data_16148_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 16148
_Entry.PDB_ID 2KEG
_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 13 . 1 1 1 A 2 2 ARG H H 2 8.864 7.793 1.071 1
1 14 . 1 1 1 A 2 2 ARG HA H 2 4.393 4.561 -0.168 1
1 22 . 1 1 1 A 2 2 ARG CA C 2 56.327 54.781 1.546 1
1 23 . 1 1 1 A 2 2 ARG N N 2 124.285 119.062 5.223 1
1 24 . 1 1 1 A 3 3 SER H H 3 8.495 8.147 0.348 1
1 25 . 1 1 1 A 3 3 SER HA H 3 4.491 4.188 0.303 1
1 28 . 1 1 1 A 3 3 SER CB C 3 64.117 63.132 0.985 1
1 29 . 1 1 1 A 3 3 SER N N 3 117.670 113.066 4.604 1
1 30 . 1 1 1 A 4 4 ARG H H 4 8.672 8.126 0.546 1
1 31 . 1 1 1 A 4 4 ARG HA H 4 4.314 4.288 0.026 1
1 39 . 1 1 1 A 4 4 ARG CA C 4 56.779 58.202 -1.423 1
1 40 . 1 1 1 A 4 4 ARG N N 4 123.739 121.036 2.703 1
1 41 . 1 1 1 A 5 5 LYS H H 5 8.328 7.693 0.635 1
1 42 . 1 1 1 A 5 5 LYS HA H 5 4.127 4.223 -0.096 1
1 49 . 1 1 1 A 5 5 LYS CA C 5 57.431 57.156 0.275 1
1 51 . 1 1 1 A 5 5 LYS N N 5 120.706 117.463 3.243 1
1 52 . 1 1 1 A 6 6 ASN H H 6 8.115 7.958 0.157 1
1 57 . 1 1 1 A 6 6 ASN CA C 6 53.066 51.850 1.216 1
1 58 . 1 1 1 A 6 6 ASN CB C 6 39.187 38.805 0.382 1
1 59 . 1 1 1 A 6 6 ASN N N 6 117.807 116.935 0.872 1
1 60 . 1 1 1 A 7 7 GLY H H 7 8.499 8.356 0.143 1
1 61 . 1 1 1 A 7 7 GLY HA2 H 7 4.051 4.136 -0.085 1
1 62 . 1 1 1 A 7 7 GLY HA3 H 7 4.051 4.300 -0.249 1
1 63 . 1 1 1 A 7 7 GLY CA C 7 46.153 45.754 0.399 1
1 64 . 1 1 1 A 7 7 GLY N N 7 108.804 111.886 -3.082 1
1 65 . 1 1 1 A 8 8 ILE H H 8 8.496 7.868 0.628 1
1 75 . 1 1 1 A 8 8 ILE CB C 8 38.082 39.339 -1.257 1
1 76 . 1 1 1 A 8 8 ILE N N 8 121.041 122.176 -1.135 1
1 77 . 1 1 1 A 9 9 GLY H H 9 8.656 8.501 0.155 1
1 78 . 1 1 1 A 9 9 GLY HA2 H 9 3.671 3.734 -0.063 1
1 79 . 1 1 1 A 9 9 GLY HA3 H 9 3.671 3.762 -0.091 1
1 80 . 1 1 1 A 9 9 GLY CA C 9 47.324 47.175 0.149 1
1 81 . 1 1 1 A 9 9 GLY N N 9 108.767 109.448 -0.681 1
1 82 . 1 1 1 A 10 10 TYR H H 10 7.987 8.234 -0.247 1
1 83 . 1 1 1 A 10 10 TYR HA H 10 4.269 4.417 -0.148 1
1 90 . 1 1 1 A 10 10 TYR CA C 10 60.713 60.071 0.642 1
1 91 . 1 1 1 A 10 10 TYR CB C 10 38.354 37.600 0.754 1
1 92 . 1 1 1 A 10 10 TYR N N 10 121.261 120.107 1.154 1
1 93 . 1 1 1 A 11 11 ALA H H 11 8.020 7.511 0.509 1
1 94 . 1 1 1 A 11 11 ALA HA H 11 4.040 3.618 0.422 1
1 98 . 1 1 1 A 11 11 ALA CA C 11 55.355 54.662 0.693 1
1 99 . 1 1 1 A 11 11 ALA CB C 11 18.737 18.203 0.534 1
1 100 . 1 1 1 A 11 11 ALA N N 11 122.295 123.361 -1.066 1
1 101 . 1 1 1 A 12 12 ILE H H 12 8.308 7.733 0.575 1
1 102 . 1 1 1 A 12 12 ILE HA H 12 3.732 3.915 -0.183 1
1 111 . 1 1 1 A 12 12 ILE CB C 12 37.611 37.707 -0.096 1
1 112 . 1 1 1 A 12 12 ILE N N 12 116.853 118.632 -1.779 1
1 113 . 1 1 1 A 13 13 GLY H H 13 8.171 8.359 -0.188 1
1 114 . 1 1 1 A 13 13 GLY HA2 H 13 3.744 3.796 -0.052 1
1 115 . 1 1 1 A 13 13 GLY HA3 H 13 3.744 3.806 -0.062 1
1 116 . 1 1 1 A 13 13 GLY CA C 13 47.343 47.210 0.133 1
1 117 . 1 1 1 A 13 13 GLY N N 13 107.089 109.430 -2.341 1
1 118 . 1 1 1 A 14 14 TYR H H 14 8.223 8.575 -0.352 1
1 119 . 1 1 1 A 14 14 TYR HA H 14 4.147 4.134 0.013 1
1 126 . 1 1 1 A 14 14 TYR CB C 14 38.415 38.998 -0.583 1
1 127 . 1 1 1 A 14 14 TYR N N 14 122.935 123.143 -0.208 1
1 128 . 1 1 1 A 15 15 ALA H H 15 8.345 8.240 0.105 1
1 129 . 1 1 1 A 15 15 ALA HA H 15 3.986 3.923 0.063 1
1 133 . 1 1 1 A 15 15 ALA CA C 15 55.067 55.054 0.013 1
1 134 . 1 1 1 A 15 15 ALA N N 15 121.882 121.673 0.209 1
1 135 . 1 1 1 A 16 16 PHE H H 16 8.668 8.570 0.098 1
1 136 . 1 1 1 A 16 16 PHE HA H 16 4.138 4.255 -0.117 1
1 143 . 1 1 1 A 16 16 PHE CA C 16 61.116 60.948 0.168 1
1 144 . 1 1 1 A 16 16 PHE CB C 16 38.857 39.246 -0.389 1
1 145 . 1 1 1 A 16 16 PHE N N 16 116.563 119.407 -2.844 1
1 146 . 1 1 1 A 17 17 GLY H H 17 8.163 9.075 -0.912 1
1 147 . 1 1 1 A 17 17 GLY HA2 H 17 3.891 3.884 0.007 1
1 148 . 1 1 1 A 17 17 GLY HA3 H 17 3.891 3.896 -0.005 1
1 149 . 1 1 1 A 17 17 GLY N N 17 105.893 106.843 -0.950 1
1 150 . 1 1 1 A 18 18 ALA H H 18 7.842 7.715 0.127 1
1 151 . 1 1 1 A 18 18 ALA HA H 18 4.035 3.924 0.111 1
1 155 . 1 1 1 A 18 18 ALA CA C 18 55.037 54.694 0.343 1
1 156 . 1 1 1 A 18 18 ALA CB C 18 18.223 18.736 -0.513 1
1 157 . 1 1 1 A 18 18 ALA N N 18 122.050 124.615 -2.565 1
1 158 . 1 1 1 A 19 19 VAL H H 19 8.010 7.653 0.357 1
1 159 . 1 1 1 A 19 19 VAL HA H 19 3.549 3.731 -0.182 1
1 167 . 1 1 1 A 19 19 VAL CA C 19 66.571 65.054 1.517 1
1 168 . 1 1 1 A 19 19 VAL CB C 19 31.436 31.530 -0.094 1
1 171 . 1 1 1 A 19 19 VAL N N 19 118.184 116.563 1.621 1
1 172 . 1 1 1 A 20 20 GLU H H 20 8.339 8.706 -0.367 1
1 173 . 1 1 1 A 20 20 GLU HA H 20 3.666 4.047 -0.381 1
1 178 . 1 1 1 A 20 20 GLU CA C 20 60.103 59.440 0.663 1
1 180 . 1 1 1 A 20 20 GLU N N 20 118.704 120.770 -2.066 1
1 181 . 1 1 1 A 21 21 ARG H H 21 7.939 8.411 -0.472 1
1 182 . 1 1 1 A 21 21 ARG HA H 21 3.935 4.009 -0.074 1
1 190 . 1 1 1 A 21 21 ARG N N 21 116.955 120.852 -3.897 1
1 191 . 1 1 1 A 22 22 ALA H H 22 7.784 7.348 0.436 1
1 192 . 1 1 1 A 22 22 ALA HA H 22 4.166 4.045 0.121 1
1 196 . 1 1 1 A 22 22 ALA CA C 22 54.645 55.043 -0.398 1
1 197 . 1 1 1 A 22 22 ALA CB C 22 18.724 18.415 0.309 1
1 198 . 1 1 1 A 22 22 ALA N N 22 121.252 121.991 -0.739 1
1 199 . 1 1 1 A 23 23 VAL H H 23 8.086 7.751 0.335 1
1 200 . 1 1 1 A 23 23 VAL HA H 23 3.872 3.632 0.240 1
1 208 . 1 1 1 A 23 23 VAL CA C 23 64.928 66.542 -1.614 1
1 209 . 1 1 1 A 23 23 VAL CB C 23 32.451 31.710 0.741 1
1 212 . 1 1 1 A 23 23 VAL N N 23 114.516 118.282 -3.766 1
1 213 . 1 1 1 A 24 24 LEU H H 24 8.060 7.757 0.303 1
1 223 . 1 1 1 A 24 24 LEU N N 24 118.014 120.124 -2.110 1
1 224 . 1 1 1 A 25 25 GLY H H 25 7.880 8.077 -0.197 1
1 225 . 1 1 1 A 25 25 GLY HA2 H 25 3.949 3.802 0.147 1
1 226 . 1 1 1 A 25 25 GLY HA3 H 25 3.966 3.805 0.161 1
1 227 . 1 1 1 A 25 25 GLY CA C 25 45.959 47.329 -1.370 1
1 228 . 1 1 1 A 25 25 GLY N N 25 106.969 109.031 -2.062 1
1 229 . 1 1 1 A 26 26 GLY H H 26 8.123 8.090 0.033 1
1 230 . 1 1 1 A 26 26 GLY HA2 H 26 3.912 3.781 0.131 1
1 231 . 1 1 1 A 26 26 GLY HA3 H 26 4.002 3.784 0.218 1
1 232 . 1 1 1 A 26 26 GLY CA C 26 45.691 46.557 -0.866 1
1 233 . 1 1 1 A 26 26 GLY N N 26 108.223 109.029 -0.806 1
1 234 . 1 1 1 A 27 27 SER H H 27 8.201 7.864 0.337 1
1 235 . 1 1 1 A 27 27 SER HA H 27 4.353 4.675 -0.322 1
1 238 . 1 1 1 A 27 27 SER CA C 27 59.117 57.109 2.008 1
1 239 . 1 1 1 A 27 27 SER CB C 27 63.770 66.290 -2.520 1
1 240 . 1 1 1 A 27 27 SER N N 27 115.317 112.041 3.276 1
1 241 . 1 1 1 A 28 28 ARG H H 28 8.155 8.635 -0.480 1
1 242 . 1 1 1 A 28 28 ARG HA H 28 4.258 3.799 0.459 1
1 250 . 1 1 1 A 28 28 ARG CA C 28 56.348 56.787 -0.439 1
1 251 . 1 1 1 A 28 28 ARG N N 28 121.519 118.339 3.180 1
1 252 . 1 1 1 A 29 29 ASP H H 29 8.167 7.809 0.358 1
1 255 . 1 1 1 A 29 29 ASP CB C 29 38.462 41.792 -3.330 1
1 256 . 1 1 1 A 29 29 ASP N N 29 118.393 118.789 -0.396 1
1 257 . 1 1 1 A 30 30 TYR H H 30 7.910 7.612 0.298 1
1 258 . 1 1 1 A 30 30 TYR HA H 30 4.484 4.869 -0.385 1
1 265 . 1 1 1 A 30 30 TYR CA C 30 58.097 56.783 1.314 1
1 266 . 1 1 1 A 30 30 TYR CB C 30 38.759 41.381 -2.622 1
1 267 . 1 1 1 A 30 30 TYR N N 30 119.859 116.572 3.287 1
1 268 . 1 1 1 A 31 31 ASN H H 31 8.152 9.435 -1.283 1
1 269 . 1 1 1 A 31 31 ASN HA H 31 4.658 4.440 0.218 1
1 274 . 1 1 1 A 31 31 ASN CA C 31 53.245 54.093 -0.848 1
1 275 . 1 1 1 A 31 31 ASN CB C 31 39.156 37.273 1.883 1
1 276 . 1 1 1 A 31 31 ASN N N 31 119.343 120.558 -1.215 1
1 13 . 2 1 1 A 2 2 ARG H H 2 8.864 7.953 0.911 1
1 14 . 2 1 1 A 2 2 ARG HA H 2 4.393 3.971 0.422 1
1 22 . 2 1 1 A 2 2 ARG CA C 2 56.327 56.807 -0.480 1
1 23 . 2 1 1 A 2 2 ARG N N 2 124.285 115.904 8.381 1
1 24 . 2 1 1 A 3 3 SER H H 3 8.495 7.951 0.544 1
1 25 . 2 1 1 A 3 3 SER HA H 3 4.491 4.285 0.206 1
1 28 . 2 1 1 A 3 3 SER CB C 3 64.117 63.309 0.808 1
1 29 . 2 1 1 A 3 3 SER N N 3 117.670 115.174 2.496 1
1 30 . 2 1 1 A 4 4 ARG H H 4 8.672 8.834 -0.162 1
1 31 . 2 1 1 A 4 4 ARG HA H 4 4.314 4.192 0.122 1
1 39 . 2 1 1 A 4 4 ARG CA C 4 56.779 57.821 -1.042 1
1 40 . 2 1 1 A 4 4 ARG N N 4 123.739 119.206 4.533 1
1 41 . 2 1 1 A 5 5 LYS H H 5 8.328 7.874 0.454 1
1 42 . 2 1 1 A 5 5 LYS HA H 5 4.127 4.332 -0.205 1
1 49 . 2 1 1 A 5 5 LYS CA C 5 57.431 57.584 -0.153 1
1 51 . 2 1 1 A 5 5 LYS N N 5 120.706 119.160 1.546 1
1 52 . 2 1 1 A 6 6 ASN H H 6 8.115 7.445 0.670 1
1 57 . 2 1 1 A 6 6 ASN CA C 6 53.066 52.421 0.645 1
1 58 . 2 1 1 A 6 6 ASN CB C 6 39.187 36.919 2.268 1
1 59 . 2 1 1 A 6 6 ASN N N 6 117.807 116.556 1.251 1
1 60 . 2 1 1 A 7 7 GLY H H 7 8.499 7.879 0.620 1
1 61 . 2 1 1 A 7 7 GLY HA2 H 7 4.051 4.135 -0.084 1
1 62 . 2 1 1 A 7 7 GLY HA3 H 7 4.051 4.303 -0.252 1
1 63 . 2 1 1 A 7 7 GLY CA C 7 46.153 45.769 0.384 1
1 64 . 2 1 1 A 7 7 GLY N N 7 108.804 111.752 -2.948 1
1 65 . 2 1 1 A 8 8 ILE H H 8 8.496 7.849 0.647 1
1 75 . 2 1 1 A 8 8 ILE CB C 8 38.082 39.345 -1.263 1
1 76 . 2 1 1 A 8 8 ILE N N 8 121.041 122.235 -1.194 1
1 77 . 2 1 1 A 9 9 GLY H H 9 8.656 8.079 0.577 1
1 78 . 2 1 1 A 9 9 GLY HA2 H 9 3.671 3.734 -0.063 1
1 79 . 2 1 1 A 9 9 GLY HA3 H 9 3.671 3.763 -0.092 1
1 80 . 2 1 1 A 9 9 GLY CA C 9 47.324 47.177 0.147 1
1 81 . 2 1 1 A 9 9 GLY N N 9 108.767 109.453 -0.686 1
1 82 . 2 1 1 A 10 10 TYR H H 10 7.987 8.238 -0.251 1
1 83 . 2 1 1 A 10 10 TYR HA H 10 4.269 4.414 -0.145 1
1 90 . 2 1 1 A 10 10 TYR CA C 10 60.713 60.072 0.641 1
1 91 . 2 1 1 A 10 10 TYR CB C 10 38.354 37.597 0.757 1
1 92 . 2 1 1 A 10 10 TYR N N 10 121.261 120.111 1.150 1
1 93 . 2 1 1 A 11 11 ALA H H 11 8.020 7.547 0.473 1
1 94 . 2 1 1 A 11 11 ALA HA H 11 4.040 3.688 0.352 1
1 98 . 2 1 1 A 11 11 ALA CA C 11 55.355 54.681 0.674 1
1 99 . 2 1 1 A 11 11 ALA CB C 11 18.737 18.201 0.536 1
1 100 . 2 1 1 A 11 11 ALA N N 11 122.295 123.381 -1.086 1
1 101 . 2 1 1 A 12 12 ILE H H 12 8.308 7.742 0.566 1
1 102 . 2 1 1 A 12 12 ILE HA H 12 3.732 3.891 -0.159 1
1 111 . 2 1 1 A 12 12 ILE CB C 12 37.611 37.718 -0.107 1
1 112 . 2 1 1 A 12 12 ILE N N 12 116.853 118.635 -1.782 1
1 113 . 2 1 1 A 13 13 GLY H H 13 8.171 8.260 -0.089 1
1 114 . 2 1 1 A 13 13 GLY HA2 H 13 3.744 3.798 -0.054 1
1 115 . 2 1 1 A 13 13 GLY HA3 H 13 3.744 3.816 -0.072 1
1 116 . 2 1 1 A 13 13 GLY CA C 13 47.343 47.234 0.109 1
1 117 . 2 1 1 A 13 13 GLY N N 13 107.089 109.362 -2.273 1
1 118 . 2 1 1 A 14 14 TYR H H 14 8.223 8.556 -0.333 1
1 119 . 2 1 1 A 14 14 TYR HA H 14 4.147 4.126 0.021 1
1 126 . 2 1 1 A 14 14 TYR CB C 14 38.415 39.005 -0.590 1
1 127 . 2 1 1 A 14 14 TYR N N 14 122.935 123.120 -0.185 1
1 128 . 2 1 1 A 15 15 ALA H H 15 8.345 8.260 0.085 1
1 129 . 2 1 1 A 15 15 ALA HA H 15 3.986 3.593 0.393 1
1 133 . 2 1 1 A 15 15 ALA CA C 15 55.067 54.865 0.202 1
1 134 . 2 1 1 A 15 15 ALA N N 15 121.882 121.303 0.579 1
1 135 . 2 1 1 A 16 16 PHE H H 16 8.668 8.516 0.152 1
1 136 . 2 1 1 A 16 16 PHE HA H 16 4.138 4.223 -0.085 1
1 143 . 2 1 1 A 16 16 PHE CA C 16 61.116 60.923 0.193 1
1 144 . 2 1 1 A 16 16 PHE CB C 16 38.857 39.172 -0.315 1
1 145 . 2 1 1 A 16 16 PHE N N 16 116.563 119.373 -2.810 1
1 146 . 2 1 1 A 17 17 GLY H H 17 8.163 9.068 -0.905 1
1 147 . 2 1 1 A 17 17 GLY HA2 H 17 3.891 3.877 0.014 1
1 148 . 2 1 1 A 17 17 GLY HA3 H 17 3.891 3.905 -0.014 1
1 149 . 2 1 1 A 17 17 GLY N N 17 105.893 106.830 -0.937 1
1 150 . 2 1 1 A 18 18 ALA H H 18 7.842 7.862 -0.020 1
1 151 . 2 1 1 A 18 18 ALA HA H 18 4.035 3.965 0.070 1
1 155 . 2 1 1 A 18 18 ALA CA C 18 55.037 54.678 0.359 1
1 156 . 2 1 1 A 18 18 ALA CB C 18 18.223 18.739 -0.516 1
1 157 . 2 1 1 A 18 18 ALA N N 18 122.050 124.631 -2.581 1
1 158 . 2 1 1 A 19 19 VAL H H 19 8.010 7.695 0.315 1
1 159 . 2 1 1 A 19 19 VAL HA H 19 3.549 3.725 -0.176 1
1 167 . 2 1 1 A 19 19 VAL CA C 19 66.571 65.032 1.539 1
1 168 . 2 1 1 A 19 19 VAL CB C 19 31.436 31.471 -0.035 1
1 171 . 2 1 1 A 19 19 VAL N N 19 118.184 116.282 1.902 1
1 172 . 2 1 1 A 20 20 GLU H H 20 8.339 8.599 -0.260 1
1 173 . 2 1 1 A 20 20 GLU HA H 20 3.666 4.040 -0.374 1
1 178 . 2 1 1 A 20 20 GLU CA C 20 60.103 59.412 0.691 1
1 180 . 2 1 1 A 20 20 GLU N N 20 118.704 120.510 -1.806 1
1 181 . 2 1 1 A 21 21 ARG H H 21 7.939 8.305 -0.366 1
1 182 . 2 1 1 A 21 21 ARG HA H 21 3.935 4.006 -0.071 1
1 190 . 2 1 1 A 21 21 ARG N N 21 116.955 120.837 -3.882 1
1 191 . 2 1 1 A 22 22 ALA H H 22 7.784 7.516 0.268 1
1 192 . 2 1 1 A 22 22 ALA HA H 22 4.166 4.033 0.133 1
1 196 . 2 1 1 A 22 22 ALA CA C 22 54.645 55.149 -0.504 1
1 197 . 2 1 1 A 22 22 ALA CB C 22 18.724 18.232 0.492 1
1 198 . 2 1 1 A 22 22 ALA N N 22 121.252 121.706 -0.454 1
1 199 . 2 1 1 A 23 23 VAL H H 23 8.086 7.605 0.481 1
1 200 . 2 1 1 A 23 23 VAL HA H 23 3.872 3.649 0.223 1
1 208 . 2 1 1 A 23 23 VAL CA C 23 64.928 66.345 -1.417 1
1 209 . 2 1 1 A 23 23 VAL CB C 23 32.451 31.578 0.873 1
1 212 . 2 1 1 A 23 23 VAL N N 23 114.516 117.946 -3.430 1
1 213 . 2 1 1 A 24 24 LEU H H 24 8.060 7.713 0.347 1
1 223 . 2 1 1 A 24 24 LEU N N 24 118.014 118.521 -0.507 1
1 224 . 2 1 1 A 25 25 GLY H H 25 7.880 8.109 -0.229 1
1 225 . 2 1 1 A 25 25 GLY HA2 H 25 3.949 3.934 0.015 1
1 226 . 2 1 1 A 25 25 GLY HA3 H 25 3.966 3.936 0.030 1
1 227 . 2 1 1 A 25 25 GLY CA C 25 45.959 45.984 -0.025 1
1 228 . 2 1 1 A 25 25 GLY N N 25 106.969 108.249 -1.280 1
1 229 . 2 1 1 A 26 26 GLY H H 26 8.123 8.239 -0.116 1
1 230 . 2 1 1 A 26 26 GLY HA2 H 26 3.912 4.152 -0.240 1
1 231 . 2 1 1 A 26 26 GLY HA3 H 26 4.002 4.153 -0.151 1
1 232 . 2 1 1 A 26 26 GLY CA C 26 45.691 45.640 0.051 1
1 233 . 2 1 1 A 26 26 GLY N N 26 108.223 112.083 -3.860 1
1 234 . 2 1 1 A 27 27 SER H H 27 8.201 8.858 -0.657 1
1 235 . 2 1 1 A 27 27 SER HA H 27 4.353 5.016 -0.663 1
1 238 . 2 1 1 A 27 27 SER CA C 27 59.117 57.504 1.613 1
1 239 . 2 1 1 A 27 27 SER CB C 27 63.770 65.917 -2.147 1
1 240 . 2 1 1 A 27 27 SER N N 27 115.317 117.230 -1.913 1
1 241 . 2 1 1 A 28 28 ARG H H 28 8.155 8.705 -0.550 1
1 242 . 2 1 1 A 28 28 ARG HA H 28 4.258 4.720 -0.462 1
1 250 . 2 1 1 A 28 28 ARG CA C 28 56.348 55.287 1.061 1
1 251 . 2 1 1 A 28 28 ARG N N 28 121.519 119.590 1.929 1
1 252 . 2 1 1 A 29 29 ASP H H 29 8.167 8.220 -0.053 1
1 255 . 2 1 1 A 29 29 ASP CB C 29 38.462 40.423 -1.961 1
1 256 . 2 1 1 A 29 29 ASP N N 29 118.393 119.223 -0.830 1
1 257 . 2 1 1 A 30 30 TYR H H 30 7.910 7.937 -0.027 1
1 258 . 2 1 1 A 30 30 TYR HA H 30 4.484 5.148 -0.664 1
1 265 . 2 1 1 A 30 30 TYR CA C 30 58.097 56.575 1.522 1
1 266 . 2 1 1 A 30 30 TYR CB C 30 38.759 43.591 -4.832 1
1 267 . 2 1 1 A 30 30 TYR N N 30 119.859 119.383 0.476 1
1 268 . 2 1 1 A 31 31 ASN H H 31 8.152 8.750 -0.598 1
1 269 . 2 1 1 A 31 31 ASN HA H 31 4.658 4.822 -0.164 1
1 274 . 2 1 1 A 31 31 ASN CA C 31 53.245 53.446 -0.201 1
1 275 . 2 1 1 A 31 31 ASN CB C 31 39.156 41.202 -2.046 1
1 276 . 2 1 1 A 31 31 ASN N N 31 119.343 119.308 0.035 1
1 13 . 3 1 1 A 2 2 ARG H H 2 8.864 8.635 0.229 1
1 14 . 3 1 1 A 2 2 ARG HA H 2 4.393 4.529 -0.136 1
1 22 . 3 1 1 A 2 2 ARG CA C 2 56.327 56.063 0.264 1
1 23 . 3 1 1 A 2 2 ARG N N 2 124.285 124.792 -0.507 1
1 24 . 3 1 1 A 3 3 SER H H 3 8.495 7.934 0.561 1
1 25 . 3 1 1 A 3 3 SER HA H 3 4.491 4.623 -0.132 1
1 28 . 3 1 1 A 3 3 SER CB C 3 64.117 64.505 -0.388 1
1 29 . 3 1 1 A 3 3 SER N N 3 117.670 112.366 5.304 1
1 30 . 3 1 1 A 4 4 ARG H H 4 8.672 7.973 0.699 1
1 31 . 3 1 1 A 4 4 ARG HA H 4 4.314 4.204 0.110 1
1 39 . 3 1 1 A 4 4 ARG CA C 4 56.779 57.935 -1.156 1
1 40 . 3 1 1 A 4 4 ARG N N 4 123.739 120.258 3.481 1
1 41 . 3 1 1 A 5 5 LYS H H 5 8.328 8.114 0.214 1
1 42 . 3 1 1 A 5 5 LYS HA H 5 4.127 4.276 -0.149 1
1 49 . 3 1 1 A 5 5 LYS CA C 5 57.431 58.168 -0.737 1
1 51 . 3 1 1 A 5 5 LYS N N 5 120.706 119.562 1.144 1
1 52 . 3 1 1 A 6 6 ASN H H 6 8.115 8.025 0.090 1
1 57 . 3 1 1 A 6 6 ASN CA C 6 53.066 51.981 1.085 1
1 58 . 3 1 1 A 6 6 ASN CB C 6 39.187 39.427 -0.240 1
1 59 . 3 1 1 A 6 6 ASN N N 6 117.807 116.579 1.228 1
1 60 . 3 1 1 A 7 7 GLY H H 7 8.499 8.251 0.248 1
1 61 . 3 1 1 A 7 7 GLY HA2 H 7 4.051 4.113 -0.062 1
1 62 . 3 1 1 A 7 7 GLY HA3 H 7 4.051 4.289 -0.238 1
1 63 . 3 1 1 A 7 7 GLY CA C 7 46.153 45.715 0.438 1
1 64 . 3 1 1 A 7 7 GLY N N 7 108.804 112.566 -3.762 1
1 65 . 3 1 1 A 8 8 ILE H H 8 8.496 7.844 0.652 1
1 75 . 3 1 1 A 8 8 ILE CB C 8 38.082 39.338 -1.256 1
1 76 . 3 1 1 A 8 8 ILE N N 8 121.041 121.658 -0.617 1
1 77 . 3 1 1 A 9 9 GLY H H 9 8.656 8.498 0.158 1
1 78 . 3 1 1 A 9 9 GLY HA2 H 9 3.671 3.727 -0.056 1
1 79 . 3 1 1 A 9 9 GLY HA3 H 9 3.671 3.756 -0.085 1
1 80 . 3 1 1 A 9 9 GLY CA C 9 47.324 47.172 0.152 1
1 81 . 3 1 1 A 9 9 GLY N N 9 108.767 109.444 -0.677 1
1 82 . 3 1 1 A 10 10 TYR H H 10 7.987 8.229 -0.242 1
1 83 . 3 1 1 A 10 10 TYR HA H 10 4.269 4.414 -0.145 1
1 90 . 3 1 1 A 10 10 TYR CA C 10 60.713 60.064 0.649 1
1 91 . 3 1 1 A 10 10 TYR CB C 10 38.354 37.600 0.754 1
1 92 . 3 1 1 A 10 10 TYR N N 10 121.261 120.077 1.184 1
1 93 . 3 1 1 A 11 11 ALA H H 11 8.020 7.506 0.514 1
1 94 . 3 1 1 A 11 11 ALA HA H 11 4.040 3.568 0.472 1
1 98 . 3 1 1 A 11 11 ALA CA C 11 55.355 54.739 0.616 1
1 99 . 3 1 1 A 11 11 ALA CB C 11 18.737 17.664 1.073 1
1 100 . 3 1 1 A 11 11 ALA N N 11 122.295 123.402 -1.107 1
1 101 . 3 1 1 A 12 12 ILE H H 12 8.308 7.608 0.700 1
1 102 . 3 1 1 A 12 12 ILE HA H 12 3.732 3.922 -0.190 1
1 111 . 3 1 1 A 12 12 ILE CB C 12 37.611 37.776 -0.165 1
1 112 . 3 1 1 A 12 12 ILE N N 12 116.853 119.097 -2.244 1
1 113 . 3 1 1 A 13 13 GLY H H 13 8.171 8.292 -0.121 1
1 114 . 3 1 1 A 13 13 GLY HA2 H 13 3.744 3.827 -0.083 1
1 115 . 3 1 1 A 13 13 GLY HA3 H 13 3.744 3.835 -0.091 1
1 116 . 3 1 1 A 13 13 GLY CA C 13 47.343 47.258 0.085 1
1 117 . 3 1 1 A 13 13 GLY N N 13 107.089 109.330 -2.241 1
1 118 . 3 1 1 A 14 14 TYR H H 14 8.223 8.434 -0.211 1
1 119 . 3 1 1 A 14 14 TYR HA H 14 4.147 4.112 0.035 1
1 126 . 3 1 1 A 14 14 TYR CB C 14 38.415 38.867 -0.452 1
1 127 . 3 1 1 A 14 14 TYR N N 14 122.935 123.279 -0.344 1
1 128 . 3 1 1 A 15 15 ALA H H 15 8.345 8.164 0.181 1
1 129 . 3 1 1 A 15 15 ALA HA H 15 3.986 3.809 0.177 1
1 133 . 3 1 1 A 15 15 ALA CA C 15 55.067 54.993 0.074 1
1 134 . 3 1 1 A 15 15 ALA N N 15 121.882 121.570 0.312 1
1 135 . 3 1 1 A 16 16 PHE H H 16 8.668 8.638 0.030 1
1 136 . 3 1 1 A 16 16 PHE HA H 16 4.138 4.256 -0.118 1
1 143 . 3 1 1 A 16 16 PHE CA C 16 61.116 60.628 0.488 1
1 144 . 3 1 1 A 16 16 PHE CB C 16 38.857 39.229 -0.372 1
1 145 . 3 1 1 A 16 16 PHE N N 16 116.563 119.046 -2.483 1
1 146 . 3 1 1 A 17 17 GLY H H 17 8.163 9.285 -1.122 1
1 147 . 3 1 1 A 17 17 GLY HA2 H 17 3.891 3.910 -0.019 1
1 148 . 3 1 1 A 17 17 GLY HA3 H 17 3.891 3.932 -0.041 1
1 149 . 3 1 1 A 17 17 GLY N N 17 105.893 106.908 -1.015 1
1 150 . 3 1 1 A 18 18 ALA H H 18 7.842 7.748 0.094 1
1 151 . 3 1 1 A 18 18 ALA HA H 18 4.035 3.931 0.104 1
1 155 . 3 1 1 A 18 18 ALA CA C 18 55.037 54.630 0.407 1
1 156 . 3 1 1 A 18 18 ALA CB C 18 18.223 18.502 -0.279 1
1 157 . 3 1 1 A 18 18 ALA N N 18 122.050 124.582 -2.532 1
1 158 . 3 1 1 A 19 19 VAL H H 19 8.010 7.796 0.214 1
1 159 . 3 1 1 A 19 19 VAL HA H 19 3.549 3.713 -0.164 1
1 167 . 3 1 1 A 19 19 VAL CA C 19 66.571 65.016 1.555 1
1 168 . 3 1 1 A 19 19 VAL CB C 19 31.436 31.414 0.022 1
1 171 . 3 1 1 A 19 19 VAL N N 19 118.184 116.203 1.981 1
1 172 . 3 1 1 A 20 20 GLU H H 20 8.339 8.726 -0.387 1
1 173 . 3 1 1 A 20 20 GLU HA H 20 3.666 4.073 -0.407 1
1 178 . 3 1 1 A 20 20 GLU CA C 20 60.103 59.326 0.777 1
1 180 . 3 1 1 A 20 20 GLU N N 20 118.704 119.978 -1.274 1
1 181 . 3 1 1 A 21 21 ARG H H 21 7.939 8.025 -0.086 1
1 182 . 3 1 1 A 21 21 ARG HA H 21 3.935 4.052 -0.117 1
1 190 . 3 1 1 A 21 21 ARG N N 21 116.955 120.854 -3.899 1
1 191 . 3 1 1 A 22 22 ALA H H 22 7.784 7.731 0.053 1
1 192 . 3 1 1 A 22 22 ALA HA H 22 4.166 4.075 0.091 1
1 196 . 3 1 1 A 22 22 ALA CA C 22 54.645 54.663 -0.018 1
1 197 . 3 1 1 A 22 22 ALA CB C 22 18.724 18.264 0.460 1
1 198 . 3 1 1 A 22 22 ALA N N 22 121.252 122.111 -0.859 1
1 199 . 3 1 1 A 23 23 VAL H H 23 8.086 7.953 0.133 1
1 200 . 3 1 1 A 23 23 VAL HA H 23 3.872 3.554 0.318 1
1 208 . 3 1 1 A 23 23 VAL CA C 23 64.928 66.881 -1.953 1
