data_15418_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15418
_Entry.PDB_ID 2JTT
_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 6 . 1 1 1 A 2 2 ALA H H 2 8.191 8.610 -0.419 1
1 7 . 1 1 1 A 2 2 ALA CA C 2 51.957 52.491 -0.534 1
1 8 . 1 1 1 A 2 2 ALA CB C 2 19.580 18.460 1.120 1
1 9 . 1 1 1 A 2 2 ALA N N 2 124.666 128.048 -3.382 1
1 10 . 1 1 1 A 3 3 SER H H 3 8.829 7.864 0.965 1
1 11 . 1 1 1 A 3 3 SER CA C 3 57.221 63.781 -6.560 1
1 12 . 1 1 1 A 3 3 SER N N 3 119.917 115.702 4.215 1
1 13 . 1 1 1 A 4 4 PRO CA C 4 66.688 65.959 0.729 1
1 14 . 1 1 1 A 4 4 PRO CB C 4 32.553 30.777 1.776 1
1 15 . 1 1 1 A 5 5 LEU H H 5 9.146 7.069 2.077 1
1 16 . 1 1 1 A 5 5 LEU CA C 5 59.017 56.993 2.024 1
1 17 . 1 1 1 A 5 5 LEU CB C 5 42.341 42.527 -0.186 1
1 18 . 1 1 1 A 5 5 LEU N N 5 117.902 116.350 1.552 1
1 19 . 1 1 1 A 6 6 ASP H H 6 7.572 8.555 -0.983 1
1 20 . 1 1 1 A 6 6 ASP CA C 6 57.997 57.524 0.473 1
1 21 . 1 1 1 A 6 6 ASP CB C 6 40.910 40.123 0.787 1
1 22 . 1 1 1 A 6 6 ASP N N 6 118.259 118.417 -0.158 1
1 23 . 1 1 1 A 7 7 GLN H H 7 8.660 8.504 0.156 1
1 24 . 1 1 1 A 7 7 GLN HA H 7 4.064 4.103 -0.039 1
1 29 . 1 1 1 A 7 7 GLN CA C 7 59.270 58.473 0.797 1
1 30 . 1 1 1 A 7 7 GLN CB C 7 28.468 28.069 0.399 1
1 31 . 1 1 1 A 7 7 GLN N N 7 119.558 118.120 1.438 1
1 32 . 1 1 1 A 8 8 ALA H H 8 8.253 8.010 0.243 1
1 33 . 1 1 1 A 8 8 ALA CA C 8 55.519 54.979 0.540 1
1 34 . 1 1 1 A 8 8 ALA CB C 8 18.113 18.131 -0.018 1
1 35 . 1 1 1 A 8 8 ALA N N 8 123.628 122.101 1.527 1
1 36 . 1 1 1 A 9 9 ILE H H 9 8.134 8.159 -0.025 1
1 37 . 1 1 1 A 9 9 ILE CA C 9 65.261 64.336 0.925 1
1 38 . 1 1 1 A 9 9 ILE CB C 9 37.023 37.248 -0.225 1
1 39 . 1 1 1 A 9 9 ILE N N 9 117.056 117.064 -0.008 1
1 40 . 1 1 1 A 10 10 GLY H H 10 8.515 8.528 -0.013 1
1 41 . 1 1 1 A 10 10 GLY HA3 H 10 3.773 3.690 0.083 1
1 42 . 1 1 1 A 10 10 GLY CA C 10 47.637 47.212 0.425 1
1 43 . 1 1 1 A 10 10 GLY N N 10 106.202 110.795 -4.593 1
1 44 . 1 1 1 A 11 11 LEU H H 11 8.212 8.090 0.122 1
1 45 . 1 1 1 A 11 11 LEU CA C 11 58.354 57.558 0.796 1
1 46 . 1 1 1 A 11 11 LEU CB C 11 41.683 41.711 -0.028 1
1 47 . 1 1 1 A 11 11 LEU N N 11 124.624 123.329 1.295 1
1 48 . 1 1 1 A 12 12 LEU H H 12 7.971 7.883 0.088 1
1 49 . 1 1 1 A 12 12 LEU HA H 12 4.144 4.225 -0.081 1
1 59 . 1 1 1 A 12 12 LEU CA C 12 58.691 58.479 0.212 1
1 60 . 1 1 1 A 12 12 LEU CB C 12 40.657 41.588 -0.931 1
1 61 . 1 1 1 A 12 12 LEU N N 12 118.095 118.307 -0.212 1
1 62 . 1 1 1 A 13 13 ILE H H 13 8.379 8.385 -0.006 1
1 63 . 1 1 1 A 13 13 ILE CA C 13 66.405 65.269 1.136 1
1 64 . 1 1 1 A 13 13 ILE CB C 13 38.916 37.999 0.917 1
1 65 . 1 1 1 A 13 13 ILE N N 13 121.161 120.215 0.946 1
1 66 . 1 1 1 A 14 14 GLY H H 14 8.823 8.575 0.248 1
1 67 . 1 1 1 A 14 14 GLY HA2 H 14 4.147 3.720 0.427 1
1 68 . 1 1 1 A 14 14 GLY HA3 H 14 3.982 3.730 0.252 1
1 69 . 1 1 1 A 14 14 GLY CA C 14 47.750 47.056 0.694 1
1 70 . 1 1 1 A 14 14 GLY N N 14 108.982 107.383 1.599 1
1 71 . 1 1 1 A 15 15 ILE H H 15 8.681 8.350 0.331 1
1 72 . 1 1 1 A 15 15 ILE CA C 15 64.996 64.795 0.201 1
1 73 . 1 1 1 A 15 15 ILE CB C 15 37.107 37.974 -0.867 1
1 74 . 1 1 1 A 15 15 ILE N N 15 121.601 122.595 -0.994 1
1 75 . 1 1 1 A 16 16 PHE H H 16 7.103 8.685 -1.582 1
1 76 . 1 1 1 A 16 16 PHE CA C 16 62.910 61.774 1.136 1
1 77 . 1 1 1 A 16 16 PHE CB C 16 38.782 39.060 -0.278 1
1 78 . 1 1 1 A 16 16 PHE N N 16 118.660 120.948 -2.288 1
1 79 . 1 1 1 A 17 17 HIS H H 17 7.591 8.388 -0.797 1
1 80 . 1 1 1 A 17 17 HIS HA H 17 4.793 4.442 0.351 1
1 82 . 1 1 1 A 17 17 HIS CA C 17 58.125 58.425 -0.300 1
1 83 . 1 1 1 A 17 17 HIS CB C 17 29.584 30.007 -0.423 1
1 84 . 1 1 1 A 17 17 HIS N N 17 114.968 118.129 -3.161 1
1 85 . 1 1 1 A 18 18 LYS H H 18 8.144 8.399 -0.255 1
1 86 . 1 1 1 A 18 18 LYS CA C 18 58.975 59.012 -0.037 1
1 87 . 1 1 1 A 18 18 LYS CB C 18 32.379 31.814 0.565 1
1 88 . 1 1 1 A 18 18 LYS N N 18 122.373 118.770 3.603 1
1 89 . 1 1 1 A 19 19 TYR H H 19 6.999 7.297 -0.298 1
1 90 . 1 1 1 A 19 19 TYR CA C 19 60.318 60.711 -0.393 1
1 91 . 1 1 1 A 19 19 TYR CB C 19 40.355 38.239 2.116 1
1 92 . 1 1 1 A 19 19 TYR N N 19 113.614 119.536 -5.922 1
1 93 . 1 1 1 A 20 20 SER H H 20 8.432 7.812 0.620 1
1 94 . 1 1 1 A 20 20 SER CA C 20 61.897 61.101 0.796 1
1 95 . 1 1 1 A 20 20 SER CB C 20 61.354 62.135 -0.781 1
1 96 . 1 1 1 A 20 20 SER N N 20 113.201 115.472 -2.271 1
1 97 . 1 1 1 A 21 21 GLY H H 21 7.678 7.878 -0.200 1
1 98 . 1 1 1 A 21 21 GLY HA2 H 21 4.195 3.870 0.325 1
1 99 . 1 1 1 A 21 21 GLY HA3 H 21 3.900 3.893 0.007 1
1 100 . 1 1 1 A 21 21 GLY CA C 21 45.628 46.429 -0.801 1
1 101 . 1 1 1 A 21 21 GLY N N 21 110.734 109.672 1.062 1
1 102 . 1 1 1 A 22 22 LYS H H 22 7.362 7.657 -0.295 1
1 103 . 1 1 1 A 22 22 LYS CA C 22 60.163 58.711 1.452 1
1 104 . 1 1 1 A 22 22 LYS CB C 22 32.554 32.033 0.521 1
1 105 . 1 1 1 A 22 22 LYS N N 22 122.161 120.654 1.507 1
1 106 . 1 1 1 A 23 23 GLU H H 23 9.639 8.180 1.459 1
1 107 . 1 1 1 A 23 23 GLU CA C 23 54.449 55.686 -1.237 1
1 108 . 1 1 1 A 23 23 GLU N N 23 116.288 114.811 1.477 1
1 109 . 1 1 1 A 24 24 GLY HA2 H 24 3.912 4.085 -0.173 1
1 110 . 1 1 1 A 24 24 GLY HA3 H 24 3.787 4.089 -0.302 1
1 111 . 1 1 1 A 24 24 GLY CA C 24 45.898 45.766 0.132 1
1 112 . 1 1 1 A 25 25 ASP H H 25 8.204 8.935 -0.731 1
1 113 . 1 1 1 A 25 25 ASP CA C 25 55.252 54.641 0.611 1
1 114 . 1 1 1 A 25 25 ASP N N 25 125.671 117.886 7.785 1
1 115 . 1 1 1 A 26 26 LYS CA C 26 57.851 56.649 1.202 1
1 116 . 1 1 1 A 26 26 LYS CB C 26 31.265 32.833 -1.568 1
1 117 . 1 1 1 A 27 27 HIS H H 27 9.763 9.279 0.484 1
1 118 . 1 1 1 A 27 27 HIS CA C 27 55.580 55.998 -0.418 1
1 119 . 1 1 1 A 27 27 HIS CB C 27 30.936 30.463 0.473 1
1 120 . 1 1 1 A 27 27 HIS N N 27 118.108 117.762 0.346 1
1 121 . 1 1 1 A 28 28 THR H H 28 7.325 7.730 -0.405 1
1 126 . 1 1 1 A 28 28 THR CA C 28 60.128 60.041 0.087 1
1 127 . 1 1 1 A 28 28 THR CB C 28 72.268 72.129 0.139 1
1 128 . 1 1 1 A 28 28 THR N N 28 106.920 110.213 -3.293 1
1 129 . 1 1 1 A 29 29 LEU H H 29 9.422 9.309 0.113 1
1 130 . 1 1 1 A 29 29 LEU HA H 29 5.368 4.945 0.423 1
1 140 . 1 1 1 A 29 29 LEU CA C 29 52.567 53.348 -0.781 1
1 141 . 1 1 1 A 29 29 LEU CB C 29 43.523 44.779 -1.256 1
1 142 . 1 1 1 A 29 29 LEU N N 29 125.021 123.967 1.054 1
1 143 . 1 1 1 A 30 30 SER H H 30 10.485 8.877 1.608 1
1 144 . 1 1 1 A 30 30 SER CA C 30 56.653 57.873 -1.220 1
1 145 . 1 1 1 A 30 30 SER CB C 30 65.313 64.124 1.189 1
1 146 . 1 1 1 A 30 30 SER N N 30 124.758 120.157 4.601 1
1 147 . 1 1 1 A 31 31 LYS H H 31 8.728 8.892 -0.164 1
1 148 . 1 1 1 A 31 31 LYS CA C 31 59.669 59.225 0.444 1
1 149 . 1 1 1 A 31 31 LYS CB C 31 31.763 31.985 -0.222 1
1 150 . 1 1 1 A 31 31 LYS N N 31 119.459 123.888 -4.429 1
1 151 . 1 1 1 A 32 32 LYS H H 32 7.857 8.041 -0.184 1
1 152 . 1 1 1 A 32 32 LYS CA C 32 59.721 58.993 0.728 1
1 153 . 1 1 1 A 32 32 LYS CB C 32 32.901 31.917 0.984 1
1 154 . 1 1 1 A 32 32 LYS N N 32 117.933 119.092 -1.159 1
1 155 . 1 1 1 A 33 33 GLU H H 33 7.559 7.805 -0.246 1
1 156 . 1 1 1 A 33 33 GLU CA C 33 59.169 58.992 0.177 1
1 157 . 1 1 1 A 33 33 GLU CB C 33 31.014 29.212 1.802 1
1 158 . 1 1 1 A 33 33 GLU N N 33 120.407 119.615 0.792 1
1 159 . 1 1 1 A 34 34 LEU H H 34 8.833 8.491 0.342 1
1 160 . 1 1 1 A 34 34 LEU CA C 34 56.928 57.989 -1.061 1
1 161 . 1 1 1 A 34 34 LEU CB C 34 41.435 41.726 -0.291 1
1 162 . 1 1 1 A 34 34 LEU N N 34 117.677 121.308 -3.631 1
1 163 . 1 1 1 A 35 35 LYS H H 35 8.010 7.949 0.061 1
1 164 . 1 1 1 A 35 35 LYS CA C 35 60.692 59.438 1.254 1
1 165 . 1 1 1 A 35 35 LYS CB C 35 32.223 31.911 0.312 1
1 166 . 1 1 1 A 35 35 LYS N N 35 119.829 118.557 1.272 1
1 167 . 1 1 1 A 36 36 GLU H H 36 7.169 8.014 -0.845 1
1 168 . 1 1 1 A 36 36 GLU CA C 36 59.588 59.127 0.461 1
1 169 . 1 1 1 A 36 36 GLU CB C 36 29.342 29.344 -0.002 1
1 170 . 1 1 1 A 36 36 GLU N N 36 117.340 119.437 -2.097 1
1 171 . 1 1 1 A 37 37 LEU H H 37 7.478 8.060 -0.582 1
1 172 . 1 1 1 A 37 37 LEU CA C 37 59.674 57.700 1.974 1
1 173 . 1 1 1 A 37 37 LEU CB C 37 42.142 40.954 1.188 1
1 174 . 1 1 1 A 37 37 LEU N N 37 120.884 121.550 -0.666 1
1 175 . 1 1 1 A 38 38 ILE H H 38 8.377 8.152 0.225 1
1 176 . 1 1 1 A 38 38 ILE CA C 38 65.651 65.523 0.128 1
1 177 . 1 1 1 A 38 38 ILE N N 38 118.450 120.033 -1.583 1
1 178 . 1 1 1 A 39 39 GLN H H 39 8.217 8.132 0.085 1
1 179 . 1 1 1 A 39 39 GLN CA C 39 59.788 59.000 0.788 1
1 180 . 1 1 1 A 39 39 GLN CB C 39 29.278 28.050 1.228 1
1 181 . 1 1 1 A 39 39 GLN N N 39 113.091 118.206 -5.115 1
1 182 . 1 1 1 A 40 40 LYS H H 40 8.426 8.124 0.302 1
1 183 . 1 1 1 A 40 40 LYS CA C 40 57.807 58.533 -0.726 1
1 184 . 1 1 1 A 40 40 LYS CB C 40 33.942 32.652 1.290 1
1 185 . 1 1 1 A 40 40 LYS N N 40 114.771 118.944 -4.173 1
1 186 . 1 1 1 A 41 41 GLU H H 41 8.496 8.004 0.492 1
1 187 . 1 1 1 A 41 41 GLU CA C 41 55.395 58.621 -3.226 1
1 188 . 1 1 1 A 41 41 GLU CB C 41 29.260 30.482 -1.222 1
1 189 . 1 1 1 A 41 41 GLU N N 41 112.546 118.563 -6.017 1
1 190 . 1 1 1 A 42 42 LEU H H 42 7.267 8.405 -1.138 1
1 191 . 1 1 1 A 42 42 LEU CA C 42 53.776 54.068 -0.292 1
1 192 . 1 1 1 A 42 42 LEU N N 42 118.657 121.179 -2.522 1
1 193 . 1 1 1 A 44 44 ILE CA C 44 62.210 61.125 1.085 1
1 194 . 1 1 1 A 44 44 ILE CB C 44 38.247 37.261 0.986 1
1 195 . 1 1 1 A 45 45 GLY H H 45 7.820 8.056 -0.236 1
1 196 . 1 1 1 A 45 45 GLY CA C 45 47.742 46.380 1.362 1
1 197 . 1 1 1 A 45 45 GLY N N 45 108.178 112.080 -3.902 1
1 198 . 1 1 1 A 46 46 SER H H 46 7.895 8.875 -0.980 1
1 199 . 1 1 1 A 46 46 SER CA C 46 59.958 60.548 -0.590 1
1 200 . 1 1 1 A 46 46 SER CB C 46 63.450 61.805 1.645 1
1 201 . 1 1 1 A 46 46 SER N N 46 113.038 114.583 -1.545 1
1 202 . 1 1 1 A 47 47 LYS H H 47 7.736 7.691 0.045 1
1 203 . 1 1 1 A 47 47 LYS CA C 47 55.636 55.898 -0.262 1
1 204 . 1 1 1 A 47 47 LYS CB C 47 33.103 33.864 -0.761 1
1 205 . 1 1 1 A 47 47 LYS N N 47 119.422 122.036 -2.614 1
1 206 . 1 1 1 A 48 48 LEU H H 48 6.988 8.831 -1.843 1
1 207 . 1 1 1 A 48 48 LEU HA H 48 4.497 4.158 0.339 1
1 217 . 1 1 1 A 48 48 LEU CA C 48 54.517 55.966 -1.449 1
1 218 . 1 1 1 A 48 48 LEU CB C 48 42.987 41.477 1.510 1
1 219 . 1 1 1 A 48 48 LEU N N 48 118.908 124.711 -5.803 1
1 220 . 1 1 1 A 49 49 GLN H H 49 9.206 8.117 1.089 1
1 221 . 1 1 1 A 49 49 GLN HA H 49 4.486 4.384 0.102 1
1 223 . 1 1 1 A 49 49 GLN CA C 49 54.785 57.882 -3.097 1
1 224 . 1 1 1 A 49 49 GLN CB C 49 29.636 28.418 1.218 1
1 225 . 1 1 1 A 49 49 GLN N N 49 121.275 118.920 2.355 1
1 226 . 1 1 1 A 50 50 ASP H H 50 8.854 8.318 0.536 1
1 227 . 1 1 1 A 50 50 ASP CA C 50 59.078 57.447 1.631 1
1 228 . 1 1 1 A 50 50 ASP CB C 50 40.632 41.879 -1.247 1
1 229 . 1 1 1 A 50 50 ASP N N 50 123.430 120.651 2.779 1
1 230 . 1 1 1 A 51 51 ALA H H 51 8.720 7.681 1.039 1
1 231 . 1 1 1 A 51 51 ALA CA C 51 55.281 54.856 0.425 1
1 232 . 1 1 1 A 51 51 ALA CB C 51 18.205 18.089 0.116 1
1 233 . 1 1 1 A 51 51 ALA N N 51 117.829 121.177 -3.348 1
1 234 . 1 1 1 A 52 52 GLU H H 52 7.161 7.852 -0.691 1
1 235 . 1 1 1 A 52 52 GLU CA C 52 58.757 58.917 -0.160 1
1 236 . 1 1 1 A 52 52 GLU CB C 52 30.247 29.643 0.604 1
1 237 . 1 1 1 A 52 52 GLU N N 52 115.459 117.429 -1.970 1
1 238 . 1 1 1 A 53 53 ILE H H 53 7.962 8.050 -0.088 1
1 239 . 1 1 1 A 53 53 ILE CA C 53 65.525 65.069 0.456 1
1 240 . 1 1 1 A 53 53 ILE CB C 53 37.289 37.787 -0.498 1
1 241 . 1 1 1 A 53 53 ILE N N 53 120.414 121.156 -0.742 1
1 242 . 1 1 1 A 54 54 VAL H H 54 8.132 8.039 0.093 1
1 243 . 1 1 1 A 54 54 VAL CA C 54 67.290 65.535 1.755 1
1 244 . 1 1 1 A 54 54 VAL CB C 54 31.434 31.134 0.300 1
1 245 . 1 1 1 A 54 54 VAL N N 54 119.775 117.266 2.509 1
1 246 . 1 1 1 A 55 55 LYS H H 55 7.155 8.069 -0.914 1
1 247 . 1 1 1 A 55 55 LYS CA C 55 59.131 59.220 -0.089 1
1 248 . 1 1 1 A 55 55 LYS CB C 55 32.131 32.065 0.066 1
1 249 . 1 1 1 A 55 55 LYS N N 55 119.175 120.800 -1.625 1
1 250 . 1 1 1 A 56 56 LEU H H 56 7.837 8.422 -0.585 1
1 251 . 1 1 1 A 56 56 LEU CA C 56 58.052 58.015 0.037 1
1 252 . 1 1 1 A 56 56 LEU CB C 56 41.878 41.362 0.516 1
1 253 . 1 1 1 A 56 56 LEU N N 56 119.679 121.345 -1.666 1
1 254 . 1 1 1 A 57 57 MET H H 57 8.385 8.873 -0.488 1
1 255 . 1 1 1 A 57 57 MET CA C 57 60.756 58.827 1.929 1
1 256 . 1 1 1 A 57 57 MET CB C 57 33.152 31.905 1.247 1
1 257 . 1 1 1 A 57 57 MET N N 57 115.116 119.363 -4.247 1
1 258 . 1 1 1 A 58 58 ASP H H 58 7.591 8.164 -0.573 1
1 259 . 1 1 1 A 58 58 ASP CA C 58 57.365 57.496 -0.131 1
1 260 . 1 1 1 A 58 58 ASP CB C 58 40.858 41.617 -0.759 1
1 261 . 1 1 1 A 58 58 ASP N N 58 118.197 119.684 -1.487 1
1 262 . 1 1 1 A 59 59 ASP H H 59 7.725 8.136 -0.411 1
1 263 . 1 1 1 A 59 59 ASP CA C 59 56.830 57.430 -0.600 1
1 264 . 1 1 1 A 59 59 ASP CB C 59 40.567 40.644 -0.077 1
1 265 . 1 1 1 A 59 59 ASP N N 59 118.481 118.047 0.434 1
1 266 . 1 1 1 A 60 60 LEU H H 60 7.703 8.013 -0.310 1
1 267 . 1 1 1 A 60 60 LEU CA C 60 56.564 57.718 -1.154 1
1 268 . 1 1 1 A 60 60 LEU CB C 60 42.714 41.012 1.702 1
1 269 . 1 1 1 A 60 60 LEU N N 60 116.935 120.807 -3.872 1
1 270 . 1 1 1 A 61 61 ASP H H 61 7.143 8.715 -1.572 1
1 271 . 1 1 1 A 61 61 ASP HA H 61 4.690 4.427 0.263 1
1 274 . 1 1 1 A 61 61 ASP CA C 61 52.286 57.176 -4.890 1
1 275 . 1 1 1 A 61 61 ASP CB C 61 39.245 40.530 -1.285 1
1 276 . 1 1 1 A 61 61 ASP N N 61 116.605 118.691 -2.086 1
1 277 . 1 1 1 A 62 62 ARG H H 62 7.786 7.719 0.067 1
1 278 . 1 1 1 A 62 62 ARG CA C 62 58.328 58.837 -0.509 1
1 279 . 1 1 1 A 62 62 ARG CB C 62 30.106 29.790 0.316 1
1 280 . 1 1 1 A 62 62 ARG N N 62 125.967 121.103 4.864 1
1 281 . 1 1 1 A 63 63 ASN H H 63 7.945 7.595 0.350 1
1 282 . 1 1 1 A 63 63 ASN CA C 63 51.863 55.443 -3.580 1
1 283 . 1 1 1 A 63 63 ASN CB C 63 36.809 39.230 -2.421 1
1 284 . 1 1 1 A 63 63 ASN N N 63 112.434 115.876 -3.442 1
1 285 . 1 1 1 A 64 64 LYS H H 64 7.477 7.620 -0.143 1
1 286 . 1 1 1 A 64 64 LYS CA C 64 56.524 55.986 0.538 1
1 287 . 1 1 1 A 64 64 LYS N N 64 114.197 117.484 -3.287 1
1 288 . 1 1 1 A 65 65 ASP H H 65 8.345 9.038 -0.693 1
1 289 . 1 1 1 A 65 65 ASP CA C 65 52.969 57.439 -4.470 1
1 290 . 1 1 1 A 65 65 ASP CB C 65 40.329 40.456 -0.127 1
1 291 . 1 1 1 A 65 65 ASP N N 65 118.581 125.751 -7.170 1
1 292 . 1 1 1 A 66 66 GLN H H 66 9.945 7.667 2.278 1
1 293 . 1 1 1 A 66 66 GLN CA C 66 58.132 57.868 0.264 1
1 294 . 1 1 1 A 66 66 GLN CB C 66 26.035 29.388 -3.353 1
1 295 . 1 1 1 A 66 66 GLN N N 66 113.203 116.949 -3.746 1
1 296 . 1 1 1 A 67 67 GLU H H 67 7.880 7.675 0.205 1
1 297 . 1 1 1 A 67 67 GLU HA H 67 4.910 4.780 0.130 1
1 302 . 1 1 1 A 67 67 GLU CA C 67 54.082 55.359 -1.277 1
1 303 . 1 1 1 A 67 67 GLU CB C 67 33.174 33.119 0.055 1
1 304 . 1 1 1 A 67 67 GLU N N 67 118.554 114.144 4.410 1
1 305 . 1 1 1 A 68 68 VAL H H 68 9.669 9.212 0.457 1
1 306 . 1 1 1 A 68 68 VAL HA H 68 5.465 4.350 1.115 1
1 314 . 1 1 1 A 68 68 VAL CA C 68 61.079 61.994 -0.915 1
1 315 . 1 1 1 A 68 68 VAL CB C 68 33.280 32.603 0.677 1
1 316 . 1 1 1 A 68 68 VAL N N 68 126.572 124.265 2.307 1
1 317 . 1 1 1 A 69 69 ASN H H 69 8.985 8.698 0.287 1
1 318 . 1 1 1 A 69 69 ASN CA C 69 50.812 53.354 -2.542 1
1 319 . 1 1 1 A 69 69 ASN CB C 69 38.609 40.593 -1.984 1
1 320 . 1 1 1 A 69 69 ASN N N 69 127.472 126.227 1.245 1
1 321 . 1 1 1 A 70 70 PHE H H 70 9.100 9.269 -0.169 1
1 322 . 1 1 1 A 70 70 PHE CA C 70 63.279 61.954 1.325 1
1 323 . 1 1 1 A 70 70 PHE CB C 70 38.741 39.471 -0.730 1
1 324 . 1 1 1 A 70 70 PHE N N 70 119.972 127.630 -7.658 1
1 325 . 1 1 1 A 71 71 GLN H H 71 8.342 8.261 0.081 1
1 326 . 1 1 1 A 71 71 GLN HA H 71 3.923 3.597 0.326 1
1 329 . 1 1 1 A 71 71 GLN CA C 71 59.866 58.375 1.491 1
1 330 . 1 1 1 A 71 71 GLN CB C 71 27.878 28.611 -0.733 1
1 331 . 1 1 1 A 71 71 GLN N N 71 118.216 117.334 0.882 1
1 332 . 1 1 1 A 72 72 GLU H H 72 8.721 7.765 0.956 1
1 333 . 1 1 1 A 72 72 GLU HA H 72 4.147 4.080 0.067 1
1 338 . 1 1 1 A 72 72 GLU CA C 72 59.313 58.871 0.442 1
1 339 . 1 1 1 A 72 72 GLU CB C 72 30.233 29.452 0.781 1
1 340 . 1 1 1 A 72 72 GLU N N 72 121.455 119.850 1.605 1
1 341 . 1 1 1 A 73 73 TYR H H 73 8.536 8.096 0.440 1
1 342 . 1 1 1 A 73 73 TYR CA C 73 60.961 61.283 -0.322 1
1 343 . 1 1 1 A 73 73 TYR CB C 73 38.724 38.778 -0.054 1
1 344 . 1 1 1 A 73 73 TYR N N 73 123.356 122.094 1.262 1
1 345 . 1 1 1 A 74 74 ILE H H 74 8.642 7.683 0.959 1
1 346 . 1 1 1 A 74 74 ILE CA C 74 61.880 63.833 -1.953 1
1 347 . 1 1 1 A 74 74 ILE CB C 74 36.077 36.822 -0.745 1
1 348 . 1 1 1 A 74 74 ILE N N 74 119.799 119.960 -0.161 1
1 349 . 1 1 1 A 75 75 THR H H 75 7.959 8.030 -0.071 1
1 354 . 1 1 1 A 75 75 THR CA C 75 67.056 66.662 0.394 1
1 355 . 1 1 1 A 75 75 THR CB C 75 68.386 68.855 -0.469 1
1 356 . 1 1 1 A 75 75 THR N N 75 119.486 117.626 1.860 1
1 357 . 1 1 1 A 76 76 PHE H H 76 7.450 8.147 -0.697 1
1 358 . 1 1 1 A 76 76 PHE CA C 76 59.010 61.697 -2.687 1
1 359 . 1 1 1 A 76 76 PHE CB C 76 38.139 39.096 -0.957 1
1 360 . 1 1 1 A 76 76 PHE N N 76 122.873 122.502 0.371 1
1 361 . 1 1 1 A 77 77 LEU H H 77 7.829 8.313 -0.484 1
1 362 . 1 1 1 A 77 77 LEU CA C 77 57.450 57.672 -0.222 1
1 363 . 1 1 1 A 77 77 LEU CB C 77 40.560 41.278 -0.718 1
1 364 . 1 1 1 A 77 77 LEU N N 77 117.405 118.443 -1.038 1
1 365 . 1 1 1 A 78 78 GLY H H 78 8.093 8.331 -0.238 1
1 366 . 1 1 1 A 78 78 GLY HA2 H 78 3.661 3.710 -0.049 1
1 367 . 1 1 1 A 78 78 GLY HA3 H 78 3.594 3.711 -0.117 1
1 368 . 1 1 1 A 78 78 GLY CA C 78 47.442 47.112 0.330 1
1 369 . 1 1 1 A 78 78 GLY N N 78 105.528 106.323 -0.795 1
1 370 . 1 1 1 A 79 79 ALA H H 79 7.759 7.636 0.123 1
1 371 . 1 1 1 A 79 79 ALA CA C 79 55.153 54.793 0.360 1
1 372 . 1 1 1 A 79 79 ALA CB C 79 17.768 19.178 -1.410 1
1 373 . 1 1 1 A 79 79 ALA N N 79 124.488 125.017 -0.529 1
1 374 . 1 1 1 A 80 80 LEU H H 80 7.963 7.928 0.035 1
1 375 . 1 1 1 A 80 80 LEU CA C 80 57.464 57.660 -0.196 1
1 376 . 1 1 1 A 80 80 LEU CB C 80 41.496 41.130 0.366 1
1 377 . 1 1 1 A 80 80 LEU N N 80 117.869 119.854 -1.985 1
1 378 . 1 1 1 A 81 81 ALA H H 81 8.365 8.186 0.179 1
1 379 . 1 1 1 A 81 81 ALA CA C 81 55.475 55.087 0.388 1
1 380 . 1 1 1 A 81 81 ALA CB C 81 17.483 17.928 -0.445 1
1 381 . 1 1 1 A 81 81 ALA N N 81 119.054 120.490 -1.436 1
1 382 . 1 1 1 A 82 82 MET H H 82 8.112 7.739 0.373 1
1 383 . 1 1 1 A 82 82 MET CA C 82 59.516 57.978 1.538 1
1 384 . 1 1 1 A 82 82 MET CB C 82 32.550 32.233 0.317 1
1 385 . 1 1 1 A 82 82 MET N N 82 115.364 117.755 -2.391 1
1 386 . 1 1 1 A 83 83 ILE H H 83 7.981 8.113 -0.132 1
1 387 . 1 1 1 A 83 83 ILE HA H 83 3.839 3.900 -0.061 1
1 391 . 1 1 1 A 83 83 ILE CA C 83 64.467 63.030 1.437 1
1 392 . 1 1 1 A 83 83 ILE CB C 83 37.312 37.424 -0.112 1
1 393 . 1 1 1 A 83 83 ILE N N 83 120.887 119.707 1.180 1
1 394 . 1 1 1 A 84 84 TYR H H 84 8.731 8.173 0.558 1
1 395 . 1 1 1 A 84 84 TYR N N 84 120.933 123.734 -2.801 1
1 396 . 1 1 1 A 87 87 ALA H H 87 7.829 8.217 -0.388 1
1 397 . 1 1 1 A 87 87 ALA CA C 87 53.768 55.085 -1.317 1
1 398 . 1 1 1 A 87 87 ALA CB C 87 18.504 18.281 0.223 1
1 399 . 1 1 1 A 87 87 ALA N N 87 120.274 122.050 -1.776 1
1 400 . 1 1 1 A 88 88 LEU H H 88 7.499 7.982 -0.483 1
1 401 . 1 1 1 A 88 88 LEU CA C 88 55.605 54.959 0.646 1
1 402 . 1 1 1 A 88 88 LEU CB C 88 42.047 41.555 0.492 1
1 403 . 1 1 1 A 88 88 LEU N N 88 117.356 118.313 -0.957 1
1 404 . 1 1 1 A 89 89 LYS H H 89 7.561 7.879 -0.318 1
1 405 . 1 1 1 A 89 89 LYS CA C 89 56.865 55.892 0.973 1
1 406 . 1 1 1 A 89 89 LYS CB C 89 32.592 34.730 -2.138 1
1 407 . 1 1 1 A 89 89 LYS N N 89 119.289 116.595 2.694 1
1 416 . 1 3 2 C 6 6 GLU H H 190 8.385 8.775 -0.390 1
1 417 . 1 3 2 C 6 6 GLU HA H 190 4.153 4.071 0.082 1
1 422 . 1 3 2 C 6 6 GLU C C 190 175.031 177.130 -2.099 1
1 423 . 1 3 2 C 6 6 GLU CA C 190 58.866 56.686 2.180 1
1 424 . 1 3 2 C 6 6 GLU CB C 190 30.751 29.736 1.015 1
1 426 . 1 3 2 C 6 6 GLU N N 190 122.715 119.044 3.671 1
1 427 . 1 3 2 C 7 7 GLY H H 191 8.475 7.730 0.745 1
1 428 . 1 3 2 C 7 7 GLY HA2 H 191 3.887 3.987 -0.100 1
1 429 . 1 3 2 C 7 7 GLY HA3 H 191 3.887 3.988 -0.101 1
1 430 . 1 3 2 C 7 7 GLY C C 191 177.922 175.147 2.775 1
1 431 . 1 3 2 C 7 7 GLY CA C 191 46.884 45.519 1.365 1
1 432 . 1 3 2 C 7 7 GLY N N 191 109.009 108.341 0.668 1
1 433 . 1 3 2 C 8 8 LEU HA H 192 4.095 3.882 0.213 1
1 443 . 1 3 2 C 8 8 LEU CA C 192 58.154 58.327 -0.173 1
1 444 . 1 3 2 C 8 8 LEU CB C 192 42.789 42.149 0.640 1
1 448 . 1 3 2 C 9 9 MET H H 193 8.250 8.364 -0.114 1
1 449 . 1 3 2 C 9 9 MET HA H 193 4.150 4.160 -0.010 1
1 457 . 1 3 2 C 9 9 MET C C 193 178.421 178.303 0.118 1
1 458 . 1 3 2 C 9 9 MET CA C 193 58.818 58.461 0.357 1
1 459 . 1 3 2 C 9 9 MET CB C 193 32.360 31.940 0.420 1
1 462 . 1 3 2 C 9 9 MET N N 193 117.049 117.068 -0.019 1
1 463 . 1 3 2 C 10 10 ASN H H 194 7.892 8.350 -0.458 1
1 464 . 1 3 2 C 10 10 ASN HA H 194 4.468 4.511 -0.043 1
1 469 . 1 3 2 C 10 10 ASN C C 194 178.099 176.971 1.128 1
1 470 . 1 3 2 C 10 10 ASN CA C 194 56.644 55.330 1.314 1
1 471 . 1 3 2 C 10 10 ASN CB C 194 39.100 38.604 0.496 1
1 472 . 1 3 2 C 10 10 ASN N N 194 117.034 118.632 -1.598 1
1 474 . 1 3 2 C 11 11 VAL H H 195 7.651 7.913 -0.262 1
1 475 . 1 3 2 C 11 11 VAL HA H 195 3.735 3.842 -0.107 1
1 483 . 1 3 2 C 11 11 VAL C C 195 177.657 178.070 -0.413 1
1 484 . 1 3 2 C 11 11 VAL CA C 195 66.710 65.263 1.447 1
1 485 . 1 3 2 C 11 11 VAL CB C 195 32.468 31.927 0.541 1
1 488 . 1 3 2 C 11 11 VAL N N 195 119.878 118.044 1.834 1
1 489 . 1 3 2 C 12 12 LEU H H 196 8.030 8.010 0.020 1
1 490 . 1 3 2 C 12 12 LEU HA H 196 4.013 3.965 0.048 1
1 500 . 1 3 2 C 12 12 LEU C C 196 177.540 179.424 -1.884 1
1 501 . 1 3 2 C 12 12 LEU CA C 196 58.489 57.760 0.729 1
1 502 . 1 3 2 C 12 12 LEU CB C 196 42.457 41.128 1.329 1
1 506 . 1 3 2 C 12 12 LEU N N 196 119.499 120.379 -0.880 1
1 507 . 1 3 2 C 13 13 LYS H H 197 8.015 8.431 -0.416 1
1 508 . 1 3 2 C 13 13 LYS HA H 197 3.949 3.968 -0.019 1
1 517 . 1 3 2 C 13 13 LYS C C 197 178.419 178.776 -0.357 1
1 518 . 1 3 2 C 13 13 LYS CA C 197 60.191 58.962 1.229 1
1 519 . 1 3 2 C 13 13 LYS CB C 197 33.075 32.050 1.025 1
1 523 . 1 3 2 C 13 13 LYS N N 197 117.888 121.255 -3.367 1
1 524 . 1 3 2 C 14 14 LYS H H 198 7.506 7.562 -0.056 1
1 525 . 1 3 2 C 14 14 LYS HA H 198 4.127 4.169 -0.042 1
1 534 . 1 3 2 C 14 14 LYS C C 198 178.262 178.797 -0.535 1
1 535 . 1 3 2 C 14 14 LYS CA C 198 59.161 58.394 0.767 1
1 536 . 1 3 2 C 14 14 LYS CB C 198 32.956 31.965 0.991 1
1 540 . 1 3 2 C 14 14 LYS N N 198 118.321 117.893 0.428 1
1 541 . 1 3 2 C 15 15 ILE H H 199 7.780 7.849 -0.069 1
1 542 . 1 3 2 C 15 15 ILE HA H 199 3.787 3.929 -0.142 1
1 552 . 1 3 2 C 15 15 ILE C C 199 178.647 178.016 0.631 1
1 553 . 1 3 2 C 15 15 ILE CA C 199 64.912 63.479 1.433 1
1 554 . 1 3 2 C 15 15 ILE CB C 199 38.780 36.744 2.036 1
1 558 . 1 3 2 C 15 15 ILE N N 199 118.644 120.023 -1.379 1
1 559 . 1 3 2 C 16 16 TYR H H 200 7.918 8.404 -0.486 1
1 560 . 1 3 2 C 16 16 TYR HA H 200 4.252 4.080 0.172 1
1 567 . 1 3 2 C 16 16 TYR C C 200 177.806 177.370 0.436 1
1 568 . 1 3 2 C 16 16 TYR CA C 200 61.171 61.615 -0.444 1
1 569 . 1 3 2 C 16 16 TYR CB C 200 39.245 39.067 0.178 1
1 573 . 1 3 2 C 16 16 TYR N N 200 118.683 122.994 -4.311 1
1 574 . 1 3 2 C 17 17 GLU H H 201 8.089 8.490 -0.401 1
1 575 . 1 3 2 C 17 17 GLU HA H 201 4.124 4.410 -0.286 1
1 580 . 1 3 2 C 17 17 GLU C C 201 177.414 178.192 -0.778 1
1 581 . 1 3 2 C 17 17 GLU CA C 201 58.784 58.451 0.333 1
1 582 . 1 3 2 C 17 17 GLU CB C 201 30.747 29.169 1.578 1
1 584 . 1 3 2 C 17 17 GLU N N 201 119.409 118.869 0.540 1
1 585 . 1 3 2 C 18 18 ASP H H 202 8.023 7.670 0.353 1
1 586 . 1 3 2 C 18 18 ASP HA H 202 4.657 4.588 0.069 1
1 589 . 1 3 2 C 18 18 ASP C C 202 177.346 176.269 1.077 1
1 590 . 1 3 2 C 18 18 ASP CA C 202 55.496 54.718 0.778 1
1 591 . 1 3 2 C 18 18 ASP CB C 202 42.023 41.263 0.760 1
1 592 . 1 3 2 C 18 18 ASP N N 202 119.459 118.854 0.605 1
1 593 . 1 3 2 C 19 19 GLY H H 203 7.933 7.853 0.080 1
1 594 . 1 3 2 C 19 19 GLY HA2 H 203 3.938 3.868 0.070 1
1 595 . 1 3 2 C 19 19 GLY HA3 H 203 3.938 3.895 0.043 1
1 596 . 1 3 2 C 19 19 GLY C C 203 177.240 174.415 2.825 1
1 597 . 1 3 2 C 19 19 GLY CA C 203 46.309 45.701 0.608 1
1 598 . 1 3 2 C 19 19 GLY N N 203 108.518 107.499 1.019 1
1 599 . 1 3 2 C 20 20 ASP H H 204 8.091 7.988 0.103 1
1 600 . 1 3 2 C 20 20 ASP HA H 204 4.616 4.607 0.009 1
1 603 . 1 3 2 C 20 20 ASP C C 204 173.979 175.508 -1.529 1
1 604 . 1 3 2 C 20 20 ASP CA C 204 55.064 54.356 0.708 1
1 605 . 1 3 2 C 20 20 ASP CB C 204 42.203 42.636 -0.433 1
1 606 . 1 3 2 C 20 20 ASP N N 204 120.172 120.793 -0.621 1
1 607 . 1 3 2 C 21 21 ASP H H 205 8.352 8.820 -0.468 1
1 608 . 1 3 2 C 21 21 ASP HA H 205 4.468 4.766 -0.298 1
1 611 . 1 3 2 C 21 21 ASP C C 205 176.432 177.130 -0.698 1
1 612 . 1 3 2 C 21 21 ASP CA C 205 56.663 54.059 2.604 1
1 613 . 1 3 2 C 21 21 ASP CB C 205 41.918 43.156 -1.238 1
1 614 . 1 3 2 C 21 21 ASP N N 205 121.515 123.911 -2.396 1
1 615 . 1 3 2 C 22 22 ASP H H 206 8.239 7.986 0.253 1
1 616 . 1 3 2 C 22 22 ASP HA H 206 4.455 4.478 -0.023 1
1 619 . 1 3 2 C 22 22 ASP C C 206 177.449 178.361 -0.912 1
1 620 . 1 3 2 C 22 22 ASP CA C 206 57.165 56.528 0.637 1
1 621 . 1 3 2 C 22 22 ASP CB C 206 41.820 40.944 0.876 1
1 622 . 1 3 2 C 22 22 ASP N N 206 120.156 119.272 0.884 1
1 623 . 1 3 2 C 23 23 MET H H 207 8.300 8.176 0.124 1
1 624 . 1 3 2 C 23 23 MET HA H 207 4.255 4.075 0.180 1
1 632 . 1 3 2 C 23 23 MET C C 207 178.412 177.877 0.535 1
1 633 . 1 3 2 C 23 23 MET CA C 207 58.065 58.587 -0.522 1
1 634 . 1 3 2 C 23 23 MET CB C 207 32.488 32.033 0.455 1
1 637 . 1 3 2 C 23 23 MET N N 207 120.707 119.677 1.030 1
1 638 . 1 3 2 C 24 24 LYS H H 208 8.047 8.112 -0.065 1
1 639 . 1 3 2 C 24 24 LYS HA H 208 3.946 4.096 -0.150 1
1 648 . 1 3 2 C 24 24 LYS C C 208 178.008 178.397 -0.389 1
1 649 . 1 3 2 C 24 24 LYS CA C 208 59.847 58.508 1.339 1
1 650 . 1 3 2 C 24 24 LYS CB C 208 32.983 31.431 1.552 1
1 654 . 1 3 2 C 24 24 LYS N N 208 119.504 117.888 1.616 1
1 655 . 1 3 2 C 25 25 ARG H H 209 7.891 7.708 0.183 1
1 656 . 1 3 2 C 25 25 ARG HA H 209 4.168 4.109 0.059 1
1 663 . 1 3 2 C 25 25 ARG C C 209 178.100 178.846 -0.746 1
1 664 . 1 3 2 C 25 25 ARG CA C 209 58.810 59.095 -0.285 1
1 665 . 1 3 2 C 25 25 ARG CB C 209 31.080 30.430 0.650 1
1 668 . 1 3 2 C 25 25 ARG N N 209 118.378 118.713 -0.335 1
1 669 . 1 3 2 C 26 26 THR H H 210 7.869 8.388 -0.519 1
1 670 . 1 3 2 C 26 26 THR HA H 210 4.023 4.010 0.013 1
1 675 . 1 3 2 C 26 26 THR C C 210 177.984 176.758 1.226 1
1 676 . 1 3 2 C 26 26 THR CA C 210 65.747 66.907 -1.160 1
1 677 . 1 3 2 C 26 26 THR CB C 210 69.683 67.966 1.717 1
1 679 . 1 3 2 C 26 26 THR N N 210 115.443 118.887 -3.444 1
1 680 . 1 3 2 C 27 27 ILE H H 211 7.901 8.098 -0.197 1
1 681 . 1 3 2 C 27 27 ILE HA H 211 4.142 3.671 0.471 1
1 691 . 1 3 2 C 27 27 ILE C C 211 175.595 178.417 -2.822 1
1 692 . 1 3 2 C 27 27 ILE CA C 211 63.528 66.035 -2.507 1
1 693 . 1 3 2 C 27 27 ILE CB C 211 38.982 37.752 1.230 1
1 697 . 1 3 2 C 27 27 ILE N N 211 121.265 121.443 -0.178 1
1 698 . 1 3 2 C 28 28 ASN HA H 212 4.465 4.385 0.080 1
1 703 . 1 3 2 C 28 28 ASN CA C 212 55.182 57.007 -1.825 1
1 704 . 1 3 2 C 28 28 ASN CB C 212 39.480 39.731 -0.251 1
1 706 . 1 3 2 C 29 29 LYS H H 213 7.968 7.970 -0.002 1
1 707 . 1 3 2 C 29 29 LYS HA H 213 4.072 3.962 0.110 1
1 716 . 1 3 2 C 29 29 LYS C C 213 176.218 179.867 -3.649 1
1 717 . 1 3 2 C 29 29 LYS CA C 213 58.489 59.717 -1.228 1
1 718 . 1 3 2 C 29 29 LYS CB C 213 33.165 32.327 0.838 1
1 722 . 1 3 2 C 29 29 LYS N N 213 120.820 118.602 2.218 1
1 723 . 1 3 2 C 30 30 ALA H H 214 7.865 8.043 -0.178 1
1 724 . 1 3 2 C 30 30 ALA HA H 214 4.217 4.165 0.052 1
1 728 . 1 3 2 C 30 30 ALA C C 214 177.041 179.776 -2.735 1
1 729 . 1 3 2 C 30 30 ALA CA C 214 54.104 54.776 -0.672 1
1 730 . 1 3 2 C 30 30 ALA CB C 214 19.496 18.014 1.482 1
1 731 . 1 3 2 C 30 30 ALA N N 214 121.571 121.398 0.173 1
1 732 . 1 3 2 C 31 31 TRP H H 215 7.831 7.849 -0.018 1
1 733 . 1 3 2 C 31 31 TRP HA H 215 4.598 4.519 0.079 1
1 742 . 1 3 2 C 31 31 TRP C C 215 178.088 178.856 -0.768 1
1 743 . 1 3 2 C 31 31 TRP CA C 215 58.432 59.599 -1.167 1
1 744 . 1 3 2 C 31 31 TRP CB C 215 30.472 30.179 0.293 1
1 750 . 1 3 2 C 31 31 TRP N N 215 118.141 117.963 0.178 1
1 752 . 1 3 2 C 32 32 VAL H H 216 7.594 8.989 -1.395 1
1 753 . 1 3 2 C 32 32 VAL HA H 216 3.978 3.694 0.284 1
1 761 . 1 3 2 C 32 32 VAL C C 216 176.574 178.316 -1.742 1
1 762 . 1 3 2 C 32 32 VAL CA C 216 63.329 66.278 -2.949 1
1 763 . 1 3 2 C 32 32 VAL CB C 216 33.373 31.311 2.062 1
1 766 . 1 3 2 C 32 32 VAL N N 216 118.287 119.876 -1.589 1
1 767 . 1 3 2 C 33 33 GLU H H 217 8.012 8.736 -0.724 1
1 768 . 1 3 2 C 33 33 GLU HA H 217 4.257 4.177 0.080 1
1 773 . 1 3 2 C 33 33 GLU C C 217 176.164 177.153 -0.989 1
1 774 . 1 3 2 C 33 33 GLU CA C 217 57.409 58.592 -1.183 1
1 775 . 1 3 2 C 33 33 GLU CB C 217 30.978 28.540 2.438 1
1 777 . 1 3 2 C 33 33 GLU N N 217 122.535 120.119 2.416 1
1 778 . 1 3 2 C 34 34 SER H H 218 8.037 7.565 0.472 1
1 779 . 1 3 2 C 34 34 SER HA H 218 4.514 4.803 -0.289 1
1 782 . 1 3 2 C 34 34 SER C C 218 176.451 174.202 2.249 1
1 783 . 1 3 2 C 34 34 SER CA C 218 58.987 57.844 1.143 1
1 784 . 1 3 2 C 34 34 SER CB C 218 64.569 63.787 0.782 1
1 785 . 1 3 2 C 34 34 SER N N 218 117.058 114.576 2.482 1
1 6 . 2 1 1 A 2 2 ALA H H 2 8.191 8.499 -0.308 1
1 7 . 2 1 1 A 2 2 ALA CA C 2 51.957 51.160 0.797 1
1 8 . 2 1 1 A 2 2 ALA CB C 2 19.580 19.828 -0.248 1
1 9 . 2 1 1 A 2 2 ALA N N 2 124.666 128.657 -3.991 1
1 10 . 2 1 1 A 3 3 SER H H 3 8.829 7.933 0.896 1
1 11 . 2 1 1 A 3 3 SER CA C 3 57.221 63.755 -6.534 1
1 12 . 2 1 1 A 3 3 SER N N 3 119.917 115.866 4.051 1
1 13 . 2 1 1 A 4 4 PRO CA C 4 66.688 65.503 1.185 1
1 14 . 2 1 1 A 4 4 PRO CB C 4 32.553 30.841 1.712 1
1 15 . 2 1 1 A 5 5 LEU H H 5 9.146 7.357 1.789 1
1 16 . 2 1 1 A 5 5 LEU CA C 5 59.017 56.983 2.034 1
1 17 . 2 1 1 A 5 5 LEU CB C 5 42.341 42.553 -0.212 1
1 18 . 2 1 1 A 5 5 LEU N N 5 117.902 117.129 0.773 1
1 19 . 2 1 1 A 6 6 ASP H H 6 7.572 8.495 -0.923 1
1 20 . 2 1 1 A 6 6 ASP CA C 6 57.997 57.667 0.330 1
1 21 . 2 1 1 A 6 6 ASP CB C 6 40.910 41.652 -0.742 1
1 22 . 2 1 1 A 6 6 ASP N N 6 118.259 119.384 -1.125 1
1 23 . 2 1 1 A 7 7 GLN H H 7 8.660 8.376 0.284 1
1 24 . 2 1 1 A 7 7 GLN HA H 7 4.064 4.103 -0.039 1
1 29 . 2 1 1 A 7 7 GLN CA C 7 59.270 58.131 1.139 1
1 30 . 2 1 1 A 7 7 GLN CB C 7 28.468 27.835 0.633 1
1 31 . 2 1 1 A 7 7 GLN N N 7 119.558 116.865 2.693 1
1 32 . 2 1 1 A 8 8 ALA H H 8 8.253 7.870 0.383 1
1 33 . 2 1 1 A 8 8 ALA CA C 8 55.519 54.785 0.734 1
1 34 . 2 1 1 A 8 8 ALA CB C 8 18.113 18.485 -0.372 1
1 35 . 2 1 1 A 8 8 ALA N N 8 123.628 122.011 1.617 1
1 36 . 2 1 1 A 9 9 ILE H H 9 8.134 8.169 -0.035 1
1 37 . 2 1 1 A 9 9 ILE CA C 9 65.261 64.490 0.771 1
1 38 . 2 1 1 A 9 9 ILE CB C 9 37.023 37.232 -0.209 1
1 39 . 2 1 1 A 9 9 ILE N N 9 117.056 117.002 0.054 1
1 40 . 2 1 1 A 10 10 GLY H H 10 8.515 8.531 -0.016 1
1 41 . 2 1 1 A 10 10 GLY HA3 H 10 3.773 3.795 -0.022 1
1 42 . 2 1 1 A 10 10 GLY CA C 10 47.637 46.818 0.819 1
1 43 . 2 1 1 A 10 10 GLY N N 10 106.202 110.882 -4.680 1
1 44 . 2 1 1 A 11 11 LEU H H 11 8.212 8.130 0.082 1
1 45 . 2 1 1 A 11 11 LEU CA C 11 58.354 57.587 0.767 1
1 46 . 2 1 1 A 11 11 LEU CB C 11 41.683 41.734 -0.051 1
1 47 . 2 1 1 A 11 11 LEU N N 11 124.624 123.554 1.070 1
1 48 . 2 1 1 A 12 12 LEU H H 12 7.971 7.891 0.080 1
1 49 . 2 1 1 A 12 12 LEU HA H 12 4.144 4.229 -0.085 1
1 59 . 2 1 1 A 12 12 LEU CA C 12 58.691 58.398 0.293 1
1 60 . 2 1 1 A 12 12 LEU CB C 12 40.657 41.596 -0.939 1
1 61 . 2 1 1 A 12 12 LEU N N 12 118.095 118.597 -0.502 1
1 62 . 2 1 1 A 13 13 ILE H H 13 8.379 8.304 0.075 1
1 63 . 2 1 1 A 13 13 ILE CA C 13 66.405 65.576 0.829 1
1 64 . 2 1 1 A 13 13 ILE CB C 13 38.916 37.898 1.018 1
1 65 . 2 1 1 A 13 13 ILE N N 13 121.161 120.365 0.796 1
1 66 . 2 1 1 A 14 14 GLY H H 14 8.823 8.568 0.255 1
1 67 . 2 1 1 A 14 14 GLY HA2 H 14 4.147 3.733 0.414 1
1 68 . 2 1 1 A 14 14 GLY HA3 H 14 3.982 3.746 0.236 1
1 69 . 2 1 1 A 14 14 GLY CA C 14 47.750 47.499 0.251 1
1 70 . 2 1 1 A 14 14 GLY N N 14 108.982 107.847 1.135 1
1 71 . 2 1 1 A 15 15 ILE H H 15 8.681 8.549 0.132 1
1 72 . 2 1 1 A 15 15 ILE CA C 15 64.996 64.932 0.064 1
1 73 . 2 1 1 A 15 15 ILE CB C 15 37.107 38.068 -0.961 1
1 74 . 2 1 1 A 15 15 ILE N N 15 121.601 122.628 -1.027 1
1 75 . 2 1 1 A 16 16 PHE H H 16 7.103 8.814 -1.711 1
1 76 . 2 1 1 A 16 16 PHE CA C 16 62.910 61.489 1.421 1
1 77 . 2 1 1 A 16 16 PHE CB C 16 38.782 39.380 -0.598 1
1 78 . 2 1 1 A 16 16 PHE N N 16 118.660 120.903 -2.243 1
1 79 . 2 1 1 A 17 17 HIS H H 17 7.591 8.726 -1.135 1
1 80 . 2 1 1 A 17 17 HIS HA H 17 4.793 4.591 0.202 1
1 82 . 2 1 1 A 17 17 HIS CA C 17 58.125 59.139 -1.014 1
1 83 . 2 1 1 A 17 17 HIS CB C 17 29.584 30.124 -0.540 1
1 84 . 2 1 1 A 17 17 HIS N N 17 114.968 118.924 -3.956 1
1 85 . 2 1 1 A 18 18 LYS H H 18 8.144 8.483 -0.339 1
1 86 . 2 1 1 A 18 18 LYS CA C 18 58.975 59.141 -0.166 1
1 87 . 2 1 1 A 18 18 LYS CB C 18 32.379 32.217 0.162 1
1 88 . 2 1 1 A 18 18 LYS N N 18 122.373 119.299 3.074 1
1 89 . 2 1 1 A 19 19 TYR H H 19 6.999 7.497 -0.498 1
1 90 . 2 1 1 A 19 19 TYR CA C 19 60.318 60.516 -0.198 1
1 91 . 2 1 1 A 19 19 TYR CB C 19 40.355 38.503 1.852 1
1 92 . 2 1 1 A 19 19 TYR N N 19 113.614 118.513 -4.899 1
1 93 . 2 1 1 A 20 20 SER H H 20 8.432 8.082 0.350 1
1 94 . 2 1 1 A 20 20 SER CA C 20 61.897 61.086 0.811 1
1 95 . 2 1 1 A 20 20 SER CB C 20 61.354 62.256 -0.902 1
1 96 . 2 1 1 A 20 20 SER N N 20 113.201 115.123 -1.922 1
1 97 . 2 1 1 A 21 21 GLY H H 21 7.678 7.958 -0.280 1
1 98 . 2 1 1 A 21 21 GLY HA2 H 21 4.195 3.741 0.454 1
1 99 . 2 1 1 A 21 21 GLY HA3 H 21 3.900 3.782 0.118 1
1 100 . 2 1 1 A 21 21 GLY CA C 21 45.628 46.504 -0.876 1
1 101 . 2 1 1 A 21 21 GLY N N 21 110.734 110.081 0.653 1
1 102 . 2 1 1 A 22 22 LYS H H 22 7.362 7.741 -0.379 1
1 103 . 2 1 1 A 22 22 LYS CA C 22 60.163 58.841 1.322 1
1 104 . 2 1 1 A 22 22 LYS CB C 22 32.554 32.070 0.484 1
1 105 . 2 1 1 A 22 22 LYS N N 22 122.161 121.241 0.920 1
1 106 . 2 1 1 A 23 23 GLU H H 23 9.639 8.340 1.299 1
1 107 . 2 1 1 A 23 23 GLU CA C 23 54.449 56.700 -2.251 1
1 108 . 2 1 1 A 23 23 GLU N N 23 116.288 116.413 -0.125 1
1 109 . 2 1 1 A 24 24 GLY HA2 H 24 3.912 4.034 -0.122 1
1 110 . 2 1 1 A 24 24 GLY HA3 H 24 3.787 4.040 -0.253 1
1 111 . 2 1 1 A 24 24 GLY CA C 24 45.898 45.559 0.339 1
1 112 . 2 1 1 A 25 25 ASP H H 25 8.204 8.912 -0.708 1
1 113 . 2 1 1 A 25 25 ASP CA C 25 55.252 55.295 -0.043 1
1 114 . 2 1 1 A 25 25 ASP N N 25 125.671 118.475 7.196 1
1 115 . 2 1 1 A 26 26 LYS CA C 26 57.851 56.468 1.383 1
1 116 . 2 1 1 A 26 26 LYS CB C 26 31.265 32.713 -1.448 1
1 117 . 2 1 1 A 27 27 HIS H H 27 9.763 8.785 0.978 1
1 118 . 2 1 1 A 27 27 HIS CA C 27 55.580 54.319 1.261 1
1 119 . 2 1 1 A 27 27 HIS CB C 27 30.936 28.189 2.747 1
1 120 . 2 1 1 A 27 27 HIS N N 27 118.108 123.557 -5.449 1
1 121 . 2 1 1 A 28 28 THR H H 28 7.325 7.960 -0.635 1
1 126 . 2 1 1 A 28 28 THR CA C 28 60.128 60.351 -0.223 1
1 127 . 2 1 1 A 28 28 THR CB C 28 72.268 72.266 0.002 1
1 128 . 2 1 1 A 28 28 THR N N 28 106.920 111.040 -4.120 1
1 129 . 2 1 1 A 29 29 LEU H H 29 9.422 9.416 0.006 1
1 130 . 2 1 1 A 29 29 LEU HA H 29 5.368 5.067 0.301 1
1 140 . 2 1 1 A 29 29 LEU CA C 29 52.567 53.391 -0.824 1
1 141 . 2 1 1 A 29 29 LEU CB C 29 43.523 44.501 -0.978 1
1 142 . 2 1 1 A 29 29 LEU N N 29 125.021 125.812 -0.791 1
1 143 . 2 1 1 A 30 30 SER H H 30 10.485 8.650 1.835 1
1 144 . 2 1 1 A 30 30 SER CA C 30 56.653 57.840 -1.187 1
1 145 . 2 1 1 A 30 30 SER CB C 30 65.313 63.973 1.340 1
1 146 . 2 1 1 A 30 30 SER N N 30 124.758 117.963 6.795 1
1 147 . 2 1 1 A 31 31 LYS H H 31 8.728 8.738 -0.010 1
1 148 . 2 1 1 A 31 31 LYS CA C 31 59.669 58.790 0.879 1
1 149 . 2 1 1 A 31 31 LYS CB C 31 31.763 32.001 -0.238 1
1 150 . 2 1 1 A 31 31 LYS N N 31 119.459 124.471 -5.012 1
1 151 . 2 1 1 A 32 32 LYS H H 32 7.857 8.201 -0.344 1
1 152 . 2 1 1 A 32 32 LYS CA C 32 59.721 59.032 0.689 1
1 153 . 2 1 1 A 32 32 LYS CB C 32 32.901 31.905 0.996 1
1 154 . 2 1 1 A 32 32 LYS N N 32 117.933 120.001 -2.068 1
1 155 . 2 1 1 A 33 33 GLU H H 33 7.559 7.973 -0.414 1
1 156 . 2 1 1 A 33 33 GLU CA C 33 59.169 59.445 -0.276 1
1 157 . 2 1 1 A 33 33 GLU CB C 33 31.014 28.712 2.302 1
1 158 . 2 1 1 A 33 33 GLU N N 33 120.407 119.591 0.816 1
1 159 . 2 1 1 A 34 34 LEU H H 34 8.833 8.133 0.700 1
1 160 . 2 1 1 A 34 34 LEU CA C 34 56.928 57.909 -0.981 1
1 161 . 2 1 1 A 34 34 LEU CB C 34 41.435 41.772 -0.337 1
1 162 . 2 1 1 A 34 34 LEU N N 34 117.677 121.464 -3.787 1
1 163 . 2 1 1 A 35 35 LYS H H 35 8.010 7.841 0.169 1
1 164 . 2 1 1 A 35 35 LYS CA C 35 60.692 60.318 0.374 1
1 165 . 2 1 1 A 35 35 LYS CB C 35 32.223 31.968 0.255 1
1 166 . 2 1 1 A 35 35 LYS N N 35 119.829 118.931 0.898 1
1 167 . 2 1 1 A 36 36 GLU H H 36 7.169 7.538 -0.369 1
1 168 . 2 1 1 A 36 36 GLU CA C 36 59.588 59.050 0.538 1
1 169 . 2 1 1 A 36 36 GLU CB C 36 29.342 29.664 -0.322 1
1 170 . 2 1 1 A 36 36 GLU N N 36 117.340 119.968 -2.628 1
1 171 . 2 1 1 A 37 37 LEU H H 37 7.478 7.896 -0.418 1
1 172 . 2 1 1 A 37 37 LEU CA C 37 59.674 57.798 1.876 1
1 173 . 2 1 1 A 37 37 LEU CB C 37 42.142 40.899 1.243 1
1 174 . 2 1 1 A 37 37 LEU N N 37 120.884 120.338 0.546 1
1 175 . 2 1 1 A 38 38 ILE H H 38 8.377 7.937 0.440 1
1 176 . 2 1 1 A 38 38 ILE CA C 38 65.651 64.857 0.794 1
1 177 . 2 1 1 A 38 38 ILE N N 38 118.450 119.740 -1.290 1
1 178 . 2 1 1 A 39 39 GLN H H 39 8.217 8.278 -0.061 1
1 179 . 2 1 1 A 39 39 GLN CA C 39 59.788 58.577 1.211 1
1 180 . 2 1 1 A 39 39 GLN CB C 39 29.278 28.138 1.140 1
1 181 . 2 1 1 A 39 39 GLN N N 39 113.091 118.959 -5.868 1
1 182 . 2 1 1 A 40 40 LYS H H 40 8.426 7.779 0.647 1
1 183 . 2 1 1 A 40 40 LYS CA C 40 57.807 59.010 -1.203 1
1 184 . 2 1 1 A 40 40 LYS CB C 40 33.942 33.050 0.892 1
1 185 . 2 1 1 A 40 40 LYS N N 40 114.771 120.069 -5.298 1
1 186 . 2 1 1 A 41 41 GLU H H 41 8.496 8.453 0.043 1
1 187 . 2 1 1 A 41 41 GLU CA C 41 55.395 58.589 -3.194 1
1 188 . 2 1 1 A 41 41 GLU CB C 41 29.260 30.597 -1.337 1
1 189 . 2 1 1 A 41 41 GLU N N 41 112.546 117.787 -5.241 1
1 190 . 2 1 1 A 42 42 LEU H H 42 7.267 7.742 -0.475 1
1 191 . 2 1 1 A 42 42 LEU CA C 42 53.776 53.972 -0.196 1
1 192 . 2 1 1 A 42 42 LEU N N 42 118.657 119.894 -1.237 1
1 193 . 2 1 1 A 44 44 ILE CA C 44 62.210 60.122 2.088 1
1 194 . 2 1 1 A 44 44 ILE CB C 44 38.247 38.032 0.215 1
1 195 . 2 1 1 A 45 45 GLY H H 45 7.820 8.755 -0.935 1
1 196 . 2 1 1 A 45 45 GLY CA C 45 47.742 46.435 1.307 1
1 197 . 2 1 1 A 45 45 GLY N N 45 108.178 116.613 -8.435 1
1 198 . 2 1 1 A 46 46 SER H H 46 7.895 7.968 -0.073 1
1 199 . 2 1 1 A 46 46 SER CA C 46 59.958 60.382 -0.424 1
1 200 . 2 1 1 A 46 46 SER CB C 46 63.450 63.367 0.083 1
1 201 . 2 1 1 A 46 46 SER N N 46 113.038 113.466 -0.428 1
1 202 . 2 1 1 A 47 47 LYS H H 47 7.736 7.585 0.151 1
1 203 . 2 1 1 A 47 47 LYS CA C 47 55.636 54.897 0.739 1
1 204 . 2 1 1 A 47 47 LYS CB C 47 33.103 33.956 -0.853 1
1 205 . 2 1 1 A 47 47 LYS N N 47 119.422 117.895 1.527 1
1 206 . 2 1 1 A 48 48 LEU H H 48 6.988 8.557 -1.569 1
1 207 . 2 1 1 A 48 48 LEU HA H 48 4.497 4.220 0.277 1
1 217 . 2 1 1 A 48 48 LEU CA C 48 54.517 56.368 -1.851 1
1 218 . 2 1 1 A 48 48 LEU CB C 48 42.987 42.199 0.788 1
1 219 . 2 1 1 A 48 48 LEU N N 48 118.908 122.219 -3.311 1
1 220 . 2 1 1 A 49 49 GLN H H 49 9.206 8.894 0.312 1
1 221 . 2 1 1 A 49 49 GLN HA H 49 4.486 4.072 0.414 1
1 223 . 2 1 1 A 49 49 GLN CA C 49 54.785 58.590 -3.805 1
1 224 . 2 1 1 A 49 49 GLN CB C 49 29.636 29.005 0.631 1
1 225 . 2 1 1 A 49 49 GLN N N 49 121.275 127.000 -5.725 1
1 226 . 2 1 1 A 50 50 ASP H H 50 8.854 8.411 0.443 1
1 227 . 2 1 1 A 50 50 ASP CA C 50 59.078 58.009 1.069 1
1 228 . 2 1 1 A 50 50 ASP CB C 50 40.632 42.039 -1.407 1
1 229 . 2 1 1 A 50 50 ASP N N 50 123.430 120.156 3.274 1
1 230 . 2 1 1 A 51 51 ALA H H 51 8.720 8.100 0.620 1
1 231 . 2 1 1 A 51 51 ALA CA C 51 55.281 54.834 0.447 1
