.851 41.620 -3.769 2
1 953 . 1 1 A 89 89 ILE N N 174 130.008 127.004 3.004 2
1 954 . 1 1 A 90 90 PRO HA H 175 4.713 4.731 -0.018 2
1 961 . 1 1 A 90 90 PRO C C 175 176.956 176.472 0.484 2
1 962 . 1 1 A 90 90 PRO CA C 175 63.159 62.935 0.223 2
1 963 . 1 1 A 90 90 PRO CB C 175 32.428 32.422 0.006 2
1 966 . 1 1 A 91 91 GLU H H 176 8.778 8.736 0.042 2
1 967 . 1 1 A 91 91 GLU HA H 176 3.910 4.699 -0.789 2
1 972 . 1 1 A 91 91 GLU C C 176 176.426 176.380 0.046 2
1 973 . 1 1 A 91 91 GLU CA C 176 56.738 55.804 0.934 2
1 974 . 1 1 A 91 91 GLU CB C 176 30.540 31.090 -0.550 2
1 976 . 1 1 A 91 91 GLU N N 176 124.561 121.918 2.643 2
1 977 . 1 1 A 92 92 LEU H H 177 8.630 8.329 0.301 2
1 978 . 1 1 A 92 92 LEU HA H 177 4.419 4.345 0.074 2
1 988 . 1 1 A 92 92 LEU C C 177 177.162 176.380 0.782 2
1 989 . 1 1 A 92 92 LEU CA C 177 55.350 56.344 -0.994 2
1 990 . 1 1 A 92 92 LEU CB C 177 42.390 41.959 0.431 2
1 994 . 1 1 A 92 92 LEU N N 177 126.683 126.955 -0.272 2
1 995 . 1 1 A 93 93 THR H H 178 8.375 8.372 0.003 2
1 996 . 1 1 A 93 93 THR HA H 178 4.359 4.553 -0.194 2
1 1001 . 1 1 A 93 93 THR C C 178 173.589 174.001 -0.412 2
1 1002 . 1 1 A 93 93 THR CA C 178 61.621 61.707 -0.086 2
1 1003 . 1 1 A 93 93 THR CB C 178 69.724 69.768 -0.044 2
1 1005 . 1 1 A 93 93 THR N N 178 119.699 114.908 4.791 2
stop_
save_