1 209 . 3 1 1 A 23 23 VAL CB C 23 32.451 31.685 0.766 1
1 212 . 3 1 1 A 23 23 VAL N N 23 114.516 119.158 -4.642 1
1 213 . 3 1 1 A 24 24 LEU H H 24 8.060 7.591 0.469 1
1 223 . 3 1 1 A 24 24 LEU N N 24 118.014 116.236 1.778 1
1 224 . 3 1 1 A 25 25 GLY H H 25 7.880 8.276 -0.396 1
1 225 . 3 1 1 A 25 25 GLY HA2 H 25 3.949 4.009 -0.060 1
1 226 . 3 1 1 A 25 25 GLY HA3 H 25 3.966 4.009 -0.043 1
1 227 . 3 1 1 A 25 25 GLY CA C 25 45.959 45.404 0.555 1
1 228 . 3 1 1 A 25 25 GLY N N 25 106.969 107.955 -0.986 1
1 229 . 3 1 1 A 26 26 GLY H H 26 8.123 8.015 0.108 1
1 230 . 3 1 1 A 26 26 GLY HA2 H 26 3.912 4.105 -0.193 1
1 231 . 3 1 1 A 26 26 GLY HA3 H 26 4.002 4.108 -0.106 1
1 232 . 3 1 1 A 26 26 GLY CA C 26 45.691 44.929 0.762 1
1 233 . 3 1 1 A 26 26 GLY N N 26 108.223 108.515 -0.292 1
1 234 . 3 1 1 A 27 27 SER H H 27 8.201 8.211 -0.010 1
1 235 . 3 1 1 A 27 27 SER HA H 27 4.353 4.890 -0.537 1
1 238 . 3 1 1 A 27 27 SER CA C 27 59.117 57.520 1.597 1
1 239 . 3 1 1 A 27 27 SER CB C 27 63.770 65.671 -1.901 1
1 240 . 3 1 1 A 27 27 SER N N 27 115.317 114.929 0.388 1
1 241 . 3 1 1 A 28 28 ARG H H 28 8.155 8.876 -0.721 1
1 242 . 3 1 1 A 28 28 ARG HA H 28 4.258 4.874 -0.616 1
1 250 . 3 1 1 A 28 28 ARG CA C 28 56.348 55.097 1.251 1
1 251 . 3 1 1 A 28 28 ARG N N 28 121.519 122.901 -1.382 1
1 252 . 3 1 1 A 29 29 ASP H H 29 8.167 9.280 -1.113 1
1 255 . 3 1 1 A 29 29 ASP CB C 29 38.462 41.162 -2.700 1
1 256 . 3 1 1 A 29 29 ASP N N 29 118.393 125.120 -6.727 1
1 257 . 3 1 1 A 30 30 TYR H H 30 7.910 8.290 -0.380 1
1 258 . 3 1 1 A 30 30 TYR HA H 30 4.484 5.196 -0.712 1
1 265 . 3 1 1 A 30 30 TYR CA C 30 58.097 56.635 1.462 1
1 266 . 3 1 1 A 30 30 TYR CB C 30 38.759 41.027 -2.268 1
1 267 . 3 1 1 A 30 30 TYR N N 30 119.859 124.138 -4.279 1
1 268 . 3 1 1 A 31 31 ASN H H 31 8.152 8.943 -0.791 1
1 269 . 3 1 1 A 31 31 ASN HA H 31 4.658 5.320 -0.662 1
1 274 . 3 1 1 A 31 31 ASN CA C 31 53.245 52.196 1.049 1
1 275 . 3 1 1 A 31 31 ASN CB C 31 39.156 39.916 -0.760 1
1 276 . 3 1 1 A 31 31 ASN N N 31 119.343 122.194 -2.851 1
1 13 . 4 1 1 A 2 2 ARG H H 2 8.864 8.334 0.530 1
1 14 . 4 1 1 A 2 2 ARG HA H 2 4.393 4.592 -0.199 1
1 22 . 4 1 1 A 2 2 ARG CA C 2 56.327 55.685 0.642 1
1 23 . 4 1 1 A 2 2 ARG N N 2 124.285 125.485 -1.200 1
1 24 . 4 1 1 A 3 3 SER H H 3 8.495 8.384 0.111 1
1 25 . 4 1 1 A 3 3 SER HA H 3 4.491 4.589 -0.098 1
1 28 . 4 1 1 A 3 3 SER CB C 3 64.117 65.831 -1.714 1
1 29 . 4 1 1 A 3 3 SER N N 3 117.670 117.722 -0.052 1
1 30 . 4 1 1 A 4 4 ARG H H 4 8.672 8.430 0.242 1
1 31 . 4 1 1 A 4 4 ARG HA H 4 4.314 4.186 0.128 1
1 39 . 4 1 1 A 4 4 ARG CA C 4 56.779 58.056 -1.277 1
1 40 . 4 1 1 A 4 4 ARG N N 4 123.739 121.526 2.213 1
1 41 . 4 1 1 A 5 5 LYS H H 5 8.328 7.940 0.388 1
1 42 . 4 1 1 A 5 5 LYS HA H 5 4.127 4.079 0.048 1
1 49 . 4 1 1 A 5 5 LYS CA C 5 57.431 57.854 -0.423 1
1 51 . 4 1 1 A 5 5 LYS N N 5 120.706 117.772 2.934 1
1 52 . 4 1 1 A 6 6 ASN H H 6 8.115 7.591 0.524 1
1 57 . 4 1 1 A 6 6 ASN CA C 6 53.066 52.887 0.179 1
1 58 . 4 1 1 A 6 6 ASN CB C 6 39.187 39.105 0.082 1
1 59 . 4 1 1 A 6 6 ASN N N 6 117.807 116.595 1.212 1
1 60 . 4 1 1 A 7 7 GLY H H 7 8.499 8.959 -0.460 1
1 61 . 4 1 1 A 7 7 GLY HA2 H 7 4.051 4.162 -0.111 1
1 62 . 4 1 1 A 7 7 GLY HA3 H 7 4.051 4.180 -0.129 1
1 63 . 4 1 1 A 7 7 GLY CA C 7 46.153 46.578 -0.425 1
1 64 . 4 1 1 A 7 7 GLY N N 7 108.804 112.382 -3.578 1
1 65 . 4 1 1 A 8 8 ILE H H 8 8.496 7.865 0.631 1
1 75 . 4 1 1 A 8 8 ILE CB C 8 38.082 40.654 -2.572 1
1 76 . 4 1 1 A 8 8 ILE N N 8 121.041 119.686 1.355 1
1 77 . 4 1 1 A 9 9 GLY H H 9 8.656 8.376 0.280 1
1 78 . 4 1 1 A 9 9 GLY HA2 H 9 3.671 3.902 -0.231 1
1 79 . 4 1 1 A 9 9 GLY HA3 H 9 3.671 3.932 -0.261 1
1 80 . 4 1 1 A 9 9 GLY CA C 9 47.324 45.849 1.475 1
1 81 . 4 1 1 A 9 9 GLY N N 9 108.767 109.203 -0.436 1
1 82 . 4 1 1 A 10 10 TYR H H 10 7.987 8.261 -0.274 1
1 83 . 4 1 1 A 10 10 TYR HA H 10 4.269 4.375 -0.106 1
1 90 . 4 1 1 A 10 10 TYR CA C 10 60.713 60.222 0.491 1
1 91 . 4 1 1 A 10 10 TYR CB C 10 38.354 37.437 0.917 1
1 92 . 4 1 1 A 10 10 TYR N N 10 121.261 120.071 1.190 1
1 93 . 4 1 1 A 11 11 ALA H H 11 8.020 7.302 0.718 1
1 94 . 4 1 1 A 11 11 ALA HA H 11 4.040 3.643 0.397 1
1 98 . 4 1 1 A 11 11 ALA CA C 11 55.355 54.656 0.699 1
1 99 . 4 1 1 A 11 11 ALA CB C 11 18.737 18.142 0.595 1
1 100 . 4 1 1 A 11 11 ALA N N 11 122.295 123.037 -0.742 1
1 101 . 4 1 1 A 12 12 ILE H H 12 8.308 8.029 0.279 1
1 102 . 4 1 1 A 12 12 ILE HA H 12 3.732 3.881 -0.149 1
1 111 . 4 1 1 A 12 12 ILE CB C 12 37.611 37.621 -0.010 1
1 112 . 4 1 1 A 12 12 ILE N N 12 116.853 118.762 -1.909 1
1 113 . 4 1 1 A 13 13 GLY H H 13 8.171 8.566 -0.395 1
1 114 . 4 1 1 A 13 13 GLY HA2 H 13 3.744 3.782 -0.038 1
1 115 . 4 1 1 A 13 13 GLY HA3 H 13 3.744 3.795 -0.051 1
1 116 . 4 1 1 A 13 13 GLY CA C 13 47.343 47.180 0.163 1
1 117 . 4 1 1 A 13 13 GLY N N 13 107.089 109.471 -2.382 1
1 118 . 4 1 1 A 14 14 TYR H H 14 8.223 8.594 -0.371 1
1 119 . 4 1 1 A 14 14 TYR HA H 14 4.147 4.154 -0.007 1
1 126 . 4 1 1 A 14 14 TYR CB C 14 38.415 38.853 -0.438 1
1 127 . 4 1 1 A 14 14 TYR N N 14 122.935 123.106 -0.171 1
1 128 . 4 1 1 A 15 15 ALA H H 15 8.345 8.165 0.180 1
1 129 . 4 1 1 A 15 15 ALA HA H 15 3.986 3.737 0.249 1
1 133 . 4 1 1 A 15 15 ALA CA C 15 55.067 54.917 0.150 1
1 134 . 4 1 1 A 15 15 ALA N N 15 121.882 121.593 0.289 1
1 135 . 4 1 1 A 16 16 PHE H H 16 8.668 8.531 0.137 1
1 136 . 4 1 1 A 16 16 PHE HA H 16 4.138 4.226 -0.088 1
1 143 . 4 1 1 A 16 16 PHE CA C 16 61.116 60.950 0.166 1
1 144 . 4 1 1 A 16 16 PHE CB C 16 38.857 39.160 -0.303 1
1 145 . 4 1 1 A 16 16 PHE N N 16 116.563 119.368 -2.805 1
1 146 . 4 1 1 A 17 17 GLY H H 17 8.163 9.021 -0.858 1
1 147 . 4 1 1 A 17 17 GLY HA2 H 17 3.891 3.867 0.024 1
1 148 . 4 1 1 A 17 17 GLY HA3 H 17 3.891 3.899 -0.008 1
1 149 . 4 1 1 A 17 17 GLY N N 17 105.893 106.870 -0.977 1
1 150 . 4 1 1 A 18 18 ALA H H 18 7.842 7.645 0.197 1
1 151 . 4 1 1 A 18 18 ALA HA H 18 4.035 3.961 0.074 1
1 155 . 4 1 1 A 18 18 ALA CA C 18 55.037 54.679 0.358 1
1 156 . 4 1 1 A 18 18 ALA CB C 18 18.223 18.709 -0.486 1
1 157 . 4 1 1 A 18 18 ALA N N 18 122.050 124.561 -2.511 1
1 158 . 4 1 1 A 19 19 VAL H H 19 8.010 7.642 0.368 1
1 159 . 4 1 1 A 19 19 VAL HA H 19 3.549 3.749 -0.200 1
1 167 . 4 1 1 A 19 19 VAL CA C 19 66.571 65.084 1.487 1
1 168 . 4 1 1 A 19 19 VAL CB C 19 31.436 31.492 -0.056 1
1 171 . 4 1 1 A 19 19 VAL N N 19 118.184 116.323 1.861 1
1 172 . 4 1 1 A 20 20 GLU H H 20 8.339 8.532 -0.193 1
1 173 . 4 1 1 A 20 20 GLU HA H 20 3.666 4.039 -0.373 1
1 178 . 4 1 1 A 20 20 GLU CA C 20 60.103 59.416 0.687 1
1 180 . 4 1 1 A 20 20 GLU N N 20 118.704 120.428 -1.724 1
1 181 . 4 1 1 A 21 21 ARG H H 21 7.939 8.282 -0.343 1
1 182 . 4 1 1 A 21 21 ARG HA H 21 3.935 4.004 -0.069 1
1 190 . 4 1 1 A 21 21 ARG N N 21 116.955 120.885 -3.930 1
1 191 . 4 1 1 A 22 22 ALA H H 22 7.784 7.528 0.256 1
1 192 . 4 1 1 A 22 22 ALA HA H 22 4.166 4.081 0.085 1
1 196 . 4 1 1 A 22 22 ALA CA C 22 54.645 55.332 -0.687 1
1 197 . 4 1 1 A 22 22 ALA CB C 22 18.724 18.598 0.126 1
1 198 . 4 1 1 A 22 22 ALA N N 22 121.252 122.091 -0.839 1
1 199 . 4 1 1 A 23 23 VAL H H 23 8.086 8.023 0.063 1
1 200 . 4 1 1 A 23 23 VAL HA H 23 3.872 3.672 0.200 1
1 208 . 4 1 1 A 23 23 VAL CA C 23 64.928 65.891 -0.963 1
1 209 . 4 1 1 A 23 23 VAL CB C 23 32.451 31.816 0.635 1
1 212 . 4 1 1 A 23 23 VAL N N 23 114.516 118.469 -3.953 1
1 213 . 4 1 1 A 24 24 LEU H H 24 8.060 8.058 0.002 1
1 223 . 4 1 1 A 24 24 LEU N N 24 118.014 119.019 -1.005 1
1 224 . 4 1 1 A 25 25 GLY H H 25 7.880 7.573 0.307 1
1 225 . 4 1 1 A 25 25 GLY HA2 H 25 3.949 4.102 -0.153 1
1 226 . 4 1 1 A 25 25 GLY HA3 H 25 3.966 4.105 -0.139 1
1 227 . 4 1 1 A 25 25 GLY CA C 25 45.959 44.713 1.246 1
1 228 . 4 1 1 A 25 25 GLY N N 25 106.969 106.523 0.446 1
1 229 . 4 1 1 A 26 26 GLY H H 26 8.123 8.647 -0.524 1
1 230 . 4 1 1 A 26 26 GLY HA2 H 26 3.912 3.928 -0.016 1
1 231 . 4 1 1 A 26 26 GLY HA3 H 26 4.002 3.928 0.074 1
1 232 . 4 1 1 A 26 26 GLY CA C 26 45.691 47.117 -1.426 1
1 233 . 4 1 1 A 26 26 GLY N N 26 108.223 111.954 -3.731 1
1 234 . 4 1 1 A 27 27 SER H H 27 8.201 8.214 -0.013 1
1 235 . 4 1 1 A 27 27 SER HA H 27 4.353 4.670 -0.317 1
1 238 . 4 1 1 A 27 27 SER CA C 27 59.117 55.655 3.462 1
1 239 . 4 1 1 A 27 27 SER CB C 27 63.770 65.644 -1.874 1
1 240 . 4 1 1 A 27 27 SER N N 27 115.317 114.029 1.288 1
1 241 . 4 1 1 A 28 28 ARG H H 28 8.155 8.780 -0.625 1
1 242 . 4 1 1 A 28 28 ARG HA H 28 4.258 4.127 0.131 1
1 250 . 4 1 1 A 28 28 ARG CA C 28 56.348 58.143 -1.795 1
1 251 . 4 1 1 A 28 28 ARG N N 28 121.519 121.802 -0.283 1
1 252 . 4 1 1 A 29 29 ASP H H 29 8.167 8.701 -0.534 1
1 255 . 4 1 1 A 29 29 ASP CB C 29 38.462 41.584 -3.122 1
1 256 . 4 1 1 A 29 29 ASP N N 29 118.393 121.373 -2.980 1
1 257 . 4 1 1 A 30 30 TYR H H 30 7.910 7.849 0.061 1
1 258 . 4 1 1 A 30 30 TYR HA H 30 4.484 4.767 -0.283 1
1 265 . 4 1 1 A 30 30 TYR CA C 30 58.097 57.434 0.663 1
1 266 . 4 1 1 A 30 30 TYR CB C 30 38.759 37.742 1.017 1
1 267 . 4 1 1 A 30 30 TYR N N 30 119.859 116.596 3.263 1
1 268 . 4 1 1 A 31 31 ASN H H 31 8.152 8.746 -0.594 1
1 269 . 4 1 1 A 31 31 ASN HA H 31 4.658 4.994 -0.336 1
1 274 . 4 1 1 A 31 31 ASN CA C 31 53.245 52.639 0.606 1
1 275 . 4 1 1 A 31 31 ASN CB C 31 39.156 38.859 0.297 1
1 276 . 4 1 1 A 31 31 ASN N N 31 119.343 121.698 -2.355 1
1 13 . 5 1 1 A 2 2 ARG H H 2 8.864 8.539 0.325 1
1 14 . 5 1 1 A 2 2 ARG HA H 2 4.393 4.647 -0.254 1
1 22 . 5 1 1 A 2 2 ARG CA C 2 56.327 55.204 1.123 1
1 23 . 5 1 1 A 2 2 ARG N N 2 124.285 123.224 1.061 1
1 24 . 5 1 1 A 3 3 SER H H 3 8.495 8.051 0.444 1
1 25 . 5 1 1 A 3 3 SER HA H 3 4.491 4.454 0.037 1
1 28 . 5 1 1 A 3 3 SER CB C 3 64.117 64.206 -0.089 1
1 29 . 5 1 1 A 3 3 SER N N 3 117.670 116.674 0.996 1
1 30 . 5 1 1 A 4 4 ARG H H 4 8.672 7.825 0.847 1
1 31 . 5 1 1 A 4 4 ARG HA H 4 4.314 4.140 0.174 1
1 39 . 5 1 1 A 4 4 ARG CA C 4 56.779 58.209 -1.430 1
1 40 . 5 1 1 A 4 4 ARG N N 4 123.739 121.838 1.901 1
1 41 . 5 1 1 A 5 5 LYS H H 5 8.328 7.694 0.634 1
1 42 . 5 1 1 A 5 5 LYS HA H 5 4.127 4.415 -0.288 1
1 49 . 5 1 1 A 5 5 LYS CA C 5 57.431 55.774 1.657 1
1 51 . 5 1 1 A 5 5 LYS N N 5 120.706 117.445 3.261 1
1 52 . 5 1 1 A 6 6 ASN H H 6 8.115 7.901 0.214 1
1 57 . 5 1 1 A 6 6 ASN CA C 6 53.066 54.279 -1.213 1
1 58 . 5 1 1 A 6 6 ASN CB C 6 39.187 37.592 1.595 1
1 59 . 5 1 1 A 6 6 ASN N N 6 117.807 115.854 1.953 1
1 60 . 5 1 1 A 7 7 GLY H H 7 8.499 8.339 0.160 1
1 61 . 5 1 1 A 7 7 GLY HA2 H 7 4.051 4.229 -0.178 1
1 62 . 5 1 1 A 7 7 GLY HA3 H 7 4.051 4.316 -0.265 1
1 63 . 5 1 1 A 7 7 GLY CA C 7 46.153 45.944 0.209 1
1 64 . 5 1 1 A 7 7 GLY N N 7 108.804 110.662 -1.858 1
1 65 . 5 1 1 A 8 8 ILE H H 8 8.496 9.088 -0.592 1
1 75 . 5 1 1 A 8 8 ILE CB C 8 38.082 37.509 0.573 1
1 76 . 5 1 1 A 8 8 ILE N N 8 121.041 125.442 -4.401 1
1 77 . 5 1 1 A 9 9 GLY H H 9 8.656 8.190 0.466 1
1 78 . 5 1 1 A 9 9 GLY HA2 H 9 3.671 3.988 -0.317 1
1 79 . 5 1 1 A 9 9 GLY HA3 H 9 3.671 4.021 -0.350 1
1 80 . 5 1 1 A 9 9 GLY CA C 9 47.324 45.352 1.972 1
1 81 . 5 1 1 A 9 9 GLY N N 9 108.767 109.991 -1.224 1
1 82 . 5 1 1 A 10 10 TYR H H 10 7.987 8.432 -0.445 1
1 83 . 5 1 1 A 10 10 TYR HA H 10 4.269 4.369 -0.100 1
1 90 . 5 1 1 A 10 10 TYR CA C 10 60.713 60.107 0.606 1
1 91 . 5 1 1 A 10 10 TYR CB C 10 38.354 37.543 0.811 1
1 92 . 5 1 1 A 10 10 TYR N N 10 121.261 119.992 1.269 1
1 93 . 5 1 1 A 11 11 ALA H H 11 8.020 7.308 0.712 1
1 94 . 5 1 1 A 11 11 ALA HA H 11 4.040 3.731 0.309 1
1 98 . 5 1 1 A 11 11 ALA CA C 11 55.355 54.712 0.643 1
1 99 . 5 1 1 A 11 11 ALA CB C 11 18.737 17.777 0.960 1
1 100 . 5 1 1 A 11 11 ALA N N 11 122.295 123.040 -0.745 1
1 101 . 5 1 1 A 12 12 ILE H H 12 8.308 8.154 0.154 1
1 102 . 5 1 1 A 12 12 ILE HA H 12 3.732 3.913 -0.181 1
1 111 . 5 1 1 A 12 12 ILE CB C 12 37.611 37.703 -0.092 1
1 112 . 5 1 1 A 12 12 ILE N N 12 116.853 119.172 -2.319 1
1 113 . 5 1 1 A 13 13 GLY H H 13 8.171 8.113 0.058 1
1 114 . 5 1 1 A 13 13 GLY HA2 H 13 3.744 3.782 -0.038 1
1 115 . 5 1 1 A 13 13 GLY HA3 H 13 3.744 3.801 -0.057 1
1 116 . 5 1 1 A 13 13 GLY CA C 13 47.343 47.196 0.147 1
1 117 . 5 1 1 A 13 13 GLY N N 13 107.089 109.616 -2.527 1
1 118 . 5 1 1 A 14 14 TYR H H 14 8.223 8.436 -0.213 1
1 119 . 5 1 1 A 14 14 TYR HA H 14 4.147 4.098 0.049 1
1 126 . 5 1 1 A 14 14 TYR CB C 14 38.415 39.082 -0.667 1
1 127 . 5 1 1 A 14 14 TYR N N 14 122.935 123.180 -0.245 1
1 128 . 5 1 1 A 15 15 ALA H H 15 8.345 8.033 0.312 1
1 129 . 5 1 1 A 15 15 ALA HA H 15 3.986 3.725 0.261 1
1 133 . 5 1 1 A 15 15 ALA CA C 15 55.067 54.922 0.145 1
1 134 . 5 1 1 A 15 15 ALA N N 15 121.882 121.402 0.480 1
1 135 . 5 1 1 A 16 16 PHE H H 16 8.668 8.775 -0.107 1
1 136 . 5 1 1 A 16 16 PHE HA H 16 4.138 4.229 -0.091 1
1 143 . 5 1 1 A 16 16 PHE CA C 16 61.116 60.855 0.261 1
1 144 . 5 1 1 A 16 16 PHE CB C 16 38.857 39.315 -0.458 1
1 145 . 5 1 1 A 16 16 PHE N N 16 116.563 119.311 -2.748 1
1 146 . 5 1 1 A 17 17 GLY H H 17 8.163 8.953 -0.790 1
1 147 . 5 1 1 A 17 17 GLY HA2 H 17 3.891 3.744 0.147 1
1 148 . 5 1 1 A 17 17 GLY HA3 H 17 3.891 3.820 0.071 1
1 149 . 5 1 1 A 17 17 GLY N N 17 105.893 106.783 -0.890 1
1 150 . 5 1 1 A 18 18 ALA H H 18 7.842 7.627 0.215 1
1 151 . 5 1 1 A 18 18 ALA HA H 18 4.035 3.929 0.106 1
1 155 . 5 1 1 A 18 18 ALA CA C 18 55.037 54.648 0.389 1
1 156 . 5 1 1 A 18 18 ALA CB C 18 18.223 18.574 -0.351 1
1 157 . 5 1 1 A 18 18 ALA N N 18 122.050 124.429 -2.379 1
1 158 . 5 1 1 A 19 19 VAL H H 19 8.010 7.766 0.244 1
1 159 . 5 1 1 A 19 19 VAL HA H 19 3.549 3.730 -0.181 1
1 167 . 5 1 1 A 19 19 VAL CA C 19 66.571 65.049 1.522 1
1 168 . 5 1 1 A 19 19 VAL CB C 19 31.436 31.559 -0.123 1
1 171 . 5 1 1 A 19 19 VAL N N 19 118.184 116.576 1.608 1
1 172 . 5 1 1 A 20 20 GLU H H 20 8.339 8.639 -0.300 1
1 173 . 5 1 1 A 20 20 GLU HA H 20 3.666 4.030 -0.364 1
1 178 . 5 1 1 A 20 20 GLU CA C 20 60.103 59.415 0.688 1
1 180 . 5 1 1 A 20 20 GLU N N 20 118.704 120.485 -1.781 1
1 181 . 5 1 1 A 21 21 ARG H H 21 7.939 8.151 -0.212 1
1 182 . 5 1 1 A 21 21 ARG HA H 21 3.935 3.995 -0.060 1
1 190 . 5 1 1 A 21 21 ARG N N 21 116.955 120.827 -3.872 1
1 191 . 5 1 1 A 22 22 ALA H H 22 7.784 7.875 -0.091 1
1 192 . 5 1 1 A 22 22 ALA HA H 22 4.166 4.009 0.157 1
1 196 . 5 1 1 A 22 22 ALA CA C 22 54.645 55.238 -0.593 1
1 197 . 5 1 1 A 22 22 ALA CB C 22 18.724 17.943 0.781 1
1 198 . 5 1 1 A 22 22 ALA N N 22 121.252 122.267 -1.015 1
1 199 . 5 1 1 A 23 23 VAL H H 23 8.086 7.877 0.209 1
1 200 . 5 1 1 A 23 23 VAL HA H 23 3.872 3.647 0.225 1
1 208 . 5 1 1 A 23 23 VAL CA C 23 64.928 66.379 -1.451 1
1 209 . 5 1 1 A 23 23 VAL CB C 23 32.451 31.724 0.727 1
1 212 . 5 1 1 A 23 23 VAL N N 23 114.516 118.082 -3.566 1
1 213 . 5 1 1 A 24 24 LEU H H 24 8.060 7.695 0.365 1
1 223 . 5 1 1 A 24 24 LEU N N 24 118.014 120.152 -2.138 1
1 224 . 5 1 1 A 25 25 GLY H H 25 7.880 8.044 -0.164 1
1 225 . 5 1 1 A 25 25 GLY HA2 H 25 3.949 4.078 -0.129 1
1 226 . 5 1 1 A 25 25 GLY HA3 H 25 3.966 4.079 -0.113 1
1 227 . 5 1 1 A 25 25 GLY CA C 25 45.959 45.144 0.815 1
1 228 . 5 1 1 A 25 25 GLY N N 25 106.969 105.862 1.107 1
1 229 . 5 1 1 A 26 26 GLY H H 26 8.123 8.250 -0.127 1
1 230 . 5 1 1 A 26 26 GLY HA2 H 26 3.912 4.198 -0.286 1
1 231 . 5 1 1 A 26 26 GLY HA3 H 26 4.002 4.198 -0.196 1
1 232 . 5 1 1 A 26 26 GLY CA C 26 45.691 46.060 -0.369 1
1 233 . 5 1 1 A 26 26 GLY N N 26 108.223 111.855 -3.632 1
1 234 . 5 1 1 A 27 27 SER H H 27 8.201 7.980 0.221 1
1 235 . 5 1 1 A 27 27 SER HA H 27 4.353 5.030 -0.677 1
1 238 . 5 1 1 A 27 27 SER CA C 27 59.117 57.700 1.417 1
1 239 . 5 1 1 A 27 27 SER CB C 27 63.770 66.590 -2.820 1
1 240 . 5 1 1 A 27 27 SER N N 27 115.317 111.388 3.929 1
1 241 . 5 1 1 A 28 28 ARG H H 28 8.155 8.459 -0.304 1
1 242 . 5 1 1 A 28 28 ARG HA H 28 4.258 4.904 -0.646 1
1 250 . 5 1 1 A 28 28 ARG CA C 28 56.348 54.934 1.414 1
1 251 . 5 1 1 A 28 28 ARG N N 28 121.519 123.780 -2.261 1
1 252 . 5 1 1 A 29 29 ASP H H 29 8.167 8.766 -0.599 1
1 255 . 5 1 1 A 29 29 ASP CB C 29 38.462 42.149 -3.687 1
1 256 . 5 1 1 A 29 29 ASP N N 29 118.393 121.678 -3.285 1
1 257 . 5 1 1 A 30 30 TYR H H 30 7.910 7.995 -0.085 1
1 258 . 5 1 1 A 30 30 TYR HA H 30 4.484 4.813 -0.329 1
1 265 . 5 1 1 A 30 30 TYR CA C 30 58.097 57.545 0.552 1
1 266 . 5 1 1 A 30 30 TYR CB C 30 38.759 40.111 -1.352 1
1 267 . 5 1 1 A 30 30 TYR N N 30 119.859 115.788 4.071 1
1 268 . 5 1 1 A 31 31 ASN H H 31 8.152 8.716 -0.564 1
1 269 . 5 1 1 A 31 31 ASN HA H 31 4.658 4.984 -0.326 1
1 274 . 5 1 1 A 31 31 ASN CA C 31 53.245 52.329 0.916 1
1 275 . 5 1 1 A 31 31 ASN CB C 31 39.156 38.797 0.359 1
1 276 . 5 1 1 A 31 31 ASN N N 31 119.343 117.234 2.109 1
1 13 . 6 1 1 A 2 2 ARG H H 2 8.864 7.998 0.866 1
1 14 . 6 1 1 A 2 2 ARG HA H 2 4.393 4.552 -0.159 1
1 22 . 6 1 1 A 2 2 ARG CA C 2 56.327 55.142 1.185 1
1 23 . 6 1 1 A 2 2 ARG N N 2 124.285 117.156 7.129 1
1 24 . 6 1 1 A 3 3 SER H H 3 8.495 8.110 0.385 1
1 25 . 6 1 1 A 3 3 SER HA H 3 4.491 4.385 0.106 1
1 28 . 6 1 1 A 3 3 SER CB C 3 64.117 63.226 0.891 1
1 29 . 6 1 1 A 3 3 SER N N 3 117.670 117.055 0.615 1
1 30 . 6 1 1 A 4 4 ARG H H 4 8.672 7.725 0.947 1
1 31 . 6 1 1 A 4 4 ARG HA H 4 4.314 4.222 0.092 1
1 39 . 6 1 1 A 4 4 ARG CA C 4 56.779 57.934 -1.155 1
1 40 . 6 1 1 A 4 4 ARG N N 4 123.739 120.319 3.420 1
1 41 . 6 1 1 A 5 5 LYS H H 5 8.328 7.503 0.825 1
1 42 . 6 1 1 A 5 5 LYS HA H 5 4.127 4.255 -0.128 1
1 49 . 6 1 1 A 5 5 LYS CA C 5 57.431 57.514 -0.083 1
1 51 . 6 1 1 A 5 5 LYS N N 5 120.706 118.232 2.474 1
1 52 . 6 1 1 A 6 6 ASN H H 6 8.115 7.623 0.492 1
1 57 . 6 1 1 A 6 6 ASN CA C 6 53.066 53.233 -0.167 1
1 58 . 6 1 1 A 6 6 ASN CB C 6 39.187 41.595 -2.408 1
1 59 . 6 1 1 A 6 6 ASN N N 6 117.807 115.986 1.821 1
1 60 . 6 1 1 A 7 7 GLY H H 7 8.499 8.591 -0.092 1
1 61 . 6 1 1 A 7 7 GLY HA2 H 7 4.051 4.285 -0.234 1
1 62 . 6 1 1 A 7 7 GLY HA3 H 7 4.051 4.374 -0.323 1
1 63 . 6 1 1 A 7 7 GLY CA C 7 46.153 45.741 0.412 1
1 64 . 6 1 1 A 7 7 GLY N N 7 108.804 110.058 -1.254 1
1 65 . 6 1 1 A 8 8 ILE H H 8 8.496 9.016 -0.520 1
1 75 . 6 1 1 A 8 8 ILE CB C 8 38.082 37.517 0.565 1
1 76 . 6 1 1 A 8 8 ILE N N 8 121.041 125.136 -4.095 1
1 77 . 6 1 1 A 9 9 GLY H H 9 8.656 8.188 0.468 1
1 78 . 6 1 1 A 9 9 GLY HA2 H 9 3.671 3.988 -0.317 1
1 79 . 6 1 1 A 9 9 GLY HA3 H 9 3.671 4.021 -0.350 1
1 80 . 6 1 1 A 9 9 GLY CA C 9 47.324 45.395 1.929 1
1 81 . 6 1 1 A 9 9 GLY N N 9 108.767 109.999 -1.232 1
1 82 . 6 1 1 A 10 10 TYR H H 10 7.987 8.519 -0.532 1
1 83 . 6 1 1 A 10 10 TYR HA H 10 4.269 4.372 -0.103 1
1 90 . 6 1 1 A 10 10 TYR CA C 10 60.713 60.109 0.604 1
1 91 . 6 1 1 A 10 10 TYR CB C 10 38.354 37.545 0.809 1
1 92 . 6 1 1 A 10 10 TYR N N 10 121.261 120.082 1.179 1
1 93 . 6 1 1 A 11 11 ALA H H 11 8.020 7.299 0.721 1
1 94 . 6 1 1 A 11 11 ALA HA H 11 4.040 3.715 0.325 1
1 98 . 6 1 1 A 11 11 ALA CA C 11 55.355 54.703 0.652 1
1 99 . 6 1 1 A 11 11 ALA CB C 11 18.737 17.693 1.044 1
1 100 . 6 1 1 A 11 11 ALA N N 11 122.295 123.037 -0.742 1
1 101 . 6 1 1 A 12 12 ILE H H 12 8.308 8.153 0.155 1
1 102 . 6 1 1 A 12 12 ILE HA H 12 3.732 3.922 -0.190 1
1 111 . 6 1 1 A 12 12 ILE CB C 12 37.611 37.803 -0.192 1
1 112 . 6 1 1 A 12 12 ILE N N 12 116.853 119.173 -2.320 1
1 113 . 6 1 1 A 13 13 GLY H H 13 8.171 8.114 0.057 1
1 114 . 6 1 1 A 13 13 GLY HA2 H 13 3.744 3.788 -0.044 1
1 115 . 6 1 1 A 13 13 GLY HA3 H 13 3.744 3.805 -0.061 1
1 116 . 6 1 1 A 13 13 GLY CA C 13 47.343 47.203 0.140 1
1 117 . 6 1 1 A 13 13 GLY N N 13 107.089 109.623 -2.534 1
1 118 . 6 1 1 A 14 14 TYR H H 14 8.223 8.447 -0.224 1
1 119 . 6 1 1 A 14 14 TYR HA H 14 4.147 4.108 0.039 1
1 126 . 6 1 1 A 14 14 TYR CB C 14 38.415 39.086 -0.671 1
1 127 . 6 1 1 A 14 14 TYR N N 14 122.935 123.187 -0.252 1
1 128 . 6 1 1 A 15 15 ALA H H 15 8.345 8.105 0.240 1
1 129 . 6 1 1 A 15 15 ALA HA H 15 3.986 3.790 0.196 1
1 133 . 6 1 1 A 15 15 ALA CA C 15 55.067 54.990 0.077 1
1 134 . 6 1 1 A 15 15 ALA N N 15 121.882 121.475 0.407 1
1 135 . 6 1 1 A 16 16 PHE H H 16 8.668 8.796 -0.128 1