1 232 . 2 1 1 A 51 51 ALA CB C 51 18.205 18.141 0.064 1
1 233 . 2 1 1 A 51 51 ALA N N 51 117.829 121.139 -3.310 1
1 234 . 2 1 1 A 52 52 GLU H H 52 7.161 7.776 -0.615 1
1 235 . 2 1 1 A 52 52 GLU CA C 52 58.757 59.176 -0.419 1
1 236 . 2 1 1 A 52 52 GLU CB C 52 30.247 29.931 0.316 1
1 237 . 2 1 1 A 52 52 GLU N N 52 115.459 117.665 -2.206 1
1 238 . 2 1 1 A 53 53 ILE H H 53 7.962 7.761 0.201 1
1 239 . 2 1 1 A 53 53 ILE CA C 53 65.525 64.394 1.131 1
1 240 . 2 1 1 A 53 53 ILE CB C 53 37.289 36.284 1.005 1
1 241 . 2 1 1 A 53 53 ILE N N 53 120.414 121.207 -0.793 1
1 242 . 2 1 1 A 54 54 VAL H H 54 8.132 8.169 -0.037 1
1 243 . 2 1 1 A 54 54 VAL CA C 54 67.290 65.668 1.622 1
1 244 . 2 1 1 A 54 54 VAL CB C 54 31.434 31.396 0.038 1
1 245 . 2 1 1 A 54 54 VAL N N 54 119.775 118.382 1.393 1
1 246 . 2 1 1 A 55 55 LYS H H 55 7.155 7.944 -0.789 1
1 247 . 2 1 1 A 55 55 LYS CA C 55 59.131 59.242 -0.111 1
1 248 . 2 1 1 A 55 55 LYS CB C 55 32.131 32.075 0.056 1
1 249 . 2 1 1 A 55 55 LYS N N 55 119.175 121.490 -2.315 1
1 250 . 2 1 1 A 56 56 LEU H H 56 7.837 8.171 -0.334 1
1 251 . 2 1 1 A 56 56 LEU CA C 56 58.052 57.851 0.201 1
1 252 . 2 1 1 A 56 56 LEU CB C 56 41.878 41.731 0.147 1
1 253 . 2 1 1 A 56 56 LEU N N 56 119.679 121.153 -1.474 1
1 254 . 2 1 1 A 57 57 MET H H 57 8.385 8.774 -0.389 1
1 255 . 2 1 1 A 57 57 MET CA C 57 60.756 58.720 2.036 1
1 256 . 2 1 1 A 57 57 MET CB C 57 33.152 31.888 1.264 1
1 257 . 2 1 1 A 57 57 MET N N 57 115.116 119.640 -4.524 1
1 258 . 2 1 1 A 58 58 ASP H H 58 7.591 8.112 -0.521 1
1 259 . 2 1 1 A 58 58 ASP CA C 58 57.365 57.609 -0.244 1
1 260 . 2 1 1 A 58 58 ASP CB C 58 40.858 41.377 -0.519 1
1 261 . 2 1 1 A 58 58 ASP N N 58 118.197 119.771 -1.574 1
1 262 . 2 1 1 A 59 59 ASP H H 59 7.725 7.939 -0.214 1
1 263 . 2 1 1 A 59 59 ASP CA C 59 56.830 56.793 0.037 1
1 264 . 2 1 1 A 59 59 ASP CB C 59 40.567 40.447 0.120 1
1 265 . 2 1 1 A 59 59 ASP N N 59 118.481 117.737 0.744 1
1 266 . 2 1 1 A 60 60 LEU H H 60 7.703 7.558 0.145 1
1 267 . 2 1 1 A 60 60 LEU CA C 60 56.564 57.260 -0.696 1
1 268 . 2 1 1 A 60 60 LEU CB C 60 42.714 41.468 1.246 1
1 269 . 2 1 1 A 60 60 LEU N N 60 116.935 119.983 -3.048 1
1 270 . 2 1 1 A 61 61 ASP H H 61 7.143 8.466 -1.323 1
1 271 . 2 1 1 A 61 61 ASP HA H 61 4.690 4.383 0.307 1
1 274 . 2 1 1 A 61 61 ASP CA C 61 52.286 56.438 -4.152 1
1 275 . 2 1 1 A 61 61 ASP CB C 61 39.245 40.718 -1.473 1
1 276 . 2 1 1 A 61 61 ASP N N 61 116.605 119.318 -2.713 1
1 277 . 2 1 1 A 62 62 ARG H H 62 7.786 8.668 -0.882 1
1 278 . 2 1 1 A 62 62 ARG CA C 62 58.328 57.877 0.451 1
1 279 . 2 1 1 A 62 62 ARG CB C 62 30.106 28.883 1.223 1
1 280 . 2 1 1 A 62 62 ARG N N 62 125.967 117.663 8.304 1
1 281 . 2 1 1 A 63 63 ASN H H 63 7.945 7.921 0.024 1
1 282 . 2 1 1 A 63 63 ASN CA C 63 51.863 55.080 -3.217 1
1 283 . 2 1 1 A 63 63 ASN CB C 63 36.809 38.515 -1.706 1
1 284 . 2 1 1 A 63 63 ASN N N 63 112.434 118.247 -5.813 1
1 285 . 2 1 1 A 64 64 LYS H H 64 7.477 7.788 -0.311 1
1 286 . 2 1 1 A 64 64 LYS CA C 64 56.524 55.198 1.326 1
1 287 . 2 1 1 A 64 64 LYS N N 64 114.197 115.918 -1.721 1
1 288 . 2 1 1 A 65 65 ASP H H 65 8.345 8.749 -0.404 1
1 289 . 2 1 1 A 65 65 ASP CA C 65 52.969 55.656 -2.687 1
1 290 . 2 1 1 A 65 65 ASP CB C 65 40.329 43.856 -3.527 1
1 291 . 2 1 1 A 65 65 ASP N N 65 118.581 122.183 -3.602 1
1 292 . 2 1 1 A 66 66 GLN H H 66 9.945 8.279 1.666 1
1 293 . 2 1 1 A 66 66 GLN CA C 66 58.132 55.493 2.639 1
1 294 . 2 1 1 A 66 66 GLN CB C 66 26.035 31.060 -5.025 1
1 295 . 2 1 1 A 66 66 GLN N N 66 113.203 115.691 -2.488 1
1 296 . 2 1 1 A 67 67 GLU H H 67 7.880 8.032 -0.152 1
1 297 . 2 1 1 A 67 67 GLU HA H 67 4.910 5.150 -0.240 1
1 302 . 2 1 1 A 67 67 GLU CA C 67 54.082 54.829 -0.747 1
1 303 . 2 1 1 A 67 67 GLU CB C 67 33.174 33.117 0.057 1
1 304 . 2 1 1 A 67 67 GLU N N 67 118.554 116.843 1.711 1
1 305 . 2 1 1 A 68 68 VAL H H 68 9.669 9.162 0.507 1
1 306 . 2 1 1 A 68 68 VAL HA H 68 5.465 4.660 0.805 1
1 314 . 2 1 1 A 68 68 VAL CA C 68 61.079 61.365 -0.286 1
1 315 . 2 1 1 A 68 68 VAL CB C 68 33.280 34.316 -1.036 1
1 316 . 2 1 1 A 68 68 VAL N N 68 126.572 121.998 4.574 1
1 317 . 2 1 1 A 69 69 ASN H H 69 8.985 8.780 0.205 1
1 318 . 2 1 1 A 69 69 ASN CA C 69 50.812 53.583 -2.771 1
1 319 . 2 1 1 A 69 69 ASN CB C 69 38.609 40.640 -2.031 1
1 320 . 2 1 1 A 69 69 ASN N N 69 127.472 126.260 1.212 1
1 321 . 2 1 1 A 70 70 PHE H H 70 9.100 8.863 0.237 1
1 322 . 2 1 1 A 70 70 PHE CA C 70 63.279 62.035 1.244 1
1 323 . 2 1 1 A 70 70 PHE CB C 70 38.741 39.069 -0.328 1
1 324 . 2 1 1 A 70 70 PHE N N 70 119.972 127.653 -7.681 1
1 325 . 2 1 1 A 71 71 GLN H H 71 8.342 8.115 0.227 1
1 326 . 2 1 1 A 71 71 GLN HA H 71 3.923 3.557 0.366 1
1 329 . 2 1 1 A 71 71 GLN CA C 71 59.866 58.404 1.462 1
1 330 . 2 1 1 A 71 71 GLN CB C 71 27.878 28.485 -0.607 1
1 331 . 2 1 1 A 71 71 GLN N N 71 118.216 117.387 0.829 1
1 332 . 2 1 1 A 72 72 GLU H H 72 8.721 8.190 0.531 1
1 333 . 2 1 1 A 72 72 GLU HA H 72 4.147 4.056 0.091 1
1 338 . 2 1 1 A 72 72 GLU CA C 72 59.313 58.663 0.650 1
1 339 . 2 1 1 A 72 72 GLU CB C 72 30.233 29.724 0.509 1
1 340 . 2 1 1 A 72 72 GLU N N 72 121.455 119.995 1.460 1
1 341 . 2 1 1 A 73 73 TYR H H 73 8.536 8.074 0.462 1
1 342 . 2 1 1 A 73 73 TYR CA C 73 60.961 61.313 -0.352 1
1 343 . 2 1 1 A 73 73 TYR CB C 73 38.724 38.738 -0.014 1
1 344 . 2 1 1 A 73 73 TYR N N 73 123.356 121.905 1.451 1
1 345 . 2 1 1 A 74 74 ILE H H 74 8.642 7.615 1.027 1
1 346 . 2 1 1 A 74 74 ILE CA C 74 61.880 63.854 -1.974 1
1 347 . 2 1 1 A 74 74 ILE CB C 74 36.077 36.880 -0.803 1
1 348 . 2 1 1 A 74 74 ILE N N 74 119.799 119.990 -0.191 1
1 349 . 2 1 1 A 75 75 THR H H 75 7.959 8.268 -0.309 1
1 354 . 2 1 1 A 75 75 THR CA C 75 67.056 66.732 0.324 1
1 355 . 2 1 1 A 75 75 THR CB C 75 68.386 68.601 -0.215 1
1 356 . 2 1 1 A 75 75 THR N N 75 119.486 117.638 1.848 1
1 357 . 2 1 1 A 76 76 PHE H H 76 7.450 8.183 -0.733 1
1 358 . 2 1 1 A 76 76 PHE CA C 76 59.010 61.728 -2.718 1
1 359 . 2 1 1 A 76 76 PHE CB C 76 38.139 39.273 -1.134 1
1 360 . 2 1 1 A 76 76 PHE N N 76 122.873 121.834 1.039 1
1 361 . 2 1 1 A 77 77 LEU H H 77 7.829 8.325 -0.496 1
1 362 . 2 1 1 A 77 77 LEU CA C 77 57.450 57.582 -0.132 1
1 363 . 2 1 1 A 77 77 LEU CB C 77 40.560 40.803 -0.243 1
1 364 . 2 1 1 A 77 77 LEU N N 77 117.405 118.521 -1.116 1
1 365 . 2 1 1 A 78 78 GLY H H 78 8.093 8.049 0.044 1
1 366 . 2 1 1 A 78 78 GLY HA2 H 78 3.661 3.754 -0.093 1
1 367 . 2 1 1 A 78 78 GLY HA3 H 78 3.594 3.761 -0.167 1
1 368 . 2 1 1 A 78 78 GLY CA C 78 47.442 47.177 0.265 1
1 369 . 2 1 1 A 78 78 GLY N N 78 105.528 105.935 -0.407 1
1 370 . 2 1 1 A 79 79 ALA H H 79 7.759 7.330 0.429 1
1 371 . 2 1 1 A 79 79 ALA CA C 79 55.153 54.458 0.695 1
1 372 . 2 1 1 A 79 79 ALA CB C 79 17.768 18.058 -0.290 1
1 373 . 2 1 1 A 79 79 ALA N N 79 124.488 124.927 -0.439 1
1 374 . 2 1 1 A 80 80 LEU H H 80 7.963 8.016 -0.053 1
1 375 . 2 1 1 A 80 80 LEU CA C 80 57.464 57.172 0.292 1
1 376 . 2 1 1 A 80 80 LEU CB C 80 41.496 41.299 0.197 1
1 377 . 2 1 1 A 80 80 LEU N N 80 117.869 120.489 -2.620 1
1 378 . 2 1 1 A 81 81 ALA H H 81 8.365 7.840 0.525 1
1 379 . 2 1 1 A 81 81 ALA CA C 81 55.475 55.303 0.172 1
1 380 . 2 1 1 A 81 81 ALA CB C 81 17.483 18.573 -1.090 1
1 381 . 2 1 1 A 81 81 ALA N N 81 119.054 121.716 -2.662 1
1 382 . 2 1 1 A 82 82 MET H H 82 8.112 8.102 0.010 1
1 383 . 2 1 1 A 82 82 MET CA C 82 59.516 58.188 1.328 1
1 384 . 2 1 1 A 82 82 MET CB C 82 32.550 32.528 0.022 1
1 385 . 2 1 1 A 82 82 MET N N 82 115.364 118.004 -2.640 1
1 386 . 2 1 1 A 83 83 ILE H H 83 7.981 8.268 -0.287 1
1 387 . 2 1 1 A 83 83 ILE HA H 83 3.839 3.701 0.138 1
1 391 . 2 1 1 A 83 83 ILE CA C 83 64.467 64.002 0.465 1
1 392 . 2 1 1 A 83 83 ILE CB C 83 37.312 37.679 -0.367 1
1 393 . 2 1 1 A 83 83 ILE N N 83 120.887 120.467 0.420 1
1 394 . 2 1 1 A 84 84 TYR H H 84 8.731 7.734 0.997 1
1 395 . 2 1 1 A 84 84 TYR N N 84 120.933 121.586 -0.653 1
1 396 . 2 1 1 A 87 87 ALA H H 87 7.829 7.992 -0.163 1
1 397 . 2 1 1 A 87 87 ALA CA C 87 53.768 54.276 -0.508 1
1 398 . 2 1 1 A 87 87 ALA CB C 87 18.504 18.254 0.250 1
1 399 . 2 1 1 A 87 87 ALA N N 87 120.274 121.630 -1.356 1
1 400 . 2 1 1 A 88 88 LEU H H 88 7.499 7.375 0.124 1
1 401 . 2 1 1 A 88 88 LEU CA C 88 55.605 54.775 0.830 1
1 402 . 2 1 1 A 88 88 LEU CB C 88 42.047 41.564 0.483 1
1 403 . 2 1 1 A 88 88 LEU N N 88 117.356 115.668 1.688 1
1 404 . 2 1 1 A 89 89 LYS H H 89 7.561 7.671 -0.110 1
1 405 . 2 1 1 A 89 89 LYS CA C 89 56.865 56.184 0.681 1
1 406 . 2 1 1 A 89 89 LYS CB C 89 32.592 33.744 -1.152 1
1 407 . 2 1 1 A 89 89 LYS N N 89 119.289 117.803 1.486 1
1 416 . 2 3 2 C 6 6 GLU H H 190 8.385 8.672 -0.287 1
1 417 . 2 3 2 C 6 6 GLU HA H 190 4.153 4.894 -0.741 1
1 422 . 2 3 2 C 6 6 GLU C C 190 175.031 175.969 -0.938 1
1 423 . 2 3 2 C 6 6 GLU CA C 190 58.866 54.867 3.999 1
1 424 . 2 3 2 C 6 6 GLU CB C 190 30.751 33.103 -2.352 1
1 426 . 2 3 2 C 6 6 GLU N N 190 122.715 124.311 -1.596 1
1 427 . 2 3 2 C 7 7 GLY H H 191 8.475 8.524 -0.049 1
1 428 . 2 3 2 C 7 7 GLY HA2 H 191 3.887 4.067 -0.180 1
1 429 . 2 3 2 C 7 7 GLY HA3 H 191 3.887 4.068 -0.181 1
1 430 . 2 3 2 C 7 7 GLY C C 191 177.922 174.383 3.539 1
1 431 . 2 3 2 C 7 7 GLY CA C 191 46.884 44.636 2.248 1
1 432 . 2 3 2 C 7 7 GLY N N 191 109.009 109.866 -0.857 1
1 433 . 2 3 2 C 8 8 LEU HA H 192 4.095 4.107 -0.012 1
1 443 . 2 3 2 C 8 8 LEU CA C 192 58.154 57.914 0.240 1
1 444 . 2 3 2 C 8 8 LEU CB C 192 42.789 41.614 1.175 1
1 448 . 2 3 2 C 9 9 MET H H 193 8.250 8.086 0.164 1
1 449 . 2 3 2 C 9 9 MET HA H 193 4.150 4.049 0.101 1
1 457 . 2 3 2 C 9 9 MET C C 193 178.421 178.099 0.322 1
1 458 . 2 3 2 C 9 9 MET CA C 193 58.818 58.812 0.006 1
1 459 . 2 3 2 C 9 9 MET CB C 193 32.360 32.179 0.181 1
1 462 . 2 3 2 C 9 9 MET N N 193 117.049 118.893 -1.844 1
1 463 . 2 3 2 C 10 10 ASN H H 194 7.892 8.013 -0.121 1
1 464 . 2 3 2 C 10 10 ASN HA H 194 4.468 4.558 -0.090 1
1 469 . 2 3 2 C 10 10 ASN C C 194 178.099 176.582 1.517 1
1 470 . 2 3 2 C 10 10 ASN CA C 194 56.644 55.245 1.399 1
1 471 . 2 3 2 C 10 10 ASN CB C 194 39.100 38.392 0.708 1
1 472 . 2 3 2 C 10 10 ASN N N 194 117.034 118.476 -1.442 1
1 474 . 2 3 2 C 11 11 VAL H H 195 7.651 8.065 -0.414 1
1 475 . 2 3 2 C 11 11 VAL HA H 195 3.735 3.867 -0.132 1
1 483 . 2 3 2 C 11 11 VAL C C 195 177.657 178.111 -0.454 1
1 484 . 2 3 2 C 11 11 VAL CA C 195 66.710 65.047 1.663 1
1 485 . 2 3 2 C 11 11 VAL CB C 195 32.468 32.113 0.355 1
1 488 . 2 3 2 C 11 11 VAL N N 195 119.878 117.280 2.598 1
1 489 . 2 3 2 C 12 12 LEU H H 196 8.030 7.990 0.040 1
1 490 . 2 3 2 C 12 12 LEU HA H 196 4.013 3.929 0.084 1
1 500 . 2 3 2 C 12 12 LEU C C 196 177.540 179.395 -1.855 1
1 501 . 2 3 2 C 12 12 LEU CA C 196 58.489 58.144 0.345 1
1 502 . 2 3 2 C 12 12 LEU CB C 196 42.457 41.178 1.279 1
1 506 . 2 3 2 C 12 12 LEU N N 196 119.499 120.516 -1.017 1
1 507 . 2 3 2 C 13 13 LYS H H 197 8.015 8.377 -0.362 1
1 508 . 2 3 2 C 13 13 LYS HA H 197 3.949 4.043 -0.094 1
1 517 . 2 3 2 C 13 13 LYS C C 197 178.419 179.032 -0.613 1
1 518 . 2 3 2 C 13 13 LYS CA C 197 60.191 59.844 0.347 1
1 519 . 2 3 2 C 13 13 LYS CB C 197 33.075 32.292 0.783 1
1 523 . 2 3 2 C 13 13 LYS N N 197 117.888 120.604 -2.716 1
1 524 . 2 3 2 C 14 14 LYS H H 198 7.506 7.784 -0.278 1
1 525 . 2 3 2 C 14 14 LYS HA H 198 4.127 4.101 0.026 1
1 534 . 2 3 2 C 14 14 LYS C C 198 178.262 178.433 -0.171 1
1 535 . 2 3 2 C 14 14 LYS CA C 198 59.161 58.461 0.700 1
1 536 . 2 3 2 C 14 14 LYS CB C 198 32.956 31.904 1.052 1
1 540 . 2 3 2 C 14 14 LYS N N 198 118.321 117.938 0.383 1
1 541 . 2 3 2 C 15 15 ILE H H 199 7.780 7.354 0.426 1
1 542 . 2 3 2 C 15 15 ILE HA H 199 3.787 3.938 -0.151 1
1 552 . 2 3 2 C 15 15 ILE C C 199 178.647 177.701 0.946 1
1 553 . 2 3 2 C 15 15 ILE CA C 199 64.912 63.130 1.782 1
1 554 . 2 3 2 C 15 15 ILE CB C 199 38.780 38.003 0.777 1
1 558 . 2 3 2 C 15 15 ILE N N 199 118.644 118.129 0.515 1
1 559 . 2 3 2 C 16 16 TYR H H 200 7.918 8.637 -0.719 1
1 560 . 2 3 2 C 16 16 TYR HA H 200 4.252 3.962 0.290 1
1 567 . 2 3 2 C 16 16 TYR C C 200 177.806 177.184 0.622 1
1 568 . 2 3 2 C 16 16 TYR CA C 200 61.171 62.130 -0.959 1
1 569 . 2 3 2 C 16 16 TYR CB C 200 39.245 38.884 0.361 1
1 573 . 2 3 2 C 16 16 TYR N N 200 118.683 122.206 -3.523 1
1 574 . 2 3 2 C 17 17 GLU H H 201 8.089 8.183 -0.094 1
1 575 . 2 3 2 C 17 17 GLU HA H 201 4.124 3.945 0.179 1
1 580 . 2 3 2 C 17 17 GLU C C 201 177.414 176.821 0.593 1
1 581 . 2 3 2 C 17 17 GLU CA C 201 58.784 57.641 1.143 1
1 582 . 2 3 2 C 17 17 GLU CB C 201 30.747 29.254 1.493 1
1 584 . 2 3 2 C 17 17 GLU N N 201 119.409 118.794 0.615 1
1 585 . 2 3 2 C 18 18 ASP H H 202 8.023 8.050 -0.027 1
1 586 . 2 3 2 C 18 18 ASP HA H 202 4.657 4.831 -0.174 1
1 589 . 2 3 2 C 18 18 ASP C C 202 177.346 176.451 0.895 1
1 590 . 2 3 2 C 18 18 ASP CA C 202 55.496 54.689 0.807 1
1 591 . 2 3 2 C 18 18 ASP CB C 202 42.023 42.911 -0.888 1
1 592 . 2 3 2 C 18 18 ASP N N 202 119.459 119.303 0.156 1
1 593 . 2 3 2 C 19 19 GLY H H 203 7.933 7.825 0.108 1
1 594 . 2 3 2 C 19 19 GLY HA2 H 203 3.938 3.991 -0.053 1
1 595 . 2 3 2 C 19 19 GLY HA3 H 203 3.938 4.005 -0.067 1
1 596 . 2 3 2 C 19 19 GLY C C 203 177.240 173.183 4.057 1
1 597 . 2 3 2 C 19 19 GLY CA C 203 46.309 44.343 1.966 1
1 598 . 2 3 2 C 19 19 GLY N N 203 108.518 108.186 0.332 1
1 599 . 2 3 2 C 20 20 ASP H H 204 8.091 8.577 -0.486 1
1 600 . 2 3 2 C 20 20 ASP HA H 204 4.616 4.510 0.106 1
1 603 . 2 3 2 C 20 20 ASP C C 204 173.979 175.798 -1.819 1
1 604 . 2 3 2 C 20 20 ASP CA C 204 55.064 55.027 0.037 1
1 605 . 2 3 2 C 20 20 ASP CB C 204 42.203 41.763 0.440 1
1 606 . 2 3 2 C 20 20 ASP N N 204 120.172 121.445 -1.273 1
1 607 . 2 3 2 C 21 21 ASP H H 205 8.352 8.770 -0.418 1
1 608 . 2 3 2 C 21 21 ASP HA H 205 4.468 4.936 -0.468 1
1 611 . 2 3 2 C 21 21 ASP C C 205 176.432 176.769 -0.337 1
1 612 . 2 3 2 C 21 21 ASP CA C 205 56.663 53.180 3.483 1
1 613 . 2 3 2 C 21 21 ASP CB C 205 41.918 42.764 -0.846 1
1 614 . 2 3 2 C 21 21 ASP N N 205 121.515 121.905 -0.390 1
1 615 . 2 3 2 C 22 22 ASP H H 206 8.239 8.148 0.091 1
1 616 . 2 3 2 C 22 22 ASP HA H 206 4.455 4.462 -0.007 1
1 619 . 2 3 2 C 22 22 ASP C C 206 177.449 178.140 -0.691 1
1 620 . 2 3 2 C 22 22 ASP CA C 206 57.165 56.474 0.691 1
1 621 . 2 3 2 C 22 22 ASP CB C 206 41.820 40.243 1.577 1
1 622 . 2 3 2 C 22 22 ASP N N 206 120.156 120.300 -0.144 1
1 623 . 2 3 2 C 23 23 MET H H 207 8.300 8.162 0.138 1
1 624 . 2 3 2 C 23 23 MET HA H 207 4.255 3.968 0.287 1
1 632 . 2 3 2 C 23 23 MET C C 207 178.412 177.918 0.494 1
1 633 . 2 3 2 C 23 23 MET CA C 207 58.065 58.879 -0.814 1
1 634 . 2 3 2 C 23 23 MET CB C 207 32.488 32.262 0.226 1
1 637 . 2 3 2 C 23 23 MET N N 207 120.707 119.087 1.620 1
1 638 . 2 3 2 C 24 24 LYS H H 208 8.047 7.789 0.258 1
1 639 . 2 3 2 C 24 24 LYS HA H 208 3.946 3.969 -0.023 1
1 648 . 2 3 2 C 24 24 LYS C C 208 178.008 178.344 -0.336 1
1 649 . 2 3 2 C 24 24 LYS CA C 208 59.847 59.191 0.656 1
1 650 . 2 3 2 C 24 24 LYS CB C 208 32.983 31.761 1.222 1
1 654 . 2 3 2 C 24 24 LYS N N 208 119.504 118.145 1.359 1
1 655 . 2 3 2 C 25 25 ARG H H 209 7.891 7.770 0.121 1
1 656 . 2 3 2 C 25 25 ARG HA H 209 4.168 4.082 0.086 1
1 663 . 2 3 2 C 25 25 ARG C C 209 178.100 178.908 -0.808 1
1 664 . 2 3 2 C 25 25 ARG CA C 209 58.810 59.011 -0.201 1
1 665 . 2 3 2 C 25 25 ARG CB C 209 31.080 29.918 1.162 1
1 668 . 2 3 2 C 25 25 ARG N N 209 118.378 119.030 -0.652 1
1 669 . 2 3 2 C 26 26 THR H H 210 7.869 7.860 0.009 1
1 670 . 2 3 2 C 26 26 THR HA H 210 4.023 4.021 0.002 1
1 675 . 2 3 2 C 26 26 THR C C 210 177.984 176.181 1.803 1
1 676 . 2 3 2 C 26 26 THR CA C 210 65.747 67.077 -1.330 1
1 677 . 2 3 2 C 26 26 THR CB C 210 69.683 67.882 1.801 1
1 679 . 2 3 2 C 26 26 THR N N 210 115.443 118.639 -3.196 1
1 680 . 2 3 2 C 27 27 ILE H H 211 7.901 7.732 0.169 1
1 681 . 2 3 2 C 27 27 ILE HA H 211 4.142 3.476 0.666 1
1 691 . 2 3 2 C 27 27 ILE C C 211 175.595 178.091 -2.496 1
1 692 . 2 3 2 C 27 27 ILE CA C 211 63.528 65.879 -2.351 1
1 693 . 2 3 2 C 27 27 ILE CB C 211 38.982 37.378 1.604 1
1 697 . 2 3 2 C 27 27 ILE N N 211 121.265 121.738 -0.473 1
1 698 . 2 3 2 C 28 28 ASN HA H 212 4.465 4.263 0.202 1
1 703 . 2 3 2 C 28 28 ASN CA C 212 55.182 56.728 -1.546 1
1 704 . 2 3 2 C 28 28 ASN CB C 212 39.480 39.744 -0.264 1
1 706 . 2 3 2 C 29 29 LYS H H 213 7.968 7.994 -0.026 1
1 707 . 2 3 2 C 29 29 LYS HA H 213 4.072 3.980 0.092 1
1 716 . 2 3 2 C 29 29 LYS C C 213 176.218 179.956 -3.738 1
1 717 . 2 3 2 C 29 29 LYS CA C 213 58.489 59.687 -1.198 1
1 718 . 2 3 2 C 29 29 LYS CB C 213 33.165 32.317 0.848 1
1 722 . 2 3 2 C 29 29 LYS N N 213 120.820 117.739 3.081 1
1 723 . 2 3 2 C 30 30 ALA H H 214 7.865 8.017 -0.152 1
1 724 . 2 3 2 C 30 30 ALA HA H 214 4.217 4.245 -0.028 1
1 728 . 2 3 2 C 30 30 ALA C C 214 177.041 180.008 -2.967 1
1 729 . 2 3 2 C 30 30 ALA CA C 214 54.104 54.907 -0.803 1
1 730 . 2 3 2 C 30 30 ALA CB C 214 19.496 18.033 1.463 1
1 731 . 2 3 2 C 30 30 ALA N N 214 121.571 121.635 -0.064 1
1 732 . 2 3 2 C 31 31 TRP H H 215 7.831 7.956 -0.125 1
1 733 . 2 3 2 C 31 31 TRP HA H 215 4.598 4.567 0.031 1
1 742 . 2 3 2 C 31 31 TRP C C 215 178.088 178.886 -0.798 1
1 743 . 2 3 2 C 31 31 TRP CA C 215 58.432 59.326 -0.894 1
1 744 . 2 3 2 C 31 31 TRP CB C 215 30.472 30.225 0.247 1
1 750 . 2 3 2 C 31 31 TRP N N 215 118.141 117.657 0.484 1
1 752 . 2 3 2 C 32 32 VAL H H 216 7.594 8.537 -0.943 1
1 753 . 2 3 2 C 32 32 VAL HA H 216 3.978 3.710 0.268 1
1 761 . 2 3 2 C 32 32 VAL C C 216 176.574 178.245 -1.671 1
1 762 . 2 3 2 C 32 32 VAL CA C 216 63.329 66.410 -3.081 1
1 763 . 2 3 2 C 32 32 VAL CB C 216 33.373 31.044 2.329 1
1 766 . 2 3 2 C 32 32 VAL N N 216 118.287 119.745 -1.458 1
1 767 . 2 3 2 C 33 33 GLU H H 217 8.012 8.853 -0.841 1
1 768 . 2 3 2 C 33 33 GLU HA H 217 4.257 4.187 0.070 1
1 773 . 2 3 2 C 33 33 GLU C C 217 176.164 177.581 -1.417 1
1 774 . 2 3 2 C 33 33 GLU CA C 217 57.409 58.563 -1.154 1
1 775 . 2 3 2 C 33 33 GLU CB C 217 30.978 27.934 3.044 1
1 777 . 2 3 2 C 33 33 GLU N N 217 122.535 120.530 2.005 1
1 778 . 2 3 2 C 34 34 SER H H 218 8.037 7.733 0.304 1
1 779 . 2 3 2 C 34 34 SER HA H 218 4.514 4.636 -0.122 1
1 782 . 2 3 2 C 34 34 SER C C 218 176.451 174.460 1.991 1
1 783 . 2 3 2 C 34 34 SER CA C 218 58.987 58.335 0.652 1
1 784 . 2 3 2 C 34 34 SER CB C 218 64.569 63.867 0.702 1
1 785 . 2 3 2 C 34 34 SER N N 218 117.058 115.007 2.051 1
1 6 . 3 1 1 A 2 2 ALA H H 2 8.191 8.712 -0.521 1
1 7 . 3 1 1 A 2 2 ALA CA C 2 51.957 53.203 -1.246 1
1 8 . 3 1 1 A 2 2 ALA CB C 2 19.580 18.933 0.647 1
1 9 . 3 1 1 A 2 2 ALA N N 2 124.666 125.039 -0.373 1
1 10 . 3 1 1 A 3 3 SER H H 3 8.829 8.382 0.447 1
1 11 . 3 1 1 A 3 3 SER CA C 3 57.221 62.200 -4.979 1
1 12 . 3 1 1 A 3 3 SER N N 3 119.917 113.801 6.116 1
1 13 . 3 1 1 A 4 4 PRO CA C 4 66.688 65.728 0.960 1
1 14 . 3 1 1 A 4 4 PRO CB C 4 32.553 30.741 1.812 1
1 15 . 3 1 1 A 5 5 LEU H H 5 9.146 7.548 1.598 1
1 16 . 3 1 1 A 5 5 LEU CA C 5 59.017 57.016 2.001 1
1 17 . 3 1 1 A 5 5 LEU CB C 5 42.341 42.396 -0.055 1
1 18 . 3 1 1 A 5 5 LEU N N 5 117.902 116.809 1.093 1
1 19 . 3 1 1 A 6 6 ASP H H 6 7.572 8.252 -0.680 1
1 20 . 3 1 1 A 6 6 ASP CA C 6 57.997 57.999 -0.002 1
1 21 . 3 1 1 A 6 6 ASP CB C 6 40.910 42.235 -1.325 1
1 22 . 3 1 1 A 6 6 ASP N N 6 118.259 119.484 -1.225 1
1 23 . 3 1 1 A 7 7 GLN H H 7 8.660 8.526 0.134 1
1 24 . 3 1 1 A 7 7 GLN HA H 7 4.064 4.067 -0.003 1
1 29 . 3 1 1 A 7 7 GLN CA C 7 59.270 58.689 0.581 1
1 30 . 3 1 1 A 7 7 GLN CB C 7 28.468 27.804 0.664 1
1 31 . 3 1 1 A 7 7 GLN N N 7 119.558 117.224 2.334 1
1 32 . 3 1 1 A 8 8 ALA H H 8 8.253 7.871 0.382 1
1 33 . 3 1 1 A 8 8 ALA CA C 8 55.519 54.909 0.610 1
1 34 . 3 1 1 A 8 8 ALA CB C 8 18.113 18.206 -0.093 1
1 35 . 3 1 1 A 8 8 ALA N N 8 123.628 121.682 1.946 1
1 36 . 3 1 1 A 9 9 ILE H H 9 8.134 8.058 0.076 1
1 37 . 3 1 1 A 9 9 ILE CA C 9 65.261 64.468 0.793 1
1 38 . 3 1 1 A 9 9 ILE CB C 9 37.023 37.234 -0.211 1
1 39 . 3 1 1 A 9 9 ILE N N 9 117.056 117.284 -0.228 1
1 40 . 3 1 1 A 10 10 GLY H H 10 8.515 8.426 0.089 1
1 41 . 3 1 1 A 10 10 GLY HA3 H 10 3.773 3.689 0.084 1
1 42 . 3 1 1 A 10 10 GLY CA C 10 47.637 47.323 0.314 1
1 43 . 3 1 1 A 10 10 GLY N N 10 106.202 110.791 -4.589 1
1 44 . 3 1 1 A 11 11 LEU H H 11 8.212 8.193 0.019 1
1 45 . 3 1 1 A 11 11 LEU CA C 11 58.354 57.703 0.651 1
1 46 . 3 1 1 A 11 11 LEU CB C 11 41.683 41.858 -0.175 1
1 47 . 3 1 1 A 11 11 LEU N N 11 124.624 123.052 1.572 1
1 48 . 3 1 1 A 12 12 LEU H H 12 7.971 8.047 -0.076 1
1 49 . 3 1 1 A 12 12 LEU HA H 12 4.144 4.120 0.024 1
1 59 . 3 1 1 A 12 12 LEU CA C 12 58.691 58.525 0.166 1
1 60 . 3 1 1 A 12 12 LEU CB C 12 40.657 41.690 -1.033 1
1 61 . 3 1 1 A 12 12 LEU N N 12 118.095 118.744 -0.649 1
1 62 . 3 1 1 A 13 13 ILE H H 13 8.379 8.331 0.048 1
1 63 . 3 1 1 A 13 13 ILE CA C 13 66.405 65.316 1.089 1
1 64 . 3 1 1 A 13 13 ILE CB C 13 38.916 37.858 1.058 1
1 65 . 3 1 1 A 13 13 ILE N N 13 121.161 120.025 1.136 1
1 66 . 3 1 1 A 14 14 GLY H H 14 8.823 8.539 0.284 1
1 67 . 3 1 1 A 14 14 GLY HA2 H 14 4.147 3.718 0.429 1
1 68 . 3 1 1 A 14 14 GLY HA3 H 14 3.982 3.734 0.248 1
1 69 . 3 1 1 A 14 14 GLY CA C 14 47.750 47.169 0.581 1
1 70 . 3 1 1 A 14 14 GLY N N 14 108.982 107.377 1.605 1
1 71 . 3 1 1 A 15 15 ILE H H 15 8.681 8.334 0.347 1
1 72 . 3 1 1 A 15 15 ILE CA C 15 64.996 65.175 -0.179 1
1 73 . 3 1 1 A 15 15 ILE CB C 15 37.107 38.003 -0.896 1
1 74 . 3 1 1 A 15 15 ILE N N 15 121.601 122.535 -0.934 1
1 75 . 3 1 1 A 16 16 PHE H H 16 7.103 8.447 -1.344 1
1 76 . 3 1 1 A 16 16 PHE CA C 16 62.910 61.683 1.227 1
1 77 . 3 1 1 A 16 16 PHE CB C 16 38.782 39.193 -0.411 1
1 78 . 3 1 1 A 16 16 PHE N N 16 118.660 120.898 -2.238 1
1 79 . 3 1 1 A 17 17 HIS H H 17 7.591 8.567 -0.976 1
1 80 . 3 1 1 A 17 17 HIS HA H 17 4.793 4.498 0.295 1
1 82 . 3 1 1 A 17 17 HIS CA C 17 58.125 59.002 -0.877 1
1 83 . 3 1 1 A 17 17 HIS CB C 17 29.584 29.377 0.207 1
1 84 . 3 1 1 A 17 17 HIS N N 17 114.968 118.087 -3.119 1
1 85 . 3 1 1 A 18 18 LYS H H 18 8.144 8.479 -0.335 1
1 86 . 3 1 1 A 18 18 LYS CA C 18 58.975 59.046 -0.071 1
1 87 . 3 1 1 A 18 18 LYS CB C 18 32.379 31.904 0.475 1
1 88 . 3 1 1 A 18 18 LYS N N 18 122.373 118.759 3.614 1
1 89 . 3 1 1 A 19 19 TYR H H 19 6.999 7.301 -0.302 1
1 90 . 3 1 1 A 19 19 TYR CA C 19 60.318 60.505 -0.187 1
1 91 . 3 1 1 A 19 19 TYR CB C 19 40.355 38.451 1.904 1
1 92 . 3 1 1 A 19 19 TYR N N 19 113.614 119.472 -5.858 1
1 93 . 3 1 1 A 20 20 SER H H 20 8.432 7.978 0.454 1
1 94 . 3 1 1 A 20 20 SER CA C 20 61.897 60.800 1.097 1
1 95 . 3 1 1 A 20 20 SER CB C 20 61.354 62.298 -0.944 1
1 96 . 3 1 1 A 20 20 SER N N 20 113.201 115.603 -2.402 1
1 97 . 3 1 1 A 21 21 GLY H H 21 7.678 8.061 -0.383 1
1 98 . 3 1 1 A 21 21 GLY HA2 H 21 4.195 3.892 0.303 1
1 99 . 3 1 1 A 21 21 GLY HA3 H 21 3.900 3.937 -0.037 1
1 100 . 3 1 1 A 21 21 GLY CA C 21 45.628 45.582 0.046 1
1 101 . 3 1 1 A 21 21 GLY N N 21 110.734 107.577 3.157 1
1 102 . 3 1 1 A 22 22 LYS H H 22 7.362 7.580 -0.218 1
1 103 . 3 1 1 A 22 22 LYS CA C 22 60.163 58.908 1.255 1
1 104 . 3 1 1 A 22 22 LYS CB C 22 32.554 32.102 0.452 1
1 105 . 3 1 1 A 22 22 LYS N N 22 122.161 120.572 1.589 1
1 106 . 3 1 1 A 23 23 GLU H H 23 9.639 8.013 1.626 1
1 107 . 3 1 1 A 23 23 GLU CA C 23 54.449 55.423 -0.974 1
1 108 . 3 1 1 A 23 23 GLU N N 23 116.288 115.195 1.093 1
1 109 . 3 1 1 A 24 24 GLY HA2 H 24 3.912 4.040 -0.128 1
1 110 . 3 1 1 A 24 24 GLY HA3 H 24 3.787 4.045 -0.258 1
1 111 . 3 1 1 A 24 24 GLY CA C 24 45.898 43.821 2.077 1
1 112 . 3 1 1 A 25 25 ASP H H 25 8.204 8.381 -0.177 1
1 113 . 3 1 1 A 25 25 ASP CA C 25 55.252 54.529 0.723 1
1 114 . 3 1 1 A 25 25 ASP N N 25 125.671 120.227 5.444 1
1 115 . 3 1 1 A 26 26 LYS CA C 26 57.851 55.036 2.815 1
1 116 . 3 1 1 A 26 26 LYS CB C 26 31.265 34.786 -3.521 1
1 117 . 3 1 1 A 27 27 HIS H H 27 9.763 8.591 1.172 1
1 118 . 3 1 1 A 27 27 HIS CA C 27 55.580 55.473 0.107 1
1 119 . 3 1 1 A 27 27 HIS CB C 27 30.936 30.005 0.931 1
1 120 . 3 1 1 A 27 27 HIS N N 27 118.108 117.635 0.473 1
1 121 . 3 1 1 A 28 28 THR H H 28 7.325 7.241 0.084 1
1 126 . 3 1 1 A 28 28 THR CA C 28 60.128 60.311 -0.183 1
1 127 . 3 1 1 A 28 28 THR CB C 28 72.268 71.906 0.362 1
1 128 . 3 1 1 A 28 28 THR N N 28 106.920 110.782 -3.862 1
1 129 . 3 1 1 A 29 29 LEU H H 29 9.422 9.427 -0.005 1
1 130 . 3 1 1 A 29 29 LEU HA H 29 5.368 5.075 0.293 1
1 140 . 3 1 1 A 29 29 LEU CA C 29 52.567 53.338 -0.771 1
1 141 . 3 1 1 A 29 29 LEU CB C 29 43.523 43.535 -0.012 1
1 142 . 3 1 1 A 29 29 LEU N N 29 125.021 125.907 -0.886 1
1 143 . 3 1 1 A 30 30 SER H H 30 10.485 9.134 1.351 1
1 144 . 3 1 1 A 30 30 SER CA C 30 56.653 57.923 -1.270 1
1 145 . 3 1 1 A 30 30 SER CB C 30 65.313 64.266 1.047 1
1 146 . 3 1 1 A 30 30 SER N N 30 124.758 120.295 4.463 1
1 147 . 3 1 1 A 31 31 LYS H H 31 8.728 8.901 -0.173 1
1 148 . 3 1 1 A 31 31 LYS CA C 31 59.669 60.262 -0.593 1
1 149 . 3 1 1 A 31 31 LYS CB C 31 31.763 32.190 -0.427 1
1 150 . 3 1 1 A 31 31 LYS N N 31 119.459 124.327 -4.868 1
1 151 . 3 1 1 A 32 32 LYS H H 32 7.857 7.905 -0.048 1
1 152 . 3 1 1 A 32 32 LYS CA C 32 59.721 59.538 0.183 1
1 153 . 3 1 1 A 32 32 LYS CB C 32 32.901 32.072 0.829 1
1 154 . 3 1 1 A 32 32 LYS N N 32 117.933 119.552 -1.619 1
1 155 . 3 1 1 A 33 33 GLU H H 33 7.559 7.863 -0.304 1
1 156 . 3 1 1 A 33 33 GLU CA C 33 59.169 58.930 0.239 1
1 157 . 3 1 1 A 33 33 GLU CB C 33 31.014 29.349 1.665 1
1 158 . 3 1 1 A 33 33 GLU N N 33 120.407 119.292 1.115 1
1 159 . 3 1 1 A 34 34 LEU H H 34 8.833 8.397 0.436 1
1 160 . 3 1 1 A 34 34 LEU CA C 34 56.928 57.873 -0.945 1
1 161 . 3 1 1 A 34 34 LEU CB C 34 41.435 41.651 -0.216 1
1 162 . 3 1 1 A 34 34 LEU N N 34 117.677 121.011 -3.334 1
1 163 . 3 1 1 A 35 35 LYS H H 35 8.010 8.124 -0.114 1
1 164 . 3 1 1 A 35 35 LYS CA C 35 60.692 60.205 0.487 1
1 165 . 3 1 1 A 35 35 LYS CB C 35 32.223 32.070 0.153 1
1 166 . 3 1 1 A 35 35 LYS N N 35 119.829 118.568 1.261 1
1 167 . 3 1 1 A 36 36 GLU H H 36 7.169 8.232 -1.063 1
1 168 . 3 1 1 A 36 36 GLU CA C 36 59.588 58.986 0.602 1
1 169 . 3 1 1 A 36 36 GLU CB C 36 29.342 29.296 0.046 1
1 170 . 3 1 1 A 36 36 GLU N N 36 117.340 120.442 -3.102 1
1 171 . 3 1 1 A 37 37 LEU H H 37 7.478 7.405 0.073 1
1 172 . 3 1 1 A 37 37 LEU CA C 37 59.674 57.680 1.994 1
1 173 . 3 1 1 A 37 37 LEU CB C 37 42.142 41.145 0.997 1
1 174 . 3 1 1 A 37 37 LEU N N 37 120.884 121.119 -0.235 1
1 175 . 3 1 1 A 38 38 ILE H H 38 8.377 7.880 0.497 1
1 176 . 3 1 1 A 38 38 ILE CA C 38 65.651 63.753 1.898 1
1 177 . 3 1 1 A 38 38 ILE N N 38 118.450 114.216 4.234 1
1 178 . 3 1 1 A 39 39 GLN H H 39 8.217 8.128 0.089 1
1 179 . 3 1 1 A 39 39 GLN CA C 39 59.788 58.475 1.313 1
1 180 . 3 1 1 A 39 39 GLN CB C 39 29.278 28.880 0.398 1
1 181 . 3 1 1 A 39 39 GLN N N 39 113.091 120.205 -7.114 1
1 182 . 3 1 1 A 40 40 LYS H H 40 8.426 8.049 0.377 1
1 183 . 3 1 1 A 40 40 LYS CA C 40 57.807 58.634 -0.827 1
1 184 . 3 1 1 A 40 40 LYS CB C 40 33.942 33.018 0.924 1
1 185 . 3 1 1 A 40 40 LYS N N 40 114.771 118.592 -3.821 1
1 186 . 3 1 1 A 41 41 GLU H H 41 8.496 8.523 -0.027 1
1 187 . 3 1 1 A 41 41 GLU CA C 41 55.395 58.659 -3.264 1
1 188 . 3 1 1 A 41 41 GLU CB C 41 29.260 30.362 -1.102 1
1 189 . 3 1 1 A 41 41 GLU N N 41 112.546 119.053 -6.507 1
1 190 . 3 1 1 A 42 42 LEU H H 42 7.267 7.724 -0.457 1
1 191 . 3 1 1 A 42 42 LEU CA C 42 53.776 54.098 -0.322 1
1 192 . 3 1 1 A 42 42 LEU N N 42 118.657 119.697 -1.040 1
1 193 . 3 1 1 A 44 44 ILE CA C 44 62.210 61.355 0.855 1
1 194 . 3 1 1 A 44 44 ILE CB C 44 38.247 38.855 -0.608 1
1 195 . 3 1 1 A 45 45 GLY H H 45 7.820 8.085 -0.265 1
1 196 . 3 1 1 A 45 45 GLY CA C 45 47.742 45.351 2.391 1
1 197 . 3 1 1 A 45 45 GLY N N 45 108.178 112.013 -3.835 1
1 198 . 3 1 1 A 46 46 SER H H 46 7.895 8.647 -0.752 1
1 199 . 3 1 1 A 46 46 SER CA C 46 59.958 60.352 -0.394 1
1 200 . 3 1 1 A 46 46 SER CB C 46 63.450 63.191 0.259 1
1 201 . 3 1 1 A 46 46 SER N N 46 113.038 121.052 -8.014 1
1 202 . 3 1 1 A 47 47 LYS H H 47 7.736 7.671 0.065 1
1 203 . 3 1 1 A 47 47 LYS CA C 47 55.636 56.610 -0.974 1
1 204 . 3 1 1 A 47 47 LYS CB C 47 33.103 33.058 0.045 1
1 205 . 3 1 1 A 47 47 LYS N N 47 119.422 123.178 -3.756 1
1 206 . 3 1 1 A 48 48 LEU H H 48 6.988 8.753 -1.765 1
1 207 . 3 1 1 A 48 48 LEU HA H 48 4.497 4.462 0.035 1
1 217 . 3 1 1 A 48 48 LEU CA C 48 54.517 54.652 -0.135 1
1 218 . 3 1 1 A 48 48 LEU CB C 48 42.987 41.923 1.064 1
1 219 . 3 1 1 A 48 48 LEU N N 48 118.908 127.474 -8.566 1
1 220 . 3 1 1 A 49 49 GLN H H 49 9.206 8.812 0.394 1
1 221 . 3 1 1 A 49 49 GLN HA H 49 4.486 4.723 -0.237 1
1 223 . 3 1 1 A 49 49 GLN CA C 49 54.785 55.225 -0.440 1
1 224 . 3 1 1 A 49 49 GLN CB C 49 29.636 29.786 -0.150 1
1 225 . 3 1 1 A 49 49 GLN N N 49 121.275 123.864 -2.589 1
1 226 . 3 1 1 A 50 50 ASP H H 50 8.854 7.923 0.931 1
1 227 . 3 1 1 A 50 50 ASP CA C 50 59.078 57.059 2.019 1
1 228 . 3 1 1 A 50 50 ASP CB C 50 40.632 41.136 -0.504 1
1 229 . 3 1 1 A 50 50 ASP N N 50 123.430 121.916 1.514 1
1 230 . 3 1 1 A 51 51 ALA H H 51 8.720 8.278 0.442 1
1 231 . 3 1 1 A 51 51 ALA CA C 51 55.281 54.966 0.315 1
1 232 . 3 1 1 A 51 51 ALA CB C 51 18.205 18.097 0.108 1
1 233 . 3 1 1 A 51 51 ALA N N 51 117.829 121.279 -3.450 1
1 234 . 3 1 1 A 52 52 GLU H H 52 7.161 7.771 -0.610 1
1 235 . 3 1 1 A 52 52 GLU CA C 52 58.757 58.919 -0.162 1
1 236 . 3 1 1 A 52 52 GLU CB C 52 30.247 29.415 0.832 1
1 237 . 3 1 1 A 52 52 GLU N N 52 115.459 117.604 -2.145 1
1 238 . 3 1 1 A 53 53 ILE H H 53 7.962 7.937 0.025 1
1 239 . 3 1 1 A 53 53 ILE CA C 53 65.525 65.098 0.427 1
1 240 . 3 1 1 A 53 53 ILE CB C 53 37.289 37.930 -0.641 1
1 241 . 3 1 1 A 53 53 ILE N N 53 120.414 121.152 -0.738 1
1 242 . 3 1 1 A 54 54 VAL H H 54 8.132 8.145 -0.013 1
1 243 . 3 1 1 A 54 54 VAL CA C 54 67.290 65.620 1.670 1
1 244 . 3 1 1 A 54 54 VAL CB C 54 31.434 31.328 0.106 1
1 245 . 3 1 1 A 54 54 VAL N N 54 119.775 116.910 2.865 1
1 246 . 3 1 1 A 55 55 LYS H H 55 7.155 8.058 -0.903 1
1 247 . 3 1 1 A 55 55 LYS CA C 55 59.131 59.148 -0.017 1
1 248 . 3 1 1 A 55 55 LYS CB C 55 32.131 31.784 0.347 1
1 249 . 3 1 1 A 55 55 LYS N N 55 119.175 120.975 -1.800 1
1 250 . 3 1 1 A 56 56 LEU H H 56 7.837 8.213 -0.376 1
1 251 . 3 1 1 A 56 56 LEU CA C 56 58.052 57.967 0.085 1
1 252 . 3 1 1 A 56 56 LEU CB C 56 41.878 41.423 0.455 1
1 253 . 3 1 1 A 56 56 LEU N N 56 119.679 121.120 -1.441 1
1 254 . 3 1 1 A 57 57 MET H H 57 8.385 8.730 -0.345 1
1 255 . 3 1 1 A 57 57 MET CA C 57 60.756 58.843 1.913 1
1 256 . 3 1 1 A 57 57 MET CB C 57 33.152 31.939 1.213 1
1 257 . 3 1 1 A 57 57 MET N N 57 115.116 119.481 -4.365 1
1 258 . 3 1 1 A 58 58 ASP H H 58 7.591 8.468 -0.877 1
1 259 . 3 1 1 A 58 58 ASP CA C 58 57.365 57.497 -0.132 1
1 260 . 3 1 1 A 58 58 ASP CB C 58 40.858 41.451 -0.593 1
1 261 . 3 1 1 A 58 58 ASP N N 58 118.197 119.647 -1.450 1
1 262 . 3 1 1 A 59 59 ASP H H 59 7.725 8.064 -0.339 1
1 263 . 3 1 1 A 59 59 ASP CA C 59 56.830 56.934 -0.104 1
1 264 . 3 1 1 A 59 59 ASP CB C 59 40.567 41.262 -0.695 1
1 265 . 3 1 1 A 59 59 ASP N N 59 118.481 119.575 -1.094 1
1 266 . 3 1 1 A 60 60 LEU H H 60 7.703 7.972 -0.269 1
1 267 . 3 1 1 A 60 60 LEU CA C 60 56.564 57.865 -1.301 1
1 268 . 3 1 1 A 60 60 LEU CB C 60 42.714 41.296 1.418 1
1 269 . 3 1 1 A 60 60 LEU N N 60 116.935 119.764 -2.829 1
1 270 . 3 1 1 A 61 61 ASP H H 61 7.143 8.542 -1.399 1
1 271 . 3 1 1 A 61 61 ASP HA H 61 4.690 4.367 0.323 1
1 274 . 3 1 1 A 61 61 ASP CA C 61 52.286 57.303 -5.017 1
1 275 . 3 1 1 A 61 61 ASP CB C 61 39.245 41.038 -1.793 1
1 276 . 3 1 1 A 61 61 ASP N N 61 116.605 119.148 -2.543 1
1 277 . 3 1 1 A 62 62 ARG H H 62 7.786 8.195 -0.409 1
1 278 . 3 1 1 A 62 62 ARG CA C 62 58.328 57.751 0.577 1
1 279 . 3 1 1 A 62 62 ARG CB C 62 30.106 29.212 0.894 1
1 280 . 3 1 1 A 62 62 ARG N N 62 125.967 118.021 7.946 1
1 281 . 3 1 1 A 63 63 ASN H H 63 7.945 7.683 0.262 1
1 282 . 3 1 1 A 63 63 ASN CA C 63 51.863 55.153 -3.290 1
1 283 . 3 1 1 A 63 63 ASN CB C 63 36.809 39.814 -3.005 1
1 284 . 3 1 1 A 63 63 ASN N N 63 112.434 118.361 -5.927 1
1 285 . 3 1 1 A 64 64 LYS H H 64 7.477 7.620 -0.143 1
1 286 . 3 1 1 A 64 64 LYS CA C 64 56.524 55.847 0.677 1
1 287 . 3 1 1 A 64 64 LYS N N 64 114.197 118.118 -3.921 1
1 288 . 3 1 1 A 65 65 ASP H H 65 8.345 8.723 -0.378 1
1 289 . 3 1 1 A 65 65 ASP CA C 65 52.969 55.600 -2.631 1
1 290 . 3 1 1 A 65 65 ASP CB C 65 40.329 40.671 -0.342 1
1 291 . 3 1 1 A 65 65 ASP N N 65 118.581 126.393 -7.812 1
1 292 . 3 1 1 A 66 66 GLN H H 66 9.945 8.987 0.958 1
1 293 . 3 1 1 A 66 66 GLN CA C 66 58.132 58.263 -0.131 1
1 294 . 3 1 1 A 66 66 GLN CB C 66 26.035 26.550 -0.515 1
1 295 . 3 1 1 A 66 66 GLN N N 66 113.203 119.225 -6.022 1
1 296 . 3 1 1 A 67 67 GLU H H 67 7.880 7.591 0.289 1
1 297 . 3 1 1 A 67 67 GLU HA H 67 4.910 4.932 -0.022 1
1 302 . 3 1 1 A 67 67 GLU CA C 67 54.082 54.992 -0.910 1
1 303 . 3 1 1 A 67 67 GLU CB C 67 33.174 32.847 0.327 1
1 304 . 3 1 1 A 67 67 GLU N N 67 118.554 114.938 3.616 1
1 305 . 3 1 1 A 68 68 VAL H H 68 9.669 9.424 0.245 1
1 306 . 3 1 1 A 68 68 VAL HA H 68 5.465 4.575 0.890 1
1 314 . 3 1 1 A 68 68 VAL CA C 68 61.079 61.881 -0.802 1
1 315 . 3 1 1 A 68 68 VAL CB C 68 33.280 32.842 0.438 1
1 316 . 3 1 1 A 68 68 VAL N N 68 126.572 124.636 1.936 1
1 317 . 3 1 1 A 69 69 ASN H H 69 8.985 8.870 0.115 1
1 318 . 3 1 1 A 69 69 ASN CA C 69 50.812 53.142 -2.330 1
1 319 . 3 1 1 A 69 69 ASN CB C 69 38.609 39.567 -0.958 1
1 320 . 3 1 1 A 69 69 ASN N N 69 127.472 125.542 1.930 1
1 321 . 3 1 1 A 70 70 PHE H H 70 9.100 8.992 0.108 1
1 322 . 3 1 1 A 70 70 PHE CA C 70 63.279 61.853 1.426 1
1 323 . 3 1 1 A 70 70 PHE CB C 70 38.741 39.382 -0.641 1
1 324 . 3 1 1 A 70 70 PHE N N 70 119.972 123.114 -3.142 1
1 325 . 3 1 1 A 71 71 GLN H H 71 8.342 8.197 0.145 1
1 326 . 3 1 1 A 71 71 GLN HA H 71 3.923 3.692 0.231 1
1 329 . 3 1 1 A 71 71 GLN CA C 71 59.866 58.596 1.270 1
1 330 . 3 1 1 A 71 71 GLN CB C 71 27.878 28.359 -0.481 1
1 331 . 3 1 1 A 71 71 GLN N N 71 118.216 117.497 0.719 1
1 332 . 3 1 1 A 72 72 GLU H H 72 8.721 8.143 0.578 1
1 333 . 3 1 1 A 72 72 GLU HA H 72 4.147 4.100 0.047 1
1 338 . 3 1 1 A 72 72 GLU CA C 72 59.313 58.797 0.516 1
1 339 . 3 1 1 A 72 72 GLU CB C 72 30.233 29.630 0.603 1
1 340 . 3 1 1 A 72 72 GLU N N 72 121.455 119.030 2.425 1
1 341 . 3 1 1 A 73 73 TYR H H 73 8.536 8.070 0.466 1
1 342 . 3 1 1 A 73 73 TYR CA C 73 60.961 61.602 -0.641 1
1 343 . 3 1 1 A 73 73 TYR CB C 73 38.724 38.796 -0.072 1
1 344 . 3 1 1 A 73 73 TYR N N 73 123.356 122.165 1.191 1
1 345 . 3 1 1 A 74 74 ILE H H 74 8.642 7.465 1.177 1
1 346 . 3 1 1 A 74 74 ILE CA C 74 61.880 63.763 -1.883 1
1 347 . 3 1 1 A 74 74 ILE CB C 74 36.077 36.363 -0.286 1
1 348 . 3 1 1 A 74 74 ILE N N 74 119.799 119.975 -0.176 1
1 349 . 3 1 1 A 75 75 THR H H 75 7.959 8.093 -0.134 1
1 354 . 3 1 1 A 75 75 THR CA C 75 67.056 66.573 0.483 1
1 355 . 3 1 1 A 75 75 THR CB C 75 68.386 68.667 -0.281 1
1 356 . 3 1 1 A 75 75 THR N N 75 119.486 117.961 1.525 1
1 357 . 3 1 1 A 76 76 PHE H H 76 7.450 8.217 -0.767 1
1 358 . 3 1 1 A 76 76 PHE CA C 76 59.010 61.710 -2.700 1
1 359 . 3 1 1 A 76 76 PHE CB C 76 38.139 39.228 -1.089 1
1 360 . 3 1 1 A 76 76 PHE N N 76 122.873 121.464 1.409 1
1 361 . 3 1 1 A 77 77 LEU H H 77 7.829 8.269 -0.440 1
1 362 . 3 1 1 A 77 77 LEU CA C 77 57.450 57.578 -0.128 1
1 363 . 3 1 1 A 77 77 LEU CB C 77 40.560 40.975 -0.415 1
1 364 . 3 1 1 A 77 77 LEU N N 77 117.405 118.198 -0.793 1
1 365 . 3 1 1 A 78 78 GLY H H 78 8.093 7.983 0.110 1
1 366 . 3 1 1 A 78 78 GLY HA2 H 78 3.661 3.732 -0.071 1
1 367 . 3 1 1 A 78 78 GLY HA3 H 78 3.594 3.739 -0.145 1
1 368 . 3 1 1 A 78 78 GLY CA C 78 47.442 47.139 0.303 1
1 369 . 3 1 1 A 78 78 GLY N N 78 105.528 105.944 -0.416 1
1 370 . 3 1 1 A 79 79 ALA H H 79 7.759 7.608 0.151 1
1 371 . 3 1 1 A 79 79 ALA CA C 79 55.153 54.646 0.507 1
1 372 . 3 1 1 A 79 79 ALA CB C 79 17.768 18.502 -0.734 1
1 373 . 3 1 1 A 79 79 ALA N N 79 124.488 125.072 -0.584 1
1 374 . 3 1 1 A 80 80 LEU H H 80 7.963 7.666 0.297 1
1 375 . 3 1 1 A 80 80 LEU CA C 80 57.464 57.661 -0.197 1
1 376 . 3 1 1 A 80 80 LEU CB C 80 41.496 41.041 0.455 1
1 377 . 3 1 1 A 80 80 LEU N N 80 117.869 119.855 -1.986 1
1 378 . 3 1 1 A 81 81 ALA H H 81 8.365 8.561 -0.196 1
1 379 . 3 1 1 A 81 81 ALA CA C 81 55.475 54.984 0.491 1
1 380 . 3 1 1 A 81 81 ALA CB C 81 17.483 18.100 -0.617 1
1 381 . 3 1 1 A 81 81 ALA N N 81 119.054 120.188 -1.134 1
1 382 . 3 1 1 A 82 82 MET H H 82 8.112 7.633 0.479 1
1 383 . 3 1 1 A 82 82 MET CA C 82 59.516 57.982 1.534 1
1 384 . 3 1 1 A 82 82 MET CB C 82 32.550 32.215 0.335 1
1 385 . 3 1 1 A 82 82 MET N N 82 115.364 117.752 -2.388 1
1 386 . 3 1 1 A 83 83 ILE H H 83 7.981 8.058 -0.077 1
1 387 . 3 1 1 A 83 83 ILE HA H 83 3.839 3.557 0.282 1
1 391 . 3 1 1 A 83 83 ILE CA C 83 64.467 64.885 -0.418 1
1 392 . 3 1 1 A 83 83 ILE CB C 83 37.312 37.194 0.118 1
1 393 . 3 1 1 A 83 83 ILE N N 83 120.887 119.492 1.395 1
1 394 . 3 1 1 A 84 84 TYR H H 84 8.731 7.611 1.120 1
1 395 . 3 1 1 A 84 84 TYR N N 84 120.933 119.834 1.099 1
1 396 . 3 1 1 A 87 87 ALA H H 87 7.829 7.898 -0.069 1
1 397 . 3 1 1 A 87 87 ALA CA C 87 53.768 54.458 -0.690 1
1 398 . 3 1 1 A 87 87 ALA CB C 87 18.504 18.145 0.359 1
1 399 . 3 1 1 A 87 87 ALA N N 87 120.274 122.558 -2.284 1
1 400 . 3 1 1 A 88 88 LEU H H 88 7.499 7.756 -0.257 1
1 401 . 3 1 1 A 88 88 LEU CA C 88 55.605 56.495 -0.890 1
1 402 . 3 1 1 A 88 88 LEU CB C 88 42.047 42.047 0.000 1
1 403 . 3 1 1 A 88 88 LEU N N 88 117.356 117.690 -0.334 1
1 404 . 3 1 1 A 89 89 LYS H H 89 7.561 7.436 0.125 1
1 405 . 3 1 1 A 89 89 LYS CA C 89 56.865 57.824 -0.959 1
1 406 . 3 1 1 A 89 89 LYS CB C 89 32.592 32.672 -0.080 1
1 407 . 3 1 1 A 89 89 LYS N N 89 119.289 118.665 0.624 1
1 416 . 3 3 2 C 6 6 GLU H H 190 8.385 8.995 -0.610 1
1 417 . 3 3 2 C 6 6 GLU HA H 190 4.153 4.934 -0.781 1
1 422 . 3 3 2 C 6 6 GLU C C 190 175.031 176.852 -1.821 1
1 423 . 3 3 2 C 6 6 GLU CA C 190 58.866 54.341 4.525 1
1 424 . 3 3 2 C 6 6 GLU CB C 190 30.751 33.478 -2.727 1
1 426 . 3 3 2 C 6 6 GLU N N 190 122.715 122.672 0.043 1
1 427 . 3 3 2 C 7 7 GLY H H 191 8.475 8.949 -0.474 1
1 428 . 3 3 2 C 7 7 GLY HA2 H 191 3.887 3.920 -0.033 1
1 429 . 3 3 2 C 7 7 GLY HA3 H 191 3.887 3.921 -0.034 1
1 430 . 3 3 2 C 7 7 GLY C C 191 177.922 175.743 2.179 1
1 431 . 3 3 2 C 7 7 GLY CA C 191 46.884 47.430 -0.546 1
1 432 . 3 3 2 C 7 7 GLY N N 191 109.009 110.216 -1.207 1
1 433 . 3 3 2 C 8 8 LEU HA H 192 4.095 3.924 0.171 1
1 443 . 3 3 2 C 8 8 LEU CA C 192 58.154 58.233 -0.079 1
1 444 . 3 3 2 C 8 8 LEU CB C 192 42.789 41.586 1.203 1
1 448 . 3 3 2 C 9 9 MET H H 193 8.250 8.215 0.035 1
1 449 . 3 3 2 C 9 9 MET HA H 193 4.150 4.053 0.097 1
1 457 . 3 3 2 C 9 9 MET C C 193 178.421 178.416 0.005 1
1 458 . 3 3 2 C 9 9 MET CA C 193 58.818 58.656 0.162 1
1 459 . 3 3 2 C 9 9 MET CB C 193 32.360 32.455 -0.095 1
1 462 . 3 3 2 C 9 9 MET N N 193 117.049 118.747 -1.698 1
1 463 . 3 3 2 C 10 10 ASN H H 194 7.892 8.398 -0.506 1
1 464 . 3 3 2 C 10 10 ASN HA H 194 4.468 4.502 -0.034 1
1 469 . 3 3 2 C 10 10 ASN C C 194 178.099 176.547 1.552 1
1 470 . 3 3 2 C 10 10 ASN CA C 194 56.644 55.542 1.102 1
1 471 . 3 3 2 C 10 10 ASN CB C 194 39.100 39.056 0.044 1
1 472 . 3 3 2 C 10 10 ASN N N 194 117.034 118.798 -1.764 1
1 474 . 3 3 2 C 11 11 VAL H H 195 7.651 7.842 -0.191 1
1 475 . 3 3 2 C 11 11 VAL HA H 195 3.735 3.877 -0.142 1
1 483 . 3 3 2 C 11 11 VAL C C 195 177.657 178.049 -0.392 1
1 484 . 3 3 2 C 11 11 VAL CA C 195 66.710 65.063 1.647 1
1 485 . 3 3 2 C 11 11 VAL CB C 195 32.468 32.088 0.380 1
1 488 . 3 3 2 C 11 11 VAL N N 195 119.878 118.005 1.873 1
1 489 . 3 3 2 C 12 12 LEU H H 196 8.030 8.083 -0.053 1
1 490 . 3 3 2 C 12 12 LEU HA H 196 4.013 3.950 0.063 1
1 500 . 3 3 2 C 12 12 LEU C C 196 177.540 179.630 -2.090 1
1 501 . 3 3 2 C 12 12 LEU CA C 196 58.489 58.040 0.449 1
1 502 . 3 3 2 C 12 12 LEU CB C 196 42.457 41.302 1.155 1