1 136 . 6 1 1 A 16 16 PHE HA H 16 4.138 4.243 -0.105 1
1 143 . 6 1 1 A 16 16 PHE CA C 16 61.116 60.870 0.246 1
1 144 . 6 1 1 A 16 16 PHE CB C 16 38.857 39.326 -0.469 1
1 145 . 6 1 1 A 16 16 PHE N N 16 116.563 119.333 -2.770 1
1 146 . 6 1 1 A 17 17 GLY H H 17 8.163 8.959 -0.796 1
1 147 . 6 1 1 A 17 17 GLY HA2 H 17 3.891 3.751 0.140 1
1 148 . 6 1 1 A 17 17 GLY HA3 H 17 3.891 3.825 0.066 1
1 149 . 6 1 1 A 17 17 GLY N N 17 105.893 106.795 -0.902 1
1 150 . 6 1 1 A 18 18 ALA H H 18 7.842 7.639 0.203 1
1 151 . 6 1 1 A 18 18 ALA HA H 18 4.035 3.938 0.097 1
1 155 . 6 1 1 A 18 18 ALA CA C 18 55.037 54.653 0.384 1
1 156 . 6 1 1 A 18 18 ALA CB C 18 18.223 18.494 -0.271 1
1 157 . 6 1 1 A 18 18 ALA N N 18 122.050 124.582 -2.532 1
1 158 . 6 1 1 A 19 19 VAL H H 19 8.010 7.901 0.109 1
1 159 . 6 1 1 A 19 19 VAL HA H 19 3.549 3.772 -0.223 1
1 167 . 6 1 1 A 19 19 VAL CA C 19 66.571 65.099 1.472 1
1 168 . 6 1 1 A 19 19 VAL CB C 19 31.436 31.548 -0.112 1
1 171 . 6 1 1 A 19 19 VAL N N 19 118.184 116.237 1.947 1
1 172 . 6 1 1 A 20 20 GLU H H 20 8.339 8.522 -0.183 1
1 173 . 6 1 1 A 20 20 GLU HA H 20 3.666 4.037 -0.371 1
1 178 . 6 1 1 A 20 20 GLU CA C 20 60.103 59.406 0.697 1
1 180 . 6 1 1 A 20 20 GLU N N 20 118.704 120.670 -1.966 1
1 181 . 6 1 1 A 21 21 ARG H H 21 7.939 8.194 -0.255 1
1 182 . 6 1 1 A 21 21 ARG HA H 21 3.935 3.993 -0.058 1
1 190 . 6 1 1 A 21 21 ARG N N 21 116.955 120.754 -3.799 1
1 191 . 6 1 1 A 22 22 ALA H H 22 7.784 7.765 0.019 1
1 192 . 6 1 1 A 22 22 ALA HA H 22 4.166 4.090 0.076 1
1 196 . 6 1 1 A 22 22 ALA CA C 22 54.645 55.093 -0.448 1
1 197 . 6 1 1 A 22 22 ALA CB C 22 18.724 18.346 0.378 1
1 198 . 6 1 1 A 22 22 ALA N N 22 121.252 122.276 -1.024 1
1 199 . 6 1 1 A 23 23 VAL H H 23 8.086 7.610 0.476 1
1 200 . 6 1 1 A 23 23 VAL HA H 23 3.872 3.860 0.012 1
1 208 . 6 1 1 A 23 23 VAL CA C 23 64.928 65.272 -0.344 1
1 209 . 6 1 1 A 23 23 VAL CB C 23 32.451 31.739 0.712 1
1 212 . 6 1 1 A 23 23 VAL N N 23 114.516 118.096 -3.580 1
1 213 . 6 1 1 A 24 24 LEU H H 24 8.060 7.399 0.661 1
1 223 . 6 1 1 A 24 24 LEU N N 24 118.014 118.340 -0.326 1
1 224 . 6 1 1 A 25 25 GLY H H 25 7.880 8.409 -0.529 1
1 225 . 6 1 1 A 25 25 GLY HA2 H 25 3.949 4.033 -0.084 1
1 226 . 6 1 1 A 25 25 GLY HA3 H 25 3.966 4.034 -0.068 1
1 227 . 6 1 1 A 25 25 GLY CA C 25 45.959 45.369 0.590 1
1 228 . 6 1 1 A 25 25 GLY N N 25 106.969 106.922 0.047 1
1 229 . 6 1 1 A 26 26 GLY H H 26 8.123 8.370 -0.247 1
1 230 . 6 1 1 A 26 26 GLY HA2 H 26 3.912 4.256 -0.344 1
1 231 . 6 1 1 A 26 26 GLY HA3 H 26 4.002 4.258 -0.256 1
1 232 . 6 1 1 A 26 26 GLY CA C 26 45.691 46.190 -0.499 1
1 233 . 6 1 1 A 26 26 GLY N N 26 108.223 110.192 -1.969 1
1 234 . 6 1 1 A 27 27 SER H H 27 8.201 8.481 -0.280 1
1 235 . 6 1 1 A 27 27 SER HA H 27 4.353 4.844 -0.491 1
1 238 . 6 1 1 A 27 27 SER CA C 27 59.117 57.717 1.400 1
1 239 . 6 1 1 A 27 27 SER CB C 27 63.770 65.412 -1.642 1
1 240 . 6 1 1 A 27 27 SER N N 27 115.317 115.260 0.057 1
1 241 . 6 1 1 A 28 28 ARG H H 28 8.155 8.662 -0.507 1
1 242 . 6 1 1 A 28 28 ARG HA H 28 4.258 5.084 -0.826 1
1 250 . 6 1 1 A 28 28 ARG CA C 28 56.348 54.251 2.097 1
1 251 . 6 1 1 A 28 28 ARG N N 28 121.519 119.327 2.192 1
1 252 . 6 1 1 A 29 29 ASP H H 29 8.167 9.345 -1.178 1
1 255 . 6 1 1 A 29 29 ASP CB C 29 38.462 39.894 -1.432 1
1 256 . 6 1 1 A 29 29 ASP N N 29 118.393 119.578 -1.185 1
1 257 . 6 1 1 A 30 30 TYR H H 30 7.910 8.840 -0.930 1
1 258 . 6 1 1 A 30 30 TYR HA H 30 4.484 4.153 0.331 1
1 265 . 6 1 1 A 30 30 TYR CA C 30 58.097 58.994 -0.897 1
1 266 . 6 1 1 A 30 30 TYR CB C 30 38.759 36.139 2.620 1
1 267 . 6 1 1 A 30 30 TYR N N 30 119.859 121.866 -2.007 1
1 268 . 6 1 1 A 31 31 ASN H H 31 8.152 8.547 -0.395 1
1 269 . 6 1 1 A 31 31 ASN HA H 31 4.658 4.476 0.182 1
1 274 . 6 1 1 A 31 31 ASN CA C 31 53.245 53.856 -0.611 1
1 275 . 6 1 1 A 31 31 ASN CB C 31 39.156 36.962 2.194 1
1 276 . 6 1 1 A 31 31 ASN N N 31 119.343 116.479 2.864 1
1 13 . 7 1 1 A 2 2 ARG H H 2 8.864 8.712 0.152 1
1 14 . 7 1 1 A 2 2 ARG HA H 2 4.393 4.628 -0.235 1
1 22 . 7 1 1 A 2 2 ARG CA C 2 56.327 55.174 1.153 1
1 23 . 7 1 1 A 2 2 ARG N N 2 124.285 126.467 -2.182 1
1 24 . 7 1 1 A 3 3 SER H H 3 8.495 8.168 0.327 1
1 25 . 7 1 1 A 3 3 SER HA H 3 4.491 4.551 -0.060 1
1 28 . 7 1 1 A 3 3 SER CB C 3 64.117 64.091 0.026 1
1 29 . 7 1 1 A 3 3 SER N N 3 117.670 115.555 2.115 1
1 30 . 7 1 1 A 4 4 ARG H H 4 8.672 7.705 0.967 1
1 31 . 7 1 1 A 4 4 ARG HA H 4 4.314 4.225 0.089 1
1 39 . 7 1 1 A 4 4 ARG CA C 4 56.779 57.286 -0.507 1
1 40 . 7 1 1 A 4 4 ARG N N 4 123.739 120.218 3.521 1
1 41 . 7 1 1 A 5 5 LYS H H 5 8.328 7.849 0.479 1
1 42 . 7 1 1 A 5 5 LYS HA H 5 4.127 4.176 -0.049 1
1 49 . 7 1 1 A 5 5 LYS CA C 5 57.431 58.948 -1.517 1
1 51 . 7 1 1 A 5 5 LYS N N 5 120.706 119.000 1.706 1
1 52 . 7 1 1 A 6 6 ASN H H 6 8.115 8.280 -0.165 1
1 57 . 7 1 1 A 6 6 ASN CA C 6 53.066 54.292 -1.226 1
1 58 . 7 1 1 A 6 6 ASN CB C 6 39.187 37.772 1.415 1
1 59 . 7 1 1 A 6 6 ASN N N 6 117.807 116.601 1.206 1
1 60 . 7 1 1 A 7 7 GLY H H 7 8.499 8.699 -0.200 1
1 61 . 7 1 1 A 7 7 GLY HA2 H 7 4.051 4.124 -0.073 1
1 62 . 7 1 1 A 7 7 GLY HA3 H 7 4.051 4.297 -0.246 1
1 63 . 7 1 1 A 7 7 GLY CA C 7 46.153 45.693 0.460 1
1 64 . 7 1 1 A 7 7 GLY N N 7 108.804 112.451 -3.647 1
1 65 . 7 1 1 A 8 8 ILE H H 8 8.496 7.903 0.593 1
1 75 . 7 1 1 A 8 8 ILE CB C 8 38.082 39.481 -1.399 1
1 76 . 7 1 1 A 8 8 ILE N N 8 121.041 121.593 -0.552 1
1 77 . 7 1 1 A 9 9 GLY H H 9 8.656 8.510 0.146 1
1 78 . 7 1 1 A 9 9 GLY HA2 H 9 3.671 3.741 -0.070 1
1 79 . 7 1 1 A 9 9 GLY HA3 H 9 3.671 3.769 -0.098 1
1 80 . 7 1 1 A 9 9 GLY CA C 9 47.324 47.191 0.133 1
1 81 . 7 1 1 A 9 9 GLY N N 9 108.767 109.451 -0.684 1
1 82 . 7 1 1 A 10 10 TYR H H 10 7.987 8.236 -0.249 1
1 83 . 7 1 1 A 10 10 TYR HA H 10 4.269 4.407 -0.138 1
1 90 . 7 1 1 A 10 10 TYR CA C 10 60.713 60.080 0.633 1
1 91 . 7 1 1 A 10 10 TYR CB C 10 38.354 37.600 0.754 1
1 92 . 7 1 1 A 10 10 TYR N N 10 121.261 120.079 1.182 1
1 93 . 7 1 1 A 11 11 ALA H H 11 8.020 7.536 0.484 1
1 94 . 7 1 1 A 11 11 ALA HA H 11 4.040 3.629 0.411 1
1 98 . 7 1 1 A 11 11 ALA CA C 11 55.355 54.737 0.618 1
1 99 . 7 1 1 A 11 11 ALA CB C 11 18.737 17.491 1.246 1
1 100 . 7 1 1 A 11 11 ALA N N 11 122.295 123.459 -1.164 1
1 101 . 7 1 1 A 12 12 ILE H H 12 8.308 7.667 0.641 1
1 102 . 7 1 1 A 12 12 ILE HA H 12 3.732 3.901 -0.169 1
1 111 . 7 1 1 A 12 12 ILE CB C 12 37.611 37.700 -0.089 1
1 112 . 7 1 1 A 12 12 ILE N N 12 116.853 119.739 -2.886 1
1 113 . 7 1 1 A 13 13 GLY H H 13 8.171 7.909 0.262 1
1 114 . 7 1 1 A 13 13 GLY HA2 H 13 3.744 3.785 -0.041 1
1 115 . 7 1 1 A 13 13 GLY HA3 H 13 3.744 3.808 -0.064 1
1 116 . 7 1 1 A 13 13 GLY CA C 13 47.343 47.204 0.139 1
1 117 . 7 1 1 A 13 13 GLY N N 13 107.089 109.625 -2.536 1
1 118 . 7 1 1 A 14 14 TYR H H 14 8.223 8.193 0.030 1
1 119 . 7 1 1 A 14 14 TYR HA H 14 4.147 4.100 0.047 1
1 126 . 7 1 1 A 14 14 TYR CB C 14 38.415 39.065 -0.650 1
1 127 . 7 1 1 A 14 14 TYR N N 14 122.935 123.216 -0.281 1
1 128 . 7 1 1 A 15 15 ALA H H 15 8.345 7.876 0.469 1
1 129 . 7 1 1 A 15 15 ALA HA H 15 3.986 3.611 0.375 1
1 133 . 7 1 1 A 15 15 ALA CA C 15 55.067 54.819 0.248 1
1 134 . 7 1 1 A 15 15 ALA N N 15 121.882 121.285 0.597 1
1 135 . 7 1 1 A 16 16 PHE H H 16 8.668 8.743 -0.075 1
1 136 . 7 1 1 A 16 16 PHE HA H 16 4.138 4.224 -0.086 1
1 143 . 7 1 1 A 16 16 PHE CA C 16 61.116 60.842 0.274 1
1 144 . 7 1 1 A 16 16 PHE CB C 16 38.857 39.303 -0.446 1
1 145 . 7 1 1 A 16 16 PHE N N 16 116.563 119.286 -2.723 1
1 146 . 7 1 1 A 17 17 GLY H H 17 8.163 8.969 -0.806 1
1 147 . 7 1 1 A 17 17 GLY HA2 H 17 3.891 3.756 0.135 1
1 148 . 7 1 1 A 17 17 GLY HA3 H 17 3.891 3.840 0.051 1
1 149 . 7 1 1 A 17 17 GLY N N 17 105.893 106.795 -0.902 1
1 150 . 7 1 1 A 18 18 ALA H H 18 7.842 7.662 0.180 1
1 151 . 7 1 1 A 18 18 ALA HA H 18 4.035 3.989 0.046 1
1 155 . 7 1 1 A 18 18 ALA CA C 18 55.037 54.692 0.345 1
1 156 . 7 1 1 A 18 18 ALA CB C 18 18.223 18.623 -0.400 1
1 157 . 7 1 1 A 18 18 ALA N N 18 122.050 124.617 -2.567 1
1 158 . 7 1 1 A 19 19 VAL H H 19 8.010 7.911 0.099 1
1 159 . 7 1 1 A 19 19 VAL HA H 19 3.549 3.756 -0.207 1
1 167 . 7 1 1 A 19 19 VAL CA C 19 66.571 65.140 1.431 1
1 168 . 7 1 1 A 19 19 VAL CB C 19 31.436 31.572 -0.136 1
1 171 . 7 1 1 A 19 19 VAL N N 19 118.184 116.229 1.955 1
1 172 . 7 1 1 A 20 20 GLU H H 20 8.339 8.657 -0.318 1
1 173 . 7 1 1 A 20 20 GLU HA H 20 3.666 4.041 -0.375 1
1 178 . 7 1 1 A 20 20 GLU CA C 20 60.103 59.419 0.684 1
1 180 . 7 1 1 A 20 20 GLU N N 20 118.704 121.036 -2.332 1
1 181 . 7 1 1 A 21 21 ARG H H 21 7.939 8.222 -0.283 1
1 182 . 7 1 1 A 21 21 ARG HA H 21 3.935 4.010 -0.075 1
1 190 . 7 1 1 A 21 21 ARG N N 21 116.955 120.721 -3.766 1
1 191 . 7 1 1 A 22 22 ALA H H 22 7.784 7.454 0.330 1
1 192 . 7 1 1 A 22 22 ALA HA H 22 4.166 4.075 0.091 1
1 196 . 7 1 1 A 22 22 ALA CA C 22 54.645 55.154 -0.509 1
1 197 . 7 1 1 A 22 22 ALA CB C 22 18.724 18.409 0.315 1
1 198 . 7 1 1 A 22 22 ALA N N 22 121.252 122.093 -0.841 1
1 199 . 7 1 1 A 23 23 VAL H H 23 8.086 7.661 0.425 1
1 200 . 7 1 1 A 23 23 VAL HA H 23 3.872 3.795 0.077 1
1 208 . 7 1 1 A 23 23 VAL CA C 23 64.928 65.390 -0.462 1
1 209 . 7 1 1 A 23 23 VAL CB C 23 32.451 31.785 0.666 1
1 212 . 7 1 1 A 23 23 VAL N N 23 114.516 118.414 -3.898 1
1 213 . 7 1 1 A 24 24 LEU H H 24 8.060 7.314 0.746 1
1 223 . 7 1 1 A 24 24 LEU N N 24 118.014 118.628 -0.614 1
1 224 . 7 1 1 A 25 25 GLY H H 25 7.880 7.490 0.390 1
1 225 . 7 1 1 A 25 25 GLY HA2 H 25 3.949 4.086 -0.137 1
1 226 . 7 1 1 A 25 25 GLY HA3 H 25 3.966 4.086 -0.120 1
1 227 . 7 1 1 A 25 25 GLY CA C 25 45.959 44.852 1.107 1
1 228 . 7 1 1 A 25 25 GLY N N 25 106.969 106.829 0.140 1
1 229 . 7 1 1 A 26 26 GLY H H 26 8.123 8.625 -0.502 1
1 230 . 7 1 1 A 26 26 GLY HA2 H 26 3.912 4.083 -0.171 1
1 231 . 7 1 1 A 26 26 GLY HA3 H 26 4.002 4.089 -0.087 1
1 232 . 7 1 1 A 26 26 GLY CA C 26 45.691 45.532 0.159 1
1 233 . 7 1 1 A 26 26 GLY N N 26 108.223 110.751 -2.528 1
1 234 . 7 1 1 A 27 27 SER H H 27 8.201 7.921 0.280 1
1 235 . 7 1 1 A 27 27 SER HA H 27 4.353 4.839 -0.486 1
1 238 . 7 1 1 A 27 27 SER CA C 27 59.117 57.666 1.451 1
1 239 . 7 1 1 A 27 27 SER CB C 27 63.770 65.205 -1.435 1
1 240 . 7 1 1 A 27 27 SER N N 27 115.317 111.813 3.504 1
1 241 . 7 1 1 A 28 28 ARG H H 28 8.155 8.859 -0.704 1
1 242 . 7 1 1 A 28 28 ARG HA H 28 4.258 4.699 -0.441 1
1 250 . 7 1 1 A 28 28 ARG CA C 28 56.348 55.250 1.098 1
1 251 . 7 1 1 A 28 28 ARG N N 28 121.519 120.105 1.414 1
1 252 . 7 1 1 A 29 29 ASP H H 29 8.167 8.529 -0.362 1
1 255 . 7 1 1 A 29 29 ASP CB C 29 38.462 41.752 -3.290 1
1 256 . 7 1 1 A 29 29 ASP N N 29 118.393 121.303 -2.910 1
1 257 . 7 1 1 A 30 30 TYR H H 30 7.910 8.004 -0.094 1
1 258 . 7 1 1 A 30 30 TYR HA H 30 4.484 4.833 -0.349 1
1 265 . 7 1 1 A 30 30 TYR CA C 30 58.097 56.275 1.822 1
1 266 . 7 1 1 A 30 30 TYR CB C 30 38.759 37.901 0.858 1
1 267 . 7 1 1 A 30 30 TYR N N 30 119.859 119.714 0.145 1
1 268 . 7 1 1 A 31 31 ASN H H 31 8.152 8.188 -0.036 1
1 269 . 7 1 1 A 31 31 ASN HA H 31 4.658 4.298 0.360 1
1 274 . 7 1 1 A 31 31 ASN CA C 31 53.245 54.650 -1.405 1
1 275 . 7 1 1 A 31 31 ASN CB C 31 39.156 37.009 2.147 1
1 276 . 7 1 1 A 31 31 ASN N N 31 119.343 114.363 4.980 1
1 13 . 8 1 1 A 2 2 ARG H H 2 8.864 8.776 0.088 1
1 14 . 8 1 1 A 2 2 ARG HA H 2 4.393 4.748 -0.355 1
1 22 . 8 1 1 A 2 2 ARG CA C 2 56.327 55.398 0.929 1
1 23 . 8 1 1 A 2 2 ARG N N 2 124.285 122.351 1.934 1
1 24 . 8 1 1 A 3 3 SER H H 3 8.495 8.283 0.212 1
1 25 . 8 1 1 A 3 3 SER HA H 3 4.491 4.707 -0.216 1
1 28 . 8 1 1 A 3 3 SER CB C 3 64.117 64.648 -0.531 1
1 29 . 8 1 1 A 3 3 SER N N 3 117.670 115.924 1.746 1
1 30 . 8 1 1 A 4 4 ARG H H 4 8.672 8.007 0.665 1
1 31 . 8 1 1 A 4 4 ARG HA H 4 4.314 4.298 0.016 1
1 39 . 8 1 1 A 4 4 ARG CA C 4 56.779 57.128 -0.349 1
1 40 . 8 1 1 A 4 4 ARG N N 4 123.739 120.251 3.488 1
1 41 . 8 1 1 A 5 5 LYS H H 5 8.328 7.473 0.855 1
1 42 . 8 1 1 A 5 5 LYS HA H 5 4.127 4.489 -0.362 1
1 49 . 8 1 1 A 5 5 LYS CA C 5 57.431 55.942 1.489 1
1 51 . 8 1 1 A 5 5 LYS N N 5 120.706 116.689 4.017 1
1 52 . 8 1 1 A 6 6 ASN H H 6 8.115 7.862 0.253 1
1 57 . 8 1 1 A 6 6 ASN CA C 6 53.066 52.202 0.864 1
1 58 . 8 1 1 A 6 6 ASN CB C 6 39.187 37.660 1.527 1
1 59 . 8 1 1 A 6 6 ASN N N 6 117.807 119.007 -1.200 1
1 60 . 8 1 1 A 7 7 GLY H H 7 8.499 8.386 0.113 1
1 61 . 8 1 1 A 7 7 GLY HA2 H 7 4.051 4.122 -0.071 1
1 62 . 8 1 1 A 7 7 GLY HA3 H 7 4.051 4.276 -0.225 1
1 63 . 8 1 1 A 7 7 GLY CA C 7 46.153 45.726 0.427 1
1 64 . 8 1 1 A 7 7 GLY N N 7 108.804 113.700 -4.896 1
1 65 . 8 1 1 A 8 8 ILE H H 8 8.496 7.969 0.527 1
1 75 . 8 1 1 A 8 8 ILE CB C 8 38.082 39.491 -1.409 1
1 76 . 8 1 1 A 8 8 ILE N N 8 121.041 121.901 -0.860 1
1 77 . 8 1 1 A 9 9 GLY H H 9 8.656 8.504 0.152 1
1 78 . 8 1 1 A 9 9 GLY HA2 H 9 3.671 3.742 -0.071 1
1 79 . 8 1 1 A 9 9 GLY HA3 H 9 3.671 3.768 -0.097 1
1 80 . 8 1 1 A 9 9 GLY CA C 9 47.324 47.151 0.173 1
1 81 . 8 1 1 A 9 9 GLY N N 9 108.767 109.436 -0.669 1
1 82 . 8 1 1 A 10 10 TYR H H 10 7.987 8.187 -0.200 1
1 83 . 8 1 1 A 10 10 TYR HA H 10 4.269 4.414 -0.145 1
1 90 . 8 1 1 A 10 10 TYR CA C 10 60.713 59.986 0.727 1
1 91 . 8 1 1 A 10 10 TYR CB C 10 38.354 37.593 0.761 1
1 92 . 8 1 1 A 10 10 TYR N N 10 121.261 120.070 1.191 1
1 93 . 8 1 1 A 11 11 ALA H H 11 8.020 7.601 0.419 1
1 94 . 8 1 1 A 11 11 ALA HA H 11 4.040 3.551 0.489 1
1 98 . 8 1 1 A 11 11 ALA CA C 11 55.355 54.729 0.626 1
1 99 . 8 1 1 A 11 11 ALA CB C 11 18.737 17.696 1.041 1
1 100 . 8 1 1 A 11 11 ALA N N 11 122.295 123.619 -1.324 1
1 101 . 8 1 1 A 12 12 ILE H H 12 8.308 7.569 0.739 1
1 102 . 8 1 1 A 12 12 ILE HA H 12 3.732 3.958 -0.226 1
1 111 . 8 1 1 A 12 12 ILE CB C 12 37.611 37.837 -0.226 1
1 112 . 8 1 1 A 12 12 ILE N N 12 116.853 118.930 -2.077 1
1 113 . 8 1 1 A 13 13 GLY H H 13 8.171 8.391 -0.220 1
1 114 . 8 1 1 A 13 13 GLY HA2 H 13 3.744 3.830 -0.086 1
1 115 . 8 1 1 A 13 13 GLY HA3 H 13 3.744 3.833 -0.089 1
1 116 . 8 1 1 A 13 13 GLY CA C 13 47.343 47.320 0.023 1
1 117 . 8 1 1 A 13 13 GLY N N 13 107.089 109.318 -2.229 1
1 118 . 8 1 1 A 14 14 TYR H H 14 8.223 8.504 -0.281 1
1 119 . 8 1 1 A 14 14 TYR HA H 14 4.147 4.064 0.083 1
1 126 . 8 1 1 A 14 14 TYR CB C 14 38.415 38.690 -0.275 1
1 127 . 8 1 1 A 14 14 TYR N N 14 122.935 123.433 -0.498 1
1 128 . 8 1 1 A 15 15 ALA H H 15 8.345 7.783 0.562 1
1 129 . 8 1 1 A 15 15 ALA HA H 15 3.986 3.646 0.340 1
1 133 . 8 1 1 A 15 15 ALA CA C 15 55.067 54.865 0.202 1
1 134 . 8 1 1 A 15 15 ALA N N 15 121.882 121.297 0.585 1
1 135 . 8 1 1 A 16 16 PHE H H 16 8.668 8.941 -0.273 1
1 136 . 8 1 1 A 16 16 PHE HA H 16 4.138 4.222 -0.084 1
1 143 . 8 1 1 A 16 16 PHE CA C 16 61.116 60.557 0.559 1
1 144 . 8 1 1 A 16 16 PHE CB C 16 38.857 39.458 -0.601 1
1 145 . 8 1 1 A 16 16 PHE N N 16 116.563 119.497 -2.934 1
1 146 . 8 1 1 A 17 17 GLY H H 17 8.163 9.232 -1.069 1
1 147 . 8 1 1 A 17 17 GLY HA2 H 17 3.891 3.894 -0.003 1
1 148 . 8 1 1 A 17 17 GLY HA3 H 17 3.891 3.908 -0.017 1
1 149 . 8 1 1 A 17 17 GLY N N 17 105.893 106.807 -0.914 1
1 150 . 8 1 1 A 18 18 ALA H H 18 7.842 7.722 0.120 1
1 151 . 8 1 1 A 18 18 ALA HA H 18 4.035 3.953 0.082 1
1 155 . 8 1 1 A 18 18 ALA CA C 18 55.037 54.614 0.423 1
1 156 . 8 1 1 A 18 18 ALA CB C 18 18.223 18.351 -0.128 1
1 157 . 8 1 1 A 18 18 ALA N N 18 122.050 124.729 -2.679 1
1 158 . 8 1 1 A 19 19 VAL H H 19 8.010 8.072 -0.062 1
1 159 . 8 1 1 A 19 19 VAL HA H 19 3.549 3.707 -0.158 1
1 167 . 8 1 1 A 19 19 VAL CA C 19 66.571 65.073 1.498 1
1 168 . 8 1 1 A 19 19 VAL CB C 19 31.436 31.430 0.006 1
1 171 . 8 1 1 A 19 19 VAL N N 19 118.184 116.696 1.488 1
1 172 . 8 1 1 A 20 20 GLU H H 20 8.339 8.715 -0.376 1
1 173 . 8 1 1 A 20 20 GLU HA H 20 3.666 4.057 -0.391 1
1 178 . 8 1 1 A 20 20 GLU CA C 20 60.103 59.463 0.640 1
1 180 . 8 1 1 A 20 20 GLU N N 20 118.704 120.550 -1.846 1
1 181 . 8 1 1 A 21 21 ARG H H 21 7.939 8.221 -0.282 1
1 182 . 8 1 1 A 21 21 ARG HA H 21 3.935 4.023 -0.088 1
1 190 . 8 1 1 A 21 21 ARG N N 21 116.955 120.870 -3.915 1
1 191 . 8 1 1 A 22 22 ALA H H 22 7.784 7.924 -0.140 1
1 192 . 8 1 1 A 22 22 ALA HA H 22 4.166 4.095 0.071 1
1 196 . 8 1 1 A 22 22 ALA CA C 22 54.645 54.533 0.112 1
1 197 . 8 1 1 A 22 22 ALA CB C 22 18.724 18.304 0.420 1
1 198 . 8 1 1 A 22 22 ALA N N 22 121.252 121.834 -0.582 1
1 199 . 8 1 1 A 23 23 VAL H H 23 8.086 7.950 0.136 1
1 200 . 8 1 1 A 23 23 VAL HA H 23 3.872 3.741 0.131 1
1 208 . 8 1 1 A 23 23 VAL CA C 23 64.928 66.407 -1.479 1
1 209 . 8 1 1 A 23 23 VAL CB C 23 32.451 31.961 0.490 1
1 212 . 8 1 1 A 23 23 VAL N N 23 114.516 118.303 -3.787 1
1 213 . 8 1 1 A 24 24 LEU H H 24 8.060 8.139 -0.079 1
1 223 . 8 1 1 A 24 24 LEU N N 24 118.014 120.071 -2.057 1
1 224 . 8 1 1 A 25 25 GLY H H 25 7.880 8.321 -0.441 1
1 225 . 8 1 1 A 25 25 GLY HA2 H 25 3.949 3.955 -0.006 1
1 226 . 8 1 1 A 25 25 GLY HA3 H 25 3.966 3.957 0.009 1
1 227 . 8 1 1 A 25 25 GLY CA C 25 45.959 47.004 -1.045 1
1 228 . 8 1 1 A 25 25 GLY N N 25 106.969 108.476 -1.507 1
1 229 . 8 1 1 A 26 26 GLY H H 26 8.123 7.487 0.636 1
1 230 . 8 1 1 A 26 26 GLY HA2 H 26 3.912 4.031 -0.119 1
1 231 . 8 1 1 A 26 26 GLY HA3 H 26 4.002 4.034 -0.032 1
1 232 . 8 1 1 A 26 26 GLY CA C 26 45.691 45.630 0.061 1
1 233 . 8 1 1 A 26 26 GLY N N 26 108.223 106.226 1.997 1
1 234 . 8 1 1 A 27 27 SER H H 27 8.201 8.771 -0.570 1
1 235 . 8 1 1 A 27 27 SER HA H 27 4.353 5.138 -0.785 1
1 238 . 8 1 1 A 27 27 SER CA C 27 59.117 57.351 1.766 1
1 239 . 8 1 1 A 27 27 SER CB C 27 63.770 65.837 -2.067 1
1 240 . 8 1 1 A 27 27 SER N N 27 115.317 118.625 -3.308 1
1 241 . 8 1 1 A 28 28 ARG H H 28 8.155 8.751 -0.596 1
1 242 . 8 1 1 A 28 28 ARG HA H 28 4.258 5.161 -0.903 1
1 250 . 8 1 1 A 28 28 ARG CA C 28 56.348 54.755 1.593 1
1 251 . 8 1 1 A 28 28 ARG N N 28 121.519 119.994 1.525 1
1 252 . 8 1 1 A 29 29 ASP H H 29 8.167 8.677 -0.510 1
1 255 . 8 1 1 A 29 29 ASP CB C 29 38.462 41.343 -2.881 1
1 256 . 8 1 1 A 29 29 ASP N N 29 118.393 122.360 -3.967 1
1 257 . 8 1 1 A 30 30 TYR H H 30 7.910 7.686 0.224 1
1 258 . 8 1 1 A 30 30 TYR HA H 30 4.484 5.017 -0.533 1
1 265 . 8 1 1 A 30 30 TYR CA C 30 58.097 56.569 1.528 1
1 266 . 8 1 1 A 30 30 TYR CB C 30 38.759 41.490 -2.731 1
1 267 . 8 1 1 A 30 30 TYR N N 30 119.859 118.660 1.199 1
1 268 . 8 1 1 A 31 31 ASN H H 31 8.152 8.982 -0.830 1
1 269 . 8 1 1 A 31 31 ASN HA H 31 4.658 5.082 -0.424 1
1 274 . 8 1 1 A 31 31 ASN CA C 31 53.245 51.878 1.367 1
1 275 . 8 1 1 A 31 31 ASN CB C 31 39.156 39.494 -0.338 1
1 276 . 8 1 1 A 31 31 ASN N N 31 119.343 122.779 -3.436 1
1 13 . 9 1 1 A 2 2 ARG H H 2 8.864 8.398 0.466 1
1 14 . 9 1 1 A 2 2 ARG HA H 2 4.393 3.987 0.406 1
1 22 . 9 1 1 A 2 2 ARG CA C 2 56.327 56.915 -0.588 1
1 23 . 9 1 1 A 2 2 ARG N N 2 124.285 115.015 9.270 1
1 24 . 9 1 1 A 3 3 SER H H 3 8.495 8.263 0.232 1
1 25 . 9 1 1 A 3 3 SER HA H 3 4.491 4.555 -0.064 1
1 28 . 9 1 1 A 3 3 SER CB C 3 64.117 65.879 -1.762 1
1 29 . 9 1 1 A 3 3 SER N N 3 117.670 113.110 4.560 1
1 30 . 9 1 1 A 4 4 ARG H H 4 8.672 8.186 0.486 1
1 31 . 9 1 1 A 4 4 ARG HA H 4 4.314 4.192 0.122 1
1 39 . 9 1 1 A 4 4 ARG CA C 4 56.779 58.117 -1.338 1
1 40 . 9 1 1 A 4 4 ARG N N 4 123.739 121.236 2.503 1
1 41 . 9 1 1 A 5 5 LYS H H 5 8.328 7.801 0.527 1
1 42 . 9 1 1 A 5 5 LYS HA H 5 4.127 4.266 -0.139 1
1 49 . 9 1 1 A 5 5 LYS CA C 5 57.431 58.069 -0.638 1
1 51 . 9 1 1 A 5 5 LYS N N 5 120.706 117.729 2.977 1
1 52 . 9 1 1 A 6 6 ASN H H 6 8.115 7.878 0.237 1
1 57 . 9 1 1 A 6 6 ASN CA C 6 53.066 52.864 0.202 1
1 58 . 9 1 1 A 6 6 ASN CB C 6 39.187 41.506 -2.319 1
1 59 . 9 1 1 A 6 6 ASN N N 6 117.807 113.623 4.184 1
1 60 . 9 1 1 A 7 7 GLY H H 7 8.499 8.493 0.006 1
1 61 . 9 1 1 A 7 7 GLY HA2 H 7 4.051 4.231 -0.180 1
1 62 . 9 1 1 A 7 7 GLY HA3 H 7 4.051 4.316 -0.265 1
1 63 . 9 1 1 A 7 7 GLY CA C 7 46.153 45.840 0.313 1
1 64 . 9 1 1 A 7 7 GLY N N 7 108.804 111.426 -2.622 1
1 65 . 9 1 1 A 8 8 ILE H H 8 8.496 9.064 -0.568 1
1 75 . 9 1 1 A 8 8 ILE CB C 8 38.082 37.639 0.443 1
1 76 . 9 1 1 A 8 8 ILE N N 8 121.041 125.805 -4.764 1
1 77 . 9 1 1 A 9 9 GLY H H 9 8.656 8.174 0.482 1
1 78 . 9 1 1 A 9 9 GLY HA2 H 9 3.671 3.969 -0.298 1
1 79 . 9 1 1 A 9 9 GLY HA3 H 9 3.671 4.003 -0.332 1
1 80 . 9 1 1 A 9 9 GLY CA C 9 47.324 45.363 1.961 1
1 81 . 9 1 1 A 9 9 GLY N N 9 108.767 109.978 -1.211 1
1 82 . 9 1 1 A 10 10 TYR H H 10 7.987 8.435 -0.448 1
1 83 . 9 1 1 A 10 10 TYR HA H 10 4.269 4.387 -0.118 1
1 90 . 9 1 1 A 10 10 TYR CA C 10 60.713 60.098 0.615 1
1 91 . 9 1 1 A 10 10 TYR CB C 10 38.354 37.553 0.801 1
1 92 . 9 1 1 A 10 10 TYR N N 10 121.261 119.993 1.268 1
1 93 . 9 1 1 A 11 11 ALA H H 11 8.020 7.325 0.695 1
1 94 . 9 1 1 A 11 11 ALA HA H 11 4.040 3.661 0.379 1
1 98 . 9 1 1 A 11 11 ALA CA C 11 55.355 54.691 0.664 1
1 99 . 9 1 1 A 11 11 ALA CB C 11 18.737 18.013 0.724 1
1 100 . 9 1 1 A 11 11 ALA N N 11 122.295 122.955 -0.660 1
1 101 . 9 1 1 A 12 12 ILE H H 12 8.308 8.034 0.274 1
1 102 . 9 1 1 A 12 12 ILE HA H 12 3.732 3.903 -0.171 1
1 111 . 9 1 1 A 12 12 ILE CB C 12 37.611 37.639 -0.028 1
1 112 . 9 1 1 A 12 12 ILE N N 12 116.853 118.627 -1.774 1
1 113 . 9 1 1 A 13 13 GLY H H 13 8.171 8.215 -0.044 1
1 114 . 9 1 1 A 13 13 GLY HA2 H 13 3.744 3.810 -0.066 1
1 115 . 9 1 1 A 13 13 GLY HA3 H 13 3.744 3.811 -0.067 1
1 116 . 9 1 1 A 13 13 GLY CA C 13 47.343 47.378 -0.035 1
1 117 . 9 1 1 A 13 13 GLY N N 13 107.089 109.437 -2.348 1
1 118 . 9 1 1 A 14 14 TYR H H 14 8.223 8.636 -0.413 1
1 119 . 9 1 1 A 14 14 TYR HA H 14 4.147 4.156 -0.009 1
1 126 . 9 1 1 A 14 14 TYR CB C 14 38.415 38.646 -0.231 1
1 127 . 9 1 1 A 14 14 TYR N N 14 122.935 123.249 -0.314 1
1 128 . 9 1 1 A 15 15 ALA H H 15 8.345 8.225 0.120 1
1 129 . 9 1 1 A 15 15 ALA HA H 15 3.986 4.012 -0.026 1
1 133 . 9 1 1 A 15 15 ALA CA C 15 55.067 55.101 -0.034 1
1 134 . 9 1 1 A 15 15 ALA N N 15 121.882 122.013 -0.131 1
1 135 . 9 1 1 A 16 16 PHE H H 16 8.668 8.580 0.088 1
1 136 . 9 1 1 A 16 16 PHE HA H 16 4.138 4.275 -0.137 1
1 143 . 9 1 1 A 16 16 PHE CA C 16 61.116 60.681 0.435 1
1 144 . 9 1 1 A 16 16 PHE CB C 16 38.857 39.153 -0.296 1
1 145 . 9 1 1 A 16 16 PHE N N 16 116.563 119.055 -2.492 1
1 146 . 9 1 1 A 17 17 GLY H H 17 8.163 9.301 -1.138 1
1 147 . 9 1 1 A 17 17 GLY HA2 H 17 3.891 3.896 -0.005 1
1 148 . 9 1 1 A 17 17 GLY HA3 H 17 3.891 3.908 -0.017 1
1 149 . 9 1 1 A 17 17 GLY N N 17 105.893 106.832 -0.939 1
1 150 . 9 1 1 A 18 18 ALA H H 18 7.842 7.777 0.065 1
1 151 . 9 1 1 A 18 18 ALA HA H 18 4.035 3.891 0.144 1
1 155 . 9 1 1 A 18 18 ALA CA C 18 55.037 54.648 0.389 1
1 156 . 9 1 1 A 18 18 ALA CB C 18 18.223 18.686 -0.463 1
1 157 . 9 1 1 A 18 18 ALA N N 18 122.050 124.505 -2.455 1
1 158 . 9 1 1 A 19 19 VAL H H 19 8.010 7.659 0.351 1
1 159 . 9 1 1 A 19 19 VAL HA H 19 3.549 3.723 -0.174 1
1 167 . 9 1 1 A 19 19 VAL CA C 19 66.571 65.032 1.539 1
1 168 . 9 1 1 A 19 19 VAL CB C 19 31.436 31.499 -0.063 1
1 171 . 9 1 1 A 19 19 VAL N N 19 118.184 115.989 2.195 1
1 172 . 9 1 1 A 20 20 GLU H H 20 8.339 8.707 -0.368 1
1 173 . 9 1 1 A 20 20 GLU HA H 20 3.666 4.044 -0.378 1
1 178 . 9 1 1 A 20 20 GLU CA C 20 60.103 59.404 0.699 1
1 180 . 9 1 1 A 20 20 GLU N N 20 118.704 120.808 -2.104 1
1 181 . 9 1 1 A 21 21 ARG H H 21 7.939 8.699 -0.760 1
1 182 . 9 1 1 A 21 21 ARG HA H 21 3.935 4.012 -0.077 1
1 190 . 9 1 1 A 21 21 ARG N N 21 116.955 120.788 -3.833 1
1 191 . 9 1 1 A 22 22 ALA H H 22 7.784 7.881 -0.097 1
1 192 . 9 1 1 A 22 22 ALA HA H 22 4.166 4.074 0.092 1
1 196 . 9 1 1 A 22 22 ALA CA C 22 54.645 54.933 -0.288 1
1 197 . 9 1 1 A 22 22 ALA CB C 22 18.724 18.645 0.079 1
1 198 . 9 1 1 A 22 22 ALA N N 22 121.252 121.832 -0.580 1
1 199 . 9 1 1 A 23 23 VAL H H 23 8.086 7.807 0.279 1
1 200 . 9 1 1 A 23 23 VAL HA H 23 3.872 3.865 0.007 1
1 208 . 9 1 1 A 23 23 VAL CA C 23 64.928 65.437 -0.509 1
1 209 . 9 1 1 A 23 23 VAL CB C 23 32.451 31.701 0.750 1
1 212 . 9 1 1 A 23 23 VAL N N 23 114.516 118.776 -4.260 1
1 213 . 9 1 1 A 24 24 LEU H H 24 8.060 7.366 0.694 1
1 223 . 9 1 1 A 24 24 LEU N N 24 118.014 118.405 -0.391 1
1 224 . 9 1 1 A 25 25 GLY H H 25 7.880 8.088 -0.208 1
1 225 . 9 1 1 A 25 25 GLY HA2 H 25 3.949 4.160 -0.211 1
1 226 . 9 1 1 A 25 25 GLY HA3 H 25 3.966 4.161 -0.195 1
1 227 . 9 1 1 A 25 25 GLY CA C 25 45.959 45.715 0.244 1
1 228 . 9 1 1 A 25 25 GLY N N 25 106.969 106.997 -0.028 1
1 229 . 9 1 1 A 26 26 GLY H H 26 8.123 7.784 0.339 1
1 230 . 9 1 1 A 26 26 GLY HA2 H 26 3.912 4.130 -0.218 1
1 231 . 9 1 1 A 26 26 GLY HA3 H 26 4.002 4.132 -0.130 1
1 232 . 9 1 1 A 26 26 GLY CA C 26 45.691 45.607 0.084 1
1 233 . 9 1 1 A 26 26 GLY N N 26 108.223 107.304 0.919 1
1 234 . 9 1 1 A 27 27 SER H H 27 8.201 8.710 -0.509 1
1 235 . 9 1 1 A 27 27 SER HA H 27 4.353 5.057 -0.704 1
1 238 . 9 1 1 A 27 27 SER CA C 27 59.117 57.659 1.458 1
1 239 . 9 1 1 A 27 27 SER CB C 27 63.770 65.610 -1.840 1
1 240 . 9 1 1 A 27 27 SER N N 27 115.317 117.888 -2.571 1
1 241 . 9 1 1 A 28 28 ARG H H 28 8.155 8.741 -0.586 1
1 242 . 9 1 1 A 28 28 ARG HA H 28 4.258 4.700 -0.442 1
1 250 . 9 1 1 A 28 28 ARG CA C 28 56.348 55.185 1.163 1
1 251 . 9 1 1 A 28 28 ARG N N 28 121.519 119.472 2.047 1
1 252 . 9 1 1 A 29 29 ASP H H 29 8.167 8.355 -0.188 1
1 255 . 9 1 1 A 29 29 ASP CB C 29 38.462 41.083 -2.621 1
1 256 . 9 1 1 A 29 29 ASP N N 29 118.393 121.478 -3.085 1
1 257 . 9 1 1 A 30 30 TYR H H 30 7.910 7.802 0.108 1
1 258 . 9 1 1 A 30 30 TYR HA H 30 4.484 4.825 -0.341 1
1 265 . 9 1 1 A 30 30 TYR CA C 30 58.097 59.024 -0.927 1
1 266 . 9 1 1 A 30 30 TYR CB C 30 38.759 40.026 -1.267 1
1 267 . 9 1 1 A 30 30 TYR N N 30 119.859 113.479 6.380 1
1 268 . 9 1 1 A 31 31 ASN H H 31 8.152 8.483 -0.331 1
1 269 . 9 1 1 A 31 31 ASN HA H 31 4.658 5.089 -0.431 1
1 274 . 9 1 1 A 31 31 ASN CA C 31 53.245 51.922 1.323 1
1 275 . 9 1 1 A 31 31 ASN CB C 31 39.156 39.563 -0.407 1
1 276 . 9 1 1 A 31 31 ASN N N 31 119.343 116.111 3.232 1
1 13 . 10 1 1 A 2 2 ARG H H 2 8.864 7.896 0.968 1
1 14 . 10 1 1 A 2 2 ARG HA H 2 4.393 4.521 -0.128 1
1 22 . 10 1 1 A 2 2 ARG CA C 2 56.327 55.209 1.118 1
1 23 . 10 1 1 A 2 2 ARG N N 2 124.285 116.883 7.402 1
1 24 . 10 1 1 A 3 3 SER H H 3 8.495 8.068 0.427 1
1 25 . 10 1 1 A 3 3 SER HA H 3 4.491 4.229 0.262 1
1 28 . 10 1 1 A 3 3 SER CB C 3 64.117 62.937 1.180 1
1 29 . 10 1 1 A 3 3 SER N N 3 117.670 113.761 3.909 1
1 30 . 10 1 1 A 4 4 ARG H H 4 8.672 7.855 0.817 1
1 31 . 10 1 1 A 4 4 ARG HA H 4 4.314 4.272 0.042 1
1 39 . 10 1 1 A 4 4 ARG CA C 4 56.779 57.773 -0.994 1
1 40 . 10 1 1 A 4 4 ARG N N 4 123.739 121.361 2.378 1
1 41 . 10 1 1 A 5 5 LYS H H 5 8.328 7.738 0.590 1
1 42 . 10 1 1 A 5 5 LYS HA H 5 4.127 4.155 -0.028 1
1 49 . 10 1 1 A 5 5 LYS CA C 5 57.431 58.172 -0.741 1
1 51 . 10 1 1 A 5 5 LYS N N 5 120.706 118.514 2.192 1
1 52 . 10 1 1 A 6 6 ASN H H 6 8.115 7.917 0.198 1
1 57 . 10 1 1 A 6 6 ASN CA C 6 53.066 52.189 0.877 1
1 58 . 10 1 1 A 6 6 ASN CB C 6 39.187 40.825 -1.638 1
1 59 . 10 1 1 A 6 6 ASN N N 6 117.807 116.327 1.480 1
1 60 . 10 1 1 A 7 7 GLY H H 7 8.499 8.545 -0.046 1
1 61 . 10 1 1 A 7 7 GLY HA2 H 7 4.051 4.042 0.009 1
1 62 . 10 1 1 A 7 7 GLY HA3 H 7 4.051 4.047 0.004 1
1 63 . 10 1 1 A 7 7 GLY CA C 7 46.153 45.667 0.486 1
1 64 . 10 1 1 A 7 7 GLY N N 7 108.804 111.515 -2.711 1
1 65 . 10 1 1 A 8 8 ILE H H 8 8.496 8.318 0.178 1
1 75 . 10 1 1 A 8 8 ILE CB C 8 38.082 38.872 -0.790 1
1 76 . 10 1 1 A 8 8 ILE N N 8 121.041 121.385 -0.344 1
1 77 . 10 1 1 A 9 9 GLY H H 9 8.656 8.492 0.164 1
1 78 . 10 1 1 A 9 9 GLY HA2 H 9 3.671 3.723 -0.052 1
1 79 . 10 1 1 A 9 9 GLY HA3 H 9 3.671 3.744 -0.073 1
1 80 . 10 1 1 A 9 9 GLY CA C 9 47.324 47.389 -0.065 1
1 81 . 10 1 1 A 9 9 GLY N N 9 108.767 109.397 -0.630 1
1 82 . 10 1 1 A 10 10 TYR H H 10 7.987 8.254 -0.267 1
1 83 . 10 1 1 A 10 10 TYR HA H 10 4.269 4.335 -0.066 1
1 90 . 10 1 1 A 10 10 TYR CA C 10 60.713 60.380 0.333 1
1 91 . 10 1 1 A 10 10 TYR CB C 10 38.354 37.812 0.542 1
1 92 . 10 1 1 A 10 10 TYR N N 10 121.261 120.863 0.398 1
1 93 . 10 1 1 A 11 11 ALA H H 11 8.020 7.966 0.054 1
1 94 . 10 1 1 A 11 11 ALA HA H 11 4.040 3.304 0.736 1
1 98 . 10 1 1 A 11 11 ALA CA C 11 55.355 54.659 0.696 1
1 99 . 10 1 1 A 11 11 ALA CB C 11 18.737 18.087 0.650 1
1 100 . 10 1 1 A 11 11 ALA N N 11 122.295 123.480 -1.185 1
1 101 . 10 1 1 A 12 12 ILE H H 12 8.308 7.615 0.693 1
1 102 . 10 1 1 A 12 12 ILE HA H 12 3.732 3.868 -0.136 1
1 111 . 10 1 1 A 12 12 ILE CB C 12 37.611 37.672 -0.061 1
1 112 . 10 1 1 A 12 12 ILE N N 12 116.853 119.058 -2.205 1
1 113 . 10 1 1 A 13 13 GLY H H 13 8.171 7.850 0.321 1
1 114 . 10 1 1 A 13 13 GLY HA2 H 13 3.744 3.786 -0.042 1
1 115 . 10 1 1 A 13 13 GLY HA3 H 13 3.744 3.804 -0.060 1
1 116 . 10 1 1 A 13 13 GLY CA C 13 47.343 47.210 0.133 1
1 117 . 10 1 1 A 13 13 GLY N N 13 107.089 109.444 -2.355 1
1 118 . 10 1 1 A 14 14 TYR H H 14 8.223 8.436 -0.213 1
1 119 . 10 1 1 A 14 14 TYR HA H 14 4.147 4.086 0.061 1
1 126 . 10 1 1 A 14 14 TYR CB C 14 38.415 38.879 -0.464 1
1 127 . 10 1 1 A 14 14 TYR N N 14 122.935 123.144 -0.209 1
1 128 . 10 1 1 A 15 15 ALA H H 15 8.345 7.960 0.385 1
1 129 . 10 1 1 A 15 15 ALA HA H 15 3.986 3.583 0.403 1
1 133 . 10 1 1 A 15 15 ALA CA C 15 55.067 54.808 0.259 1
1 134 . 10 1 1 A 15 15 ALA N N 15 121.882 121.089 0.793 1
1 135 . 10 1 1 A 16 16 PHE H H 16 8.668 8.536 0.132 1
1 136 . 10 1 1 A 16 16 PHE HA H 16 4.138 4.217 -0.079 1
1 143 . 10 1 1 A 16 16 PHE CA C 16 61.116 60.889 0.227 1
1 144 . 10 1 1 A 16 16 PHE CB C 16 38.857 39.207 -0.350 1
1 145 . 10 1 1 A 16 16 PHE N N 16 116.563 119.374 -2.811 1
1 146 . 10 1 1 A 17 17 GLY H H 17 8.163 9.200 -1.037 1
1 147 . 10 1 1 A 17 17 GLY HA2 H 17 3.891 3.909 -0.018 1
1 148 . 10 1 1 A 17 17 GLY HA3 H 17 3.891 3.914 -0.023 1
1 149 . 10 1 1 A 17 17 GLY N N 17 105.893 106.842 -0.949 1
1 150 . 10 1 1 A 18 18 ALA H H 18 7.842 7.941 -0.099 1
1 151 . 10 1 1 A 18 18 ALA HA H 18 4.035 3.984 0.051 1
1 155 . 10 1 1 A 18 18 ALA CA C 18 55.037 54.756 0.281 1
1 156 . 10 1 1 A 18 18 ALA CB C 18 18.223 18.799 -0.576 1
1 157 . 10 1 1 A 18 18 ALA N N 18 122.050 124.495 -2.445 1
1 158 . 10 1 1 A 19 19 VAL H H 19 8.010 7.628 0.382 1
1 159 . 10 1 1 A 19 19 VAL HA H 19 3.549 3.722 -0.173 1
1 167 . 10 1 1 A 19 19 VAL CA C 19 66.571 65.061 1.510 1
1 168 . 10 1 1 A 19 19 VAL CB C 19 31.436 31.485 -0.049 1
1 171 . 10 1 1 A 19 19 VAL N N 19 118.184 116.511 1.673 1
1 172 . 10 1 1 A 20 20 GLU H H 20 8.339 8.467 -0.128 1
1 173 . 10 1 1 A 20 20 GLU HA H 20 3.666 4.042 -0.376 1
1 178 . 10 1 1 A 20 20 GLU CA C 20 60.103 59.465 0.638 1
1 180 . 10 1 1 A 20 20 GLU N N 20 118.704 120.584 -1.880 1
1 181 . 10 1 1 A 21 21 ARG H H 21 7.939 8.624 -0.685 1
1 182 . 10 1 1 A 21 21 ARG HA H 21 3.935 4.036 -0.101 1
1 190 . 10 1 1 A 21 21 ARG N N 21 116.955 120.757 -3.802 1
1 191 . 10 1 1 A 22 22 ALA H H 22 7.784 7.818 -0.034 1
1 192 . 10 1 1 A 22 22 ALA HA H 22 4.166 4.047 0.119 1
1 196 . 10 1 1 A 22 22 ALA CA C 22 54.645 55.229 -0.584 1
1 197 . 10 1 1 A 22 22 ALA CB C 22 18.724 18.484 0.240 1
1 198 . 10 1 1 A 22 22 ALA N N 22 121.252 122.038 -0.786 1
1 199 . 10 1 1 A 23 23 VAL H H 23 8.086 8.041 0.045 1
1 200 . 10 1 1 A 23 23 VAL HA H 23 3.872 3.671 0.201 1
1 208 . 10 1 1 A 23 23 VAL CA C 23 64.928 65.977 -1.049 1
1 209 . 10 1 1 A 23 23 VAL CB C 23 32.451 31.833 0.618 1
1 212 . 10 1 1 A 23 23 VAL N N 23 114.516 118.681 -4.165 1
1 213 . 10 1 1 A 24 24 LEU H H 24 8.060 7.522 0.538 1
1 223 . 10 1 1 A 24 24 LEU N N 24 118.014 118.571 -0.557 1
1 224 . 10 1 1 A 25 25 GLY H H 25 7.880 8.566 -0.686 1
1 225 . 10 1 1 A 25 25 GLY HA2 H 25 3.949 3.876 0.073 1
1 226 . 10 1 1 A 25 25 GLY HA3 H 25 3.966 3.877 0.089 1
1 227 . 10 1 1 A 25 25 GLY CA C 25 45.959 47.011 -1.052 1
1 228 . 10 1 1 A 25 25 GLY N N 25 106.969 108.674 -1.705 1
1 229 . 10 1 1 A 26 26 GLY H H 26 8.123 8.026 0.097 1
1 230 . 10 1 1 A 26 26 GLY HA2 H 26 3.912 4.088 -0.176 1
1 231 . 10 1 1 A 26 26 GLY HA3 H 26 4.002 4.089 -0.087 1
1 232 . 10 1 1 A 26 26 GLY CA C 26 45.691 45.765 -0.074 1
1 233 . 10 1 1 A 26 26 GLY N N 26 108.223 107.287 0.936 1
1 234 . 10 1 1 A 27 27 SER H H 27 8.201 8.751 -0.550 1
1 235 . 10 1 1 A 27 27 SER HA H 27 4.353 5.171 -0.818 1
1 238 . 10 1 1 A 27 27 SER CA C 27 59.117 57.370 1.747 1
1 239 . 10 1 1 A 27 27 SER CB C 27 63.770 65.951 -2.181 1
1 240 . 10 1 1 A 27 27 SER N N 27 115.317 117.855 -2.538 1
1 241 . 10 1 1 A 28 28 ARG H H 28 8.155 8.740 -0.585 1
1 242 . 10 1 1 A 28 28 ARG HA H 28 4.258 4.630 -0.372 1
1 250 . 10 1 1 A 28 28 ARG CA C 28 56.348 55.326 1.022 1
1 251 . 10 1 1 A 28 28 ARG N N 28 121.519 119.506 2.013 1
1 252 . 10 1 1 A 29 29 ASP H H 29 8.167 7.984 0.183 1
1 255 . 10 1 1 A 29 29 ASP CB C 29 38.462 42.742 -4.280 1
1 256 . 10 1 1 A 29 29 ASP N N 29 118.393 117.745 0.648 1
1 257 . 10 1 1 A 30 30 TYR H H 30 7.910 7.622 0.288 1
1 258 . 10 1 1 A 30 30 TYR HA H 30 4.484 4.924 -0.440 1
1 265 . 10 1 1 A 30 30 TYR CA C 30 58.097 56.720 1.377 1
1 266 . 10 1 1 A 30 30 TYR CB C 30 38.759 42.527 -3.768 1
1 267 . 10 1 1 A 30 30 TYR N N 30 119.859 117.411 2.448 1
1 268 . 10 1 1 A 31 31 ASN H H 31 8.152 9.119 -0.967 1
1 269 . 10 1 1 A 31 31 ASN HA H 31 4.658 4.638 0.020 1
1 274 . 10 1 1 A 31 31 ASN CA C 31 53.245 55.725 -2.480 1
1 275 . 10 1 1 A 31 31 ASN CB C 31 39.156 38.552 0.604 1
1 276 . 10 1 1 A 31 31 ASN N N 31 119.343 123.320 -3.977 1
1 13 . 11 1 1 A 2 2 ARG H H 2 8.864 8.916 -0.052 1
1 14 . 11 1 1 A 2 2 ARG HA H 2 4.393 3.791 0.602 1
1 22 . 11 1 1 A 2 2 ARG CA C 2 56.327 56.977 -0.650 1
1 23 . 11 1 1 A 2 2 ARG N N 2 124.285 124.256 0.029 1
1 24 . 11 1 1 A 3 3 SER H H 3 8.495 8.199 0.296 1
1 25 . 11 1 1 A 3 3 SER HA H 3 4.491 4.772 -0.281 1
1 28 . 11 1 1 A 3 3 SER CB C 3 64.117 64.451 -0.334 1
1 29 . 11 1 1 A 3 3 SER N N 3 117.670 112.643 5.027 1
1 30 . 11 1 1 A 4 4 ARG H H 4 8.672 7.952 0.720 1
1 31 . 11 1 1 A 4 4 ARG HA H 4 4.314 4.218 0.096 1
1 39 . 11 1 1 A 4 4 ARG CA C 4 56.779 57.740 -0.961 1
1 40 . 11 1 1 A 4 4 ARG N N 4 123.739 122.079 1.660 1
1 41 . 11 1 1 A 5 5 LYS H H 5 8.328 7.933 0.395 1
1 42 . 11 1 1 A 5 5 LYS HA H 5 4.127 4.144 -0.017 1
1 49 . 11 1 1 A 5 5 LYS CA C 5 57.431 57.669 -0.238 1
1 51 . 11 1 1 A 5 5 LYS N N 5 120.706 118.411 2.295 1
1 52 . 11 1 1 A 6 6 ASN H H 6 8.115 7.808 0.307 1
1 57 . 11 1 1 A 6 6 ASN CA C 6 53.066 52.306 0.760 1
1 58 . 11 1 1 A 6 6 ASN CB C 6 39.187 39.416 -0.229 1
1 59 . 11 1 1 A 6 6 ASN N N 6 117.807 115.773 2.034 1
1 60 . 11 1 1 A 7 7 GLY H H 7 8.499 8.544 -0.045 1
1 61 . 11 1 1 A 7 7 GLY HA2 H 7 4.051 4.138 -0.087 1
1 62 . 11 1 1 A 7 7 GLY HA3 H 7 4.051 4.154 -0.103 1
1 63 . 11 1 1 A 7 7 GLY CA C 7 46.153 44.680 1.473 1
1 64 . 11 1 1 A 7 7 GLY N N 7 108.804 108.476 0.328 1
1 65 . 11 1 1 A 8 8 ILE H H 8 8.496 8.109 0.387 1
1 75 . 11 1 1 A 8 8 ILE CB C 8 38.082 38.963 -0.881 1
1 76 . 11 1 1 A 8 8 ILE N N 8 121.041 122.311 -1.270 1
1 77 . 11 1 1 A 9 9 GLY H H 9 8.656 8.563 0.093 1
1 78 . 11 1 1 A 9 9 GLY HA2 H 9 3.671 3.740 -0.069 1
1 79 . 11 1 1 A 9 9 GLY HA3 H 9 3.671 3.764 -0.093 1
1 80 . 11 1 1 A 9 9 GLY CA C 9 47.324 47.380 -0.056 1
1 81 . 11 1 1 A 9 9 GLY N N 9 108.767 109.458 -0.691 1
1 82 . 11 1 1 A 10 10 TYR H H 10 7.987 8.200 -0.213 1
1 83 . 11 1 1 A 10 10 TYR HA H 10 4.269 4.377 -0.108 1
1 90 . 11 1 1 A 10 10 TYR CA C 10 60.713 60.225 0.488 1
1 91 . 11 1 1 A 10 10 TYR CB C 10 38.354 37.691 0.663 1
1 92 . 11 1 1 A 10 10 TYR N N 10 121.261 120.666 0.595 1
1 93 . 11 1 1 A 11 11 ALA H H 11 8.020 7.771 0.249 1
1 94 . 11 1 1 A 11 11 ALA HA H 11 4.040 3.336 0.704 1
1 98 . 11 1 1 A 11 11 ALA CA C 11 55.355 54.631 0.724 1
1 99 . 11 1 1 A 11 11 ALA CB C 11 18.737 18.289 0.448 1
1 100 . 11 1 1 A 11 11 ALA N N 11 122.295 123.375 -1.080 1
1 101 . 11 1 1 A 12 12 ILE H H 12 8.308 7.631 0.677 1
1 102 . 11 1 1 A 12 12 ILE HA H 12 3.732 3.871 -0.139 1
1 111 . 11 1 1 A 12 12 ILE CB C 12 37.611 37.645 -0.034 1
1 112 . 11 1 1 A 12 12 ILE N N 12 116.853 118.762 -1.909 1
1 113 . 11 1 1 A 13 13 GLY H H 13 8.171 8.230 -0.059 1
1 114 . 11 1 1 A 13 13 GLY HA2 H 13 3.744 3.779 -0.035 1
1 115 . 11 1 1 A 13 13 GLY HA3 H 13 3.744 3.790 -0.046 1
1 116 . 11 1 1 A 13 13 GLY CA C 13 47.343 47.153 0.190 1
1 117 . 11 1 1 A 13 13 GLY N N 13 107.089 109.446 -2.357 1
1 118 . 11 1 1 A 14 14 TYR H H 14 8.223 8.555 -0.332 1
1 119 . 11 1 1 A 14 14 TYR HA H 14 4.147 4.141 0.006 1
1 126 . 11 1 1 A 14 14 TYR CB C 14 38.415 38.667 -0.252 1
1 127 . 11 1 1 A 14 14 TYR N N 14 122.935 123.062 -0.127 1
1 128 . 11 1 1 A 15 15 ALA H H 15 8.345 8.108 0.237 1
1 129 . 11 1 1 A 15 15 ALA HA H 15 3.986 3.754 0.232 1
1 133 . 11 1 1 A 15 15 ALA CA C 15 55.067 54.927 0.140 1
1 134 . 11 1 1 A 15 15 ALA N N 15 121.882 121.588 0.294 1
1 135 . 11 1 1 A 16 16 PHE H H 16 8.668 8.525 0.143 1
1 136 . 11 1 1 A 16 16 PHE HA H 16 4.138 4.230 -0.092 1
1 143 . 11 1 1 A 16 16 PHE CA C 16 61.116 60.942 0.174 1
1 144 . 11 1 1 A 16 16 PHE CB C 16 38.857 39.176 -0.319 1
1 145 . 11 1 1 A 16 16 PHE N N 16 116.563 119.366 -2.803 1
1 146 . 11 1 1 A 17 17 GLY H H 17 8.163 9.007 -0.844 1
1 147 . 11 1 1 A 17 17 GLY HA2 H 17 3.891 3.871 0.020 1
1 148 . 11 1 1 A 17 17 GLY HA3 H 17 3.891 3.896 -0.005 1
1 149 . 11 1 1 A 17 17 GLY N N 17 105.893 106.862 -0.969 1
1 150 . 11 1 1 A 18 18 ALA H H 18 7.842 7.629 0.213 1
1 151 . 11 1 1 A 18 18 ALA HA H 18 4.035 3.946 0.089 1
1 155 . 11 1 1 A 18 18 ALA CA C 18 55.037 54.663 0.374 1
1 156 . 11 1 1 A 18 18 ALA CB C 18 18.223 18.656 -0.433 1
1 157 . 11 1 1 A 18 18 ALA N N 18 122.050 124.552 -2.502 1
1 158 . 11 1 1 A 19 19 VAL H H 19 8.010 7.688 0.322 1
1 159 . 11 1 1 A 19 19 VAL HA H 19 3.549 3.751 -0.202 1
1 167 . 11 1 1 A 19 19 VAL CA C 19 66.571 65.100 1.471 1
1 168 . 11 1 1 A 19 19 VAL CB C 19 31.436 31.495 -0.059 1
1 171 . 11 1 1 A 19 19 VAL N N 19 118.184 116.234 1.950 1
1 172 . 11 1 1 A 20 20 GLU H H 20 8.339 8.372 -0.033 1
1 173 . 11 1 1 A 20 20 GLU HA H 20 3.666 4.021 -0.355 1
1 178 . 11 1 1 A 20 20 GLU CA C 20 60.103 59.441 0.662 1
1 180 . 11 1 1 A 20 20 GLU N N 20 118.704 120.697 -1.993 1
1 181 . 11 1 1 A 21 21 ARG H H 21 7.939 8.278 -0.339 1
1 182 . 11 1 1 A 21 21 ARG HA H 21 3.935 4.015 -0.080 1
1 190 . 11 1 1 A 21 21 ARG N N 21 116.955 120.692 -3.737 1
1 191 . 11 1 1 A 22 22 ALA H H 22 7.784 7.259 0.525 1
1 192 . 11 1 1 A 22 22 ALA HA H 22 4.166 4.054 0.112 1
1 196 . 11 1 1 A 22 22 ALA CA C 22 54.645 55.202 -0.557 1
1 197 . 11 1 1 A 22 22 ALA CB C 22 18.724 18.407 0.317 1
1 198 . 11 1 1 A 22 22 ALA N N 22 121.252 122.023 -0.771 1
1 199 . 11 1 1 A 23 23 VAL H H 23 8.086 7.540 0.546 1
1 200 . 11 1 1 A 23 23 VAL HA H 23 3.872 3.671 0.201 1
1 208 . 11 1 1 A 23 23 VAL CA C 23 64.928 65.845 -0.917 1
1 209 . 11 1 1 A 23 23 VAL CB C 23 32.451 31.834 0.617 1
1 212 . 11 1 1 A 23 23 VAL N N 23 114.516 118.502 -3.986 1
1 213 . 11 1 1 A 24 24 LEU H H 24 8.060 7.496 0.564 1
1 223 . 11 1 1 A 24 24 LEU N N 24 118.014 118.854 -0.840 1
1 224 . 11 1 1 A 25 25 GLY H H 25 7.880 7.892 -0.012 1
1 225 . 11 1 1 A 25 25 GLY HA2 H 25 3.949 4.107 -0.158 1
1 226 . 11 1 1 A 25 25 GLY HA3 H 25 3.966 4.108 -0.142 1
1 227 . 11 1 1 A 25 25 GLY CA C 25 45.959 45.568 0.391 1
1 228 . 11 1 1 A 25 25 GLY N N 25 106.969 104.705 2.264 1
1 229 . 11 1 1 A 26 26 GLY H H 26 8.123 8.185 -0.062 1
1 230 . 11 1 1 A 26 26 GLY HA2 H 26 3.912 4.133 -0.221 1
1 231 . 11 1 1 A 26 26 GLY HA3 H 26 4.002 4.134 -0.132 1
1 232 . 11 1 1 A 26 26 GLY CA C 26 45.691 45.132 0.559 1
1 233 . 11 1 1 A 26 26 GLY N N 26 108.223 108.799 -0.576 1
1 234 . 11 1 1 A 27 27 SER H H 27 8.201 8.751 -0.550 1
1 235 . 11 1 1 A 27 27 SER HA H 27 4.353 4.777 -0.424 1
1 238 . 11 1 1 A 27 27 SER CA C 27 59.117 56.856 2.261 1
1 239 . 11 1 1 A 27 27 SER CB C 27 63.770 66.481 -2.711 1
1 240 . 11 1 1 A 27 27 SER N N 27 115.317 116.909 -1.592 1
1 241 . 11 1 1 A 28 28 ARG H H 28 8.155 8.693 -0.538 1
1 242 . 11 1 1 A 28 28 ARG HA H 28 4.258 4.114 0.144 1
1 250 . 11 1 1 A 28 28 ARG CA C 28 56.348 56.776 -0.428 1
1 251 . 11 1 1 A 28 28 ARG N N 28 121.519 118.264 3.255 1
1 252 . 11 1 1 A 29 29 ASP H H 29 8.167 8.580 -0.413 1