1 506 . 3 3 2 C 12 12 LEU N N 196 119.499 120.430 -0.931 1
1 507 . 3 3 2 C 13 13 LYS H H 197 8.015 8.324 -0.309 1
1 508 . 3 3 2 C 13 13 LYS HA H 197 3.949 4.114 -0.165 1
1 517 . 3 3 2 C 13 13 LYS C C 197 178.419 179.071 -0.652 1
1 518 . 3 3 2 C 13 13 LYS CA C 197 60.191 59.197 0.994 1
1 519 . 3 3 2 C 13 13 LYS CB C 197 33.075 32.004 1.071 1
1 523 . 3 3 2 C 13 13 LYS N N 197 117.888 120.320 -2.432 1
1 524 . 3 3 2 C 14 14 LYS H H 198 7.506 7.789 -0.283 1
1 525 . 3 3 2 C 14 14 LYS HA H 198 4.127 4.092 0.035 1
1 534 . 3 3 2 C 14 14 LYS C C 198 178.262 178.633 -0.371 1
1 535 . 3 3 2 C 14 14 LYS CA C 198 59.161 58.611 0.550 1
1 536 . 3 3 2 C 14 14 LYS CB C 198 32.956 31.748 1.208 1
1 540 . 3 3 2 C 14 14 LYS N N 198 118.321 118.300 0.021 1
1 541 . 3 3 2 C 15 15 ILE H H 199 7.780 7.196 0.584 1
1 542 . 3 3 2 C 15 15 ILE HA H 199 3.787 3.967 -0.180 1
1 552 . 3 3 2 C 15 15 ILE C C 199 178.647 177.836 0.811 1
1 553 . 3 3 2 C 15 15 ILE CA C 199 64.912 63.603 1.309 1
1 554 . 3 3 2 C 15 15 ILE CB C 199 38.780 37.829 0.951 1
1 558 . 3 3 2 C 15 15 ILE N N 199 118.644 119.235 -0.591 1
1 559 . 3 3 2 C 16 16 TYR H H 200 7.918 8.593 -0.675 1
1 560 . 3 3 2 C 16 16 TYR HA H 200 4.252 4.001 0.251 1
1 567 . 3 3 2 C 16 16 TYR C C 200 177.806 177.851 -0.045 1
1 568 . 3 3 2 C 16 16 TYR CA C 200 61.171 62.262 -1.091 1
1 569 . 3 3 2 C 16 16 TYR CB C 200 39.245 38.704 0.541 1
1 573 . 3 3 2 C 16 16 TYR N N 200 118.683 121.599 -2.916 1
1 574 . 3 3 2 C 17 17 GLU H H 201 8.089 8.404 -0.315 1
1 575 . 3 3 2 C 17 17 GLU HA H 201 4.124 3.830 0.294 1
1 580 . 3 3 2 C 17 17 GLU C C 201 177.414 176.169 1.245 1
1 581 . 3 3 2 C 17 17 GLU CA C 201 58.784 57.790 0.994 1
1 582 . 3 3 2 C 17 17 GLU CB C 201 30.747 28.353 2.394 1
1 584 . 3 3 2 C 17 17 GLU N N 201 119.409 116.230 3.179 1
1 585 . 3 3 2 C 18 18 ASP H H 202 8.023 7.706 0.317 1
1 586 . 3 3 2 C 18 18 ASP HA H 202 4.657 4.745 -0.088 1
1 589 . 3 3 2 C 18 18 ASP C C 202 177.346 176.399 0.947 1
1 590 . 3 3 2 C 18 18 ASP CA C 202 55.496 53.224 2.272 1
1 591 . 3 3 2 C 18 18 ASP CB C 202 42.023 40.976 1.047 1
1 592 . 3 3 2 C 18 18 ASP N N 202 119.459 119.268 0.191 1
1 593 . 3 3 2 C 19 19 GLY H H 203 7.933 7.860 0.073 1
1 594 . 3 3 2 C 19 19 GLY HA2 H 203 3.938 4.099 -0.161 1
1 595 . 3 3 2 C 19 19 GLY HA3 H 203 3.938 4.124 -0.186 1
1 596 . 3 3 2 C 19 19 GLY C C 203 177.240 172.197 5.043 1
1 597 . 3 3 2 C 19 19 GLY CA C 203 46.309 44.477 1.832 1
1 598 . 3 3 2 C 19 19 GLY N N 203 108.518 108.456 0.062 1
1 599 . 3 3 2 C 20 20 ASP H H 204 8.091 8.449 -0.358 1
1 600 . 3 3 2 C 20 20 ASP HA H 204 4.616 4.784 -0.168 1
1 603 . 3 3 2 C 20 20 ASP C C 204 173.979 176.791 -2.812 1
1 604 . 3 3 2 C 20 20 ASP CA C 204 55.064 54.368 0.696 1
1 605 . 3 3 2 C 20 20 ASP CB C 204 42.203 42.715 -0.512 1
1 606 . 3 3 2 C 20 20 ASP N N 204 120.172 120.196 -0.024 1
1 607 . 3 3 2 C 21 21 ASP H H 205 8.352 9.189 -0.837 1
1 608 . 3 3 2 C 21 21 ASP HA H 205 4.468 4.505 -0.037 1
1 611 . 3 3 2 C 21 21 ASP C C 205 176.432 177.747 -1.315 1
1 612 . 3 3 2 C 21 21 ASP CA C 205 56.663 55.952 0.711 1
1 613 . 3 3 2 C 21 21 ASP CB C 205 41.918 40.776 1.142 1
1 614 . 3 3 2 C 21 21 ASP N N 205 121.515 126.444 -4.929 1
1 615 . 3 3 2 C 22 22 ASP H H 206 8.239 8.318 -0.079 1
1 616 . 3 3 2 C 22 22 ASP HA H 206 4.455 4.604 -0.149 1
1 619 . 3 3 2 C 22 22 ASP C C 206 177.449 178.051 -0.602 1
1 620 . 3 3 2 C 22 22 ASP CA C 206 57.165 56.485 0.680 1
1 621 . 3 3 2 C 22 22 ASP CB C 206 41.820 40.649 1.171 1
1 622 . 3 3 2 C 22 22 ASP N N 206 120.156 118.998 1.158 1
1 623 . 3 3 2 C 23 23 MET H H 207 8.300 8.024 0.276 1
1 624 . 3 3 2 C 23 23 MET HA H 207 4.255 4.061 0.194 1
1 632 . 3 3 2 C 23 23 MET C C 207 178.412 178.287 0.125 1
1 633 . 3 3 2 C 23 23 MET CA C 207 58.065 58.756 -0.691 1
1 634 . 3 3 2 C 23 23 MET CB C 207 32.488 32.235 0.253 1
1 637 . 3 3 2 C 23 23 MET N N 207 120.707 119.570 1.137 1
1 638 . 3 3 2 C 24 24 LYS H H 208 8.047 8.274 -0.227 1
1 639 . 3 3 2 C 24 24 LYS HA H 208 3.946 4.000 -0.054 1
1 648 . 3 3 2 C 24 24 LYS C C 208 178.008 179.077 -1.069 1
1 649 . 3 3 2 C 24 24 LYS CA C 208 59.847 59.921 -0.074 1
1 650 . 3 3 2 C 24 24 LYS CB C 208 32.983 32.171 0.812 1
1 654 . 3 3 2 C 24 24 LYS N N 208 119.504 118.761 0.743 1
1 655 . 3 3 2 C 25 25 ARG H H 209 7.891 8.034 -0.143 1
1 656 . 3 3 2 C 25 25 ARG HA H 209 4.168 4.048 0.120 1
1 663 . 3 3 2 C 25 25 ARG C C 209 178.100 178.636 -0.536 1
1 664 . 3 3 2 C 25 25 ARG CA C 209 58.810 59.370 -0.560 1
1 665 . 3 3 2 C 25 25 ARG CB C 209 31.080 29.989 1.091 1
1 668 . 3 3 2 C 25 25 ARG N N 209 118.378 120.131 -1.753 1
1 669 . 3 3 2 C 26 26 THR H H 210 7.869 8.209 -0.340 1
1 670 . 3 3 2 C 26 26 THR HA H 210 4.023 4.035 -0.012 1
1 675 . 3 3 2 C 26 26 THR C C 210 177.984 176.692 1.292 1
1 676 . 3 3 2 C 26 26 THR CA C 210 65.747 66.890 -1.143 1
1 677 . 3 3 2 C 26 26 THR CB C 210 69.683 68.366 1.317 1
1 679 . 3 3 2 C 26 26 THR N N 210 115.443 116.708 -1.265 1
1 680 . 3 3 2 C 27 27 ILE H H 211 7.901 8.109 -0.208 1
1 681 . 3 3 2 C 27 27 ILE HA H 211 4.142 3.633 0.509 1
1 691 . 3 3 2 C 27 27 ILE C C 211 175.595 178.343 -2.748 1
1 692 . 3 3 2 C 27 27 ILE CA C 211 63.528 65.960 -2.432 1
1 693 . 3 3 2 C 27 27 ILE CB C 211 38.982 37.713 1.269 1
1 697 . 3 3 2 C 27 27 ILE N N 211 121.265 121.425 -0.160 1
1 698 . 3 3 2 C 28 28 ASN HA H 212 4.465 4.350 0.115 1
1 703 . 3 3 2 C 28 28 ASN CA C 212 55.182 57.053 -1.871 1
1 704 . 3 3 2 C 28 28 ASN CB C 212 39.480 39.712 -0.232 1
1 706 . 3 3 2 C 29 29 LYS H H 213 7.968 7.893 0.075 1
1 707 . 3 3 2 C 29 29 LYS HA H 213 4.072 4.045 0.027 1
1 716 . 3 3 2 C 29 29 LYS C C 213 176.218 178.901 -2.683 1
1 717 . 3 3 2 C 29 29 LYS CA C 213 58.489 59.553 -1.064 1
1 718 . 3 3 2 C 29 29 LYS CB C 213 33.165 32.305 0.860 1
1 722 . 3 3 2 C 29 29 LYS N N 213 120.820 119.409 1.411 1
1 723 . 3 3 2 C 30 30 ALA H H 214 7.865 8.184 -0.319 1
1 724 . 3 3 2 C 30 30 ALA HA H 214 4.217 4.180 0.037 1
1 728 . 3 3 2 C 30 30 ALA C C 214 177.041 179.787 -2.746 1
1 729 . 3 3 2 C 30 30 ALA CA C 214 54.104 54.851 -0.747 1
1 730 . 3 3 2 C 30 30 ALA CB C 214 19.496 17.993 1.503 1
1 731 . 3 3 2 C 30 30 ALA N N 214 121.571 120.732 0.839 1
1 732 . 3 3 2 C 31 31 TRP H H 215 7.831 7.822 0.009 1
1 733 . 3 3 2 C 31 31 TRP HA H 215 4.598 4.238 0.360 1
1 742 . 3 3 2 C 31 31 TRP C C 215 178.088 178.261 -0.173 1
1 743 . 3 3 2 C 31 31 TRP CA C 215 58.432 61.327 -2.895 1
1 744 . 3 3 2 C 31 31 TRP CB C 215 30.472 29.367 1.105 1
1 750 . 3 3 2 C 31 31 TRP N N 215 118.141 120.462 -2.321 1
1 752 . 3 3 2 C 32 32 VAL H H 216 7.594 8.590 -0.996 1
1 753 . 3 3 2 C 32 32 VAL HA H 216 3.978 3.768 0.210 1
1 761 . 3 3 2 C 32 32 VAL C C 216 176.574 178.182 -1.608 1
1 762 . 3 3 2 C 32 32 VAL CA C 216 63.329 66.180 -2.851 1
1 763 . 3 3 2 C 32 32 VAL CB C 216 33.373 31.183 2.190 1
1 766 . 3 3 2 C 32 32 VAL N N 216 118.287 119.366 -1.079 1
1 767 . 3 3 2 C 33 33 GLU H H 217 8.012 9.029 -1.017 1
1 768 . 3 3 2 C 33 33 GLU HA H 217 4.257 4.201 0.056 1
1 773 . 3 3 2 C 33 33 GLU C C 217 176.164 177.347 -1.183 1
1 774 . 3 3 2 C 33 33 GLU CA C 217 57.409 58.524 -1.115 1
1 775 . 3 3 2 C 33 33 GLU CB C 217 30.978 27.822 3.156 1
1 777 . 3 3 2 C 33 33 GLU N N 217 122.535 120.395 2.140 1
1 778 . 3 3 2 C 34 34 SER H H 218 8.037 7.202 0.835 1
1 779 . 3 3 2 C 34 34 SER HA H 218 4.514 4.624 -0.110 1
1 782 . 3 3 2 C 34 34 SER C C 218 176.451 174.236 2.215 1
1 783 . 3 3 2 C 34 34 SER CA C 218 58.987 58.342 0.645 1
1 784 . 3 3 2 C 34 34 SER CB C 218 64.569 63.861 0.708 1
1 785 . 3 3 2 C 34 34 SER N N 218 117.058 114.856 2.202 1
1 6 . 4 1 1 A 2 2 ALA H H 2 8.191 8.810 -0.619 1
1 7 . 4 1 1 A 2 2 ALA CA C 2 51.957 55.041 -3.084 1
1 8 . 4 1 1 A 2 2 ALA CB C 2 19.580 17.127 2.453 1
1 9 . 4 1 1 A 2 2 ALA N N 2 124.666 121.576 3.090 1
1 10 . 4 1 1 A 3 3 SER H H 3 8.829 8.742 0.087 1
1 11 . 4 1 1 A 3 3 SER CA C 3 57.221 62.161 -4.940 1
1 12 . 4 1 1 A 3 3 SER N N 3 119.917 113.100 6.817 1
1 13 . 4 1 1 A 4 4 PRO CA C 4 66.688 65.811 0.877 1
1 14 . 4 1 1 A 4 4 PRO CB C 4 32.553 30.875 1.678 1
1 15 . 4 1 1 A 5 5 LEU H H 5 9.146 7.327 1.819 1
1 16 . 4 1 1 A 5 5 LEU CA C 5 59.017 56.989 2.028 1
1 17 . 4 1 1 A 5 5 LEU CB C 5 42.341 42.544 -0.203 1
1 18 . 4 1 1 A 5 5 LEU N N 5 117.902 116.169 1.733 1
1 19 . 4 1 1 A 6 6 ASP H H 6 7.572 8.339 -0.767 1
1 20 . 4 1 1 A 6 6 ASP CA C 6 57.997 57.457 0.540 1
1 21 . 4 1 1 A 6 6 ASP CB C 6 40.910 40.111 0.799 1
1 22 . 4 1 1 A 6 6 ASP N N 6 118.259 118.362 -0.103 1
1 23 . 4 1 1 A 7 7 GLN H H 7 8.660 8.433 0.227 1
1 24 . 4 1 1 A 7 7 GLN HA H 7 4.064 4.184 -0.120 1
1 29 . 4 1 1 A 7 7 GLN CA C 7 59.270 57.524 1.746 1
1 30 . 4 1 1 A 7 7 GLN CB C 7 28.468 27.503 0.965 1
1 31 . 4 1 1 A 7 7 GLN N N 7 119.558 118.072 1.486 1
1 32 . 4 1 1 A 8 8 ALA H H 8 8.253 7.795 0.458 1
1 33 . 4 1 1 A 8 8 ALA CA C 8 55.519 54.810 0.709 1
1 34 . 4 1 1 A 8 8 ALA CB C 8 18.113 18.855 -0.742 1
1 35 . 4 1 1 A 8 8 ALA N N 8 123.628 122.780 0.848 1
1 36 . 4 1 1 A 9 9 ILE H H 9 8.134 8.229 -0.095 1
1 37 . 4 1 1 A 9 9 ILE CA C 9 65.261 64.487 0.774 1
1 38 . 4 1 1 A 9 9 ILE CB C 9 37.023 37.229 -0.206 1
1 39 . 4 1 1 A 9 9 ILE N N 9 117.056 117.085 -0.029 1
1 40 . 4 1 1 A 10 10 GLY H H 10 8.515 8.558 -0.043 1
1 41 . 4 1 1 A 10 10 GLY HA3 H 10 3.773 3.798 -0.025 1
1 42 . 4 1 1 A 10 10 GLY CA C 10 47.637 46.745 0.892 1
1 43 . 4 1 1 A 10 10 GLY N N 10 106.202 110.890 -4.688 1
1 44 . 4 1 1 A 11 11 LEU H H 11 8.212 8.028 0.184 1
1 45 . 4 1 1 A 11 11 LEU CA C 11 58.354 57.562 0.792 1
1 46 . 4 1 1 A 11 11 LEU CB C 11 41.683 41.666 0.017 1
1 47 . 4 1 1 A 11 11 LEU N N 11 124.624 123.716 0.908 1
1 48 . 4 1 1 A 12 12 LEU H H 12 7.971 7.803 0.168 1
1 49 . 4 1 1 A 12 12 LEU HA H 12 4.144 4.268 -0.124 1
1 59 . 4 1 1 A 12 12 LEU CA C 12 58.691 58.423 0.268 1
1 60 . 4 1 1 A 12 12 LEU CB C 12 40.657 41.659 -1.002 1
1 61 . 4 1 1 A 12 12 LEU N N 12 118.095 118.136 -0.041 1
1 62 . 4 1 1 A 13 13 ILE H H 13 8.379 8.268 0.111 1
1 63 . 4 1 1 A 13 13 ILE CA C 13 66.405 65.299 1.106 1
1 64 . 4 1 1 A 13 13 ILE CB C 13 38.916 38.169 0.747 1
1 65 . 4 1 1 A 13 13 ILE N N 13 121.161 119.916 1.245 1
1 66 . 4 1 1 A 14 14 GLY H H 14 8.823 8.545 0.278 1
1 67 . 4 1 1 A 14 14 GLY HA2 H 14 4.147 3.705 0.442 1
1 68 . 4 1 1 A 14 14 GLY HA3 H 14 3.982 3.714 0.268 1
1 69 . 4 1 1 A 14 14 GLY CA C 14 47.750 47.176 0.574 1
1 70 . 4 1 1 A 14 14 GLY N N 14 108.982 107.326 1.656 1
1 71 . 4 1 1 A 15 15 ILE H H 15 8.681 8.404 0.277 1
1 72 . 4 1 1 A 15 15 ILE CA C 15 64.996 64.853 0.143 1
1 73 . 4 1 1 A 15 15 ILE CB C 15 37.107 38.004 -0.897 1
1 74 . 4 1 1 A 15 15 ILE N N 15 121.601 122.643 -1.042 1
1 75 . 4 1 1 A 16 16 PHE H H 16 7.103 8.758 -1.655 1
1 76 . 4 1 1 A 16 16 PHE CA C 16 62.910 61.677 1.233 1
1 77 . 4 1 1 A 16 16 PHE CB C 16 38.782 39.042 -0.260 1
1 78 . 4 1 1 A 16 16 PHE N N 16 118.660 121.020 -2.360 1
1 79 . 4 1 1 A 17 17 HIS H H 17 7.591 8.442 -0.851 1
1 80 . 4 1 1 A 17 17 HIS HA H 17 4.793 4.195 0.598 1
1 82 . 4 1 1 A 17 17 HIS CA C 17 58.125 59.031 -0.906 1
1 83 . 4 1 1 A 17 17 HIS CB C 17 29.584 30.099 -0.515 1
1 84 . 4 1 1 A 17 17 HIS N N 17 114.968 118.773 -3.805 1
1 85 . 4 1 1 A 18 18 LYS H H 18 8.144 8.484 -0.340 1
1 86 . 4 1 1 A 18 18 LYS CA C 18 58.975 58.767 0.208 1
1 87 . 4 1 1 A 18 18 LYS CB C 18 32.379 31.952 0.427 1
1 88 . 4 1 1 A 18 18 LYS N N 18 122.373 117.484 4.889 1
1 89 . 4 1 1 A 19 19 TYR H H 19 6.999 7.322 -0.323 1
1 90 . 4 1 1 A 19 19 TYR CA C 19 60.318 60.819 -0.501 1
1 91 . 4 1 1 A 19 19 TYR CB C 19 40.355 38.164 2.191 1
1 92 . 4 1 1 A 19 19 TYR N N 19 113.614 118.359 -4.745 1
1 93 . 4 1 1 A 20 20 SER H H 20 8.432 7.717 0.715 1
1 94 . 4 1 1 A 20 20 SER CA C 20 61.897 62.743 -0.846 1
1 95 . 4 1 1 A 20 20 SER CB C 20 61.354 62.506 -1.152 1
1 96 . 4 1 1 A 20 20 SER N N 20 113.201 115.897 -2.696 1
1 97 . 4 1 1 A 21 21 GLY H H 21 7.678 7.873 -0.195 1
1 98 . 4 1 1 A 21 21 GLY HA2 H 21 4.195 3.878 0.317 1
1 99 . 4 1 1 A 21 21 GLY HA3 H 21 3.900 3.929 -0.029 1
1 100 . 4 1 1 A 21 21 GLY CA C 21 45.628 45.223 0.405 1
1 101 . 4 1 1 A 21 21 GLY N N 21 110.734 108.173 2.561 1
1 102 . 4 1 1 A 22 22 LYS H H 22 7.362 7.446 -0.084 1
1 103 . 4 1 1 A 22 22 LYS CA C 22 60.163 58.688 1.475 1
1 104 . 4 1 1 A 22 22 LYS CB C 22 32.554 33.022 -0.468 1
1 105 . 4 1 1 A 22 22 LYS N N 22 122.161 120.457 1.704 1
1 106 . 4 1 1 A 23 23 GLU H H 23 9.639 8.265 1.374 1
1 107 . 4 1 1 A 23 23 GLU CA C 23 54.449 56.333 -1.884 1
1 108 . 4 1 1 A 23 23 GLU N N 23 116.288 113.899 2.389 1
1 109 . 4 1 1 A 24 24 GLY HA2 H 24 3.912 4.014 -0.102 1
1 110 . 4 1 1 A 24 24 GLY HA3 H 24 3.787 4.026 -0.239 1
1 111 . 4 1 1 A 24 24 GLY CA C 24 45.898 44.206 1.692 1
1 112 . 4 1 1 A 25 25 ASP H H 25 8.204 8.552 -0.348 1
1 113 . 4 1 1 A 25 25 ASP CA C 25 55.252 53.620 1.632 1
1 114 . 4 1 1 A 25 25 ASP N N 25 125.671 120.212 5.459 1
1 115 . 4 1 1 A 26 26 LYS CA C 26 57.851 58.520 -0.669 1
1 116 . 4 1 1 A 26 26 LYS CB C 26 31.265 31.203 0.062 1
1 117 . 4 1 1 A 27 27 HIS H H 27 9.763 8.867 0.896 1
1 118 . 4 1 1 A 27 27 HIS CA C 27 55.580 55.821 -0.241 1
1 119 . 4 1 1 A 27 27 HIS CB C 27 30.936 29.213 1.723 1
1 120 . 4 1 1 A 27 27 HIS N N 27 118.108 117.104 1.004 1
1 121 . 4 1 1 A 28 28 THR H H 28 7.325 8.191 -0.866 1
1 126 . 4 1 1 A 28 28 THR CA C 28 60.128 60.633 -0.505 1
1 127 . 4 1 1 A 28 28 THR CB C 28 72.268 71.175 1.093 1
1 128 . 4 1 1 A 28 28 THR N N 28 106.920 115.342 -8.422 1
1 129 . 4 1 1 A 29 29 LEU H H 29 9.422 9.044 0.378 1
1 130 . 4 1 1 A 29 29 LEU HA H 29 5.368 5.310 0.058 1
1 140 . 4 1 1 A 29 29 LEU CA C 29 52.567 53.440 -0.873 1
1 141 . 4 1 1 A 29 29 LEU CB C 29 43.523 45.070 -1.547 1
1 142 . 4 1 1 A 29 29 LEU N N 29 125.021 127.181 -2.160 1
1 143 . 4 1 1 A 30 30 SER H H 30 10.485 8.671 1.814 1
1 144 . 4 1 1 A 30 30 SER CA C 30 56.653 57.092 -0.439 1
1 145 . 4 1 1 A 30 30 SER CB C 30 65.313 65.413 -0.100 1
1 146 . 4 1 1 A 30 30 SER N N 30 124.758 116.533 8.225 1
1 147 . 4 1 1 A 31 31 LYS H H 31 8.728 8.890 -0.162 1
1 148 . 4 1 1 A 31 31 LYS CA C 31 59.669 60.183 -0.514 1
1 149 . 4 1 1 A 31 31 LYS CB C 31 31.763 32.226 -0.463 1
1 150 . 4 1 1 A 31 31 LYS N N 31 119.459 121.168 -1.709 1
1 151 . 4 1 1 A 32 32 LYS H H 32 7.857 7.918 -0.061 1
1 152 . 4 1 1 A 32 32 LYS CA C 32 59.721 59.589 0.132 1
1 153 . 4 1 1 A 32 32 LYS CB C 32 32.901 32.198 0.703 1
1 154 . 4 1 1 A 32 32 LYS N N 32 117.933 119.698 -1.765 1
1 155 . 4 1 1 A 33 33 GLU H H 33 7.559 7.759 -0.200 1
1 156 . 4 1 1 A 33 33 GLU CA C 33 59.169 58.963 0.206 1
1 157 . 4 1 1 A 33 33 GLU CB C 33 31.014 29.521 1.493 1
1 158 . 4 1 1 A 33 33 GLU N N 33 120.407 119.135 1.272 1
1 159 . 4 1 1 A 34 34 LEU H H 34 8.833 8.304 0.529 1
1 160 . 4 1 1 A 34 34 LEU CA C 34 56.928 57.715 -0.787 1
1 161 . 4 1 1 A 34 34 LEU CB C 34 41.435 41.403 0.032 1
1 162 . 4 1 1 A 34 34 LEU N N 34 117.677 120.925 -3.248 1
1 163 . 4 1 1 A 35 35 LYS H H 35 8.010 8.229 -0.219 1
1 164 . 4 1 1 A 35 35 LYS CA C 35 60.692 59.718 0.974 1
1 165 . 4 1 1 A 35 35 LYS CB C 35 32.223 32.171 0.052 1
1 166 . 4 1 1 A 35 35 LYS N N 35 119.829 118.955 0.874 1
1 167 . 4 1 1 A 36 36 GLU H H 36 7.169 8.034 -0.865 1
1 168 . 4 1 1 A 36 36 GLU CA C 36 59.588 58.682 0.906 1
1 169 . 4 1 1 A 36 36 GLU CB C 36 29.342 29.418 -0.076 1
1 170 . 4 1 1 A 36 36 GLU N N 36 117.340 119.216 -1.876 1
1 171 . 4 1 1 A 37 37 LEU H H 37 7.478 8.001 -0.523 1
1 172 . 4 1 1 A 37 37 LEU CA C 37 59.674 57.587 2.087 1
1 173 . 4 1 1 A 37 37 LEU CB C 37 42.142 40.886 1.256 1
1 174 . 4 1 1 A 37 37 LEU N N 37 120.884 120.565 0.319 1
1 175 . 4 1 1 A 38 38 ILE H H 38 8.377 8.119 0.258 1
1 176 . 4 1 1 A 38 38 ILE CA C 38 65.651 65.560 0.091 1
1 177 . 4 1 1 A 38 38 ILE N N 38 118.450 119.967 -1.517 1
1 178 . 4 1 1 A 39 39 GLN H H 39 8.217 8.162 0.055 1
1 179 . 4 1 1 A 39 39 GLN CA C 39 59.788 58.979 0.809 1
1 180 . 4 1 1 A 39 39 GLN CB C 39 29.278 28.253 1.025 1
1 181 . 4 1 1 A 39 39 GLN N N 39 113.091 118.403 -5.312 1
1 182 . 4 1 1 A 40 40 LYS H H 40 8.426 8.157 0.269 1
1 183 . 4 1 1 A 40 40 LYS CA C 40 57.807 58.508 -0.701 1
1 184 . 4 1 1 A 40 40 LYS CB C 40 33.942 33.112 0.830 1
1 185 . 4 1 1 A 40 40 LYS N N 40 114.771 118.348 -3.577 1
1 186 . 4 1 1 A 41 41 GLU H H 41 8.496 8.285 0.211 1
1 187 . 4 1 1 A 41 41 GLU CA C 41 55.395 58.509 -3.114 1
1 188 . 4 1 1 A 41 41 GLU CB C 41 29.260 30.477 -1.217 1
1 189 . 4 1 1 A 41 41 GLU N N 41 112.546 119.055 -6.509 1
1 190 . 4 1 1 A 42 42 LEU H H 42 7.267 7.851 -0.584 1
1 191 . 4 1 1 A 42 42 LEU CA C 42 53.776 53.863 -0.087 1
1 192 . 4 1 1 A 42 42 LEU N N 42 118.657 119.978 -1.321 1
1 193 . 4 1 1 A 44 44 ILE CA C 44 62.210 60.788 1.422 1
1 194 . 4 1 1 A 44 44 ILE CB C 44 38.247 37.412 0.835 1
1 195 . 4 1 1 A 45 45 GLY H H 45 7.820 7.921 -0.101 1
1 196 . 4 1 1 A 45 45 GLY CA C 45 47.742 45.425 2.317 1
1 197 . 4 1 1 A 45 45 GLY N N 45 108.178 112.471 -4.293 1
1 198 . 4 1 1 A 46 46 SER H H 46 7.895 8.349 -0.454 1
1 199 . 4 1 1 A 46 46 SER CA C 46 59.958 60.256 -0.298 1
1 200 . 4 1 1 A 46 46 SER CB C 46 63.450 61.315 2.135 1
1 201 . 4 1 1 A 46 46 SER N N 46 113.038 112.232 0.806 1
1 202 . 4 1 1 A 47 47 LYS H H 47 7.736 8.420 -0.684 1
1 203 . 4 1 1 A 47 47 LYS CA C 47 55.636 58.407 -2.771 1
1 204 . 4 1 1 A 47 47 LYS CB C 47 33.103 31.119 1.984 1
1 205 . 4 1 1 A 47 47 LYS N N 47 119.422 118.338 1.084 1
1 206 . 4 1 1 A 48 48 LEU H H 48 6.988 8.507 -1.519 1
1 207 . 4 1 1 A 48 48 LEU HA H 48 4.497 4.609 -0.112 1
1 217 . 4 1 1 A 48 48 LEU CA C 48 54.517 54.690 -0.173 1
1 218 . 4 1 1 A 48 48 LEU CB C 48 42.987 42.522 0.465 1
1 219 . 4 1 1 A 48 48 LEU N N 48 118.908 125.093 -6.185 1
1 220 . 4 1 1 A 49 49 GLN H H 49 9.206 8.271 0.935 1
1 221 . 4 1 1 A 49 49 GLN HA H 49 4.486 4.287 0.199 1
1 223 . 4 1 1 A 49 49 GLN CA C 49 54.785 57.123 -2.338 1
1 224 . 4 1 1 A 49 49 GLN CB C 49 29.636 29.052 0.584 1
1 225 . 4 1 1 A 49 49 GLN N N 49 121.275 119.068 2.207 1
1 226 . 4 1 1 A 50 50 ASP H H 50 8.854 8.209 0.645 1
1 227 . 4 1 1 A 50 50 ASP CA C 50 59.078 58.050 1.028 1
1 228 . 4 1 1 A 50 50 ASP CB C 50 40.632 41.937 -1.305 1
1 229 . 4 1 1 A 50 50 ASP N N 50 123.430 121.287 2.143 1
1 230 . 4 1 1 A 51 51 ALA H H 51 8.720 8.065 0.655 1
1 231 . 4 1 1 A 51 51 ALA CA C 51 55.281 54.867 0.414 1
1 232 . 4 1 1 A 51 51 ALA CB C 51 18.205 18.109 0.096 1
1 233 . 4 1 1 A 51 51 ALA N N 51 117.829 121.295 -3.466 1
1 234 . 4 1 1 A 52 52 GLU H H 52 7.161 7.747 -0.586 1
1 235 . 4 1 1 A 52 52 GLU CA C 52 58.757 58.895 -0.138 1
1 236 . 4 1 1 A 52 52 GLU CB C 52 30.247 29.329 0.918 1
1 237 . 4 1 1 A 52 52 GLU N N 52 115.459 117.169 -1.710 1
1 238 . 4 1 1 A 53 53 ILE H H 53 7.962 8.103 -0.141 1
1 239 . 4 1 1 A 53 53 ILE CA C 53 65.525 65.061 0.464 1
1 240 . 4 1 1 A 53 53 ILE CB C 53 37.289 37.812 -0.523 1
1 241 . 4 1 1 A 53 53 ILE N N 53 120.414 121.514 -1.100 1
1 242 . 4 1 1 A 54 54 VAL H H 54 8.132 8.007 0.125 1
1 243 . 4 1 1 A 54 54 VAL CA C 54 67.290 65.291 1.999 1
1 244 . 4 1 1 A 54 54 VAL CB C 54 31.434 31.347 0.087 1
1 245 . 4 1 1 A 54 54 VAL N N 54 119.775 116.640 3.135 1
1 246 . 4 1 1 A 55 55 LYS H H 55 7.155 8.034 -0.879 1
1 247 . 4 1 1 A 55 55 LYS CA C 55 59.131 59.287 -0.156 1
1 248 . 4 1 1 A 55 55 LYS CB C 55 32.131 32.144 -0.013 1
1 249 . 4 1 1 A 55 55 LYS N N 55 119.175 120.732 -1.557 1
1 250 . 4 1 1 A 56 56 LEU H H 56 7.837 8.386 -0.549 1
1 251 . 4 1 1 A 56 56 LEU CA C 56 58.052 57.994 0.058 1
1 252 . 4 1 1 A 56 56 LEU CB C 56 41.878 41.601 0.277 1
1 253 . 4 1 1 A 56 56 LEU N N 56 119.679 121.293 -1.614 1
1 254 . 4 1 1 A 57 57 MET H H 57 8.385 8.657 -0.272 1
1 255 . 4 1 1 A 57 57 MET CA C 57 60.756 58.764 1.992 1
1 256 . 4 1 1 A 57 57 MET CB C 57 33.152 31.904 1.248 1
1 257 . 4 1 1 A 57 57 MET N N 57 115.116 119.454 -4.338 1
1 258 . 4 1 1 A 58 58 ASP H H 58 7.591 7.969 -0.378 1
1 259 . 4 1 1 A 58 58 ASP CA C 58 57.365 57.303 0.062 1
1 260 . 4 1 1 A 58 58 ASP CB C 58 40.858 41.075 -0.217 1
1 261 . 4 1 1 A 58 58 ASP N N 58 118.197 119.470 -1.273 1
1 262 . 4 1 1 A 59 59 ASP H H 59 7.725 8.330 -0.605 1
1 263 . 4 1 1 A 59 59 ASP CA C 59 56.830 57.490 -0.660 1
1 264 . 4 1 1 A 59 59 ASP CB C 59 40.567 40.299 0.268 1
1 265 . 4 1 1 A 59 59 ASP N N 59 118.481 118.441 0.040 1
1 266 . 4 1 1 A 60 60 LEU H H 60 7.703 8.048 -0.345 1
1 267 . 4 1 1 A 60 60 LEU CA C 60 56.564 57.748 -1.184 1
1 268 . 4 1 1 A 60 60 LEU CB C 60 42.714 41.215 1.499 1
1 269 . 4 1 1 A 60 60 LEU N N 60 116.935 120.954 -4.019 1
1 270 . 4 1 1 A 61 61 ASP H H 61 7.143 8.010 -0.867 1
1 271 . 4 1 1 A 61 61 ASP HA H 61 4.690 4.439 0.251 1
1 274 . 4 1 1 A 61 61 ASP CA C 61 52.286 56.451 -4.165 1
1 275 . 4 1 1 A 61 61 ASP CB C 61 39.245 41.068 -1.823 1
1 276 . 4 1 1 A 61 61 ASP N N 61 116.605 119.249 -2.644 1
1 277 . 4 1 1 A 62 62 ARG H H 62 7.786 8.123 -0.337 1
1 278 . 4 1 1 A 62 62 ARG CA C 62 58.328 59.510 -1.182 1
1 279 . 4 1 1 A 62 62 ARG CB C 62 30.106 29.913 0.193 1
1 280 . 4 1 1 A 62 62 ARG N N 62 125.967 118.026 7.941 1
1 281 . 4 1 1 A 63 63 ASN H H 63 7.945 7.692 0.253 1
1 282 . 4 1 1 A 63 63 ASN CA C 63 51.863 54.861 -2.998 1
1 283 . 4 1 1 A 63 63 ASN CB C 63 36.809 38.545 -1.736 1
1 284 . 4 1 1 A 63 63 ASN N N 63 112.434 116.588 -4.154 1
1 285 . 4 1 1 A 64 64 LYS H H 64 7.477 7.735 -0.258 1
1 286 . 4 1 1 A 64 64 LYS CA C 64 56.524 55.287 1.237 1
1 287 . 4 1 1 A 64 64 LYS N N 64 114.197 117.443 -3.246 1
1 288 . 4 1 1 A 65 65 ASP H H 65 8.345 8.746 -0.401 1
1 289 . 4 1 1 A 65 65 ASP CA C 65 52.969 55.722 -2.753 1
1 290 . 4 1 1 A 65 65 ASP CB C 65 40.329 43.146 -2.817 1
1 291 . 4 1 1 A 65 65 ASP N N 65 118.581 122.041 -3.460 1
1 292 . 4 1 1 A 66 66 GLN H H 66 9.945 8.122 1.823 1
1 293 . 4 1 1 A 66 66 GLN CA C 66 58.132 57.008 1.124 1
1 294 . 4 1 1 A 66 66 GLN CB C 66 26.035 30.744 -4.709 1
1 295 . 4 1 1 A 66 66 GLN N N 66 113.203 118.066 -4.863 1
1 296 . 4 1 1 A 67 67 GLU H H 67 7.880 7.921 -0.041 1
1 297 . 4 1 1 A 67 67 GLU HA H 67 4.910 5.000 -0.090 1
1 302 . 4 1 1 A 67 67 GLU CA C 67 54.082 54.868 -0.786 1
1 303 . 4 1 1 A 67 67 GLU CB C 67 33.174 32.974 0.200 1
1 304 . 4 1 1 A 67 67 GLU N N 67 118.554 115.108 3.446 1
1 305 . 4 1 1 A 68 68 VAL H H 68 9.669 9.496 0.173 1
1 306 . 4 1 1 A 68 68 VAL HA H 68 5.465 4.641 0.824 1
1 314 . 4 1 1 A 68 68 VAL CA C 68 61.079 61.736 -0.657 1
1 315 . 4 1 1 A 68 68 VAL CB C 68 33.280 32.043 1.237 1
1 316 . 4 1 1 A 68 68 VAL N N 68 126.572 123.233 3.339 1
1 317 . 4 1 1 A 69 69 ASN H H 69 8.985 8.798 0.187 1
1 318 . 4 1 1 A 69 69 ASN CA C 69 50.812 53.529 -2.717 1
1 319 . 4 1 1 A 69 69 ASN CB C 69 38.609 40.354 -1.745 1
1 320 . 4 1 1 A 69 69 ASN N N 69 127.472 126.743 0.729 1
1 321 . 4 1 1 A 70 70 PHE H H 70 9.100 8.975 0.125 1
1 322 . 4 1 1 A 70 70 PHE CA C 70 63.279 61.939 1.340 1
1 323 . 4 1 1 A 70 70 PHE CB C 70 38.741 39.742 -1.001 1
1 324 . 4 1 1 A 70 70 PHE N N 70 119.972 127.289 -7.317 1
1 325 . 4 1 1 A 71 71 GLN H H 71 8.342 8.336 0.006 1
1 326 . 4 1 1 A 71 71 GLN HA H 71 3.923 3.810 0.113 1
1 329 . 4 1 1 A 71 71 GLN CA C 71 59.866 58.627 1.239 1
1 330 . 4 1 1 A 71 71 GLN CB C 71 27.878 28.418 -0.540 1
1 331 . 4 1 1 A 71 71 GLN N N 71 118.216 117.816 0.400 1
1 332 . 4 1 1 A 72 72 GLU H H 72 8.721 7.848 0.873 1
1 333 . 4 1 1 A 72 72 GLU HA H 72 4.147 4.095 0.052 1
1 338 . 4 1 1 A 72 72 GLU CA C 72 59.313 58.995 0.318 1
1 339 . 4 1 1 A 72 72 GLU CB C 72 30.233 29.539 0.694 1
1 340 . 4 1 1 A 72 72 GLU N N 72 121.455 119.152 2.303 1
1 341 . 4 1 1 A 73 73 TYR H H 73 8.536 8.143 0.393 1
1 342 . 4 1 1 A 73 73 TYR CA C 73 60.961 61.188 -0.227 1
1 343 . 4 1 1 A 73 73 TYR CB C 73 38.724 38.845 -0.121 1
1 344 . 4 1 1 A 73 73 TYR N N 73 123.356 121.976 1.380 1
1 345 . 4 1 1 A 74 74 ILE H H 74 8.642 7.794 0.848 1
1 346 . 4 1 1 A 74 74 ILE CA C 74 61.880 63.731 -1.851 1
1 347 . 4 1 1 A 74 74 ILE CB C 74 36.077 36.471 -0.394 1
1 348 . 4 1 1 A 74 74 ILE N N 74 119.799 120.011 -0.212 1
1 349 . 4 1 1 A 75 75 THR H H 75 7.959 7.989 -0.030 1
1 354 . 4 1 1 A 75 75 THR CA C 75 67.056 66.681 0.375 1
1 355 . 4 1 1 A 75 75 THR CB C 75 68.386 68.690 -0.304 1
1 356 . 4 1 1 A 75 75 THR N N 75 119.486 117.755 1.731 1
1 357 . 4 1 1 A 76 76 PHE H H 76 7.450 8.344 -0.894 1
1 358 . 4 1 1 A 76 76 PHE CA C 76 59.010 61.660 -2.650 1
1 359 . 4 1 1 A 76 76 PHE CB C 76 38.139 39.099 -0.960 1
1 360 . 4 1 1 A 76 76 PHE N N 76 122.873 121.911 0.962 1
1 361 . 4 1 1 A 77 77 LEU H H 77 7.829 8.325 -0.496 1
1 362 . 4 1 1 A 77 77 LEU CA C 77 57.450 57.620 -0.170 1
1 363 . 4 1 1 A 77 77 LEU CB C 77 40.560 40.839 -0.279 1
1 364 . 4 1 1 A 77 77 LEU N N 77 117.405 118.437 -1.032 1
1 365 . 4 1 1 A 78 78 GLY H H 78 8.093 7.942 0.151 1
1 366 . 4 1 1 A 78 78 GLY HA2 H 78 3.661 3.725 -0.064 1
1 367 . 4 1 1 A 78 78 GLY HA3 H 78 3.594 3.734 -0.140 1
1 368 . 4 1 1 A 78 78 GLY CA C 78 47.442 47.181 0.261 1
1 369 . 4 1 1 A 78 78 GLY N N 78 105.528 105.911 -0.383 1
1 370 . 4 1 1 A 79 79 ALA H H 79 7.759 7.581 0.178 1
1 371 . 4 1 1 A 79 79 ALA CA C 79 55.153 54.428 0.725 1
1 372 . 4 1 1 A 79 79 ALA CB C 79 17.768 18.199 -0.431 1
1 373 . 4 1 1 A 79 79 ALA N N 79 124.488 124.942 -0.454 1
1 374 . 4 1 1 A 80 80 LEU H H 80 7.963 7.875 0.088 1
1 375 . 4 1 1 A 80 80 LEU CA C 80 57.464 57.200 0.264 1
1 376 . 4 1 1 A 80 80 LEU CB C 80 41.496 41.205 0.291 1
1 377 . 4 1 1 A 80 80 LEU N N 80 117.869 120.503 -2.634 1
1 378 . 4 1 1 A 81 81 ALA H H 81 8.365 8.002 0.363 1
1 379 . 4 1 1 A 81 81 ALA CA C 81 55.475 55.252 0.223 1
1 380 . 4 1 1 A 81 81 ALA CB C 81 17.483 18.498 -1.015 1
1 381 . 4 1 1 A 81 81 ALA N N 81 119.054 121.389 -2.335 1
1 382 . 4 1 1 A 82 82 MET H H 82 8.112 7.968 0.144 1
1 383 . 4 1 1 A 82 82 MET CA C 82 59.516 58.142 1.374 1
1 384 . 4 1 1 A 82 82 MET CB C 82 32.550 32.478 0.072 1
1 385 . 4 1 1 A 82 82 MET N N 82 115.364 117.984 -2.620 1
1 386 . 4 1 1 A 83 83 ILE H H 83 7.981 8.215 -0.234 1
1 387 . 4 1 1 A 83 83 ILE HA H 83 3.839 3.785 0.054 1
1 391 . 4 1 1 A 83 83 ILE CA C 83 64.467 63.451 1.016 1
1 392 . 4 1 1 A 83 83 ILE CB C 83 37.312 37.472 -0.160 1
1 393 . 4 1 1 A 83 83 ILE N N 83 120.887 119.469 1.418 1
1 394 . 4 1 1 A 84 84 TYR H H 84 8.731 7.505 1.226 1
1 395 . 4 1 1 A 84 84 TYR N N 84 120.933 121.537 -0.604 1
1 396 . 4 1 1 A 87 87 ALA H H 87 7.829 7.841 -0.012 1
1 397 . 4 1 1 A 87 87 ALA CA C 87 53.768 54.191 -0.423 1
1 398 . 4 1 1 A 87 87 ALA CB C 87 18.504 18.406 0.098 1
1 399 . 4 1 1 A 87 87 ALA N N 87 120.274 121.569 -1.295 1
1 400 . 4 1 1 A 88 88 LEU H H 88 7.499 7.284 0.215 1
1 401 . 4 1 1 A 88 88 LEU CA C 88 55.605 54.730 0.875 1
1 402 . 4 1 1 A 88 88 LEU CB C 88 42.047 41.789 0.258 1
1 403 . 4 1 1 A 88 88 LEU N N 88 117.356 116.179 1.177 1
1 404 . 4 1 1 A 89 89 LYS H H 89 7.561 7.836 -0.275 1
1 405 . 4 1 1 A 89 89 LYS CA C 89 56.865 56.591 0.274 1
1 406 . 4 1 1 A 89 89 LYS CB C 89 32.592 34.835 -2.243 1
1 407 . 4 1 1 A 89 89 LYS N N 89 119.289 116.825 2.464 1
1 416 . 4 3 2 C 6 6 GLU H H 190 8.385 8.437 -0.052 1
1 417 . 4 3 2 C 6 6 GLU HA H 190 4.153 4.451 -0.298 1
1 422 . 4 3 2 C 6 6 GLU C C 190 175.031 176.488 -1.457 1
1 423 . 4 3 2 C 6 6 GLU CA C 190 58.866 55.797 3.069 1
1 424 . 4 3 2 C 6 6 GLU CB C 190 30.751 29.375 1.376 1
1 426 . 4 3 2 C 6 6 GLU N N 190 122.715 123.736 -1.021 1
1 427 . 4 3 2 C 7 7 GLY H H 191 8.475 7.738 0.737 1
1 428 . 4 3 2 C 7 7 GLY HA2 H 191 3.887 4.059 -0.172 1
1 429 . 4 3 2 C 7 7 GLY HA3 H 191 3.887 4.061 -0.174 1
1 430 . 4 3 2 C 7 7 GLY C C 191 177.922 174.130 3.792 1
1 431 . 4 3 2 C 7 7 GLY CA C 191 46.884 44.617 2.267 1
1 432 . 4 3 2 C 7 7 GLY N N 191 109.009 108.989 0.020 1
1 433 . 4 3 2 C 8 8 LEU HA H 192 4.095 4.028 0.067 1
1 443 . 4 3 2 C 8 8 LEU CA C 192 58.154 58.022 0.132 1
1 444 . 4 3 2 C 8 8 LEU CB C 192 42.789 41.492 1.297 1
1 448 . 4 3 2 C 9 9 MET H H 193 8.250 8.539 -0.289 1
1 449 . 4 3 2 C 9 9 MET HA H 193 4.150 4.243 -0.093 1
1 457 . 4 3 2 C 9 9 MET C C 193 178.421 177.421 1.000 1
1 458 . 4 3 2 C 9 9 MET CA C 193 58.818 57.757 1.061 1
1 459 . 4 3 2 C 9 9 MET CB C 193 32.360 32.002 0.358 1
1 462 . 4 3 2 C 9 9 MET N N 193 117.049 118.048 -0.999 1
1 463 . 4 3 2 C 10 10 ASN H H 194 7.892 7.681 0.211 1
1 464 . 4 3 2 C 10 10 ASN HA H 194 4.468 4.679 -0.211 1
1 469 . 4 3 2 C 10 10 ASN C C 194 178.099 176.519 1.580 1
1 470 . 4 3 2 C 10 10 ASN CA C 194 56.644 54.898 1.746 1
1 471 . 4 3 2 C 10 10 ASN CB C 194 39.100 38.658 0.442 1
1 472 . 4 3 2 C 10 10 ASN N N 194 117.034 118.893 -1.859 1
1 474 . 4 3 2 C 11 11 VAL H H 195 7.651 7.952 -0.301 1
1 475 . 4 3 2 C 11 11 VAL HA H 195 3.735 3.863 -0.128 1
1 483 . 4 3 2 C 11 11 VAL C C 195 177.657 178.272 -0.615 1
1 484 . 4 3 2 C 11 11 VAL CA C 195 66.710 65.061 1.649 1
1 485 . 4 3 2 C 11 11 VAL CB C 195 32.468 32.033 0.435 1
1 488 . 4 3 2 C 11 11 VAL N N 195 119.878 119.058 0.820 1
1 489 . 4 3 2 C 12 12 LEU H H 196 8.030 8.412 -0.382 1
1 490 . 4 3 2 C 12 12 LEU HA H 196 4.013 4.037 -0.024 1
1 500 . 4 3 2 C 12 12 LEU C C 196 177.540 179.838 -2.298 1
1 501 . 4 3 2 C 12 12 LEU CA C 196 58.489 57.439 1.050 1
1 502 . 4 3 2 C 12 12 LEU CB C 196 42.457 41.267 1.190 1
1 506 . 4 3 2 C 12 12 LEU N N 196 119.499 119.443 0.056 1
1 507 . 4 3 2 C 13 13 LYS H H 197 8.015 8.201 -0.186 1
1 508 . 4 3 2 C 13 13 LYS HA H 197 3.949 4.214 -0.265 1
1 517 . 4 3 2 C 13 13 LYS C C 197 178.419 178.180 0.239 1
1 518 . 4 3 2 C 13 13 LYS CA C 197 60.191 59.058 1.133 1
1 519 . 4 3 2 C 13 13 LYS CB C 197 33.075 31.841 1.234 1
1 523 . 4 3 2 C 13 13 LYS N N 197 117.888 118.315 -0.427 1
1 524 . 4 3 2 C 14 14 LYS H H 198 7.506 7.810 -0.304 1
1 525 . 4 3 2 C 14 14 LYS HA H 198 4.127 4.119 0.008 1
1 534 . 4 3 2 C 14 14 LYS C C 198 178.262 178.379 -0.117 1
1 535 . 4 3 2 C 14 14 LYS CA C 198 59.161 58.487 0.674 1
1 536 . 4 3 2 C 14 14 LYS CB C 198 32.956 31.898 1.058 1
1 540 . 4 3 2 C 14 14 LYS N N 198 118.321 118.715 -0.394 1
1 541 . 4 3 2 C 15 15 ILE H H 199 7.780 7.390 0.390 1
1 542 . 4 3 2 C 15 15 ILE HA H 199 3.787 3.965 -0.178 1
1 552 . 4 3 2 C 15 15 ILE C C 199 178.647 177.834 0.813 1
1 553 . 4 3 2 C 15 15 ILE CA C 199 64.912 62.993 1.919 1
1 554 . 4 3 2 C 15 15 ILE CB C 199 38.780 37.736 1.044 1
1 558 . 4 3 2 C 15 15 ILE N N 199 118.644 118.012 0.632 1
1 559 . 4 3 2 C 16 16 TYR H H 200 7.918 8.427 -0.509 1
1 560 . 4 3 2 C 16 16 TYR HA H 200 4.252 4.064 0.188 1
1 567 . 4 3 2 C 16 16 TYR C C 200 177.806 177.651 0.155 1
1 568 . 4 3 2 C 16 16 TYR CA C 200 61.171 61.854 -0.683 1
1 569 . 4 3 2 C 16 16 TYR CB C 200 39.245 38.991 0.254 1
1 573 . 4 3 2 C 16 16 TYR N N 200 118.683 122.574 -3.891 1
1 574 . 4 3 2 C 17 17 GLU H H 201 8.089 8.349 -0.260 1
1 575 . 4 3 2 C 17 17 GLU HA H 201 4.124 4.122 0.002 1
1 580 . 4 3 2 C 17 17 GLU C C 201 177.414 176.556 0.858 1
1 581 . 4 3 2 C 17 17 GLU CA C 201 58.784 58.455 0.329 1
1 582 . 4 3 2 C 17 17 GLU CB C 201 30.747 29.154 1.593 1
1 584 . 4 3 2 C 17 17 GLU N N 201 119.409 118.095 1.314 1
1 585 . 4 3 2 C 18 18 ASP H H 202 8.023 7.889 0.134 1
1 586 . 4 3 2 C 18 18 ASP HA H 202 4.657 4.807 -0.150 1
1 589 . 4 3 2 C 18 18 ASP C C 202 177.346 176.497 0.849 1
1 590 . 4 3 2 C 18 18 ASP CA C 202 55.496 53.251 2.245 1
1 591 . 4 3 2 C 18 18 ASP CB C 202 42.023 40.931 1.092 1
1 592 . 4 3 2 C 18 18 ASP N N 202 119.459 119.524 -0.065 1
1 593 . 4 3 2 C 19 19 GLY H H 203 7.933 7.855 0.078 1
1 594 . 4 3 2 C 19 19 GLY HA2 H 203 3.938 4.081 -0.143 1
1 595 . 4 3 2 C 19 19 GLY HA3 H 203 3.938 4.099 -0.161 1
1 596 . 4 3 2 C 19 19 GLY C C 203 177.240 172.205 5.035 1
1 597 . 4 3 2 C 19 19 GLY CA C 203 46.309 45.525 0.784 1
1 598 . 4 3 2 C 19 19 GLY N N 203 108.518 107.947 0.571 1
1 599 . 4 3 2 C 20 20 ASP H H 204 8.091 8.533 -0.442 1
1 600 . 4 3 2 C 20 20 ASP HA H 204 4.616 4.656 -0.040 1
1 603 . 4 3 2 C 20 20 ASP C C 204 173.979 176.944 -2.965 1
1 604 . 4 3 2 C 20 20 ASP CA C 204 55.064 54.549 0.515 1
1 605 . 4 3 2 C 20 20 ASP CB C 204 42.203 42.938 -0.735 1
1 606 . 4 3 2 C 20 20 ASP N N 204 120.172 121.879 -1.707 1
1 607 . 4 3 2 C 21 21 ASP H H 205 8.352 9.266 -0.914 1
1 608 . 4 3 2 C 21 21 ASP HA H 205 4.468 4.384 0.084 1
1 611 . 4 3 2 C 21 21 ASP C C 205 176.432 177.657 -1.225 1
1 612 . 4 3 2 C 21 21 ASP CA C 205 56.663 56.860 -0.197 1
1 613 . 4 3 2 C 21 21 ASP CB C 205 41.918 40.595 1.323 1
1 614 . 4 3 2 C 21 21 ASP N N 205 121.515 127.623 -6.108 1
1 615 . 4 3 2 C 22 22 ASP H H 206 8.239 8.197 0.042 1
1 616 . 4 3 2 C 22 22 ASP HA H 206 4.455 4.616 -0.161 1
1 619 . 4 3 2 C 22 22 ASP C C 206 177.449 178.766 -1.317 1
1 620 . 4 3 2 C 22 22 ASP CA C 206 57.165 56.409 0.756 1
1 621 . 4 3 2 C 22 22 ASP CB C 206 41.820 40.443 1.377 1
1 622 . 4 3 2 C 22 22 ASP N N 206 120.156 118.289 1.867 1
1 623 . 4 3 2 C 23 23 MET H H 207 8.300 7.889 0.411 1
1 624 . 4 3 2 C 23 23 MET HA H 207 4.255 4.155 0.100 1
1 632 . 4 3 2 C 23 23 MET C C 207 178.412 178.361 0.051 1
1 633 . 4 3 2 C 23 23 MET CA C 207 58.065 58.530 -0.465 1
1 634 . 4 3 2 C 23 23 MET CB C 207 32.488 32.104 0.384 1
1 637 . 4 3 2 C 23 23 MET N N 207 120.707 119.697 1.010 1
1 638 . 4 3 2 C 24 24 LYS H H 208 8.047 8.035 0.012 1
1 639 . 4 3 2 C 24 24 LYS HA H 208 3.946 4.035 -0.089 1
1 648 . 4 3 2 C 24 24 LYS C C 208 178.008 179.212 -1.204 1
1 649 . 4 3 2 C 24 24 LYS CA C 208 59.847 59.590 0.257 1
1 650 . 4 3 2 C 24 24 LYS CB C 208 32.983 32.084 0.899 1
1 654 . 4 3 2 C 24 24 LYS N N 208 119.504 118.747 0.757 1
1 655 . 4 3 2 C 25 25 ARG H H 209 7.891 7.820 0.071 1
1 656 . 4 3 2 C 25 25 ARG HA H 209 4.168 4.149 0.019 1
1 663 . 4 3 2 C 25 25 ARG C C 209 178.100 178.681 -0.581 1
1 664 . 4 3 2 C 25 25 ARG CA C 209 58.810 59.046 -0.236 1
1 665 . 4 3 2 C 25 25 ARG CB C 209 31.080 29.758 1.322 1
1 668 . 4 3 2 C 25 25 ARG N N 209 118.378 119.043 -0.665 1
1 669 . 4 3 2 C 26 26 THR H H 210 7.869 8.276 -0.407 1
1 670 . 4 3 2 C 26 26 THR HA H 210 4.023 4.023 0.000 1
1 675 . 4 3 2 C 26 26 THR C C 210 177.984 177.090 0.894 1
1 676 . 4 3 2 C 26 26 THR CA C 210 65.747 67.141 -1.394 1
1 677 . 4 3 2 C 26 26 THR CB C 210 69.683 68.880 0.803 1
1 679 . 4 3 2 C 26 26 THR N N 210 115.443 118.482 -3.039 1
1 680 . 4 3 2 C 27 27 ILE H H 211 7.901 8.001 -0.100 1
1 681 . 4 3 2 C 27 27 ILE HA H 211 4.142 3.864 0.278 1
1 691 . 4 3 2 C 27 27 ILE C C 211 175.595 177.835 -2.240 1
1 692 . 4 3 2 C 27 27 ILE CA C 211 63.528 64.703 -1.175 1
1 693 . 4 3 2 C 27 27 ILE CB C 211 38.982 37.722 1.260 1
1 697 . 4 3 2 C 27 27 ILE N N 211 121.265 117.081 4.184 1
1 698 . 4 3 2 C 28 28 ASN HA H 212 4.465 4.434 0.031 1
1 703 . 4 3 2 C 28 28 ASN CA C 212 55.182 56.496 -1.314 1
1 704 . 4 3 2 C 28 28 ASN CB C 212 39.480 38.833 0.647 1
1 706 . 4 3 2 C 29 29 LYS H H 213 7.968 8.358 -0.390 1
1 707 . 4 3 2 C 29 29 LYS HA H 213 4.072 4.062 0.010 1
1 716 . 4 3 2 C 29 29 LYS C C 213 176.218 178.793 -2.575 1
1 717 . 4 3 2 C 29 29 LYS CA C 213 58.489 59.049 -0.560 1
1 718 . 4 3 2 C 29 29 LYS CB C 213 33.165 32.221 0.944 1
1 722 . 4 3 2 C 29 29 LYS N N 213 120.820 118.053 2.767 1
1 723 . 4 3 2 C 30 30 ALA H H 214 7.865 8.097 -0.232 1
1 724 . 4 3 2 C 30 30 ALA HA H 214 4.217 4.175 0.042 1
1 728 . 4 3 2 C 30 30 ALA C C 214 177.041 179.654 -2.613 1
1 729 . 4 3 2 C 30 30 ALA CA C 214 54.104 54.900 -0.796 1
1 730 . 4 3 2 C 30 30 ALA CB C 214 19.496 17.893 1.603 1
1 731 . 4 3 2 C 30 30 ALA N N 214 121.571 121.238 0.333 1
1 732 . 4 3 2 C 31 31 TRP H H 215 7.831 7.446 0.385 1
1 733 . 4 3 2 C 31 31 TRP HA H 215 4.598 4.284 0.314 1
1 742 . 4 3 2 C 31 31 TRP C C 215 178.088 178.081 0.007 1
1 743 . 4 3 2 C 31 31 TRP CA C 215 58.432 61.606 -3.174 1
1 744 . 4 3 2 C 31 31 TRP CB C 215 30.472 29.220 1.252 1
1 750 . 4 3 2 C 31 31 TRP N N 215 118.141 120.618 -2.477 1
1 752 . 4 3 2 C 32 32 VAL H H 216 7.594 8.718 -1.124 1
1 753 . 4 3 2 C 32 32 VAL HA H 216 3.978 3.709 0.269 1
1 761 . 4 3 2 C 32 32 VAL C C 216 176.574 179.007 -2.433 1
1 762 . 4 3 2 C 32 32 VAL CA C 216 63.329 66.691 -3.362 1
1 763 . 4 3 2 C 32 32 VAL CB C 216 33.373 31.569 1.804 1
1 766 . 4 3 2 C 32 32 VAL N N 216 118.287 119.766 -1.479 1
1 767 . 4 3 2 C 33 33 GLU H H 217 8.012 8.218 -0.206 1
1 768 . 4 3 2 C 33 33 GLU HA H 217 4.257 4.293 -0.036 1
1 773 . 4 3 2 C 33 33 GLU C C 217 176.164 175.754 0.410 1
1 774 . 4 3 2 C 33 33 GLU CA C 217 57.409 57.764 -0.355 1
1 775 . 4 3 2 C 33 33 GLU CB C 217 30.978 29.493 1.485 1
1 777 . 4 3 2 C 33 33 GLU N N 217 122.535 119.940 2.595 1
1 778 . 4 3 2 C 34 34 SER H H 218 8.037 7.815 0.222 1
1 779 . 4 3 2 C 34 34 SER HA H 218 4.514 5.116 -0.602 1
1 782 . 4 3 2 C 34 34 SER C C 218 176.451 173.131 3.320 1
1 783 . 4 3 2 C 34 34 SER CA C 218 58.987 57.376 1.611 1
1 784 . 4 3 2 C 34 34 SER CB C 218 64.569 65.943 -1.374 1
1 785 . 4 3 2 C 34 34 SER N N 218 117.058 116.296 0.762 1
1 6 . 5 1 1 A 2 2 ALA H H 2 8.191 9.048 -0.857 1
1 7 . 5 1 1 A 2 2 ALA CA C 2 51.957 54.953 -2.996 1
1 8 . 5 1 1 A 2 2 ALA CB C 2 19.580 18.252 1.328 1
1 9 . 5 1 1 A 2 2 ALA N N 2 124.666 126.329 -1.663 1
1 10 . 5 1 1 A 3 3 SER H H 3 8.829 8.232 0.597 1
1 11 . 5 1 1 A 3 3 SER CA C 3 57.221 62.838 -5.617 1
1 12 . 5 1 1 A 3 3 SER N N 3 119.917 113.217 6.700 1
1 13 . 5 1 1 A 4 4 PRO CA C 4 66.688 65.294 1.394 1
1 14 . 5 1 1 A 4 4 PRO CB C 4 32.553 31.030 1.523 1
1 15 . 5 1 1 A 5 5 LEU H H 5 9.146 7.357 1.789 1
1 16 . 5 1 1 A 5 5 LEU CA C 5 59.017 56.993 2.024 1
1 17 . 5 1 1 A 5 5 LEU CB C 5 42.341 42.608 -0.267 1
1 18 . 5 1 1 A 5 5 LEU N N 5 117.902 117.621 0.281 1
1 19 . 5 1 1 A 6 6 ASP H H 6 7.572 8.521 -0.949 1
1 20 . 5 1 1 A 6 6 ASP CA C 6 57.997 57.711 0.286 1
1 21 . 5 1 1 A 6 6 ASP CB C 6 40.910 41.845 -0.935 1
1 22 . 5 1 1 A 6 6 ASP N N 6 118.259 119.378 -1.119 1
1 23 . 5 1 1 A 7 7 GLN H H 7 8.660 8.483 0.177 1
1 24 . 5 1 1 A 7 7 GLN HA H 7 4.064 4.063 0.001 1
1 29 . 5 1 1 A 7 7 GLN CA C 7 59.270 58.594 0.676 1
1 30 . 5 1 1 A 7 7 GLN CB C 7 28.468 27.653 0.815 1
1 31 . 5 1 1 A 7 7 GLN N N 7 119.558 116.877 2.681 1
1 32 . 5 1 1 A 8 8 ALA H H 8 8.253 7.955 0.298 1
1 33 . 5 1 1 A 8 8 ALA CA C 8 55.519 54.828 0.691 1
1 34 . 5 1 1 A 8 8 ALA CB C 8 18.113 18.580 -0.467 1
1 35 . 5 1 1 A 8 8 ALA N N 8 123.628 121.969 1.659 1
1 36 . 5 1 1 A 9 9 ILE H H 9 8.134 8.214 -0.080 1
1 37 . 5 1 1 A 9 9 ILE CA C 9 65.261 64.313 0.948 1
1 38 . 5 1 1 A 9 9 ILE CB C 9 37.023 37.229 -0.206 1
1 39 . 5 1 1 A 9 9 ILE N N 9 117.056 116.987 0.069 1
1 40 . 5 1 1 A 10 10 GLY H H 10 8.515 8.358 0.157 1
1 41 . 5 1 1 A 10 10 GLY HA3 H 10 3.773 3.719 0.054 1
1 42 . 5 1 1 A 10 10 GLY CA C 10 47.637 46.926 0.711 1
1 43 . 5 1 1 A 10 10 GLY N N 10 106.202 110.758 -4.556 1
1 44 . 5 1 1 A 11 11 LEU H H 11 8.212 7.926 0.286 1
1 45 . 5 1 1 A 11 11 LEU CA C 11 58.354 57.519 0.835 1
1 46 . 5 1 1 A 11 11 LEU CB C 11 41.683 41.668 0.015 1
1 47 . 5 1 1 A 11 11 LEU N N 11 124.624 123.610 1.014 1
1 48 . 5 1 1 A 12 12 LEU H H 12 7.971 8.157 -0.186 1
1 49 . 5 1 1 A 12 12 LEU HA H 12 4.144 4.263 -0.119 1
1 59 . 5 1 1 A 12 12 LEU CA C 12 58.691 58.527 0.164 1
1 60 . 5 1 1 A 12 12 LEU CB C 12 40.657 41.490 -0.833 1
1 61 . 5 1 1 A 12 12 LEU N N 12 118.095 118.447 -0.352 1
1 62 . 5 1 1 A 13 13 ILE H H 13 8.379 8.203 0.176 1
1 63 . 5 1 1 A 13 13 ILE CA C 13 66.405 65.353 1.052 1
1 64 . 5 1 1 A 13 13 ILE CB C 13 38.916 37.590 1.326 1
1 65 . 5 1 1 A 13 13 ILE N N 13 121.161 120.194 0.967 1
1 66 . 5 1 1 A 14 14 GLY H H 14 8.823 8.551 0.272 1
1 67 . 5 1 1 A 14 14 GLY HA2 H 14 4.147 3.874 0.273 1
1 68 . 5 1 1 A 14 14 GLY HA3 H 14 3.982 3.877 0.105 1
1 69 . 5 1 1 A 14 14 GLY CA C 14 47.750 47.494 0.256 1
1 70 . 5 1 1 A 14 14 GLY N N 14 108.982 107.768 1.214 1
1 71 . 5 1 1 A 15 15 ILE H H 15 8.681 8.664 0.017 1
1 72 . 5 1 1 A 15 15 ILE CA C 15 64.996 64.509 0.487 1
1 73 . 5 1 1 A 15 15 ILE CB C 15 37.107 37.294 -0.187 1
1 74 . 5 1 1 A 15 15 ILE N N 15 121.601 122.545 -0.944 1
1 75 . 5 1 1 A 16 16 PHE H H 16 7.103 8.191 -1.088 1
1 76 . 5 1 1 A 16 16 PHE CA C 16 62.910 61.477 1.433 1
1 77 . 5 1 1 A 16 16 PHE CB C 16 38.782 39.232 -0.450 1