1 255 . 11 1 1 A 29 29 ASP CB C 29 38.462 43.809 -5.347 1
1 256 . 11 1 1 A 29 29 ASP N N 29 118.393 124.712 -6.319 1
1 257 . 11 1 1 A 30 30 TYR H H 30 7.910 7.858 0.052 1
1 258 . 11 1 1 A 30 30 TYR HA H 30 4.484 4.619 -0.135 1
1 265 . 11 1 1 A 30 30 TYR CA C 30 58.097 57.684 0.413 1
1 266 . 11 1 1 A 30 30 TYR CB C 30 38.759 39.394 -0.635 1
1 267 . 11 1 1 A 30 30 TYR N N 30 119.859 115.062 4.797 1
1 268 . 11 1 1 A 31 31 ASN H H 31 8.152 8.242 -0.090 1
1 269 . 11 1 1 A 31 31 ASN HA H 31 4.658 4.408 0.250 1
1 274 . 11 1 1 A 31 31 ASN CA C 31 53.245 54.004 -0.759 1
1 275 . 11 1 1 A 31 31 ASN CB C 31 39.156 37.066 2.090 1
1 276 . 11 1 1 A 31 31 ASN N N 31 119.343 117.898 1.445 1
1 13 . 12 1 1 A 2 2 ARG H H 2 8.864 7.914 0.950 1
1 14 . 12 1 1 A 2 2 ARG HA H 2 4.393 4.004 0.389 1
1 22 . 12 1 1 A 2 2 ARG CA C 2 56.327 57.185 -0.858 1
1 23 . 12 1 1 A 2 2 ARG N N 2 124.285 118.930 5.355 1
1 24 . 12 1 1 A 3 3 SER H H 3 8.495 8.091 0.404 1
1 25 . 12 1 1 A 3 3 SER HA H 3 4.491 4.492 -0.001 1
1 28 . 12 1 1 A 3 3 SER CB C 3 64.117 64.041 0.076 1
1 29 . 12 1 1 A 3 3 SER N N 3 117.670 112.768 4.902 1
1 30 . 12 1 1 A 4 4 ARG H H 4 8.672 7.906 0.766 1
1 31 . 12 1 1 A 4 4 ARG HA H 4 4.314 4.181 0.133 1
1 39 . 12 1 1 A 4 4 ARG CA C 4 56.779 58.345 -1.566 1
1 40 . 12 1 1 A 4 4 ARG N N 4 123.739 120.969 2.770 1
1 41 . 12 1 1 A 5 5 LYS H H 5 8.328 7.743 0.585 1
1 42 . 12 1 1 A 5 5 LYS HA H 5 4.127 4.281 -0.154 1
1 49 . 12 1 1 A 5 5 LYS CA C 5 57.431 57.523 -0.092 1
1 51 . 12 1 1 A 5 5 LYS N N 5 120.706 118.086 2.620 1
1 52 . 12 1 1 A 6 6 ASN H H 6 8.115 8.275 -0.160 1
1 57 . 12 1 1 A 6 6 ASN CA C 6 53.066 54.525 -1.459 1
1 58 . 12 1 1 A 6 6 ASN CB C 6 39.187 39.159 0.028 1
1 59 . 12 1 1 A 6 6 ASN N N 6 117.807 114.535 3.272 1
1 60 . 12 1 1 A 7 7 GLY H H 7 8.499 8.044 0.455 1
1 61 . 12 1 1 A 7 7 GLY HA2 H 7 4.051 4.141 -0.090 1
1 62 . 12 1 1 A 7 7 GLY HA3 H 7 4.051 4.222 -0.171 1
1 63 . 12 1 1 A 7 7 GLY CA C 7 46.153 44.626 1.527 1
1 64 . 12 1 1 A 7 7 GLY N N 7 108.804 104.911 3.893 1
1 65 . 12 1 1 A 8 8 ILE H H 8 8.496 8.848 -0.352 1
1 75 . 12 1 1 A 8 8 ILE CB C 8 38.082 37.530 0.552 1
1 76 . 12 1 1 A 8 8 ILE N N 8 121.041 124.416 -3.375 1
1 77 . 12 1 1 A 9 9 GLY H H 9 8.656 8.175 0.481 1
1 78 . 12 1 1 A 9 9 GLY HA2 H 9 3.671 3.974 -0.303 1
1 79 . 12 1 1 A 9 9 GLY HA3 H 9 3.671 4.009 -0.338 1
1 80 . 12 1 1 A 9 9 GLY CA C 9 47.324 45.349 1.975 1
1 81 . 12 1 1 A 9 9 GLY N N 9 108.767 109.990 -1.223 1
1 82 . 12 1 1 A 10 10 TYR H H 10 7.987 8.393 -0.406 1
1 83 . 12 1 1 A 10 10 TYR HA H 10 4.269 4.377 -0.108 1
1 90 . 12 1 1 A 10 10 TYR CA C 10 60.713 60.108 0.605 1
1 91 . 12 1 1 A 10 10 TYR CB C 10 38.354 37.547 0.807 1
1 92 . 12 1 1 A 10 10 TYR N N 10 121.261 119.982 1.279 1
1 93 . 12 1 1 A 11 11 ALA H H 11 8.020 7.261 0.759 1
1 94 . 12 1 1 A 11 11 ALA HA H 11 4.040 3.687 0.353 1
1 98 . 12 1 1 A 11 11 ALA CA C 11 55.355 54.677 0.678 1
1 99 . 12 1 1 A 11 11 ALA CB C 11 18.737 18.029 0.708 1
1 100 . 12 1 1 A 11 11 ALA N N 11 122.295 122.997 -0.702 1
1 101 . 12 1 1 A 12 12 ILE H H 12 8.308 8.032 0.276 1
1 102 . 12 1 1 A 12 12 ILE HA H 12 3.732 3.898 -0.166 1
1 111 . 12 1 1 A 12 12 ILE CB C 12 37.611 37.577 0.034 1
1 112 . 12 1 1 A 12 12 ILE N N 12 116.853 118.776 -1.923 1
1 113 . 12 1 1 A 13 13 GLY H H 13 8.171 8.230 -0.059 1
1 114 . 12 1 1 A 13 13 GLY HA2 H 13 3.744 3.790 -0.046 1
1 115 . 12 1 1 A 13 13 GLY HA3 H 13 3.744 3.800 -0.056 1
1 116 . 12 1 1 A 13 13 GLY CA C 13 47.343 47.188 0.155 1
1 117 . 12 1 1 A 13 13 GLY N N 13 107.089 109.475 -2.386 1
1 118 . 12 1 1 A 14 14 TYR H H 14 8.223 8.662 -0.439 1
1 119 . 12 1 1 A 14 14 TYR HA H 14 4.147 4.141 0.006 1
1 126 . 12 1 1 A 14 14 TYR CB C 14 38.415 39.096 -0.681 1
1 127 . 12 1 1 A 14 14 TYR N N 14 122.935 123.123 -0.188 1
1 128 . 12 1 1 A 15 15 ALA H H 15 8.345 8.517 -0.172 1
1 129 . 12 1 1 A 15 15 ALA HA H 15 3.986 4.015 -0.029 1
1 133 . 12 1 1 A 15 15 ALA CA C 15 55.067 55.132 -0.065 1
1 134 . 12 1 1 A 15 15 ALA N N 15 121.882 121.732 0.150 1
1 135 . 12 1 1 A 16 16 PHE H H 16 8.668 8.626 0.042 1
1 136 . 12 1 1 A 16 16 PHE HA H 16 4.138 4.254 -0.116 1
1 143 . 12 1 1 A 16 16 PHE CA C 16 61.116 60.945 0.171 1
1 144 . 12 1 1 A 16 16 PHE CB C 16 38.857 39.251 -0.394 1
1 145 . 12 1 1 A 16 16 PHE N N 16 116.563 119.426 -2.863 1
1 146 . 12 1 1 A 17 17 GLY H H 17 8.163 8.952 -0.789 1
1 147 . 12 1 1 A 17 17 GLY HA2 H 17 3.891 3.750 0.141 1
1 148 . 12 1 1 A 17 17 GLY HA3 H 17 3.891 3.829 0.062 1
1 149 . 12 1 1 A 17 17 GLY N N 17 105.893 106.758 -0.865 1
1 150 . 12 1 1 A 18 18 ALA H H 18 7.842 7.725 0.117 1
1 151 . 12 1 1 A 18 18 ALA HA H 18 4.035 3.908 0.127 1
1 155 . 12 1 1 A 18 18 ALA CA C 18 55.037 54.661 0.376 1
1 156 . 12 1 1 A 18 18 ALA CB C 18 18.223 18.714 -0.491 1
1 157 . 12 1 1 A 18 18 ALA N N 18 122.050 124.545 -2.495 1
1 158 . 12 1 1 A 19 19 VAL H H 19 8.010 7.677 0.333 1
1 159 . 12 1 1 A 19 19 VAL HA H 19 3.549 3.751 -0.202 1
1 167 . 12 1 1 A 19 19 VAL CA C 19 66.571 65.076 1.495 1
1 168 . 12 1 1 A 19 19 VAL CB C 19 31.436 31.551 -0.115 1
1 171 . 12 1 1 A 19 19 VAL N N 19 118.184 116.566 1.618 1
1 172 . 12 1 1 A 20 20 GLU H H 20 8.339 8.544 -0.205 1
1 173 . 12 1 1 A 20 20 GLU HA H 20 3.666 4.000 -0.334 1
1 178 . 12 1 1 A 20 20 GLU CA C 20 60.103 59.403 0.700 1
1 180 . 12 1 1 A 20 20 GLU N N 20 118.704 120.622 -1.918 1
1 181 . 12 1 1 A 21 21 ARG H H 21 7.939 8.539 -0.600 1
1 182 . 12 1 1 A 21 21 ARG HA H 21 3.935 3.978 -0.043 1
1 190 . 12 1 1 A 21 21 ARG N N 21 116.955 120.823 -3.868 1
1 191 . 12 1 1 A 22 22 ALA H H 22 7.784 7.752 0.032 1
1 192 . 12 1 1 A 22 22 ALA HA H 22 4.166 4.076 0.090 1
1 196 . 12 1 1 A 22 22 ALA CA C 22 54.645 55.204 -0.559 1
1 197 . 12 1 1 A 22 22 ALA CB C 22 18.724 18.529 0.195 1
1 198 . 12 1 1 A 22 22 ALA N N 22 121.252 122.012 -0.760 1
1 199 . 12 1 1 A 23 23 VAL H H 23 8.086 7.555 0.531 1
1 200 . 12 1 1 A 23 23 VAL HA H 23 3.872 3.664 0.208 1
1 208 . 12 1 1 A 23 23 VAL CA C 23 64.928 65.888 -0.960 1
1 209 . 12 1 1 A 23 23 VAL CB C 23 32.451 31.825 0.626 1
1 212 . 12 1 1 A 23 23 VAL N N 23 114.516 118.544 -4.028 1
1 213 . 12 1 1 A 24 24 LEU H H 24 8.060 7.658 0.402 1
1 223 . 12 1 1 A 24 24 LEU N N 24 118.014 120.912 -2.898 1
1 224 . 12 1 1 A 25 25 GLY H H 25 7.880 8.019 -0.139 1
1 225 . 12 1 1 A 25 25 GLY HA2 H 25 3.949 3.762 0.187 1
1 226 . 12 1 1 A 25 25 GLY HA3 H 25 3.966 3.763 0.203 1
1 227 . 12 1 1 A 25 25 GLY CA C 25 45.959 46.128 -0.169 1
1 228 . 12 1 1 A 25 25 GLY N N 25 106.969 106.336 0.633 1
1 229 . 12 1 1 A 26 26 GLY H H 26 8.123 7.613 0.510 1
1 230 . 12 1 1 A 26 26 GLY HA2 H 26 3.912 4.257 -0.345 1
1 231 . 12 1 1 A 26 26 GLY HA3 H 26 4.002 4.258 -0.256 1
1 232 . 12 1 1 A 26 26 GLY CA C 26 45.691 46.143 -0.452 1
1 233 . 12 1 1 A 26 26 GLY N N 26 108.223 107.347 0.876 1
1 234 . 12 1 1 A 27 27 SER H H 27 8.201 8.156 0.045 1
1 235 . 12 1 1 A 27 27 SER HA H 27 4.353 4.593 -0.240 1
1 238 . 12 1 1 A 27 27 SER CA C 27 59.117 55.794 3.323 1
1 239 . 12 1 1 A 27 27 SER CB C 27 63.770 66.031 -2.261 1
1 240 . 12 1 1 A 27 27 SER N N 27 115.317 114.097 1.220 1
1 241 . 12 1 1 A 28 28 ARG H H 28 8.155 8.878 -0.723 1
1 242 . 12 1 1 A 28 28 ARG HA H 28 4.258 4.064 0.194 1
1 250 . 12 1 1 A 28 28 ARG CA C 28 56.348 58.256 -1.908 1
1 251 . 12 1 1 A 28 28 ARG N N 28 121.519 120.961 0.558 1
1 252 . 12 1 1 A 29 29 ASP H H 29 8.167 8.953 -0.786 1
1 255 . 12 1 1 A 29 29 ASP CB C 29 38.462 43.763 -5.301 1
1 256 . 12 1 1 A 29 29 ASP N N 29 118.393 120.670 -2.277 1
1 257 . 12 1 1 A 30 30 TYR H H 30 7.910 7.829 0.081 1
1 258 . 12 1 1 A 30 30 TYR HA H 30 4.484 4.793 -0.309 1
1 265 . 12 1 1 A 30 30 TYR CA C 30 58.097 56.941 1.156 1
1 266 . 12 1 1 A 30 30 TYR CB C 30 38.759 41.856 -3.097 1
1 267 . 12 1 1 A 30 30 TYR N N 30 119.859 116.582 3.277 1
1 268 . 12 1 1 A 31 31 ASN H H 31 8.152 8.000 0.152 1
1 269 . 12 1 1 A 31 31 ASN HA H 31 4.658 4.531 0.127 1
1 274 . 12 1 1 A 31 31 ASN CA C 31 53.245 51.917 1.328 1
1 275 . 12 1 1 A 31 31 ASN CB C 31 39.156 38.285 0.871 1
1 276 . 12 1 1 A 31 31 ASN N N 31 119.343 120.629 -1.286 1
1 13 . 13 1 1 A 2 2 ARG H H 2 8.864 9.272 -0.408 1
1 14 . 13 1 1 A 2 2 ARG HA H 2 4.393 3.942 0.451 1
1 22 . 13 1 1 A 2 2 ARG CA C 2 56.327 56.888 -0.561 1
1 23 . 13 1 1 A 2 2 ARG N N 2 124.285 123.244 1.041 1
1 24 . 13 1 1 A 3 3 SER H H 3 8.495 8.386 0.109 1
1 25 . 13 1 1 A 3 3 SER HA H 3 4.491 4.200 0.291 1
1 28 . 13 1 1 A 3 3 SER CB C 3 64.117 63.121 0.996 1
1 29 . 13 1 1 A 3 3 SER N N 3 117.670 119.823 -2.153 1
1 30 . 13 1 1 A 4 4 ARG H H 4 8.672 7.816 0.856 1
1 31 . 13 1 1 A 4 4 ARG HA H 4 4.314 4.320 -0.006 1
1 39 . 13 1 1 A 4 4 ARG CA C 4 56.779 57.046 -0.267 1
1 40 . 13 1 1 A 4 4 ARG N N 4 123.739 120.776 2.963 1
1 41 . 13 1 1 A 5 5 LYS H H 5 8.328 8.223 0.105 1
1 42 . 13 1 1 A 5 5 LYS HA H 5 4.127 4.067 0.060 1
1 49 . 13 1 1 A 5 5 LYS CA C 5 57.431 59.291 -1.860 1
1 51 . 13 1 1 A 5 5 LYS N N 5 120.706 118.442 2.264 1
1 52 . 13 1 1 A 6 6 ASN H H 6 8.115 8.006 0.109 1
1 57 . 13 1 1 A 6 6 ASN CA C 6 53.066 55.739 -2.673 1
1 58 . 13 1 1 A 6 6 ASN CB C 6 39.187 38.708 0.479 1
1 59 . 13 1 1 A 6 6 ASN N N 6 117.807 116.755 1.052 1
1 60 . 13 1 1 A 7 7 GLY H H 7 8.499 8.004 0.495 1
1 61 . 13 1 1 A 7 7 GLY HA2 H 7 4.051 4.091 -0.040 1
1 62 . 13 1 1 A 7 7 GLY HA3 H 7 4.051 4.171 -0.120 1
1 63 . 13 1 1 A 7 7 GLY CA C 7 46.153 44.763 1.390 1
1 64 . 13 1 1 A 7 7 GLY N N 7 108.804 105.425 3.379 1
1 65 . 13 1 1 A 8 8 ILE H H 8 8.496 8.776 -0.280 1
1 75 . 13 1 1 A 8 8 ILE CB C 8 38.082 37.525 0.557 1
1 76 . 13 1 1 A 8 8 ILE N N 8 121.041 124.208 -3.167 1
1 77 . 13 1 1 A 9 9 GLY H H 9 8.656 8.183 0.473 1
1 78 . 13 1 1 A 9 9 GLY HA2 H 9 3.671 3.978 -0.307 1
1 79 . 13 1 1 A 9 9 GLY HA3 H 9 3.671 4.011 -0.340 1
1 80 . 13 1 1 A 9 9 GLY CA C 9 47.324 45.401 1.923 1
1 81 . 13 1 1 A 9 9 GLY N N 9 108.767 109.959 -1.192 1
1 82 . 13 1 1 A 10 10 TYR H H 10 7.987 8.452 -0.465 1
1 83 . 13 1 1 A 10 10 TYR HA H 10 4.269 4.364 -0.095 1
1 90 . 13 1 1 A 10 10 TYR CA C 10 60.713 60.093 0.620 1
1 91 . 13 1 1 A 10 10 TYR CB C 10 38.354 37.549 0.805 1
1 92 . 13 1 1 A 10 10 TYR N N 10 121.261 119.989 1.272 1
1 93 . 13 1 1 A 11 11 ALA H H 11 8.020 7.369 0.651 1
1 94 . 13 1 1 A 11 11 ALA HA H 11 4.040 3.704 0.336 1
1 98 . 13 1 1 A 11 11 ALA CA C 11 55.355 54.720 0.635 1
1 99 . 13 1 1 A 11 11 ALA CB C 11 18.737 18.035 0.702 1
1 100 . 13 1 1 A 11 11 ALA N N 11 122.295 122.975 -0.680 1
1 101 . 13 1 1 A 12 12 ILE H H 12 8.308 8.065 0.243 1
1 102 . 13 1 1 A 12 12 ILE HA H 12 3.732 3.888 -0.156 1
1 111 . 13 1 1 A 12 12 ILE CB C 12 37.611 37.640 -0.029 1
1 112 . 13 1 1 A 12 12 ILE N N 12 116.853 118.626 -1.773 1
1 113 . 13 1 1 A 13 13 GLY H H 13 8.171 8.249 -0.078 1
1 114 . 13 1 1 A 13 13 GLY HA2 H 13 3.744 3.790 -0.046 1
1 115 . 13 1 1 A 13 13 GLY HA3 H 13 3.744 3.804 -0.060 1
1 116 . 13 1 1 A 13 13 GLY CA C 13 47.343 47.172 0.171 1
1 117 . 13 1 1 A 13 13 GLY N N 13 107.089 109.479 -2.390 1
1 118 . 13 1 1 A 14 14 TYR H H 14 8.223 8.649 -0.426 1
1 119 . 13 1 1 A 14 14 TYR HA H 14 4.147 4.159 -0.012 1
1 126 . 13 1 1 A 14 14 TYR CB C 14 38.415 38.742 -0.327 1
1 127 . 13 1 1 A 14 14 TYR N N 14 122.935 123.109 -0.174 1
1 128 . 13 1 1 A 15 15 ALA H H 15 8.345 8.153 0.192 1
1 129 . 13 1 1 A 15 15 ALA HA H 15 3.986 3.807 0.179 1
1 133 . 13 1 1 A 15 15 ALA CA C 15 55.067 54.974 0.093 1
1 134 . 13 1 1 A 15 15 ALA N N 15 121.882 121.646 0.236 1
1 135 . 13 1 1 A 16 16 PHE H H 16 8.668 8.550 0.118 1
1 136 . 13 1 1 A 16 16 PHE HA H 16 4.138 4.241 -0.103 1
1 143 . 13 1 1 A 16 16 PHE CA C 16 61.116 60.946 0.170 1
1 144 . 13 1 1 A 16 16 PHE CB C 16 38.857 39.184 -0.327 1
1 145 . 13 1 1 A 16 16 PHE N N 16 116.563 119.383 -2.820 1
1 146 . 13 1 1 A 17 17 GLY H H 17 8.163 9.026 -0.863 1
1 147 . 13 1 1 A 17 17 GLY HA2 H 17 3.891 3.854 0.037 1
1 148 . 13 1 1 A 17 17 GLY HA3 H 17 3.891 3.880 0.011 1
1 149 . 13 1 1 A 17 17 GLY N N 17 105.893 106.833 -0.940 1
1 150 . 13 1 1 A 18 18 ALA H H 18 7.842 7.761 0.081 1
1 151 . 13 1 1 A 18 18 ALA HA H 18 4.035 3.929 0.106 1
1 155 . 13 1 1 A 18 18 ALA CA C 18 55.037 54.676 0.361 1
1 156 . 13 1 1 A 18 18 ALA CB C 18 18.223 18.739 -0.516 1
1 157 . 13 1 1 A 18 18 ALA N N 18 122.050 124.519 -2.469 1
1 158 . 13 1 1 A 19 19 VAL H H 19 8.010 7.632 0.378 1
1 159 . 13 1 1 A 19 19 VAL HA H 19 3.549 3.745 -0.196 1
1 167 . 13 1 1 A 19 19 VAL CA C 19 66.571 65.091 1.480 1
1 168 . 13 1 1 A 19 19 VAL CB C 19 31.436 31.494 -0.058 1
1 171 . 13 1 1 A 19 19 VAL N N 19 118.184 116.326 1.858 1
1 172 . 13 1 1 A 20 20 GLU H H 20 8.339 8.527 -0.188 1
1 173 . 13 1 1 A 20 20 GLU HA H 20 3.666 4.032 -0.366 1
1 178 . 13 1 1 A 20 20 GLU CA C 20 60.103 59.414 0.689 1
1 180 . 13 1 1 A 20 20 GLU N N 20 118.704 120.315 -1.611 1
1 181 . 13 1 1 A 21 21 ARG H H 21 7.939 8.392 -0.453 1
1 182 . 13 1 1 A 21 21 ARG HA H 21 3.935 4.024 -0.089 1
1 190 . 13 1 1 A 21 21 ARG N N 21 116.955 120.911 -3.956 1
1 191 . 13 1 1 A 22 22 ALA H H 22 7.784 7.865 -0.081 1
1 192 . 13 1 1 A 22 22 ALA HA H 22 4.166 4.026 0.140 1
1 196 . 13 1 1 A 22 22 ALA CA C 22 54.645 55.208 -0.563 1
1 197 . 13 1 1 A 22 22 ALA CB C 22 18.724 18.178 0.546 1
1 198 . 13 1 1 A 22 22 ALA N N 22 121.252 122.172 -0.920 1
1 199 . 13 1 1 A 23 23 VAL H H 23 8.086 7.626 0.460 1
1 200 . 13 1 1 A 23 23 VAL HA H 23 3.872 3.778 0.094 1
1 208 . 13 1 1 A 23 23 VAL CA C 23 64.928 65.808 -0.880 1
1 209 . 13 1 1 A 23 23 VAL CB C 23 32.451 31.683 0.768 1
1 212 . 13 1 1 A 23 23 VAL N N 23 114.516 118.247 -3.731 1
1 213 . 13 1 1 A 24 24 LEU H H 24 8.060 7.759 0.301 1
1 223 . 13 1 1 A 24 24 LEU N N 24 118.014 118.220 -0.206 1
1 224 . 13 1 1 A 25 25 GLY H H 25 7.880 7.703 0.177 1
1 225 . 13 1 1 A 25 25 GLY HA2 H 25 3.949 4.201 -0.252 1
1 226 . 13 1 1 A 25 25 GLY HA3 H 25 3.966 4.202 -0.236 1
1 227 . 13 1 1 A 25 25 GLY CA C 25 45.959 45.898 0.061 1
1 228 . 13 1 1 A 25 25 GLY N N 25 106.969 106.886 0.083 1
1 229 . 13 1 1 A 26 26 GLY H H 26 8.123 8.469 -0.346 1
1 230 . 13 1 1 A 26 26 GLY HA2 H 26 3.912 4.113 -0.201 1
1 231 . 13 1 1 A 26 26 GLY HA3 H 26 4.002 4.116 -0.114 1
1 232 . 13 1 1 A 26 26 GLY CA C 26 45.691 44.783 0.908 1
1 233 . 13 1 1 A 26 26 GLY N N 26 108.223 108.562 -0.339 1
1 234 . 13 1 1 A 27 27 SER H H 27 8.201 8.538 -0.337 1
1 235 . 13 1 1 A 27 27 SER HA H 27 4.353 4.681 -0.328 1
1 238 . 13 1 1 A 27 27 SER CA C 27 59.117 56.992 2.125 1
1 239 . 13 1 1 A 27 27 SER CB C 27 63.770 66.210 -2.440 1
1 240 . 13 1 1 A 27 27 SER N N 27 115.317 119.675 -4.358 1
1 241 . 13 1 1 A 28 28 ARG H H 28 8.155 8.297 -0.142 1
1 242 . 13 1 1 A 28 28 ARG HA H 28 4.258 3.724 0.534 1
1 250 . 13 1 1 A 28 28 ARG CA C 28 56.348 56.757 -0.409 1
1 251 . 13 1 1 A 28 28 ARG N N 28 121.519 118.540 2.979 1
1 252 . 13 1 1 A 29 29 ASP H H 29 8.167 7.717 0.450 1
1 255 . 13 1 1 A 29 29 ASP CB C 29 38.462 42.424 -3.962 1
1 256 . 13 1 1 A 29 29 ASP N N 29 118.393 116.652 1.741 1
1 257 . 13 1 1 A 30 30 TYR H H 30 7.910 7.699 0.211 1
1 258 . 13 1 1 A 30 30 TYR HA H 30 4.484 4.141 0.343 1
1 265 . 13 1 1 A 30 30 TYR CA C 30 58.097 58.655 -0.558 1
1 266 . 13 1 1 A 30 30 TYR CB C 30 38.759 35.475 3.284 1
1 267 . 13 1 1 A 30 30 TYR N N 30 119.859 115.657 4.202 1
1 268 . 13 1 1 A 31 31 ASN H H 31 8.152 7.859 0.293 1
1 269 . 13 1 1 A 31 31 ASN HA H 31 4.658 4.762 -0.104 1
1 274 . 13 1 1 A 31 31 ASN CA C 31 53.245 52.029 1.216 1
1 275 . 13 1 1 A 31 31 ASN CB C 31 39.156 37.456 1.700 1
1 276 . 13 1 1 A 31 31 ASN N N 31 119.343 118.339 1.004 1
1 13 . 14 1 1 A 2 2 ARG H H 2 8.864 8.537 0.327 1
1 14 . 14 1 1 A 2 2 ARG HA H 2 4.393 4.523 -0.130 1
1 22 . 14 1 1 A 2 2 ARG CA C 2 56.327 55.115 1.212 1
1 23 . 14 1 1 A 2 2 ARG N N 2 124.285 126.015 -1.730 1
1 24 . 14 1 1 A 3 3 SER H H 3 8.495 8.289 0.206 1
1 25 . 14 1 1 A 3 3 SER HA H 3 4.491 4.174 0.317 1
1 28 . 14 1 1 A 3 3 SER CB C 3 64.117 61.029 3.088 1
1 29 . 14 1 1 A 3 3 SER N N 3 117.670 109.985 7.685 1
1 30 . 14 1 1 A 4 4 ARG H H 4 8.672 7.879 0.793 1
1 31 . 14 1 1 A 4 4 ARG HA H 4 4.314 4.211 0.103 1
1 39 . 14 1 1 A 4 4 ARG CA C 4 56.779 58.111 -1.332 1
1 40 . 14 1 1 A 4 4 ARG N N 4 123.739 120.037 3.702 1
1 41 . 14 1 1 A 5 5 LYS H H 5 8.328 7.880 0.448 1
1 42 . 14 1 1 A 5 5 LYS HA H 5 4.127 4.187 -0.060 1
1 49 . 14 1 1 A 5 5 LYS CA C 5 57.431 58.834 -1.403 1
1 51 . 14 1 1 A 5 5 LYS N N 5 120.706 118.710 1.996 1
1 52 . 14 1 1 A 6 6 ASN H H 6 8.115 7.972 0.143 1
1 57 . 14 1 1 A 6 6 ASN CA C 6 53.066 55.225 -2.159 1
1 58 . 14 1 1 A 6 6 ASN CB C 6 39.187 38.476 0.711 1
1 59 . 14 1 1 A 6 6 ASN N N 6 117.807 115.703 2.104 1
1 60 . 14 1 1 A 7 7 GLY H H 7 8.499 8.208 0.291 1
1 61 . 14 1 1 A 7 7 GLY HA2 H 7 4.051 4.127 -0.076 1
1 62 . 14 1 1 A 7 7 GLY HA3 H 7 4.051 4.300 -0.249 1
1 63 . 14 1 1 A 7 7 GLY CA C 7 46.153 45.652 0.501 1
1 64 . 14 1 1 A 7 7 GLY N N 7 108.804 106.748 2.056 1
1 65 . 14 1 1 A 8 8 ILE H H 8 8.496 8.057 0.439 1
1 75 . 14 1 1 A 8 8 ILE CB C 8 38.082 39.380 -1.298 1
1 76 . 14 1 1 A 8 8 ILE N N 8 121.041 121.630 -0.589 1
1 77 . 14 1 1 A 9 9 GLY H H 9 8.656 8.504 0.152 1
1 78 . 14 1 1 A 9 9 GLY HA2 H 9 3.671 3.735 -0.064 1
1 79 . 14 1 1 A 9 9 GLY HA3 H 9 3.671 3.763 -0.092 1
1 80 . 14 1 1 A 9 9 GLY CA C 9 47.324 47.182 0.142 1
1 81 . 14 1 1 A 9 9 GLY N N 9 108.767 109.448 -0.681 1
1 82 . 14 1 1 A 10 10 TYR H H 10 7.987 8.192 -0.205 1
1 83 . 14 1 1 A 10 10 TYR HA H 10 4.269 4.413 -0.144 1
1 90 . 14 1 1 A 10 10 TYR CA C 10 60.713 60.067 0.646 1
1 91 . 14 1 1 A 10 10 TYR CB C 10 38.354 37.597 0.757 1
1 92 . 14 1 1 A 10 10 TYR N N 10 121.261 120.105 1.156 1
1 93 . 14 1 1 A 11 11 ALA H H 11 8.020 7.539 0.481 1
1 94 . 14 1 1 A 11 11 ALA HA H 11 4.040 3.618 0.422 1
1 98 . 14 1 1 A 11 11 ALA CA C 11 55.355 54.646 0.709 1
1 99 . 14 1 1 A 11 11 ALA CB C 11 18.737 18.213 0.524 1
1 100 . 14 1 1 A 11 11 ALA N N 11 122.295 123.363 -1.068 1
1 101 . 14 1 1 A 12 12 ILE H H 12 8.308 7.696 0.612 1
1 102 . 14 1 1 A 12 12 ILE HA H 12 3.732 3.906 -0.174 1
1 111 . 14 1 1 A 12 12 ILE CB C 12 37.611 37.665 -0.054 1
1 112 . 14 1 1 A 12 12 ILE N N 12 116.853 118.641 -1.788 1
1 113 . 14 1 1 A 13 13 GLY H H 13 8.171 8.175 -0.004 1
1 114 . 14 1 1 A 13 13 GLY HA2 H 13 3.744 3.794 -0.050 1
1 115 . 14 1 1 A 13 13 GLY HA3 H 13 3.744 3.808 -0.064 1
1 116 . 14 1 1 A 13 13 GLY CA C 13 47.343 47.312 0.031 1
1 117 . 14 1 1 A 13 13 GLY N N 13 107.089 109.405 -2.316 1
1 118 . 14 1 1 A 14 14 TYR H H 14 8.223 8.465 -0.242 1
1 119 . 14 1 1 A 14 14 TYR HA H 14 4.147 4.134 0.013 1
1 126 . 14 1 1 A 14 14 TYR CB C 14 38.415 39.054 -0.639 1
1 127 . 14 1 1 A 14 14 TYR N N 14 122.935 123.120 -0.185 1
1 128 . 14 1 1 A 15 15 ALA H H 15 8.345 8.474 -0.129 1
1 129 . 14 1 1 A 15 15 ALA HA H 15 3.986 3.793 0.193 1
1 133 . 14 1 1 A 15 15 ALA CA C 15 55.067 55.061 0.006 1
1 134 . 14 1 1 A 15 15 ALA N N 15 121.882 121.274 0.608 1
1 135 . 14 1 1 A 16 16 PHE H H 16 8.668 8.494 0.174 1
1 136 . 14 1 1 A 16 16 PHE HA H 16 4.138 4.267 -0.129 1
1 143 . 14 1 1 A 16 16 PHE CA C 16 61.116 60.870 0.246 1
1 144 . 14 1 1 A 16 16 PHE CB C 16 38.857 39.191 -0.334 1
1 145 . 14 1 1 A 16 16 PHE N N 16 116.563 119.416 -2.853 1
1 146 . 14 1 1 A 17 17 GLY H H 17 8.163 9.086 -0.923 1
1 147 . 14 1 1 A 17 17 GLY HA2 H 17 3.891 3.896 -0.005 1
1 148 . 14 1 1 A 17 17 GLY HA3 H 17 3.891 3.914 -0.023 1
1 149 . 14 1 1 A 17 17 GLY N N 17 105.893 106.846 -0.953 1
1 150 . 14 1 1 A 18 18 ALA H H 18 7.842 7.819 0.023 1
1 151 . 14 1 1 A 18 18 ALA HA H 18 4.035 3.926 0.109 1
1 155 . 14 1 1 A 18 18 ALA CA C 18 55.037 54.637 0.400 1
1 156 . 14 1 1 A 18 18 ALA CB C 18 18.223 18.527 -0.304 1
1 157 . 14 1 1 A 18 18 ALA N N 18 122.050 124.215 -2.165 1
1 158 . 14 1 1 A 19 19 VAL H H 19 8.010 7.591 0.419 1
1 159 . 14 1 1 A 19 19 VAL HA H 19 3.549 3.737 -0.188 1
1 167 . 14 1 1 A 19 19 VAL CA C 19 66.571 65.065 1.506 1
1 168 . 14 1 1 A 19 19 VAL CB C 19 31.436 31.504 -0.068 1
1 171 . 14 1 1 A 19 19 VAL N N 19 118.184 116.314 1.870 1
1 172 . 14 1 1 A 20 20 GLU H H 20 8.339 8.554 -0.215 1
1 173 . 14 1 1 A 20 20 GLU HA H 20 3.666 4.036 -0.370 1
1 178 . 14 1 1 A 20 20 GLU CA C 20 60.103 59.420 0.683 1
1 180 . 14 1 1 A 20 20 GLU N N 20 118.704 120.624 -1.920 1
1 181 . 14 1 1 A 21 21 ARG H H 21 7.939 8.330 -0.391 1
1 182 . 14 1 1 A 21 21 ARG HA H 21 3.935 3.997 -0.062 1
1 190 . 14 1 1 A 21 21 ARG N N 21 116.955 120.828 -3.873 1
1 191 . 14 1 1 A 22 22 ALA H H 22 7.784 7.831 -0.047 1
1 192 . 14 1 1 A 22 22 ALA HA H 22 4.166 4.081 0.085 1
1 196 . 14 1 1 A 22 22 ALA CA C 22 54.645 54.837 -0.192 1
1 197 . 14 1 1 A 22 22 ALA CB C 22 18.724 18.391 0.333 1
1 198 . 14 1 1 A 22 22 ALA N N 22 121.252 121.851 -0.599 1
1 199 . 14 1 1 A 23 23 VAL H H 23 8.086 7.848 0.238 1
1 200 . 14 1 1 A 23 23 VAL HA H 23 3.872 3.728 0.144 1
1 208 . 14 1 1 A 23 23 VAL CA C 23 64.928 65.984 -1.056 1
1 209 . 14 1 1 A 23 23 VAL CB C 23 32.451 31.595 0.856 1
1 212 . 14 1 1 A 23 23 VAL N N 23 114.516 118.502 -3.986 1
1 213 . 14 1 1 A 24 24 LEU H H 24 8.060 7.654 0.406 1
1 223 . 14 1 1 A 24 24 LEU N N 24 118.014 118.331 -0.317 1
1 224 . 14 1 1 A 25 25 GLY H H 25 7.880 8.451 -0.571 1
1 225 . 14 1 1 A 25 25 GLY HA2 H 25 3.949 4.021 -0.072 1
1 226 . 14 1 1 A 25 25 GLY HA3 H 25 3.966 4.022 -0.056 1
1 227 . 14 1 1 A 25 25 GLY CA C 25 45.959 45.638 0.321 1
1 228 . 14 1 1 A 25 25 GLY N N 25 106.969 106.845 0.124 1
1 229 . 14 1 1 A 26 26 GLY H H 26 8.123 8.168 -0.045 1
1 230 . 14 1 1 A 26 26 GLY HA2 H 26 3.912 4.149 -0.237 1
1 231 . 14 1 1 A 26 26 GLY HA3 H 26 4.002 4.149 -0.147 1
1 232 . 14 1 1 A 26 26 GLY CA C 26 45.691 45.492 0.199 1
1 233 . 14 1 1 A 26 26 GLY N N 26 108.223 110.571 -2.348 1
1 234 . 14 1 1 A 27 27 SER H H 27 8.201 8.823 -0.622 1
1 235 . 14 1 1 A 27 27 SER HA H 27 4.353 4.843 -0.490 1
1 238 . 14 1 1 A 27 27 SER CA C 27 59.117 57.103 2.014 1
1 239 . 14 1 1 A 27 27 SER CB C 27 63.770 66.531 -2.761 1
1 240 . 14 1 1 A 27 27 SER N N 27 115.317 120.367 -5.050 1
1 241 . 14 1 1 A 28 28 ARG H H 28 8.155 8.823 -0.668 1
1 242 . 14 1 1 A 28 28 ARG HA H 28 4.258 4.093 0.165 1
1 250 . 14 1 1 A 28 28 ARG CA C 28 56.348 58.281 -1.933 1
1 251 . 14 1 1 A 28 28 ARG N N 28 121.519 118.891 2.628 1
1 252 . 14 1 1 A 29 29 ASP H H 29 8.167 8.803 -0.636 1
1 255 . 14 1 1 A 29 29 ASP CB C 29 38.462 42.634 -4.172 1
1 256 . 14 1 1 A 29 29 ASP N N 29 118.393 121.610 -3.217 1
1 257 . 14 1 1 A 30 30 TYR H H 30 7.910 8.262 -0.352 1
1 258 . 14 1 1 A 30 30 TYR HA H 30 4.484 4.998 -0.514 1
1 265 . 14 1 1 A 30 30 TYR CA C 30 58.097 57.320 0.777 1
1 266 . 14 1 1 A 30 30 TYR CB C 30 38.759 41.437 -2.678 1
1 267 . 14 1 1 A 30 30 TYR N N 30 119.859 117.662 2.197 1
1 268 . 14 1 1 A 31 31 ASN H H 31 8.152 8.370 -0.218 1
1 269 . 14 1 1 A 31 31 ASN HA H 31 4.658 4.645 0.013 1
1 274 . 14 1 1 A 31 31 ASN CA C 31 53.245 52.405 0.840 1
1 275 . 14 1 1 A 31 31 ASN CB C 31 39.156 39.643 -0.487 1
1 276 . 14 1 1 A 31 31 ASN N N 31 119.343 125.384 -6.041 1
1 13 . 15 1 1 A 2 2 ARG H H 2 8.864 8.680 0.184 1
1 14 . 15 1 1 A 2 2 ARG HA H 2 4.393 4.669 -0.276 1
1 22 . 15 1 1 A 2 2 ARG CA C 2 56.327 56.211 0.116 1
1 23 . 15 1 1 A 2 2 ARG N N 2 124.285 124.009 0.276 1
1 24 . 15 1 1 A 3 3 SER H H 3 8.495 8.998 -0.503 1
1 25 . 15 1 1 A 3 3 SER HA H 3 4.491 4.571 -0.080 1
1 28 . 15 1 1 A 3 3 SER CB C 3 64.117 65.849 -1.732 1
1 29 . 15 1 1 A 3 3 SER N N 3 117.670 121.598 -3.928 1
1 30 . 15 1 1 A 4 4 ARG H H 4 8.672 7.828 0.844 1
1 31 . 15 1 1 A 4 4 ARG HA H 4 4.314 4.097 0.217 1
1 39 . 15 1 1 A 4 4 ARG CA C 4 56.779 58.983 -2.204 1
1 40 . 15 1 1 A 4 4 ARG N N 4 123.739 121.239 2.500 1
1 41 . 15 1 1 A 5 5 LYS H H 5 8.328 8.138 0.190 1
1 42 . 15 1 1 A 5 5 LYS HA H 5 4.127 4.078 0.049 1
1 49 . 15 1 1 A 5 5 LYS CA C 5 57.431 59.371 -1.940 1
1 51 . 15 1 1 A 5 5 LYS N N 5 120.706 118.966 1.740 1
1 52 . 15 1 1 A 6 6 ASN H H 6 8.115 8.044 0.071 1
1 57 . 15 1 1 A 6 6 ASN CA C 6 53.066 55.178 -2.112 1
1 58 . 15 1 1 A 6 6 ASN CB C 6 39.187 38.802 0.385 1
1 59 . 15 1 1 A 6 6 ASN N N 6 117.807 115.411 2.396 1
1 60 . 15 1 1 A 7 7 GLY H H 7 8.499 7.997 0.502 1
1 61 . 15 1 1 A 7 7 GLY HA2 H 7 4.051 4.161 -0.110 1
1 62 . 15 1 1 A 7 7 GLY HA3 H 7 4.051 4.241 -0.190 1
1 63 . 15 1 1 A 7 7 GLY CA C 7 46.153 44.570 1.583 1
1 64 . 15 1 1 A 7 7 GLY N N 7 108.804 104.717 4.087 1
1 65 . 15 1 1 A 8 8 ILE H H 8 8.496 8.856 -0.360 1
1 75 . 15 1 1 A 8 8 ILE CB C 8 38.082 37.524 0.558 1
1 76 . 15 1 1 A 8 8 ILE N N 8 121.041 124.421 -3.380 1
1 77 . 15 1 1 A 9 9 GLY H H 9 8.656 8.182 0.474 1
1 78 . 15 1 1 A 9 9 GLY HA2 H 9 3.671 3.977 -0.306 1
1 79 . 15 1 1 A 9 9 GLY HA3 H 9 3.671 4.010 -0.339 1
1 80 . 15 1 1 A 9 9 GLY CA C 9 47.324 45.439 1.885 1
1 81 . 15 1 1 A 9 9 GLY N N 9 108.767 109.966 -1.199 1
1 82 . 15 1 1 A 10 10 TYR H H 10 7.987 8.473 -0.486 1
1 83 . 15 1 1 A 10 10 TYR HA H 10 4.269 4.364 -0.095 1
1 90 . 15 1 1 A 10 10 TYR CA C 10 60.713 60.087 0.626 1
1 91 . 15 1 1 A 10 10 TYR CB C 10 38.354 37.573 0.781 1
1 92 . 15 1 1 A 10 10 TYR N N 10 121.261 120.076 1.185 1
1 93 . 15 1 1 A 11 11 ALA H H 11 8.020 7.359 0.661 1
1 94 . 15 1 1 A 11 11 ALA HA H 11 4.040 3.721 0.319 1
1 98 . 15 1 1 A 11 11 ALA CA C 11 55.355 54.737 0.618 1
1 99 . 15 1 1 A 11 11 ALA CB C 11 18.737 18.051 0.686 1
1 100 . 15 1 1 A 11 11 ALA N N 11 122.295 122.987 -0.692 1
1 101 . 15 1 1 A 12 12 ILE H H 12 8.308 8.049 0.259 1
1 102 . 15 1 1 A 12 12 ILE HA H 12 3.732 3.898 -0.166 1
1 111 . 15 1 1 A 12 12 ILE CB C 12 37.611 37.651 -0.040 1
1 112 . 15 1 1 A 12 12 ILE N N 12 116.853 118.637 -1.784 1
1 113 . 15 1 1 A 13 13 GLY H H 13 8.171 8.138 0.033 1
1 114 . 15 1 1 A 13 13 GLY HA2 H 13 3.744 3.790 -0.046 1
1 115 . 15 1 1 A 13 13 GLY HA3 H 13 3.744 3.807 -0.063 1
1 116 . 15 1 1 A 13 13 GLY CA C 13 47.343 47.313 0.030 1
1 117 . 15 1 1 A 13 13 GLY N N 13 107.089 109.416 -2.327 1
1 118 . 15 1 1 A 14 14 TYR H H 14 8.223 8.627 -0.404 1
1 119 . 15 1 1 A 14 14 TYR HA H 14 4.147 4.134 0.013 1
1 126 . 15 1 1 A 14 14 TYR CB C 14 38.415 39.057 -0.642 1
1 127 . 15 1 1 A 14 14 TYR N N 14 122.935 123.130 -0.195 1
1 128 . 15 1 1 A 15 15 ALA H H 15 8.345 8.349 -0.004 1
1 129 . 15 1 1 A 15 15 ALA HA H 15 3.986 3.663 0.323 1
1 133 . 15 1 1 A 15 15 ALA CA C 15 55.067 54.959 0.108 1
1 134 . 15 1 1 A 15 15 ALA N N 15 121.882 121.166 0.716 1
1 135 . 15 1 1 A 16 16 PHE H H 16 8.668 8.473 0.195 1
1 136 . 15 1 1 A 16 16 PHE HA H 16 4.138 4.234 -0.096 1
1 143 . 15 1 1 A 16 16 PHE CA C 16 61.116 60.945 0.171 1
1 144 . 15 1 1 A 16 16 PHE CB C 16 38.857 39.182 -0.325 1
1 145 . 15 1 1 A 16 16 PHE N N 16 116.563 119.395 -2.832 1
1 146 . 15 1 1 A 17 17 GLY H H 17 8.163 9.054 -0.891 1
1 147 . 15 1 1 A 17 17 GLY HA2 H 17 3.891 3.896 -0.005 1
1 148 . 15 1 1 A 17 17 GLY HA3 H 17 3.891 3.922 -0.031 1
1 149 . 15 1 1 A 17 17 GLY N N 17 105.893 106.871 -0.978 1
1 150 . 15 1 1 A 18 18 ALA H H 18 7.842 7.797 0.045 1
1 151 . 15 1 1 A 18 18 ALA HA H 18 4.035 3.952 0.083 1
1 155 . 15 1 1 A 18 18 ALA CA C 18 55.037 54.654 0.383 1
1 156 . 15 1 1 A 18 18 ALA CB C 18 18.223 18.463 -0.240 1
1 157 . 15 1 1 A 18 18 ALA N N 18 122.050 124.239 -2.189 1
1 158 . 15 1 1 A 19 19 VAL H H 19 8.010 7.610 0.400 1
1 159 . 15 1 1 A 19 19 VAL HA H 19 3.549 3.732 -0.183 1
1 167 . 15 1 1 A 19 19 VAL CA C 19 66.571 65.058 1.513 1
1 168 . 15 1 1 A 19 19 VAL CB C 19 31.436 31.517 -0.081 1
1 171 . 15 1 1 A 19 19 VAL N N 19 118.184 116.319 1.865 1
1 172 . 15 1 1 A 20 20 GLU H H 20 8.339 8.700 -0.361 1
1 173 . 15 1 1 A 20 20 GLU HA H 20 3.666 4.047 -0.381 1
1 178 . 15 1 1 A 20 20 GLU CA C 20 60.103 59.438 0.665 1
1 180 . 15 1 1 A 20 20 GLU N N 20 118.704 120.538 -1.834 1
1 181 . 15 1 1 A 21 21 ARG H H 21 7.939 8.284 -0.345 1
1 182 . 15 1 1 A 21 21 ARG HA H 21 3.935 4.025 -0.090 1
1 190 . 15 1 1 A 21 21 ARG N N 21 116.955 120.887 -3.932 1
1 191 . 15 1 1 A 22 22 ALA H H 22 7.784 7.369 0.415 1
1 192 . 15 1 1 A 22 22 ALA HA H 22 4.166 4.101 0.065 1
1 196 . 15 1 1 A 22 22 ALA CA C 22 54.645 54.942 -0.297 1
1 197 . 15 1 1 A 22 22 ALA CB C 22 18.724 18.360 0.364 1
1 198 . 15 1 1 A 22 22 ALA N N 22 121.252 121.871 -0.619 1
1 199 . 15 1 1 A 23 23 VAL H H 23 8.086 7.501 0.585 1
1 200 . 15 1 1 A 23 23 VAL HA H 23 3.872 3.768 0.104 1
1 208 . 15 1 1 A 23 23 VAL CA C 23 64.928 65.868 -0.940 1
1 209 . 15 1 1 A 23 23 VAL CB C 23 32.451 31.445 1.006 1
1 212 . 15 1 1 A 23 23 VAL N N 23 114.516 118.602 -4.086 1
1 213 . 15 1 1 A 24 24 LEU H H 24 8.060 7.651 0.409 1
1 223 . 15 1 1 A 24 24 LEU N N 24 118.014 120.313 -2.299 1
1 224 . 15 1 1 A 25 25 GLY H H 25 7.880 8.072 -0.192 1
1 225 . 15 1 1 A 25 25 GLY HA2 H 25 3.949 3.710 0.239 1
1 226 . 15 1 1 A 25 25 GLY HA3 H 25 3.966 3.711 0.255 1
1 227 . 15 1 1 A 25 25 GLY CA C 25 45.959 47.239 -1.280 1
1 228 . 15 1 1 A 25 25 GLY N N 25 106.969 106.491 0.478 1
1 229 . 15 1 1 A 26 26 GLY H H 26 8.123 7.058 1.065 1
1 230 . 15 1 1 A 26 26 GLY HA2 H 26 3.912 4.066 -0.154 1
1 231 . 15 1 1 A 26 26 GLY HA3 H 26 4.002 4.069 -0.067 1
1 232 . 15 1 1 A 26 26 GLY CA C 26 45.691 45.799 -0.108 1
1 233 . 15 1 1 A 26 26 GLY N N 26 108.223 104.030 4.193 1
1 234 . 15 1 1 A 27 27 SER H H 27 8.201 8.874 -0.673 1
1 235 . 15 1 1 A 27 27 SER HA H 27 4.353 5.276 -0.923 1
1 238 . 15 1 1 A 27 27 SER CA C 27 59.117 56.966 2.151 1
1 239 . 15 1 1 A 27 27 SER CB C 27 63.770 66.428 -2.658 1
1 240 . 15 1 1 A 27 27 SER N N 27 115.317 121.673 -6.356 1
1 241 . 15 1 1 A 28 28 ARG H H 28 8.155 8.782 -0.627 1
1 242 . 15 1 1 A 28 28 ARG HA H 28 4.258 4.096 0.162 1
1 250 . 15 1 1 A 28 28 ARG CA C 28 56.348 58.316 -1.968 1
1 251 . 15 1 1 A 28 28 ARG N N 28 121.519 118.870 2.649 1
1 252 . 15 1 1 A 29 29 ASP H H 29 8.167 8.587 -0.420 1
1 255 . 15 1 1 A 29 29 ASP CB C 29 38.462 43.274 -4.812 1
1 256 . 15 1 1 A 29 29 ASP N N 29 118.393 121.774 -3.381 1
1 257 . 15 1 1 A 30 30 TYR H H 30 7.910 7.754 0.156 1
1 258 . 15 1 1 A 30 30 TYR HA H 30 4.484 4.599 -0.115 1
1 265 . 15 1 1 A 30 30 TYR CA C 30 58.097 56.687 1.410 1
1 266 . 15 1 1 A 30 30 TYR CB C 30 38.759 36.496 2.263 1
1 267 . 15 1 1 A 30 30 TYR N N 30 119.859 116.614 3.245 1
1 268 . 15 1 1 A 31 31 ASN H H 31 8.152 7.927 0.225 1
1 269 . 15 1 1 A 31 31 ASN HA H 31 4.658 5.359 -0.701 1
1 274 . 15 1 1 A 31 31 ASN CA C 31 53.245 53.136 0.109 1
1 275 . 15 1 1 A 31 31 ASN CB C 31 39.156 40.671 -1.515 1
1 276 . 15 1 1 A 31 31 ASN N N 31 119.343 122.880 -3.537 1
1 13 . 16 1 1 A 2 2 ARG H H 2 8.864 9.452 -0.588 1
1 14 . 16 1 1 A 2 2 ARG HA H 2 4.393 4.017 0.376 1
1 22 . 16 1 1 A 2 2 ARG CA C 2 56.327 57.220 -0.893 1
1 23 . 16 1 1 A 2 2 ARG N N 2 124.285 119.709 4.576 1
1 24 . 16 1 1 A 3 3 SER H H 3 8.495 8.407 0.088 1
1 25 . 16 1 1 A 3 3 SER HA H 3 4.491 4.218 0.273 1
1 28 . 16 1 1 A 3 3 SER CB C 3 64.117 63.063 1.054 1
1 29 . 16 1 1 A 3 3 SER N N 3 117.670 113.407 4.263 1
1 30 . 16 1 1 A 4 4 ARG H H 4 8.672 8.119 0.553 1
1 31 . 16 1 1 A 4 4 ARG HA H 4 4.314 4.270 0.044 1
1 39 . 16 1 1 A 4 4 ARG CA C 4 56.779 57.551 -0.772 1
1 40 . 16 1 1 A 4 4 ARG N N 4 123.739 119.687 4.052 1
1 41 . 16 1 1 A 5 5 LYS H H 5 8.328 7.666 0.662 1
1 42 . 16 1 1 A 5 5 LYS HA H 5 4.127 4.096 0.031 1
1 49 . 16 1 1 A 5 5 LYS CA C 5 57.431 59.168 -1.737 1
1 51 . 16 1 1 A 5 5 LYS N N 5 120.706 117.912 2.794 1
1 52 . 16 1 1 A 6 6 ASN H H 6 8.115 8.267 -0.152 1
1 57 . 16 1 1 A 6 6 ASN CA C 6 53.066 53.901 -0.835 1
1 58 . 16 1 1 A 6 6 ASN CB C 6 39.187 37.815 1.372 1
1 59 . 16 1 1 A 6 6 ASN N N 6 117.807 117.760 0.047 1
1 60 . 16 1 1 A 7 7 GLY H H 7 8.499 8.607 -0.108 1
1 61 . 16 1 1 A 7 7 GLY HA2 H 7 4.051 4.108 -0.057 1
1 62 . 16 1 1 A 7 7 GLY HA3 H 7 4.051 4.272 -0.221 1
1 63 . 16 1 1 A 7 7 GLY CA C 7 46.153 45.671 0.482 1
1 64 . 16 1 1 A 7 7 GLY N N 7 108.804 113.450 -4.646 1
1 65 . 16 1 1 A 8 8 ILE H H 8 8.496 7.989 0.507 1
1 75 . 16 1 1 A 8 8 ILE CB C 8 38.082 39.335 -1.253 1
1 76 . 16 1 1 A 8 8 ILE N N 8 121.041 121.914 -0.873 1
1 77 . 16 1 1 A 9 9 GLY H H 9 8.656 8.500 0.156 1
1 78 . 16 1 1 A 9 9 GLY HA2 H 9 3.671 3.732 -0.061 1
1 79 . 16 1 1 A 9 9 GLY HA3 H 9 3.671 3.761 -0.090 1
1 80 . 16 1 1 A 9 9 GLY CA C 9 47.324 47.175 0.149 1
1 81 . 16 1 1 A 9 9 GLY N N 9 108.767 109.447 -0.680 1
1 82 . 16 1 1 A 10 10 TYR H H 10 7.987 8.234 -0.247 1
1 83 . 16 1 1 A 10 10 TYR HA H 10 4.269 4.416 -0.147 1
1 90 . 16 1 1 A 10 10 TYR CA C 10 60.713 60.001 0.712 1
1 91 . 16 1 1 A 10 10 TYR CB C 10 38.354 37.565 0.789 1
1 92 . 16 1 1 A 10 10 TYR N N 10 121.261 120.098 1.163 1
1 93 . 16 1 1 A 11 11 ALA H H 11 8.020 7.529 0.491 1
1 94 . 16 1 1 A 11 11 ALA HA H 11 4.040 3.624 0.416 1
1 98 . 16 1 1 A 11 11 ALA CA C 11 55.355 54.655 0.700 1
1 99 . 16 1 1 A 11 11 ALA CB C 11 18.737 18.227 0.510 1
1 100 . 16 1 1 A 11 11 ALA N N 11 122.295 123.378 -1.083 1
1 101 . 16 1 1 A 12 12 ILE H H 12 8.308 7.718 0.590 1
1 102 . 16 1 1 A 12 12 ILE HA H 12 3.732 3.914 -0.182 1
1 111 . 16 1 1 A 12 12 ILE CB C 12 37.611 37.715 -0.104 1
1 112 . 16 1 1 A 12 12 ILE N N 12 116.853 118.636 -1.783 1
1 113 . 16 1 1 A 13 13 GLY H H 13 8.171 8.399 -0.228 1
1 114 . 16 1 1 A 13 13 GLY HA2 H 13 3.744 3.792 -0.048 1
1 115 . 16 1 1 A 13 13 GLY HA3 H 13 3.744 3.804 -0.060 1
1 116 . 16 1 1 A 13 13 GLY CA C 13 47.343 47.215 0.128 1
1 117 . 16 1 1 A 13 13 GLY N N 13 107.089 109.424 -2.335 1
1 118 . 16 1 1 A 14 14 TYR H H 14 8.223 8.611 -0.388 1
1 119 . 16 1 1 A 14 14 TYR HA H 14 4.147 4.132 0.015 1
1 126 . 16 1 1 A 14 14 TYR CB C 14 38.415 39.071 -0.656 1
1 127 . 16 1 1 A 14 14 TYR N N 14 122.935 123.140 -0.205 1
1 128 . 16 1 1 A 15 15 ALA H H 15 8.345 8.340 0.005 1
1 129 . 16 1 1 A 15 15 ALA HA H 15 3.986 3.835 0.151 1
1 133 . 16 1 1 A 15 15 ALA CA C 15 55.067 55.005 0.062 1
1 134 . 16 1 1 A 15 15 ALA N N 15 121.882 121.603 0.279 1
1 135 . 16 1 1 A 16 16 PHE H H 16 8.668 8.558 0.110 1
1 136 . 16 1 1 A 16 16 PHE HA H 16 4.138 4.238 -0.100 1
1 143 . 16 1 1 A 16 16 PHE CA C 16 61.116 60.946 0.170 1
1 144 . 16 1 1 A 16 16 PHE CB C 16 38.857 39.265 -0.408 1
1 145 . 16 1 1 A 16 16 PHE N N 16 116.563 119.411 -2.848 1
1 146 . 16 1 1 A 17 17 GLY H H 17 8.163 9.066 -0.903 1
1 147 . 16 1 1 A 17 17 GLY HA2 H 17 3.891 3.882 0.009 1
1 148 . 16 1 1 A 17 17 GLY HA3 H 17 3.891 3.896 -0.005 1
1 149 . 16 1 1 A 17 17 GLY N N 17 105.893 106.876 -0.983 1
1 150 . 16 1 1 A 18 18 ALA H H 18 7.842 7.693 0.149 1
1 151 . 16 1 1 A 18 18 ALA HA H 18 4.035 3.944 0.091 1
1 155 . 16 1 1 A 18 18 ALA CA C 18 55.037 54.654 0.383 1
1 156 . 16 1 1 A 18 18 ALA CB C 18 18.223 18.574 -0.351 1
1 157 . 16 1 1 A 18 18 ALA N N 18 122.050 124.580 -2.530 1
1 158 . 16 1 1 A 19 19 VAL H H 19 8.010 7.749 0.261 1
1 159 . 16 1 1 A 19 19 VAL HA H 19 3.549 3.762 -0.213 1
1 167 . 16 1 1 A 19 19 VAL CA C 19 66.571 65.108 1.463 1
1 168 . 16 1 1 A 19 19 VAL CB C 19 31.436 31.495 -0.059 1
1 171 . 16 1 1 A 19 19 VAL N N 19 118.184 116.203 1.981 1
1 172 . 16 1 1 A 20 20 GLU H H 20 8.339 8.541 -0.202 1
1 173 . 16 1 1 A 20 20 GLU HA H 20 3.666 4.041 -0.375 1
1 178 . 16 1 1 A 20 20 GLU CA C 20 60.103 59.436 0.667 1
1 180 . 16 1 1 A 20 20 GLU N N 20 118.704 120.837 -2.133 1
1 181 . 16 1 1 A 21 21 ARG H H 21 7.939 8.293 -0.354 1
1 182 . 16 1 1 A 21 21 ARG HA H 21 3.935 4.012 -0.077 1
1 190 . 16 1 1 A 21 21 ARG N N 21 116.955 120.820 -3.865 1
1 191 . 16 1 1 A 22 22 ALA H H 22 7.784 7.838 -0.054 1
1 192 . 16 1 1 A 22 22 ALA HA H 22 4.166 4.068 0.098 1
1 196 . 16 1 1 A 22 22 ALA CA C 22 54.645 55.191 -0.546 1
1 197 . 16 1 1 A 22 22 ALA CB C 22 18.724 18.424 0.300 1
1 198 . 16 1 1 A 22 22 ALA N N 22 121.252 122.138 -0.886 1
1 199 . 16 1 1 A 23 23 VAL H H 23 8.086 8.040 0.046 1
1 200 . 16 1 1 A 23 23 VAL HA H 23 3.872 3.637 0.235 1
1 208 . 16 1 1 A 23 23 VAL CA C 23 64.928 66.380 -1.452 1
1 209 . 16 1 1 A 23 23 VAL CB C 23 32.451 31.697 0.754 1
1 212 . 16 1 1 A 23 23 VAL N N 23 114.516 118.488 -3.972 1
1 213 . 16 1 1 A 24 24 LEU H H 24 8.060 7.478 0.582 1
1 223 . 16 1 1 A 24 24 LEU N N 24 118.014 118.367 -0.353 1
1 224 . 16 1 1 A 25 25 GLY H H 25 7.880 7.671 0.209 1
1 225 . 16 1 1 A 25 25 GLY HA2 H 25 3.949 4.046 -0.097 1
1 226 . 16 1 1 A 25 25 GLY HA3 H 25 3.966 4.046 -0.080 1
1 227 . 16 1 1 A 25 25 GLY CA C 25 45.959 44.854 1.105 1
1 228 . 16 1 1 A 25 25 GLY N N 25 106.969 106.239 0.730 1
1 229 . 16 1 1 A 26 26 GLY H H 26 8.123 8.301 -0.178 1
1 230 . 16 1 1 A 26 26 GLY HA2 H 26 3.912 4.179 -0.267 1
1 231 . 16 1 1 A 26 26 GLY HA3 H 26 4.002 4.180 -0.178 1
1 232 . 16 1 1 A 26 26 GLY CA C 26 45.691 45.628 0.063 1
1 233 . 16 1 1 A 26 26 GLY N N 26 108.223 110.387 -2.164 1
1 234 . 16 1 1 A 27 27 SER H H 27 8.201 8.818 -0.617 1
1 235 . 16 1 1 A 27 27 SER HA H 27 4.353 5.135 -0.782 1
1 238 . 16 1 1 A 27 27 SER CA C 27 59.117 57.569 1.548 1
1 239 . 16 1 1 A 27 27 SER CB C 27 63.770 65.649 -1.879 1
1 240 . 16 1 1 A 27 27 SER N N 27 115.317 117.507 -2.190 1
1 241 . 16 1 1 A 28 28 ARG H H 28 8.155 8.601 -0.446 1
1 242 . 16 1 1 A 28 28 ARG HA H 28 4.258 4.904 -0.646 1
1 250 . 16 1 1 A 28 28 ARG CA C 28 56.348 54.888 1.460 1
1 251 . 16 1 1 A 28 28 ARG N N 28 121.519 121.159 0.360 1
1 252 . 16 1 1 A 29 29 ASP H H 29 8.167 9.381 -1.214 1
1 255 . 16 1 1 A 29 29 ASP CB C 29 38.462 39.693 -1.231 1
1 256 . 16 1 1 A 29 29 ASP N N 29 118.393 119.762 -1.369 1
1 257 . 16 1 1 A 30 30 TYR H H 30 7.910 8.486 -0.576 1
1 258 . 16 1 1 A 30 30 TYR HA H 30 4.484 4.157 0.327 1
1 265 . 16 1 1 A 30 30 TYR CA C 30 58.097 58.509 -0.412 1
1 266 . 16 1 1 A 30 30 TYR CB C 30 38.759 35.898 2.861 1
1 267 . 16 1 1 A 30 30 TYR N N 30 119.859 112.090 7.769 1
1 268 . 16 1 1 A 31 31 ASN H H 31 8.152 7.892 0.260 1
1 269 . 16 1 1 A 31 31 ASN HA H 31 4.658 4.399 0.259 1
1 274 . 16 1 1 A 31 31 ASN CA C 31 53.245 56.048 -2.803 1
1 275 . 16 1 1 A 31 31 ASN CB C 31 39.156 38.867 0.289 1
1 276 . 16 1 1 A 31 31 ASN N N 31 119.343 117.396 1.947 1
1 13 . 17 1 1 A 2 2 ARG H H 2 8.864 9.017 -0.153 1
1 14 . 17 1 1 A 2 2 ARG HA H 2 4.393 3.748 0.645 1
1 22 . 17 1 1 A 2 2 ARG CA C 2 56.327 57.083 -0.756 1
1 23 . 17 1 1 A 2 2 ARG N N 2 124.285 124.517 -0.232 1
1 24 . 17 1 1 A 3 3 SER H H 3 8.495 7.933 0.562 1
1 25 . 17 1 1 A 3 3 SER HA H 3 4.491 4.622 -0.131 1
1 28 . 17 1 1 A 3 3 SER CB C 3 64.117 63.641 0.476 1
1 29 . 17 1 1 A 3 3 SER N N 3 117.670 113.382 4.288 1
1 30 . 17 1 1 A 4 4 ARG H H 4 8.672 7.740 0.932 1
1 31 . 17 1 1 A 4 4 ARG HA H 4 4.314 4.143 0.171 1
1 39 . 17 1 1 A 4 4 ARG CA C 4 56.779 58.597 -1.818 1
1 40 . 17 1 1 A 4 4 ARG N N 4 123.739 121.961 1.778 1
1 41 . 17 1 1 A 5 5 LYS H H 5 8.328 7.694 0.634 1
1 42 . 17 1 1 A 5 5 LYS HA H 5 4.127 4.378 -0.251 1
1 49 . 17 1 1 A 5 5 LYS CA C 5 57.431 56.215 1.216 1
1 51 . 17 1 1 A 5 5 LYS N N 5 120.706 117.088 3.618 1
1 52 . 17 1 1 A 6 6 ASN H H 6 8.115 8.198 -0.083 1
1 57 . 17 1 1 A 6 6 ASN CA C 6 53.066 53.910 -0.844 1
1 58 . 17 1 1 A 6 6 ASN CB C 6 39.187 37.390 1.797 1
1 59 . 17 1 1 A 6 6 ASN N N 6 117.807 116.664 1.143 1
1 60 . 17 1 1 A 7 7 GLY H H 7 8.499 8.291 0.208 1
1 61 . 17 1 1 A 7 7 GLY HA2 H 7 4.051 4.201 -0.150 1
1 62 . 17 1 1 A 7 7 GLY HA3 H 7 4.051 4.329 -0.278 1
1 63 . 17 1 1 A 7 7 GLY CA C 7 46.153 45.304 0.849 1
1 64 . 17 1 1 A 7 7 GLY N N 7 108.804 110.902 -2.098 1
1 65 . 17 1 1 A 8 8 ILE H H 8 8.496 8.151 0.345 1
1 75 . 17 1 1 A 8 8 ILE CB C 8 38.082 40.771 -2.689 1
1 76 . 17 1 1 A 8 8 ILE N N 8 121.041 119.129 1.912 1
1 77 . 17 1 1 A 9 9 GLY H H 9 8.656 8.233 0.423 1
1 78 . 17 1 1 A 9 9 GLY HA2 H 9 3.671 3.963 -0.292 1
1 79 . 17 1 1 A 9 9 GLY HA3 H 9 3.671 3.996 -0.325 1
1 80 . 17 1 1 A 9 9 GLY CA C 9 47.324 45.468 1.856 1
1 81 . 17 1 1 A 9 9 GLY N N 9 108.767 109.504 -0.737 1
1 82 . 17 1 1 A 10 10 TYR H H 10 7.987 8.477 -0.490 1
1 83 . 17 1 1 A 10 10 TYR HA H 10 4.269 4.395 -0.126 1
1 90 . 17 1 1 A 10 10 TYR CA C 10 60.713 60.096 0.617 1
1 91 . 17 1 1 A 10 10 TYR CB C 10 38.354 37.553 0.801 1
1 92 . 17 1 1 A 10 10 TYR N N 10 121.261 120.071 1.190 1
1 93 . 17 1 1 A 11 11 ALA H H 11 8.020 7.332 0.688 1