1 78 . 5 1 1 A 16 16 PHE N N 16 118.660 121.687 -3.027 1
1 79 . 5 1 1 A 17 17 HIS H H 17 7.591 8.741 -1.150 1
1 80 . 5 1 1 A 17 17 HIS HA H 17 4.793 4.372 0.421 1
1 82 . 5 1 1 A 17 17 HIS CA C 17 58.125 59.076 -0.951 1
1 83 . 5 1 1 A 17 17 HIS CB C 17 29.584 29.326 0.258 1
1 84 . 5 1 1 A 17 17 HIS N N 17 114.968 118.155 -3.187 1
1 85 . 5 1 1 A 18 18 LYS H H 18 8.144 8.215 -0.071 1
1 86 . 5 1 1 A 18 18 LYS CA C 18 58.975 59.301 -0.326 1
1 87 . 5 1 1 A 18 18 LYS CB C 18 32.379 32.141 0.238 1
1 88 . 5 1 1 A 18 18 LYS N N 18 122.373 119.141 3.232 1
1 89 . 5 1 1 A 19 19 TYR H H 19 6.999 7.491 -0.492 1
1 90 . 5 1 1 A 19 19 TYR CA C 19 60.318 60.714 -0.396 1
1 91 . 5 1 1 A 19 19 TYR CB C 19 40.355 38.450 1.905 1
1 92 . 5 1 1 A 19 19 TYR N N 19 113.614 118.774 -5.160 1
1 93 . 5 1 1 A 20 20 SER H H 20 8.432 7.863 0.569 1
1 94 . 5 1 1 A 20 20 SER CA C 20 61.897 62.686 -0.789 1
1 95 . 5 1 1 A 20 20 SER CB C 20 61.354 62.404 -1.050 1
1 96 . 5 1 1 A 20 20 SER N N 20 113.201 116.261 -3.060 1
1 97 . 5 1 1 A 21 21 GLY H H 21 7.678 7.988 -0.310 1
1 98 . 5 1 1 A 21 21 GLY HA2 H 21 4.195 3.806 0.389 1
1 99 . 5 1 1 A 21 21 GLY HA3 H 21 3.900 3.811 0.089 1
1 100 . 5 1 1 A 21 21 GLY CA C 21 45.628 46.033 -0.405 1
1 101 . 5 1 1 A 21 21 GLY N N 21 110.734 107.782 2.952 1
1 102 . 5 1 1 A 22 22 LYS H H 22 7.362 7.718 -0.356 1
1 103 . 5 1 1 A 22 22 LYS CA C 22 60.163 59.481 0.682 1
1 104 . 5 1 1 A 22 22 LYS CB C 22 32.554 32.189 0.365 1
1 105 . 5 1 1 A 22 22 LYS N N 22 122.161 121.198 0.963 1
1 106 . 5 1 1 A 23 23 GLU H H 23 9.639 8.032 1.607 1
1 107 . 5 1 1 A 23 23 GLU CA C 23 54.449 56.627 -2.178 1
1 108 . 5 1 1 A 23 23 GLU N N 23 116.288 115.868 0.420 1
1 109 . 5 1 1 A 24 24 GLY HA2 H 24 3.912 3.965 -0.053 1
1 110 . 5 1 1 A 24 24 GLY HA3 H 24 3.787 3.980 -0.193 1
1 111 . 5 1 1 A 24 24 GLY CA C 24 45.898 45.621 0.277 1
1 112 . 5 1 1 A 25 25 ASP H H 25 8.204 8.469 -0.265 1
1 113 . 5 1 1 A 25 25 ASP CA C 25 55.252 54.797 0.455 1
1 114 . 5 1 1 A 25 25 ASP N N 25 125.671 123.515 2.156 1
1 115 . 5 1 1 A 26 26 LYS CA C 26 57.851 55.843 2.008 1
1 116 . 5 1 1 A 26 26 LYS CB C 26 31.265 36.254 -4.989 1
1 117 . 5 1 1 A 27 27 HIS H H 27 9.763 8.782 0.981 1
1 118 . 5 1 1 A 27 27 HIS CA C 27 55.580 56.827 -1.247 1
1 119 . 5 1 1 A 27 27 HIS CB C 27 30.936 29.754 1.182 1
1 120 . 5 1 1 A 27 27 HIS N N 27 118.108 121.061 -2.953 1
1 121 . 5 1 1 A 28 28 THR H H 28 7.325 7.808 -0.483 1
1 126 . 5 1 1 A 28 28 THR CA C 28 60.128 60.549 -0.421 1
1 127 . 5 1 1 A 28 28 THR CB C 28 72.268 71.906 0.362 1
1 128 . 5 1 1 A 28 28 THR N N 28 106.920 113.943 -7.023 1
1 129 . 5 1 1 A 29 29 LEU H H 29 9.422 9.423 -0.001 1
1 130 . 5 1 1 A 29 29 LEU HA H 29 5.368 5.044 0.324 1
1 140 . 5 1 1 A 29 29 LEU CA C 29 52.567 53.400 -0.833 1
1 141 . 5 1 1 A 29 29 LEU CB C 29 43.523 43.690 -0.167 1
1 142 . 5 1 1 A 29 29 LEU N N 29 125.021 128.648 -3.627 1
1 143 . 5 1 1 A 30 30 SER H H 30 10.485 8.958 1.527 1
1 144 . 5 1 1 A 30 30 SER CA C 30 56.653 57.733 -1.080 1
1 145 . 5 1 1 A 30 30 SER CB C 30 65.313 64.192 1.121 1
1 146 . 5 1 1 A 30 30 SER N N 30 124.758 118.887 5.871 1
1 147 . 5 1 1 A 31 31 LYS H H 31 8.728 8.652 0.076 1
1 148 . 5 1 1 A 31 31 LYS CA C 31 59.669 59.334 0.335 1
1 149 . 5 1 1 A 31 31 LYS CB C 31 31.763 31.966 -0.203 1
1 150 . 5 1 1 A 31 31 LYS N N 31 119.459 123.536 -4.077 1
1 151 . 5 1 1 A 32 32 LYS H H 32 7.857 8.014 -0.157 1
1 152 . 5 1 1 A 32 32 LYS CA C 32 59.721 59.145 0.576 1
1 153 . 5 1 1 A 32 32 LYS CB C 32 32.901 32.043 0.858 1
1 154 . 5 1 1 A 32 32 LYS N N 32 117.933 119.168 -1.235 1
1 155 . 5 1 1 A 33 33 GLU H H 33 7.559 7.559 0.000 1
1 156 . 5 1 1 A 33 33 GLU CA C 33 59.169 58.528 0.641 1
1 157 . 5 1 1 A 33 33 GLU CB C 33 31.014 29.286 1.728 1
1 158 . 5 1 1 A 33 33 GLU N N 33 120.407 119.348 1.059 1
1 159 . 5 1 1 A 34 34 LEU H H 34 8.833 8.385 0.448 1
1 160 . 5 1 1 A 34 34 LEU CA C 34 56.928 57.880 -0.952 1
1 161 . 5 1 1 A 34 34 LEU CB C 34 41.435 41.789 -0.354 1
1 162 . 5 1 1 A 34 34 LEU N N 34 117.677 121.446 -3.769 1
1 163 . 5 1 1 A 35 35 LYS H H 35 8.010 7.888 0.122 1
1 164 . 5 1 1 A 35 35 LYS CA C 35 60.692 59.695 0.997 1
1 165 . 5 1 1 A 35 35 LYS CB C 35 32.223 32.459 -0.236 1
1 166 . 5 1 1 A 35 35 LYS N N 35 119.829 118.593 1.236 1
1 167 . 5 1 1 A 36 36 GLU H H 36 7.169 8.101 -0.932 1
1 168 . 5 1 1 A 36 36 GLU CA C 36 59.588 59.023 0.565 1
1 169 . 5 1 1 A 36 36 GLU CB C 36 29.342 29.325 0.017 1
1 170 . 5 1 1 A 36 36 GLU N N 36 117.340 119.504 -2.164 1
1 171 . 5 1 1 A 37 37 LEU H H 37 7.478 7.565 -0.087 1
1 172 . 5 1 1 A 37 37 LEU CA C 37 59.674 58.126 1.548 1
1 173 . 5 1 1 A 37 37 LEU CB C 37 42.142 41.234 0.908 1
1 174 . 5 1 1 A 37 37 LEU N N 37 120.884 121.757 -0.873 1
1 175 . 5 1 1 A 38 38 ILE H H 38 8.377 8.185 0.192 1
1 176 . 5 1 1 A 38 38 ILE CA C 38 65.651 65.074 0.577 1
1 177 . 5 1 1 A 38 38 ILE N N 38 118.450 120.098 -1.648 1
1 178 . 5 1 1 A 39 39 GLN H H 39 8.217 8.158 0.059 1
1 179 . 5 1 1 A 39 39 GLN CA C 39 59.788 58.900 0.888 1
1 180 . 5 1 1 A 39 39 GLN CB C 39 29.278 28.221 1.057 1
1 181 . 5 1 1 A 39 39 GLN N N 39 113.091 118.593 -5.502 1
1 182 . 5 1 1 A 40 40 LYS H H 40 8.426 7.470 0.956 1
1 183 . 5 1 1 A 40 40 LYS CA C 40 57.807 59.238 -1.431 1
1 184 . 5 1 1 A 40 40 LYS CB C 40 33.942 32.222 1.720 1
1 185 . 5 1 1 A 40 40 LYS N N 40 114.771 120.493 -5.722 1
1 186 . 5 1 1 A 41 41 GLU H H 41 8.496 8.112 0.384 1
1 187 . 5 1 1 A 41 41 GLU CA C 41 55.395 58.883 -3.488 1
1 188 . 5 1 1 A 41 41 GLU CB C 41 29.260 30.197 -0.937 1
1 189 . 5 1 1 A 41 41 GLU N N 41 112.546 119.990 -7.444 1
1 190 . 5 1 1 A 42 42 LEU H H 42 7.267 8.470 -1.203 1
1 191 . 5 1 1 A 42 42 LEU CA C 42 53.776 54.057 -0.281 1
1 192 . 5 1 1 A 42 42 LEU N N 42 118.657 119.626 -0.969 1
1 193 . 5 1 1 A 44 44 ILE CA C 44 62.210 61.748 0.462 1
1 194 . 5 1 1 A 44 44 ILE CB C 44 38.247 38.492 -0.245 1
1 195 . 5 1 1 A 45 45 GLY H H 45 7.820 7.954 -0.134 1
1 196 . 5 1 1 A 45 45 GLY CA C 45 47.742 44.874 2.868 1
1 197 . 5 1 1 A 45 45 GLY N N 45 108.178 109.745 -1.567 1
1 198 . 5 1 1 A 46 46 SER H H 46 7.895 8.494 -0.599 1
1 199 . 5 1 1 A 46 46 SER CA C 46 59.958 57.917 2.041 1
1 200 . 5 1 1 A 46 46 SER CB C 46 63.450 62.447 1.003 1
1 201 . 5 1 1 A 46 46 SER N N 46 113.038 121.003 -7.965 1
1 202 . 5 1 1 A 47 47 LYS H H 47 7.736 7.711 0.025 1
1 203 . 5 1 1 A 47 47 LYS CA C 47 55.636 54.887 0.749 1
1 204 . 5 1 1 A 47 47 LYS CB C 47 33.103 35.934 -2.831 1
1 205 . 5 1 1 A 47 47 LYS N N 47 119.422 117.115 2.307 1
1 206 . 5 1 1 A 48 48 LEU H H 48 6.988 8.852 -1.864 1
1 207 . 5 1 1 A 48 48 LEU HA H 48 4.497 4.270 0.227 1
1 217 . 5 1 1 A 48 48 LEU CA C 48 54.517 55.304 -0.787 1
1 218 . 5 1 1 A 48 48 LEU CB C 48 42.987 41.656 1.331 1
1 219 . 5 1 1 A 48 48 LEU N N 48 118.908 124.277 -5.369 1
1 220 . 5 1 1 A 49 49 GLN H H 49 9.206 8.405 0.801 1
1 221 . 5 1 1 A 49 49 GLN HA H 49 4.486 4.638 -0.152 1
1 223 . 5 1 1 A 49 49 GLN CA C 49 54.785 56.035 -1.250 1
1 224 . 5 1 1 A 49 49 GLN CB C 49 29.636 30.723 -1.087 1
1 225 . 5 1 1 A 49 49 GLN N N 49 121.275 118.524 2.751 1
1 226 . 5 1 1 A 50 50 ASP H H 50 8.854 8.169 0.685 1
1 227 . 5 1 1 A 50 50 ASP CA C 50 59.078 57.949 1.129 1
1 228 . 5 1 1 A 50 50 ASP CB C 50 40.632 42.182 -1.550 1
1 229 . 5 1 1 A 50 50 ASP N N 50 123.430 121.171 2.259 1
1 230 . 5 1 1 A 51 51 ALA H H 51 8.720 8.174 0.546 1
1 231 . 5 1 1 A 51 51 ALA CA C 51 55.281 54.815 0.466 1
1 232 . 5 1 1 A 51 51 ALA CB C 51 18.205 18.087 0.118 1
1 233 . 5 1 1 A 51 51 ALA N N 51 117.829 121.465 -3.636 1
1 234 . 5 1 1 A 52 52 GLU H H 52 7.161 7.682 -0.521 1
1 235 . 5 1 1 A 52 52 GLU CA C 52 58.757 59.148 -0.391 1
1 236 . 5 1 1 A 52 52 GLU CB C 52 30.247 29.852 0.395 1
1 237 . 5 1 1 A 52 52 GLU N N 52 115.459 117.396 -1.937 1
1 238 . 5 1 1 A 53 53 ILE H H 53 7.962 8.028 -0.066 1
1 239 . 5 1 1 A 53 53 ILE CA C 53 65.525 65.009 0.516 1
1 240 . 5 1 1 A 53 53 ILE CB C 53 37.289 37.608 -0.319 1
1 241 . 5 1 1 A 53 53 ILE N N 53 120.414 121.330 -0.916 1
1 242 . 5 1 1 A 54 54 VAL H H 54 8.132 8.067 0.065 1
1 243 . 5 1 1 A 54 54 VAL CA C 54 67.290 65.587 1.703 1
1 244 . 5 1 1 A 54 54 VAL CB C 54 31.434 31.301 0.133 1
1 245 . 5 1 1 A 54 54 VAL N N 54 119.775 117.400 2.375 1
1 246 . 5 1 1 A 55 55 LYS H H 55 7.155 8.054 -0.899 1
1 247 . 5 1 1 A 55 55 LYS CA C 55 59.131 59.152 -0.021 1
1 248 . 5 1 1 A 55 55 LYS CB C 55 32.131 31.840 0.291 1
1 249 . 5 1 1 A 55 55 LYS N N 55 119.175 120.951 -1.776 1
1 250 . 5 1 1 A 56 56 LEU H H 56 7.837 8.332 -0.495 1
1 251 . 5 1 1 A 56 56 LEU CA C 56 58.052 57.896 0.156 1
1 252 . 5 1 1 A 56 56 LEU CB C 56 41.878 41.339 0.539 1
1 253 . 5 1 1 A 56 56 LEU N N 56 119.679 121.215 -1.536 1
1 254 . 5 1 1 A 57 57 MET H H 57 8.385 8.684 -0.299 1
1 255 . 5 1 1 A 57 57 MET CA C 57 60.756 58.112 2.644 1
1 256 . 5 1 1 A 57 57 MET CB C 57 33.152 32.582 0.570 1
1 257 . 5 1 1 A 57 57 MET N N 57 115.116 117.251 -2.135 1
1 258 . 5 1 1 A 58 58 ASP H H 58 7.591 8.012 -0.421 1
1 259 . 5 1 1 A 58 58 ASP CA C 58 57.365 57.221 0.144 1
1 260 . 5 1 1 A 58 58 ASP CB C 58 40.858 41.202 -0.344 1
1 261 . 5 1 1 A 58 58 ASP N N 58 118.197 120.249 -2.052 1
1 262 . 5 1 1 A 59 59 ASP H H 59 7.725 7.657 0.068 1
1 263 . 5 1 1 A 59 59 ASP CA C 59 56.830 56.537 0.293 1
1 264 . 5 1 1 A 59 59 ASP CB C 59 40.567 40.751 -0.184 1
1 265 . 5 1 1 A 59 59 ASP N N 59 118.481 117.871 0.610 1
1 266 . 5 1 1 A 60 60 LEU H H 60 7.703 7.541 0.162 1
1 267 . 5 1 1 A 60 60 LEU CA C 60 56.564 56.878 -0.314 1
1 268 . 5 1 1 A 60 60 LEU CB C 60 42.714 41.484 1.230 1
1 269 . 5 1 1 A 60 60 LEU N N 60 116.935 119.620 -2.685 1
1 270 . 5 1 1 A 61 61 ASP H H 61 7.143 8.628 -1.485 1
1 271 . 5 1 1 A 61 61 ASP HA H 61 4.690 4.627 0.063 1
1 274 . 5 1 1 A 61 61 ASP CA C 61 52.286 56.407 -4.121 1
1 275 . 5 1 1 A 61 61 ASP CB C 61 39.245 40.574 -1.329 1
1 276 . 5 1 1 A 61 61 ASP N N 61 116.605 119.220 -2.615 1
1 277 . 5 1 1 A 62 62 ARG H H 62 7.786 7.909 -0.123 1
1 278 . 5 1 1 A 62 62 ARG CA C 62 58.328 58.681 -0.353 1
1 279 . 5 1 1 A 62 62 ARG CB C 62 30.106 29.880 0.226 1
1 280 . 5 1 1 A 62 62 ARG N N 62 125.967 121.104 4.863 1
1 281 . 5 1 1 A 63 63 ASN H H 63 7.945 7.497 0.448 1
1 282 . 5 1 1 A 63 63 ASN CA C 63 51.863 55.172 -3.309 1
1 283 . 5 1 1 A 63 63 ASN CB C 63 36.809 39.673 -2.864 1
1 284 . 5 1 1 A 63 63 ASN N N 63 112.434 115.618 -3.184 1
1 285 . 5 1 1 A 64 64 LYS H H 64 7.477 7.394 0.083 1
1 286 . 5 1 1 A 64 64 LYS CA C 64 56.524 55.943 0.581 1
1 287 . 5 1 1 A 64 64 LYS N N 64 114.197 117.744 -3.547 1
1 288 . 5 1 1 A 65 65 ASP H H 65 8.345 9.270 -0.925 1
1 289 . 5 1 1 A 65 65 ASP CA C 65 52.969 55.891 -2.922 1
1 290 . 5 1 1 A 65 65 ASP CB C 65 40.329 39.985 0.344 1
1 291 . 5 1 1 A 65 65 ASP N N 65 118.581 125.999 -7.418 1
1 292 . 5 1 1 A 66 66 GLN H H 66 9.945 7.934 2.011 1
1 293 . 5 1 1 A 66 66 GLN CA C 66 58.132 56.304 1.828 1
1 294 . 5 1 1 A 66 66 GLN CB C 66 26.035 31.260 -5.225 1
1 295 . 5 1 1 A 66 66 GLN N N 66 113.203 116.841 -3.638 1
1 296 . 5 1 1 A 67 67 GLU H H 67 7.880 7.847 0.033 1
1 297 . 5 1 1 A 67 67 GLU HA H 67 4.910 4.711 0.199 1
1 302 . 5 1 1 A 67 67 GLU CA C 67 54.082 55.467 -1.385 1
1 303 . 5 1 1 A 67 67 GLU CB C 67 33.174 32.533 0.641 1
1 304 . 5 1 1 A 67 67 GLU N N 67 118.554 115.262 3.292 1
1 305 . 5 1 1 A 68 68 VAL H H 68 9.669 9.061 0.608 1
1 306 . 5 1 1 A 68 68 VAL HA H 68 5.465 4.740 0.725 1
1 314 . 5 1 1 A 68 68 VAL CA C 68 61.079 61.067 0.012 1
1 315 . 5 1 1 A 68 68 VAL CB C 68 33.280 34.282 -1.002 1
1 316 . 5 1 1 A 68 68 VAL N N 68 126.572 121.925 4.647 1
1 317 . 5 1 1 A 69 69 ASN H H 69 8.985 8.634 0.351 1
1 318 . 5 1 1 A 69 69 ASN CA C 69 50.812 53.326 -2.514 1
1 319 . 5 1 1 A 69 69 ASN CB C 69 38.609 40.646 -2.037 1
1 320 . 5 1 1 A 69 69 ASN N N 69 127.472 126.243 1.229 1
1 321 . 5 1 1 A 70 70 PHE H H 70 9.100 9.372 -0.272 1
1 322 . 5 1 1 A 70 70 PHE CA C 70 63.279 61.859 1.420 1
1 323 . 5 1 1 A 70 70 PHE CB C 70 38.741 39.478 -0.737 1
1 324 . 5 1 1 A 70 70 PHE N N 70 119.972 127.779 -7.807 1
1 325 . 5 1 1 A 71 71 GLN H H 71 8.342 8.038 0.304 1
1 326 . 5 1 1 A 71 71 GLN HA H 71 3.923 3.643 0.280 1
1 329 . 5 1 1 A 71 71 GLN CA C 71 59.866 58.328 1.538 1
1 330 . 5 1 1 A 71 71 GLN CB C 71 27.878 28.198 -0.320 1
1 331 . 5 1 1 A 71 71 GLN N N 71 118.216 117.394 0.822 1
1 332 . 5 1 1 A 72 72 GLU H H 72 8.721 7.740 0.981 1
1 333 . 5 1 1 A 72 72 GLU HA H 72 4.147 4.073 0.074 1
1 338 . 5 1 1 A 72 72 GLU CA C 72 59.313 58.763 0.550 1
1 339 . 5 1 1 A 72 72 GLU CB C 72 30.233 29.383 0.850 1
1 340 . 5 1 1 A 72 72 GLU N N 72 121.455 119.670 1.785 1
1 341 . 5 1 1 A 73 73 TYR H H 73 8.536 7.956 0.580 1
1 342 . 5 1 1 A 73 73 TYR CA C 73 60.961 61.525 -0.564 1
1 343 . 5 1 1 A 73 73 TYR CB C 73 38.724 38.753 -0.029 1
1 344 . 5 1 1 A 73 73 TYR N N 73 123.356 122.435 0.921 1
1 345 . 5 1 1 A 74 74 ILE H H 74 8.642 8.020 0.622 1
1 346 . 5 1 1 A 74 74 ILE CA C 74 61.880 64.180 -2.300 1
1 347 . 5 1 1 A 74 74 ILE CB C 74 36.077 37.503 -1.426 1
1 348 . 5 1 1 A 74 74 ILE N N 74 119.799 120.649 -0.850 1
1 349 . 5 1 1 A 75 75 THR H H 75 7.959 8.139 -0.180 1
1 354 . 5 1 1 A 75 75 THR CA C 75 67.056 66.819 0.237 1
1 355 . 5 1 1 A 75 75 THR CB C 75 68.386 68.437 -0.051 1
1 356 . 5 1 1 A 75 75 THR N N 75 119.486 117.890 1.596 1
1 357 . 5 1 1 A 76 76 PHE H H 76 7.450 8.304 -0.854 1
1 358 . 5 1 1 A 76 76 PHE CA C 76 59.010 61.775 -2.765 1
1 359 . 5 1 1 A 76 76 PHE CB C 76 38.139 39.041 -0.902 1
1 360 . 5 1 1 A 76 76 PHE N N 76 122.873 121.918 0.955 1
1 361 . 5 1 1 A 77 77 LEU H H 77 7.829 8.232 -0.403 1
1 362 . 5 1 1 A 77 77 LEU CA C 77 57.450 57.603 -0.153 1
1 363 . 5 1 1 A 77 77 LEU CB C 77 40.560 41.136 -0.576 1
1 364 . 5 1 1 A 77 77 LEU N N 77 117.405 118.638 -1.233 1
1 365 . 5 1 1 A 78 78 GLY H H 78 8.093 8.242 -0.149 1
1 366 . 5 1 1 A 78 78 GLY HA2 H 78 3.661 3.711 -0.050 1
1 367 . 5 1 1 A 78 78 GLY HA3 H 78 3.594 3.713 -0.119 1
1 368 . 5 1 1 A 78 78 GLY CA C 78 47.442 47.158 0.284 1
1 369 . 5 1 1 A 78 78 GLY N N 78 105.528 106.300 -0.772 1
1 370 . 5 1 1 A 79 79 ALA H H 79 7.759 7.637 0.122 1
1 371 . 5 1 1 A 79 79 ALA CA C 79 55.153 54.875 0.278 1
1 372 . 5 1 1 A 79 79 ALA CB C 79 17.768 19.134 -1.366 1
1 373 . 5 1 1 A 79 79 ALA N N 79 124.488 125.027 -0.539 1
1 374 . 5 1 1 A 80 80 LEU H H 80 7.963 7.875 0.088 1
1 375 . 5 1 1 A 80 80 LEU CA C 80 57.464 57.313 0.151 1
1 376 . 5 1 1 A 80 80 LEU CB C 80 41.496 40.846 0.650 1
1 377 . 5 1 1 A 80 80 LEU N N 80 117.869 119.657 -1.788 1
1 378 . 5 1 1 A 81 81 ALA H H 81 8.365 8.191 0.174 1
1 379 . 5 1 1 A 81 81 ALA CA C 81 55.475 54.913 0.562 1
1 380 . 5 1 1 A 81 81 ALA CB C 81 17.483 17.941 -0.458 1
1 381 . 5 1 1 A 81 81 ALA N N 81 119.054 119.935 -0.881 1
1 382 . 5 1 1 A 82 82 MET H H 82 8.112 7.521 0.591 1
1 383 . 5 1 1 A 82 82 MET CA C 82 59.516 57.960 1.556 1
1 384 . 5 1 1 A 82 82 MET CB C 82 32.550 32.137 0.413 1
1 385 . 5 1 1 A 82 82 MET N N 82 115.364 117.751 -2.387 1
1 386 . 5 1 1 A 83 83 ILE H H 83 7.981 8.012 -0.031 1
1 387 . 5 1 1 A 83 83 ILE HA H 83 3.839 3.595 0.244 1
1 391 . 5 1 1 A 83 83 ILE CA C 83 64.467 65.004 -0.537 1
1 392 . 5 1 1 A 83 83 ILE CB C 83 37.312 37.531 -0.219 1
1 393 . 5 1 1 A 83 83 ILE N N 83 120.887 119.475 1.412 1
1 394 . 5 1 1 A 84 84 TYR H H 84 8.731 7.667 1.064 1
1 395 . 5 1 1 A 84 84 TYR N N 84 120.933 119.098 1.835 1
1 396 . 5 1 1 A 87 87 ALA H H 87 7.829 8.136 -0.307 1
1 397 . 5 1 1 A 87 87 ALA CA C 87 53.768 54.312 -0.544 1
1 398 . 5 1 1 A 87 87 ALA CB C 87 18.504 18.299 0.205 1
1 399 . 5 1 1 A 87 87 ALA N N 87 120.274 121.025 -0.751 1
1 400 . 5 1 1 A 88 88 LEU H H 88 7.499 7.553 -0.054 1
1 401 . 5 1 1 A 88 88 LEU CA C 88 55.605 54.765 0.840 1
1 402 . 5 1 1 A 88 88 LEU CB C 88 42.047 41.597 0.450 1
1 403 . 5 1 1 A 88 88 LEU N N 88 117.356 116.122 1.234 1
1 404 . 5 1 1 A 89 89 LYS H H 89 7.561 7.811 -0.250 1
1 405 . 5 1 1 A 89 89 LYS CA C 89 56.865 56.381 0.484 1
1 406 . 5 1 1 A 89 89 LYS CB C 89 32.592 34.893 -2.301 1
1 407 . 5 1 1 A 89 89 LYS N N 89 119.289 116.712 2.577 1
1 416 . 5 3 2 C 6 6 GLU H H 190 8.385 9.142 -0.757 1
1 417 . 5 3 2 C 6 6 GLU HA H 190 4.153 3.917 0.236 1
1 422 . 5 3 2 C 6 6 GLU C C 190 175.031 176.864 -1.833 1
1 423 . 5 3 2 C 6 6 GLU CA C 190 58.866 57.941 0.925 1
1 424 . 5 3 2 C 6 6 GLU CB C 190 30.751 31.009 -0.258 1
1 426 . 5 3 2 C 6 6 GLU N N 190 122.715 126.248 -3.533 1
1 427 . 5 3 2 C 7 7 GLY H H 191 8.475 7.460 1.015 1
1 428 . 5 3 2 C 7 7 GLY HA2 H 191 3.887 3.981 -0.094 1
1 429 . 5 3 2 C 7 7 GLY HA3 H 191 3.887 3.982 -0.095 1
1 430 . 5 3 2 C 7 7 GLY C C 191 177.922 175.136 2.786 1
1 431 . 5 3 2 C 7 7 GLY CA C 191 46.884 45.572 1.312 1
1 432 . 5 3 2 C 7 7 GLY N N 191 109.009 107.836 1.173 1
1 433 . 5 3 2 C 8 8 LEU HA H 192 4.095 3.883 0.212 1
1 443 . 5 3 2 C 8 8 LEU CA C 192 58.154 58.406 -0.252 1
1 444 . 5 3 2 C 8 8 LEU CB C 192 42.789 42.014 0.775 1
1 448 . 5 3 2 C 9 9 MET H H 193 8.250 8.495 -0.245 1
1 449 . 5 3 2 C 9 9 MET HA H 193 4.150 4.262 -0.112 1
1 457 . 5 3 2 C 9 9 MET C C 193 178.421 178.192 0.229 1
1 458 . 5 3 2 C 9 9 MET CA C 193 58.818 58.343 0.475 1
1 459 . 5 3 2 C 9 9 MET CB C 193 32.360 32.074 0.286 1
1 462 . 5 3 2 C 9 9 MET N N 193 117.049 117.119 -0.070 1
1 463 . 5 3 2 C 10 10 ASN H H 194 7.892 8.169 -0.277 1
1 464 . 5 3 2 C 10 10 ASN HA H 194 4.468 4.534 -0.066 1
1 469 . 5 3 2 C 10 10 ASN C C 194 178.099 176.940 1.159 1
1 470 . 5 3 2 C 10 10 ASN CA C 194 56.644 55.253 1.391 1
1 471 . 5 3 2 C 10 10 ASN CB C 194 39.100 38.479 0.621 1
1 472 . 5 3 2 C 10 10 ASN N N 194 117.034 118.808 -1.774 1
1 474 . 5 3 2 C 11 11 VAL H H 195 7.651 7.973 -0.322 1
1 475 . 5 3 2 C 11 11 VAL HA H 195 3.735 3.838 -0.103 1
1 483 . 5 3 2 C 11 11 VAL C C 195 177.657 178.278 -0.621 1
1 484 . 5 3 2 C 11 11 VAL CA C 195 66.710 65.345 1.365 1
1 485 . 5 3 2 C 11 11 VAL CB C 195 32.468 31.822 0.646 1
1 488 . 5 3 2 C 11 11 VAL N N 195 119.878 118.148 1.730 1
1 489 . 5 3 2 C 12 12 LEU H H 196 8.030 7.935 0.095 1
1 490 . 5 3 2 C 12 12 LEU HA H 196 4.013 3.980 0.033 1
1 500 . 5 3 2 C 12 12 LEU C C 196 177.540 179.345 -1.805 1
1 501 . 5 3 2 C 12 12 LEU CA C 196 58.489 57.832 0.657 1
1 502 . 5 3 2 C 12 12 LEU CB C 196 42.457 41.203 1.254 1
1 506 . 5 3 2 C 12 12 LEU N N 196 119.499 120.125 -0.626 1
1 507 . 5 3 2 C 13 13 LYS H H 197 8.015 8.358 -0.343 1
1 508 . 5 3 2 C 13 13 LYS HA H 197 3.949 4.003 -0.054 1
1 517 . 5 3 2 C 13 13 LYS C C 197 178.419 178.735 -0.316 1
1 518 . 5 3 2 C 13 13 LYS CA C 197 60.191 59.731 0.460 1
1 519 . 5 3 2 C 13 13 LYS CB C 197 33.075 32.219 0.856 1
1 523 . 5 3 2 C 13 13 LYS N N 197 117.888 120.778 -2.890 1
1 524 . 5 3 2 C 14 14 LYS H H 198 7.506 7.785 -0.279 1
1 525 . 5 3 2 C 14 14 LYS HA H 198 4.127 4.108 0.019 1
1 534 . 5 3 2 C 14 14 LYS C C 198 178.262 179.008 -0.746 1
1 535 . 5 3 2 C 14 14 LYS CA C 198 59.161 58.562 0.599 1
1 536 . 5 3 2 C 14 14 LYS CB C 198 32.956 31.989 0.967 1
1 540 . 5 3 2 C 14 14 LYS N N 198 118.321 117.784 0.537 1
1 541 . 5 3 2 C 15 15 ILE H H 199 7.780 7.558 0.222 1
1 542 . 5 3 2 C 15 15 ILE HA H 199 3.787 3.936 -0.149 1
1 552 . 5 3 2 C 15 15 ILE C C 199 178.647 178.017 0.630 1
1 553 . 5 3 2 C 15 15 ILE CA C 199 64.912 63.415 1.497 1
1 554 . 5 3 2 C 15 15 ILE CB C 199 38.780 37.265 1.515 1
1 558 . 5 3 2 C 15 15 ILE N N 199 118.644 119.399 -0.755 1
1 559 . 5 3 2 C 16 16 TYR H H 200 7.918 8.162 -0.244 1
1 560 . 5 3 2 C 16 16 TYR HA H 200 4.252 4.018 0.234 1
1 567 . 5 3 2 C 16 16 TYR C C 200 177.806 177.723 0.083 1
1 568 . 5 3 2 C 16 16 TYR CA C 200 61.171 61.299 -0.128 1
1 569 . 5 3 2 C 16 16 TYR CB C 200 39.245 38.535 0.710 1
1 573 . 5 3 2 C 16 16 TYR N N 200 118.683 122.391 -3.708 1
1 574 . 5 3 2 C 17 17 GLU H H 201 8.089 8.634 -0.545 1
1 575 . 5 3 2 C 17 17 GLU HA H 201 4.124 4.119 0.005 1
1 580 . 5 3 2 C 17 17 GLU C C 201 177.414 177.079 0.335 1
1 581 . 5 3 2 C 17 17 GLU CA C 201 58.784 58.117 0.667 1
1 582 . 5 3 2 C 17 17 GLU CB C 201 30.747 29.187 1.560 1
1 584 . 5 3 2 C 17 17 GLU N N 201 119.409 117.793 1.616 1
1 585 . 5 3 2 C 18 18 ASP H H 202 8.023 7.812 0.211 1
1 586 . 5 3 2 C 18 18 ASP HA H 202 4.657 4.797 -0.140 1
1 589 . 5 3 2 C 18 18 ASP C C 202 177.346 175.633 1.713 1
1 590 . 5 3 2 C 18 18 ASP CA C 202 55.496 54.817 0.679 1
1 591 . 5 3 2 C 18 18 ASP CB C 202 42.023 42.636 -0.613 1
1 592 . 5 3 2 C 18 18 ASP N N 202 119.459 119.763 -0.304 1
1 593 . 5 3 2 C 19 19 GLY H H 203 7.933 7.072 0.861 1
1 594 . 5 3 2 C 19 19 GLY HA2 H 203 3.938 4.096 -0.158 1
1 595 . 5 3 2 C 19 19 GLY HA3 H 203 3.938 4.112 -0.174 1
1 596 . 5 3 2 C 19 19 GLY C C 203 177.240 171.964 5.276 1
1 597 . 5 3 2 C 19 19 GLY CA C 203 46.309 45.652 0.657 1
1 598 . 5 3 2 C 19 19 GLY N N 203 108.518 105.684 2.834 1
1 599 . 5 3 2 C 20 20 ASP H H 204 8.091 8.714 -0.623 1
1 600 . 5 3 2 C 20 20 ASP HA H 204 4.616 5.264 -0.648 1
1 603 . 5 3 2 C 20 20 ASP C C 204 173.979 175.036 -1.057 1
1 604 . 5 3 2 C 20 20 ASP CA C 204 55.064 54.592 0.472 1
1 605 . 5 3 2 C 20 20 ASP CB C 204 42.203 42.777 -0.574 1
1 606 . 5 3 2 C 20 20 ASP N N 204 120.172 120.608 -0.436 1
1 607 . 5 3 2 C 21 21 ASP H H 205 8.352 8.724 -0.372 1
1 608 . 5 3 2 C 21 21 ASP HA H 205 4.468 4.884 -0.416 1
1 611 . 5 3 2 C 21 21 ASP C C 205 176.432 177.023 -0.591 1
1 612 . 5 3 2 C 21 21 ASP CA C 205 56.663 55.666 0.997 1
1 613 . 5 3 2 C 21 21 ASP CB C 205 41.918 43.404 -1.486 1
1 614 . 5 3 2 C 21 21 ASP N N 205 121.515 126.722 -5.207 1
1 615 . 5 3 2 C 22 22 ASP H H 206 8.239 8.438 -0.199 1
1 616 . 5 3 2 C 22 22 ASP HA H 206 4.455 4.479 -0.024 1
1 619 . 5 3 2 C 22 22 ASP C C 206 177.449 178.657 -1.208 1
1 620 . 5 3 2 C 22 22 ASP CA C 206 57.165 56.429 0.736 1
1 621 . 5 3 2 C 22 22 ASP CB C 206 41.820 40.962 0.858 1
1 622 . 5 3 2 C 22 22 ASP N N 206 120.156 118.297 1.859 1
1 623 . 5 3 2 C 23 23 MET H H 207 8.300 8.114 0.186 1
1 624 . 5 3 2 C 23 23 MET HA H 207 4.255 4.023 0.232 1
1 632 . 5 3 2 C 23 23 MET C C 207 178.412 177.987 0.425 1
1 633 . 5 3 2 C 23 23 MET CA C 207 58.065 58.667 -0.602 1
1 634 . 5 3 2 C 23 23 MET CB C 207 32.488 31.868 0.620 1
1 637 . 5 3 2 C 23 23 MET N N 207 120.707 119.652 1.055 1
1 638 . 5 3 2 C 24 24 LYS H H 208 8.047 8.210 -0.163 1
1 639 . 5 3 2 C 24 24 LYS HA H 208 3.946 4.036 -0.090 1
1 648 . 5 3 2 C 24 24 LYS C C 208 178.008 178.600 -0.592 1
1 649 . 5 3 2 C 24 24 LYS CA C 208 59.847 59.070 0.777 1
1 650 . 5 3 2 C 24 24 LYS CB C 208 32.983 31.902 1.081 1
1 654 . 5 3 2 C 24 24 LYS N N 208 119.504 118.160 1.344 1
1 655 . 5 3 2 C 25 25 ARG H H 209 7.891 7.754 0.137 1
1 656 . 5 3 2 C 25 25 ARG HA H 209 4.168 4.112 0.056 1
1 663 . 5 3 2 C 25 25 ARG C C 209 178.100 178.438 -0.338 1
1 664 . 5 3 2 C 25 25 ARG CA C 209 58.810 59.480 -0.670 1
1 665 . 5 3 2 C 25 25 ARG CB C 209 31.080 30.739 0.341 1
1 668 . 5 3 2 C 25 25 ARG N N 209 118.378 119.158 -0.780 1
1 669 . 5 3 2 C 26 26 THR H H 210 7.869 8.345 -0.476 1
1 670 . 5 3 2 C 26 26 THR HA H 210 4.023 4.039 -0.016 1
1 675 . 5 3 2 C 26 26 THR C C 210 177.984 176.603 1.381 1
1 676 . 5 3 2 C 26 26 THR CA C 210 65.747 66.829 -1.082 1
1 677 . 5 3 2 C 26 26 THR CB C 210 69.683 67.748 1.935 1
1 679 . 5 3 2 C 26 26 THR N N 210 115.443 119.153 -3.710 1
1 680 . 5 3 2 C 27 27 ILE H H 211 7.901 8.161 -0.260 1
1 681 . 5 3 2 C 27 27 ILE HA H 211 4.142 3.717 0.425 1
1 691 . 5 3 2 C 27 27 ILE C C 211 175.595 177.938 -2.343 1
1 692 . 5 3 2 C 27 27 ILE CA C 211 63.528 65.755 -2.227 1
1 693 . 5 3 2 C 27 27 ILE CB C 211 38.982 37.805 1.177 1
1 697 . 5 3 2 C 27 27 ILE N N 211 121.265 121.580 -0.315 1
1 698 . 5 3 2 C 28 28 ASN HA H 212 4.465 4.564 -0.099 1
1 703 . 5 3 2 C 28 28 ASN CA C 212 55.182 56.445 -1.263 1
1 704 . 5 3 2 C 28 28 ASN CB C 212 39.480 37.747 1.733 1
1 706 . 5 3 2 C 29 29 LYS H H 213 7.968 8.007 -0.039 1
1 707 . 5 3 2 C 29 29 LYS HA H 213 4.072 3.981 0.091 1
1 716 . 5 3 2 C 29 29 LYS C C 213 176.218 179.653 -3.435 1
1 717 . 5 3 2 C 29 29 LYS CA C 213 58.489 59.472 -0.983 1
1 718 . 5 3 2 C 29 29 LYS CB C 213 33.165 32.290 0.875 1
1 722 . 5 3 2 C 29 29 LYS N N 213 120.820 119.100 1.720 1
1 723 . 5 3 2 C 30 30 ALA H H 214 7.865 8.056 -0.191 1
1 724 . 5 3 2 C 30 30 ALA HA H 214 4.217 4.157 0.060 1
1 728 . 5 3 2 C 30 30 ALA C C 214 177.041 179.975 -2.934 1
1 729 . 5 3 2 C 30 30 ALA CA C 214 54.104 54.949 -0.845 1
1 730 . 5 3 2 C 30 30 ALA CB C 214 19.496 18.581 0.915 1
1 731 . 5 3 2 C 30 30 ALA N N 214 121.571 121.511 0.060 1
1 732 . 5 3 2 C 31 31 TRP H H 215 7.831 7.844 -0.013 1
1 733 . 5 3 2 C 31 31 TRP HA H 215 4.598 4.311 0.287 1
1 742 . 5 3 2 C 31 31 TRP C C 215 178.088 177.973 0.115 1
1 743 . 5 3 2 C 31 31 TRP CA C 215 58.432 61.577 -3.145 1
1 744 . 5 3 2 C 31 31 TRP CB C 215 30.472 29.223 1.249 1
1 750 . 5 3 2 C 31 31 TRP N N 215 118.141 120.417 -2.276 1
1 752 . 5 3 2 C 32 32 VAL H H 216 7.594 8.866 -1.272 1
1 753 . 5 3 2 C 32 32 VAL HA H 216 3.978 3.656 0.322 1
1 761 . 5 3 2 C 32 32 VAL C C 216 176.574 178.539 -1.965 1
1 762 . 5 3 2 C 32 32 VAL CA C 216 63.329 66.550 -3.221 1
1 763 . 5 3 2 C 32 32 VAL CB C 216 33.373 31.456 1.917 1
1 766 . 5 3 2 C 32 32 VAL N N 216 118.287 120.088 -1.801 1
1 767 . 5 3 2 C 33 33 GLU H H 217 8.012 8.108 -0.096 1
1 768 . 5 3 2 C 33 33 GLU HA H 217 4.257 4.083 0.174 1
1 773 . 5 3 2 C 33 33 GLU C C 217 176.164 177.618 -1.454 1
1 774 . 5 3 2 C 33 33 GLU CA C 217 57.409 59.169 -1.760 1
1 775 . 5 3 2 C 33 33 GLU CB C 217 30.978 29.225 1.753 1
1 777 . 5 3 2 C 33 33 GLU N N 217 122.535 120.645 1.890 1
1 778 . 5 3 2 C 34 34 SER H H 218 8.037 7.387 0.650 1
1 779 . 5 3 2 C 34 34 SER HA H 218 4.514 4.479 0.035 1
1 782 . 5 3 2 C 34 34 SER C C 218 176.451 174.280 2.171 1
1 783 . 5 3 2 C 34 34 SER CA C 218 58.987 58.641 0.346 1
1 784 . 5 3 2 C 34 34 SER CB C 218 64.569 63.936 0.633 1
1 785 . 5 3 2 C 34 34 SER N N 218 117.058 114.340 2.718 1
1 6 . 6 1 1 A 2 2 ALA H H 2 8.191 9.043 -0.852 1
1 7 . 6 1 1 A 2 2 ALA CA C 2 51.957 52.937 -0.980 1
1 8 . 6 1 1 A 2 2 ALA CB C 2 19.580 18.369 1.211 1
1 9 . 6 1 1 A 2 2 ALA N N 2 124.666 129.255 -4.589 1
1 10 . 6 1 1 A 3 3 SER H H 3 8.829 8.022 0.807 1
1 11 . 6 1 1 A 3 3 SER CA C 3 57.221 63.068 -5.847 1
1 12 . 6 1 1 A 3 3 SER N N 3 119.917 114.997 4.920 1
1 13 . 6 1 1 A 4 4 PRO CA C 4 66.688 65.439 1.249 1
1 14 . 6 1 1 A 4 4 PRO CB C 4 32.553 30.812 1.741 1
1 15 . 6 1 1 A 5 5 LEU H H 5 9.146 7.603 1.543 1
1 16 . 6 1 1 A 5 5 LEU CA C 5 59.017 57.077 1.940 1
1 17 . 6 1 1 A 5 5 LEU CB C 5 42.341 42.082 0.259 1
1 18 . 6 1 1 A 5 5 LEU N N 5 117.902 117.604 0.298 1
1 19 . 6 1 1 A 6 6 ASP H H 6 7.572 8.526 -0.954 1
1 20 . 6 1 1 A 6 6 ASP CA C 6 57.997 57.960 0.037 1
1 21 . 6 1 1 A 6 6 ASP CB C 6 40.910 42.216 -1.306 1
1 22 . 6 1 1 A 6 6 ASP N N 6 118.259 119.301 -1.042 1
1 23 . 6 1 1 A 7 7 GLN H H 7 8.660 8.442 0.218 1
1 24 . 6 1 1 A 7 7 GLN HA H 7 4.064 4.204 -0.140 1
1 29 . 6 1 1 A 7 7 GLN CA C 7 59.270 57.452 1.818 1
1 30 . 6 1 1 A 7 7 GLN CB C 7 28.468 27.499 0.969 1
1 31 . 6 1 1 A 7 7 GLN N N 7 119.558 116.988 2.570 1
1 32 . 6 1 1 A 8 8 ALA H H 8 8.253 7.925 0.328 1
1 33 . 6 1 1 A 8 8 ALA CA C 8 55.519 54.807 0.712 1
1 34 . 6 1 1 A 8 8 ALA CB C 8 18.113 18.852 -0.739 1
1 35 . 6 1 1 A 8 8 ALA N N 8 123.628 122.855 0.773 1
1 36 . 6 1 1 A 9 9 ILE H H 9 8.134 8.327 -0.193 1
1 37 . 6 1 1 A 9 9 ILE CA C 9 65.261 64.429 0.832 1
1 38 . 6 1 1 A 9 9 ILE CB C 9 37.023 37.215 -0.192 1
1 39 . 6 1 1 A 9 9 ILE N N 9 117.056 117.059 -0.003 1
1 40 . 6 1 1 A 10 10 GLY H H 10 8.515 8.641 -0.126 1
1 41 . 6 1 1 A 10 10 GLY HA3 H 10 3.773 3.834 -0.061 1
1 42 . 6 1 1 A 10 10 GLY CA C 10 47.637 46.658 0.979 1
1 43 . 6 1 1 A 10 10 GLY N N 10 106.202 110.974 -4.772 1
1 44 . 6 1 1 A 11 11 LEU H H 11 8.212 8.032 0.180 1
1 45 . 6 1 1 A 11 11 LEU CA C 11 58.354 57.476 0.878 1
1 46 . 6 1 1 A 11 11 LEU CB C 11 41.683 41.721 -0.038 1
1 47 . 6 1 1 A 11 11 LEU N N 11 124.624 123.361 1.263 1
1 48 . 6 1 1 A 12 12 LEU H H 12 7.971 7.895 0.076 1
1 49 . 6 1 1 A 12 12 LEU HA H 12 4.144 4.272 -0.128 1
1 59 . 6 1 1 A 12 12 LEU CA C 12 58.691 58.442 0.249 1
1 60 . 6 1 1 A 12 12 LEU CB C 12 40.657 41.648 -0.991 1
1 61 . 6 1 1 A 12 12 LEU N N 12 118.095 118.080 0.015 1
1 62 . 6 1 1 A 13 13 ILE H H 13 8.379 8.244 0.135 1
1 63 . 6 1 1 A 13 13 ILE CA C 13 66.405 65.553 0.852 1
1 64 . 6 1 1 A 13 13 ILE CB C 13 38.916 37.850 1.066 1
1 65 . 6 1 1 A 13 13 ILE N N 13 121.161 120.346 0.815 1
1 66 . 6 1 1 A 14 14 GLY H H 14 8.823 8.496 0.327 1
1 67 . 6 1 1 A 14 14 GLY HA2 H 14 4.147 3.745 0.402 1
1 68 . 6 1 1 A 14 14 GLY HA3 H 14 3.982 3.751 0.231 1
1 69 . 6 1 1 A 14 14 GLY CA C 14 47.750 47.408 0.342 1
1 70 . 6 1 1 A 14 14 GLY N N 14 108.982 107.855 1.127 1
1 71 . 6 1 1 A 15 15 ILE H H 15 8.681 8.563 0.118 1
1 72 . 6 1 1 A 15 15 ILE CA C 15 64.996 65.048 -0.052 1
1 73 . 6 1 1 A 15 15 ILE CB C 15 37.107 37.946 -0.839 1
1 74 . 6 1 1 A 15 15 ILE N N 15 121.601 122.601 -1.000 1
1 75 . 6 1 1 A 16 16 PHE H H 16 7.103 8.610 -1.507 1
1 76 . 6 1 1 A 16 16 PHE CA C 16 62.910 61.761 1.149 1
1 77 . 6 1 1 A 16 16 PHE CB C 16 38.782 39.097 -0.315 1
1 78 . 6 1 1 A 16 16 PHE N N 16 118.660 120.691 -2.031 1
1 79 . 6 1 1 A 17 17 HIS H H 17 7.591 8.572 -0.981 1
1 80 . 6 1 1 A 17 17 HIS HA H 17 4.793 4.453 0.340 1
1 82 . 6 1 1 A 17 17 HIS CA C 17 58.125 59.512 -1.387 1
1 83 . 6 1 1 A 17 17 HIS CB C 17 29.584 29.827 -0.243 1
1 84 . 6 1 1 A 17 17 HIS N N 17 114.968 118.647 -3.679 1
1 85 . 6 1 1 A 18 18 LYS H H 18 8.144 8.493 -0.349 1
1 86 . 6 1 1 A 18 18 LYS CA C 18 58.975 58.959 0.016 1
1 87 . 6 1 1 A 18 18 LYS CB C 18 32.379 31.926 0.453 1
1 88 . 6 1 1 A 18 18 LYS N N 18 122.373 118.251 4.122 1
1 89 . 6 1 1 A 19 19 TYR H H 19 6.999 7.458 -0.459 1
1 90 . 6 1 1 A 19 19 TYR CA C 19 60.318 60.513 -0.195 1
1 91 . 6 1 1 A 19 19 TYR CB C 19 40.355 38.406 1.949 1
1 92 . 6 1 1 A 19 19 TYR N N 19 113.614 119.490 -5.876 1
1 93 . 6 1 1 A 20 20 SER H H 20 8.432 7.924 0.508 1
1 94 . 6 1 1 A 20 20 SER CA C 20 61.897 61.127 0.770 1
1 95 . 6 1 1 A 20 20 SER CB C 20 61.354 62.294 -0.940 1
1 96 . 6 1 1 A 20 20 SER N N 20 113.201 114.884 -1.683 1
1 97 . 6 1 1 A 21 21 GLY H H 21 7.678 7.981 -0.303 1
1 98 . 6 1 1 A 21 21 GLY HA2 H 21 4.195 3.803 0.392 1
1 99 . 6 1 1 A 21 21 GLY HA3 H 21 3.900 3.825 0.075 1
1 100 . 6 1 1 A 21 21 GLY CA C 21 45.628 46.444 -0.816 1
1 101 . 6 1 1 A 21 21 GLY N N 21 110.734 109.589 1.145 1
1 102 . 6 1 1 A 22 22 LYS H H 22 7.362 7.726 -0.364 1
1 103 . 6 1 1 A 22 22 LYS CA C 22 60.163 58.848 1.315 1
1 104 . 6 1 1 A 22 22 LYS CB C 22 32.554 32.033 0.521 1
1 105 . 6 1 1 A 22 22 LYS N N 22 122.161 120.859 1.302 1
1 106 . 6 1 1 A 23 23 GLU H H 23 9.639 7.772 1.867 1
1 107 . 6 1 1 A 23 23 GLU CA C 23 54.449 56.479 -2.030 1
1 108 . 6 1 1 A 23 23 GLU N N 23 116.288 115.524 0.764 1
1 109 . 6 1 1 A 24 24 GLY HA2 H 24 3.912 3.923 -0.011 1
1 110 . 6 1 1 A 24 24 GLY HA3 H 24 3.787 3.935 -0.148 1
1 111 . 6 1 1 A 24 24 GLY CA C 24 45.898 45.731 0.167 1
1 112 . 6 1 1 A 25 25 ASP H H 25 8.204 7.961 0.243 1
1 113 . 6 1 1 A 25 25 ASP CA C 25 55.252 56.414 -1.162 1
1 114 . 6 1 1 A 25 25 ASP N N 25 125.671 121.762 3.909 1
1 115 . 6 1 1 A 26 26 LYS CA C 26 57.851 55.696 2.155 1
1 116 . 6 1 1 A 26 26 LYS CB C 26 31.265 35.822 -4.557 1
1 117 . 6 1 1 A 27 27 HIS H H 27 9.763 9.120 0.643 1
1 118 . 6 1 1 A 27 27 HIS CA C 27 55.580 55.775 -0.195 1
1 119 . 6 1 1 A 27 27 HIS CB C 27 30.936 29.302 1.634 1
1 120 . 6 1 1 A 27 27 HIS N N 27 118.108 119.937 -1.829 1
1 121 . 6 1 1 A 28 28 THR H H 28 7.325 8.054 -0.729 1
1 126 . 6 1 1 A 28 28 THR CA C 28 60.128 60.125 0.003 1
1 127 . 6 1 1 A 28 28 THR CB C 28 72.268 71.940 0.328 1
1 128 . 6 1 1 A 28 28 THR N N 28 106.920 115.009 -8.089 1
1 129 . 6 1 1 A 29 29 LEU H H 29 9.422 9.092 0.330 1
1 130 . 6 1 1 A 29 29 LEU HA H 29 5.368 5.070 0.298 1
1 140 . 6 1 1 A 29 29 LEU CA C 29 52.567 53.375 -0.808 1
1 141 . 6 1 1 A 29 29 LEU CB C 29 43.523 45.194 -1.671 1
1 142 . 6 1 1 A 29 29 LEU N N 29 125.021 125.994 -0.973 1
1 143 . 6 1 1 A 30 30 SER H H 30 10.485 8.713 1.772 1
1 144 . 6 1 1 A 30 30 SER CA C 30 56.653 56.989 -0.336 1
1 145 . 6 1 1 A 30 30 SER CB C 30 65.313 65.639 -0.326 1
1 146 . 6 1 1 A 30 30 SER N N 30 124.758 116.521 8.237 1
1 147 . 6 1 1 A 31 31 LYS H H 31 8.728 8.593 0.135 1
1 148 . 6 1 1 A 31 31 LYS CA C 31 59.669 59.399 0.270 1
1 149 . 6 1 1 A 31 31 LYS CB C 31 31.763 32.148 -0.385 1
1 150 . 6 1 1 A 31 31 LYS N N 31 119.459 119.383 0.076 1
1 151 . 6 1 1 A 32 32 LYS H H 32 7.857 7.995 -0.138 1
1 152 . 6 1 1 A 32 32 LYS CA C 32 59.721 59.388 0.333 1
1 153 . 6 1 1 A 32 32 LYS CB C 32 32.901 32.109 0.792 1
1 154 . 6 1 1 A 32 32 LYS N N 32 117.933 119.463 -1.530 1
1 155 . 6 1 1 A 33 33 GLU H H 33 7.559 7.734 -0.175 1
1 156 . 6 1 1 A 33 33 GLU CA C 33 59.169 58.973 0.196 1
1 157 . 6 1 1 A 33 33 GLU CB C 33 31.014 29.489 1.525 1
1 158 . 6 1 1 A 33 33 GLU N N 33 120.407 118.986 1.421 1
1 159 . 6 1 1 A 34 34 LEU H H 34 8.833 8.407 0.426 1
1 160 . 6 1 1 A 34 34 LEU CA C 34 56.928 57.834 -0.906 1
1 161 . 6 1 1 A 34 34 LEU CB C 34 41.435 41.803 -0.368 1
1 162 . 6 1 1 A 34 34 LEU N N 34 117.677 121.218 -3.541 1
1 163 . 6 1 1 A 35 35 LYS H H 35 8.010 7.992 0.018 1
1 164 . 6 1 1 A 35 35 LYS CA C 35 60.692 59.636 1.056 1
1 165 . 6 1 1 A 35 35 LYS CB C 35 32.223 32.101 0.122 1
1 166 . 6 1 1 A 35 35 LYS N N 35 119.829 118.708 1.121 1
1 167 . 6 1 1 A 36 36 GLU H H 36 7.169 7.963 -0.794 1
1 168 . 6 1 1 A 36 36 GLU CA C 36 59.588 59.071 0.517 1
1 169 . 6 1 1 A 36 36 GLU CB C 36 29.342 29.421 -0.079 1
1 170 . 6 1 1 A 36 36 GLU N N 36 117.340 119.193 -1.853 1
1 171 . 6 1 1 A 37 37 LEU H H 37 7.478 7.819 -0.341 1
1 172 . 6 1 1 A 37 37 LEU CA C 37 59.674 57.668 2.006 1
1 173 . 6 1 1 A 37 37 LEU CB C 37 42.142 41.163 0.979 1
1 174 . 6 1 1 A 37 37 LEU N N 37 120.884 120.310 0.574 1
1 175 . 6 1 1 A 38 38 ILE H H 38 8.377 8.273 0.104 1
1 176 . 6 1 1 A 38 38 ILE CA C 38 65.651 65.167 0.484 1
1 177 . 6 1 1 A 38 38 ILE N N 38 118.450 119.945 -1.495 1
1 178 . 6 1 1 A 39 39 GLN H H 39 8.217 8.166 0.051 1
1 179 . 6 1 1 A 39 39 GLN CA C 39 59.788 58.824 0.964 1
1 180 . 6 1 1 A 39 39 GLN CB C 39 29.278 28.350 0.928 1
1 181 . 6 1 1 A 39 39 GLN N N 39 113.091 117.755 -4.664 1
1 182 . 6 1 1 A 40 40 LYS H H 40 8.426 7.601 0.825 1
1 183 . 6 1 1 A 40 40 LYS CA C 40 57.807 58.760 -0.953 1
1 184 . 6 1 1 A 40 40 LYS CB C 40 33.942 33.203 0.739 1
1 185 . 6 1 1 A 40 40 LYS N N 40 114.771 118.660 -3.889 1
1 186 . 6 1 1 A 41 41 GLU H H 41 8.496 8.391 0.105 1
1 187 . 6 1 1 A 41 41 GLU CA C 41 55.395 57.854 -2.459 1
1 188 . 6 1 1 A 41 41 GLU CB C 41 29.260 30.511 -1.251 1
1 189 . 6 1 1 A 41 41 GLU N N 41 112.546 116.635 -4.089 1
1 190 . 6 1 1 A 42 42 LEU H H 42 7.267 7.703 -0.436 1
1 191 . 6 1 1 A 42 42 LEU CA C 42 53.776 53.743 0.033 1
1 192 . 6 1 1 A 42 42 LEU N N 42 118.657 121.158 -2.501 1
1 193 . 6 1 1 A 44 44 ILE CA C 44 62.210 60.955 1.255 1
1 194 . 6 1 1 A 44 44 ILE CB C 44 38.247 37.917 0.330 1
1 195 . 6 1 1 A 45 45 GLY H H 45 7.820 8.058 -0.238 1
1 196 . 6 1 1 A 45 45 GLY CA C 45 47.742 44.998 2.744 1
1 197 . 6 1 1 A 45 45 GLY N N 45 108.178 113.049 -4.871 1
1 198 . 6 1 1 A 46 46 SER H H 46 7.895 8.848 -0.953 1
1 199 . 6 1 1 A 46 46 SER CA C 46 59.958 58.876 1.082 1
1 200 . 6 1 1 A 46 46 SER CB C 46 63.450 63.345 0.105 1
1 201 . 6 1 1 A 46 46 SER N N 46 113.038 119.062 -6.024 1
1 202 . 6 1 1 A 47 47 LYS H H 47 7.736 7.655 0.081 1
1 203 . 6 1 1 A 47 47 LYS CA C 47 55.636 56.794 -1.158 1
1 204 . 6 1 1 A 47 47 LYS CB C 47 33.103 32.850 0.253 1
1 205 . 6 1 1 A 47 47 LYS N N 47 119.422 122.227 -2.805 1
1 206 . 6 1 1 A 48 48 LEU H H 48 6.988 8.455 -1.467 1
1 207 . 6 1 1 A 48 48 LEU HA H 48 4.497 4.470 0.027 1
1 217 . 6 1 1 A 48 48 LEU CA C 48 54.517 54.976 -0.459 1
1 218 . 6 1 1 A 48 48 LEU CB C 48 42.987 42.250 0.737 1
1 219 . 6 1 1 A 48 48 LEU N N 48 118.908 126.810 -7.902 1
1 220 . 6 1 1 A 49 49 GLN H H 49 9.206 8.723 0.483 1
1 221 . 6 1 1 A 49 49 GLN HA H 49 4.486 4.655 -0.169 1
1 223 . 6 1 1 A 49 49 GLN CA C 49 54.785 55.325 -0.540 1
1 224 . 6 1 1 A 49 49 GLN CB C 49 29.636 29.791 -0.155 1
1 225 . 6 1 1 A 49 49 GLN N N 49 121.275 125.330 -4.055 1
1 226 . 6 1 1 A 50 50 ASP H H 50 8.854 7.960 0.894 1
1 227 . 6 1 1 A 50 50 ASP CA C 50 59.078 58.072 1.006 1
1 228 . 6 1 1 A 50 50 ASP CB C 50 40.632 42.009 -1.377 1
1 229 . 6 1 1 A 50 50 ASP N N 50 123.430 122.108 1.322 1
1 230 . 6 1 1 A 51 51 ALA H H 51 8.720 8.010 0.710 1
1 231 . 6 1 1 A 51 51 ALA CA C 51 55.281 54.872 0.409 1
1 232 . 6 1 1 A 51 51 ALA CB C 51 18.205 18.105 0.100 1
1 233 . 6 1 1 A 51 51 ALA N N 51 117.829 121.277 -3.448 1
1 234 . 6 1 1 A 52 52 GLU H H 52 7.161 7.779 -0.618 1
1 235 . 6 1 1 A 52 52 GLU CA C 52 58.757 58.907 -0.150 1
1 236 . 6 1 1 A 52 52 GLU CB C 52 30.247 29.440 0.807 1
1 237 . 6 1 1 A 52 52 GLU N N 52 115.459 117.422 -1.963 1
1 238 . 6 1 1 A 53 53 ILE H H 53 7.962 8.198 -0.236 1
1 239 . 6 1 1 A 53 53 ILE CA C 53 65.525 65.117 0.408 1
1 240 . 6 1 1 A 53 53 ILE CB C 53 37.289 37.977 -0.688 1
1 241 . 6 1 1 A 53 53 ILE N N 53 120.414 121.392 -0.978 1
1 242 . 6 1 1 A 54 54 VAL H H 54 8.132 8.049 0.083 1
1 243 . 6 1 1 A 54 54 VAL CA C 54 67.290 65.397 1.893 1
1 244 . 6 1 1 A 54 54 VAL CB C 54 31.434 31.178 0.256 1
1 245 . 6 1 1 A 54 54 VAL N N 54 119.775 116.919 2.856 1
1 246 . 6 1 1 A 55 55 LYS H H 55 7.155 8.013 -0.858 1
1 247 . 6 1 1 A 55 55 LYS CA C 55 59.131 59.145 -0.014 1
1 248 . 6 1 1 A 55 55 LYS CB C 55 32.131 31.889 0.242 1
1 249 . 6 1 1 A 55 55 LYS N N 55 119.175 120.782 -1.607 1
1 250 . 6 1 1 A 56 56 LEU H H 56 7.837 8.297 -0.460 1
1 251 . 6 1 1 A 56 56 LEU CA C 56 58.052 58.018 0.034 1
1 252 . 6 1 1 A 56 56 LEU CB C 56 41.878 41.675 0.203 1
1 253 . 6 1 1 A 56 56 LEU N N 56 119.679 121.097 -1.418 1
1 254 . 6 1 1 A 57 57 MET H H 57 8.385 8.831 -0.446 1
1 255 . 6 1 1 A 57 57 MET CA C 57 60.756 58.849 1.907 1
1 256 . 6 1 1 A 57 57 MET CB C 57 33.152 31.907 1.245 1
1 257 . 6 1 1 A 57 57 MET N N 57 115.116 119.464 -4.348 1
1 258 . 6 1 1 A 58 58 ASP H H 58 7.591 8.308 -0.717 1
1 259 . 6 1 1 A 58 58 ASP CA C 58 57.365 57.505 -0.140 1
1 260 . 6 1 1 A 58 58 ASP CB C 58 40.858 41.495 -0.637 1
1 261 . 6 1 1 A 58 58 ASP N N 58 118.197 119.701 -1.504 1
1 262 . 6 1 1 A 59 59 ASP H H 59 7.725 8.027 -0.302 1
1 263 . 6 1 1 A 59 59 ASP CA C 59 56.830 56.419 0.411 1
1 264 . 6 1 1 A 59 59 ASP CB C 59 40.567 40.931 -0.364 1
1 265 . 6 1 1 A 59 59 ASP N N 59 118.481 119.467 -0.986 1
1 266 . 6 1 1 A 60 60 LEU H H 60 7.703 7.650 0.053 1
1 267 . 6 1 1 A 60 60 LEU CA C 60 56.564 57.518 -0.954 1
1 268 . 6 1 1 A 60 60 LEU CB C 60 42.714 41.609 1.105 1
1 269 . 6 1 1 A 60 60 LEU N N 60 116.935 119.453 -2.518 1
1 270 . 6 1 1 A 61 61 ASP H H 61 7.143 8.393 -1.250 1
1 271 . 6 1 1 A 61 61 ASP HA H 61 4.690 4.468 0.222 1
1 274 . 6 1 1 A 61 61 ASP CA C 61 52.286 56.512 -4.226 1
1 275 . 6 1 1 A 61 61 ASP CB C 61 39.245 41.520 -2.275 1
1 276 . 6 1 1 A 61 61 ASP N N 61 116.605 118.988 -2.383 1
1 277 . 6 1 1 A 62 62 ARG H H 62 7.786 8.059 -0.273 1
1 278 . 6 1 1 A 62 62 ARG CA C 62 58.328 58.197 0.131 1
1 279 . 6 1 1 A 62 62 ARG CB C 62 30.106 29.158 0.948 1
1 280 . 6 1 1 A 62 62 ARG N N 62 125.967 117.800 8.167 1
1 281 . 6 1 1 A 63 63 ASN H H 63 7.945 7.727 0.218 1
1 282 . 6 1 1 A 63 63 ASN CA C 63 51.863 55.996 -4.133 1
1 283 . 6 1 1 A 63 63 ASN CB C 63 36.809 38.647 -1.838 1
1 284 . 6 1 1 A 63 63 ASN N N 63 112.434 118.871 -6.437 1
1 285 . 6 1 1 A 64 64 LYS H H 64 7.477 8.054 -0.577 1
1 286 . 6 1 1 A 64 64 LYS CA C 64 56.524 56.824 -0.300 1
1 287 . 6 1 1 A 64 64 LYS N N 64 114.197 118.004 -3.807 1
1 288 . 6 1 1 A 65 65 ASP H H 65 8.345 8.627 -0.282 1
1 289 . 6 1 1 A 65 65 ASP CA C 65 52.969 55.484 -2.515 1
1 290 . 6 1 1 A 65 65 ASP CB C 65 40.329 40.415 -0.086 1
1 291 . 6 1 1 A 65 65 ASP N N 65 118.581 119.529 -0.948 1
1 292 . 6 1 1 A 66 66 GLN H H 66 9.945 7.916 2.029 1