1 94 . 17 1 1 A 11 11 ALA HA H 11 4.040 3.645 0.395 1
1 98 . 17 1 1 A 11 11 ALA CA C 11 55.355 54.683 0.672 1
1 99 . 17 1 1 A 11 11 ALA CB C 11 18.737 18.062 0.675 1
1 100 . 17 1 1 A 11 11 ALA N N 11 122.295 122.948 -0.653 1
1 101 . 17 1 1 A 12 12 ILE H H 12 8.308 8.000 0.308 1
1 102 . 17 1 1 A 12 12 ILE HA H 12 3.732 3.893 -0.161 1
1 111 . 17 1 1 A 12 12 ILE CB C 12 37.611 37.639 -0.028 1
1 112 . 17 1 1 A 12 12 ILE N N 12 116.853 118.620 -1.767 1
1 113 . 17 1 1 A 13 13 GLY H H 13 8.171 8.281 -0.110 1
1 114 . 17 1 1 A 13 13 GLY HA2 H 13 3.744 3.794 -0.050 1
1 115 . 17 1 1 A 13 13 GLY HA3 H 13 3.744 3.804 -0.060 1
1 116 . 17 1 1 A 13 13 GLY CA C 13 47.343 47.175 0.168 1
1 117 . 17 1 1 A 13 13 GLY N N 13 107.089 109.480 -2.391 1
1 118 . 17 1 1 A 14 14 TYR H H 14 8.223 8.647 -0.424 1
1 119 . 17 1 1 A 14 14 TYR HA H 14 4.147 4.160 -0.013 1
1 126 . 17 1 1 A 14 14 TYR CB C 14 38.415 38.952 -0.537 1
1 127 . 17 1 1 A 14 14 TYR N N 14 122.935 123.108 -0.173 1
1 128 . 17 1 1 A 15 15 ALA H H 15 8.345 8.253 0.092 1
1 129 . 17 1 1 A 15 15 ALA HA H 15 3.986 3.974 0.012 1
1 133 . 17 1 1 A 15 15 ALA CA C 15 55.067 55.095 -0.028 1
1 134 . 17 1 1 A 15 15 ALA N N 15 121.882 121.785 0.097 1
1 135 . 17 1 1 A 16 16 PHE H H 16 8.668 8.577 0.091 1
1 136 . 17 1 1 A 16 16 PHE HA H 16 4.138 4.260 -0.122 1
1 143 . 17 1 1 A 16 16 PHE CA C 16 61.116 60.972 0.144 1
1 144 . 17 1 1 A 16 16 PHE CB C 16 38.857 39.197 -0.340 1
1 145 . 17 1 1 A 16 16 PHE N N 16 116.563 119.418 -2.855 1
1 146 . 17 1 1 A 17 17 GLY H H 17 8.163 8.975 -0.812 1
1 147 . 17 1 1 A 17 17 GLY HA2 H 17 3.891 3.892 -0.001 1
1 148 . 17 1 1 A 17 17 GLY HA3 H 17 3.891 3.914 -0.023 1
1 149 . 17 1 1 A 17 17 GLY N N 17 105.893 106.879 -0.986 1
1 150 . 17 1 1 A 18 18 ALA H H 18 7.842 7.936 -0.094 1
1 151 . 17 1 1 A 18 18 ALA HA H 18 4.035 3.926 0.109 1
1 155 . 17 1 1 A 18 18 ALA CA C 18 55.037 54.651 0.386 1
1 156 . 17 1 1 A 18 18 ALA CB C 18 18.223 18.489 -0.266 1
1 157 . 17 1 1 A 18 18 ALA N N 18 122.050 124.414 -2.364 1
1 158 . 17 1 1 A 19 19 VAL H H 19 8.010 7.669 0.341 1
1 159 . 17 1 1 A 19 19 VAL HA H 19 3.549 3.755 -0.206 1
1 167 . 17 1 1 A 19 19 VAL CA C 19 66.571 65.061 1.510 1
1 168 . 17 1 1 A 19 19 VAL CB C 19 31.436 31.540 -0.104 1
1 171 . 17 1 1 A 19 19 VAL N N 19 118.184 116.541 1.643 1
1 172 . 17 1 1 A 20 20 GLU H H 20 8.339 8.559 -0.220 1
1 173 . 17 1 1 A 20 20 GLU HA H 20 3.666 4.051 -0.385 1
1 178 . 17 1 1 A 20 20 GLU CA C 20 60.103 59.456 0.647 1
1 180 . 17 1 1 A 20 20 GLU N N 20 118.704 120.545 -1.841 1
1 181 . 17 1 1 A 21 21 ARG H H 21 7.939 8.113 -0.174 1
1 182 . 17 1 1 A 21 21 ARG HA H 21 3.935 4.019 -0.084 1
1 190 . 17 1 1 A 21 21 ARG N N 21 116.955 120.747 -3.792 1
1 191 . 17 1 1 A 22 22 ALA H H 22 7.784 7.389 0.395 1
1 192 . 17 1 1 A 22 22 ALA HA H 22 4.166 4.029 0.137 1
1 196 . 17 1 1 A 22 22 ALA CA C 22 54.645 55.172 -0.527 1
1 197 . 17 1 1 A 22 22 ALA CB C 22 18.724 18.183 0.541 1
1 198 . 17 1 1 A 22 22 ALA N N 22 121.252 122.122 -0.870 1
1 199 . 17 1 1 A 23 23 VAL H H 23 8.086 7.644 0.442 1
1 200 . 17 1 1 A 23 23 VAL HA H 23 3.872 3.712 0.160 1
1 208 . 17 1 1 A 23 23 VAL CA C 23 64.928 66.256 -1.328 1
1 209 . 17 1 1 A 23 23 VAL CB C 23 32.451 31.673 0.778 1
1 212 . 17 1 1 A 23 23 VAL N N 23 114.516 118.078 -3.562 1
1 213 . 17 1 1 A 24 24 LEU H H 24 8.060 7.723 0.337 1
1 223 . 17 1 1 A 24 24 LEU N N 24 118.014 118.671 -0.657 1
1 224 . 17 1 1 A 25 25 GLY H H 25 7.880 8.169 -0.289 1
1 225 . 17 1 1 A 25 25 GLY HA2 H 25 3.949 3.993 -0.044 1
1 226 . 17 1 1 A 25 25 GLY HA3 H 25 3.966 3.993 -0.027 1
1 227 . 17 1 1 A 25 25 GLY CA C 25 45.959 46.051 -0.092 1
1 228 . 17 1 1 A 25 25 GLY N N 25 106.969 108.202 -1.233 1
1 229 . 17 1 1 A 26 26 GLY H H 26 8.123 8.317 -0.194 1
1 230 . 17 1 1 A 26 26 GLY HA2 H 26 3.912 4.202 -0.290 1
1 231 . 17 1 1 A 26 26 GLY HA3 H 26 4.002 4.203 -0.201 1
1 232 . 17 1 1 A 26 26 GLY CA C 26 45.691 45.991 -0.300 1
1 233 . 17 1 1 A 26 26 GLY N N 26 108.223 110.507 -2.284 1
1 234 . 17 1 1 A 27 27 SER H H 27 8.201 8.344 -0.143 1
1 235 . 17 1 1 A 27 27 SER HA H 27 4.353 5.031 -0.678 1
1 238 . 17 1 1 A 27 27 SER CA C 27 59.117 57.554 1.563 1
1 239 . 17 1 1 A 27 27 SER CB C 27 63.770 65.327 -1.557 1
1 240 . 17 1 1 A 27 27 SER N N 27 115.317 114.640 0.677 1
1 241 . 17 1 1 A 28 28 ARG H H 28 8.155 8.756 -0.601 1
1 242 . 17 1 1 A 28 28 ARG HA H 28 4.258 5.155 -0.897 1
1 250 . 17 1 1 A 28 28 ARG CA C 28 56.348 54.914 1.434 1
1 251 . 17 1 1 A 28 28 ARG N N 28 121.519 119.580 1.939 1
1 252 . 17 1 1 A 29 29 ASP H H 29 8.167 9.013 -0.846 1
1 255 . 17 1 1 A 29 29 ASP CB C 29 38.462 43.875 -5.413 1
1 256 . 17 1 1 A 29 29 ASP N N 29 118.393 119.783 -1.390 1
1 257 . 17 1 1 A 30 30 TYR H H 30 7.910 7.884 0.026 1
1 258 . 17 1 1 A 30 30 TYR HA H 30 4.484 4.774 -0.290 1
1 265 . 17 1 1 A 30 30 TYR CA C 30 58.097 57.746 0.351 1
1 266 . 17 1 1 A 30 30 TYR CB C 30 38.759 40.427 -1.668 1
1 267 . 17 1 1 A 30 30 TYR N N 30 119.859 116.291 3.568 1
1 268 . 17 1 1 A 31 31 ASN H H 31 8.152 9.033 -0.881 1
1 269 . 17 1 1 A 31 31 ASN HA H 31 4.658 5.090 -0.432 1
1 274 . 17 1 1 A 31 31 ASN CA C 31 53.245 51.827 1.418 1
1 275 . 17 1 1 A 31 31 ASN CB C 31 39.156 37.617 1.539 1
1 276 . 17 1 1 A 31 31 ASN N N 31 119.343 121.011 -1.668 1
1 13 . 18 1 1 A 2 2 ARG H H 2 8.864 7.955 0.909 1
1 14 . 18 1 1 A 2 2 ARG HA H 2 4.393 4.725 -0.332 1
1 22 . 18 1 1 A 2 2 ARG CA C 2 56.327 55.110 1.217 1
1 23 . 18 1 1 A 2 2 ARG N N 2 124.285 116.977 7.308 1
1 24 . 18 1 1 A 3 3 SER H H 3 8.495 7.885 0.610 1
1 25 . 18 1 1 A 3 3 SER HA H 3 4.491 4.390 0.101 1
1 28 . 18 1 1 A 3 3 SER CB C 3 64.117 62.620 1.497 1
1 29 . 18 1 1 A 3 3 SER N N 3 117.670 115.679 1.991 1
1 30 . 18 1 1 A 4 4 ARG H H 4 8.672 7.660 1.012 1
1 31 . 18 1 1 A 4 4 ARG HA H 4 4.314 4.286 0.028 1
1 39 . 18 1 1 A 4 4 ARG CA C 4 56.779 56.650 0.129 1
1 40 . 18 1 1 A 4 4 ARG N N 4 123.739 119.510 4.229 1
1 41 . 18 1 1 A 5 5 LYS H H 5 8.328 7.857 0.471 1
1 42 . 18 1 1 A 5 5 LYS HA H 5 4.127 4.334 -0.207 1
1 49 . 18 1 1 A 5 5 LYS CA C 5 57.431 57.721 -0.290 1
1 51 . 18 1 1 A 5 5 LYS N N 5 120.706 119.699 1.007 1
1 52 . 18 1 1 A 6 6 ASN H H 6 8.115 8.160 -0.045 1
1 57 . 18 1 1 A 6 6 ASN CA C 6 53.066 54.236 -1.170 1
1 58 . 18 1 1 A 6 6 ASN CB C 6 39.187 39.744 -0.557 1
1 59 . 18 1 1 A 6 6 ASN N N 6 117.807 115.438 2.369 1
1 60 . 18 1 1 A 7 7 GLY H H 7 8.499 8.291 0.208 1
1 61 . 18 1 1 A 7 7 GLY HA2 H 7 4.051 4.101 -0.050 1
1 62 . 18 1 1 A 7 7 GLY HA3 H 7 4.051 4.270 -0.219 1
1 63 . 18 1 1 A 7 7 GLY CA C 7 46.153 46.458 -0.305 1
1 64 . 18 1 1 A 7 7 GLY N N 7 108.804 105.705 3.099 1
1 65 . 18 1 1 A 8 8 ILE H H 8 8.496 8.013 0.483 1
1 75 . 18 1 1 A 8 8 ILE CB C 8 38.082 40.485 -2.403 1
1 76 . 18 1 1 A 8 8 ILE N N 8 121.041 119.026 2.015 1
1 77 . 18 1 1 A 9 9 GLY H H 9 8.656 8.334 0.322 1
1 78 . 18 1 1 A 9 9 GLY HA2 H 9 3.671 3.902 -0.231 1
1 79 . 18 1 1 A 9 9 GLY HA3 H 9 3.671 3.934 -0.263 1
1 80 . 18 1 1 A 9 9 GLY CA C 9 47.324 45.775 1.549 1
1 81 . 18 1 1 A 9 9 GLY N N 9 108.767 109.211 -0.444 1
1 82 . 18 1 1 A 10 10 TYR H H 10 7.987 8.407 -0.420 1
1 83 . 18 1 1 A 10 10 TYR HA H 10 4.269 4.394 -0.125 1
1 90 . 18 1 1 A 10 10 TYR CA C 10 60.713 60.088 0.625 1
1 91 . 18 1 1 A 10 10 TYR CB C 10 38.354 37.575 0.779 1
1 92 . 18 1 1 A 10 10 TYR N N 10 121.261 119.945 1.316 1
1 93 . 18 1 1 A 11 11 ALA H H 11 8.020 7.374 0.646 1
1 94 . 18 1 1 A 11 11 ALA HA H 11 4.040 3.688 0.352 1
1 98 . 18 1 1 A 11 11 ALA CA C 11 55.355 54.719 0.636 1
1 99 . 18 1 1 A 11 11 ALA CB C 11 18.737 18.085 0.652 1
1 100 . 18 1 1 A 11 11 ALA N N 11 122.295 122.977 -0.682 1
1 101 . 18 1 1 A 12 12 ILE H H 12 8.308 8.065 0.243 1
1 102 . 18 1 1 A 12 12 ILE HA H 12 3.732 3.888 -0.156 1
1 111 . 18 1 1 A 12 12 ILE CB C 12 37.611 37.641 -0.030 1
1 112 . 18 1 1 A 12 12 ILE N N 12 116.853 118.628 -1.775 1
1 113 . 18 1 1 A 13 13 GLY H H 13 8.171 8.277 -0.106 1
1 114 . 18 1 1 A 13 13 GLY HA2 H 13 3.744 3.791 -0.047 1
1 115 . 18 1 1 A 13 13 GLY HA3 H 13 3.744 3.804 -0.060 1
1 116 . 18 1 1 A 13 13 GLY CA C 13 47.343 47.172 0.171 1
1 117 . 18 1 1 A 13 13 GLY N N 13 107.089 109.472 -2.383 1
1 118 . 18 1 1 A 14 14 TYR H H 14 8.223 8.633 -0.410 1
1 119 . 18 1 1 A 14 14 TYR HA H 14 4.147 4.159 -0.012 1
1 126 . 18 1 1 A 14 14 TYR CB C 14 38.415 38.743 -0.328 1
1 127 . 18 1 1 A 14 14 TYR N N 14 122.935 123.111 -0.176 1
1 128 . 18 1 1 A 15 15 ALA H H 15 8.345 8.157 0.188 1
1 129 . 18 1 1 A 15 15 ALA HA H 15 3.986 3.774 0.212 1
1 133 . 18 1 1 A 15 15 ALA CA C 15 55.067 54.962 0.105 1
1 134 . 18 1 1 A 15 15 ALA N N 15 121.882 121.630 0.252 1
1 135 . 18 1 1 A 16 16 PHE H H 16 8.668 8.542 0.126 1
1 136 . 18 1 1 A 16 16 PHE HA H 16 4.138 4.239 -0.101 1
1 143 . 18 1 1 A 16 16 PHE CA C 16 61.116 60.952 0.164 1
1 144 . 18 1 1 A 16 16 PHE CB C 16 38.857 39.165 -0.308 1
1 145 . 18 1 1 A 16 16 PHE N N 16 116.563 119.382 -2.819 1
1 146 . 18 1 1 A 17 17 GLY H H 17 8.163 9.030 -0.867 1
1 147 . 18 1 1 A 17 17 GLY HA2 H 17 3.891 3.874 0.017 1
1 148 . 18 1 1 A 17 17 GLY HA3 H 17 3.891 3.899 -0.008 1
1 149 . 18 1 1 A 17 17 GLY N N 17 105.893 106.871 -0.978 1
1 150 . 18 1 1 A 18 18 ALA H H 18 7.842 7.649 0.193 1
1 151 . 18 1 1 A 18 18 ALA HA H 18 4.035 3.946 0.089 1
1 155 . 18 1 1 A 18 18 ALA CA C 18 55.037 54.702 0.335 1
1 156 . 18 1 1 A 18 18 ALA CB C 18 18.223 18.690 -0.467 1
1 157 . 18 1 1 A 18 18 ALA N N 18 122.050 124.560 -2.510 1
1 158 . 18 1 1 A 19 19 VAL H H 19 8.010 7.599 0.411 1
1 159 . 18 1 1 A 19 19 VAL HA H 19 3.549 3.746 -0.197 1
1 167 . 18 1 1 A 19 19 VAL CA C 19 66.571 65.084 1.487 1
1 168 . 18 1 1 A 19 19 VAL CB C 19 31.436 31.494 -0.058 1
1 171 . 18 1 1 A 19 19 VAL N N 19 118.184 116.562 1.622 1
1 172 . 18 1 1 A 20 20 GLU H H 20 8.339 8.513 -0.174 1
1 173 . 18 1 1 A 20 20 GLU HA H 20 3.666 4.039 -0.373 1
1 178 . 18 1 1 A 20 20 GLU CA C 20 60.103 59.420 0.683 1
1 180 . 18 1 1 A 20 20 GLU N N 20 118.704 120.597 -1.893 1
1 181 . 18 1 1 A 21 21 ARG H H 21 7.939 8.288 -0.349 1
1 182 . 18 1 1 A 21 21 ARG HA H 21 3.935 4.005 -0.070 1
1 190 . 18 1 1 A 21 21 ARG N N 21 116.955 120.795 -3.840 1
1 191 . 18 1 1 A 22 22 ALA H H 22 7.784 7.778 0.006 1
1 192 . 18 1 1 A 22 22 ALA HA H 22 4.166 4.045 0.121 1
1 196 . 18 1 1 A 22 22 ALA CA C 22 54.645 55.228 -0.583 1
1 197 . 18 1 1 A 22 22 ALA CB C 22 18.724 18.228 0.496 1
1 198 . 18 1 1 A 22 22 ALA N N 22 121.252 121.862 -0.610 1
1 199 . 18 1 1 A 23 23 VAL H H 23 8.086 7.912 0.174 1
1 200 . 18 1 1 A 23 23 VAL HA H 23 3.872 3.550 0.322 1
1 208 . 18 1 1 A 23 23 VAL CA C 23 64.928 66.911 -1.983 1
1 209 . 18 1 1 A 23 23 VAL CB C 23 32.451 31.346 1.105 1
1 212 . 18 1 1 A 23 23 VAL N N 23 114.516 118.445 -3.929 1
1 213 . 18 1 1 A 24 24 LEU H H 24 8.060 7.788 0.272 1
1 223 . 18 1 1 A 24 24 LEU N N 24 118.014 119.342 -1.328 1
1 224 . 18 1 1 A 25 25 GLY H H 25 7.880 7.629 0.251 1
1 225 . 18 1 1 A 25 25 GLY HA2 H 25 3.949 4.029 -0.080 1
1 226 . 18 1 1 A 25 25 GLY HA3 H 25 3.966 4.029 -0.063 1
1 227 . 18 1 1 A 25 25 GLY CA C 25 45.959 44.719 1.240 1
1 228 . 18 1 1 A 25 25 GLY N N 25 106.969 106.003 0.966 1
1 229 . 18 1 1 A 26 26 GLY H H 26 8.123 8.512 -0.389 1
1 230 . 18 1 1 A 26 26 GLY HA2 H 26 3.912 4.183 -0.271 1
1 231 . 18 1 1 A 26 26 GLY HA3 H 26 4.002 4.184 -0.182 1
1 232 . 18 1 1 A 26 26 GLY CA C 26 45.691 45.637 0.054 1
1 233 . 18 1 1 A 26 26 GLY N N 26 108.223 108.317 -0.094 1
1 234 . 18 1 1 A 27 27 SER H H 27 8.201 8.933 -0.732 1
1 235 . 18 1 1 A 27 27 SER HA H 27 4.353 4.740 -0.387 1
1 238 . 18 1 1 A 27 27 SER CA C 27 59.117 56.026 3.091 1
1 239 . 18 1 1 A 27 27 SER CB C 27 63.770 65.776 -2.006 1
1 240 . 18 1 1 A 27 27 SER N N 27 115.317 118.967 -3.650 1
1 241 . 18 1 1 A 28 28 ARG H H 28 8.155 8.720 -0.565 1
1 242 . 18 1 1 A 28 28 ARG HA H 28 4.258 4.041 0.217 1
1 250 . 18 1 1 A 28 28 ARG CA C 28 56.348 56.581 -0.233 1
1 251 . 18 1 1 A 28 28 ARG N N 28 121.519 120.315 1.204 1
1 252 . 18 1 1 A 29 29 ASP H H 29 8.167 8.657 -0.490 1
1 255 . 18 1 1 A 29 29 ASP CB C 29 38.462 42.686 -4.224 1
1 256 . 18 1 1 A 29 29 ASP N N 29 118.393 120.526 -2.133 1
1 257 . 18 1 1 A 30 30 TYR H H 30 7.910 8.051 -0.141 1
1 258 . 18 1 1 A 30 30 TYR HA H 30 4.484 4.578 -0.094 1
1 265 . 18 1 1 A 30 30 TYR CA C 30 58.097 57.825 0.272 1
1 266 . 18 1 1 A 30 30 TYR CB C 30 38.759 39.304 -0.545 1
1 267 . 18 1 1 A 30 30 TYR N N 30 119.859 114.434 5.425 1
1 268 . 18 1 1 A 31 31 ASN H H 31 8.152 7.910 0.242 1
1 269 . 18 1 1 A 31 31 ASN HA H 31 4.658 4.837 -0.179 1
1 274 . 18 1 1 A 31 31 ASN CA C 31 53.245 53.848 -0.603 1
1 275 . 18 1 1 A 31 31 ASN CB C 31 39.156 40.970 -1.814 1
1 276 . 18 1 1 A 31 31 ASN N N 31 119.343 117.546 1.797 1
1 13 . 19 1 1 A 2 2 ARG H H 2 8.864 8.682 0.182 1
1 14 . 19 1 1 A 2 2 ARG HA H 2 4.393 4.646 -0.253 1
1 22 . 19 1 1 A 2 2 ARG CA C 2 56.327 55.226 1.101 1
1 23 . 19 1 1 A 2 2 ARG N N 2 124.285 120.534 3.751 1
1 24 . 19 1 1 A 3 3 SER H H 3 8.495 8.563 -0.068 1
1 25 . 19 1 1 A 3 3 SER HA H 3 4.491 4.883 -0.392 1
1 28 . 19 1 1 A 3 3 SER CB C 3 64.117 64.395 -0.278 1
1 29 . 19 1 1 A 3 3 SER N N 3 117.670 118.206 -0.536 1
1 30 . 19 1 1 A 4 4 ARG H H 4 8.672 7.832 0.840 1
1 31 . 19 1 1 A 4 4 ARG HA H 4 4.314 4.039 0.275 1
1 39 . 19 1 1 A 4 4 ARG CA C 4 56.779 59.025 -2.246 1
1 40 . 19 1 1 A 4 4 ARG N N 4 123.739 122.299 1.440 1
1 41 . 19 1 1 A 5 5 LYS H H 5 8.328 7.724 0.604 1
1 42 . 19 1 1 A 5 5 LYS HA H 5 4.127 4.157 -0.030 1
1 49 . 19 1 1 A 5 5 LYS CA C 5 57.431 58.069 -0.638 1
1 51 . 19 1 1 A 5 5 LYS N N 5 120.706 118.367 2.339 1
1 52 . 19 1 1 A 6 6 ASN H H 6 8.115 7.965 0.150 1
1 57 . 19 1 1 A 6 6 ASN CA C 6 53.066 52.471 0.595 1
1 58 . 19 1 1 A 6 6 ASN CB C 6 39.187 40.798 -1.611 1
1 59 . 19 1 1 A 6 6 ASN N N 6 117.807 113.196 4.611 1
1 60 . 19 1 1 A 7 7 GLY H H 7 8.499 8.665 -0.166 1
1 61 . 19 1 1 A 7 7 GLY HA2 H 7 4.051 4.230 -0.179 1
1 62 . 19 1 1 A 7 7 GLY HA3 H 7 4.051 4.318 -0.267 1
1 63 . 19 1 1 A 7 7 GLY CA C 7 46.153 45.081 1.072 1
1 64 . 19 1 1 A 7 7 GLY N N 7 108.804 106.886 1.918 1
1 65 . 19 1 1 A 8 8 ILE H H 8 8.496 8.987 -0.491 1
1 75 . 19 1 1 A 8 8 ILE CB C 8 38.082 37.654 0.428 1
1 76 . 19 1 1 A 8 8 ILE N N 8 121.041 125.325 -4.284 1
1 77 . 19 1 1 A 9 9 GLY H H 9 8.656 8.191 0.465 1
1 78 . 19 1 1 A 9 9 GLY HA2 H 9 3.671 3.989 -0.318 1
1 79 . 19 1 1 A 9 9 GLY HA3 H 9 3.671 4.022 -0.351 1
1 80 . 19 1 1 A 9 9 GLY CA C 9 47.324 45.393 1.931 1
1 81 . 19 1 1 A 9 9 GLY N N 9 108.767 110.003 -1.236 1
1 82 . 19 1 1 A 10 10 TYR H H 10 7.987 8.442 -0.455 1
1 83 . 19 1 1 A 10 10 TYR HA H 10 4.269 4.373 -0.104 1
1 90 . 19 1 1 A 10 10 TYR CA C 10 60.713 60.106 0.607 1
1 91 . 19 1 1 A 10 10 TYR CB C 10 38.354 37.548 0.806 1
1 92 . 19 1 1 A 10 10 TYR N N 10 121.261 120.082 1.179 1
1 93 . 19 1 1 A 11 11 ALA H H 11 8.020 7.372 0.648 1
1 94 . 19 1 1 A 11 11 ALA HA H 11 4.040 3.737 0.303 1
1 98 . 19 1 1 A 11 11 ALA CA C 11 55.355 54.765 0.590 1
1 99 . 19 1 1 A 11 11 ALA CB C 11 18.737 17.649 1.088 1
1 100 . 19 1 1 A 11 11 ALA N N 11 122.295 122.988 -0.693 1
1 101 . 19 1 1 A 12 12 ILE H H 12 8.308 8.091 0.217 1
1 102 . 19 1 1 A 12 12 ILE HA H 12 3.732 3.915 -0.183 1
1 111 . 19 1 1 A 12 12 ILE CB C 12 37.611 37.701 -0.090 1
1 112 . 19 1 1 A 12 12 ILE N N 12 116.853 118.984 -2.131 1
1 113 . 19 1 1 A 13 13 GLY H H 13 8.171 8.069 0.102 1
1 114 . 19 1 1 A 13 13 GLY HA2 H 13 3.744 3.787 -0.043 1
1 115 . 19 1 1 A 13 13 GLY HA3 H 13 3.744 3.807 -0.063 1
1 116 . 19 1 1 A 13 13 GLY CA C 13 47.343 47.209 0.134 1
1 117 . 19 1 1 A 13 13 GLY N N 13 107.089 109.627 -2.538 1
1 118 . 19 1 1 A 14 14 TYR H H 14 8.223 8.356 -0.133 1
1 119 . 19 1 1 A 14 14 TYR HA H 14 4.147 4.107 0.040 1
1 126 . 19 1 1 A 14 14 TYR CB C 14 38.415 39.074 -0.659 1
1 127 . 19 1 1 A 14 14 TYR N N 14 122.935 123.230 -0.295 1
1 128 . 19 1 1 A 15 15 ALA H H 15 8.345 7.931 0.414 1
1 129 . 19 1 1 A 15 15 ALA HA H 15 3.986 3.668 0.318 1
1 133 . 19 1 1 A 15 15 ALA CA C 15 55.067 54.865 0.202 1
1 134 . 19 1 1 A 15 15 ALA N N 15 121.882 121.334 0.548 1
1 135 . 19 1 1 A 16 16 PHE H H 16 8.668 8.761 -0.093 1
1 136 . 19 1 1 A 16 16 PHE HA H 16 4.138 4.223 -0.085 1
1 143 . 19 1 1 A 16 16 PHE CA C 16 61.116 60.849 0.267 1
1 144 . 19 1 1 A 16 16 PHE CB C 16 38.857 39.309 -0.452 1
1 145 . 19 1 1 A 16 16 PHE N N 16 116.563 119.299 -2.736 1
1 146 . 19 1 1 A 17 17 GLY H H 17 8.163 8.971 -0.808 1
1 147 . 19 1 1 A 17 17 GLY HA2 H 17 3.891 3.756 0.135 1
1 148 . 19 1 1 A 17 17 GLY HA3 H 17 3.891 3.838 0.053 1
1 149 . 19 1 1 A 17 17 GLY N N 17 105.893 106.789 -0.896 1
1 150 . 19 1 1 A 18 18 ALA H H 18 7.842 7.652 0.190 1
1 151 . 19 1 1 A 18 18 ALA HA H 18 4.035 3.981 0.054 1
1 155 . 19 1 1 A 18 18 ALA CA C 18 55.037 54.687 0.350 1
1 156 . 19 1 1 A 18 18 ALA CB C 18 18.223 18.554 -0.331 1
1 157 . 19 1 1 A 18 18 ALA N N 18 122.050 124.605 -2.555 1
1 158 . 19 1 1 A 19 19 VAL H H 19 8.010 7.892 0.118 1
1 159 . 19 1 1 A 19 19 VAL HA H 19 3.549 3.762 -0.213 1
1 167 . 19 1 1 A 19 19 VAL CA C 19 66.571 65.138 1.433 1
1 168 . 19 1 1 A 19 19 VAL CB C 19 31.436 31.563 -0.127 1
1 171 . 19 1 1 A 19 19 VAL N N 19 118.184 116.258 1.926 1
1 172 . 19 1 1 A 20 20 GLU H H 20 8.339 8.561 -0.222 1
1 173 . 19 1 1 A 20 20 GLU HA H 20 3.666 4.037 -0.371 1
1 178 . 19 1 1 A 20 20 GLU CA C 20 60.103 59.418 0.685 1
1 180 . 19 1 1 A 20 20 GLU N N 20 118.704 120.952 -2.248 1
1 181 . 19 1 1 A 21 21 ARG H H 21 7.939 8.200 -0.261 1
1 182 . 19 1 1 A 21 21 ARG HA H 21 3.935 4.015 -0.080 1
1 190 . 19 1 1 A 21 21 ARG N N 21 116.955 120.726 -3.771 1
1 191 . 19 1 1 A 22 22 ALA H H 22 7.784 7.507 0.277 1
1 192 . 19 1 1 A 22 22 ALA HA H 22 4.166 4.100 0.066 1
1 196 . 19 1 1 A 22 22 ALA CA C 22 54.645 55.153 -0.508 1
1 197 . 19 1 1 A 22 22 ALA CB C 22 18.724 18.383 0.341 1
1 198 . 19 1 1 A 22 22 ALA N N 22 121.252 122.318 -1.066 1
1 199 . 19 1 1 A 23 23 VAL H H 23 8.086 7.562 0.524 1
1 200 . 19 1 1 A 23 23 VAL HA H 23 3.872 3.823 0.049 1
1 208 . 19 1 1 A 23 23 VAL CA C 23 64.928 65.296 -0.368 1
1 209 . 19 1 1 A 23 23 VAL CB C 23 32.451 31.721 0.730 1
1 212 . 19 1 1 A 23 23 VAL N N 23 114.516 118.317 -3.801 1
1 213 . 19 1 1 A 24 24 LEU H H 24 8.060 7.383 0.677 1
1 223 . 19 1 1 A 24 24 LEU N N 24 118.014 118.608 -0.594 1
1 224 . 19 1 1 A 25 25 GLY H H 25 7.880 8.058 -0.178 1
1 225 . 19 1 1 A 25 25 GLY HA2 H 25 3.949 4.022 -0.073 1
1 226 . 19 1 1 A 25 25 GLY HA3 H 25 3.966 4.026 -0.060 1
1 227 . 19 1 1 A 25 25 GLY CA C 25 45.959 46.383 -0.424 1
1 228 . 19 1 1 A 25 25 GLY N N 25 106.969 106.725 0.244 1
1 229 . 19 1 1 A 26 26 GLY H H 26 8.123 8.006 0.117 1
1 230 . 19 1 1 A 26 26 GLY HA2 H 26 3.912 4.045 -0.133 1
1 231 . 19 1 1 A 26 26 GLY HA3 H 26 4.002 4.047 -0.045 1
1 232 . 19 1 1 A 26 26 GLY CA C 26 45.691 44.570 1.121 1
1 233 . 19 1 1 A 26 26 GLY N N 26 108.223 107.707 0.516 1
1 234 . 19 1 1 A 27 27 SER H H 27 8.201 8.356 -0.155 1
1 235 . 19 1 1 A 27 27 SER HA H 27 4.353 4.789 -0.436 1
1 238 . 19 1 1 A 27 27 SER CA C 27 59.117 57.108 2.009 1
1 239 . 19 1 1 A 27 27 SER CB C 27 63.770 65.642 -1.872 1
1 240 . 19 1 1 A 27 27 SER N N 27 115.317 115.262 0.055 1
1 241 . 19 1 1 A 28 28 ARG H H 28 8.155 8.687 -0.532 1
1 242 . 19 1 1 A 28 28 ARG HA H 28 4.258 3.817 0.441 1
1 250 . 19 1 1 A 28 28 ARG CA C 28 56.348 56.978 -0.630 1
1 251 . 19 1 1 A 28 28 ARG N N 28 121.519 118.173 3.346 1
1 252 . 19 1 1 A 29 29 ASP H H 29 8.167 8.495 -0.328 1
1 255 . 19 1 1 A 29 29 ASP CB C 29 38.462 40.662 -2.200 1
1 256 . 19 1 1 A 29 29 ASP N N 29 118.393 116.936 1.457 1
1 257 . 19 1 1 A 30 30 TYR H H 30 7.910 7.762 0.148 1
1 258 . 19 1 1 A 30 30 TYR HA H 30 4.484 5.007 -0.523 1
1 265 . 19 1 1 A 30 30 TYR CA C 30 58.097 56.303 1.794 1
1 266 . 19 1 1 A 30 30 TYR CB C 30 38.759 39.309 -0.550 1
1 267 . 19 1 1 A 30 30 TYR N N 30 119.859 120.611 -0.752 1
1 268 . 19 1 1 A 31 31 ASN H H 31 8.152 9.003 -0.851 1
1 269 . 19 1 1 A 31 31 ASN HA H 31 4.658 5.102 -0.444 1