1 293 . 6 1 1 A 66 66 GLN CA C 66 58.132 56.989 1.143 1
1 294 . 6 1 1 A 66 66 GLN CB C 66 26.035 31.995 -5.960 1
1 295 . 6 1 1 A 66 66 GLN N N 66 113.203 118.411 -5.208 1
1 296 . 6 1 1 A 67 67 GLU H H 67 7.880 7.697 0.183 1
1 297 . 6 1 1 A 67 67 GLU HA H 67 4.910 5.015 -0.105 1
1 302 . 6 1 1 A 67 67 GLU CA C 67 54.082 55.008 -0.926 1
1 303 . 6 1 1 A 67 67 GLU CB C 67 33.174 34.587 -1.413 1
1 304 . 6 1 1 A 67 67 GLU N N 67 118.554 117.083 1.471 1
1 305 . 6 1 1 A 68 68 VAL H H 68 9.669 9.448 0.221 1
1 306 . 6 1 1 A 68 68 VAL HA H 68 5.465 4.865 0.600 1
1 314 . 6 1 1 A 68 68 VAL CA C 68 61.079 60.092 0.987 1
1 315 . 6 1 1 A 68 68 VAL CB C 68 33.280 34.264 -0.984 1
1 316 . 6 1 1 A 68 68 VAL N N 68 126.572 121.934 4.638 1
1 317 . 6 1 1 A 69 69 ASN H H 69 8.985 8.695 0.290 1
1 318 . 6 1 1 A 69 69 ASN CA C 69 50.812 53.217 -2.405 1
1 319 . 6 1 1 A 69 69 ASN CB C 69 38.609 40.276 -1.667 1
1 320 . 6 1 1 A 69 69 ASN N N 69 127.472 126.767 0.705 1
1 321 . 6 1 1 A 70 70 PHE H H 70 9.100 9.142 -0.042 1
1 322 . 6 1 1 A 70 70 PHE CA C 70 63.279 61.941 1.338 1
1 323 . 6 1 1 A 70 70 PHE CB C 70 38.741 39.534 -0.793 1
1 324 . 6 1 1 A 70 70 PHE N N 70 119.972 127.261 -7.289 1
1 325 . 6 1 1 A 71 71 GLN H H 71 8.342 8.296 0.046 1
1 326 . 6 1 1 A 71 71 GLN HA H 71 3.923 3.818 0.105 1
1 329 . 6 1 1 A 71 71 GLN CA C 71 59.866 58.524 1.342 1
1 330 . 6 1 1 A 71 71 GLN CB C 71 27.878 28.299 -0.421 1
1 331 . 6 1 1 A 71 71 GLN N N 71 118.216 117.533 0.683 1
1 332 . 6 1 1 A 72 72 GLU H H 72 8.721 7.795 0.926 1
1 333 . 6 1 1 A 72 72 GLU HA H 72 4.147 4.091 0.056 1
1 338 . 6 1 1 A 72 72 GLU CA C 72 59.313 58.705 0.608 1
1 339 . 6 1 1 A 72 72 GLU CB C 72 30.233 29.485 0.748 1
1 340 . 6 1 1 A 72 72 GLU N N 72 121.455 119.586 1.869 1
1 341 . 6 1 1 A 73 73 TYR H H 73 8.536 8.002 0.534 1
1 342 . 6 1 1 A 73 73 TYR CA C 73 60.961 61.527 -0.566 1
1 343 . 6 1 1 A 73 73 TYR CB C 73 38.724 38.733 -0.009 1
1 344 . 6 1 1 A 73 73 TYR N N 73 123.356 122.546 0.810 1
1 345 . 6 1 1 A 74 74 ILE H H 74 8.642 8.107 0.535 1
1 346 . 6 1 1 A 74 74 ILE CA C 74 61.880 64.276 -2.396 1
1 347 . 6 1 1 A 74 74 ILE CB C 74 36.077 37.640 -1.563 1
1 348 . 6 1 1 A 74 74 ILE N N 74 119.799 120.381 -0.582 1
1 349 . 6 1 1 A 75 75 THR H H 75 7.959 7.965 -0.006 1
1 354 . 6 1 1 A 75 75 THR CA C 75 67.056 66.853 0.203 1
1 355 . 6 1 1 A 75 75 THR CB C 75 68.386 68.444 -0.058 1
1 356 . 6 1 1 A 75 75 THR N N 75 119.486 117.484 2.002 1
1 357 . 6 1 1 A 76 76 PHE H H 76 7.450 8.392 -0.942 1
1 358 . 6 1 1 A 76 76 PHE CA C 76 59.010 61.698 -2.688 1
1 359 . 6 1 1 A 76 76 PHE CB C 76 38.139 39.244 -1.105 1
1 360 . 6 1 1 A 76 76 PHE N N 76 122.873 121.726 1.147 1
1 361 . 6 1 1 A 77 77 LEU H H 77 7.829 8.345 -0.516 1
1 362 . 6 1 1 A 77 77 LEU CA C 77 57.450 57.651 -0.201 1
1 363 . 6 1 1 A 77 77 LEU CB C 77 40.560 40.956 -0.396 1
1 364 . 6 1 1 A 77 77 LEU N N 77 117.405 118.282 -0.877 1
1 365 . 6 1 1 A 78 78 GLY H H 78 8.093 8.123 -0.030 1
1 366 . 6 1 1 A 78 78 GLY HA2 H 78 3.661 3.720 -0.059 1
1 367 . 6 1 1 A 78 78 GLY HA3 H 78 3.594 3.728 -0.134 1
1 368 . 6 1 1 A 78 78 GLY CA C 78 47.442 47.245 0.197 1
1 369 . 6 1 1 A 78 78 GLY N N 78 105.528 106.136 -0.608 1
1 370 . 6 1 1 A 79 79 ALA H H 79 7.759 7.698 0.061 1
1 371 . 6 1 1 A 79 79 ALA CA C 79 55.153 54.351 0.802 1
1 372 . 6 1 1 A 79 79 ALA CB C 79 17.768 18.179 -0.411 1
1 373 . 6 1 1 A 79 79 ALA N N 79 124.488 125.106 -0.618 1
1 374 . 6 1 1 A 80 80 LEU H H 80 7.963 7.986 -0.023 1
1 375 . 6 1 1 A 80 80 LEU CA C 80 57.464 57.335 0.129 1
1 376 . 6 1 1 A 80 80 LEU CB C 80 41.496 41.202 0.294 1
1 377 . 6 1 1 A 80 80 LEU N N 80 117.869 120.386 -2.517 1
1 378 . 6 1 1 A 81 81 ALA H H 81 8.365 8.349 0.016 1
1 379 . 6 1 1 A 81 81 ALA CA C 81 55.475 55.181 0.294 1
1 380 . 6 1 1 A 81 81 ALA CB C 81 17.483 18.002 -0.519 1
1 381 . 6 1 1 A 81 81 ALA N N 81 119.054 120.802 -1.748 1
1 382 . 6 1 1 A 82 82 MET H H 82 8.112 7.813 0.299 1
1 383 . 6 1 1 A 82 82 MET CA C 82 59.516 58.011 1.505 1
1 384 . 6 1 1 A 82 82 MET CB C 82 32.550 32.147 0.403 1
1 385 . 6 1 1 A 82 82 MET N N 82 115.364 118.089 -2.725 1
1 386 . 6 1 1 A 83 83 ILE H H 83 7.981 8.171 -0.190 1
1 387 . 6 1 1 A 83 83 ILE HA H 83 3.839 3.640 0.199 1
1 391 . 6 1 1 A 83 83 ILE CA C 83 64.467 64.189 0.278 1
1 392 . 6 1 1 A 83 83 ILE CB C 83 37.312 37.176 0.136 1
1 393 . 6 1 1 A 83 83 ILE N N 83 120.887 120.148 0.739 1
1 394 . 6 1 1 A 84 84 TYR H H 84 8.731 7.577 1.154 1
1 395 . 6 1 1 A 84 84 TYR N N 84 120.933 121.760 -0.827 1
1 396 . 6 1 1 A 87 87 ALA H H 87 7.829 7.920 -0.091 1
1 397 . 6 1 1 A 87 87 ALA CA C 87 53.768 54.237 -0.469 1
1 398 . 6 1 1 A 87 87 ALA CB C 87 18.504 18.326 0.178 1
1 399 . 6 1 1 A 87 87 ALA N N 87 120.274 121.331 -1.057 1
1 400 . 6 1 1 A 88 88 LEU H H 88 7.499 7.494 0.005 1
1 401 . 6 1 1 A 88 88 LEU CA C 88 55.605 54.708 0.897 1
1 402 . 6 1 1 A 88 88 LEU CB C 88 42.047 41.853 0.194 1
1 403 . 6 1 1 A 88 88 LEU N N 88 117.356 116.211 1.145 1
1 404 . 6 1 1 A 89 89 LYS H H 89 7.561 7.885 -0.324 1
1 405 . 6 1 1 A 89 89 LYS CA C 89 56.865 57.173 -0.308 1
1 406 . 6 1 1 A 89 89 LYS CB C 89 32.592 35.183 -2.591 1
1 407 . 6 1 1 A 89 89 LYS N N 89 119.289 118.998 0.291 1
1 416 . 6 3 2 C 6 6 GLU H H 190 8.385 7.877 0.508 1
1 417 . 6 3 2 C 6 6 GLU HA H 190 4.153 4.459 -0.306 1
1 422 . 6 3 2 C 6 6 GLU C C 190 175.031 177.484 -2.453 1
1 423 . 6 3 2 C 6 6 GLU CA C 190 58.866 56.859 2.007 1
1 424 . 6 3 2 C 6 6 GLU CB C 190 30.751 30.021 0.730 1
1 426 . 6 3 2 C 6 6 GLU N N 190 122.715 119.480 3.235 1
1 427 . 6 3 2 C 7 7 GLY H H 191 8.475 8.775 -0.300 1
1 428 . 6 3 2 C 7 7 GLY HA2 H 191 3.887 3.923 -0.036 1
1 429 . 6 3 2 C 7 7 GLY HA3 H 191 3.887 3.924 -0.037 1
1 430 . 6 3 2 C 7 7 GLY C C 191 177.922 175.806 2.116 1
1 431 . 6 3 2 C 7 7 GLY CA C 191 46.884 46.880 0.004 1
1 432 . 6 3 2 C 7 7 GLY N N 191 109.009 112.352 -3.343 1
1 433 . 6 3 2 C 8 8 LEU HA H 192 4.095 3.893 0.202 1
1 443 . 6 3 2 C 8 8 LEU CA C 192 58.154 58.141 0.013 1
1 444 . 6 3 2 C 8 8 LEU CB C 192 42.789 41.556 1.233 1
1 448 . 6 3 2 C 9 9 MET H H 193 8.250 8.573 -0.323 1
1 449 . 6 3 2 C 9 9 MET HA H 193 4.150 4.234 -0.084 1
1 457 . 6 3 2 C 9 9 MET C C 193 178.421 178.167 0.254 1
1 458 . 6 3 2 C 9 9 MET CA C 193 58.818 58.241 0.577 1
1 459 . 6 3 2 C 9 9 MET CB C 193 32.360 32.072 0.288 1
1 462 . 6 3 2 C 9 9 MET N N 193 117.049 118.057 -1.008 1
1 463 . 6 3 2 C 10 10 ASN H H 194 7.892 8.186 -0.294 1
1 464 . 6 3 2 C 10 10 ASN HA H 194 4.468 4.485 -0.017 1
1 469 . 6 3 2 C 10 10 ASN C C 194 178.099 176.541 1.558 1
1 470 . 6 3 2 C 10 10 ASN CA C 194 56.644 55.554 1.090 1
1 471 . 6 3 2 C 10 10 ASN CB C 194 39.100 38.789 0.311 1
1 472 . 6 3 2 C 10 10 ASN N N 194 117.034 118.713 -1.679 1
1 474 . 6 3 2 C 11 11 VAL H H 195 7.651 7.971 -0.320 1
1 475 . 6 3 2 C 11 11 VAL HA H 195 3.735 3.846 -0.111 1
1 483 . 6 3 2 C 11 11 VAL C C 195 177.657 178.294 -0.637 1
1 484 . 6 3 2 C 11 11 VAL CA C 195 66.710 65.084 1.626 1
1 485 . 6 3 2 C 11 11 VAL CB C 195 32.468 32.046 0.422 1
1 488 . 6 3 2 C 11 11 VAL N N 195 119.878 118.136 1.742 1
1 489 . 6 3 2 C 12 12 LEU H H 196 8.030 8.196 -0.166 1
1 490 . 6 3 2 C 12 12 LEU HA H 196 4.013 3.903 0.110 1
1 500 . 6 3 2 C 12 12 LEU C C 196 177.540 179.349 -1.809 1
1 501 . 6 3 2 C 12 12 LEU CA C 196 58.489 58.265 0.224 1
1 502 . 6 3 2 C 12 12 LEU CB C 196 42.457 41.550 0.907 1
1 506 . 6 3 2 C 12 12 LEU N N 196 119.499 120.619 -1.120 1
1 507 . 6 3 2 C 13 13 LYS H H 197 8.015 8.321 -0.306 1
1 508 . 6 3 2 C 13 13 LYS HA H 197 3.949 4.014 -0.065 1
1 517 . 6 3 2 C 13 13 LYS C C 197 178.419 179.371 -0.952 1
1 518 . 6 3 2 C 13 13 LYS CA C 197 60.191 59.609 0.582 1
1 519 . 6 3 2 C 13 13 LYS CB C 197 33.075 32.169 0.906 1
1 523 . 6 3 2 C 13 13 LYS N N 197 117.888 120.613 -2.725 1
1 524 . 6 3 2 C 14 14 LYS H H 198 7.506 7.831 -0.325 1
1 525 . 6 3 2 C 14 14 LYS HA H 198 4.127 4.186 -0.059 1
1 534 . 6 3 2 C 14 14 LYS C C 198 178.262 177.605 0.657 1
1 535 . 6 3 2 C 14 14 LYS CA C 198 59.161 58.212 0.949 1
1 536 . 6 3 2 C 14 14 LYS CB C 198 32.956 32.300 0.656 1
1 540 . 6 3 2 C 14 14 LYS N N 198 118.321 117.982 0.339 1
1 541 . 6 3 2 C 15 15 ILE H H 199 7.780 7.481 0.299 1
1 542 . 6 3 2 C 15 15 ILE HA H 199 3.787 3.956 -0.169 1
1 552 . 6 3 2 C 15 15 ILE C C 199 178.647 177.549 1.098 1
1 553 . 6 3 2 C 15 15 ILE CA C 199 64.912 63.210 1.702 1
1 554 . 6 3 2 C 15 15 ILE CB C 199 38.780 38.135 0.645 1
1 558 . 6 3 2 C 15 15 ILE N N 199 118.644 117.605 1.039 1
1 559 . 6 3 2 C 16 16 TYR H H 200 7.918 8.549 -0.631 1
1 560 . 6 3 2 C 16 16 TYR HA H 200 4.252 4.014 0.238 1
1 567 . 6 3 2 C 16 16 TYR C C 200 177.806 177.863 -0.057 1
1 568 . 6 3 2 C 16 16 TYR CA C 200 61.171 62.208 -1.037 1
1 569 . 6 3 2 C 16 16 TYR CB C 200 39.245 38.856 0.389 1
1 573 . 6 3 2 C 16 16 TYR N N 200 118.683 121.299 -2.616 1
1 574 . 6 3 2 C 17 17 GLU H H 201 8.089 8.981 -0.892 1
1 575 . 6 3 2 C 17 17 GLU HA H 201 4.124 4.013 0.111 1
1 580 . 6 3 2 C 17 17 GLU C C 201 177.414 177.661 -0.247 1
1 581 . 6 3 2 C 17 17 GLU CA C 201 58.784 57.910 0.874 1
1 582 . 6 3 2 C 17 17 GLU CB C 201 30.747 28.313 2.434 1
1 584 . 6 3 2 C 17 17 GLU N N 201 119.409 117.145 2.264 1
1 585 . 6 3 2 C 18 18 ASP H H 202 8.023 7.578 0.445 1
1 586 . 6 3 2 C 18 18 ASP HA H 202 4.657 4.653 0.004 1
1 589 . 6 3 2 C 18 18 ASP C C 202 177.346 176.118 1.228 1
1 590 . 6 3 2 C 18 18 ASP CA C 202 55.496 54.321 1.175 1
1 591 . 6 3 2 C 18 18 ASP CB C 202 42.023 41.098 0.925 1
1 592 . 6 3 2 C 18 18 ASP N N 202 119.459 120.617 -1.158 1
1 593 . 6 3 2 C 19 19 GLY H H 203 7.933 7.350 0.583 1
1 594 . 6 3 2 C 19 19 GLY HA2 H 203 3.938 3.949 -0.011 1
1 595 . 6 3 2 C 19 19 GLY HA3 H 203 3.938 3.983 -0.045 1
1 596 . 6 3 2 C 19 19 GLY C C 203 177.240 174.025 3.215 1
1 597 . 6 3 2 C 19 19 GLY CA C 203 46.309 44.984 1.325 1
1 598 . 6 3 2 C 19 19 GLY N N 203 108.518 106.968 1.550 1
1 599 . 6 3 2 C 20 20 ASP H H 204 8.091 7.791 0.300 1
1 600 . 6 3 2 C 20 20 ASP HA H 204 4.616 4.597 0.019 1
1 603 . 6 3 2 C 20 20 ASP C C 204 173.979 175.372 -1.393 1
1 604 . 6 3 2 C 20 20 ASP CA C 204 55.064 54.849 0.215 1
1 605 . 6 3 2 C 20 20 ASP CB C 204 42.203 41.714 0.489 1
1 606 . 6 3 2 C 20 20 ASP N N 204 120.172 120.195 -0.023 1
1 607 . 6 3 2 C 21 21 ASP H H 205 8.352 8.857 -0.505 1
1 608 . 6 3 2 C 21 21 ASP HA H 205 4.468 4.810 -0.342 1
1 611 . 6 3 2 C 21 21 ASP C C 205 176.432 176.849 -0.417 1
1 612 . 6 3 2 C 21 21 ASP CA C 205 56.663 54.950 1.713 1
1 613 . 6 3 2 C 21 21 ASP CB C 205 41.918 44.021 -2.103 1
1 614 . 6 3 2 C 21 21 ASP N N 205 121.515 123.532 -2.017 1
1 615 . 6 3 2 C 22 22 ASP H H 206 8.239 8.303 -0.064 1
1 616 . 6 3 2 C 22 22 ASP HA H 206 4.455 4.431 0.024 1
1 619 . 6 3 2 C 22 22 ASP C C 206 177.449 178.268 -0.819 1
1 620 . 6 3 2 C 22 22 ASP CA C 206 57.165 56.791 0.374 1
1 621 . 6 3 2 C 22 22 ASP CB C 206 41.820 40.330 1.490 1
1 622 . 6 3 2 C 22 22 ASP N N 206 120.156 119.886 0.270 1
1 623 . 6 3 2 C 23 23 MET H H 207 8.300 8.062 0.238 1
1 624 . 6 3 2 C 23 23 MET HA H 207 4.255 3.955 0.300 1
1 632 . 6 3 2 C 23 23 MET C C 207 178.412 177.907 0.505 1
1 633 . 6 3 2 C 23 23 MET CA C 207 58.065 58.731 -0.666 1
1 634 . 6 3 2 C 23 23 MET CB C 207 32.488 32.081 0.407 1
1 637 . 6 3 2 C 23 23 MET N N 207 120.707 119.419 1.288 1
1 638 . 6 3 2 C 24 24 LYS H H 208 8.047 7.911 0.136 1
1 639 . 6 3 2 C 24 24 LYS HA H 208 3.946 3.971 -0.025 1
1 648 . 6 3 2 C 24 24 LYS C C 208 178.008 178.472 -0.464 1
1 649 . 6 3 2 C 24 24 LYS CA C 208 59.847 59.198 0.649 1
1 650 . 6 3 2 C 24 24 LYS CB C 208 32.983 32.113 0.870 1
1 654 . 6 3 2 C 24 24 LYS N N 208 119.504 117.339 2.165 1
1 655 . 6 3 2 C 25 25 ARG H H 209 7.891 7.698 0.193 1
1 656 . 6 3 2 C 25 25 ARG HA H 209 4.168 4.037 0.131 1
1 663 . 6 3 2 C 25 25 ARG C C 209 178.100 178.561 -0.461 1
1 664 . 6 3 2 C 25 25 ARG CA C 209 58.810 59.361 -0.551 1
1 665 . 6 3 2 C 25 25 ARG CB C 209 31.080 30.553 0.527 1
1 668 . 6 3 2 C 25 25 ARG N N 209 118.378 119.418 -1.040 1
1 669 . 6 3 2 C 26 26 THR H H 210 7.869 8.103 -0.234 1
1 670 . 6 3 2 C 26 26 THR HA H 210 4.023 3.982 0.041 1
1 675 . 6 3 2 C 26 26 THR C C 210 177.984 176.285 1.699 1
1 676 . 6 3 2 C 26 26 THR CA C 210 65.747 66.992 -1.245 1
1 677 . 6 3 2 C 26 26 THR CB C 210 69.683 67.853 1.830 1
1 679 . 6 3 2 C 26 26 THR N N 210 115.443 119.050 -3.607 1
1 680 . 6 3 2 C 27 27 ILE H H 211 7.901 7.728 0.173 1
1 681 . 6 3 2 C 27 27 ILE HA H 211 4.142 2.962 1.180 1
1 691 . 6 3 2 C 27 27 ILE C C 211 175.595 177.721 -2.126 1
1 692 . 6 3 2 C 27 27 ILE CA C 211 63.528 65.869 -2.341 1
1 693 . 6 3 2 C 27 27 ILE CB C 211 38.982 36.807 2.175 1
1 697 . 6 3 2 C 27 27 ILE N N 211 121.265 121.986 -0.721 1
1 698 . 6 3 2 C 28 28 ASN HA H 212 4.465 4.326 0.139 1
1 703 . 6 3 2 C 28 28 ASN CA C 212 55.182 56.757 -1.575 1
1 704 . 6 3 2 C 28 28 ASN CB C 212 39.480 39.927 -0.447 1
1 706 . 6 3 2 C 29 29 LYS H H 213 7.968 7.874 0.094 1
1 707 . 6 3 2 C 29 29 LYS HA H 213 4.072 4.149 -0.077 1
1 716 . 6 3 2 C 29 29 LYS C C 213 176.218 178.277 -2.059 1
1 717 . 6 3 2 C 29 29 LYS CA C 213 58.489 58.665 -0.176 1
1 718 . 6 3 2 C 29 29 LYS CB C 213 33.165 32.214 0.951 1
1 722 . 6 3 2 C 29 29 LYS N N 213 120.820 118.066 2.754 1
1 723 . 6 3 2 C 30 30 ALA H H 214 7.865 7.661 0.204 1
1 724 . 6 3 2 C 30 30 ALA HA H 214 4.217 4.344 -0.127 1
1 728 . 6 3 2 C 30 30 ALA C C 214 177.041 179.564 -2.523 1
1 729 . 6 3 2 C 30 30 ALA CA C 214 54.104 54.495 -0.391 1
1 730 . 6 3 2 C 30 30 ALA CB C 214 19.496 19.095 0.401 1
1 731 . 6 3 2 C 30 30 ALA N N 214 121.571 121.150 0.421 1
1 732 . 6 3 2 C 31 31 TRP H H 215 7.831 7.820 0.011 1
1 733 . 6 3 2 C 31 31 TRP HA H 215 4.598 4.503 0.095 1
1 742 . 6 3 2 C 31 31 TRP C C 215 178.088 178.752 -0.664 1
1 743 . 6 3 2 C 31 31 TRP CA C 215 58.432 59.279 -0.847 1
1 744 . 6 3 2 C 31 31 TRP CB C 215 30.472 29.677 0.795 1
1 750 . 6 3 2 C 31 31 TRP N N 215 118.141 117.480 0.661 1
1 752 . 6 3 2 C 32 32 VAL H H 216 7.594 8.502 -0.908 1
1 753 . 6 3 2 C 32 32 VAL HA H 216 3.978 3.739 0.239 1
1 761 . 6 3 2 C 32 32 VAL C C 216 176.574 177.808 -1.234 1
1 762 . 6 3 2 C 32 32 VAL CA C 216 63.329 65.016 -1.687 1
1 763 . 6 3 2 C 32 32 VAL CB C 216 33.373 31.089 2.284 1
1 766 . 6 3 2 C 32 32 VAL N N 216 118.287 120.322 -2.035 1
1 767 . 6 3 2 C 33 33 GLU H H 217 8.012 8.325 -0.313 1
1 768 . 6 3 2 C 33 33 GLU HA H 217 4.257 4.105 0.152 1
1 773 . 6 3 2 C 33 33 GLU C C 217 176.164 177.041 -0.877 1
1 774 . 6 3 2 C 33 33 GLU CA C 217 57.409 59.353 -1.944 1
1 775 . 6 3 2 C 33 33 GLU CB C 217 30.978 29.250 1.728 1
1 777 . 6 3 2 C 33 33 GLU N N 217 122.535 121.458 1.077 1
1 778 . 6 3 2 C 34 34 SER H H 218 8.037 7.797 0.240 1
1 779 . 6 3 2 C 34 34 SER HA H 218 4.514 4.459 0.055 1
1 782 . 6 3 2 C 34 34 SER C C 218 176.451 174.598 1.853 1
1 783 . 6 3 2 C 34 34 SER CA C 218 58.987 57.853 1.134 1
1 784 . 6 3 2 C 34 34 SER CB C 218 64.569 63.957 0.612 1
1 785 . 6 3 2 C 34 34 SER N N 218 117.058 115.945 1.113 1
1 6 . 7 1 1 A 2 2 ALA H H 2 8.191 8.990 -0.799 1
1 7 . 7 1 1 A 2 2 ALA CA C 2 51.957 55.132 -3.175 1
1 8 . 7 1 1 A 2 2 ALA CB C 2 19.580 18.177 1.403 1
1 9 . 7 1 1 A 2 2 ALA N N 2 124.666 125.057 -0.391 1
1 10 . 7 1 1 A 3 3 SER H H 3 8.829 7.927 0.902 1
1 11 . 7 1 1 A 3 3 SER CA C 3 57.221 63.387 -6.166 1
1 12 . 7 1 1 A 3 3 SER N N 3 119.917 114.148 5.769 1
1 13 . 7 1 1 A 4 4 PRO CA C 4 66.688 65.821 0.867 1
1 14 . 7 1 1 A 4 4 PRO CB C 4 32.553 30.702 1.851 1
1 15 . 7 1 1 A 5 5 LEU H H 5 9.146 7.318 1.828 1
1 16 . 7 1 1 A 5 5 LEU CA C 5 59.017 57.038 1.979 1
1 17 . 7 1 1 A 5 5 LEU CB C 5 42.341 42.377 -0.036 1
1 18 . 7 1 1 A 5 5 LEU N N 5 117.902 116.602 1.300 1
1 19 . 7 1 1 A 6 6 ASP H H 6 7.572 8.717 -1.145 1
1 20 . 7 1 1 A 6 6 ASP CA C 6 57.997 57.538 0.459 1
1 21 . 7 1 1 A 6 6 ASP CB C 6 40.910 40.009 0.901 1
1 22 . 7 1 1 A 6 6 ASP N N 6 118.259 117.881 0.378 1
1 23 . 7 1 1 A 7 7 GLN H H 7 8.660 8.434 0.226 1
1 24 . 7 1 1 A 7 7 GLN HA H 7 4.064 4.141 -0.077 1
1 29 . 7 1 1 A 7 7 GLN CA C 7 59.270 57.722 1.548 1
1 30 . 7 1 1 A 7 7 GLN CB C 7 28.468 27.460 1.008 1
1 31 . 7 1 1 A 7 7 GLN N N 7 119.558 117.674 1.884 1
1 32 . 7 1 1 A 8 8 ALA H H 8 8.253 7.908 0.345 1
1 33 . 7 1 1 A 8 8 ALA CA C 8 55.519 54.677 0.842 1
1 34 . 7 1 1 A 8 8 ALA CB C 8 18.113 18.544 -0.431 1
1 35 . 7 1 1 A 8 8 ALA N N 8 123.628 122.330 1.298 1
1 36 . 7 1 1 A 9 9 ILE H H 9 8.134 8.209 -0.075 1
1 37 . 7 1 1 A 9 9 ILE CA C 9 65.261 64.469 0.792 1
1 38 . 7 1 1 A 9 9 ILE CB C 9 37.023 37.165 -0.142 1
1 39 . 7 1 1 A 9 9 ILE N N 9 117.056 117.081 -0.025 1
1 40 . 7 1 1 A 10 10 GLY H H 10 8.515 8.620 -0.105 1
1 41 . 7 1 1 A 10 10 GLY HA3 H 10 3.773 3.743 0.030 1
1 42 . 7 1 1 A 10 10 GLY CA C 10 47.637 47.045 0.592 1
1 43 . 7 1 1 A 10 10 GLY N N 10 106.202 110.828 -4.626 1
1 44 . 7 1 1 A 11 11 LEU H H 11 8.212 8.147 0.065 1
1 45 . 7 1 1 A 11 11 LEU CA C 11 58.354 57.613 0.741 1
1 46 . 7 1 1 A 11 11 LEU CB C 11 41.683 41.932 -0.249 1
1 47 . 7 1 1 A 11 11 LEU N N 11 124.624 123.659 0.965 1
1 48 . 7 1 1 A 12 12 LEU H H 12 7.971 8.116 -0.145 1
1 49 . 7 1 1 A 12 12 LEU HA H 12 4.144 4.202 -0.058 1
1 59 . 7 1 1 A 12 12 LEU CA C 12 58.691 58.418 0.273 1
1 60 . 7 1 1 A 12 12 LEU CB C 12 40.657 41.554 -0.897 1
1 61 . 7 1 1 A 12 12 LEU N N 12 118.095 118.838 -0.743 1
1 62 . 7 1 1 A 13 13 ILE H H 13 8.379 8.475 -0.096 1
1 63 . 7 1 1 A 13 13 ILE CA C 13 66.405 65.354 1.051 1
1 64 . 7 1 1 A 13 13 ILE CB C 13 38.916 38.137 0.779 1
1 65 . 7 1 1 A 13 13 ILE N N 13 121.161 120.283 0.878 1
1 66 . 7 1 1 A 14 14 GLY H H 14 8.823 8.455 0.368 1
1 67 . 7 1 1 A 14 14 GLY HA2 H 14 4.147 3.746 0.401 1
1 68 . 7 1 1 A 14 14 GLY HA3 H 14 3.982 3.762 0.220 1
1 69 . 7 1 1 A 14 14 GLY CA C 14 47.750 47.314 0.436 1
1 70 . 7 1 1 A 14 14 GLY N N 14 108.982 107.324 1.658 1
1 71 . 7 1 1 A 15 15 ILE H H 15 8.681 8.516 0.165 1
1 72 . 7 1 1 A 15 15 ILE CA C 15 64.996 64.551 0.445 1
1 73 . 7 1 1 A 15 15 ILE CB C 15 37.107 37.452 -0.345 1
1 74 . 7 1 1 A 15 15 ILE N N 15 121.601 122.613 -1.012 1
1 75 . 7 1 1 A 16 16 PHE H H 16 7.103 8.094 -0.991 1
1 76 . 7 1 1 A 16 16 PHE CA C 16 62.910 61.446 1.464 1
1 77 . 7 1 1 A 16 16 PHE CB C 16 38.782 39.719 -0.937 1
1 78 . 7 1 1 A 16 16 PHE N N 16 118.660 121.272 -2.612 1
1 79 . 7 1 1 A 17 17 HIS H H 17 7.591 8.651 -1.060 1
1 80 . 7 1 1 A 17 17 HIS HA H 17 4.793 4.421 0.372 1
1 82 . 7 1 1 A 17 17 HIS CA C 17 58.125 59.352 -1.227 1
1 83 . 7 1 1 A 17 17 HIS CB C 17 29.584 30.144 -0.560 1
1 84 . 7 1 1 A 17 17 HIS N N 17 114.968 118.782 -3.814 1
1 85 . 7 1 1 A 18 18 LYS H H 18 8.144 8.554 -0.410 1
1 86 . 7 1 1 A 18 18 LYS CA C 18 58.975 59.233 -0.258 1
1 87 . 7 1 1 A 18 18 LYS CB C 18 32.379 32.217 0.162 1
1 88 . 7 1 1 A 18 18 LYS N N 18 122.373 119.140 3.233 1
1 89 . 7 1 1 A 19 19 TYR H H 19 6.999 7.563 -0.564 1
1 90 . 7 1 1 A 19 19 TYR CA C 19 60.318 60.853 -0.535 1
1 91 . 7 1 1 A 19 19 TYR CB C 19 40.355 38.281 2.074 1
1 92 . 7 1 1 A 19 19 TYR N N 19 113.614 118.563 -4.949 1
1 93 . 7 1 1 A 20 20 SER H H 20 8.432 8.011 0.421 1
1 94 . 7 1 1 A 20 20 SER CA C 20 61.897 61.112 0.785 1
1 95 . 7 1 1 A 20 20 SER CB C 20 61.354 62.092 -0.738 1
1 96 . 7 1 1 A 20 20 SER N N 20 113.201 115.509 -2.308 1
1 97 . 7 1 1 A 21 21 GLY H H 21 7.678 7.800 -0.122 1
1 98 . 7 1 1 A 21 21 GLY HA2 H 21 4.195 3.742 0.453 1
1 99 . 7 1 1 A 21 21 GLY HA3 H 21 3.900 3.751 0.149 1
1 100 . 7 1 1 A 21 21 GLY CA C 21 45.628 46.818 -1.190 1
1 101 . 7 1 1 A 21 21 GLY N N 21 110.734 110.047 0.687 1
1 102 . 7 1 1 A 22 22 LYS H H 22 7.362 7.548 -0.186 1
1 103 . 7 1 1 A 22 22 LYS CA C 22 60.163 58.589 1.574 1
1 104 . 7 1 1 A 22 22 LYS CB C 22 32.554 31.608 0.946 1
1 105 . 7 1 1 A 22 22 LYS N N 22 122.161 121.528 0.633 1
1 106 . 7 1 1 A 23 23 GLU H H 23 9.639 7.497 2.142 1
1 107 . 7 1 1 A 23 23 GLU CA C 23 54.449 56.121 -1.672 1
1 108 . 7 1 1 A 23 23 GLU N N 23 116.288 115.666 0.622 1
1 109 . 7 1 1 A 24 24 GLY HA2 H 24 3.912 3.850 0.062 1
1 110 . 7 1 1 A 24 24 GLY HA3 H 24 3.787 3.863 -0.076 1
1 111 . 7 1 1 A 24 24 GLY CA C 24 45.898 45.479 0.419 1
1 112 . 7 1 1 A 25 25 ASP H H 25 8.204 7.906 0.298 1
1 113 . 7 1 1 A 25 25 ASP CA C 25 55.252 52.339 2.913 1
1 114 . 7 1 1 A 25 25 ASP N N 25 125.671 119.900 5.771 1
1 115 . 7 1 1 A 26 26 LYS CA C 26 57.851 57.573 0.278 1
1 116 . 7 1 1 A 26 26 LYS CB C 26 31.265 32.461 -1.196 1
1 117 . 7 1 1 A 27 27 HIS H H 27 9.763 7.900 1.863 1
1 118 . 7 1 1 A 27 27 HIS CA C 27 55.580 55.619 -0.039 1
1 119 . 7 1 1 A 27 27 HIS CB C 27 30.936 30.444 0.492 1
1 120 . 7 1 1 A 27 27 HIS N N 27 118.108 116.038 2.070 1
1 121 . 7 1 1 A 28 28 THR H H 28 7.325 7.653 -0.328 1
1 126 . 7 1 1 A 28 28 THR CA C 28 60.128 60.035 0.093 1
1 127 . 7 1 1 A 28 28 THR CB C 28 72.268 72.078 0.190 1
1 128 . 7 1 1 A 28 28 THR N N 28 106.920 110.751 -3.831 1
1 129 . 7 1 1 A 29 29 LEU H H 29 9.422 9.339 0.083 1
1 130 . 7 1 1 A 29 29 LEU HA H 29 5.368 4.942 0.426 1
1 140 . 7 1 1 A 29 29 LEU CA C 29 52.567 53.350 -0.783 1
1 141 . 7 1 1 A 29 29 LEU CB C 29 43.523 44.593 -1.070 1
1 142 . 7 1 1 A 29 29 LEU N N 29 125.021 125.832 -0.811 1
1 143 . 7 1 1 A 30 30 SER H H 30 10.485 8.908 1.577 1
1 144 . 7 1 1 A 30 30 SER CA C 30 56.653 57.770 -1.117 1
1 145 . 7 1 1 A 30 30 SER CB C 30 65.313 63.879 1.434 1
1 146 . 7 1 1 A 30 30 SER N N 30 124.758 118.103 6.655 1
1 147 . 7 1 1 A 31 31 LYS H H 31 8.728 8.635 0.093 1
1 148 . 7 1 1 A 31 31 LYS CA C 31 59.669 59.218 0.451 1
1 149 . 7 1 1 A 31 31 LYS CB C 31 31.763 31.994 -0.231 1
1 150 . 7 1 1 A 31 31 LYS N N 31 119.459 124.232 -4.773 1
1 151 . 7 1 1 A 32 32 LYS H H 32 7.857 8.191 -0.334 1
1 152 . 7 1 1 A 32 32 LYS CA C 32 59.721 59.184 0.537 1
1 153 . 7 1 1 A 32 32 LYS CB C 32 32.901 31.935 0.966 1
1 154 . 7 1 1 A 32 32 LYS N N 32 117.933 119.104 -1.171 1
1 155 . 7 1 1 A 33 33 GLU H H 33 7.559 7.980 -0.421 1
1 156 . 7 1 1 A 33 33 GLU CA C 33 59.169 59.643 -0.474 1
1 157 . 7 1 1 A 33 33 GLU CB C 33 31.014 28.542 2.472 1
1 158 . 7 1 1 A 33 33 GLU N N 33 120.407 119.410 0.997 1
1 159 . 7 1 1 A 34 34 LEU H H 34 8.833 7.983 0.850 1
1 160 . 7 1 1 A 34 34 LEU CA C 34 56.928 57.847 -0.919 1
1 161 . 7 1 1 A 34 34 LEU CB C 34 41.435 41.733 -0.298 1
1 162 . 7 1 1 A 34 34 LEU N N 34 117.677 121.234 -3.557 1
1 163 . 7 1 1 A 35 35 LYS H H 35 8.010 7.836 0.174 1
1 164 . 7 1 1 A 35 35 LYS CA C 35 60.692 59.698 0.994 1
1 165 . 7 1 1 A 35 35 LYS CB C 35 32.223 32.185 0.038 1
1 166 . 7 1 1 A 35 35 LYS N N 35 119.829 118.696 1.133 1
1 167 . 7 1 1 A 36 36 GLU H H 36 7.169 8.003 -0.834 1
1 168 . 7 1 1 A 36 36 GLU CA C 36 59.588 59.126 0.462 1
1 169 . 7 1 1 A 36 36 GLU CB C 36 29.342 29.453 -0.111 1
1 170 . 7 1 1 A 36 36 GLU N N 36 117.340 119.434 -2.094 1
1 171 . 7 1 1 A 37 37 LEU H H 37 7.478 8.223 -0.745 1
1 172 . 7 1 1 A 37 37 LEU CA C 37 59.674 57.795 1.879 1
1 173 . 7 1 1 A 37 37 LEU CB C 37 42.142 40.896 1.246 1
1 174 . 7 1 1 A 37 37 LEU N N 37 120.884 121.684 -0.800 1
1 175 . 7 1 1 A 38 38 ILE H H 38 8.377 8.182 0.195 1
1 176 . 7 1 1 A 38 38 ILE CA C 38 65.651 65.646 0.005 1
1 177 . 7 1 1 A 38 38 ILE N N 38 118.450 120.129 -1.679 1
1 178 . 7 1 1 A 39 39 GLN H H 39 8.217 8.155 0.062 1
1 179 . 7 1 1 A 39 39 GLN CA C 39 59.788 58.496 1.292 1
1 180 . 7 1 1 A 39 39 GLN CB C 39 29.278 28.079 1.199 1
1 181 . 7 1 1 A 39 39 GLN N N 39 113.091 118.118 -5.027 1
1 182 . 7 1 1 A 40 40 LYS H H 40 8.426 8.201 0.225 1
1 183 . 7 1 1 A 40 40 LYS CA C 40 57.807 59.099 -1.292 1
1 184 . 7 1 1 A 40 40 LYS CB C 40 33.942 32.572 1.370 1
1 185 . 7 1 1 A 40 40 LYS N N 40 114.771 120.868 -6.097 1
1 186 . 7 1 1 A 41 41 GLU H H 41 8.496 8.199 0.297 1
1 187 . 7 1 1 A 41 41 GLU CA C 41 55.395 58.553 -3.158 1
1 188 . 7 1 1 A 41 41 GLU CB C 41 29.260 30.226 -0.966 1
1 189 . 7 1 1 A 41 41 GLU N N 41 112.546 118.795 -6.249 1
1 190 . 7 1 1 A 42 42 LEU H H 42 7.267 8.014 -0.747 1
1 191 . 7 1 1 A 42 42 LEU CA C 42 53.776 57.185 -3.409 1
1 192 . 7 1 1 A 42 42 LEU N N 42 118.657 118.715 -0.058 1
1 193 . 7 1 1 A 44 44 ILE CA C 44 62.210 60.950 1.260 1
1 194 . 7 1 1 A 44 44 ILE CB C 44 38.247 38.416 -0.169 1
1 195 . 7 1 1 A 45 45 GLY H H 45 7.820 7.938 -0.118 1
1 196 . 7 1 1 A 45 45 GLY CA C 45 47.742 45.353 2.389 1
1 197 . 7 1 1 A 45 45 GLY N N 45 108.178 112.556 -4.378 1
1 198 . 7 1 1 A 46 46 SER H H 46 7.895 8.595 -0.700 1
1 199 . 7 1 1 A 46 46 SER CA C 46 59.958 58.256 1.702 1
1 200 . 7 1 1 A 46 46 SER CB C 46 63.450 63.142 0.308 1
1 201 . 7 1 1 A 46 46 SER N N 46 113.038 121.117 -8.079 1
1 202 . 7 1 1 A 47 47 LYS H H 47 7.736 7.273 0.463 1
1 203 . 7 1 1 A 47 47 LYS CA C 47 55.636 56.701 -1.065 1
1 204 . 7 1 1 A 47 47 LYS CB C 47 33.103 33.011 0.092 1
1 205 . 7 1 1 A 47 47 LYS N N 47 119.422 120.913 -1.491 1
1 206 . 7 1 1 A 48 48 LEU H H 48 6.988 8.746 -1.758 1
1 207 . 7 1 1 A 48 48 LEU HA H 48 4.497 4.014 0.483 1
1 217 . 7 1 1 A 48 48 LEU CA C 48 54.517 57.572 -3.055 1
1 218 . 7 1 1 A 48 48 LEU CB C 48 42.987 41.481 1.506 1
1 219 . 7 1 1 A 48 48 LEU N N 48 118.908 122.520 -3.612 1
1 220 . 7 1 1 A 49 49 GLN H H 49 9.206 8.317 0.889 1
1 221 . 7 1 1 A 49 49 GLN HA H 49 4.486 4.236 0.250 1
1 223 . 7 1 1 A 49 49 GLN CA C 49 54.785 58.166 -3.381 1
1 224 . 7 1 1 A 49 49 GLN CB C 49 29.636 28.368 1.268 1
1 225 . 7 1 1 A 49 49 GLN N N 49 121.275 118.331 2.944 1
1 226 . 7 1 1 A 50 50 ASP H H 50 8.854 8.390 0.464 1
1 227 . 7 1 1 A 50 50 ASP CA C 50 59.078 57.511 1.567 1
1 228 . 7 1 1 A 50 50 ASP CB C 50 40.632 42.026 -1.394 1
1 229 . 7 1 1 A 50 50 ASP N N 50 123.430 119.930 3.500 1
1 230 . 7 1 1 A 51 51 ALA H H 51 8.720 7.989 0.731 1
1 231 . 7 1 1 A 51 51 ALA CA C 51 55.281 54.831 0.450 1
1 232 . 7 1 1 A 51 51 ALA CB C 51 18.205 18.216 -0.011 1
1 233 . 7 1 1 A 51 51 ALA N N 51 117.829 121.201 -3.372 1
1 234 . 7 1 1 A 52 52 GLU H H 52 7.161 7.739 -0.578 1
1 235 . 7 1 1 A 52 52 GLU CA C 52 58.757 59.061 -0.304 1
1 236 . 7 1 1 A 52 52 GLU CB C 52 30.247 29.662 0.585 1
1 237 . 7 1 1 A 52 52 GLU N N 52 115.459 117.383 -1.924 1
1 238 . 7 1 1 A 53 53 ILE H H 53 7.962 8.107 -0.145 1
1 239 . 7 1 1 A 53 53 ILE CA C 53 65.525 65.128 0.397 1
1 240 . 7 1 1 A 53 53 ILE CB C 53 37.289 38.046 -0.757 1
1 241 . 7 1 1 A 53 53 ILE N N 53 120.414 121.156 -0.742 1
1 242 . 7 1 1 A 54 54 VAL H H 54 8.132 7.990 0.142 1
1 243 . 7 1 1 A 54 54 VAL CA C 54 67.290 65.489 1.801 1
1 244 . 7 1 1 A 54 54 VAL CB C 54 31.434 31.167 0.267 1
1 245 . 7 1 1 A 54 54 VAL N N 54 119.775 116.924 2.851 1
1 246 . 7 1 1 A 55 55 LYS H H 55 7.155 8.011 -0.856 1
1 247 . 7 1 1 A 55 55 LYS CA C 55 59.131 59.177 -0.046 1
1 248 . 7 1 1 A 55 55 LYS CB C 55 32.131 32.033 0.098 1
1 249 . 7 1 1 A 55 55 LYS N N 55 119.175 120.769 -1.594 1
1 250 . 7 1 1 A 56 56 LEU H H 56 7.837 8.299 -0.462 1
1 251 . 7 1 1 A 56 56 LEU CA C 56 58.052 58.020 0.032 1
1 252 . 7 1 1 A 56 56 LEU CB C 56 41.878 41.742 0.136 1
1 253 . 7 1 1 A 56 56 LEU N N 56 119.679 121.128 -1.449 1
1 254 . 7 1 1 A 57 57 MET H H 57 8.385 8.771 -0.386 1
1 255 . 7 1 1 A 57 57 MET CA C 57 60.756 58.703 2.053 1
1 256 . 7 1 1 A 57 57 MET CB C 57 33.152 31.890 1.262 1
1 257 . 7 1 1 A 57 57 MET N N 57 115.116 119.567 -4.451 1
1 258 . 7 1 1 A 58 58 ASP H H 58 7.591 8.261 -0.670 1
1 259 . 7 1 1 A 58 58 ASP CA C 58 57.365 57.784 -0.419 1
1 260 . 7 1 1 A 58 58 ASP CB C 58 40.858 41.804 -0.946 1
1 261 . 7 1 1 A 58 58 ASP N N 58 118.197 119.835 -1.638 1
1 262 . 7 1 1 A 59 59 ASP H H 59 7.725 8.191 -0.466 1
1 263 . 7 1 1 A 59 59 ASP CA C 59 56.830 56.835 -0.005 1
1 264 . 7 1 1 A 59 59 ASP CB C 59 40.567 40.425 0.142 1
1 265 . 7 1 1 A 59 59 ASP N N 59 118.481 117.970 0.511 1
1 266 . 7 1 1 A 60 60 LEU H H 60 7.703 7.569 0.134 1
1 267 . 7 1 1 A 60 60 LEU CA C 60 56.564 57.330 -0.766 1
1 268 . 7 1 1 A 60 60 LEU CB C 60 42.714 41.427 1.287 1
1 269 . 7 1 1 A 60 60 LEU N N 60 116.935 120.130 -3.195 1
1 270 . 7 1 1 A 61 61 ASP H H 61 7.143 8.438 -1.295 1
1 271 . 7 1 1 A 61 61 ASP HA H 61 4.690 4.303 0.387 1
1 274 . 7 1 1 A 61 61 ASP CA C 61 52.286 57.413 -5.127 1
1 275 . 7 1 1 A 61 61 ASP CB C 61 39.245 40.926 -1.681 1
1 276 . 7 1 1 A 61 61 ASP N N 61 116.605 118.970 -2.365 1
1 277 . 7 1 1 A 62 62 ARG H H 62 7.786 8.329 -0.543 1
1 278 . 7 1 1 A 62 62 ARG CA C 62 58.328 57.740 0.588 1
1 279 . 7 1 1 A 62 62 ARG CB C 62 30.106 29.162 0.944 1
1 280 . 7 1 1 A 62 62 ARG N N 62 125.967 117.880 8.087 1
1 281 . 7 1 1 A 63 63 ASN H H 63 7.945 8.095 -0.150 1
1 282 . 7 1 1 A 63 63 ASN CA C 63 51.863 55.661 -3.798 1
1 283 . 7 1 1 A 63 63 ASN CB C 63 36.809 38.391 -1.582 1
1 284 . 7 1 1 A 63 63 ASN N N 63 112.434 117.246 -4.812 1
1 285 . 7 1 1 A 64 64 LYS H H 64 7.477 8.265 -0.788 1
1 286 . 7 1 1 A 64 64 LYS CA C 64 56.524 57.768 -1.244 1
1 287 . 7 1 1 A 64 64 LYS N N 64 114.197 119.287 -5.090 1
1 288 . 7 1 1 A 65 65 ASP H H 65 8.345 7.782 0.563 1
1 289 . 7 1 1 A 65 65 ASP CA C 65 52.969 55.713 -2.744 1
1 290 . 7 1 1 A 65 65 ASP CB C 65 40.329 43.010 -2.681 1
1 291 . 7 1 1 A 65 65 ASP N N 65 118.581 118.494 0.087 1
1 292 . 7 1 1 A 66 66 GLN H H 66 9.945 7.929 2.016 1
1 293 . 7 1 1 A 66 66 GLN CA C 66 58.132 54.993 3.139 1
1 294 . 7 1 1 A 66 66 GLN CB C 66 26.035 30.149 -4.114 1
1 295 . 7 1 1 A 66 66 GLN N N 66 113.203 117.955 -4.752 1
1 296 . 7 1 1 A 67 67 GLU H H 67 7.880 7.767 0.113 1
1 297 . 7 1 1 A 67 67 GLU HA H 67 4.910 4.989 -0.079 1
1 302 . 7 1 1 A 67 67 GLU CA C 67 54.082 54.803 -0.721 1
1 303 . 7 1 1 A 67 67 GLU CB C 67 33.174 34.785 -1.611 1
1 304 . 7 1 1 A 67 67 GLU N N 67 118.554 119.390 -0.836 1
1 305 . 7 1 1 A 68 68 VAL H H 68 9.669 9.181 0.488 1
1 306 . 7 1 1 A 68 68 VAL HA H 68 5.465 4.766 0.699 1
1 314 . 7 1 1 A 68 68 VAL CA C 68 61.079 61.219 -0.140 1
1 315 . 7 1 1 A 68 68 VAL CB C 68 33.280 34.318 -1.038 1
1 316 . 7 1 1 A 68 68 VAL N N 68 126.572 121.831 4.741 1
1 317 . 7 1 1 A 69 69 ASN H H 69 8.985 8.814 0.171 1
1 318 . 7 1 1 A 69 69 ASN CA C 69 50.812 53.318 -2.506 1
1 319 . 7 1 1 A 69 69 ASN CB C 69 38.609 40.718 -2.109 1
1 320 . 7 1 1 A 69 69 ASN N N 69 127.472 126.342 1.130 1
1 321 . 7 1 1 A 70 70 PHE H H 70 9.100 9.005 0.095 1
1 322 . 7 1 1 A 70 70 PHE CA C 70 63.279 61.973 1.306 1
1 323 . 7 1 1 A 70 70 PHE CB C 70 38.741 39.188 -0.447 1
1 324 . 7 1 1 A 70 70 PHE N N 70 119.972 127.452 -7.480 1
1 325 . 7 1 1 A 71 71 GLN H H 71 8.342 8.171 0.171 1
1 326 . 7 1 1 A 71 71 GLN HA H 71 3.923 3.618 0.305 1
1 329 . 7 1 1 A 71 71 GLN CA C 71 59.866 58.615 1.251 1
1 330 . 7 1 1 A 71 71 GLN CB C 71 27.878 28.493 -0.615 1
1 331 . 7 1 1 A 71 71 GLN N N 71 118.216 117.903 0.313 1
1 332 . 7 1 1 A 72 72 GLU H H 72 8.721 7.912 0.809 1
1 333 . 7 1 1 A 72 72 GLU HA H 72 4.147 4.091 0.056 1
1 338 . 7 1 1 A 72 72 GLU CA C 72 59.313 59.283 0.030 1
1 339 . 7 1 1 A 72 72 GLU CB C 72 30.233 29.352 0.881 1
1 340 . 7 1 1 A 72 72 GLU N N 72 121.455 119.542 1.913 1
1 341 . 7 1 1 A 73 73 TYR H H 73 8.536 8.319 0.217 1
1 342 . 7 1 1 A 73 73 TYR CA C 73 60.961 61.280 -0.319 1
1 343 . 7 1 1 A 73 73 TYR CB C 73 38.724 39.007 -0.283 1
1 344 . 7 1 1 A 73 73 TYR N N 73 123.356 121.403 1.953 1
1 345 . 7 1 1 A 74 74 ILE H H 74 8.642 7.913 0.729 1
1 346 . 7 1 1 A 74 74 ILE CA C 74 61.880 64.314 -2.434 1
1 347 . 7 1 1 A 74 74 ILE CB C 74 36.077 37.273 -1.196 1
1 348 . 7 1 1 A 74 74 ILE N N 74 119.799 120.363 -0.564 1
1 349 . 7 1 1 A 75 75 THR H H 75 7.959 8.139 -0.180 1
1 354 . 7 1 1 A 75 75 THR CA C 75 67.056 66.810 0.246 1
1 355 . 7 1 1 A 75 75 THR CB C 75 68.386 68.485 -0.099 1
1 356 . 7 1 1 A 75 75 THR N N 75 119.486 117.923 1.563 1
1 357 . 7 1 1 A 76 76 PHE H H 76 7.450 8.291 -0.841 1
1 358 . 7 1 1 A 76 76 PHE CA C 76 59.010 61.778 -2.768 1
1 359 . 7 1 1 A 76 76 PHE CB C 76 38.139 39.176 -1.037 1
1 360 . 7 1 1 A 76 76 PHE N N 76 122.873 121.846 1.027 1
1 361 . 7 1 1 A 77 77 LEU H H 77 7.829 8.358 -0.529 1
1 362 . 7 1 1 A 77 77 LEU CA C 77 57.450 57.654 -0.204 1
1 363 . 7 1 1 A 77 77 LEU CB C 77 40.560 41.368 -0.808 1
1 364 . 7 1 1 A 77 77 LEU N N 77 117.405 118.522 -1.117 1
1 365 . 7 1 1 A 78 78 GLY H H 78 8.093 8.342 -0.249 1
1 366 . 7 1 1 A 78 78 GLY HA2 H 78 3.661 3.709 -0.048 1
1 367 . 7 1 1 A 78 78 GLY HA3 H 78 3.594 3.711 -0.117 1
1 368 . 7 1 1 A 78 78 GLY CA C 78 47.442 47.152 0.290 1
1 369 . 7 1 1 A 78 78 GLY N N 78 105.528 106.319 -0.791 1
1 370 . 7 1 1 A 79 79 ALA H H 79 7.759 7.767 -0.008 1
1 371 . 7 1 1 A 79 79 ALA CA C 79 55.153 54.645 0.508 1
1 372 . 7 1 1 A 79 79 ALA CB C 79 17.768 18.908 -1.140 1
1 373 . 7 1 1 A 79 79 ALA N N 79 124.488 125.035 -0.547 1
1 374 . 7 1 1 A 80 80 LEU H H 80 7.963 7.933 0.030 1
1 375 . 7 1 1 A 80 80 LEU CA C 80 57.464 57.396 0.068 1
1 376 . 7 1 1 A 80 80 LEU CB C 80 41.496 40.992 0.504 1
1 377 . 7 1 1 A 80 80 LEU N N 80 117.869 119.554 -1.685 1
1 378 . 7 1 1 A 81 81 ALA H H 81 8.365 8.179 0.186 1
1 379 . 7 1 1 A 81 81 ALA CA C 81 55.475 55.253 0.222 1
1 380 . 7 1 1 A 81 81 ALA CB C 81 17.483 18.249 -0.766 1
1 381 . 7 1 1 A 81 81 ALA N N 81 119.054 120.325 -1.271 1
1 382 . 7 1 1 A 82 82 MET H H 82 8.112 8.051 0.061 1
1 383 . 7 1 1 A 82 82 MET CA C 82 59.516 57.752 1.764 1
1 384 . 7 1 1 A 82 82 MET CB C 82 32.550 32.275 0.275 1
1 385 . 7 1 1 A 82 82 MET N N 82 115.364 116.089 -0.725 1
1 386 . 7 1 1 A 83 83 ILE H H 83 7.981 7.844 0.137 1
1 387 . 7 1 1 A 83 83 ILE HA H 83 3.839 3.706 0.133 1
1 391 . 7 1 1 A 83 83 ILE CA C 83 64.467 64.734 -0.267 1
1 392 . 7 1 1 A 83 83 ILE CB C 83 37.312 36.975 0.337 1
1 393 . 7 1 1 A 83 83 ILE N N 83 120.887 120.997 -0.110 1
1 394 . 7 1 1 A 84 84 TYR H H 84 8.731 7.384 1.347 1
1 395 . 7 1 1 A 84 84 TYR N N 84 120.933 119.780 1.153 1
1 396 . 7 1 1 A 87 87 ALA H H 87 7.829 8.022 -0.193 1
1 397 . 7 1 1 A 87 87 ALA CA C 87 53.768 55.055 -1.287 1
1 398 . 7 1 1 A 87 87 ALA CB C 87 18.504 18.314 0.190 1
1 399 . 7 1 1 A 87 87 ALA N N 87 120.274 122.134 -1.860 1
1 400 . 7 1 1 A 88 88 LEU H H 88 7.499 8.201 -0.702 1
1 401 . 7 1 1 A 88 88 LEU CA C 88 55.605 57.466 -1.861 1
1 402 . 7 1 1 A 88 88 LEU CB C 88 42.047 41.365 0.682 1
1 403 . 7 1 1 A 88 88 LEU N N 88 117.356 119.623 -2.267 1
1 404 . 7 1 1 A 89 89 LYS H H 89 7.561 7.739 -0.178 1
1 405 . 7 1 1 A 89 89 LYS CA C 89 56.865 57.227 -0.362 1
1 406 . 7 1 1 A 89 89 LYS CB C 89 32.592 32.669 -0.077 1
1 407 . 7 1 1 A 89 89 LYS N N 89 119.289 116.537 2.752 1
1 416 . 7 3 2 C 6 6 GLU H H 190 8.385 8.322 0.063 1
1 417 . 7 3 2 C 6 6 GLU HA H 190 4.153 4.389 -0.236 1
1 422 . 7 3 2 C 6 6 GLU C C 190 175.031 177.836 -2.805 1
1 423 . 7 3 2 C 6 6 GLU CA C 190 58.866 55.694 3.172 1
1 424 . 7 3 2 C 6 6 GLU CB C 190 30.751 30.310 0.441 1
1 426 . 7 3 2 C 6 6 GLU N N 190 122.715 123.151 -0.436 1
1 427 . 7 3 2 C 7 7 GLY H H 191 8.475 8.761 -0.286 1
1 428 . 7 3 2 C 7 7 GLY HA2 H 191 3.887 3.912 -0.025 1
1 429 . 7 3 2 C 7 7 GLY HA3 H 191 3.887 3.914 -0.027 1
1 430 . 7 3 2 C 7 7 GLY C C 191 177.922 174.975 2.947 1
1 431 . 7 3 2 C 7 7 GLY CA C 191 46.884 46.723 0.161 1
1 432 . 7 3 2 C 7 7 GLY N N 191 109.009 108.311 0.698 1
1 433 . 7 3 2 C 8 8 LEU HA H 192 4.095 3.896 0.199 1
1 443 . 7 3 2 C 8 8 LEU CA C 192 58.154 58.490 -0.336 1
1 444 . 7 3 2 C 8 8 LEU CB C 192 42.789 41.803 0.986 1
1 448 . 7 3 2 C 9 9 MET H H 193 8.250 8.476 -0.226 1
1 449 . 7 3 2 C 9 9 MET HA H 193 4.150 4.202 -0.052 1
1 457 . 7 3 2 C 9 9 MET C C 193 178.421 178.239 0.182 1
1 458 . 7 3 2 C 9 9 MET CA C 193 58.818 58.360 0.458 1
1 459 . 7 3 2 C 9 9 MET CB C 193 32.360 32.068 0.292 1
1 462 . 7 3 2 C 9 9 MET N N 193 117.049 117.109 -0.060 1
1 463 . 7 3 2 C 10 10 ASN H H 194 7.892 7.923 -0.031 1
1 464 . 7 3 2 C 10 10 ASN HA H 194 4.468 4.461 0.007 1
1 469 . 7 3 2 C 10 10 ASN C C 194 178.099 176.742 1.357 1
1 470 . 7 3 2 C 10 10 ASN CA C 194 56.644 55.433 1.211 1
1 471 . 7 3 2 C 10 10 ASN CB C 194 39.100 38.651 0.449 1
1 472 . 7 3 2 C 10 10 ASN N N 194 117.034 118.604 -1.570 1
1 474 . 7 3 2 C 11 11 VAL H H 195 7.651 7.843 -0.192 1
1 475 . 7 3 2 C 11 11 VAL HA H 195 3.735 3.853 -0.118 1
1 483 . 7 3 2 C 11 11 VAL C C 195 177.657 178.299 -0.642 1
1 484 . 7 3 2 C 11 11 VAL CA C 195 66.710 65.171 1.539 1
1 485 . 7 3 2 C 11 11 VAL CB C 195 32.468 31.882 0.586 1
1 488 . 7 3 2 C 11 11 VAL N N 195 119.878 118.025 1.853 1
1 489 . 7 3 2 C 12 12 LEU H H 196 8.030 8.096 -0.066 1
1 490 . 7 3 2 C 12 12 LEU HA H 196 4.013 3.981 0.032 1
1 500 . 7 3 2 C 12 12 LEU C C 196 177.540 179.297 -1.757 1
1 501 . 7 3 2 C 12 12 LEU CA C 196 58.489 57.404 1.085 1
1 502 . 7 3 2 C 12 12 LEU CB C 196 42.457 41.144 1.313 1
1 506 . 7 3 2 C 12 12 LEU N N 196 119.499 119.711 -0.212 1
1 507 . 7 3 2 C 13 13 LYS H H 197 8.015 8.251 -0.236 1
1 508 . 7 3 2 C 13 13 LYS HA H 197 3.949 3.927 0.022 1
1 517 . 7 3 2 C 13 13 LYS C C 197 178.419 178.827 -0.408 1
1 518 . 7 3 2 C 13 13 LYS CA C 197 60.191 59.362 0.829 1
1 519 . 7 3 2 C 13 13 LYS CB C 197 33.075 32.096 0.979 1
1 523 . 7 3 2 C 13 13 LYS N N 197 117.888 121.084 -3.196 1
1 524 . 7 3 2 C 14 14 LYS H H 198 7.506 7.530 -0.024 1
1 525 . 7 3 2 C 14 14 LYS HA H 198 4.127 4.134 -0.007 1
1 534 . 7 3 2 C 14 14 LYS C C 198 178.262 177.700 0.562 1
1 535 . 7 3 2 C 14 14 LYS CA C 198 59.161 58.238 0.923 1
1 536 . 7 3 2 C 14 14 LYS CB C 198 32.956 32.618 0.338 1
1 540 . 7 3 2 C 14 14 LYS N N 198 118.321 117.960 0.361 1
1 541 . 7 3 2 C 15 15 ILE H H 199 7.780 7.690 0.090 1
1 542 . 7 3 2 C 15 15 ILE HA H 199 3.787 3.953 -0.166 1
1 552 . 7 3 2 C 15 15 ILE C C 199 178.647 177.603 1.044 1
1 553 . 7 3 2 C 15 15 ILE CA C 199 64.912 63.150 1.762 1
1 554 . 7 3 2 C 15 15 ILE CB C 199 38.780 37.992 0.788 1
1 558 . 7 3 2 C 15 15 ILE N N 199 118.644 117.740 0.904 1
1 559 . 7 3 2 C 16 16 TYR H H 200 7.918 8.404 -0.486 1
1 560 . 7 3 2 C 16 16 TYR HA H 200 4.252 3.981 0.271 1
1 567 . 7 3 2 C 16 16 TYR C C 200 177.806 177.481 0.325 1
1 568 . 7 3 2 C 16 16 TYR CA C 200 61.171 62.104 -0.933 1
1 569 . 7 3 2 C 16 16 TYR CB C 200 39.245 38.936 0.309 1
1 573 . 7 3 2 C 16 16 TYR N N 200 118.683 121.842 -3.159 1
1 574 . 7 3 2 C 17 17 GLU H H 201 8.089 8.610 -0.521 1
1 575 . 7 3 2 C 17 17 GLU HA H 201 4.124 4.179 -0.055 1
1 580 . 7 3 2 C 17 17 GLU C C 201 177.414 177.174 0.240 1
1 581 . 7 3 2 C 17 17 GLU CA C 201 58.784 58.780 0.004 1
1 582 . 7 3 2 C 17 17 GLU CB C 201 30.747 29.271 1.476 1
1 584 . 7 3 2 C 17 17 GLU N N 201 119.409 118.394 1.015 1
1 585 . 7 3 2 C 18 18 ASP H H 202 8.023 7.801 0.222 1
1 586 . 7 3 2 C 18 18 ASP HA H 202 4.657 4.713 -0.056 1
1 589 . 7 3 2 C 18 18 ASP C C 202 177.346 176.416 0.930 1
1 590 . 7 3 2 C 18 18 ASP CA C 202 55.496 54.038 1.458 1
1 591 . 7 3 2 C 18 18 ASP CB C 202 42.023 41.798 0.225 1
1 592 . 7 3 2 C 18 18 ASP N N 202 119.459 117.997 1.462 1
1 593 . 7 3 2 C 19 19 GLY H H 203 7.933 7.697 0.236 1
1 594 . 7 3 2 C 19 19 GLY HA2 H 203 3.938 3.902 0.036 1
1 595 . 7 3 2 C 19 19 GLY HA3 H 203 3.938 3.952 -0.014 1
1 596 . 7 3 2 C 19 19 GLY C C 203 177.240 172.396 4.844 1
1 597 . 7 3 2 C 19 19 GLY CA C 203 46.309 45.349 0.960 1
1 598 . 7 3 2 C 19 19 GLY N N 203 108.518 107.731 0.787 1
1 599 . 7 3 2 C 20 20 ASP H H 204 8.091 8.610 -0.519 1
1 600 . 7 3 2 C 20 20 ASP HA H 204 4.616 4.652 -0.036 1
1 603 . 7 3 2 C 20 20 ASP C C 204 173.979 176.780 -2.801 1
1 604 . 7 3 2 C 20 20 ASP CA C 204 55.064 54.414 0.650 1
1 605 . 7 3 2 C 20 20 ASP CB C 204 42.203 42.723 -0.520 1
1 606 . 7 3 2 C 20 20 ASP N N 204 120.172 122.924 -2.752 1
1 607 . 7 3 2 C 21 21 ASP H H 205 8.352 9.108 -0.756 1
1 608 . 7 3 2 C 21 21 ASP HA H 205 4.468 4.249 0.219 1
1 611 . 7 3 2 C 21 21 ASP C C 205 176.432 177.831 -1.399 1
1 612 . 7 3 2 C 21 21 ASP CA C 205 56.663 56.808 -0.145 1
1 613 . 7 3 2 C 21 21 ASP CB C 205 41.918 40.242 1.676 1
1 614 . 7 3 2 C 21 21 ASP N N 205 121.515 126.614 -5.099 1
1 615 . 7 3 2 C 22 22 ASP H H 206 8.239 8.205 0.034 1
1 616 . 7 3 2 C 22 22 ASP HA H 206 4.455 4.443 0.012 1
1 619 . 7 3 2 C 22 22 ASP C C 206 177.449 179.274 -1.825 1