1 274 . 19 1 1 A 31 31 ASN CA C 31 53.245 51.761 1.484 1
1 275 . 19 1 1 A 31 31 ASN CB C 31 39.156 39.270 -0.114 1
1 276 . 19 1 1 A 31 31 ASN N N 31 119.343 124.904 -5.561 1
1 13 . 20 1 1 A 2 2 ARG H H 2 8.864 8.399 0.465 1
1 14 . 20 1 1 A 2 2 ARG HA H 2 4.393 4.391 0.002 1
1 22 . 20 1 1 A 2 2 ARG CA C 2 56.327 57.397 -1.070 1
1 23 . 20 1 1 A 2 2 ARG N N 2 124.285 120.728 3.557 1
1 24 . 20 1 1 A 3 3 SER H H 3 8.495 8.195 0.300 1
1 25 . 20 1 1 A 3 3 SER HA H 3 4.491 4.543 -0.052 1
1 28 . 20 1 1 A 3 3 SER CB C 3 64.117 64.941 -0.824 1
1 29 . 20 1 1 A 3 3 SER N N 3 117.670 110.502 7.168 1
1 30 . 20 1 1 A 4 4 ARG H H 4 8.672 8.495 0.177 1
1 31 . 20 1 1 A 4 4 ARG HA H 4 4.314 4.253 0.061 1
1 39 . 20 1 1 A 4 4 ARG CA C 4 56.779 57.532 -0.753 1
1 40 . 20 1 1 A 4 4 ARG N N 4 123.739 120.938 2.801 1
1 41 . 20 1 1 A 5 5 LYS H H 5 8.328 7.768 0.560 1
1 42 . 20 1 1 A 5 5 LYS HA H 5 4.127 4.423 -0.296 1
1 49 . 20 1 1 A 5 5 LYS CA C 5 57.431 56.111 1.320 1
1 51 . 20 1 1 A 5 5 LYS N N 5 120.706 118.740 1.966 1
1 52 . 20 1 1 A 6 6 ASN H H 6 8.115 7.832 0.283 1
1 57 . 20 1 1 A 6 6 ASN CA C 6 53.066 53.153 -0.087 1
1 58 . 20 1 1 A 6 6 ASN CB C 6 39.187 39.871 -0.684 1
1 59 . 20 1 1 A 6 6 ASN N N 6 117.807 117.338 0.469 1
1 60 . 20 1 1 A 7 7 GLY H H 7 8.499 8.492 0.007 1
1 61 . 20 1 1 A 7 7 GLY HA2 H 7 4.051 4.091 -0.040 1
1 62 . 20 1 1 A 7 7 GLY HA3 H 7 4.051 4.256 -0.205 1
1 63 . 20 1 1 A 7 7 GLY CA C 7 46.153 45.718 0.435 1
1 64 . 20 1 1 A 7 7 GLY N N 7 108.804 111.368 -2.564 1
1 65 . 20 1 1 A 8 8 ILE H H 8 8.496 7.897 0.599 1
1 75 . 20 1 1 A 8 8 ILE CB C 8 38.082 39.343 -1.261 1
1 76 . 20 1 1 A 8 8 ILE N N 8 121.041 121.949 -0.908 1
1 77 . 20 1 1 A 9 9 GLY H H 9 8.656 8.504 0.152 1
1 78 . 20 1 1 A 9 9 GLY HA2 H 9 3.671 3.732 -0.061 1
1 79 . 20 1 1 A 9 9 GLY HA3 H 9 3.671 3.761 -0.090 1
1 80 . 20 1 1 A 9 9 GLY CA C 9 47.324 47.177 0.147 1
1 81 . 20 1 1 A 9 9 GLY N N 9 108.767 109.452 -0.685 1
1 82 . 20 1 1 A 10 10 TYR H H 10 7.987 8.239 -0.252 1
1 83 . 20 1 1 A 10 10 TYR HA H 10 4.269 4.418 -0.149 1
1 90 . 20 1 1 A 10 10 TYR CA C 10 60.713 60.075 0.638 1
1 91 . 20 1 1 A 10 10 TYR CB C 10 38.354 37.602 0.752 1
1 92 . 20 1 1 A 10 10 TYR N N 10 121.261 120.106 1.155 1
1 93 . 20 1 1 A 11 11 ALA H H 11 8.020 7.534 0.486 1
1 94 . 20 1 1 A 11 11 ALA HA H 11 4.040 3.699 0.341 1
1 98 . 20 1 1 A 11 11 ALA CA C 11 55.355 54.700 0.655 1
1 99 . 20 1 1 A 11 11 ALA CB C 11 18.737 18.150 0.587 1
1 100 . 20 1 1 A 11 11 ALA N N 11 122.295 123.137 -0.842 1
1 101 . 20 1 1 A 12 12 ILE H H 12 8.308 7.677 0.631 1
1 102 . 20 1 1 A 12 12 ILE HA H 12 3.732 3.896 -0.164 1
1 111 . 20 1 1 A 12 12 ILE CB C 12 37.611 37.721 -0.110 1
1 112 . 20 1 1 A 12 12 ILE N N 12 116.853 118.764 -1.911 1
1 113 . 20 1 1 A 13 13 GLY H H 13 8.171 8.359 -0.188 1
1 114 . 20 1 1 A 13 13 GLY HA2 H 13 3.744 3.820 -0.076 1
1 115 . 20 1 1 A 13 13 GLY HA3 H 13 3.744 3.828 -0.084 1
1 116 . 20 1 1 A 13 13 GLY CA C 13 47.343 47.242 0.101 1
1 117 . 20 1 1 A 13 13 GLY N N 13 107.089 109.333 -2.244 1
1 118 . 20 1 1 A 14 14 TYR H H 14 8.223 8.583 -0.360 1
1 119 . 20 1 1 A 14 14 TYR HA H 14 4.147 4.150 -0.003 1
1 126 . 20 1 1 A 14 14 TYR CB C 14 38.415 38.788 -0.373 1
1 127 . 20 1 1 A 14 14 TYR N N 14 122.935 123.273 -0.338 1
1 128 . 20 1 1 A 15 15 ALA H H 15 8.345 7.865 0.480 1
1 129 . 20 1 1 A 15 15 ALA HA H 15 3.986 3.654 0.332 1
1 133 . 20 1 1 A 15 15 ALA CA C 15 55.067 54.837 0.230 1
1 134 . 20 1 1 A 15 15 ALA N N 15 121.882 121.501 0.381 1
1 135 . 20 1 1 A 16 16 PHE H H 16 8.668 8.507 0.161 1
1 136 . 20 1 1 A 16 16 PHE HA H 16 4.138 4.234 -0.096 1
1 143 . 20 1 1 A 16 16 PHE CA C 16 61.116 60.592 0.524 1
1 144 . 20 1 1 A 16 16 PHE CB C 16 38.857 39.118 -0.261 1
1 145 . 20 1 1 A 16 16 PHE N N 16 116.563 118.989 -2.426 1
1 146 . 20 1 1 A 17 17 GLY H H 17 8.163 9.302 -1.139 1
1 147 . 20 1 1 A 17 17 GLY HA2 H 17 3.891 3.912 -0.021 1
1 148 . 20 1 1 A 17 17 GLY HA3 H 17 3.891 3.917 -0.026 1
1 149 . 20 1 1 A 17 17 GLY N N 17 105.893 106.809 -0.916 1
1 150 . 20 1 1 A 18 18 ALA H H 18 7.842 7.792 0.050 1
1 151 . 20 1 1 A 18 18 ALA HA H 18 4.035 3.985 0.050 1
1 155 . 20 1 1 A 18 18 ALA CA C 18 55.037 54.706 0.331 1
1 156 . 20 1 1 A 18 18 ALA CB C 18 18.223 18.714 -0.491 1
1 157 . 20 1 1 A 18 18 ALA N N 18 122.050 124.542 -2.492 1
1 158 . 20 1 1 A 19 19 VAL H H 19 8.010 7.558 0.452 1
1 159 . 20 1 1 A 19 19 VAL HA H 19 3.549 3.634 -0.085 1
1 167 . 20 1 1 A 19 19 VAL CA C 19 66.571 65.016 1.555 1
1 168 . 20 1 1 A 19 19 VAL CB C 19 31.436 31.465 -0.029 1
1 171 . 20 1 1 A 19 19 VAL N N 19 118.184 116.088 2.096 1
1 172 . 20 1 1 A 20 20 GLU H H 20 8.339 8.675 -0.336 1
1 173 . 20 1 1 A 20 20 GLU HA H 20 3.666 4.027 -0.361 1
1 178 . 20 1 1 A 20 20 GLU CA C 20 60.103 59.432 0.671 1
1 180 . 20 1 1 A 20 20 GLU N N 20 118.704 120.644 -1.940 1
1 181 . 20 1 1 A 21 21 ARG H H 21 7.939 8.690 -0.751 1
1 182 . 20 1 1 A 21 21 ARG HA H 21 3.935 4.029 -0.094 1
1 190 . 20 1 1 A 21 21 ARG N N 21 116.955 120.824 -3.869 1
1 191 . 20 1 1 A 22 22 ALA H H 22 7.784 7.840 -0.056 1
1 192 . 20 1 1 A 22 22 ALA HA H 22 4.166 4.081 0.085 1
1 196 . 20 1 1 A 22 22 ALA CA C 22 54.645 54.778 -0.133 1
1 197 . 20 1 1 A 22 22 ALA CB C 22 18.724 18.521 0.203 1
1 198 . 20 1 1 A 22 22 ALA N N 22 121.252 121.986 -0.734 1
1 199 . 20 1 1 A 23 23 VAL H H 23 8.086 7.713 0.373 1
1 200 . 20 1 1 A 23 23 VAL HA H 23 3.872 3.795 0.077 1
1 208 . 20 1 1 A 23 23 VAL CA C 23 64.928 65.778 -0.850 1
1 209 . 20 1 1 A 23 23 VAL CB C 23 32.451 31.675 0.776 1
1 212 . 20 1 1 A 23 23 VAL N N 23 114.516 118.641 -4.125 1
1 213 . 20 1 1 A 24 24 LEU H H 24 8.060 7.580 0.480 1
1 223 . 20 1 1 A 24 24 LEU N N 24 118.014 118.420 -0.406 1
1 224 . 20 1 1 A 25 25 GLY H H 25 7.880 7.968 -0.088 1
1 225 . 20 1 1 A 25 25 GLY HA2 H 25 3.949 3.981 -0.032 1
1 226 . 20 1 1 A 25 25 GLY HA3 H 25 3.966 3.981 -0.015 1
1 227 . 20 1 1 A 25 25 GLY CA C 25 45.959 45.396 0.563 1
1 228 . 20 1 1 A 25 25 GLY N N 25 106.969 108.464 -1.495 1
1 229 . 20 1 1 A 26 26 GLY H H 26 8.123 8.491 -0.368 1
1 230 . 20 1 1 A 26 26 GLY HA2 H 26 3.912 4.175 -0.263 1
1 231 . 20 1 1 A 26 26 GLY HA3 H 26 4.002 4.178 -0.176 1
1 232 . 20 1 1 A 26 26 GLY CA C 26 45.691 46.150 -0.459 1
1 233 . 20 1 1 A 26 26 GLY N N 26 108.223 111.193 -2.970 1
1 234 . 20 1 1 A 27 27 SER H H 27 8.201 8.236 -0.035 1
1 235 . 20 1 1 A 27 27 SER HA H 27 4.353 5.074 -0.721 1
1 238 . 20 1 1 A 27 27 SER CA C 27 59.117 57.497 1.620 1
1 239 . 20 1 1 A 27 27 SER CB C 27 63.770 65.459 -1.689 1
1 240 . 20 1 1 A 27 27 SER N N 27 115.317 113.339 1.978 1
1 241 . 20 1 1 A 28 28 ARG H H 28 8.155 8.789 -0.634 1
1 242 . 20 1 1 A 28 28 ARG HA H 28 4.258 5.303 -1.045 1
1 250 . 20 1 1 A 28 28 ARG CA C 28 56.348 55.039 1.309 1
1 251 . 20 1 1 A 28 28 ARG N N 28 121.519 119.434 2.085 1
1 252 . 20 1 1 A 29 29 ASP H H 29 8.167 9.015 -0.848 1
1 255 . 20 1 1 A 29 29 ASP CB C 29 38.462 41.106 -2.644 1
1 256 . 20 1 1 A 29 29 ASP N N 29 118.393 123.255 -4.862 1
1 257 . 20 1 1 A 30 30 TYR H H 30 7.910 8.466 -0.556 1
1 258 . 20 1 1 A 30 30 TYR HA H 30 4.484 4.646 -0.162 1
1 265 . 20 1 1 A 30 30 TYR CA C 30 58.097 56.927 1.170 1
1 266 . 20 1 1 A 30 30 TYR CB C 30 38.759 38.764 -0.005 1
1 267 . 20 1 1 A 30 30 TYR N N 30 119.859 122.046 -2.187 1
1 268 . 20 1 1 A 31 31 ASN H H 31 8.152 7.860 0.292 1
1 269 . 20 1 1 A 31 31 ASN HA H 31 4.658 5.109 -0.451 1
1 274 . 20 1 1 A 31 31 ASN CA C 31 53.245 52.101 1.144 1
1 275 . 20 1 1 A 31 31 ASN CB C 31 39.156 39.481 -0.325 1
1 276 . 20 1 1 A 31 31 ASN N N 31 119.343 117.943 1.400 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 0 0.000 1
2 1 1 1 "RMS(OBS, PRED)" CA 22 1.024 1
3 1 1 1 "RMS(OBS, PRED)" CB 16 1.479 1
4 1 1 1 "RMS(OBS, PRED)" H 30 0.500 1
5 1 1 1 "RMS(OBS, PRED)" HA 32 0.209 1
6 1 1 1 "RMS(OBS, PRED)" N 30 2.523 1
7 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
8 1 2 1 "RMS(OBS, PRED)" CA 22 0.822 1
9 1 2 1 "RMS(OBS, PRED)" CB 16 1.751 1
10 1 2 1 "RMS(OBS, PRED)" H 30 0.470 1
11 1 2 1 "RMS(OBS, PRED)" HA 32 0.263 1
12 1 2 1 "RMS(OBS, PRED)" N 30 2.608 1
13 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 3 1 "RMS(OBS, PRED)" CA 22 0.967 1
15 1 3 1 "RMS(OBS, PRED)" CB 16 1.194 1
16 1 3 1 "RMS(OBS, PRED)" H 30 0.482 1
17 1 3 1 "RMS(OBS, PRED)" HA 32 0.283 1
18 1 3 1 "RMS(OBS, PRED)" N 30 2.664 1
19 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
20 1 4 1 "RMS(OBS, PRED)" CA 22 1.180 1
21 1 4 1 "RMS(OBS, PRED)" CB 16 1.319 1
22 1 4 1 "RMS(OBS, PRED)" H 30 0.416 1
23 1 4 1 "RMS(OBS, PRED)" HA 32 0.187 1
24 1 4 1 "RMS(OBS, PRED)" N 30 2.181 1
25 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 5 1 "RMS(OBS, PRED)" CA 22 1.062 1
27 1 5 1 "RMS(OBS, PRED)" CB 16 1.412 1
28 1 5 1 "RMS(OBS, PRED)" H 30 0.410 1
29 1 5 1 "RMS(OBS, PRED)" HA 32 0.269 1
30 1 5 1 "RMS(OBS, PRED)" N 30 2.481 1
31 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
32 1 6 1 "RMS(OBS, PRED)" CA 22 0.946 1
33 1 6 1 "RMS(OBS, PRED)" CB 16 1.330 1
34 1 6 1 "RMS(OBS, PRED)" H 30 0.548 1
35 1 6 1 "RMS(OBS, PRED)" HA 32 0.263 1
36 1 6 1 "RMS(OBS, PRED)" N 30 2.488 1
37 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 7 1 "RMS(OBS, PRED)" CA 22 0.964 1
39 1 7 1 "RMS(OBS, PRED)" CB 16 1.308 1
40 1 7 1 "RMS(OBS, PRED)" H 30 0.439 1
41 1 7 1 "RMS(OBS, PRED)" HA 32 0.220 1
42 1 7 1 "RMS(OBS, PRED)" N 30 2.396 1
43 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
44 1 8 1 "RMS(OBS, PRED)" CA 22 1.010 1
45 1 8 1 "RMS(OBS, PRED)" CB 16 1.350 1
46 1 8 1 "RMS(OBS, PRED)" H 30 0.477 1
47 1 8 1 "RMS(OBS, PRED)" HA 32 0.309 1
48 1 8 1 "RMS(OBS, PRED)" N 30 2.489 1
49 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 9 1 "RMS(OBS, PRED)" CA 22 0.901 1
51 1 9 1 "RMS(OBS, PRED)" CB 16 1.233 1
52 1 9 1 "RMS(OBS, PRED)" H 30 0.454 1
53 1 9 1 "RMS(OBS, PRED)" HA 32 0.258 1
54 1 9 1 "RMS(OBS, PRED)" N 30 3.265 1
55 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
56 1 10 1 "RMS(OBS, PRED)" CA 22 1.023 1
57 1 10 1 "RMS(OBS, PRED)" CB 16 1.716 1
58 1 10 1 "RMS(OBS, PRED)" H 30 0.501 1
59 1 10 1 "RMS(OBS, PRED)" HA 32 0.262 1
60 1 10 1 "RMS(OBS, PRED)" N 30 2.584 1
61 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 11 1 "RMS(OBS, PRED)" CA 22 0.856 1
63 1 11 1 "RMS(OBS, PRED)" CB 16 1.696 1
64 1 11 1 "RMS(OBS, PRED)" H 30 0.391 1
65 1 11 1 "RMS(OBS, PRED)" HA 32 0.234 1
66 1 11 1 "RMS(OBS, PRED)" N 30 2.546 1
67 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
68 1 12 1 "RMS(OBS, PRED)" CA 22 1.283 1
69 1 12 1 "RMS(OBS, PRED)" CB 16 1.757 1
70 1 12 1 "RMS(OBS, PRED)" H 30 0.480 1
71 1 12 1 "RMS(OBS, PRED)" HA 32 0.207 1
72 1 12 1 "RMS(OBS, PRED)" N 30 2.624 1
73 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 13 1 "RMS(OBS, PRED)" CA 22 1.168 1
75 1 13 1 "RMS(OBS, PRED)" CB 16 1.620 1
76 1 13 1 "RMS(OBS, PRED)" H 30 0.393 1
77 1 13 1 "RMS(OBS, PRED)" HA 32 0.229 1
78 1 13 1 "RMS(OBS, PRED)" N 30 2.317 1
79 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
80 1 14 1 "RMS(OBS, PRED)" CA 22 1.078 1
81 1 14 1 "RMS(OBS, PRED)" CB 16 1.760 1
82 1 14 1 "RMS(OBS, PRED)" H 30 0.425 1
83 1 14 1 "RMS(OBS, PRED)" HA 32 0.208 1
84 1 14 1 "RMS(OBS, PRED)" N 30 2.892 1
85 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 15 1 "RMS(OBS, PRED)" CA 22 1.309 1
87 1 15 1 "RMS(OBS, PRED)" CB 16 1.711 1
88 1 15 1 "RMS(OBS, PRED)" H 30 0.482 1
89 1 15 1 "RMS(OBS, PRED)" HA 32 0.278 1
90 1 15 1 "RMS(OBS, PRED)" N 30 2.812 1
91 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
92 1 16 1 "RMS(OBS, PRED)" CA 22 1.098 1
93 1 16 1 "RMS(OBS, PRED)" CB 16 1.159 1
94 1 16 1 "RMS(OBS, PRED)" H 30 0.463 1
95 1 16 1 "RMS(OBS, PRED)" HA 32 0.263 1
96 1 16 1 "RMS(OBS, PRED)" N 30 2.811 1
97 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 17 1 "RMS(OBS, PRED)" CA 22 1.041 1
99 1 17 1 "RMS(OBS, PRED)" CB 16 1.827 1
100 1 17 1 "RMS(OBS, PRED)" H 30 0.466 1
101 1 17 1 "RMS(OBS, PRED)" HA 32 0.309 1
102 1 17 1 "RMS(OBS, PRED)" N 30 2.140 1
103 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
104 1 18 1 "RMS(OBS, PRED)" CA 22 1.090 1
105 1 18 1 "RMS(OBS, PRED)" CB 16 1.564 1
106 1 18 1 "RMS(OBS, PRED)" H 30 0.467 1
107 1 18 1 "RMS(OBS, PRED)" HA 32 0.199 1
108 1 18 1 "RMS(OBS, PRED)" N 30 2.713 1
109 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 19 1 "RMS(OBS, PRED)" CA 22 1.135 1
111 1 19 1 "RMS(OBS, PRED)" CB 16 0.992 1
112 1 19 1 "RMS(OBS, PRED)" H 30 0.429 1
113 1 19 1 "RMS(OBS, PRED)" HA 32 0.253 1
114 1 19 1 "RMS(OBS, PRED)" N 30 2.483 1
115 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
116 1 20 1 "RMS(OBS, PRED)" CA 22 0.876 1
117 1 20 1 "RMS(OBS, PRED)" CB 16 0.990 1
118 1 20 1 "RMS(OBS, PRED)" H 30 0.471 1
119 1 20 1 "RMS(OBS, PRED)" HA 32 0.287 1
120 1 20 1 "RMS(OBS, PRED)" N 30 2.615 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 13 . 1 1 A 2 2 ARG H H 2 8.864 8.493 0.371 2
1 14 . 1 1 A 2 2 ARG HA H 2 4.393 4.360 0.033 2
1 22 . 1 1 A 2 2 ARG CA C 2 56.327 56.039 0.288 2
1 23 . 1 1 A 2 2 ARG N N 2 124.285 121.263 3.022 2
1 24 . 1 1 A 3 3 SER H H 3 8.495 8.215 0.280 2
1 25 . 1 1 A 3 3 SER HA H 3 4.491 4.472 0.019 2
1 28 . 1 1 A 3 3 SER CB C 3 64.117 63.946 0.171 2
1 29 . 1 1 A 3 3 SER N N 3 117.670 114.920 2.750 2
1 30 . 1 1 A 4 4 ARG H H 4 8.672 7.995 0.677 2
1 31 . 1 1 A 4 4 ARG HA H 4 4.314 4.212 0.102 2
1 39 . 1 1 A 4 4 ARG CA C 4 56.779 57.902 -1.123 2
1 40 . 1 1 A 4 4 ARG N N 4 123.739 120.837 2.902 2
1 41 . 1 1 A 5 5 LYS H H 5 8.328 7.815 0.513 2
1 42 . 1 1 A 5 5 LYS HA H 5 4.127 4.241 -0.114 2
1 49 . 1 1 A 5 5 LYS CA C 5 57.431 57.758 -0.327 2
1 51 . 1 1 A 5 5 LYS N N 5 120.706 118.299 2.407 2
1 52 . 1 1 A 6 6 ASN H H 6 8.115 7.950 0.165 2
1 57 . 1 1 A 6 6 ASN CA C 6 53.066 53.442 -0.376 2
1 58 . 1 1 A 6 6 ASN CB C 6 39.187 39.069 0.118 2
1 59 . 1 1 A 6 6 ASN N N 6 117.807 116.132 1.675 2
1 60 . 1 1 A 7 7 GLY H H 7 8.499 8.382 0.117 2
1 61 . 1 1 A 7 7 GLY HA2 H 7 4.051 4.148 -0.097 2
1 62 . 1 1 A 7 7 GLY HA3 H 7 4.051 4.262 -0.211 2
1 63 . 1 1 A 7 7 GLY CA C 7 46.153 45.547 0.605 2
1 64 . 1 1 A 7 7 GLY N N 7 108.804 109.849 -1.045 2
1 65 . 1 1 A 8 8 ILE H H 8 8.496 8.323 0.173 2
1 75 . 1 1 A 8 8 ILE CB C 8 38.082 38.885 -0.803 2
1 76 . 1 1 A 8 8 ILE N N 8 121.041 122.567 -1.526 2
1 77 . 1 1 A 9 9 GLY H H 9 8.656 8.344 0.312 2
1 78 . 1 1 A 9 9 GLY HA2 H 9 3.671 3.849 -0.177 2
1 79 . 1 1 A 9 9 GLY HA3 H 9 3.671 3.878 -0.207 2
1 80 . 1 1 A 9 9 GLY CA C 9 47.324 46.348 0.976 2
1 81 . 1 1 A 9 9 GLY N N 9 108.767 109.612 -0.845 2
1 82 . 1 1 A 10 10 TYR H H 10 7.987 8.327 -0.340 2
1 83 . 1 1 A 10 10 TYR HA H 10 4.269 4.390 -0.121 2
1 90 . 1 1 A 10 10 TYR CA C 10 60.713 60.107 0.606 2
1 91 . 1 1 A 10 10 TYR CB C 10 38.354 37.584 0.770 2
1 92 . 1 1 A 10 10 TYR N N 10 121.261 120.128 1.133 2
1 93 . 1 1 A 11 11 ALA H H 11 8.020 7.467 0.553 2
1 94 . 1 1 A 11 11 ALA HA H 11 4.040 3.628 0.412 2
1 98 . 1 1 A 11 11 ALA CA C 11 55.355 54.695 0.660 2
1 99 . 1 1 A 11 11 ALA CB C 11 18.737 17.988 0.749 2
1 100 . 1 1 A 11 11 ALA N N 11 122.295 123.195 -0.900 2
1 101 . 1 1 A 12 12 ILE H H 12 8.308 7.866 0.442 2
1 102 . 1 1 A 12 12 ILE HA H 12 3.732 3.902 -0.170 2
1 111 . 1 1 A 12 12 ILE CB C 12 37.611 37.689 -0.078 2
1 112 . 1 1 A 12 12 ILE N N 12 116.853 118.845 -1.992 2
1 113 . 1 1 A 13 13 GLY H H 13 8.171 8.224 -0.053 2
1 114 . 1 1 A 13 13 GLY HA2 H 13 3.744 3.796 -0.052 2
1 115 . 1 1 A 13 13 GLY HA3 H 13 3.744 3.808 -0.065 2
1 116 . 1 1 A 13 13 GLY CA C 13 47.343 47.227 0.116 2
1 117 . 1 1 A 13 13 GLY N N 13 107.089 109.461 -2.372 2
1 118 . 1 1 A 14 14 TYR H H 14 8.223 8.530 -0.307 2
1 119 . 1 1 A 14 14 TYR HA H 14 4.147 4.128 0.019 2
1 126 . 1 1 A 14 14 TYR CB C 14 38.415 38.921 -0.506 2
1 127 . 1 1 A 14 14 TYR N N 14 122.935 123.173 -0.238 2
1 128 . 1 1 A 15 15 ALA H H 15 8.345 8.148 0.197 2
1 129 . 1 1 A 15 15 ALA HA H 15 3.986 3.768 0.218 2
1 133 . 1 1 A 15 15 ALA CA C 15 55.067 54.958 0.109 2
1 134 . 1 1 A 15 15 ALA N N 15 121.882 121.498 0.384 2
1 135 . 1 1 A 16 16 PHE H H 16 8.668 8.612 0.056 2
1 136 . 1 1 A 16 16 PHE HA H 16 4.138 4.239 -0.102 2
1 143 . 1 1 A 16 16 PHE CA C 16 61.116 60.855 0.261 2
1 144 . 1 1 A 16 16 PHE CB C 16 38.857 39.230 -0.373 2
1 145 . 1 1 A 16 16 PHE N N 16 116.563 119.327 -2.764 2
1 146 . 1 1 A 17 17 GLY H H 17 8.163 9.077 -0.914 2
1 147 . 1 1 A 17 17 GLY HA2 H 17 3.891 3.854 0.037 2
1 148 . 1 1 A 17 17 GLY HA3 H 17 3.891 3.888 0.003 2
1 149 . 1 1 A 17 17 GLY N N 17 105.893 106.835 -0.942 2
1 150 . 1 1 A 18 18 ALA H H 18 7.842 7.740 0.102 2
1 151 . 1 1 A 18 18 ALA HA H 18 4.035 3.945 0.090 2
1 155 . 1 1 A 18 18 ALA CA C 18 55.037 54.669 0.368 2
1 156 . 1 1 A 18 18 ALA CB C 18 18.223 18.617 -0.394 2
1 157 . 1 1 A 18 18 ALA N N 18 122.050 124.526 -2.476 2
1 158 . 1 1 A 19 19 VAL H H 19 8.010 7.719 0.291 2
1 159 . 1 1 A 19 19 VAL HA H 19 3.549 3.735 -0.186 2
1 167 . 1 1 A 19 19 VAL CA C 19 66.571 65.072 1.499 2
1 168 . 1 1 A 19 19 VAL CB C 19 31.436 31.506 -0.070 2
1 171 . 1 1 A 19 19 VAL N N 19 118.184 116.351 1.833 2
1 172 . 1 1 A 20 20 GLU H H 20 8.339 8.591 -0.252 2
1 173 . 1 1 A 20 20 GLU HA H 20 3.666 4.039 -0.373 2
1 178 . 1 1 A 20 20 GLU CA C 20 60.103 59.422 0.681 2
1 180 . 1 1 A 20 20 GLU N N 20 118.704 120.609 -1.906 2
1 181 . 1 1 A 21 21 ARG H H 21 7.939 8.327 -0.388 2
1 182 . 1 1 A 21 21 ARG HA H 21 3.935 4.013 -0.078 2
1 190 . 1 1 A 21 21 ARG N N 21 116.955 120.810 -3.855 2
1 191 . 1 1 A 22 22 ALA H H 22 7.784 7.663 0.121 2
1 192 . 1 1 A 22 22 ALA HA H 22 4.166 4.064 0.102 2
1 196 . 1 1 A 22 22 ALA CA C 22 54.645 55.064 -0.419 2
1 197 . 1 1 A 22 22 ALA CB C 22 18.724 18.362 0.362 2
1 198 . 1 1 A 22 22 ALA N N 22 121.252 122.030 -0.778 2
1 199 . 1 1 A 23 23 VAL H H 23 8.086 7.761 0.325 2
1 200 . 1 1 A 23 23 VAL HA H 23 3.872 3.711 0.161 2
1 208 . 1 1 A 23 23 VAL CA C 23 64.928 66.027 -1.099 2
1 209 . 1 1 A 23 23 VAL CB C 23 32.451 31.701 0.750 2
1 212 . 1 1 A 23 23 VAL N N 23 114.516 118.429 -3.913 2
1 213 . 1 1 A 24 24 LEU H H 24 8.060 7.636 0.424 2
1 223 . 1 1 A 24 24 LEU N N 24 118.014 118.905 -0.891 2
1 224 . 1 1 A 25 25 GLY H H 25 7.880 8.029 -0.149 2
1 225 . 1 1 A 25 25 GLY HA2 H 25 3.949 3.995 -0.046 2
1 226 . 1 1 A 25 25 GLY HA3 H 25 3.966 3.997 -0.030 2
1 227 . 1 1 A 25 25 GLY CA C 25 45.959 45.820 0.139 2
1 228 . 1 1 A 25 25 GLY N N 25 106.969 107.121 -0.152 2
1 229 . 1 1 A 26 26 GLY H H 26 8.123 8.133 -0.010 2
1 230 . 1 1 A 26 26 GLY HA2 H 26 3.912 4.113 -0.201 2
1 231 . 1 1 A 26 26 GLY HA3 H 26 4.002 4.115 -0.113 2
1 232 . 1 1 A 26 26 GLY CA C 26 45.691 45.718 -0.027 2
1 233 . 1 1 A 26 26 GLY N N 26 108.223 109.131 -0.908 2
1 234 . 1 1 A 27 27 SER H H 27 8.201 8.479 -0.278 2
1 235 . 1 1 A 27 27 SER HA H 27 4.353 4.913 -0.560 2
1 238 . 1 1 A 27 27 SER CA C 27 59.117 57.136 1.981 2
1 239 . 1 1 A 27 27 SER CB C 27 63.770 65.883 -2.113 2
1 240 . 1 1 A 27 27 SER N N 27 115.317 116.175 -0.858 2
1 241 . 1 1 A 28 28 ARG H H 28 8.155 8.712 -0.557 2
1 242 . 1 1 A 28 28 ARG HA H 28 4.258 4.500 -0.242 2
1 250 . 1 1 A 28 28 ARG CA C 28 56.348 56.090 0.258 2
1 251 . 1 1 A 28 28 ARG N N 28 121.519 119.950 1.569 2
1 252 . 1 1 A 29 29 ASP H H 29 8.167 8.643 -0.476 2
1 255 . 1 1 A 29 29 ASP CB C 29 38.462 41.892 -3.430 2
1 256 . 1 1 A 29 29 ASP N N 29 118.393 120.716 -2.323 2
1 257 . 1 1 A 30 30 TYR H H 30 7.910 7.984 -0.074 2
1 258 . 1 1 A 30 30 TYR HA H 30 4.484 4.743 -0.259 2
1 265 . 1 1 A 30 30 TYR CA C 30 58.097 57.358 0.739 2
1 266 . 1 1 A 30 30 TYR CB C 30 38.759 39.515 -0.756 2
1 267 . 1 1 A 30 30 TYR N N 30 119.859 117.533 2.326 2
1 268 . 1 1 A 31 31 ASN H H 31 8.152 8.500 -0.348 2
1 269 . 1 1 A 31 31 ASN HA H 31 4.658 4.819 -0.161 2
1 274 . 1 1 A 31 31 ASN CA C 31 53.245 53.090 0.154 2
1 275 . 1 1 A 31 31 ASN CB C 31 39.156 38.848 0.308 2
1 276 . 1 1 A 31 31 ASN N N 31 119.343 119.899 -0.556 2
stop_
save_