1 620 . 7 3 2 C 22 22 ASP CA C 206 57.165 56.894 0.271 1
1 621 . 7 3 2 C 22 22 ASP CB C 206 41.820 40.377 1.443 1
1 622 . 7 3 2 C 22 22 ASP N N 206 120.156 118.445 1.711 1
1 623 . 7 3 2 C 23 23 MET H H 207 8.300 7.818 0.482 1
1 624 . 7 3 2 C 23 23 MET HA H 207 4.255 4.101 0.154 1
1 632 . 7 3 2 C 23 23 MET C C 207 178.412 178.839 -0.427 1
1 633 . 7 3 2 C 23 23 MET CA C 207 58.065 58.794 -0.729 1
1 634 . 7 3 2 C 23 23 MET CB C 207 32.488 32.651 -0.163 1
1 637 . 7 3 2 C 23 23 MET N N 207 120.707 119.229 1.478 1
1 638 . 7 3 2 C 24 24 LYS H H 208 8.047 7.816 0.231 1
1 639 . 7 3 2 C 24 24 LYS HA H 208 3.946 3.952 -0.006 1
1 648 . 7 3 2 C 24 24 LYS C C 208 178.008 179.354 -1.346 1
1 649 . 7 3 2 C 24 24 LYS CA C 208 59.847 60.138 -0.291 1
1 650 . 7 3 2 C 24 24 LYS CB C 208 32.983 32.045 0.938 1
1 654 . 7 3 2 C 24 24 LYS N N 208 119.504 118.747 0.757 1
1 655 . 7 3 2 C 25 25 ARG H H 209 7.891 7.287 0.604 1
1 656 . 7 3 2 C 25 25 ARG HA H 209 4.168 4.129 0.039 1
1 663 . 7 3 2 C 25 25 ARG C C 209 178.100 179.119 -1.019 1
1 664 . 7 3 2 C 25 25 ARG CA C 209 58.810 58.982 -0.172 1
1 665 . 7 3 2 C 25 25 ARG CB C 209 31.080 29.822 1.258 1
1 668 . 7 3 2 C 25 25 ARG N N 209 118.378 119.147 -0.769 1
1 669 . 7 3 2 C 26 26 THR H H 210 7.869 8.310 -0.441 1
1 670 . 7 3 2 C 26 26 THR HA H 210 4.023 4.031 -0.008 1
1 675 . 7 3 2 C 26 26 THR C C 210 177.984 176.301 1.683 1
1 676 . 7 3 2 C 26 26 THR CA C 210 65.747 67.130 -1.383 1
1 677 . 7 3 2 C 26 26 THR CB C 210 69.683 68.225 1.458 1
1 679 . 7 3 2 C 26 26 THR N N 210 115.443 118.335 -2.892 1
1 680 . 7 3 2 C 27 27 ILE H H 211 7.901 8.225 -0.324 1
1 681 . 7 3 2 C 27 27 ILE HA H 211 4.142 3.635 0.507 1
1 691 . 7 3 2 C 27 27 ILE C C 211 175.595 178.221 -2.626 1
1 692 . 7 3 2 C 27 27 ILE CA C 211 63.528 65.555 -2.027 1
1 693 . 7 3 2 C 27 27 ILE CB C 211 38.982 37.653 1.329 1
1 697 . 7 3 2 C 27 27 ILE N N 211 121.265 121.348 -0.083 1
1 698 . 7 3 2 C 28 28 ASN HA H 212 4.465 4.568 -0.103 1
1 703 . 7 3 2 C 28 28 ASN CA C 212 55.182 56.866 -1.684 1
1 704 . 7 3 2 C 28 28 ASN CB C 212 39.480 39.682 -0.202 1
1 706 . 7 3 2 C 29 29 LYS H H 213 7.968 8.201 -0.233 1
1 707 . 7 3 2 C 29 29 LYS HA H 213 4.072 4.182 -0.110 1
1 716 . 7 3 2 C 29 29 LYS C C 213 176.218 178.684 -2.466 1
1 717 . 7 3 2 C 29 29 LYS CA C 213 58.489 58.554 -0.065 1
1 718 . 7 3 2 C 29 29 LYS CB C 213 33.165 31.504 1.661 1
1 722 . 7 3 2 C 29 29 LYS N N 213 120.820 118.247 2.573 1
1 723 . 7 3 2 C 30 30 ALA H H 214 7.865 7.973 -0.108 1
1 724 . 7 3 2 C 30 30 ALA HA H 214 4.217 4.191 0.026 1
1 728 . 7 3 2 C 30 30 ALA C C 214 177.041 179.475 -2.434 1
1 729 . 7 3 2 C 30 30 ALA CA C 214 54.104 55.018 -0.914 1
1 730 . 7 3 2 C 30 30 ALA CB C 214 19.496 18.463 1.033 1
1 731 . 7 3 2 C 30 30 ALA N N 214 121.571 122.030 -0.459 1
1 732 . 7 3 2 C 31 31 TRP H H 215 7.831 8.048 -0.217 1
1 733 . 7 3 2 C 31 31 TRP HA H 215 4.598 4.335 0.263 1
1 742 . 7 3 2 C 31 31 TRP C C 215 178.088 178.174 -0.086 1
1 743 . 7 3 2 C 31 31 TRP CA C 215 58.432 61.578 -3.146 1
1 744 . 7 3 2 C 31 31 TRP CB C 215 30.472 29.346 1.126 1
1 750 . 7 3 2 C 31 31 TRP N N 215 118.141 120.812 -2.671 1
1 752 . 7 3 2 C 32 32 VAL H H 216 7.594 8.714 -1.120 1
1 753 . 7 3 2 C 32 32 VAL HA H 216 3.978 3.267 0.711 1
1 761 . 7 3 2 C 32 32 VAL C C 216 176.574 177.426 -0.852 1
1 762 . 7 3 2 C 32 32 VAL CA C 216 63.329 64.745 -1.416 1
1 763 . 7 3 2 C 32 32 VAL CB C 216 33.373 31.012 2.361 1
1 766 . 7 3 2 C 32 32 VAL N N 216 118.287 119.252 -0.965 1
1 767 . 7 3 2 C 33 33 GLU H H 217 8.012 8.364 -0.352 1
1 768 . 7 3 2 C 33 33 GLU HA H 217 4.257 3.982 0.275 1
1 773 . 7 3 2 C 33 33 GLU C C 217 176.164 177.699 -1.535 1
1 774 . 7 3 2 C 33 33 GLU CA C 217 57.409 59.557 -2.148 1
1 775 . 7 3 2 C 33 33 GLU CB C 217 30.978 29.361 1.617 1
1 777 . 7 3 2 C 33 33 GLU N N 217 122.535 121.538 0.997 1
1 778 . 7 3 2 C 34 34 SER H H 218 8.037 7.389 0.648 1
1 779 . 7 3 2 C 34 34 SER HA H 218 4.514 4.553 -0.039 1
1 782 . 7 3 2 C 34 34 SER C C 218 176.451 174.178 2.273 1
1 783 . 7 3 2 C 34 34 SER CA C 218 58.987 58.290 0.697 1
1 784 . 7 3 2 C 34 34 SER CB C 218 64.569 64.020 0.549 1
1 785 . 7 3 2 C 34 34 SER N N 218 117.058 112.139 4.919 1
1 6 . 8 1 1 A 2 2 ALA H H 2 8.191 8.866 -0.675 1
1 7 . 8 1 1 A 2 2 ALA CA C 2 51.957 53.446 -1.489 1
1 8 . 8 1 1 A 2 2 ALA CB C 2 19.580 20.741 -1.161 1
1 9 . 8 1 1 A 2 2 ALA N N 2 124.666 123.236 1.430 1
1 10 . 8 1 1 A 3 3 SER H H 3 8.829 8.567 0.262 1
1 11 . 8 1 1 A 3 3 SER CA C 3 57.221 62.312 -5.091 1
1 12 . 8 1 1 A 3 3 SER N N 3 119.917 113.900 6.017 1
1 13 . 8 1 1 A 4 4 PRO CA C 4 66.688 66.012 0.676 1
1 14 . 8 1 1 A 4 4 PRO CB C 4 32.553 30.788 1.765 1
1 15 . 8 1 1 A 5 5 LEU H H 5 9.146 7.535 1.611 1
1 16 . 8 1 1 A 5 5 LEU CA C 5 59.017 57.048 1.969 1
1 17 . 8 1 1 A 5 5 LEU CB C 5 42.341 42.293 0.048 1
1 18 . 8 1 1 A 5 5 LEU N N 5 117.902 116.698 1.204 1
1 19 . 8 1 1 A 6 6 ASP H H 6 7.572 7.967 -0.395 1
1 20 . 8 1 1 A 6 6 ASP CA C 6 57.997 58.007 -0.010 1
1 21 . 8 1 1 A 6 6 ASP CB C 6 40.910 42.131 -1.221 1
1 22 . 8 1 1 A 6 6 ASP N N 6 118.259 119.355 -1.096 1
1 23 . 8 1 1 A 7 7 GLN H H 7 8.660 8.439 0.221 1
1 24 . 8 1 1 A 7 7 GLN HA H 7 4.064 4.130 -0.066 1
1 29 . 8 1 1 A 7 7 GLN CA C 7 59.270 57.774 1.496 1
1 30 . 8 1 1 A 7 7 GLN CB C 7 28.468 27.435 1.033 1
1 31 . 8 1 1 A 7 7 GLN N N 7 119.558 117.029 2.529 1
1 32 . 8 1 1 A 8 8 ALA H H 8 8.253 7.793 0.460 1
1 33 . 8 1 1 A 8 8 ALA CA C 8 55.519 54.827 0.692 1
1 34 . 8 1 1 A 8 8 ALA CB C 8 18.113 18.651 -0.538 1
1 35 . 8 1 1 A 8 8 ALA N N 8 123.628 122.361 1.267 1
1 36 . 8 1 1 A 9 9 ILE H H 9 8.134 8.220 -0.086 1
1 37 . 8 1 1 A 9 9 ILE CA C 9 65.261 64.481 0.780 1
1 38 . 8 1 1 A 9 9 ILE CB C 9 37.023 37.251 -0.228 1
1 39 . 8 1 1 A 9 9 ILE N N 9 117.056 117.049 0.007 1
1 40 . 8 1 1 A 10 10 GLY H H 10 8.515 8.530 -0.015 1
1 41 . 8 1 1 A 10 10 GLY HA3 H 10 3.773 3.711 0.062 1
1 42 . 8 1 1 A 10 10 GLY CA C 10 47.637 47.162 0.475 1
1 43 . 8 1 1 A 10 10 GLY N N 10 106.202 110.550 -4.348 1
1 44 . 8 1 1 A 11 11 LEU H H 11 8.212 8.183 0.029 1
1 45 . 8 1 1 A 11 11 LEU CA C 11 58.354 57.616 0.738 1
1 46 . 8 1 1 A 11 11 LEU CB C 11 41.683 41.902 -0.219 1
1 47 . 8 1 1 A 11 11 LEU N N 11 124.624 123.298 1.326 1
1 48 . 8 1 1 A 12 12 LEU H H 12 7.971 7.876 0.095 1
1 49 . 8 1 1 A 12 12 LEU HA H 12 4.144 4.215 -0.071 1
1 59 . 8 1 1 A 12 12 LEU CA C 12 58.691 58.351 0.340 1
1 60 . 8 1 1 A 12 12 LEU CB C 12 40.657 41.622 -0.965 1
1 61 . 8 1 1 A 12 12 LEU N N 12 118.095 118.401 -0.306 1
1 62 . 8 1 1 A 13 13 ILE H H 13 8.379 8.324 0.055 1
1 63 . 8 1 1 A 13 13 ILE CA C 13 66.405 65.218 1.187 1
1 64 . 8 1 1 A 13 13 ILE CB C 13 38.916 37.930 0.986 1
1 65 . 8 1 1 A 13 13 ILE N N 13 121.161 120.538 0.623 1
1 66 . 8 1 1 A 14 14 GLY H H 14 8.823 8.505 0.318 1
1 67 . 8 1 1 A 14 14 GLY HA2 H 14 4.147 3.774 0.373 1
1 68 . 8 1 1 A 14 14 GLY HA3 H 14 3.982 3.782 0.200 1
1 69 . 8 1 1 A 14 14 GLY CA C 14 47.750 47.492 0.258 1
1 70 . 8 1 1 A 14 14 GLY N N 14 108.982 107.348 1.634 1
1 71 . 8 1 1 A 15 15 ILE H H 15 8.681 8.512 0.169 1
1 72 . 8 1 1 A 15 15 ILE CA C 15 64.996 64.494 0.502 1
1 73 . 8 1 1 A 15 15 ILE CB C 15 37.107 37.486 -0.379 1
1 74 . 8 1 1 A 15 15 ILE N N 15 121.601 122.684 -1.083 1
1 75 . 8 1 1 A 16 16 PHE H H 16 7.103 8.309 -1.206 1
1 76 . 8 1 1 A 16 16 PHE CA C 16 62.910 61.498 1.412 1
1 77 . 8 1 1 A 16 16 PHE CB C 16 38.782 39.971 -1.189 1
1 78 . 8 1 1 A 16 16 PHE N N 16 118.660 121.360 -2.700 1
1 79 . 8 1 1 A 17 17 HIS H H 17 7.591 8.607 -1.016 1
1 80 . 8 1 1 A 17 17 HIS HA H 17 4.793 4.118 0.675 1
1 82 . 8 1 1 A 17 17 HIS CA C 17 58.125 59.135 -1.010 1
1 83 . 8 1 1 A 17 17 HIS CB C 17 29.584 30.153 -0.569 1
1 84 . 8 1 1 A 17 17 HIS N N 17 114.968 118.931 -3.963 1
1 85 . 8 1 1 A 18 18 LYS H H 18 8.144 8.632 -0.488 1
1 86 . 8 1 1 A 18 18 LYS CA C 18 58.975 58.633 0.342 1
1 87 . 8 1 1 A 18 18 LYS CB C 18 32.379 31.949 0.430 1
1 88 . 8 1 1 A 18 18 LYS N N 18 122.373 117.255 5.118 1
1 89 . 8 1 1 A 19 19 TYR H H 19 6.999 7.336 -0.337 1
1 90 . 8 1 1 A 19 19 TYR CA C 19 60.318 60.358 -0.040 1
1 91 . 8 1 1 A 19 19 TYR CB C 19 40.355 38.435 1.920 1
1 92 . 8 1 1 A 19 19 TYR N N 19 113.614 119.412 -5.798 1
1 93 . 8 1 1 A 20 20 SER H H 20 8.432 7.742 0.690 1
1 94 . 8 1 1 A 20 20 SER CA C 20 61.897 61.613 0.284 1
1 95 . 8 1 1 A 20 20 SER CB C 20 61.354 62.797 -1.443 1
1 96 . 8 1 1 A 20 20 SER N N 20 113.201 115.637 -2.436 1
1 97 . 8 1 1 A 21 21 GLY H H 21 7.678 7.344 0.334 1
1 98 . 8 1 1 A 21 21 GLY HA2 H 21 4.195 3.814 0.381 1
1 99 . 8 1 1 A 21 21 GLY HA3 H 21 3.900 3.870 0.030 1
1 100 . 8 1 1 A 21 21 GLY CA C 21 45.628 45.383 0.245 1
1 101 . 8 1 1 A 21 21 GLY N N 21 110.734 108.516 2.218 1
1 102 . 8 1 1 A 22 22 LYS H H 22 7.362 7.613 -0.251 1
1 103 . 8 1 1 A 22 22 LYS CA C 22 60.163 58.475 1.688 1
1 104 . 8 1 1 A 22 22 LYS CB C 22 32.554 33.307 -0.753 1
1 105 . 8 1 1 A 22 22 LYS N N 22 122.161 120.601 1.560 1
1 106 . 8 1 1 A 23 23 GLU H H 23 9.639 8.534 1.105 1
1 107 . 8 1 1 A 23 23 GLU CA C 23 54.449 56.779 -2.330 1
1 108 . 8 1 1 A 23 23 GLU N N 23 116.288 116.411 -0.123 1
1 109 . 8 1 1 A 24 24 GLY HA2 H 24 3.912 4.022 -0.110 1
1 110 . 8 1 1 A 24 24 GLY HA3 H 24 3.787 4.035 -0.248 1
1 111 . 8 1 1 A 24 24 GLY CA C 24 45.898 44.293 1.605 1
1 112 . 8 1 1 A 25 25 ASP H H 25 8.204 8.625 -0.421 1
1 113 . 8 1 1 A 25 25 ASP CA C 25 55.252 53.720 1.532 1
1 114 . 8 1 1 A 25 25 ASP N N 25 125.671 118.993 6.678 1
1 115 . 8 1 1 A 26 26 LYS CA C 26 57.851 54.148 3.703 1
1 116 . 8 1 1 A 26 26 LYS CB C 26 31.265 35.767 -4.502 1
1 117 . 8 1 1 A 27 27 HIS H H 27 9.763 8.207 1.556 1
1 118 . 8 1 1 A 27 27 HIS CA C 27 55.580 56.483 -0.903 1
1 119 . 8 1 1 A 27 27 HIS CB C 27 30.936 29.793 1.143 1
1 120 . 8 1 1 A 27 27 HIS N N 27 118.108 119.247 -1.139 1
1 121 . 8 1 1 A 28 28 THR H H 28 7.325 7.693 -0.368 1
1 126 . 8 1 1 A 28 28 THR CA C 28 60.128 61.653 -1.525 1
1 127 . 8 1 1 A 28 28 THR CB C 28 72.268 72.369 -0.101 1
1 128 . 8 1 1 A 28 28 THR N N 28 106.920 115.528 -8.608 1
1 129 . 8 1 1 A 29 29 LEU H H 29 9.422 9.225 0.197 1
1 130 . 8 1 1 A 29 29 LEU HA H 29 5.368 4.931 0.437 1
1 140 . 8 1 1 A 29 29 LEU CA C 29 52.567 53.665 -1.098 1
1 141 . 8 1 1 A 29 29 LEU CB C 29 43.523 43.488 0.035 1
1 142 . 8 1 1 A 29 29 LEU N N 29 125.021 128.175 -3.154 1
1 143 . 8 1 1 A 30 30 SER H H 30 10.485 8.936 1.549 1
1 144 . 8 1 1 A 30 30 SER CA C 30 56.653 57.756 -1.103 1
1 145 . 8 1 1 A 30 30 SER CB C 30 65.313 63.872 1.441 1
1 146 . 8 1 1 A 30 30 SER N N 30 124.758 118.416 6.342 1
1 147 . 8 1 1 A 31 31 LYS H H 31 8.728 8.663 0.065 1
1 148 . 8 1 1 A 31 31 LYS CA C 31 59.669 59.231 0.438 1
1 149 . 8 1 1 A 31 31 LYS CB C 31 31.763 31.988 -0.225 1
1 150 . 8 1 1 A 31 31 LYS N N 31 119.459 124.027 -4.568 1
1 151 . 8 1 1 A 32 32 LYS H H 32 7.857 8.018 -0.161 1
1 152 . 8 1 1 A 32 32 LYS CA C 32 59.721 59.389 0.332 1
1 153 . 8 1 1 A 32 32 LYS CB C 32 32.901 32.050 0.851 1
1 154 . 8 1 1 A 32 32 LYS N N 32 117.933 119.502 -1.569 1
1 155 . 8 1 1 A 33 33 GLU H H 33 7.559 7.550 0.009 1
1 156 . 8 1 1 A 33 33 GLU CA C 33 59.169 58.545 0.624 1
1 157 . 8 1 1 A 33 33 GLU CB C 33 31.014 29.427 1.587 1
1 158 . 8 1 1 A 33 33 GLU N N 33 120.407 118.977 1.430 1
1 159 . 8 1 1 A 34 34 LEU H H 34 8.833 8.337 0.496 1
1 160 . 8 1 1 A 34 34 LEU CA C 34 56.928 57.812 -0.884 1
1 161 . 8 1 1 A 34 34 LEU CB C 34 41.435 41.512 -0.077 1
1 162 . 8 1 1 A 34 34 LEU N N 34 117.677 121.152 -3.475 1
1 163 . 8 1 1 A 35 35 LYS H H 35 8.010 8.115 -0.105 1
1 164 . 8 1 1 A 35 35 LYS CA C 35 60.692 59.728 0.964 1
1 165 . 8 1 1 A 35 35 LYS CB C 35 32.223 32.240 -0.017 1
1 166 . 8 1 1 A 35 35 LYS N N 35 119.829 118.751 1.078 1
1 167 . 8 1 1 A 36 36 GLU H H 36 7.169 8.133 -0.964 1
1 168 . 8 1 1 A 36 36 GLU CA C 36 59.588 58.954 0.634 1
1 169 . 8 1 1 A 36 36 GLU CB C 36 29.342 29.655 -0.313 1
1 170 . 8 1 1 A 36 36 GLU N N 36 117.340 119.419 -2.079 1
1 171 . 8 1 1 A 37 37 LEU H H 37 7.478 7.767 -0.289 1
1 172 . 8 1 1 A 37 37 LEU CA C 37 59.674 57.658 2.016 1
1 173 . 8 1 1 A 37 37 LEU CB C 37 42.142 40.986 1.156 1
1 174 . 8 1 1 A 37 37 LEU N N 37 120.884 121.445 -0.561 1
1 175 . 8 1 1 A 38 38 ILE H H 38 8.377 8.116 0.261 1
1 176 . 8 1 1 A 38 38 ILE CA C 38 65.651 65.499 0.152 1
1 177 . 8 1 1 A 38 38 ILE N N 38 118.450 119.914 -1.464 1
1 178 . 8 1 1 A 39 39 GLN H H 39 8.217 8.076 0.141 1
1 179 . 8 1 1 A 39 39 GLN CA C 39 59.788 58.995 0.793 1
1 180 . 8 1 1 A 39 39 GLN CB C 39 29.278 27.935 1.343 1
1 181 . 8 1 1 A 39 39 GLN N N 39 113.091 118.279 -5.188 1
1 182 . 8 1 1 A 40 40 LYS H H 40 8.426 7.902 0.524 1
1 183 . 8 1 1 A 40 40 LYS CA C 40 57.807 59.219 -1.412 1
1 184 . 8 1 1 A 40 40 LYS CB C 40 33.942 32.858 1.084 1
1 185 . 8 1 1 A 40 40 LYS N N 40 114.771 119.985 -5.214 1
1 186 . 8 1 1 A 41 41 GLU H H 41 8.496 8.429 0.067 1
1 187 . 8 1 1 A 41 41 GLU CA C 41 55.395 58.455 -3.060 1
1 188 . 8 1 1 A 41 41 GLU CB C 41 29.260 30.528 -1.268 1
1 189 . 8 1 1 A 41 41 GLU N N 41 112.546 117.790 -5.244 1
1 190 . 8 1 1 A 42 42 LEU H H 42 7.267 8.039 -0.772 1
1 191 . 8 1 1 A 42 42 LEU CA C 42 53.776 53.886 -0.110 1
1 192 . 8 1 1 A 42 42 LEU N N 42 118.657 120.552 -1.895 1
1 193 . 8 1 1 A 44 44 ILE CA C 44 62.210 59.914 2.296 1
1 194 . 8 1 1 A 44 44 ILE CB C 44 38.247 40.623 -2.376 1
1 195 . 8 1 1 A 45 45 GLY H H 45 7.820 8.753 -0.933 1
1 196 . 8 1 1 A 45 45 GLY CA C 45 47.742 46.559 1.183 1
1 197 . 8 1 1 A 45 45 GLY N N 45 108.178 116.086 -7.908 1
1 198 . 8 1 1 A 46 46 SER H H 46 7.895 7.860 0.035 1
1 199 . 8 1 1 A 46 46 SER CA C 46 59.958 57.239 2.719 1
1 200 . 8 1 1 A 46 46 SER CB C 46 63.450 61.100 2.350 1
1 201 . 8 1 1 A 46 46 SER N N 46 113.038 116.496 -3.458 1
1 202 . 8 1 1 A 47 47 LYS H H 47 7.736 8.040 -0.304 1
1 203 . 8 1 1 A 47 47 LYS CA C 47 55.636 58.294 -2.658 1
1 204 . 8 1 1 A 47 47 LYS CB C 47 33.103 32.102 1.001 1
1 205 . 8 1 1 A 47 47 LYS N N 47 119.422 124.104 -4.682 1
1 206 . 8 1 1 A 48 48 LEU H H 48 6.988 7.816 -0.828 1
1 207 . 8 1 1 A 48 48 LEU HA H 48 4.497 4.054 0.443 1
1 217 . 8 1 1 A 48 48 LEU CA C 48 54.517 57.447 -2.930 1
1 218 . 8 1 1 A 48 48 LEU CB C 48 42.987 41.127 1.860 1
1 219 . 8 1 1 A 48 48 LEU N N 48 118.908 117.787 1.121 1
1 220 . 8 1 1 A 49 49 GLN H H 49 9.206 8.250 0.956 1
1 221 . 8 1 1 A 49 49 GLN HA H 49 4.486 4.136 0.350 1
1 223 . 8 1 1 A 49 49 GLN CA C 49 54.785 58.089 -3.304 1
1 224 . 8 1 1 A 49 49 GLN CB C 49 29.636 28.766 0.870 1
1 225 . 8 1 1 A 49 49 GLN N N 49 121.275 119.616 1.659 1
1 226 . 8 1 1 A 50 50 ASP H H 50 8.854 8.413 0.441 1
1 227 . 8 1 1 A 50 50 ASP CA C 50 59.078 57.368 1.710 1
1 228 . 8 1 1 A 50 50 ASP CB C 50 40.632 41.595 -0.963 1
1 229 . 8 1 1 A 50 50 ASP N N 50 123.430 119.336 4.094 1
1 230 . 8 1 1 A 51 51 ALA H H 51 8.720 7.728 0.992 1
1 231 . 8 1 1 A 51 51 ALA CA C 51 55.281 54.902 0.379 1
1 232 . 8 1 1 A 51 51 ALA CB C 51 18.205 18.070 0.135 1
1 233 . 8 1 1 A 51 51 ALA N N 51 117.829 121.253 -3.424 1
1 234 . 8 1 1 A 52 52 GLU H H 52 7.161 7.898 -0.737 1
1 235 . 8 1 1 A 52 52 GLU CA C 52 58.757 58.893 -0.136 1
1 236 . 8 1 1 A 52 52 GLU CB C 52 30.247 29.382 0.865 1
1 237 . 8 1 1 A 52 52 GLU N N 52 115.459 117.250 -1.791 1
1 238 . 8 1 1 A 53 53 ILE H H 53 7.962 7.877 0.085 1
1 239 . 8 1 1 A 53 53 ILE CA C 53 65.525 65.082 0.443 1
1 240 . 8 1 1 A 53 53 ILE CB C 53 37.289 37.800 -0.511 1
1 241 . 8 1 1 A 53 53 ILE N N 53 120.414 121.376 -0.962 1
1 242 . 8 1 1 A 54 54 VAL H H 54 8.132 8.133 -0.001 1
1 243 . 8 1 1 A 54 54 VAL CA C 54 67.290 65.409 1.881 1
1 244 . 8 1 1 A 54 54 VAL CB C 54 31.434 31.153 0.281 1
1 245 . 8 1 1 A 54 54 VAL N N 54 119.775 117.153 2.622 1
1 246 . 8 1 1 A 55 55 LYS H H 55 7.155 7.998 -0.843 1
1 247 . 8 1 1 A 55 55 LYS CA C 55 59.131 59.050 0.081 1
1 248 . 8 1 1 A 55 55 LYS CB C 55 32.131 31.825 0.306 1
1 249 . 8 1 1 A 55 55 LYS N N 55 119.175 120.752 -1.577 1
1 250 . 8 1 1 A 56 56 LEU H H 56 7.837 8.148 -0.311 1
1 251 . 8 1 1 A 56 56 LEU CA C 56 58.052 57.739 0.313 1
1 252 . 8 1 1 A 56 56 LEU CB C 56 41.878 41.844 0.034 1
1 253 . 8 1 1 A 56 56 LEU N N 56 119.679 121.031 -1.352 1
1 254 . 8 1 1 A 57 57 MET H H 57 8.385 8.736 -0.351 1
1 255 . 8 1 1 A 57 57 MET CA C 57 60.756 58.719 2.037 1
1 256 . 8 1 1 A 57 57 MET CB C 57 33.152 31.907 1.245 1
1 257 . 8 1 1 A 57 57 MET N N 57 115.116 119.770 -4.654 1
1 258 . 8 1 1 A 58 58 ASP H H 58 7.591 8.209 -0.618 1
1 259 . 8 1 1 A 58 58 ASP CA C 58 57.365 57.747 -0.382 1
1 260 . 8 1 1 A 58 58 ASP CB C 58 40.858 42.169 -1.311 1
1 261 . 8 1 1 A 58 58 ASP N N 58 118.197 119.852 -1.655 1
1 262 . 8 1 1 A 59 59 ASP H H 59 7.725 8.145 -0.420 1
1 263 . 8 1 1 A 59 59 ASP CA C 59 56.830 57.349 -0.519 1
1 264 . 8 1 1 A 59 59 ASP CB C 59 40.567 41.649 -1.082 1
1 265 . 8 1 1 A 59 59 ASP N N 59 118.481 119.491 -1.010 1
1 266 . 8 1 1 A 60 60 LEU H H 60 7.703 8.113 -0.410 1
1 267 . 8 1 1 A 60 60 LEU CA C 60 56.564 57.821 -1.257 1
1 268 . 8 1 1 A 60 60 LEU CB C 60 42.714 40.832 1.882 1
1 269 . 8 1 1 A 60 60 LEU N N 60 116.935 119.525 -2.590 1
1 270 . 8 1 1 A 61 61 ASP H H 61 7.143 8.421 -1.278 1
1 271 . 8 1 1 A 61 61 ASP HA H 61 4.690 4.466 0.224 1
1 274 . 8 1 1 A 61 61 ASP CA C 61 52.286 56.438 -4.152 1
1 275 . 8 1 1 A 61 61 ASP CB C 61 39.245 41.225 -1.980 1
1 276 . 8 1 1 A 61 61 ASP N N 61 116.605 119.398 -2.793 1
1 277 . 8 1 1 A 62 62 ARG H H 62 7.786 7.655 0.131 1
1 278 . 8 1 1 A 62 62 ARG CA C 62 58.328 58.708 -0.380 1
1 279 . 8 1 1 A 62 62 ARG CB C 62 30.106 30.049 0.057 1
1 280 . 8 1 1 A 62 62 ARG N N 62 125.967 117.840 8.127 1
1 281 . 8 1 1 A 63 63 ASN H H 63 7.945 7.692 0.253 1
1 282 . 8 1 1 A 63 63 ASN CA C 63 51.863 55.692 -3.829 1
1 283 . 8 1 1 A 63 63 ASN CB C 63 36.809 38.603 -1.794 1
1 284 . 8 1 1 A 63 63 ASN N N 63 112.434 116.509 -4.075 1
1 285 . 8 1 1 A 64 64 LYS H H 64 7.477 7.506 -0.029 1
1 286 . 8 1 1 A 64 64 LYS CA C 64 56.524 56.454 0.070 1
1 287 . 8 1 1 A 64 64 LYS N N 64 114.197 117.426 -3.229 1
1 288 . 8 1 1 A 65 65 ASP H H 65 8.345 8.936 -0.591 1
1 289 . 8 1 1 A 65 65 ASP CA C 65 52.969 55.660 -2.691 1
1 290 . 8 1 1 A 65 65 ASP CB C 65 40.329 43.791 -3.462 1
1 291 . 8 1 1 A 65 65 ASP N N 65 118.581 122.849 -4.268 1
1 292 . 8 1 1 A 66 66 GLN H H 66 9.945 8.222 1.723 1
1 293 . 8 1 1 A 66 66 GLN CA C 66 58.132 55.438 2.694 1
1 294 . 8 1 1 A 66 66 GLN CB C 66 26.035 30.579 -4.544 1
1 295 . 8 1 1 A 66 66 GLN N N 66 113.203 115.978 -2.775 1
1 296 . 8 1 1 A 67 67 GLU H H 67 7.880 7.902 -0.022 1
1 297 . 8 1 1 A 67 67 GLU HA H 67 4.910 4.795 0.115 1
1 302 . 8 1 1 A 67 67 GLU CA C 67 54.082 55.288 -1.206 1
1 303 . 8 1 1 A 67 67 GLU CB C 67 33.174 32.902 0.272 1
1 304 . 8 1 1 A 67 67 GLU N N 67 118.554 117.392 1.162 1
1 305 . 8 1 1 A 68 68 VAL H H 68 9.669 9.090 0.579 1
1 306 . 8 1 1 A 68 68 VAL HA H 68 5.465 4.789 0.676 1
1 314 . 8 1 1 A 68 68 VAL CA C 68 61.079 61.342 -0.263 1
1 315 . 8 1 1 A 68 68 VAL CB C 68 33.280 35.122 -1.842 1
1 316 . 8 1 1 A 68 68 VAL N N 68 126.572 120.856 5.716 1
1 317 . 8 1 1 A 69 69 ASN H H 69 8.985 8.741 0.244 1
1 318 . 8 1 1 A 69 69 ASN CA C 69 50.812 53.582 -2.770 1
1 319 . 8 1 1 A 69 69 ASN CB C 69 38.609 40.743 -2.134 1
1 320 . 8 1 1 A 69 69 ASN N N 69 127.472 125.782 1.690 1
1 321 . 8 1 1 A 70 70 PHE H H 70 9.100 9.364 -0.264 1
1 322 . 8 1 1 A 70 70 PHE CA C 70 63.279 62.184 1.095 1
1 323 . 8 1 1 A 70 70 PHE CB C 70 38.741 39.795 -1.054 1
1 324 . 8 1 1 A 70 70 PHE N N 70 119.972 127.834 -7.862 1
1 325 . 8 1 1 A 71 71 GLN H H 71 8.342 7.899 0.443 1
1 326 . 8 1 1 A 71 71 GLN HA H 71 3.923 3.631 0.292 1
1 329 . 8 1 1 A 71 71 GLN CA C 71 59.866 58.305 1.561 1
1 330 . 8 1 1 A 71 71 GLN CB C 71 27.878 27.688 0.190 1
1 331 . 8 1 1 A 71 71 GLN N N 71 118.216 117.079 1.137 1
1 332 . 8 1 1 A 72 72 GLU H H 72 8.721 7.585 1.136 1
1 333 . 8 1 1 A 72 72 GLU HA H 72 4.147 4.073 0.074 1
1 338 . 8 1 1 A 72 72 GLU CA C 72 59.313 58.919 0.394 1
1 339 . 8 1 1 A 72 72 GLU CB C 72 30.233 29.465 0.768 1
1 340 . 8 1 1 A 72 72 GLU N N 72 121.455 119.672 1.783 1
1 341 . 8 1 1 A 73 73 TYR H H 73 8.536 8.081 0.455 1
1 342 . 8 1 1 A 73 73 TYR CA C 73 60.961 61.581 -0.620 1
1 343 . 8 1 1 A 73 73 TYR CB C 73 38.724 38.746 -0.022 1
1 344 . 8 1 1 A 73 73 TYR N N 73 123.356 122.193 1.163 1
1 345 . 8 1 1 A 74 74 ILE H H 74 8.642 8.160 0.482 1
1 346 . 8 1 1 A 74 74 ILE CA C 74 61.880 64.415 -2.535 1
1 347 . 8 1 1 A 74 74 ILE CB C 74 36.077 37.424 -1.347 1
1 348 . 8 1 1 A 74 74 ILE N N 74 119.799 120.680 -0.881 1
1 349 . 8 1 1 A 75 75 THR H H 75 7.959 8.069 -0.110 1
1 354 . 8 1 1 A 75 75 THR CA C 75 67.056 66.618 0.438 1
1 355 . 8 1 1 A 75 75 THR CB C 75 68.386 68.535 -0.149 1
1 356 . 8 1 1 A 75 75 THR N N 75 119.486 118.047 1.439 1
1 357 . 8 1 1 A 76 76 PHE H H 76 7.450 8.160 -0.710 1
1 358 . 8 1 1 A 76 76 PHE CA C 76 59.010 61.740 -2.730 1
1 359 . 8 1 1 A 76 76 PHE CB C 76 38.139 39.315 -1.176 1
1 360 . 8 1 1 A 76 76 PHE N N 76 122.873 122.912 -0.039 1
1 361 . 8 1 1 A 77 77 LEU H H 77 7.829 8.206 -0.377 1
1 362 . 8 1 1 A 77 77 LEU CA C 77 57.450 57.625 -0.175 1
1 363 . 8 1 1 A 77 77 LEU CB C 77 40.560 41.022 -0.462 1
1 364 . 8 1 1 A 77 77 LEU N N 77 117.405 118.588 -1.183 1
1 365 . 8 1 1 A 78 78 GLY H H 78 8.093 8.146 -0.053 1
1 366 . 8 1 1 A 78 78 GLY HA2 H 78 3.661 3.736 -0.075 1
1 367 . 8 1 1 A 78 78 GLY HA3 H 78 3.594 3.747 -0.153 1
1 368 . 8 1 1 A 78 78 GLY CA C 78 47.442 47.230 0.212 1
1 369 . 8 1 1 A 78 78 GLY N N 78 105.528 106.055 -0.527 1
1 370 . 8 1 1 A 79 79 ALA H H 79 7.759 7.711 0.048 1
1 371 . 8 1 1 A 79 79 ALA CA C 79 55.153 54.411 0.742 1
1 372 . 8 1 1 A 79 79 ALA CB C 79 17.768 18.161 -0.393 1
1 373 . 8 1 1 A 79 79 ALA N N 79 124.488 124.988 -0.500 1
1 374 . 8 1 1 A 80 80 LEU H H 80 7.963 8.020 -0.057 1
1 375 . 8 1 1 A 80 80 LEU CA C 80 57.464 57.597 -0.133 1
1 376 . 8 1 1 A 80 80 LEU CB C 80 41.496 41.079 0.417 1
1 377 . 8 1 1 A 80 80 LEU N N 80 117.869 120.638 -2.769 1
1 378 . 8 1 1 A 81 81 ALA H H 81 8.365 8.325 0.040 1
1 379 . 8 1 1 A 81 81 ALA CA C 81 55.475 54.963 0.512 1
1 380 . 8 1 1 A 81 81 ALA CB C 81 17.483 18.141 -0.658 1
1 381 . 8 1 1 A 81 81 ALA N N 81 119.054 120.175 -1.121 1
1 382 . 8 1 1 A 82 82 MET H H 82 8.112 7.616 0.496 1
1 383 . 8 1 1 A 82 82 MET CA C 82 59.516 57.939 1.577 1
1 384 . 8 1 1 A 82 82 MET CB C 82 32.550 32.179 0.371 1
1 385 . 8 1 1 A 82 82 MET N N 82 115.364 117.498 -2.134 1
1 386 . 8 1 1 A 83 83 ILE H H 83 7.981 8.125 -0.144 1
1 387 . 8 1 1 A 83 83 ILE HA H 83 3.839 3.724 0.115 1
1 391 . 8 1 1 A 83 83 ILE CA C 83 64.467 63.729 0.738 1
1 392 . 8 1 1 A 83 83 ILE CB C 83 37.312 37.256 0.056 1
1 393 . 8 1 1 A 83 83 ILE N N 83 120.887 120.400 0.487 1
1 394 . 8 1 1 A 84 84 TYR H H 84 8.731 7.579 1.152 1
1 395 . 8 1 1 A 84 84 TYR N N 84 120.933 121.307 -0.374 1
1 396 . 8 1 1 A 87 87 ALA H H 87 7.829 8.209 -0.380 1
1 397 . 8 1 1 A 87 87 ALA CA C 87 53.768 54.799 -1.031 1
1 398 . 8 1 1 A 87 87 ALA CB C 87 18.504 18.331 0.173 1
1 399 . 8 1 1 A 87 87 ALA N N 87 120.274 121.987 -1.713 1
1 400 . 8 1 1 A 88 88 LEU H H 88 7.499 7.824 -0.325 1
1 401 . 8 1 1 A 88 88 LEU CA C 88 55.605 55.633 -0.028 1
1 402 . 8 1 1 A 88 88 LEU CB C 88 42.047 42.031 0.016 1
1 403 . 8 1 1 A 88 88 LEU N N 88 117.356 118.141 -0.785 1
1 404 . 8 1 1 A 89 89 LYS H H 89 7.561 7.738 -0.177 1
1 405 . 8 1 1 A 89 89 LYS CA C 89 56.865 55.805 1.060 1
1 406 . 8 1 1 A 89 89 LYS CB C 89 32.592 33.471 -0.879 1
1 407 . 8 1 1 A 89 89 LYS N N 89 119.289 117.491 1.798 1
1 416 . 8 3 2 C 6 6 GLU H H 190 8.385 8.713 -0.328 1
1 417 . 8 3 2 C 6 6 GLU HA H 190 4.153 4.020 0.133 1
1 422 . 8 3 2 C 6 6 GLU C C 190 175.031 177.170 -2.139 1
1 423 . 8 3 2 C 6 6 GLU CA C 190 58.866 57.977 0.889 1
1 424 . 8 3 2 C 6 6 GLU CB C 190 30.751 30.300 0.451 1
1 426 . 8 3 2 C 6 6 GLU N N 190 122.715 123.746 -1.031 1
1 427 . 8 3 2 C 7 7 GLY H H 191 8.475 8.139 0.336 1
1 428 . 8 3 2 C 7 7 GLY HA2 H 191 3.887 3.951 -0.064 1
1 429 . 8 3 2 C 7 7 GLY HA3 H 191 3.887 3.953 -0.066 1
1 430 . 8 3 2 C 7 7 GLY C C 191 177.922 174.708 3.214 1
1 431 . 8 3 2 C 7 7 GLY CA C 191 46.884 45.514 1.370 1
1 432 . 8 3 2 C 7 7 GLY N N 191 109.009 111.991 -2.982 1
1 433 . 8 3 2 C 8 8 LEU HA H 192 4.095 3.925 0.170 1
1 443 . 8 3 2 C 8 8 LEU CA C 192 58.154 58.202 -0.048 1
1 444 . 8 3 2 C 8 8 LEU CB C 192 42.789 42.120 0.669 1
1 448 . 8 3 2 C 9 9 MET H H 193 8.250 8.511 -0.261 1
1 449 . 8 3 2 C 9 9 MET HA H 193 4.150 4.215 -0.065 1
1 457 . 8 3 2 C 9 9 MET C C 193 178.421 178.281 0.140 1
1 458 . 8 3 2 C 9 9 MET CA C 193 58.818 58.442 0.376 1
1 459 . 8 3 2 C 9 9 MET CB C 193 32.360 32.486 -0.126 1
1 462 . 8 3 2 C 9 9 MET N N 193 117.049 117.574 -0.525 1
1 463 . 8 3 2 C 10 10 ASN H H 194 7.892 8.398 -0.506 1
1 464 . 8 3 2 C 10 10 ASN HA H 194 4.468 4.537 -0.069 1
1 469 . 8 3 2 C 10 10 ASN C C 194 178.099 176.330 1.769 1
1 470 . 8 3 2 C 10 10 ASN CA C 194 56.644 55.215 1.429 1
1 471 . 8 3 2 C 10 10 ASN CB C 194 39.100 38.566 0.534 1
1 472 . 8 3 2 C 10 10 ASN N N 194 117.034 118.115 -1.081 1
1 474 . 8 3 2 C 11 11 VAL H H 195 7.651 7.835 -0.184 1
1 475 . 8 3 2 C 11 11 VAL HA H 195 3.735 3.872 -0.137 1
1 483 . 8 3 2 C 11 11 VAL C C 195 177.657 178.321 -0.664 1
1 484 . 8 3 2 C 11 11 VAL CA C 195 66.710 65.085 1.625 1
1 485 . 8 3 2 C 11 11 VAL CB C 195 32.468 31.666 0.802 1
1 488 . 8 3 2 C 11 11 VAL N N 195 119.878 117.376 2.502 1
1 489 . 8 3 2 C 12 12 LEU H H 196 8.030 7.838 0.192 1
1 490 . 8 3 2 C 12 12 LEU HA H 196 4.013 4.097 -0.084 1
1 500 . 8 3 2 C 12 12 LEU C C 196 177.540 178.974 -1.434 1
1 501 . 8 3 2 C 12 12 LEU CA C 196 58.489 57.164 1.325 1
1 502 . 8 3 2 C 12 12 LEU CB C 196 42.457 41.784 0.673 1
1 506 . 8 3 2 C 12 12 LEU N N 196 119.499 120.413 -0.914 1
1 507 . 8 3 2 C 13 13 LYS H H 197 8.015 8.359 -0.344 1
1 508 . 8 3 2 C 13 13 LYS HA H 197 3.949 4.002 -0.053 1
1 517 . 8 3 2 C 13 13 LYS C C 197 178.419 179.554 -1.135 1
1 518 . 8 3 2 C 13 13 LYS CA C 197 60.191 60.318 -0.127 1
1 519 . 8 3 2 C 13 13 LYS CB C 197 33.075 32.108 0.967 1
1 523 . 8 3 2 C 13 13 LYS N N 197 117.888 119.425 -1.537 1
1 524 . 8 3 2 C 14 14 LYS H H 198 7.506 7.725 -0.219 1
1 525 . 8 3 2 C 14 14 LYS HA H 198 4.127 4.065 0.062 1
1 534 . 8 3 2 C 14 14 LYS C C 198 178.262 179.223 -0.961 1
1 535 . 8 3 2 C 14 14 LYS CA C 198 59.161 58.967 0.194 1
1 536 . 8 3 2 C 14 14 LYS CB C 198 32.956 31.941 1.015 1
1 540 . 8 3 2 C 14 14 LYS N N 198 118.321 119.392 -1.071 1
1 541 . 8 3 2 C 15 15 ILE H H 199 7.780 7.677 0.103 1
1 542 . 8 3 2 C 15 15 ILE HA H 199 3.787 3.928 -0.141 1
1 552 . 8 3 2 C 15 15 ILE C C 199 178.647 178.033 0.614 1
1 553 . 8 3 2 C 15 15 ILE CA C 199 64.912 64.104 0.808 1
1 554 . 8 3 2 C 15 15 ILE CB C 199 38.780 37.194 1.586 1
1 558 . 8 3 2 C 15 15 ILE N N 199 118.644 120.708 -2.064 1
1 559 . 8 3 2 C 16 16 TYR H H 200 7.918 8.271 -0.353 1
1 560 . 8 3 2 C 16 16 TYR HA H 200 4.252 4.081 0.171 1
1 567 . 8 3 2 C 16 16 TYR C C 200 177.806 177.396 0.410 1
1 568 . 8 3 2 C 16 16 TYR CA C 200 61.171 61.722 -0.551 1
1 569 . 8 3 2 C 16 16 TYR CB C 200 39.245 39.013 0.232 1
1 573 . 8 3 2 C 16 16 TYR N N 200 118.683 122.323 -3.640 1
1 574 . 8 3 2 C 17 17 GLU H H 201 8.089 8.667 -0.578 1
1 575 . 8 3 2 C 17 17 GLU HA H 201 4.124 4.138 -0.014 1
1 580 . 8 3 2 C 17 17 GLU C C 201 177.414 176.734 0.680 1
1 581 . 8 3 2 C 17 17 GLU CA C 201 58.784 58.013 0.771 1
1 582 . 8 3 2 C 17 17 GLU CB C 201 30.747 29.249 1.498 1
1 584 . 8 3 2 C 17 17 GLU N N 201 119.409 118.584 0.825 1
1 585 . 8 3 2 C 18 18 ASP H H 202 8.023 8.076 -0.053 1
1 586 . 8 3 2 C 18 18 ASP HA H 202 4.657 4.865 -0.208 1
1 589 . 8 3 2 C 18 18 ASP C C 202 177.346 176.530 0.816 1
1 590 . 8 3 2 C 18 18 ASP CA C 202 55.496 53.787 1.709 1
1 591 . 8 3 2 C 18 18 ASP CB C 202 42.023 41.465 0.558 1
1 592 . 8 3 2 C 18 18 ASP N N 202 119.459 119.016 0.443 1
1 593 . 8 3 2 C 19 19 GLY H H 203 7.933 7.748 0.185 1
1 594 . 8 3 2 C 19 19 GLY HA2 H 203 3.938 4.114 -0.176 1
1 595 . 8 3 2 C 19 19 GLY HA3 H 203 3.938 4.127 -0.189 1
1 596 . 8 3 2 C 19 19 GLY C C 203 177.240 172.555 4.685 1
1 597 . 8 3 2 C 19 19 GLY CA C 203 46.309 44.843 1.466 1
1 598 . 8 3 2 C 19 19 GLY N N 203 108.518 108.186 0.332 1
1 599 . 8 3 2 C 20 20 ASP H H 204 8.091 8.875 -0.784 1
1 600 . 8 3 2 C 20 20 ASP HA H 204 4.616 4.831 -0.215 1
1 603 . 8 3 2 C 20 20 ASP C C 204 173.979 177.034 -3.055 1
1 604 . 8 3 2 C 20 20 ASP CA C 204 55.064 53.202 1.862 1
1 605 . 8 3 2 C 20 20 ASP CB C 204 42.203 41.990 0.213 1
1 606 . 8 3 2 C 20 20 ASP N N 204 120.172 119.933 0.239 1
1 607 . 8 3 2 C 21 21 ASP H H 205 8.352 8.997 -0.645 1
1 608 . 8 3 2 C 21 21 ASP HA H 205 4.468 4.381 0.087 1
1 611 . 8 3 2 C 21 21 ASP C C 205 176.432 177.474 -1.042 1
1 612 . 8 3 2 C 21 21 ASP CA C 205 56.663 55.645 1.018 1
1 613 . 8 3 2 C 21 21 ASP CB C 205 41.918 40.987 0.931 1
1 614 . 8 3 2 C 21 21 ASP N N 205 121.515 123.430 -1.915 1
1 615 . 8 3 2 C 22 22 ASP H H 206 8.239 8.141 0.098 1
1 616 . 8 3 2 C 22 22 ASP HA H 206 4.455 4.509 -0.054 1
1 619 . 8 3 2 C 22 22 ASP C C 206 177.449 179.405 -1.956 1
1 620 . 8 3 2 C 22 22 ASP CA C 206 57.165 56.904 0.261 1
1 621 . 8 3 2 C 22 22 ASP CB C 206 41.820 40.164 1.656 1
1 622 . 8 3 2 C 22 22 ASP N N 206 120.156 119.229 0.927 1
1 623 . 8 3 2 C 23 23 MET H H 207 8.300 7.732 0.568 1
1 624 . 8 3 2 C 23 23 MET HA H 207 4.255 4.117 0.138 1
1 632 . 8 3 2 C 23 23 MET C C 207 178.412 178.186 0.226 1
1 633 . 8 3 2 C 23 23 MET CA C 207 58.065 58.792 -0.727 1
1 634 . 8 3 2 C 23 23 MET CB C 207 32.488 32.791 -0.303 1
1 637 . 8 3 2 C 23 23 MET N N 207 120.707 119.323 1.384 1
1 638 . 8 3 2 C 24 24 LYS H H 208 8.047 8.246 -0.199 1
1 639 . 8 3 2 C 24 24 LYS HA H 208 3.946 4.031 -0.085 1
1 648 . 8 3 2 C 24 24 LYS C C 208 178.008 178.876 -0.868 1
1 649 . 8 3 2 C 24 24 LYS CA C 208 59.847 59.017 0.830 1
1 650 . 8 3 2 C 24 24 LYS CB C 208 32.983 31.407 1.576 1
1 654 . 8 3 2 C 24 24 LYS N N 208 119.504 117.521 1.983 1
1 655 . 8 3 2 C 25 25 ARG H H 209 7.891 7.769 0.122 1
1 656 . 8 3 2 C 25 25 ARG HA H 209 4.168 4.054 0.114 1
1 663 . 8 3 2 C 25 25 ARG C C 209 178.100 178.755 -0.655 1
1 664 . 8 3 2 C 25 25 ARG CA C 209 58.810 59.049 -0.239 1
1 665 . 8 3 2 C 25 25 ARG CB C 209 31.080 30.754 0.326 1
1 668 . 8 3 2 C 25 25 ARG N N 209 118.378 119.251 -0.873 1
1 669 . 8 3 2 C 26 26 THR H H 210 7.869 8.468 -0.599 1
1 670 . 8 3 2 C 26 26 THR HA H 210 4.023 4.002 0.021 1
1 675 . 8 3 2 C 26 26 THR C C 210 177.984 176.391 1.593 1
1 676 . 8 3 2 C 26 26 THR CA C 210 65.747 67.141 -1.394 1
1 677 . 8 3 2 C 26 26 THR CB C 210 69.683 68.681 1.002 1
1 679 . 8 3 2 C 26 26 THR N N 210 115.443 116.447 -1.004 1
1 680 . 8 3 2 C 27 27 ILE H H 211 7.901 8.148 -0.247 1
1 681 . 8 3 2 C 27 27 ILE HA H 211 4.142 3.674 0.468 1
1 691 . 8 3 2 C 27 27 ILE C C 211 175.595 178.172 -2.577 1
1 692 . 8 3 2 C 27 27 ILE CA C 211 63.528 64.622 -1.094 1
1 693 . 8 3 2 C 27 27 ILE CB C 211 38.982 37.264 1.718 1
1 697 . 8 3 2 C 27 27 ILE N N 211 121.265 121.057 0.208 1
1 698 . 8 3 2 C 28 28 ASN HA H 212 4.465 4.299 0.166 1
1 703 . 8 3 2 C 28 28 ASN CA C 212 55.182 56.737 -1.555 1
1 704 . 8 3 2 C 28 28 ASN CB C 212 39.480 39.528 -0.048 1
1 706 . 8 3 2 C 29 29 LYS H H 213 7.968 8.219 -0.251 1
1 707 . 8 3 2 C 29 29 LYS HA H 213 4.072 4.058 0.014 1
1 716 . 8 3 2 C 29 29 LYS C C 213 176.218 178.905 -2.687 1
1 717 . 8 3 2 C 29 29 LYS CA C 213 58.489 59.070 -0.581 1
1 718 . 8 3 2 C 29 29 LYS CB C 213 33.165 32.135 1.030 1
1 722 . 8 3 2 C 29 29 LYS N N 213 120.820 118.081 2.739 1
1 723 . 8 3 2 C 30 30 ALA H H 214 7.865 8.060 -0.195 1
1 724 . 8 3 2 C 30 30 ALA HA H 214 4.217 4.172 0.045 1
1 728 . 8 3 2 C 30 30 ALA C C 214 177.041 179.760 -2.719 1
1 729 . 8 3 2 C 30 30 ALA CA C 214 54.104 54.978 -0.874 1
1 730 . 8 3 2 C 30 30 ALA CB C 214 19.496 18.418 1.078 1
1 731 . 8 3 2 C 30 30 ALA N N 214 121.571 121.262 0.309 1
1 732 . 8 3 2 C 31 31 TRP H H 215 7.831 8.148 -0.317 1
1 733 . 8 3 2 C 31 31 TRP HA H 215 4.598 4.450 0.148 1
1 742 . 8 3 2 C 31 31 TRP C C 215 178.088 179.107 -1.019 1
1 743 . 8 3 2 C 31 31 TRP CA C 215 58.432 59.879 -1.447 1
1 744 . 8 3 2 C 31 31 TRP CB C 215 30.472 29.965 0.507 1
1 750 . 8 3 2 C 31 31 TRP N N 215 118.141 117.587 0.554 1
1 752 . 8 3 2 C 32 32 VAL H H 216 7.594 8.332 -0.738 1
1 753 . 8 3 2 C 32 32 VAL HA H 216 3.978 3.708 0.270 1
1 761 . 8 3 2 C 32 32 VAL C C 216 176.574 177.516 -0.942 1
1 762 . 8 3 2 C 32 32 VAL CA C 216 63.329 66.348 -3.019 1
1 763 . 8 3 2 C 32 32 VAL CB C 216 33.373 31.294 2.079 1
1 766 . 8 3 2 C 32 32 VAL N N 216 118.287 120.174 -1.887 1
1 767 . 8 3 2 C 33 33 GLU H H 217 8.012 8.683 -0.671 1
1 768 . 8 3 2 C 33 33 GLU HA H 217 4.257 4.211 0.046 1
1 773 . 8 3 2 C 33 33 GLU C C 217 176.164 178.389 -2.225 1
1 774 . 8 3 2 C 33 33 GLU CA C 217 57.409 58.031 -0.622 1
1 775 . 8 3 2 C 33 33 GLU CB C 217 30.978 28.402 2.576 1
1 777 . 8 3 2 C 33 33 GLU N N 217 122.535 120.073 2.462 1
1 778 . 8 3 2 C 34 34 SER H H 218 8.037 7.960 0.077 1
1 779 . 8 3 2 C 34 34 SER HA H 218 4.514 4.042 0.472 1
1 782 . 8 3 2 C 34 34 SER C C 218 176.451 174.076 2.375 1
1 783 . 8 3 2 C 34 34 SER CA C 218 58.987 61.898 -2.911 1
1 784 . 8 3 2 C 34 34 SER CB C 218 64.569 62.823 1.746 1
1 785 . 8 3 2 C 34 34 SER N N 218 117.058 118.041 -0.983 1
1 6 . 9 1 1 A 2 2 ALA H H 2 8.191 7.829 0.362 1
1 7 . 9 1 1 A 2 2 ALA CA C 2 51.957 55.082 -3.125 1
1 8 . 9 1 1 A 2 2 ALA CB C 2 19.580 17.173 2.407 1
1 9 . 9 1 1 A 2 2 ALA N N 2 124.666 122.198 2.468 1
1 10 . 9 1 1 A 3 3 SER H H 3 8.829 8.770 0.059 1
1 11 . 9 1 1 A 3 3 SER CA C 3 57.221 62.618 -5.397 1
1 12 . 9 1 1 A 3 3 SER N N 3 119.917 113.123 6.794 1
1 13 . 9 1 1 A 4 4 PRO CA C 4 66.688 65.790 0.898 1
1 14 . 9 1 1 A 4 4 PRO CB C 4 32.553 30.732 1.821 1
1 15 . 9 1 1 A 5 5 LEU H H 5 9.146 7.571 1.575 1
1 16 . 9 1 1 A 5 5 LEU CA C 5 59.017 57.054 1.963 1
1 17 . 9 1 1 A 5 5 LEU CB C 5 42.341 42.173 0.168 1
1 18 . 9 1 1 A 5 5 LEU N N 5 117.902 116.669 1.233 1
1 19 . 9 1 1 A 6 6 ASP H H 6 7.572 8.347 -0.775 1
1 20 . 9 1 1 A 6 6 ASP CA C 6 57.997 57.636 0.361 1
1 21 . 9 1 1 A 6 6 ASP CB C 6 40.910 41.082 -0.172 1
1 22 . 9 1 1 A 6 6 ASP N N 6 118.259 119.136 -0.877 1
1 23 . 9 1 1 A 7 7 GLN H H 7 8.660 8.211 0.449 1
1 24 . 9 1 1 A 7 7 GLN HA H 7 4.064 4.137 -0.073 1
1 29 . 9 1 1 A 7 7 GLN CA C 7 59.270 58.076 1.194 1
1 30 . 9 1 1 A 7 7 GLN CB C 7 28.468 27.604 0.864 1
1 31 . 9 1 1 A 7 7 GLN N N 7 119.558 117.053 2.505 1
1 32 . 9 1 1 A 8 8 ALA H H 8 8.253 7.870 0.383 1
1 33 . 9 1 1 A 8 8 ALA CA C 8 55.519 54.815 0.704 1
1 34 . 9 1 1 A 8 8 ALA CB C 8 18.113 18.575 -0.462 1
1 35 . 9 1 1 A 8 8 ALA N N 8 123.628 122.246 1.382 1
1 36 . 9 1 1 A 9 9 ILE H H 9 8.134 8.227 -0.093 1
1 37 . 9 1 1 A 9 9 ILE CA C 9 65.261 64.564 0.697 1
1 38 . 9 1 1 A 9 9 ILE CB C 9 37.023 37.234 -0.211 1
1 39 . 9 1 1 A 9 9 ILE N N 9 117.056 117.056 0.000 1
1 40 . 9 1 1 A 10 10 GLY H H 10 8.515 8.371 0.144 1
1 41 . 9 1 1 A 10 10 GLY HA3 H 10 3.773 3.761 0.012 1
1 42 . 9 1 1 A 10 10 GLY CA C 10 47.637 46.931 0.706 1
1 43 . 9 1 1 A 10 10 GLY N N 10 106.202 110.827 -4.625 1
1 44 . 9 1 1 A 11 11 LEU H H 11 8.212 7.776 0.436 1
1 45 . 9 1 1 A 11 11 LEU CA C 11 58.354 57.606 0.748 1
1 46 . 9 1 1 A 11 11 LEU CB C 11 41.683 41.925 -0.242 1
1 47 . 9 1 1 A 11 11 LEU N N 11 124.624 123.767 0.857 1
1 48 . 9 1 1 A 12 12 LEU H H 12 7.971 7.940 0.031 1
1 49 . 9 1 1 A 12 12 LEU HA H 12 4.144 4.222 -0.078 1
1 59 . 9 1 1 A 12 12 LEU CA C 12 58.691 58.428 0.263 1
1 60 . 9 1 1 A 12 12 LEU CB C 12 40.657 41.758 -1.101 1
1 61 . 9 1 1 A 12 12 LEU N N 12 118.095 118.617 -0.522 1
1 62 . 9 1 1 A 13 13 ILE H H 13 8.379 8.540 -0.161 1
1 63 . 9 1 1 A 13 13 ILE CA C 13 66.405 65.183 1.222 1
1 64 . 9 1 1 A 13 13 ILE CB C 13 38.916 38.051 0.865 1
1 65 . 9 1 1 A 13 13 ILE N N 13 121.161 120.448 0.713 1
1 66 . 9 1 1 A 14 14 GLY H H 14 8.823 8.461 0.362 1
1 67 . 9 1 1 A 14 14 GLY HA2 H 14 4.147 3.687 0.460 1
1 68 . 9 1 1 A 14 14 GLY HA3 H 14 3.982 3.698 0.284 1
1 69 . 9 1 1 A 14 14 GLY CA C 14 47.750 47.065 0.685 1
1 70 . 9 1 1 A 14 14 GLY N N 14 108.982 107.324 1.658 1
1 71 . 9 1 1 A 15 15 ILE H H 15 8.681 8.284 0.397 1
1 72 . 9 1 1 A 15 15 ILE CA C 15 64.996 64.851 0.145 1
1 73 . 9 1 1 A 15 15 ILE CB C 15 37.107 38.039 -0.932 1
1 74 . 9 1 1 A 15 15 ILE N N 15 121.601 122.483 -0.882 1
1 75 . 9 1 1 A 16 16 PHE H H 16 7.103 8.736 -1.633 1
1 76 . 9 1 1 A 16 16 PHE CA C 16 62.910 61.342 1.568 1
1 77 . 9 1 1 A 16 16 PHE CB C 16 38.782 38.857 -0.075 1
1 78 . 9 1 1 A 16 16 PHE N N 16 118.660 120.953 -2.293 1
1 79 . 9 1 1 A 17 17 HIS H H 17 7.591 8.384 -0.793 1
1 80 . 9 1 1 A 17 17 HIS HA H 17 4.793 4.173 0.620 1
1 82 . 9 1 1 A 17 17 HIS CA C 17 58.125 59.226 -1.101 1
1 83 . 9 1 1 A 17 17 HIS CB C 17 29.584 30.011 -0.427 1
1 84 . 9 1 1 A 17 17 HIS N N 17 114.968 118.528 -3.560 1
1 85 . 9 1 1 A 18 18 LYS H H 18 8.144 8.314 -0.170 1
1 86 . 9 1 1 A 18 18 LYS CA C 18 58.975 59.122 -0.147 1
1 87 . 9 1 1 A 18 18 LYS CB C 18 32.379 31.856 0.523 1
1 88 . 9 1 1 A 18 18 LYS N N 18 122.373 118.631 3.742 1
1 89 . 9 1 1 A 19 19 TYR H H 19 6.999 7.396 -0.397 1
1 90 . 9 1 1 A 19 19 TYR CA C 19 60.318 60.515 -0.197 1
1 91 . 9 1 1 A 19 19 TYR CB C 19 40.355 38.507 1.848 1
1 92 . 9 1 1 A 19 19 TYR N N 19 113.614 118.222 -4.608 1
1 93 . 9 1 1 A 20 20 SER H H 20 8.432 7.783 0.649 1
1 94 . 9 1 1 A 20 20 SER CA C 20 61.897 61.001 0.896 1
1 95 . 9 1 1 A 20 20 SER CB C 20 61.354 62.042 -0.688 1
1 96 . 9 1 1 A 20 20 SER N N 20 113.201 115.382 -2.181 1
1 97 . 9 1 1 A 21 21 GLY H H 21 7.678 8.055 -0.377 1
1 98 . 9 1 1 A 21 21 GLY HA2 H 21 4.195 3.837 0.358 1
1 99 . 9 1 1 A 21 21 GLY HA3 H 21 3.900 3.838 0.062 1
1 100 . 9 1 1 A 21 21 GLY CA C 21 45.628 46.345 -0.717 1
1 101 . 9 1 1 A 21 21 GLY N N 21 110.734 109.331 1.403 1
1 102 . 9 1 1 A 22 22 LYS H H 22 7.362 7.631 -0.269 1
1 103 . 9 1 1 A 22 22 LYS CA C 22 60.163 58.886 1.277 1
1 104 . 9 1 1 A 22 22 LYS CB C 22 32.554 32.156 0.398 1
1 105 . 9 1 1 A 22 22 LYS N N 22 122.161 120.332 1.829 1
1 106 . 9 1 1 A 23 23 GLU H H 23 9.639 7.508 2.131 1
1 107 . 9 1 1 A 23 23 GLU CA C 23 54.449 56.214 -1.765 1
1 108 . 9 1 1 A 23 23 GLU N N 23 116.288 115.540 0.748 1
1 109 . 9 1 1 A 24 24 GLY HA2 H 24 3.912 3.898 0.014 1
1 110 . 9 1 1 A 24 24 GLY HA3 H 24 3.787 3.910 -0.123 1
1 111 . 9 1 1 A 24 24 GLY CA C 24 45.898 45.398 0.500 1
1 112 . 9 1 1 A 25 25 ASP H H 25 8.204 8.150 0.054 1
1 113 . 9 1 1 A 25 25 ASP CA C 25 55.252 54.109 1.143 1
1 114 . 9 1 1 A 25 25 ASP N N 25 125.671 120.373 5.298 1
1 115 . 9 1 1 A 26 26 LYS CA C 26 57.851 58.450 -0.599 1
1 116 . 9 1 1 A 26 26 LYS CB C 26 31.265 33.054 -1.789 1
1 117 . 9 1 1 A 27 27 HIS H H 27 9.763 7.740 2.023 1
1 118 . 9 1 1 A 27 27 HIS CA C 27 55.580 55.361 0.219 1
1 119 . 9 1 1 A 27 27 HIS CB C 27 30.936 31.363 -0.427 1
1 120 . 9 1 1 A 27 27 HIS N N 27 118.108 111.352 6.756 1
1 121 . 9 1 1 A 28 28 THR H H 28 7.325 7.886 -0.561 1
1 126 . 9 1 1 A 28 28 THR CA C 28 60.128 60.417 -0.289 1
1 127 . 9 1 1 A 28 28 THR CB C 28 72.268 72.403 -0.135 1
1 128 . 9 1 1 A 28 28 THR N N 28 106.920 114.276 -7.356 1
1 129 . 9 1 1 A 29 29 LEU H H 29 9.422 9.360 0.062 1
1 130 . 9 1 1 A 29 29 LEU HA H 29 5.368 5.118 0.250 1
1 140 . 9 1 1 A 29 29 LEU CA C 29 52.567 53.493 -0.926 1
1 141 . 9 1 1 A 29 29 LEU CB C 29 43.523 45.050 -1.527 1
1 142 . 9 1 1 A 29 29 LEU N N 29 125.021 125.422 -0.401 1
1 143 . 9 1 1 A 30 30 SER H H 30 10.485 8.798 1.687 1
1 144 . 9 1 1 A 30 30 SER CA C 30 56.653 56.994 -0.341 1
1 145 . 9 1 1 A 30 30 SER CB C 30 65.313 65.584 -0.271 1
1 146 . 9 1 1 A 30 30 SER N N 30 124.758 117.901 6.857 1
1 147 . 9 1 1 A 31 31 LYS H H 31 8.728 8.500 0.228 1
1 148 . 9 1 1 A 31 31 LYS CA C 31 59.669 60.291 -0.622 1
1 149 . 9 1 1 A 31 31 LYS CB C 31 31.763 32.096 -0.333 1
1 150 . 9 1 1 A 31 31 LYS N N 31 119.459 121.189 -1.730 1
1 151 . 9 1 1 A 32 32 LYS H H 32 7.857 7.928 -0.071 1
1 152 . 9 1 1 A 32 32 LYS CA C 32 59.721 59.355 0.366 1
1 153 . 9 1 1 A 32 32 LYS CB C 32 32.901 31.933 0.968 1
1 154 . 9 1 1 A 32 32 LYS N N 32 117.933 119.309 -1.376 1
1 155 . 9 1 1 A 33 33 GLU H H 33 7.559 7.646 -0.087 1
1 156 . 9 1 1 A 33 33 GLU CA C 33 59.169 58.925 0.244 1
1 157 . 9 1 1 A 33 33 GLU CB C 33 31.014 29.298 1.716 1
1 158 . 9 1 1 A 33 33 GLU N N 33 120.407 119.041 1.366 1
1 159 . 9 1 1 A 34 34 LEU H H 34 8.833 8.155 0.678 1
1 160 . 9 1 1 A 34 34 LEU CA C 34 56.928 57.745 -0.817 1
1 161 . 9 1 1 A 34 34 LEU CB C 34 41.435 41.339 0.096 1
1 162 . 9 1 1 A 34 34 LEU N N 34 117.677 120.964 -3.287 1
1 163 . 9 1 1 A 35 35 LYS H H 35 8.010 7.997 0.013 1
1 164 . 9 1 1 A 35 35 LYS CA C 35 60.692 59.503 1.189 1
1 165 . 9 1 1 A 35 35 LYS CB C 35 32.223 32.075 0.148 1
1 166 . 9 1 1 A 35 35 LYS N N 35 119.829 118.887 0.942 1
1 167 . 9 1 1 A 36 36 GLU H H 36 7.169 8.222 -1.053 1
1 168 . 9 1 1 A 36 36 GLU CA C 36 59.588 58.914 0.674 1
1 169 . 9 1 1 A 36 36 GLU CB C 36 29.342 29.399 -0.057 1
1 170 . 9 1 1 A 36 36 GLU N N 36 117.340 119.574 -2.234 1
1 171 . 9 1 1 A 37 37 LEU H H 37 7.478 7.889 -0.411 1
1 172 . 9 1 1 A 37 37 LEU CA C 37 59.674 57.510 2.164 1
1 173 . 9 1 1 A 37 37 LEU CB C 37 42.142 41.033 1.109 1
1 174 . 9 1 1 A 37 37 LEU N N 37 120.884 121.502 -0.618 1
1 175 . 9 1 1 A 38 38 ILE H H 38 8.377 8.149 0.228 1
1 176 . 9 1 1 A 38 38 ILE CA C 38 65.651 65.492 0.159 1
1 177 . 9 1 1 A 38 38 ILE N N 38 118.450 119.740 -1.290 1
1 178 . 9 1 1 A 39 39 GLN H H 39 8.217 8.149 0.068 1
1 179 . 9 1 1 A 39 39 GLN CA C 39 59.788 58.792 0.996 1
1 180 . 9 1 1 A 39 39 GLN CB C 39 29.278 28.161 1.117 1
1 181 . 9 1 1 A 39 39 GLN N N 39 113.091 118.023 -4.932 1
1 182 . 9 1 1 A 40 40 LYS H H 40 8.426 8.090 0.336 1
1 183 . 9 1 1 A 40 40 LYS CA C 40 57.807 58.934 -1.127 1
1 184 . 9 1 1 A 40 40 LYS CB C 40 33.942 33.169 0.773 1
1 185 . 9 1 1 A 40 40 LYS N N 40 114.771 119.773 -5.002 1
1 186 . 9 1 1 A 41 41 GLU H H 41 8.496 8.257 0.239 1
1 187 . 9 1 1 A 41 41 GLU CA C 41 55.395 58.714 -3.319 1
1 188 . 9 1 1 A 41 41 GLU CB C 41 29.260 30.003 -0.743 1
1 189 . 9 1 1 A 41 41 GLU N N 41 112.546 119.323 -6.777 1
1 190 . 9 1 1 A 42 42 LEU H H 42 7.267 7.793 -0.526 1
1 191 . 9 1 1 A 42 42 LEU CA C 42 53.776 55.764 -1.988 1
1 192 . 9 1 1 A 42 42 LEU N N 42 118.657 118.626 0.031 1
1 193 . 9 1 1 A 44 44 ILE CA C 44 62.210 61.704 0.506 1
1 194 . 9 1 1 A 44 44 ILE CB C 44 38.247 37.939 0.308 1
1 195 . 9 1 1 A 45 45 GLY H H 45 7.820 7.968 -0.148 1
1 196 . 9 1 1 A 45 45 GLY CA C 45 47.742 44.741 3.001 1
1 197 . 9 1 1 A 45 45 GLY N N 45 108.178 112.036 -3.858 1
1 198 . 9 1 1 A 46 46 SER H H 46 7.895 8.720 -0.825 1
1 199 . 9 1 1 A 46 46 SER CA C 46 59.958 58.251 1.707 1
1 200 . 9 1 1 A 46 46 SER CB C 46 63.450 63.163 0.287 1
1 201 . 9 1 1 A 46 46 SER N N 46 113.038 115.100 -2.062 1
1 202 . 9 1 1 A 47 47 LYS H H 47 7.736 7.353 0.383 1
1 203 . 9 1 1 A 47 47 LYS CA C 47 55.636 55.425 0.211 1
1 204 . 9 1 1 A 47 47 LYS CB C 47 33.103 33.096 0.007 1
1 205 . 9 1 1 A 47 47 LYS N N 47 119.422 118.937 0.485 1
1 206 . 9 1 1 A 48 48 LEU H H 48 6.988 8.919 -1.931 1
1 207 . 9 1 1 A 48 48 LEU HA H 48 4.497 3.918 0.579 1
1 217 . 9 1 1 A 48 48 LEU CA C 48 54.517 57.744 -3.227 1
1 218 . 9 1 1 A 48 48 LEU CB C 48 42.987 41.225 1.762 1
1 219 . 9 1 1 A 48 48 LEU N N 48 118.908 120.335 -1.427 1
1 220 . 9 1 1 A 49 49 GLN H H 49 9.206 8.354 0.852 1
1 221 . 9 1 1 A 49 49 GLN HA H 49 4.486 4.095 0.391 1
1 223 . 9 1 1 A 49 49 GLN CA C 49 54.785 58.416 -3.631 1
1 224 . 9 1 1 A 49 49 GLN CB C 49 29.636 28.966 0.670 1
1 225 . 9 1 1 A 49 49 GLN N N 49 121.275 119.827 1.448 1
1 226 . 9 1 1 A 50 50 ASP H H 50 8.854 8.564 0.290 1
1 227 . 9 1 1 A 50 50 ASP CA C 50 59.078 57.258 1.820 1
1 228 . 9 1 1 A 50 50 ASP CB C 50 40.632 41.518 -0.886 1
1 229 . 9 1 1 A 50 50 ASP N N 50 123.430 119.351 4.079 1
1 230 . 9 1 1 A 51 51 ALA H H 51 8.720 7.903 0.817 1
1 231 . 9 1 1 A 51 51 ALA CA C 51 55.281 54.845 0.436 1
1 232 . 9 1 1 A 51 51 ALA CB C 51 18.205 18.234 -0.029 1
1 233 . 9 1 1 A 51 51 ALA N N 51 117.829 121.211 -3.382 1
1 234 . 9 1 1 A 52 52 GLU H H 52 7.161 7.819 -0.658 1
1 235 . 9 1 1 A 52 52 GLU CA C 52 58.757 59.049 -0.292 1
1 236 . 9 1 1 A 52 52 GLU CB C 52 30.247 29.654 0.593 1
1 237 . 9 1 1 A 52 52 GLU N N 52 115.459 117.226 -1.767 1
1 238 . 9 1 1 A 53 53 ILE H H 53 7.962 7.798 0.164 1
1 239 . 9 1 1 A 53 53 ILE CA C 53 65.525 65.169 0.356 1
1 240 . 9 1 1 A 53 53 ILE CB C 53 37.289 37.937 -0.648 1
1 241 . 9 1 1 A 53 53 ILE N N 53 120.414 121.252 -0.838 1
1 242 . 9 1 1 A 54 54 VAL H H 54 8.132 8.181 -0.049 1
1 243 . 9 1 1 A 54 54 VAL CA C 54 67.290 65.673 1.617 1
1 244 . 9 1 1 A 54 54 VAL CB C 54 31.434 31.356 0.078 1
1 245 . 9 1 1 A 54 54 VAL N N 54 119.775 117.167 2.608 1
1 246 . 9 1 1 A 55 55 LYS H H 55 7.155 7.992 -0.837 1
1 247 . 9 1 1 A 55 55 LYS CA C 55 59.131 59.222 -0.091 1
1 248 . 9 1 1 A 55 55 LYS CB C 55 32.131 31.874 0.257 1
1 249 . 9 1 1 A 55 55 LYS N N 55 119.175 121.042 -1.867 1
1 250 . 9 1 1 A 56 56 LEU H H 56 7.837 8.289 -0.452 1
1 251 . 9 1 1 A 56 56 LEU CA C 56 58.052 58.053 -0.001 1
1 252 . 9 1 1 A 56 56 LEU CB C 56 41.878 41.592 0.286 1
1 253 . 9 1 1 A 56 56 LEU N N 56 119.679 121.137 -1.458 1
1 254 . 9 1 1 A 57 57 MET H H 57 8.385 8.658 -0.273 1
1 255 . 9 1 1 A 57 57 MET CA C 57 60.756 58.495 2.261 1
1 256 . 9 1 1 A 57 57 MET CB C 57 33.152 31.877 1.275 1
1 257 . 9 1 1 A 57 57 MET N N 57 115.116 119.212 -4.096 1
1 258 . 9 1 1 A 58 58 ASP H H 58 7.591 8.215 -0.624 1
1 259 . 9 1 1 A 58 58 ASP CA C 58 57.365 56.843 0.522 1
1 260 . 9 1 1 A 58 58 ASP CB C 58 40.858 40.619 0.239 1
1 261 . 9 1 1 A 58 58 ASP N N 58 118.197 119.160 -0.963 1
1 262 . 9 1 1 A 59 59 ASP H H 59 7.725 8.026 -0.301 1
1 263 . 9 1 1 A 59 59 ASP CA C 59 56.830 56.963 -0.133 1
1 264 . 9 1 1 A 59 59 ASP CB C 59 40.567 40.819 -0.252 1
1 265 . 9 1 1 A 59 59 ASP N N 59 118.481 118.203 0.278 1
1 266 . 9 1 1 A 60 60 LEU H H 60 7.703 7.679 0.024 1
1 267 . 9 1 1 A 60 60 LEU CA C 60 56.564 57.585 -1.021 1
1 268 . 9 1 1 A 60 60 LEU CB C 60 42.714 41.294 1.420 1
1 269 . 9 1 1 A 60 60 LEU N N 60 116.935 120.598 -3.663 1
1 270 . 9 1 1 A 61 61 ASP H H 61 7.143 8.158 -1.015 1
1 271 . 9 1 1 A 61 61 ASP HA H 61 4.690 4.435 0.255 1
1 274 . 9 1 1 A 61 61 ASP CA C 61 52.286 56.630 -4.344 1
1 275 . 9 1 1 A 61 61 ASP CB C 61 39.245 41.526 -2.281 1
1 276 . 9 1 1 A 61 61 ASP N N 61 116.605 118.829 -2.224 1
1 277 . 9 1 1 A 62 62 ARG H H 62 7.786 7.555 0.231 1
1 278 . 9 1 1 A 62 62 ARG CA C 62 58.328 58.707 -0.379 1
1 279 . 9 1 1 A 62 62 ARG CB C 62 30.106 29.855 0.251 1
1 280 . 9 1 1 A 62 62 ARG N N 62 125.967 118.706 7.261 1
1 281 . 9 1 1 A 63 63 ASN H H 63 7.945 7.892 0.053 1
1 282 . 9 1 1 A 63 63 ASN CA C 63 51.863 55.147 -3.284 1
1 283 . 9 1 1 A 63 63 ASN CB C 63 36.809 39.795 -2.986 1
1 284 . 9 1 1 A 63 63 ASN N N 63 112.434 115.159 -2.725 1
1 285 . 9 1 1 A 64 64 LYS H H 64 7.477 7.560 -0.083 1
1 286 . 9 1 1 A 64 64 LYS CA C 64 56.524 55.923 0.601 1
1 287 . 9 1 1 A 64 64 LYS N N 64 114.197 118.663 -4.466 1
1 288 . 9 1 1 A 65 65 ASP H H 65 8.345 8.698 -0.353 1
1 289 . 9 1 1 A 65 65 ASP CA C 65 52.969 55.614 -2.645 1
1 290 . 9 1 1 A 65 65 ASP CB C 65 40.329 40.670 -0.341 1
1 291 . 9 1 1 A 65 65 ASP N N 65 118.581 126.389 -7.808 1
1 292 . 9 1 1 A 66 66 GLN H H 66 9.945 9.182 0.763 1
1 293 . 9 1 1 A 66 66 GLN CA C 66 58.132 57.682 0.450 1
1 294 . 9 1 1 A 66 66 GLN CB C 66 26.035 28.606 -2.571 1
1 295 . 9 1 1 A 66 66 GLN N N 66 113.203 125.211 -12.008 1
1 296 . 9 1 1 A 67 67 GLU H H 67 7.880 8.077 -0.197 1
1 297 . 9 1 1 A 67 67 GLU HA H 67 4.910 4.969 -0.059 1
1 302 . 9 1 1 A 67 67 GLU CA C 67 54.082 55.311 -1.229 1
1 303 . 9 1 1 A 67 67 GLU CB C 67 33.174 32.685 0.489 1
1 304 . 9 1 1 A 67 67 GLU N N 67 118.554 117.446 1.108 1
1 305 . 9 1 1 A 68 68 VAL H H 68 9.669 9.234 0.435 1
1 306 . 9 1 1 A 68 68 VAL HA H 68 5.465 4.900 0.565 1
1 314 . 9 1 1 A 68 68 VAL CA C 68 61.079 60.947 0.132 1
1 315 . 9 1 1 A 68 68 VAL CB C 68 33.280 33.454 -0.174 1
1 316 . 9 1 1 A 68 68 VAL N N 68 126.572 119.880 6.692 1
1 317 . 9 1 1 A 69 69 ASN H H 69 8.985 8.717 0.268 1
1 318 . 9 1 1 A 69 69 ASN CA C 69 50.812 53.502 -2.690 1
1 319 . 9 1 1 A 69 69 ASN CB C 69 38.609 40.418 -1.809 1
1 320 . 9 1 1 A 69 69 ASN N N 69 127.472 125.402 2.070 1
1 321 . 9 1 1 A 70 70 PHE H H 70 9.100 9.323 -0.223 1
1 322 . 9 1 1 A 70 70 PHE CA C 70 63.279 61.725 1.554 1
1 323 . 9 1 1 A 70 70 PHE CB C 70 38.741 39.363 -0.622 1
1 324 . 9 1 1 A 70 70 PHE N N 70 119.972 127.126 -7.154 1
1 325 . 9 1 1 A 71 71 GLN H H 71 8.342 8.200 0.142 1
1 326 . 9 1 1 A 71 71 GLN HA H 71 3.923 3.693 0.230 1
1 329 . 9 1 1 A 71 71 GLN CA C 71 59.866 58.405 1.461 1
1 330 . 9 1 1 A 71 71 GLN CB C 71 27.878 28.307 -0.429 1
1 331 . 9 1 1 A 71 71 GLN N N 71 118.216 117.518 0.698 1
1 332 . 9 1 1 A 72 72 GLU H H 72 8.721 7.879 0.842 1
1 333 . 9 1 1 A 72 72 GLU HA H 72 4.147 4.072 0.075 1
1 338 . 9 1 1 A 72 72 GLU CA C 72 59.313 58.883 0.430 1
1 339 . 9 1 1 A 72 72 GLU CB C 72 30.233 29.432 0.801 1
1 340 . 9 1 1 A 72 72 GLU N N 72 121.455 119.600 1.855 1
1 341 . 9 1 1 A 73 73 TYR H H 73 8.536 7.961 0.575 1
1 342 . 9 1 1 A 73 73 TYR CA C 73 60.961 61.398 -0.437 1
1 343 . 9 1 1 A 73 73 TYR CB C 73 38.724 38.887 -0.163 1
1 344 . 9 1 1 A 73 73 TYR N N 73 123.356 122.361 0.995 1
1 345 . 9 1 1 A 74 74 ILE H H 74 8.642 8.177 0.465 1
1 346 . 9 1 1 A 74 74 ILE CA C 74 61.880 64.464 -2.584 1
1 347 . 9 1 1 A 74 74 ILE CB C 74 36.077 37.548 -1.471 1
1 348 . 9 1 1 A 74 74 ILE N N 74 119.799 120.565 -0.766 1
1 349 . 9 1 1 A 75 75 THR H H 75 7.959 8.186 -0.227 1
1 354 . 9 1 1 A 75 75 THR CA C 75 67.056 66.726 0.330 1
1 355 . 9 1 1 A 75 75 THR CB C 75 68.386 68.617 -0.231 1
1 356 . 9 1 1 A 75 75 THR N N 75 119.486 117.885 1.601 1
1 357 . 9 1 1 A 76 76 PHE H H 76 7.450 8.195 -0.745 1
1 358 . 9 1 1 A 76 76 PHE CA C 76 59.010 61.263 -2.253 1
1 359 . 9 1 1 A 76 76 PHE CB C 76 38.139 39.200 -1.061 1
1 360 . 9 1 1 A 76 76 PHE N N 76 122.873 122.061 0.812 1
1 361 . 9 1 1 A 77 77 LEU H H 77 7.829 8.158 -0.329 1
1 362 . 9 1 1 A 77 77 LEU CA C 77 57.450 57.637 -0.187 1
1 363 . 9 1 1 A 77 77 LEU CB C 77 40.560 41.364 -0.804 1
1 364 . 9 1 1 A 77 77 LEU N N 77 117.405 118.532 -1.127 1
1 365 . 9 1 1 A 78 78 GLY H H 78 8.093 8.410 -0.317 1
1 366 . 9 1 1 A 78 78 GLY HA2 H 78 3.661 3.719 -0.058 1
1 367 . 9 1 1 A 78 78 GLY HA3 H 78 3.594 3.725 -0.131 1
1 368 . 9 1 1 A 78 78 GLY CA C 78 47.442 47.127 0.315 1
1 369 . 9 1 1 A 78 78 GLY N N 78 105.528 106.299 -0.771 1
1 370 . 9 1 1 A 79 79 ALA H H 79 7.759 7.815 -0.056 1
1 371 . 9 1 1 A 79 79 ALA CA C 79 55.153 54.700 0.453 1
1 372 . 9 1 1 A 79 79 ALA CB C 79 17.768 18.940 -1.172 1
1 373 . 9 1 1 A 79 79 ALA N N 79 124.488 125.154 -0.666 1
1 374 . 9 1 1 A 80 80 LEU H H 80 7.963 7.930 0.033 1
1 375 . 9 1 1 A 80 80 LEU CA C 80 57.464 57.467 -0.003 1
1 376 . 9 1 1 A 80 80 LEU CB C 80 41.496 41.168 0.328 1
1 377 . 9 1 1 A 80 80 LEU N N 80 117.869 118.762 -0.893 1
1 378 . 9 1 1 A 81 81 ALA H H 81 8.365 8.265 0.100 1
1 379 . 9 1 1 A 81 81 ALA CA C 81 55.475 55.064 0.411 1
1 380 . 9 1 1 A 81 81 ALA CB C 81 17.483 17.765 -0.282 1
1 381 . 9 1 1 A 81 81 ALA N N 81 119.054 121.042 -1.988 1
1 382 . 9 1 1 A 82 82 MET H H 82 8.112 7.939 0.173 1
1 383 . 9 1 1 A 82 82 MET CA C 82 59.516 57.938 1.578 1
1 384 . 9 1 1 A 82 82 MET CB C 82 32.550 32.094 0.456 1
1 385 . 9 1 1 A 82 82 MET N N 82 115.364 117.991 -2.627 1
1 386 . 9 1 1 A 83 83 ILE H H 83 7.981 8.009 -0.028 1
1 387 . 9 1 1 A 83 83 ILE HA H 83 3.839 3.595 0.244 1
1 391 . 9 1 1 A 83 83 ILE CA C 83 64.467 65.167 -0.700 1
1 392 . 9 1 1 A 83 83 ILE CB C 83 37.312 37.489 -0.177 1
1 393 . 9 1 1 A 83 83 ILE N N 83 120.887 119.479 1.408 1
1 394 . 9 1 1 A 84 84 TYR H H 84 8.731 7.823 0.908 1
1 395 . 9 1 1 A 84 84 TYR N N 84 120.933 118.886 2.047 1
1 396 . 9 1 1 A 87 87 ALA H H 87 7.829 8.186 -0.357 1
1 397 . 9 1 1 A 87 87 ALA CA C 87 53.768 54.381 -0.613 1
1 398 . 9 1 1 A 87 87 ALA CB C 87 18.504 18.356 0.148 1
1 399 . 9 1 1 A 87 87 ALA N N 87 120.274 122.545 -2.271 1
1 400 . 9 1 1 A 88 88 LEU H H 88 7.499 8.067 -0.568 1
1 401 . 9 1 1 A 88 88 LEU CA C 88 55.605 57.379 -1.774 1
1 402 . 9 1 1 A 88 88 LEU CB C 88 42.047 41.498 0.549 1
1 403 . 9 1 1 A 88 88 LEU N N 88 117.356 119.914 -2.558 1
1 404 . 9 1 1 A 89 89 LYS H H 89 7.561 7.915 -0.354 1
1 405 . 9 1 1 A 89 89 LYS CA C 89 56.865 58.709 -1.844 1
1 406 . 9 1 1 A 89 89 LYS CB C 89 32.592 32.894 -0.302 1
1 407 . 9 1 1 A 89 89 LYS N N 89 119.289 119.871 -0.582 1
1 416 . 9 3 2 C 6 6 GLU H H 190 8.385 8.928 -0.543 1
1 417 . 9 3 2 C 6 6 GLU HA H 190 4.153 4.235 -0.082 1
1 422 . 9 3 2 C 6 6 GLU C C 190 175.031 177.296 -2.265 1
1 423 . 9 3 2 C 6 6 GLU CA C 190 58.866 56.498 2.368 1
1 424 . 9 3 2 C 6 6 GLU CB C 190 30.751 30.056 0.695 1
1 426 . 9 3 2 C 6 6 GLU N N 190 122.715 117.249 5.466 1
1 427 . 9 3 2 C 7 7 GLY H H 191 8.475 7.689 0.786 1
1 428 . 9 3 2 C 7 7 GLY HA2 H 191 3.887 3.961 -0.074 1
1 429 . 9 3 2 C 7 7 GLY HA3 H 191 3.887 3.963 -0.076 1
1 430 . 9 3 2 C 7 7 GLY C C 191 177.922 175.324 2.598 1
1 431 . 9 3 2 C 7 7 GLY CA C 191 46.884 46.709 0.175 1
1 432 . 9 3 2 C 7 7 GLY N N 191 109.009 108.209 0.800 1
1 433 . 9 3 2 C 8 8 LEU HA H 192 4.095 3.934 0.161 1
1 443 . 9 3 2 C 8 8 LEU CA C 192 58.154 58.135 0.019 1
1 444 . 9 3 2 C 8 8 LEU CB C 192 42.789 41.500 1.289 1
1 448 . 9 3 2 C 9 9 MET H H 193 8.250 8.218 0.032 1
1 449 . 9 3 2 C 9 9 MET HA H 193 4.150 4.061 0.089 1
1 457 . 9 3 2 C 9 9 MET C C 193 178.421 178.393 0.028 1
1 458 . 9 3 2 C 9 9 MET CA C 193 58.818 58.817 0.001 1
1 459 . 9 3 2 C 9 9 MET CB C 193 32.360 32.280 0.080 1
1 462 . 9 3 2 C 9 9 MET N N 193 117.049 118.922 -1.873 1
1 463 . 9 3 2 C 10 10 ASN H H 194 7.892 8.253 -0.361 1
1 464 . 9 3 2 C 10 10 ASN HA H 194 4.468 4.504 -0.036 1
1 469 . 9 3 2 C 10 10 ASN C C 194 178.099 176.457 1.642 1
1 470 . 9 3 2 C 10 10 ASN CA C 194 56.644 55.406 1.238 1
1 471 . 9 3 2 C 10 10 ASN CB C 194 39.100 38.644 0.456 1
1 472 . 9 3 2 C 10 10 ASN N N 194 117.034 118.725 -1.691 1
1 474 . 9 3 2 C 11 11 VAL H H 195 7.651 7.995 -0.344 1
1 475 . 9 3 2 C 11 11 VAL HA H 195 3.735 3.874 -0.139 1
1 483 . 9 3 2 C 11 11 VAL C C 195 177.657 178.143 -0.486 1
1 484 . 9 3 2 C 11 11 VAL CA C 195 66.710 65.101 1.609 1
1 485 . 9 3 2 C 11 11 VAL CB C 195 32.468 31.971 0.497 1
1 488 . 9 3 2 C 11 11 VAL N N 195 119.878 117.985 1.893 1
1 489 . 9 3 2 C 12 12 LEU H H 196 8.030 7.984 0.046 1
1 490 . 9 3 2 C 12 12 LEU HA H 196 4.013 3.958 0.055 1
1 500 . 9 3 2 C 12 12 LEU C C 196 177.540 179.496 -1.956 1
1 501 . 9 3 2 C 12 12 LEU CA C 196 58.489 57.746 0.743 1
1 502 . 9 3 2 C 12 12 LEU CB C 196 42.457 41.243 1.214 1
1 506 . 9 3 2 C 12 12 LEU N N 196 119.499 120.425 -0.926 1
1 507 . 9 3 2 C 13 13 LYS H H 197 8.015 8.300 -0.285 1
1 508 . 9 3 2 C 13 13 LYS HA H 197 3.949 4.060 -0.111 1
1 517 . 9 3 2 C 13 13 LYS C C 197 178.419 179.085 -0.666 1
1 518 . 9 3 2 C 13 13 LYS CA C 197 60.191 59.691 0.500 1
1 519 . 9 3 2 C 13 13 LYS CB C 197 33.075 32.276 0.799 1
1 523 . 9 3 2 C 13 13 LYS N N 197 117.888 120.842 -2.954 1
1 524 . 9 3 2 C 14 14 LYS H H 198 7.506 7.474 0.032 1
1 525 . 9 3 2 C 14 14 LYS HA H 198 4.127 4.108 0.019 1
1 534 . 9 3 2 C 14 14 LYS C C 198 178.262 178.269 -0.007 1
1 535 . 9 3 2 C 14 14 LYS CA C 198 59.161 58.211 0.950 1
1 536 . 9 3 2 C 14 14 LYS CB C 198 32.956 32.224 0.732 1
1 540 . 9 3 2 C 14 14 LYS N N 198 118.321 117.926 0.395 1
1 541 . 9 3 2 C 15 15 ILE H H 199 7.780 7.359 0.421 1
1 542 . 9 3 2 C 15 15 ILE HA H 199 3.787 3.950 -0.163 1
1 552 . 9 3 2 C 15 15 ILE C C 199 178.647 177.874 0.773 1
1 553 . 9 3 2 C 15 15 ILE CA C 199 64.912 63.309 1.603 1
1 554 . 9 3 2 C 15 15 ILE CB C 199 38.780 37.952 0.828 1
1 558 . 9 3 2 C 15 15 ILE N N 199 118.644 118.064 0.580 1
1 559 . 9 3 2 C 16 16 TYR H H 200 7.918 8.316 -0.398 1
1 560 . 9 3 2 C 16 16 TYR HA H 200 4.252 3.982 0.270 1
1 567 . 9 3 2 C 16 16 TYR C C 200 177.806 177.946 -0.140 1
1 568 . 9 3 2 C 16 16 TYR CA C 200 61.171 62.060 -0.889 1
1 569 . 9 3 2 C 16 16 TYR CB C 200 39.245 38.990 0.255 1
1 573 . 9 3 2 C 16 16 TYR N N 200 118.683 122.253 -3.570 1
1 574 . 9 3 2 C 17 17 GLU H H 201 8.089 8.614 -0.525 1
1 575 . 9 3 2 C 17 17 GLU HA H 201 4.124 3.944 0.180 1
1 580 . 9 3 2 C 17 17 GLU C C 201 177.414 177.187 0.227 1
1 581 . 9 3 2 C 17 17 GLU CA C 201 58.784 57.547 1.237 1
1 582 . 9 3 2 C 17 17 GLU CB C 201 30.747 28.952 1.795 1
1 584 . 9 3 2 C 17 17 GLU N N 201 119.409 117.137 2.272 1
1 585 . 9 3 2 C 18 18 ASP H H 202 8.023 8.332 -0.309 1
1 586 . 9 3 2 C 18 18 ASP HA H 202 4.657 4.868 -0.211 1
1 589 . 9 3 2 C 18 18 ASP C C 202 177.346 175.444 1.902 1
1 590 . 9 3 2 C 18 18 ASP CA C 202 55.496 54.993 0.503 1
1 591 . 9 3 2 C 18 18 ASP CB C 202 42.023 43.055 -1.032 1
1 592 . 9 3 2 C 18 18 ASP N N 202 119.459 119.392 0.067 1
1 593 . 9 3 2 C 19 19 GLY H H 203 7.933 8.139 -0.206 1
1 594 . 9 3 2 C 19 19 GLY HA2 H 203 3.938 4.201 -0.263 1
1 595 . 9 3 2 C 19 19 GLY HA3 H 203 3.938 4.214 -0.276 1
1 596 . 9 3 2 C 19 19 GLY C C 203 177.240 172.068 5.172 1
1 597 . 9 3 2 C 19 19 GLY CA C 203 46.309 44.577 1.732 1
1 598 . 9 3 2 C 19 19 GLY N N 203 108.518 106.902 1.616 1
1 599 . 9 3 2 C 20 20 ASP H H 204 8.091 8.682 -0.591 1
1 600 . 9 3 2 C 20 20 ASP HA H 204 4.616 5.349 -0.733 1
1 603 . 9 3 2 C 20 20 ASP C C 204 173.979 174.177 -0.198 1
1 604 . 9 3 2 C 20 20 ASP CA C 204 55.064 54.205 0.859 1
1 605 . 9 3 2 C 20 20 ASP CB C 204 42.203 43.690 -1.487 1
1 606 . 9 3 2 C 20 20 ASP N N 204 120.172 121.883 -1.711 1
1 607 . 9 3 2 C 21 21 ASP H H 205 8.352 8.591 -0.239 1
1 608 . 9 3 2 C 21 21 ASP HA H 205 4.468 4.753 -0.285 1
1 611 . 9 3 2 C 21 21 ASP C C 205 176.432 176.533 -0.101 1
1 612 . 9 3 2 C 21 21 ASP CA C 205 56.663 55.853 0.810 1
1 613 . 9 3 2 C 21 21 ASP CB C 205 41.918 42.371 -0.453 1
1 614 . 9 3 2 C 21 21 ASP N N 205 121.515 123.197 -1.682 1
1 615 . 9 3 2 C 22 22 ASP H H 206 8.239 8.776 -0.537 1
1 616 . 9 3 2 C 22 22 ASP HA H 206 4.455 4.561 -0.106 1
1 619 . 9 3 2 C 22 22 ASP C C 206 177.449 179.316 -1.867 1
1 620 . 9 3 2 C 22 22 ASP CA C 206 57.165 56.773 0.392 1
1 621 . 9 3 2 C 22 22 ASP CB C 206 41.820 40.010 1.810 1
1 622 . 9 3 2 C 22 22 ASP N N 206 120.156 121.179 -1.023 1
1 623 . 9 3 2 C 23 23 MET H H 207 8.300 8.135 0.165 1
1 624 . 9 3 2 C 23 23 MET HA H 207 4.255 4.127 0.128 1
1 632 . 9 3 2 C 23 23 MET C C 207 178.412 178.877 -0.465 1
1 633 . 9 3 2 C 23 23 MET CA C 207 58.065 58.800 -0.735 1
1 634 . 9 3 2 C 23 23 MET CB C 207 32.488 32.803 -0.315 1
1 637 . 9 3 2 C 23 23 MET N N 207 120.707 119.374 1.333 1
1 638 . 9 3 2 C 24 24 LYS H H 208 8.047 8.162 -0.115 1
1 639 . 9 3 2 C 24 24 LYS HA H 208 3.946 4.138 -0.192 1
1 648 . 9 3 2 C 24 24 LYS C C 208 178.008 178.771 -0.763 1
1 649 . 9 3 2 C 24 24 LYS CA C 208 59.847 58.967 0.880 1
1 650 . 9 3 2 C 24 24 LYS CB C 208 32.983 32.244 0.739 1
1 654 . 9 3 2 C 24 24 LYS N N 208 119.504 118.719 0.785 1
1 655 . 9 3 2 C 25 25 ARG H H 209 7.891 7.711 0.180 1
1 656 . 9 3 2 C 25 25 ARG HA H 209 4.168 4.225 -0.057 1
1 663 . 9 3 2 C 25 25 ARG C C 209 178.100 178.871 -0.771 1
1 664 . 9 3 2 C 25 25 ARG CA C 209 58.810 58.783 0.027 1
1 665 . 9 3 2 C 25 25 ARG CB C 209 31.080 30.822 0.258 1
1 668 . 9 3 2 C 25 25 ARG N N 209 118.378 119.032 -0.654 1
1 669 . 9 3 2 C 26 26 THR H H 210 7.869 8.496 -0.627 1
1 670 . 9 3 2 C 26 26 THR HA H 210 4.023 4.039 -0.016 1
1 675 . 9 3 2 C 26 26 THR C C 210 177.984 176.663 1.321 1
1 676 . 9 3 2 C 26 26 THR CA C 210 65.747 67.206 -1.459 1
1 677 . 9 3 2 C 26 26 THR CB C 210 69.683 68.410 1.273 1
1 679 . 9 3 2 C 26 26 THR N N 210 115.443 118.435 -2.992 1
1 680 . 9 3 2 C 27 27 ILE H H 211 7.901 8.172 -0.271 1
1 681 . 9 3 2 C 27 27 ILE HA H 211 4.142 3.891 0.251 1
1 691 . 9 3 2 C 27 27 ILE C C 211 175.595 178.293 -2.698 1
1 692 . 9 3 2 C 27 27 ILE CA C 211 63.528 64.826 -1.298 1
1 693 . 9 3 2 C 27 27 ILE CB C 211 38.982 37.482 1.500 1
1 697 . 9 3 2 C 27 27 ILE N N 211 121.265 121.017 0.248 1
1 698 . 9 3 2 C 28 28 ASN HA H 212 4.465 4.519 -0.054 1
1 703 . 9 3 2 C 28 28 ASN CA C 212 55.182 55.965 -0.783 1
1 704 . 9 3 2 C 28 28 ASN CB C 212 39.480 39.185 0.295 1
1 706 . 9 3 2 C 29 29 LYS H H 213 7.968 7.801 0.167 1
1 707 . 9 3 2 C 29 29 LYS HA H 213 4.072 4.214 -0.142 1
1 716 . 9 3 2 C 29 29 LYS C C 213 176.218 179.442 -3.224 1
1 717 . 9 3 2 C 29 29 LYS CA C 213 58.489 58.764 -0.275 1
1 718 . 9 3 2 C 29 29 LYS CB C 213 33.165 32.902 0.263 1
1 722 . 9 3 2 C 29 29 LYS N N 213 120.820 118.203 2.617 1
1 723 . 9 3 2 C 30 30 ALA H H 214 7.865 8.699 -0.834 1
1 724 . 9 3 2 C 30 30 ALA HA H 214 4.217 4.162 0.055 1
1 728 . 9 3 2 C 30 30 ALA C C 214 177.041 179.398 -2.357 1
1 729 . 9 3 2 C 30 30 ALA CA C 214 54.104 54.958 -0.854 1
1 730 . 9 3 2 C 30 30 ALA CB C 214 19.496 18.218 1.278 1
1 731 . 9 3 2 C 30 30 ALA N N 214 121.571 121.632 -0.061 1
1 732 . 9 3 2 C 31 31 TRP H H 215 7.831 7.560 0.271 1
1 733 . 9 3 2 C 31 31 TRP HA H 215 4.598 4.558 0.040 1
1 742 . 9 3 2 C 31 31 TRP C C 215 178.088 177.832 0.256 1
1 743 . 9 3 2 C 31 31 TRP CA C 215 58.432 59.388 -0.956 1
1 744 . 9 3 2 C 31 31 TRP CB C 215 30.472 29.306 1.166 1
1 750 . 9 3 2 C 31 31 TRP N N 215 118.141 116.984 1.157 1
1 752 . 9 3 2 C 32 32 VAL H H 216 7.594 8.020 -0.426 1
1 753 . 9 3 2 C 32 32 VAL HA H 216 3.978 3.920 0.058 1
1 761 . 9 3 2 C 32 32 VAL C C 216 176.574 178.621 -2.047 1
1 762 . 9 3 2 C 32 32 VAL CA C 216 63.329 65.489 -2.160 1
1 763 . 9 3 2 C 32 32 VAL CB C 216 33.373 32.010 1.363 1
1 766 . 9 3 2 C 32 32 VAL N N 216 118.287 120.630 -2.343 1
1 767 . 9 3 2 C 33 33 GLU H H 217 8.012 8.449 -0.437 1
1 768 . 9 3 2 C 33 33 GLU HA H 217 4.257 4.287 -0.030 1
1 773 . 9 3 2 C 33 33 GLU C C 217 176.164 178.682 -2.518 1
1 774 . 9 3 2 C 33 33 GLU CA C 217 57.409 58.762 -1.353 1
1 775 . 9 3 2 C 33 33 GLU CB C 217 30.978 29.253 1.725 1
1 777 . 9 3 2 C 33 33 GLU N N 217 122.535 120.460 2.075 1
1 778 . 9 3 2 C 34 34 SER H H 218 8.037 7.989 0.048 1
1 779 . 9 3 2 C 34 34 SER HA H 218 4.514 4.252 0.262 1
1 782 . 9 3 2 C 34 34 SER C C 218 176.451 175.268 1.183 1
1 783 . 9 3 2 C 34 34 SER CA C 218 58.987 61.639 -2.652 1
1 784 . 9 3 2 C 34 34 SER CB C 218 64.569 63.046 1.523 1
1 785 . 9 3 2 C 34 34 SER N N 218 117.058 115.894 1.164 1
1 6 . 10 1 1 A 2 2 ALA H H 2 8.191 8.583 -0.392 1
1 7 . 10 1 1 A 2 2 ALA CA C 2 51.957 51.421 0.536 1
1 8 . 10 1 1 A 2 2 ALA CB C 2 19.580 20.204 -0.624 1
1 9 . 10 1 1 A 2 2 ALA N N 2 124.666 124.863 -0.197 1
1 10 . 10 1 1 A 3 3 SER H H 3 8.829 8.130 0.699 1
1 11 . 10 1 1 A 3 3 SER CA C 3 57.221 62.926 -5.705 1
1 12 . 10 1 1 A 3 3 SER N N 3 119.917 114.478 5.439 1
1 13 . 10 1 1 A 4 4 PRO CA C 4 66.688 65.281 1.407 1
1 14 . 10 1 1 A 4 4 PRO CB C 4 32.553 30.926 1.627 1
1 15 . 10 1 1 A 5 5 LEU H H 5 9.146 7.384 1.762 1
1 16 . 10 1 1 A 5 5 LEU CA C 5 59.017 56.984 2.033 1
1 17 . 10 1 1 A 5 5 LEU CB C 5 42.341 42.593 -0.252 1
1 18 . 10 1 1 A 5 5 LEU N N 5 117.902 117.506 0.396 1
1 19 . 10 1 1 A 6 6 ASP H H 6 7.572 8.751 -1.179 1
1 20 . 10 1 1 A 6 6 ASP CA C 6 57.997 57.568 0.429 1
1 21 . 10 1 1 A 6 6 ASP CB C 6 40.910 40.193 0.717 1
1 22 . 10 1 1 A 6 6 ASP N N 6 118.259 118.284 -0.025 1
1 23 . 10 1 1 A 7 7 GLN H H 7 8.660 8.441 0.219 1
1 24 . 10 1 1 A 7 7 GLN HA H 7 4.064 4.048 0.016 1
1 29 . 10 1 1 A 7 7 GLN CA C 7 59.270 58.490 0.780 1
1 30 . 10 1 1 A 7 7 GLN CB C 7 28.468 27.638 0.830 1
1 31 . 10 1 1 A 7 7 GLN N N 7 119.558 117.905 1.653 1
1 32 . 10 1 1 A 8 8 ALA H H 8 8.253 7.968 0.285 1
1 33 . 10 1 1 A 8 8 ALA CA C 8 55.519 54.754 0.765 1
1 34 . 10 1 1 A 8 8 ALA CB C 8 18.113 18.724 -0.611 1
1 35 . 10 1 1 A 8 8 ALA N N 8 123.628 121.898 1.730 1
1 36 . 10 1 1 A 9 9 ILE H H 9 8.134 8.209 -0.075 1
1 37 . 10 1 1 A 9 9 ILE CA C 9 65.261 64.443 0.818 1
1 38 . 10 1 1 A 9 9 ILE CB C 9 37.023 37.217 -0.194 1
1 39 . 10 1 1 A 9 9 ILE N N 9 117.056 117.054 0.002 1
1 40 . 10 1 1 A 10 10 GLY H H 10 8.515 8.523 -0.008 1
1 41 . 10 1 1 A 10 10 GLY HA3 H 10 3.773 3.819 -0.046 1
1 42 . 10 1 1 A 10 10 GLY CA C 10 47.637 46.821 0.816 1
1 43 . 10 1 1 A 10 10 GLY N N 10 106.202 111.074 -4.872 1
1 44 . 10 1 1 A 11 11 LEU H H 11 8.212 8.035 0.177 1
1 45 . 10 1 1 A 11 11 LEU CA C 11 58.354 57.583 0.771 1
1 46 . 10 1 1 A 11 11 LEU CB C 11 41.683 41.856 -0.173 1
1 47 . 10 1 1 A 11 11 LEU N N 11 124.624 123.496 1.128 1
1 48 . 10 1 1 A 12 12 LEU H H 12 7.971 7.940 0.031 1
1 49 . 10 1 1 A 12 12 LEU HA H 12 4.144 4.162 -0.018 1
1 59 . 10 1 1 A 12 12 LEU CA C 12 58.691 58.492 0.199 1
1 60 . 10 1 1 A 12 12 LEU CB C 12 40.657 41.363 -0.706 1
1 61 . 10 1 1 A 12 12 LEU N N 12 118.095 118.480 -0.385 1
1 62 . 10 1 1 A 13 13 ILE H H 13 8.379 8.267 0.112 1
1 63 . 10 1 1 A 13 13 ILE CA C 13 66.405 65.441 0.964 1
1 64 . 10 1 1 A 13 13 ILE CB C 13 38.916 37.949 0.967 1
1 65 . 10 1 1 A 13 13 ILE N N 13 121.161 120.125 1.036 1
1 66 . 10 1 1 A 14 14 GLY H H 14 8.823 8.552 0.271 1
1 67 . 10 1 1 A 14 14 GLY HA2 H 14 4.147 3.733 0.414 1
1 68 . 10 1 1 A 14 14 GLY HA3 H 14 3.982 3.748 0.234 1
1 69 . 10 1 1 A 14 14 GLY CA C 14 47.750 47.379 0.371 1
1 70 . 10 1 1 A 14 14 GLY N N 14 108.982 107.586 1.396 1
1 71 . 10 1 1 A 15 15 ILE H H 15 8.681 8.431 0.250 1
1 72 . 10 1 1 A 15 15 ILE CA C 15 64.996 64.967 0.029 1
1 73 . 10 1 1 A 15 15 ILE CB C 15 37.107 37.954 -0.847 1
1 74 . 10 1 1 A 15 15 ILE N N 15 121.601 122.611 -1.010 1
1 75 . 10 1 1 A 16 16 PHE H H 16 7.103 8.586 -1.483 1
1 76 . 10 1 1 A 16 16 PHE CA C 16 62.910 61.526 1.384 1
1 77 . 10 1 1 A 16 16 PHE CB C 16 38.782 39.200 -0.418 1
1 78 . 10 1 1 A 16 16 PHE N N 16 118.660 120.757 -2.097 1
1 79 . 10 1 1 A 17 17 HIS H H 17 7.591 8.417 -0.826 1
1 80 . 10 1 1 A 17 17 HIS HA H 17 4.793 4.096 0.697 1
1 82 . 10 1 1 A 17 17 HIS CA C 17 58.125 59.352 -1.227 1
1 83 . 10 1 1 A 17 17 HIS CB C 17 29.584 30.143 -0.559 1
1 84 . 10 1 1 A 17 17 HIS N N 17 114.968 118.980 -4.012 1
1 85 . 10 1 1 A 18 18 LYS H H 18 8.144 8.370 -0.226 1
1 86 . 10 1 1 A 18 18 LYS CA C 18 58.975 59.069 -0.094 1
1 87 . 10 1 1 A 18 18 LYS CB C 18 32.379 31.884 0.495 1
1 88 . 10 1 1 A 18 18 LYS N N 18 122.373 118.315 4.058 1
1 89 . 10 1 1 A 19 19 TYR H H 19 6.999 7.369 -0.370 1
1 90 . 10 1 1 A 19 19 TYR CA C 19 60.318 60.714 -0.396 1
1 91 . 10 1 1 A 19 19 TYR CB C 19 40.355 38.205 2.150 1
1 92 . 10 1 1 A 19 19 TYR N N 19 113.614 119.542 -5.928 1
1 93 . 10 1 1 A 20 20 SER H H 20 8.432 7.800 0.632 1
1 94 . 10 1 1 A 20 20 SER CA C 20 61.897 62.318 -0.421 1
1 95 . 10 1 1 A 20 20 SER CB C 20 61.354 62.452 -1.098 1
1 96 . 10 1 1 A 20 20 SER N N 20 113.201 115.975 -2.774 1
1 97 . 10 1 1 A 21 21 GLY H H 21 7.678 7.476 0.202 1
1 98 . 10 1 1 A 21 21 GLY HA2 H 21 4.195 3.820 0.375 1
1 99 . 10 1 1 A 21 21 GLY HA3 H 21 3.900 3.853 0.047 1
1 100 . 10 1 1 A 21 21 GLY CA C 21 45.628 45.231 0.397 1
1 101 . 10 1 1 A 21 21 GLY N N 21 110.734 108.253 2.481 1
1 102 . 10 1 1 A 22 22 LYS H H 22 7.362 7.626 -0.264 1
1 103 . 10 1 1 A 22 22 LYS CA C 22 60.163 58.433 1.730 1
1 104 . 10 1 1 A 22 22 LYS CB C 22 32.554 33.112 -0.558 1
1 105 . 10 1 1 A 22 22 LYS N N 22 122.161 120.582 1.579 1
1 106 . 10 1 1 A 23 23 GLU H H 23 9.639 8.485 1.154 1
1 107 . 10 1 1 A 23 23 GLU CA C 23 54.449 55.813 -1.364 1
1 108 . 10 1 1 A 23 23 GLU N N 23 116.288 117.897 -1.609 1
1 109 . 10 1 1 A 24 24 GLY HA2 H 24 3.912 3.864 0.048 1
1 110 . 10 1 1 A 24 24 GLY HA3 H 24 3.787 3.865 -0.078 1
1 111 . 10 1 1 A 24 24 GLY CA C 24 45.898 45.960 -0.062 1
1 112 . 10 1 1 A 25 25 ASP H H 25 8.204 8.470 -0.266 1
1 113 . 10 1 1 A 25 25 ASP CA C 25 55.252 53.393 1.859 1
1 114 . 10 1 1 A 25 25 ASP N N 25 125.671 122.009 3.662 1
1 115 . 10 1 1 A 26 26 LYS CA C 26 57.851 55.019 2.832 1
1 116 . 10 1 1 A 26 26 LYS CB C 26 31.265 35.236 -3.971 1
1 117 . 10 1 1 A 27 27 HIS H H 27 9.763 8.301 1.462 1
1 118 . 10 1 1 A 27 27 HIS CA C 27 55.580 56.077 -0.497 1
1 119 . 10 1 1 A 27 27 HIS CB C 27 30.936 30.410 0.526 1
1 120 . 10 1 1 A 27 27 HIS N N 27 118.108 115.623 2.485 1
1 121 . 10 1 1 A 28 28 THR H H 28 7.325 7.645 -0.320 1
1 126 . 10 1 1 A 28 28 THR CA C 28 60.128 61.495 -1.367 1
1 127 . 10 1 1 A 28 28 THR CB C 28 72.268 72.862 -0.594 1
1 128 . 10 1 1 A 28 28 THR N N 28 106.920 115.199 -8.279 1
1 129 . 10 1 1 A 29 29 LEU H H 29 9.422 9.383 0.039 1
1 130 . 10 1 1 A 29 29 LEU HA H 29 5.368 5.299 0.069 1
1 140 . 10 1 1 A 29 29 LEU CA C 29 52.567 53.366 -0.799 1
1 141 . 10 1 1 A 29 29 LEU CB C 29 43.523 44.606 -1.083 1
1 142 . 10 1 1 A 29 29 LEU N N 29 125.021 125.618 -0.597 1
1 143 . 10 1 1 A 30 30 SER H H 30 10.485 8.915 1.570 1
1 144 . 10 1 1 A 30 30 SER CA C 30 56.653 56.950 -0.297 1
1 145 . 10 1 1 A 30 30 SER CB C 30 65.313 65.490 -0.177 1
1 146 . 10 1 1 A 30 30 SER N N 30 124.758 118.212 6.546 1
1 147 . 10 1 1 A 31 31 LYS H H 31 8.728 8.464 0.264 1
1 148 . 10 1 1 A 31 31 LYS CA C 31 59.669 60.214 -0.545 1
1 149 . 10 1 1 A 31 31 LYS CB C 31 31.763 32.227 -0.464 1
1 150 . 10 1 1 A 31 31 LYS N N 31 119.459 121.156 -1.697 1
1 151 . 10 1 1 A 32 32 LYS H H 32 7.857 8.141 -0.284 1
1 152 . 10 1 1 A 32 32 LYS CA C 32 59.721 59.259 0.462 1
1 153 . 10 1 1 A 32 32 LYS CB C 32 32.901 31.857 1.044 1
1 154 . 10 1 1 A 32 32 LYS N N 32 117.933 118.637 -0.704 1
1 155 . 10 1 1 A 33 33 GLU H H 33 7.559 7.465 0.094 1
1 156 . 10 1 1 A 33 33 GLU CA C 33 59.169 58.947 0.222 1
1 157 . 10 1 1 A 33 33 GLU CB C 33 31.014 29.482 1.532 1
1 158 . 10 1 1 A 33 33 GLU N N 33 120.407 119.025 1.382 1
1 159 . 10 1 1 A 34 34 LEU H H 34 8.833 8.188 0.645 1
1 160 . 10 1 1 A 34 34 LEU CA C 34 56.928 57.609 -0.681 1
1 161 . 10 1 1 A 34 34 LEU CB C 34 41.435 41.323 0.112 1
1 162 . 10 1 1 A 34 34 LEU N N 34 117.677 120.883 -3.206 1
1 163 . 10 1 1 A 35 35 LYS H H 35 8.010 8.111 -0.101 1
1 164 . 10 1 1 A 35 35 LYS CA C 35 60.692 59.863 0.829 1
1 165 . 10 1 1 A 35 35 LYS CB C 35 32.223 32.087 0.136 1
1 166 . 10 1 1 A 35 35 LYS N N 35 119.829 118.977 0.852 1
1 167 . 10 1 1 A 36 36 GLU H H 36 7.169 8.235 -1.066 1
1 168 . 10 1 1 A 36 36 GLU CA C 36 59.588 59.029 0.559 1
1 169 . 10 1 1 A 36 36 GLU CB C 36 29.342 29.389 -0.047 1
1 170 . 10 1 1 A 36 36 GLU N N 36 117.340 119.231 -1.891 1
1 171 . 10 1 1 A 37 37 LEU H H 37 7.478 7.716 -0.238 1
1 172 . 10 1 1 A 37 37 LEU CA C 37 59.674 57.598 2.076 1
1 173 . 10 1 1 A 37 37 LEU CB C 37 42.142 40.940 1.202 1
1 174 . 10 1 1 A 37 37 LEU N N 37 120.884 121.381 -0.497 1
1 175 . 10 1 1 A 38 38 ILE H H 38 8.377 8.008 0.369 1
1 176 . 10 1 1 A 38 38 ILE CA C 38 65.651 65.468 0.183 1
1 177 . 10 1 1 A 38 38 ILE N N 38 118.450 119.824 -1.374 1
1 178 . 10 1 1 A 39 39 GLN H H 39 8.217 8.097 0.120 1
1 179 . 10 1 1 A 39 39 GLN CA C 39 59.788 58.724 1.064 1
1 180 . 10 1 1 A 39 39 GLN CB C 39 29.278 28.199 1.079 1
1 181 . 10 1 1 A 39 39 GLN N N 39 113.091 117.976 -4.885 1
1 182 . 10 1 1 A 40 40 LYS H H 40 8.426 8.115 0.311 1
1 183 . 10 1 1 A 40 40 LYS CA C 40 57.807 58.928 -1.121 1
1 184 . 10 1 1 A 40 40 LYS CB C 40 33.942 33.182 0.760 1
1 185 . 10 1 1 A 40 40 LYS N N 40 114.771 119.739 -4.968 1
1 186 . 10 1 1 A 41 41 GLU H H 41 8.496 8.206 0.290 1
1 187 . 10 1 1 A 41 41 GLU CA C 41 55.395 58.586 -3.191 1
1 188 . 10 1 1 A 41 41 GLU CB C 41 29.260 30.511 -1.251 1
1 189 . 10 1 1 A 41 41 GLU N N 41 112.546 118.925 -6.379 1
1 190 . 10 1 1 A 42 42 LEU H H 42 7.267 7.506 -0.239 1
1 191 . 10 1 1 A 42 42 LEU CA C 42 53.776 54.004 -0.228 1
1 192 . 10 1 1 A 42 42 LEU N N 42 118.657 118.559 0.098 1
1 193 . 10 1 1 A 44 44 ILE CA C 44 62.210 59.094 3.116 1
1 194 . 10 1 1 A 44 44 ILE CB C 44 38.247 41.318 -3.071 1
1 195 . 10 1 1 A 45 45 GLY H H 45 7.820 9.010 -1.190 1
1 196 . 10 1 1 A 45 45 GLY CA C 45 47.742 47.082 0.660 1
1 197 . 10 1 1 A 45 45 GLY N N 45 108.178 111.409 -3.231 1
1 198 . 10 1 1 A 46 46 SER H H 46 7.895 7.846 0.049 1
1 199 . 10 1 1 A 46 46 SER CA C 46 59.958 59.816 0.142 1
1 200 . 10 1 1 A 46 46 SER CB C 46 63.450 64.480 -1.030 1
1 201 . 10 1 1 A 46 46 SER N N 46 113.038 115.339 -2.301 1
1 202 . 10 1 1 A 47 47 LYS H H 47 7.736 7.795 -0.059 1
1 203 . 10 1 1 A 47 47 LYS CA C 47 55.636 57.657 -2.021 1
1 204 . 10 1 1 A 47 47 LYS CB C 47 33.103 29.610 3.493 1
1 205 . 10 1 1 A 47 47 LYS N N 47 119.422 115.946 3.476 1
1 206 . 10 1 1 A 48 48 LEU H H 48 6.988 7.921 -0.933 1
1 207 . 10 1 1 A 48 48 LEU HA H 48 4.497 4.103 0.394 1
1 217 . 10 1 1 A 48 48 LEU CA C 48 54.517 57.395 -2.878 1
1 218 . 10 1 1 A 48 48 LEU CB C 48 42.987 41.271 1.716 1
1 219 . 10 1 1 A 48 48 LEU N N 48 118.908 119.624 -0.716 1
1 220 . 10 1 1 A 49 49 GLN H H 49 9.206 8.113 1.093 1
1 221 . 10 1 1 A 49 49 GLN HA H 49 4.486 4.410 0.076 1
1 223 . 10 1 1 A 49 49 GLN CA C 49 54.785 56.733 -1.948 1
1 224 . 10 1 1 A 49 49 GLN CB C 49 29.636 28.768 0.868 1
1 225 . 10 1 1 A 49 49 GLN N N 49 121.275 117.930 3.345 1
1 226 . 10 1 1 A 50 50 ASP H H 50 8.854 7.797 1.057 1
1 227 . 10 1 1 A 50 50 ASP CA C 50 59.078 57.384 1.694 1
1 228 . 10 1 1 A 50 50 ASP CB C 50 40.632 41.637 -1.005 1
1 229 . 10 1 1 A 50 50 ASP N N 50 123.430 121.334 2.096 1
1 230 . 10 1 1 A 51 51 ALA H H 51 8.720 8.167 0.553 1
1 231 . 10 1 1 A 51 51 ALA CA C 51 55.281 55.004 0.277 1
1 232 . 10 1 1 A 51 51 ALA CB C 51 18.205 18.291 -0.086 1
1 233 . 10 1 1 A 51 51 ALA N N 51 117.829 121.192 -3.363 1
1 234 . 10 1 1 A 52 52 GLU H H 52 7.161 7.778 -0.617 1
1 235 . 10 1 1 A 52 52 GLU CA C 52 58.757 58.881 -0.124 1
1 236 . 10 1 1 A 52 52 GLU CB C 52 30.247 29.189 1.058 1
1 237 . 10 1 1 A 52 52 GLU N N 52 115.459 117.361 -1.902 1
1 238 . 10 1 1 A 53 53 ILE H H 53 7.962 7.648 0.314 1
1 239 . 10 1 1 A 53 53 ILE CA C 53 65.525 65.000 0.525 1
1 240 . 10 1 1 A 53 53 ILE CB C 53 37.289 37.780 -0.491 1
1 241 . 10 1 1 A 53 53 ILE N N 53 120.414 121.607 -1.193 1
1 242 . 10 1 1 A 54 54 VAL H H 54 8.132 8.146 -0.014 1
1 243 . 10 1 1 A 54 54 VAL CA C 54 67.290 65.621 1.669 1
1 244 . 10 1 1 A 54 54 VAL CB C 54 31.434 31.308 0.126 1
1 245 . 10 1 1 A 54 54 VAL N N 54 119.775 116.944 2.831 1
1 246 . 10 1 1 A 55 55 LYS H H 55 7.155 7.967 -0.812 1
1 247 . 10 1 1 A 55 55 LYS CA C 55 59.131 59.161 -0.030 1
1 248 . 10 1 1 A 55 55 LYS CB C 55 32.131 31.867 0.264 1
1 249 . 10 1 1 A 55 55 LYS N N 55 119.175 120.888 -1.713 1
1 250 . 10 1 1 A 56 56 LEU H H 56 7.837 8.348 -0.511 1
1 251 . 10 1 1 A 56 56 LEU CA C 56 58.052 58.006 0.046 1
1 252 . 10 1 1 A 56 56 LEU CB C 56 41.878 41.220 0.658 1
1 253 . 10 1 1 A 56 56 LEU N N 56 119.679 121.128 -1.449 1
1 254 . 10 1 1 A 57 57 MET H H 57 8.385 8.725 -0.340 1
1 255 . 10 1 1 A 57 57 MET CA C 57 60.756 58.553 2.203 1
1 256 . 10 1 1 A 57 57 MET CB C 57 33.152 31.875 1.277 1
1 257 . 10 1 1 A 57 57 MET N N 57 115.116 119.136 -4.020 1
1 258 . 10 1 1 A 58 58 ASP H H 58 7.591 8.195 -0.604 1
1 259 . 10 1 1 A 58 58 ASP CA C 58 57.365 57.197 0.168 1
1 260 . 10 1 1 A 58 58 ASP CB C 58 40.858 41.026 -0.168 1
1 261 . 10 1 1 A 58 58 ASP N N 58 118.197 119.584 -1.387 1
1 262 . 10 1 1 A 59 59 ASP H H 59 7.725 7.959 -0.234 1
1 263 . 10 1 1 A 59 59 ASP CA C 59 56.830 57.298 -0.468 1
1 264 . 10 1 1 A 59 59 ASP CB C 59 40.567 41.170 -0.603 1
1 265 . 10 1 1 A 59 59 ASP N N 59 118.481 118.305 0.176 1
1 266 . 10 1 1 A 60 60 LEU H H 60 7.703 8.138 -0.435 1
1 267 . 10 1 1 A 60 60 LEU CA C 60 56.564 57.707 -1.143 1
1 268 . 10 1 1 A 60 60 LEU CB C 60 42.714 41.154 1.560 1
1 269 . 10 1 1 A 60 60 LEU N N 60 116.935 120.875 -3.940 1
1 270 . 10 1 1 A 61 61 ASP H H 61 7.143 8.239 -1.096 1
1 271 . 10 1 1 A 61 61 ASP HA H 61 4.690 4.451 0.239 1
1 274 . 10 1 1 A 61 61 ASP CA C 61 52.286 56.441 -4.155 1
1 275 . 10 1 1 A 61 61 ASP CB C 61 39.245 41.226 -1.981 1
1 276 . 10 1 1 A 61 61 ASP N N 61 116.605 119.198 -2.593 1
1 277 . 10 1 1 A 62 62 ARG H H 62 7.786 7.667 0.119 1
1 278 . 10 1 1 A 62 62 ARG CA C 62 58.328 58.931 -0.603 1
1 279 . 10 1 1 A 62 62 ARG CB C 62 30.106 29.971 0.135 1
1 280 . 10 1 1 A 62 62 ARG N N 62 125.967 118.745 7.222 1
1 281 . 10 1 1 A 63 63 ASN H H 63 7.945 8.221 -0.276 1
1 282 . 10 1 1 A 63 63 ASN CA C 63 51.863 55.763 -3.900 1
1 283 . 10 1 1 A 63 63 ASN CB C 63 36.809 38.822 -2.013 1
1 284 . 10 1 1 A 63 63 ASN N N 63 112.434 116.719 -4.285 1
1 285 . 10 1 1 A 64 64 LYS H H 64 7.477 7.841 -0.364 1
1 286 . 10 1 1 A 64 64 LYS CA C 64 56.524 55.027 1.497 1
1 287 . 10 1 1 A 64 64 LYS N N 64 114.197 116.886 -2.689 1
1 288 . 10 1 1 A 65 65 ASP H H 65 8.345 8.569 -0.224 1
1 289 . 10 1 1 A 65 65 ASP CA C 65 52.969 53.937 -0.968 1
1 290 . 10 1 1 A 65 65 ASP CB C 65 40.329 42.911 -2.582 1
1 291 . 10 1 1 A 65 65 ASP N N 65 118.581 119.823 -1.242 1
1 292 . 10 1 1 A 66 66 GLN H H 66 9.945 8.937 1.008 1
1 293 . 10 1 1 A 66 66 GLN CA C 66 58.132 58.002 0.130 1
1 294 . 10 1 1 A 66 66 GLN CB C 66 26.035 26.998 -0.963 1
1 295 . 10 1 1 A 66 66 GLN N N 66 113.203 117.130 -3.927 1
1 296 . 10 1 1 A 67 67 GLU H H 67 7.880 7.582 0.298 1
1 297 . 10 1 1 A 67 67 GLU HA H 67 4.910 4.804 0.106 1
1 302 . 10 1 1 A 67 67 GLU CA C 67 54.082 55.177 -1.095 1
1 303 . 10 1 1 A 67 67 GLU CB C 67 33.174 32.575 0.599 1
1 304 . 10 1 1 A 67 67 GLU N N 67 118.554 116.654 1.900 1
1 305 . 10 1 1 A 68 68 VAL H H 68 9.669 9.098 0.571 1
1 306 . 10 1 1 A 68 68 VAL HA H 68 5.465 4.768 0.697 1
1 314 . 10 1 1 A 68 68 VAL CA C 68 61.079 61.337 -0.258 1
1 315 . 10 1 1 A 68 68 VAL CB C 68 33.280 34.551 -1.271 1
1 316 . 10 1 1 A 68 68 VAL N N 68 126.572 122.031 4.541 1
1 317 . 10 1 1 A 69 69 ASN H H 69 8.985 8.818 0.167 1
1 318 . 10 1 1 A 69 69 ASN CA C 69 50.812 53.190 -2.378 1
1 319 . 10 1 1 A 69 69 ASN CB C 69 38.609 39.467 -0.858 1
1 320 . 10 1 1 A 69 69 ASN N N 69 127.472 126.277 1.195 1
1 321 . 10 1 1 A 70 70 PHE H H 70 9.100 9.180 -0.080 1
1 322 . 10 1 1 A 70 70 PHE CA C 70 63.279 62.145 1.134 1
1 323 . 10 1 1 A 70 70 PHE CB C 70 38.741 39.707 -0.966 1
1 324 . 10 1 1 A 70 70 PHE N N 70 119.972 123.188 -3.216 1
1 325 . 10 1 1 A 71 71 GLN H H 71 8.342 8.271 0.071 1
1 326 . 10 1 1 A 71 71 GLN HA H 71 3.923 3.792 0.131 1
1 329 . 10 1 1 A 71 71 GLN CA C 71 59.866 58.644 1.222 1
1 330 . 10 1 1 A 71 71 GLN CB C 71 27.878 28.403 -0.525 1
1 331 . 10 1 1 A 71 71 GLN N N 71 118.216 117.250 0.966 1
1 332 . 10 1 1 A 72 72 GLU H H 72 8.721 7.797 0.924 1
1 333 . 10 1 1 A 72 72 GLU HA H 72 4.147 4.069 0.078 1
1 338 . 10 1 1 A 72 72 GLU CA C 72 59.313 58.887 0.426 1
1 339 . 10 1 1 A 72 72 GLU CB C 72 30.233 29.613 0.620 1
1 340 . 10 1 1 A 72 72 GLU N N 72 121.455 119.795 1.660 1
1 341 . 10 1 1 A 73 73 TYR H H 73 8.536 8.000 0.536 1
1 342 . 10 1 1 A 73 73 TYR CA C 73 60.961 61.415 -0.454 1
1 343 . 10 1 1 A 73 73 TYR CB C 73 38.724 38.823 -0.099 1
1 344 . 10 1 1 A 73 73 TYR N N 73 123.356 121.955 1.401 1
1 345 . 10 1 1 A 74 74 ILE H H 74 8.642 8.007 0.635 1
1 346 . 10 1 1 A 74 74 ILE CA C 74 61.880 64.136 -2.256 1
1 347 . 10 1 1 A 74 74 ILE CB C 74 36.077 36.938 -0.861 1
1 348 . 10 1 1 A 74 74 ILE N N 74 119.799 120.238 -0.439 1
1 349 . 10 1 1 A 75 75 THR H H 75 7.959 8.221 -0.262 1
1 354 . 10 1 1 A 75 75 THR CA C 75 67.056 66.844 0.212 1
1 355 . 10 1 1 A 75 75 THR CB C 75 68.386 68.400 -0.014 1
1 356 . 10 1 1 A 75 75 THR N N 75 119.486 117.916 1.570 1
1 357 . 10 1 1 A 76 76 PHE H H 76 7.450 8.154 -0.704 1
1 358 . 10 1 1 A 76 76 PHE CA C 76 59.010 61.764 -2.754 1
1 359 . 10 1 1 A 76 76 PHE CB C 76 38.139 39.326 -1.187 1
1 360 . 10 1 1 A 76 76 PHE N N 76 122.873 122.045 0.828 1
1 361 . 10 1 1 A 77 77 LEU H H 77 7.829 8.330 -0.501 1
1 362 . 10 1 1 A 77 77 LEU CA C 77 57.450 57.605 -0.155 1
1 363 . 10 1 1 A 77 77 LEU CB C 77 40.560 40.777 -0.217 1
1 364 . 10 1 1 A 77 77 LEU N N 77 117.405 118.549 -1.144 1
1 365 . 10 1 1 A 78 78 GLY H H 78 8.093 8.132 -0.039 1
1 366 . 10 1 1 A 78 78 GLY HA2 H 78 3.661 3.717 -0.056 1
1 367 . 10 1 1 A 78 78 GLY HA3 H 78 3.594 3.723 -0.129 1
1 368 . 10 1 1 A 78 78 GLY CA C 78 47.442 47.173 0.269 1
1 369 . 10 1 1 A 78 78 GLY N N 78 105.528 106.048 -0.520 1
1 370 . 10 1 1 A 79 79 ALA H H 79 7.759 7.549 0.210 1
1 371 . 10 1 1 A 79 79 ALA CA C 79 55.153 54.528 0.625 1
1 372 . 10 1 1 A 79 79 ALA CB C 79 17.768 18.090 -0.322 1
1 373 . 10 1 1 A 79 79 ALA N N 79 124.488 125.057 -0.569 1
1 374 . 10 1 1 A 80 80 LEU H H 80 7.963 8.029 -0.066 1
1 375 . 10 1 1 A 80 80 LEU CA C 80 57.464 57.639 -0.175 1
1 376 . 10 1 1 A 80 80 LEU CB C 80 41.496 41.245 0.251 1
1 377 . 10 1 1 A 80 80 LEU N N 80 117.869 120.263 -2.394 1
1 378 . 10 1 1 A 81 81 ALA H H 81 8.365 8.347 0.018 1
1 379 . 10 1 1 A 81 81 ALA CA C 81 55.475 55.025 0.450 1
1 380 . 10 1 1 A 81 81 ALA CB C 81 17.483 18.161 -0.678 1
1 381 . 10 1 1 A 81 81 ALA N N 81 119.054 120.219 -1.165 1
1 382 . 10 1 1 A 82 82 MET H H 82 8.112 7.622 0.490 1
1 383 . 10 1 1 A 82 82 MET CA C 82 59.516 58.086 1.430 1
1 384 . 10 1 1 A 82 82 MET CB C 82 32.550 32.280 0.270 1
1 385 . 10 1 1 A 82 82 MET N N 82 115.364 117.780 -2.416 1
1 386 . 10 1 1 A 83 83 ILE H H 83 7.981 7.496 0.485 1
1 387 . 10 1 1 A 83 83 ILE HA H 83 3.839 3.726 0.113 1
1 391 . 10 1 1 A 83 83 ILE CA C 83 64.467 64.668 -0.201 1
1 392 . 10 1 1 A 83 83 ILE CB C 83 37.312 37.417 -0.105 1
1 393 . 10 1 1 A 83 83 ILE N N 83 120.887 119.022 1.865 1
1 394 . 10 1 1 A 84 84 TYR H H 84 8.731 7.953 0.778 1
1 395 . 10 1 1 A 84 84 TYR N N 84 120.933 119.648 1.285 1
1 396 . 10 1 1 A 87 87 ALA H H 87 7.829 7.921 -0.092 1
1 397 . 10 1 1 A 87 87 ALA CA C 87 53.768 54.972 -1.204 1
1 398 . 10 1 1 A 87 87 ALA CB C 87 18.504 18.441 0.063 1
1 399 . 10 1 1 A 87 87 ALA N N 87 120.274 122.626 -2.352 1
1 400 . 10 1 1 A 88 88 LEU H H 88 7.499 8.079 -0.580 1
1 401 . 10 1 1 A 88 88 LEU CA C 88 55.605 56.523 -0.918 1
1 402 . 10 1 1 A 88 88 LEU CB C 88 42.047 42.041 0.006 1
1 403 . 10 1 1 A 88 88 LEU N N 88 117.356 120.227 -2.871 1
1 404 . 10 1 1 A 89 89 LYS H H 89 7.561 7.615 -0.054 1
1 405 . 10 1 1 A 89 89 LYS CA C 89 56.865 57.306 -0.441 1
1 406 . 10 1 1 A 89 89 LYS CB C 89 32.592 35.206 -2.614 1
1 407 . 10 1 1 A 89 89 LYS N N 89 119.289 119.083 0.206 1
1 416 . 10 3 2 C 6 6 GLU H H 190 8.385 7.844 0.541 1
1 417 . 10 3 2 C 6 6 GLU HA H 190 4.153 4.685 -0.532 1
1 422 . 10 3 2 C 6 6 GLU C C 190 175.031 173.983 1.048 1
1 423 . 10 3 2 C 6 6 GLU CA C 190 58.866 55.222 3.644 1
1 424 . 10 3 2 C 6 6 GLU CB C 190 30.751 32.436 -1.685 1
1 426 . 10 3 2 C 6 6 GLU N N 190 122.715 114.554 8.161 1
1 427 . 10 3 2 C 7 7 GLY H H 191 8.475 8.547 -0.072 1
1 428 . 10 3 2 C 7 7 GLY HA2 H 191 3.887 4.431 -0.544 1
1 429 . 10 3 2 C 7 7 GLY HA3 H 191 3.887 4.431 -0.544 1
1 430 . 10 3 2 C 7 7 GLY C C 191 177.922 174.741 3.181 1
1 431 . 10 3 2 C 7 7 GLY CA C 191 46.884 44.633 2.251 1
1 432 . 10 3 2 C 7 7 GLY N N 191 109.009 106.452 2.557 1
1 433 . 10 3 2 C 8 8 LEU HA H 192 4.095 3.951 0.144 1
1 443 . 10 3 2 C 8 8 LEU CA C 192 58.154 58.323 -0.169 1
1 444 . 10 3 2 C 8 8 LEU CB C 192 42.789 41.513 1.276 1
1 448 . 10 3 2 C 9 9 MET H H 193 8.250 8.183 0.067 1
1 449 . 10 3 2 C 9 9 MET HA H 193 4.150 4.107 0.043 1
1 457 . 10 3 2 C 9 9 MET C C 193 178.421 178.351 0.070 1
1 458 . 10 3 2 C 9 9 MET CA C 193 58.818 58.628 0.190 1
1 459 . 10 3 2 C 9 9 MET CB C 193 32.360 31.964 0.396 1
1 462 . 10 3 2 C 9 9 MET N N 193 117.049 118.788 -1.739 1
1 463 . 10 3 2 C 10 10 ASN H H 194 7.892 8.205 -0.313 1
1 464 . 10 3 2 C 10 10 ASN HA H 194 4.468 4.523 -0.055 1
1 469 . 10 3 2 C 10 10 ASN C C 194 178.099 176.605 1.494 1
1 470 . 10 3 2 C 10 10 ASN CA C 194 56.644 55.375 1.269 1
1 471 . 10 3 2 C 10 10 ASN CB C 194 39.100 38.612 0.488 1
1 472 . 10 3 2 C 10 10 ASN N N 194 117.034 118.793 -1.759 1
1 474 . 10 3 2 C 11 11 VAL H H 195 7.651 7.848 -0.197 1
1 475 . 10 3 2 C 11 11 VAL HA H 195 3.735 3.861 -0.126 1
1 483 . 10 3 2 C 11 11 VAL C C 195 177.657 178.150 -0.493 1
1 484 . 10 3 2 C 11 11 VAL CA C 195 66.710 65.040 1.670 1
1 485 . 10 3 2 C 11 11 VAL CB C 195 32.468 32.212 0.256 1
1 488 . 10 3 2 C 11 11 VAL N N 195 119.878 117.841 2.037 1
1 489 . 10 3 2 C 12 12 LEU H H 196 8.030 8.212 -0.182 1
1 490 . 10 3 2 C 12 12 LEU HA H 196 4.013 3.973 0.040 1
1 500 . 10 3 2 C 12 12 LEU C C 196 177.540 179.176 -1.636 1
1 501 . 10 3 2 C 12 12 LEU CA C 196 58.489 57.774 0.715 1
1 502 . 10 3 2 C 12 12 LEU CB C 196 42.457 41.149 1.308 1
1 506 . 10 3 2 C 12 12 LEU N N 196 119.499 120.011 -0.512 1
1 507 . 10 3 2 C 13 13 LYS H H 197 8.015 8.238 -0.223 1
1 508 . 10 3 2 C 13 13 LYS HA H 197 3.949 3.996 -0.047 1
1 517 . 10 3 2 C 13 13 LYS C C 197 178.419 179.101 -0.682 1
1 518 . 10 3 2 C 13 13 LYS CA C 197 60.191 59.036 1.155 1
1 519 . 10 3 2 C 13 13 LYS CB C 197 33.075 31.688 1.387 1
1 523 . 10 3 2 C 13 13 LYS N N 197 117.888 121.513 -3.625 1
1 524 . 10 3 2 C 14 14 LYS H H 198 7.506 7.784 -0.278 1
1 525 . 10 3 2 C 14 14 LYS HA H 198 4.127 4.163 -0.036 1
1 534 . 10 3 2 C 14 14 LYS C C 198 178.262 178.978 -0.716 1
1 535 . 10 3 2 C 14 14 LYS CA C 198 59.161 58.355 0.806 1
1 536 . 10 3 2 C 14 14 LYS CB C 198 32.956 32.048 0.908 1
1 540 . 10 3 2 C 14 14 LYS N N 198 118.321 117.945 0.376 1
1 541 . 10 3 2 C 15 15 ILE H H 199 7.780 7.869 -0.089 1
1 542 . 10 3 2 C 15 15 ILE HA H 199 3.787 3.912 -0.125 1
1 552 . 10 3 2 C 15 15 ILE C C 199 178.647 178.090 0.557 1
1 553 . 10 3 2 C 15 15 ILE CA C 199 64.912 63.629 1.283 1
1 554 . 10 3 2 C 15 15 ILE CB C 199 38.780 36.507 2.273 1
1 558 . 10 3 2 C 15 15 ILE N N 199 118.644 120.724 -2.080 1
1 559 . 10 3 2 C 16 16 TYR H H 200 7.918 8.375 -0.457 1
1 560 . 10 3 2 C 16 16 TYR HA H 200 4.252 4.063 0.189 1
1 567 . 10 3 2 C 16 16 TYR C C 200 177.806 177.080 0.726 1
1 568 . 10 3 2 C 16 16 TYR CA C 200 61.171 61.707 -0.536 1
1 569 . 10 3 2 C 16 16 TYR CB C 200 39.245 39.072 0.173 1
1 573 . 10 3 2 C 16 16 TYR N N 200 118.683 122.952 -4.269 1
1 574 . 10 3 2 C 17 17 GLU H H 201 8.089 8.413 -0.324 1
1 575 . 10 3 2 C 17 17 GLU HA H 201 4.124 4.076 0.048 1
1 580 . 10 3 2 C 17 17 GLU C C 201 177.414 176.900 0.514 1
1 581 . 10 3 2 C 17 17 GLU CA C 201 58.784 57.583 1.201 1
1 582 . 10 3 2 C 17 17 GLU CB C 201 30.747 29.269 1.478 1
1 584 . 10 3 2 C 17 17 GLU N N 201 119.409 118.732 0.677 1
1 585 . 10 3 2 C 18 18 ASP H H 202 8.023 7.922 0.101 1
1 586 . 10 3 2 C 18 18 ASP HA H 202 4.657 4.799 -0.142 1
1 589 . 10 3 2 C 18 18 ASP C C 202 177.346 176.801 0.545 1
1 590 . 10 3 2 C 18 18 ASP CA C 202 55.496 55.058 0.438 1
1 591 . 10 3 2 C 18 18 ASP CB C 202 42.023 42.109 -0.086 1
1 592 . 10 3 2 C 18 18 ASP N N 202 119.459 119.429 0.030 1
1 593 . 10 3 2 C 19 19 GLY H H 203 7.933 7.868 0.065 1
1 594 . 10 3 2 C 19 19 GLY HA2 H 203 3.938 4.009 -0.071 1
1 595 . 10 3 2 C 19 19 GLY HA3 H 203 3.938 4.021 -0.083 1
1 596 . 10 3 2 C 19 19 GLY C C 203 177.240 172.445 4.795 1
1 597 . 10 3 2 C 19 19 GLY CA C 203 46.309 45.254 1.055 1
1 598 . 10 3 2 C 19 19 GLY N N 203 108.518 107.909 0.609 1
1 599 . 10 3 2 C 20 20 ASP H H 204 8.091 8.754 -0.663 1
1 600 . 10 3 2 C 20 20 ASP HA H 204 4.616 4.747 -0.131 1
1 603 . 10 3 2 C 20 20 ASP C C 204 173.979 177.232 -3.253 1
1 604 . 10 3 2 C 20 20 ASP CA C 204 55.064 53.268 1.796 1
1 605 . 10 3 2 C 20 20 ASP CB C 204 42.203 41.893 0.310 1
1 606 . 10 3 2 C 20 20 ASP N N 204 120.172 120.001 0.171 1
1 607 . 10 3 2 C 21 21 ASP H H 205 8.352 9.016 -0.664 1
1 608 . 10 3 2 C 21 21 ASP HA H 205 4.468 4.254 0.214 1
1 611 . 10 3 2 C 21 21 ASP C C 205 176.432 177.649 -1.217 1
1 612 . 10 3 2 C 21 21 ASP CA C 205 56.663 56.230 0.433 1
1 613 . 10 3 2 C 21 21 ASP CB C 205 41.918 40.828 1.090 1
1 614 . 10 3 2 C 21 21 ASP N N 205 121.515 123.172 -1.657 1
1 615 . 10 3 2 C 22 22 ASP H H 206 8.239 8.066 0.173 1
1 616 . 10 3 2 C 22 22 ASP HA H 206 4.455 4.394 0.061 1
1 619 . 10 3 2 C 22 22 ASP C C 206 177.449 178.570 -1.121 1
1 620 . 10 3 2 C 22 22 ASP CA C 206 57.165 57.111 0.054 1
1 621 . 10 3 2 C 22 22 ASP CB C 206 41.820 40.186 1.634 1
1 622 . 10 3 2 C 22 22 ASP N N 206 120.156 118.791 1.365 1
1 623 . 10 3 2 C 23 23 MET H H 207 8.300 7.859 0.441 1
1 624 . 10 3 2 C 23 23 MET HA H 207 4.255 4.032 0.223 1
1 632 . 10 3 2 C 23 23 MET C C 207 178.412 178.383 0.029 1
1 633 . 10 3 2 C 23 23 MET CA C 207 58.065 58.650 -0.585 1
1 634 . 10 3 2 C 23 23 MET CB C 207 32.488 31.810 0.678 1
1 637 . 10 3 2 C 23 23 MET N N 207 120.707 119.662 1.045 1
1 638 . 10 3 2 C 24 24 LYS H H 208 8.047 8.120 -0.073 1
1 639 . 10 3 2 C 24 24 LYS HA H 208 3.946 4.106 -0.160 1
1 648 . 10 3 2 C 24 24 LYS C C 208 178.008 179.420 -1.412 1
1 649 . 10 3 2 C 24 24 LYS CA C 208 59.847 59.504 0.343 1
1 650 . 10 3 2 C 24 24 LYS CB C 208 32.983 32.023 0.960 1
1 654 . 10 3 2 C 24 24 LYS N N 208 119.504 118.590 0.914 1
1 655 . 10 3 2 C 25 25 ARG H H 209 7.891 7.857 0.034 1
1 656 . 10 3 2 C 25 25 ARG HA H 209 4.168 4.062 0.106 1
1 663 . 10 3 2 C 25 25 ARG C C 209 178.100 178.709 -0.609 1
1 664 . 10 3 2 C 25 25 ARG CA C 209 58.810 58.999 -0.189 1
1 665 . 10 3 2 C 25 25 ARG CB C 209 31.080 29.916 1.164 1
1 668 . 10 3 2 C 25 25 ARG N N 209 118.378 120.696 -2.318 1
1 669 . 10 3 2 C 26 26 THR H H 210 7.869 7.802 0.067 1
1 670 . 10 3 2 C 26 26 THR HA H 210 4.023 4.029 -0.006 1
1 675 . 10 3 2 C 26 26 THR C C 210 177.984 176.774 1.210 1
1 676 . 10 3 2 C 26 26 THR CA C 210 65.747 67.116 -1.369 1
1 677 . 10 3 2 C 26 26 THR CB C 210 69.683 68.288 1.395 1
1 679 . 10 3 2 C 26 26 THR N N 210 115.443 116.687 -1.244 1
1 680 . 10 3 2 C 27 27 ILE H H 211 7.901 7.749 0.152 1
1 681 . 10 3 2 C 27 27 ILE HA H 211 4.142 3.497 0.645 1
1 691 . 10 3 2 C 27 27 ILE C C 211 175.595 177.938 -2.343 1
1 692 . 10 3 2 C 27 27 ILE CA C 211 63.528 65.850 -2.322 1
1 693 . 10 3 2 C 27 27 ILE CB C 211 38.982 36.933 2.049 1
1 697 . 10 3 2 C 27 27 ILE N N 211 121.265 121.192 0.073 1
1 698 . 10 3 2 C 28 28 ASN HA H 212 4.465 4.392 0.073 1
1 703 . 10 3 2 C 28 28 ASN CA C 212 55.182 56.877 -1.695 1
1 704 . 10 3 2 C 28 28 ASN CB C 212 39.480 39.681 -0.201 1
1 706 . 10 3 2 C 29 29 LYS H H 213 7.968 8.221 -0.253 1
1 707 . 10 3 2 C 29 29 LYS HA H 213 4.072 4.093 -0.021 1
1 716 . 10 3 2 C 29 29 LYS C C 213 176.218 178.942 -2.724 1
1 717 . 10 3 2 C 29 29 LYS CA C 213 58.489 59.130 -0.641 1
1 718 . 10 3 2 C 29 29 LYS CB C 213 33.165 32.245 0.920 1
1 722 . 10 3 2 C 29 29 LYS N N 213 120.820 117.486 3.334 1
1 723 . 10 3 2 C 30 30 ALA H H 214 7.865 7.956 -0.091 1
1 724 . 10 3 2 C 30 30 ALA HA H 214 4.217 4.166 0.051 1
1 728 . 10 3 2 C 30 30 ALA C C 214 177.041 179.917 -2.876 1
1 729 . 10 3 2 C 30 30 ALA CA C 214 54.104 54.938 -0.834 1
1 730 . 10 3 2 C 30 30 ALA CB C 214 19.496 18.481 1.015 1
1 731 . 10 3 2 C 30 30 ALA N N 214 121.571 121.545 0.026 1
1 732 . 10 3 2 C 31 31 TRP H H 215 7.831 8.044 -0.213 1
1 733 . 10 3 2 C 31 31 TRP HA H 215 4.598 4.291 0.307 1
1 742 . 10 3 2 C 31 31 TRP C C 215 178.088 178.166 -0.078 1
1 743 . 10 3 2 C 31 31 TRP CA C 215 58.432 61.333 -2.901 1
1 744 . 10 3 2 C 31 31 TRP CB C 215 30.472 29.364 1.108 1
1 750 . 10 3 2 C 31 31 TRP N N 215 118.141 120.499 -2.358 1
1 752 . 10 3 2 C 32 32 VAL H H 216 7.594 8.501 -0.907 1
1 753 . 10 3 2 C 32 32 VAL HA H 216 3.978 3.622 0.356 1
1 761 . 10 3 2 C 32 32 VAL C C 216 176.574 177.828 -1.254 1
1 762 . 10 3 2 C 32 32 VAL CA C 216 63.329 66.485 -3.156 1
1 763 . 10 3 2 C 32 32 VAL CB C 216 33.373 31.862 1.511 1
1 766 . 10 3 2 C 32 32 VAL N N 216 118.287 120.305 -2.018 1
1 767 . 10 3 2 C 33 33 GLU H H 217 8.012 8.186 -0.174 1
1 768 . 10 3 2 C 33 33 GLU HA H 217 4.257 4.205 0.052 1
1 773 . 10 3 2 C 33 33 GLU C C 217 176.164 178.421 -2.257 1
1 774 . 10 3 2 C 33 33 GLU CA C 217 57.409 58.014 -0.605 1
1 775 . 10 3 2 C 33 33 GLU CB C 217 30.978 29.261 1.717 1
1 777 . 10 3 2 C 33 33 GLU N N 217 122.535 119.049 3.486 1
1 778 . 10 3 2 C 34 34 SER H H 218 8.037 7.803 0.234 1
1 779 . 10 3 2 C 34 34 SER HA H 218 4.514 4.329 0.185 1
1 782 . 10 3 2 C 34 34 SER C C 218 176.451 175.469 0.982 1
1 783 . 10 3 2 C 34 34 SER CA C 218 58.987 60.288 -1.301 1
1 784 . 10 3 2 C 34 34 SER CB C 218 64.569 63.074 1.495 1
1 785 . 10 3 2 C 34 34 SER N N 218 117.058 113.956 3.102 1
1 6 . 11 1 1 A 2 2 ALA H H 2 8.191 8.345 -0.154 1
1 7 . 11 1 1 A 2 2 ALA CA C 2 51.957 54.317 -2.360 1
1 8 . 11 1 1 A 2 2 ALA CB C 2 19.580 17.371 2.209 1
1 9 . 11 1 1 A 2 2 ALA N N 2 124.666 122.558 2.108 1
1 10 . 11 1 1 A 3 3 SER H H 3 8.829 8.197 0.632 1
1 11 . 11 1 1 A 3 3 SER CA C 3 57.221 63.553 -6.332 1
1 12 . 11 1 1 A 3 3 SER N N 3 119.917 113.462 6.455 1
1 13 . 11 1 1 A 4 4 PRO CA C 4 66.688 65.568 1.120 1
1 14 . 11 1 1 A 4 4 PRO CB C 4 32.553 30.733 1.820 1
1 15 . 11 1 1 A 5 5 LEU H H 5 9.146 7.246 1.900 1
1 16 . 11 1 1 A 5 5 LEU CA C 5 59.017 57.042 1.975 1
1 17 . 11 1 1 A 5 5 LEU CB C 5 42.341 42.358 -0.017 1
1 18 . 11 1 1 A 5 5 LEU N N 5 117.902 117.289 0.613 1
1 19 . 11 1 1 A 6 6 ASP H H 6 7.572 8.457 -0.885 1
1 20 . 11 1 1 A 6 6 ASP CA C 6 57.997 57.388 0.609 1
1 21 . 11 1 1 A 6 6 ASP CB C 6 40.910 40.120 0.790 1
1 22 . 11 1 1 A 6 6 ASP N N 6 118.259 118.625 -0.366 1
1 23 . 11 1 1 A 7 7 GLN H H 7 8.660 8.552 0.108 1
1 24 . 11 1 1 A 7 7 GLN HA H 7 4.064 4.079 -0.015 1
1 29 . 11 1 1 A 7 7 GLN CA C 7 59.270 58.745 0.525 1
1 30 . 11 1 1 A 7 7 GLN CB C 7 28.468 27.797 0.671 1
1 31 . 11 1 1 A 7 7 GLN N N 7 119.558 118.092 1.466 1
1 32 . 11 1 1 A 8 8 ALA H H 8 8.253 7.466 0.787 1
1 33 . 11 1 1 A 8 8 ALA CA C 8 55.519 54.946 0.573 1
1 34 . 11 1 1 A 8 8 ALA CB C 8 18.113 18.181 -0.068 1
1 35 . 11 1 1 A 8 8 ALA N N 8 123.628 122.076 1.552 1
1 36 . 11 1 1 A 9 9 ILE H H 9 8.134 8.216 -0.082 1
1 37 . 11 1 1 A 9 9 ILE CA C 9 65.261 64.419 0.842 1
1 38 . 11 1 1 A 9 9 ILE CB C 9 37.023 37.220 -0.197 1
1 39 . 11 1 1 A 9 9 ILE N N 9 117.056 117.002 0.054 1
1 40 . 11 1 1 A 10 10 GLY H H 10 8.515 8.324 0.191 1
1 41 . 11 1 1 A 10 10 GLY HA3 H 10 3.773 3.725 0.048 1
1 42 . 11 1 1 A 10 10 GLY CA C 10 47.637 47.310 0.327 1
1 43 . 11 1 1 A 10 10 GLY N N 10 106.202 110.761 -4.559 1
1 44 . 11 1 1 A 11 11 LEU H H 11 8.212 8.126 0.086 1
1 45 . 11 1 1 A 11 11 LEU CA C 11 58.354 57.710 0.644 1
1 46 . 11 1 1 A 11 11 LEU CB C 11 41.683 41.807 -0.124 1
1 47 . 11 1 1 A 11 11 LEU N N 11 124.624 123.038 1.586 1
1 48 . 11 1 1 A 12 12 LEU H H 12 7.971 7.926 0.045 1
1 49 . 11 1 1 A 12 12 LEU HA H 12 4.144 4.228 -0.084 1
1 59 . 11 1 1 A 12 12 LEU CA C 12 58.691 58.499 0.192 1
1 60 . 11 1 1 A 12 12 LEU CB C 12 40.657 41.567 -0.910 1
1 61 . 11 1 1 A 12 12 LEU N N 12 118.095 118.462 -0.367 1
1 62 . 11 1 1 A 13 13 ILE H H 13 8.379 8.462 -0.083 1
1 63 . 11 1 1 A 13 13 ILE CA C 13 66.405 65.267 1.138 1
1 64 . 11 1 1 A 13 13 ILE CB C 13 38.916 38.210 0.706 1
1 65 . 11 1 1 A 13 13 ILE N N 13 121.161 120.351 0.810 1
1 66 . 11 1 1 A 14 14 GLY H H 14 8.823 8.478 0.345 1
1 67 . 11 1 1 A 14 14 GLY HA2 H 14 4.147 3.719 0.428 1
1 68 . 11 1 1 A 14 14 GLY HA3 H 14 3.982 3.728 0.254 1
1 69 . 11 1 1 A 14 14 GLY CA C 14 47.750 47.333 0.417 1
1 70 . 11 1 1 A 14 14 GLY N N 14 108.982 107.298 1.684 1
1 71 . 11 1 1 A 15 15 ILE H H 15 8.681 8.407 0.274 1
1 72 . 11 1 1 A 15 15 ILE CA C 15 64.996 64.481 0.515 1
1 73 . 11 1 1 A 15 15 ILE CB C 15 37.107 37.299 -0.192 1
1 74 . 11 1 1 A 15 15 ILE N N 15 121.601 122.640 -1.039 1
1 75 . 11 1 1 A 16 16 PHE H H 16 7.103 8.231 -1.128 1
1 76 . 11 1 1 A 16 16 PHE CA C 16 62.910 61.457 1.453 1
1 77 . 11 1 1 A 16 16 PHE CB C 16 38.782 39.462 -0.680 1
1 78 . 11 1 1 A 16 16 PHE N N 16 118.660 121.349 -2.689 1
1 79 . 11 1 1 A 17 17 HIS H H 17 7.591 8.613 -1.022 1
1 80 . 11 1 1 A 17 17 HIS HA H 17 4.793 4.144 0.649 1
1 82 . 11 1 1 A 17 17 HIS CA C 17 58.125 59.717 -1.592 1
1 83 . 11 1 1 A 17 17 HIS CB C 17 29.584 30.000 -0.416 1
1 84 . 11 1 1 A 17 17 HIS N N 17 114.968 118.661 -3.693 1
1 85 . 11 1 1 A 18 18 LYS H H 18 8.144 7.897 0.247 1
1 86 . 11 1 1 A 18 18 LYS CA C 18 58.975 58.715 0.260 1
1 87 . 11 1 1 A 18 18 LYS CB C 18 32.379 31.951 0.428 1
1 88 . 11 1 1 A 18 18 LYS N N 18 122.373 117.569 4.804 1
1 89 . 11 1 1 A 19 19 TYR H H 19 6.999 7.384 -0.385 1
1 90 . 11 1 1 A 19 19 TYR CA C 19 60.318 60.886 -0.568 1
1 91 . 11 1 1 A 19 19 TYR CB C 19 40.355 38.270 2.085 1
1 92 . 11 1 1 A 19 19 TYR N N 19 113.614 119.622 -6.008 1
1 93 . 11 1 1 A 20 20 SER H H 20 8.432 7.808 0.624 1
1 94 . 11 1 1 A 20 20 SER CA C 20 61.897 62.532 -0.635 1
1 95 . 11 1 1 A 20 20 SER CB C 20 61.354 62.233 -0.879 1
1 96 . 11 1 1 A 20 20 SER N N 20 113.201 116.422 -3.221 1
1 97 . 11 1 1 A 21 21 GLY H H 21 7.678 8.017 -0.339 1
1 98 . 11 1 1 A 21 21 GLY HA2 H 21 4.195 3.790 0.405 1
1 99 . 11 1 1 A 21 21 GLY HA3 H 21 3.900 3.819 0.081 1
1 100 . 11 1 1 A 21 21 GLY CA C 21 45.628 46.250 -0.622 1
1 101 . 11 1 1 A 21 21 GLY N N 21 110.734 108.279 2.455 1
1 102 . 11 1 1 A 22 22 LYS H H 22 7.362 7.332 0.030 1
1 103 . 11 1 1 A 22 22 LYS CA C 22 60.163 58.251 1.912 1
1 104 . 11 1 1 A 22 22 LYS CB C 22 32.554 33.526 -0.972 1
1 105 . 11 1 1 A 22 22 LYS N N 22 122.161 120.705 1.456 1
1 106 . 11 1 1 A 23 23 GLU H H 23 9.639 8.037 1.602 1
1 107 . 11 1 1 A 23 23 GLU CA C 23 54.449 56.145 -1.696 1
1 108 . 11 1 1 A 23 23 GLU N N 23 116.288 116.552 -0.264 1
1 109 . 11 1 1 A 24 24 GLY HA2 H 24 3.912 4.006 -0.094 1
1 110 . 11 1 1 A 24 24 GLY HA3 H 24 3.787 4.031 -0.244 1
1 111 . 11 1 1 A 24 24 GLY CA C 24 45.898 44.358 1.540 1
1 112 . 11 1 1 A 25 25 ASP H H 25 8.204 8.724 -0.520 1
1 113 . 11 1 1 A 25 25 ASP CA C 25 55.252 52.406 2.846 1
1 114 . 11 1 1 A 25 25 ASP N N 25 125.671 119.592 6.079 1
1 115 . 11 1 1 A 26 26 LYS CA C 26 57.851 59.102 -1.251 1
1 116 . 11 1 1 A 26 26 LYS CB C 26 31.265 32.559 -1.294 1
1 117 . 11 1 1 A 27 27 HIS H H 27 9.763 8.029 1.734 1
1 118 . 11 1 1 A 27 27 HIS CA C 27 55.580 54.346 1.234 1
1 119 . 11 1 1 A 27 27 HIS CB C 27 30.936 29.699 1.237 1
1 120 . 11 1 1 A 27 27 HIS N N 27 118.108 111.673 6.435 1
1 121 . 11 1 1 A 28 28 THR H H 28 7.325 7.805 -0.480 1
1 126 . 11 1 1 A 28 28 THR CA C 28 60.128 59.892 0.236 1
1 127 . 11 1 1 A 28 28 THR CB C 28 72.268 71.794 0.474 1
1 128 . 11 1 1 A 28 28 THR N N 28 106.920 109.936 -3.016 1
1 129 . 11 1 1 A 29 29 LEU H H 29 9.422 9.178 0.244 1
1 130 . 11 1 1 A 29 29 LEU HA H 29 5.368 4.911 0.457 1
1 140 . 11 1 1 A 29 29 LEU CA C 29 52.567 53.346 -0.779 1
1 141 . 11 1 1 A 29 29 LEU CB C 29 43.523 45.409 -1.886 1
1 142 . 11 1 1 A 29 29 LEU N N 29 125.021 122.878 2.143 1
1 143 . 11 1 1 A 30 30 SER H H 30 10.485 8.788 1.697 1
1 144 . 11 1 1 A 30 30 SER CA C 30 56.653 57.116 -0.463 1
1 145 . 11 1 1 A 30 30 SER CB C 30 65.313 65.586 -0.273 1
1 146 . 11 1 1 A 30 30 SER N N 30 124.758 117.351 7.407 1
1 147 . 11 1 1 A 31 31 LYS H H 31 8.728 8.942 -0.214 1
1 148 . 11 1 1 A 31 31 LYS CA C 31 59.669 60.109 -0.440 1
1 149 . 11 1 1 A 31 31 LYS CB C 31 31.763 32.002 -0.239 1
1 150 . 11 1 1 A 31 31 LYS N N 31 119.459 121.048 -1.589 1
1 151 . 11 1 1 A 32 32 LYS H H 32 7.857 7.974 -0.117 1
1 152 . 11 1 1 A 32 32 LYS CA C 32 59.721 59.637 0.084 1
1 153 . 11 1 1 A 32 32 LYS CB C 32 32.901 32.129 0.772 1
1 154 . 11 1 1 A 32 32 LYS N N 32 117.933 120.459 -2.526 1
1 155 . 11 1 1 A 33 33 GLU H H 33 7.559 7.725 -0.166 1
1 156 . 11 1 1 A 33 33 GLU CA C 33 59.169 58.918 0.251 1
1 157 . 11 1 1 A 33 33 GLU CB C 33 31.014 29.513 1.501 1
1 158 . 11 1 1 A 33 33 GLU N N 33 120.407 119.198 1.209 1
1 159 . 11 1 1 A 34 34 LEU H H 34 8.833 8.350 0.483 1
1 160 . 11 1 1 A 34 34 LEU CA C 34 56.928 57.564 -0.636 1
1 161 . 11 1 1 A 34 34 LEU CB C 34 41.435 41.628 -0.193 1
1 162 . 11 1 1 A 34 34 LEU N N 34 117.677 120.880 -3.203 1
1 163 . 11 1 1 A 35 35 LYS H H 35 8.010 8.102 -0.092 1
1 164 . 11 1 1 A 35 35 LYS CA C 35 60.692 59.884 0.808 1
1 165 . 11 1 1 A 35 35 LYS CB C 35 32.223 32.252 -0.029 1
1 166 . 11 1 1 A 35 35 LYS N N 35 119.829 119.276 0.553 1
1 167 . 11 1 1 A 36 36 GLU H H 36 7.169 8.212 -1.043 1
1 168 . 11 1 1 A 36 36 GLU CA C 36 59.588 58.964 0.624 1
1 169 . 11 1 1 A 36 36 GLU CB C 36 29.342 29.032 0.310 1
1 170 . 11 1 1 A 36 36 GLU N N 36 117.340 119.151 -1.811 1
1 171 . 11 1 1 A 37 37 LEU H H 37 7.478 7.439 0.039 1
1 172 . 11 1 1 A 37 37 LEU CA C 37 59.674 57.558 2.116 1
1 173 . 11 1 1 A 37 37 LEU CB C 37 42.142 41.312 0.830 1
1 174 . 11 1 1 A 37 37 LEU N N 37 120.884 121.195 -0.311 1
1 175 . 11 1 1 A 38 38 ILE H H 38 8.377 8.398 -0.021 1
1 176 . 11 1 1 A 38 38 ILE CA C 38 65.651 65.499 0.152 1
1 177 . 11 1 1 A 38 38 ILE N N 38 118.450 120.013 -1.563 1
1 178 . 11 1 1 A 39 39 GLN H H 39 8.217 8.127 0.090 1
1 179 . 11 1 1 A 39 39 GLN CA C 39 59.788 58.955 0.833 1
1 180 . 11 1 1 A 39 39 GLN CB C 39 29.278 28.082 1.196 1
1 181 . 11 1 1 A 39 39 GLN N N 39 113.091 117.734 -4.643 1
1 182 . 11 1 1 A 40 40 LYS H H 40 8.426 8.025 0.401 1
1 183 . 11 1 1 A 40 40 LYS CA C 40 57.807 58.891 -1.084 1
1 184 . 11 1 1 A 40 40 LYS CB C 40 33.942 33.230 0.712 1
1 185 . 11 1 1 A 40 40 LYS N N 40 114.771 118.598 -3.827 1
1 186 . 11 1 1 A 41 41 GLU H H 41 8.496 8.489 0.007 1
1 187 . 11 1 1 A 41 41 GLU CA C 41 55.395 58.045 -2.650 1
1 188 . 11 1 1 A 41 41 GLU CB C 41 29.260 30.437 -1.177 1
1 189 . 11 1 1 A 41 41 GLU N N 41 112.546 117.169 -4.623 1
1 190 . 11 1 1 A 42 42 LEU H H 42 7.267 7.661 -0.394 1
1 191 . 11 1 1 A 42 42 LEU CA C 42 53.776 53.693 0.083 1
1 192 . 11 1 1 A 42 42 LEU N N 42 118.657 118.207 0.450 1
1 193 . 11 1 1 A 44 44 ILE CA C 44 62.210 62.296 -0.086 1
1 194 . 11 1 1 A 44 44 ILE CB C 44 38.247 39.099 -0.852 1
1 195 . 11 1 1 A 45 45 GLY H H 45 7.820 8.895 -1.075 1
1 196 . 11 1 1 A 45 45 GLY CA C 45 47.742 45.491 2.251 1
1 197 . 11 1 1 A 45 45 GLY N N 45 108.178 111.099 -2.921 1
1 198 . 11 1 1 A 46 46 SER H H 46 7.895 7.701 0.194 1
1 199 . 11 1 1 A 46 46 SER CA C 46 59.958 57.225 2.733 1
1 200 . 11 1 1 A 46 46 SER CB C 46 63.450 64.333 -0.883 1
1 201 . 11 1 1 A 46 46 SER N N 46 113.038 114.570 -1.532 1
1 202 . 11 1 1 A 47 47 LYS H H 47 7.736 8.747 -1.011 1
1 203 . 11 1 1 A 47 47 LYS CA C 47 55.636 56.685 -1.049 1
1 204 . 11 1 1 A 47 47 LYS CB C 47 33.103 32.187 0.916 1
1 205 . 11 1 1 A 47 47 LYS N N 47 119.422 125.181 -5.759 1
1 206 . 11 1 1 A 48 48 LEU H H 48 6.988 7.505 -0.517 1
1 207 . 11 1 1 A 48 48 LEU HA H 48 4.497 3.966 0.531 1
1 217 . 11 1 1 A 48 48 LEU CA C 48 54.517 57.845 -3.328 1
1 218 . 11 1 1 A 48 48 LEU CB C 48 42.987 41.849 1.138 1
1 219 . 11 1 1 A 48 48 LEU N N 48 118.908 121.985 -3.077 1
1 220 . 11 1 1 A 49 49 GLN H H 49 9.206 7.950 1.256 1
1 221 . 11 1 1 A 49 49 GLN HA H 49 4.486 4.323 0.163 1
1 223 . 11 1 1 A 49 49 GLN CA C 49 54.785 56.033 -1.248 1
1 224 . 11 1 1 A 49 49 GLN CB C 49 29.636 29.035 0.601 1
1 225 . 11 1 1 A 49 49 GLN N N 49 121.275 118.691 2.584 1
1 226 . 11 1 1 A 50 50 ASP H H 50 8.854 8.082 0.772 1
1 227 . 11 1 1 A 50 50 ASP CA C 50 59.078 57.207 1.871 1
1 228 . 11 1 1 A 50 50 ASP CB C 50 40.632 41.484 -0.852 1
1 229 . 11 1 1 A 50 50 ASP N N 50 123.430 121.306 2.124 1
1 230 . 11 1 1 A 51 51 ALA H H 51 8.720 8.203 0.517 1
1 231 . 11 1 1 A 51 51 ALA CA C 51 55.281 54.819 0.462 1
1 232 . 11 1 1 A 51 51 ALA CB C 51 18.205 18.214 -0.009 1
1 233 . 11 1 1 A 51 51 ALA N N 51 117.829 121.174 -3.345 1
1 234 . 11 1 1 A 52 52 GLU H H 52 7.161 7.846 -0.685 1
1 235 . 11 1 1 A 52 52 GLU CA C 52 58.757 59.147 -0.390 1
1 236 . 11 1 1 A 52 52 GLU CB C 52 30.247 29.797 0.450 1
1 237 . 11 1 1 A 52 52 GLU N N 52 115.459 117.698 -2.239 1
1 238 . 11 1 1 A 53 53 ILE H H 53 7.962 7.948 0.014 1
1 239 . 11 1 1 A 53 53 ILE CA C 53 65.525 65.111 0.414 1
1 240 . 11 1 1 A 53 53 ILE CB C 53 37.289 37.963 -0.674 1
1 241 . 11 1 1 A 53 53 ILE N N 53 120.414 121.040 -0.626 1
1 242 . 11 1 1 A 54 54 VAL H H 54 8.132 8.113 0.019 1
1 243 . 11 1 1 A 54 54 VAL CA C 54 67.290 65.566 1.724 1
1 244 . 11 1 1 A 54 54 VAL CB C 54 31.434 31.256 0.178 1
1 245 . 11 1 1 A 54 54 VAL N N 54 119.775 116.917 2.858 1
1 246 . 11 1 1 A 55 55 LYS H H 55 7.155 8.000 -0.845 1
1 247 . 11 1 1 A 55 55 LYS CA C 55 59.131 58.778 0.353 1
1 248 . 11 1 1 A 55 55 LYS CB C 55 32.131 31.693 0.438 1
1 249 . 11 1 1 A 55 55 LYS N N 55 119.175 120.889 -1.714 1
1 250 . 11 1 1 A 56 56 LEU H H 56 7.837 7.868 -0.031 1
1 251 . 11 1 1 A 56 56 LEU CA C 56 58.052 57.648 0.404 1
1 252 . 11 1 1 A 56 56 LEU CB C 56 41.878 41.976 -0.098 1
1 253 . 11 1 1 A 56 56 LEU N N 56 119.679 120.885 -1.206 1
1 254 . 11 1 1 A 57 57 MET H H 57 8.385 8.675 -0.290 1
1 255 . 11 1 1 A 57 57 MET CA C 57 60.756 58.589 2.167 1
1 256 . 11 1 1 A 57 57 MET CB C 57 33.152 33.203 -0.051 1
1 257 . 11 1 1 A 57 57 MET N N 57 115.116 116.939 -1.823 1
1 258 . 11 1 1 A 58 58 ASP H H 58 7.591 8.316 -0.725 1
1 259 . 11 1 1 A 58 58 ASP CA C 58 57.365 57.525 -0.160 1
1 260 . 11 1 1 A 58 58 ASP CB C 58 40.858 41.926 -1.068 1
1 261 . 11 1 1 A 58 58 ASP N N 58 118.197 120.555 -2.358 1
1 262 . 11 1 1 A 59 59 ASP H H 59 7.725 7.580 0.145 1
1 263 . 11 1 1 A 59 59 ASP CA C 59 56.830 56.708 0.122 1
1 264 . 11 1 1 A 59 59 ASP CB C 59 40.567 40.743 -0.176 1
1 265 . 11 1 1 A 59 59 ASP N N 59 118.481 119.692 -1.211 1
1 266 . 11 1 1 A 60 60 LEU H H 60 7.703 7.881 -0.178 1
1 267 . 11 1 1 A 60 60 LEU CA C 60 56.564 57.839 -1.275 1
1 268 . 11 1 1 A 60 60 LEU CB C 60 42.714 41.268 1.446 1
1 269 . 11 1 1 A 60 60 LEU N N 60 116.935 119.693 -2.758 1
1 270 . 11 1 1 A 61 61 ASP H H 61 7.143 8.466 -1.323 1
1 271 . 11 1 1 A 61 61 ASP HA H 61 4.690 4.455 0.235 1
1 274 . 11 1 1 A 61 61 ASP CA C 61 52.286 55.800 -3.514 1
1 275 . 11 1 1 A 61 61 ASP CB C 61 39.245 40.706 -1.461 1
1 276 . 11 1 1 A 61 61 ASP N N 61 116.605 118.948 -2.343 1
1 277 . 11 1 1 A 62 62 ARG H H 62 7.786 7.892 -0.106 1
1 278 . 11 1 1 A 62 62 ARG CA C 62 58.328 58.869 -0.541 1
1 279 . 11 1 1 A 62 62 ARG CB C 62 30.106 29.821 0.285 1
1 280 . 11 1 1 A 62 62 ARG N N 62 125.967 118.922 7.045 1
1 281 . 11 1 1 A 63 63 ASN H H 63 7.945 8.140 -0.195 1
1 282 . 11 1 1 A 63 63 ASN CA C 63 51.863 55.038 -3.175 1
1 283 . 11 1 1 A 63 63 ASN CB C 63 36.809 38.587 -1.778 1
1 284 . 11 1 1 A 63 63 ASN N N 63 112.434 115.607 -3.173 1
1 285 . 11 1 1 A 64 64 LYS H H 64 7.477 7.682 -0.205 1
1 286 . 11 1 1 A 64 64 LYS CA C 64 56.524 56.024 0.500 1
1 287 . 11 1 1 A 64 64 LYS N N 64 114.197 116.673 -2.476 1
1 288 . 11 1 1 A 65 65 ASP H H 65 8.345 8.799 -0.454 1
1 289 . 11 1 1 A 65 65 ASP CA C 65 52.969 55.478 -2.509 1
1 290 . 11 1 1 A 65 65 ASP CB C 65 40.329 40.295 0.034 1
1 291 . 11 1 1 A 65 65 ASP N N 65 118.581 118.691 -0.110 1
1 292 . 11 1 1 A 66 66 GLN H H 66 9.945 7.796 2.149 1
1 293 . 11 1 1 A 66 66 GLN CA C 66 58.132 56.685 1.447 1
1 294 . 11 1 1 A 66 66 GLN CB C 66 26.035 31.120 -5.085 1
1 295 . 11 1 1 A 66 66 GLN N N 66 113.203 116.909 -3.706 1
1 296 . 11 1 1 A 67 67 GLU H H 67 7.880 7.843 0.037 1
1 297 . 11 1 1 A 67 67 GLU HA H 67 4.910 4.770 0.140 1
1 302 . 11 1 1 A 67 67 GLU CA C 67 54.082 54.603 -0.521 1
1 303 . 11 1 1 A 67 67 GLU CB C 67 33.174 33.577 -0.403 1
1 304 . 11 1 1 A 67 67 GLU N N 67 118.554 116.417 2.137 1
1 305 . 11 1 1 A 68 68 VAL H H 68 9.669 9.208 0.461 1
1 306 . 11 1 1 A 68 68 VAL HA H 68 5.465 4.244 1.221 1
1 314 . 11 1 1 A 68 68 VAL CA C 68 61.079 62.902 -1.823 1
1 315 . 11 1 1 A 68 68 VAL CB C 68 33.280 31.436 1.844 1
1 316 . 11 1 1 A 68 68 VAL N N 68 126.572 123.487 3.085 1
1 317 . 11 1 1 A 69 69 ASN H H 69 8.985 8.850 0.135 1
1 318 . 11 1 1 A 69 69 ASN CA C 69 50.812 53.469 -2.657 1
1 319 . 11 1 1 A 69 69 ASN CB C 69 38.609 40.161 -1.552 1
1 320 . 11 1 1 A 69 69 ASN N N 69 127.472 126.963 0.509 1
1 321 . 11 1 1 A 70 70 PHE H H 70 9.100 8.802 0.298 1
1 322 . 11 1 1 A 70 70 PHE CA C 70 63.279 62.009 1.270 1
1 323 . 11 1 1 A 70 70 PHE CB C 70 38.741 39.008 -0.267 1
1 324 . 11 1 1 A 70 70 PHE N N 70 119.972 126.765 -6.793 1
1 325 . 11 1 1 A 71 71 GLN H H 71 8.342 8.085 0.257 1
1 326 . 11 1 1 A 71 71 GLN HA H 71 3.923 3.484 0.439 1
1 329 . 11 1 1 A 71 71 GLN CA C 71 59.866 58.250 1.616 1
1 330 . 11 1 1 A 71 71 GLN CB C 71 27.878 28.617 -0.739 1
1 331 . 11 1 1 A 71 71 GLN N N 71 118.216 117.063 1.153 1
1 332 . 11 1 1 A 72 72 GLU H H 72 8.721 8.036 0.685 1
1 333 . 11 1 1 A 72 72 GLU HA H 72 4.147 4.023 0.124 1
1 338 . 11 1 1 A 72 72 GLU CA C 72 59.313 59.285 0.028 1
1 339 . 11 1 1 A 72 72 GLU CB C 72 30.233 29.497 0.736 1
1 340 . 11 1 1 A 72 72 GLU N N 72 121.455 120.372 1.083 1
1 341 . 11 1 1 A 73 73 TYR H H 73 8.536 8.007 0.529 1
1 342 . 11 1 1 A 73 73 TYR CA C 73 60.961 61.533 -0.572 1
1 343 . 11 1 1 A 73 73 TYR CB C 73 38.724 38.694 0.030 1
1 344 . 11 1 1 A 73 73 TYR N N 73 123.356 121.947 1.409 1
1 345 . 11 1 1 A 74 74 ILE H H 74 8.642 7.459 1.183 1
1 346 . 11 1 1 A 74 74 ILE CA C 74 61.880 63.747 -1.867 1
1 347 . 11 1 1 A 74 74 ILE CB C 74 36.077 37.105 -1.028 1
1 348 . 11 1 1 A 74 74 ILE N N 74 119.799 119.928 -0.129 1
1 349 . 11 1 1 A 75 75 THR H H 75 7.959 8.123 -0.164 1
1 354 . 11 1 1 A 75 75 THR CA C 75 67.056 66.619 0.437 1
1 355 . 11 1 1 A 75 75 THR CB C 75 68.386 68.732 -0.346 1
1 356 . 11 1 1 A 75 75 THR N N 75 119.486 117.607 1.879 1
1 357 . 11 1 1 A 76 76 PHE H H 76 7.450 8.123 -0.673 1
1 358 . 11 1 1 A 76 76 PHE CA C 76 59.010 61.624 -2.614 1
1 359 . 11 1 1 A 76 76 PHE CB C 76 38.139 39.141 -1.002 1
1 360 . 11 1 1 A 76 76 PHE N N 76 122.873 122.443 0.430 1
1 361 . 11 1 1 A 77 77 LEU H H 77 7.829 8.110 -0.281 1
1 362 . 11 1 1 A 77 77 LEU CA C 77 57.450 57.598 -0.148 1
1 363 . 11 1 1 A 77 77 LEU CB C 77 40.560 41.304 -0.744 1
1 364 . 11 1 1 A 77 77 LEU N N 77 117.405 118.453 -1.048 1
1 365 . 11 1 1 A 78 78 GLY H H 78 8.093 8.127 -0.034 1
1 366 . 11 1 1 A 78 78 GLY HA2 H 78 3.661 3.658 0.003 1
1 367 . 11 1 1 A 78 78 GLY HA3 H 78 3.594 3.669 -0.075 1
1 368 . 11 1 1 A 78 78 GLY CA C 78 47.442 46.989 0.453 1
1 369 . 11 1 1 A 78 78 GLY N N 78 105.528 106.178 -0.650 1
1 370 . 11 1 1 A 79 79 ALA H H 79 7.759 7.458 0.301 1
1 371 . 11 1 1 A 79 79 ALA CA C 79 55.153 54.476 0.677 1
1 372 . 11 1 1 A 79 79 ALA CB C 79 17.768 18.402 -0.634 1
1 373 . 11 1 1 A 79 79 ALA N N 79 124.488 124.881 -0.393 1
1 374 . 11 1 1 A 80 80 LEU H H 80 7.963 7.758 0.205 1
1 375 . 11 1 1 A 80 80 LEU CA C 80 57.464 57.361 0.103 1
1 376 . 11 1 1 A 80 80 LEU CB C 80 41.496 40.743 0.753 1
1 377 . 11 1 1 A 80 80 LEU N N 80 117.869 119.649 -1.780 1
1 378 . 11 1 1 A 81 81 ALA H H 81 8.365 8.152 0.213 1
1 379 . 11 1 1 A 81 81 ALA CA C 81 55.475 54.726 0.749 1
1 380 . 11 1 1 A 81 81 ALA CB C 81 17.483 17.988 -0.505 1
1 381 . 11 1 1 A 81 81 ALA N N 81 119.054 119.708 -0.654 1
1 382 . 11 1 1 A 82 82 MET H H 82 8.112 7.374 0.738 1
1 383 . 11 1 1 A 82 82 MET CA C 82 59.516 57.918 1.598 1
1 384 . 11 1 1 A 82 82 MET CB C 82 32.550 32.255 0.295 1
1 385 . 11 1 1 A 82 82 MET N N 82 115.364 117.446 -2.082 1
1 386 . 11 1 1 A 83 83 ILE H H 83 7.981 8.096 -0.115 1
1 387 . 11 1 1 A 83 83 ILE HA H 83 3.839 3.700 0.139 1
1 391 . 11 1 1 A 83 83 ILE CA C 83 64.467 64.912 -0.445 1
1 392 . 11 1 1 A 83 83 ILE CB C 83 37.312 37.116 0.196 1
1 393 . 11 1 1 A 83 83 ILE N N 83 120.887 119.584 1.303 1
1 394 . 11 1 1 A 84 84 TYR H H 84 8.731 7.816 0.915 1
1 395 . 11 1 1 A 84 84 TYR N N 84 120.933 119.342 1.591 1
1 396 . 11 1 1 A 87 87 ALA H H 87 7.829 8.061 -0.232 1
1 397 . 11 1 1 A 87 87 ALA CA C 87 53.768 54.921 -1.153 1
1 398 . 11 1 1 A 87 87 ALA CB C 87 18.504 18.854 -0.350 1
1 399 . 11 1 1 A 87 87 ALA N N 87 120.274 121.871 -1.597 1
1 400 . 11 1 1 A 88 88 LEU H H 88 7.499 7.836 -0.337 1
1 401 . 11 1 1 A 88 88 LEU CA C 88 55.605 53.916 1.689 1
1 402 . 11 1 1 A 88 88 LEU CB C 88 42.047 40.451 1.596 1
1 403 . 11 1 1 A 88 88 LEU N N 88 117.356 118.741 -1.385 1
1 404 . 11 1 1 A 89 89 LYS H H 89 7.561 8.276 -0.715 1
1 405 . 11 1 1 A 89 89 LYS CA C 89 56.865 56.805 0.060 1
1 406 . 11 1 1 A 89 89 LYS CB C 89 32.592 35.902 -3.310 1
1 407 . 11 1 1 A 89 89 LYS N N 89 119.289 124.351 -5.062 1
1 416 . 11 3 2 C 6 6 GLU H H 190 8.385 8.928 -0.543 1
1 417 . 11 3 2 C 6 6 GLU HA H 190 4.153 4.340 -0.187 1
1 422 . 11 3 2 C 6 6 GLU C C 190 175.031 177.009 -1.978 1
1 423 . 11 3 2 C 6 6 GLU CA C 190 58.866 57.127 1.739 1
1 424 . 11 3 2 C 6 6 GLU CB C 190 30.751 29.562 1.189 1
1 426 . 11 3 2 C 6 6 GLU N N 190 122.715 122.590 0.125 1
1 427 . 11 3 2 C 7 7 GLY H H 191 8.475 8.781 -0.306 1
1 428 . 11 3 2 C 7 7 GLY HA2 H 191 3.887 3.881 0.006 1
1 429 . 11 3 2 C 7 7 GLY HA3 H 191 3.887 3.882 0.005 1
1 430 . 11 3 2 C 7 7 GLY C C 191 177.922 175.490 2.432 1
1 431 . 11 3 2 C 7 7 GLY CA C 191 46.884 46.017 0.867 1
1 432 . 11 3 2 C 7 7 GLY N N 191 109.009 109.144 -0.135 1
1 433 . 11 3 2 C 8 8 LEU HA H 192 4.095 3.915 0.180 1
1 443 . 11 3 2 C 8 8 LEU CA C 192 58.154 58.394 -0.240 1
1 444 . 11 3 2 C 8 8 LEU CB C 192 42.789 41.978 0.811 1
1 448 . 11 3 2 C 9 9 MET H H 193 8.250 8.344 -0.094 1
1 449 . 11 3 2 C 9 9 MET HA H 193 4.150 4.160 -0.010 1
1 457 . 11 3 2 C 9 9 MET C C 193 178.421 178.419 0.002 1
1 458 . 11 3 2 C 9 9 MET CA C 193 58.818 58.258 0.560 1
1 459 . 11 3 2 C 9 9 MET CB C 193 32.360 31.521 0.839 1
1 462 . 11 3 2 C 9 9 MET N N 193 117.049 116.810 0.239 1
1 463 . 11 3 2 C 10 10 ASN H H 194 7.892 8.401 -0.509 1
1 464 . 11 3 2 C 10 10 ASN HA H 194 4.468 4.539 -0.071 1
1 469 . 11 3 2 C 10 10 ASN C C 194 178.099 176.193 1.906 1
1 470 . 11 3 2 C 10 10 ASN CA C 194 56.644 55.399 1.245 1
1 471 . 11 3 2 C 10 10 ASN CB C 194 39.100 38.703 0.397 1
1 472 . 11 3 2 C 10 10 ASN N N 194 117.034 119.086 -2.052 1
1 474 . 11 3 2 C 11 11 VAL H H 195 7.651 7.811 -0.160 1
1 475 . 11 3 2 C 11 11 VAL HA H 195 3.735 3.868 -0.133 1
1 483 . 11 3 2 C 11 11 VAL C C 195 177.657 178.335 -0.678 1
1 484 . 11 3 2 C 11 11 VAL CA C 195 66.710 65.138 1.572 1
1 485 . 11 3 2 C 11 11 VAL CB C 195 32.468 31.919 0.549 1
1 488 . 11 3 2 C 11 11 VAL N N 195 119.878 117.983 1.895 1
1 489 . 11 3 2 C 12 12 LEU H H 196 8.030 7.985 0.045 1
1 490 . 11 3 2 C 12 12 LEU HA H 196 4.013 4.000 0.013 1
1 500 . 11 3 2 C 12 12 LEU C C 196 177.540 179.496 -1.956 1
1 501 . 11 3 2 C 12 12 LEU CA C 196 58.489 57.430 1.059 1
1 502 . 11 3 2 C 12 12 LEU CB C 196 42.457 40.960 1.497 1
1 506 . 11 3 2 C 12 12 LEU N N 196 119.499 120.241 -0.742 1
1 507 . 11 3 2 C 13 13 LYS H H 197 8.015 8.328 -0.313 1
1 508 . 11 3 2 C 13 13 LYS HA H 197 3.949 4.091 -0.142 1
1 517 . 11 3 2 C 13 13 LYS C C 197 178.419 179.118 -0.699 1
1 518 . 11 3 2 C 13 13 LYS CA C 197 60.191 59.508 0.683 1
1 519 . 11 3 2 C 13 13 LYS CB C 197 33.075 32.276 0.799 1
1 523 . 11 3 2 C 13 13 LYS N N 197 117.888 120.950 -3.062 1
1 524 . 11 3 2 C 14 14 LYS H H 198 7.506 7.766 -0.260 1
1 525 . 11 3 2 C 14 14 LYS HA H 198 4.127 4.111 0.016 1
1 534 . 11 3 2 C 14 14 LYS C C 198 178.262 178.529 -0.267 1
1 535 . 11 3 2 C 14 14 LYS CA C 198 59.161 58.228 0.933 1
1 536 . 11 3 2 C 14 14 LYS CB C 198 32.956 32.025 0.931 1
1 540 . 11 3 2 C 14 14 LYS N N 198 118.321 118.101 0.220 1
1 541 . 11 3 2 C 15 15 ILE H H 199 7.780 7.443 0.337 1
1 542 . 11 3 2 C 15 15 ILE HA H 199 3.787 3.957 -0.170 1
1 552 . 11 3 2 C 15 15 ILE C C 199 178.647 178.004 0.643 1
1 553 . 11 3 2 C 15 15 ILE CA C 199 64.912 63.921 0.991 1
1 554 . 11 3 2 C 15 15 ILE CB C 199 38.780 37.773 1.007 1
1 558 . 11 3 2 C 15 15 ILE N N 199 118.644 118.708 -0.064 1
1 559 . 11 3 2 C 16 16 TYR H H 200 7.918 8.375 -0.457 1
1 560 . 11 3 2 C 16 16 TYR HA H 200 4.252 3.928 0.324 1
1 567 . 11 3 2 C 16 16 TYR C C 200 177.806 177.528 0.278 1
1 568 . 11 3 2 C 16 16 TYR CA C 200 61.171 61.870 -0.699 1
1 569 . 11 3 2 C 16 16 TYR CB C 200 39.245 39.289 -0.044 1
1 573 . 11 3 2 C 16 16 TYR N N 200 118.683 121.671 -2.988 1
1 574 . 11 3 2 C 17 17 GLU H H 201 8.089 8.675 -0.586 1
1 575 . 11 3 2 C 17 17 GLU HA H 201 4.124 4.012 0.112 1
1 580 . 11 3 2 C 17 17 GLU C C 201 177.414 176.338 1.076 1
1 581 . 11 3 2 C 17 17 GLU CA C 201 58.784 58.075 0.709 1
1 582 . 11 3 2 C 17 17 GLU CB C 201 30.747 28.202 2.545 1
1 584 . 11 3 2 C 17 17 GLU N N 201 119.409 115.489 3.920 1
1 585 . 11 3 2 C 18 18 ASP H H 202 8.023 7.907 0.116 1
1 586 . 11 3 2 C 18 18 ASP HA H 202 4.657 4.801 -0.144 1
1 589 . 11 3 2 C 18 18 ASP C C 202 177.346 176.485 0.861 1
1 590 . 11 3 2 C 18 18 ASP CA C 202 55.496 53.219 2.277 1
1 591 . 11 3 2 C 18 18 ASP CB C 202 42.023 40.923 1.100 1
1 592 . 11 3 2 C 18 18 ASP N N 202 119.459 119.389 0.070 1
1 593 . 11 3 2 C 19 19 GLY H H 203 7.933 7.836 0.097 1
1 594 . 11 3 2 C 19 19 GLY HA2 H 203 3.938 4.084 -0.146 1
1 595 . 11 3 2 C 19 19 GLY HA3 H 203 3.938 4.105 -0.167 1
1 596 . 11 3 2 C 19 19 GLY C C 203 177.240 172.814 4.426 1
1 597 . 11 3 2 C 19 19 GLY CA C 203 46.309 45.453 0.856 1
1 598 . 11 3 2 C 19 19 GLY N N 203 108.518 107.943 0.575 1
1 599 . 11 3 2 C 20 20 ASP H H 204 8.091 8.435 -0.344 1
1 600 . 11 3 2 C 20 20 ASP HA H 204 4.616 4.655 -0.039 1
1 603 . 11 3 2 C 20 20 ASP C C 204 173.979 176.062 -2.083 1
1 604 . 11 3 2 C 20 20 ASP CA C 204 55.064 54.207 0.857 1
1 605 . 11 3 2 C 20 20 ASP CB C 204 42.203 42.193 0.010 1
1 606 . 11 3 2 C 20 20 ASP N N 204 120.172 121.658 -1.486 1
1 607 . 11 3 2 C 21 21 ASP H H 205 8.352 8.893 -0.541 1
1 608 . 11 3 2 C 21 21 ASP HA H 205 4.468 4.798 -0.330 1
1 611 . 11 3 2 C 21 21 ASP C C 205 176.432 176.751 -0.319 1
1 612 . 11 3 2 C 21 21 ASP CA C 205 56.663 53.453 3.210 1
1 613 . 11 3 2 C 21 21 ASP CB C 205 41.918 42.058 -0.140 1
1 614 . 11 3 2 C 21 21 ASP N N 205 121.515 124.013 -2.498 1
1 615 . 11 3 2 C 22 22 ASP H H 206 8.239 8.013 0.226 1
1 616 . 11 3 2 C 22 22 ASP HA H 206 4.455 4.543 -0.088 1
1 619 . 11 3 2 C 22 22 ASP C C 206 177.449 178.469 -1.020 1
1 620 . 11 3 2 C 22 22 ASP CA C 206 57.165 56.497 0.668 1
1 621 . 11 3 2 C 22 22 ASP CB C 206 41.820 40.836 0.984 1
1 622 . 11 3 2 C 22 22 ASP N N 206 120.156 119.747 0.409 1
1 623 . 11 3 2 C 23 23 MET H H 207 8.300 8.339 -0.039 1
1 624 . 11 3 2 C 23 23 MET HA H 207 4.255 4.010 0.245 1
1 632 . 11 3 2 C 23 23 MET C C 207 178.412 178.009 0.403 1
1 633 . 11 3 2 C 23 23 MET CA C 207 58.065 58.613 -0.548 1
1 634 . 11 3 2 C 23 23 MET CB C 207 32.488 32.018 0.470 1
1 637 . 11 3 2 C 23 23 MET N N 207 120.707 119.757 0.950 1
1 638 . 11 3 2 C 24 24 LYS H H 208 8.047 8.246 -0.199 1
1 639 . 11 3 2 C 24 24 LYS HA H 208 3.946 4.068 -0.122 1
1 648 . 11 3 2 C 24 24 LYS C C 208 178.008 178.633 -0.625 1
1 649 . 11 3 2 C 24 24 LYS CA C 208 59.847 59.442 0.405 1
1 650 . 11 3 2 C 24 24 LYS CB C 208 32.983 32.368 0.615 1
1 654 . 11 3 2 C 24 24 LYS N N 208 119.504 117.846 1.658 1
1 655 . 11 3 2 C 25 25 ARG H H 209 7.891 7.623 0.268 1
1 656 . 11 3 2 C 25 25 ARG HA H 209 4.168 4.087 0.081 1
1 663 . 11 3 2 C 25 25 ARG C C 209 178.100 179.000 -0.900 1
1 664 . 11 3 2 C 25 25 ARG CA C 209 58.810 59.252 -0.442 1
1 665 . 11 3 2 C 25 25 ARG CB C 209 31.080 30.175 0.905 1
1 668 . 11 3 2 C 25 25 ARG N N 209 118.378 119.415 -1.037 1
1 669 . 11 3 2 C 26 26 THR H H 210 7.869 8.273 -0.404 1
1 670 . 11 3 2 C 26 26 THR HA H 210 4.023 4.051 -0.028 1
1 675 . 11 3 2 C 26 26 THR C C 210 177.984 176.827 1.157 1
1 676 . 11 3 2 C 26 26 THR CA C 210 65.747 66.968 -1.221 1
1 677 . 11 3 2 C 26 26 THR CB C 210 69.683 67.993 1.690 1
1 679 . 11 3 2 C 26 26 THR N N 210 115.443 118.873 -3.430 1
1 680 . 11 3 2 C 27 27 ILE H H 211 7.901 8.334 -0.433 1
1 681 . 11 3 2 C 27 27 ILE HA H 211 4.142 3.648 0.494 1
1 691 . 11 3 2 C 27 27 ILE C C 211 175.595 177.651 -2.056 1
1 692 . 11 3 2 C 27 27 ILE CA C 211 63.528 65.971 -2.443 1
1 693 . 11 3 2 C 27 27 ILE CB C 211 38.982 37.823 1.159 1
1 697 . 11 3 2 C 27 27 ILE N N 211 121.265 121.372 -0.107 1
1 698 . 11 3 2 C 28 28 ASN HA H 212 4.465 4.584 -0.119 1
1 703 . 11 3 2 C 28 28 ASN CA C 212 55.182 56.509 -1.327 1
1 704 . 11 3 2 C 28 28 ASN CB C 212 39.480 37.665 1.815 1
1 706 . 11 3 2 C 29 29 LYS H H 213 7.968 7.960 0.008 1
1 707 . 11 3 2 C 29 29 LYS HA H 213 4.072 4.062 0.010 1
1 716 . 11 3 2 C 29 29 LYS C C 213 176.218 179.576 -3.358 1
1 717 . 11 3 2 C 29 29 LYS CA C 213 58.489 59.528 -1.039 1
1 718 . 11 3 2 C 29 29 LYS CB C 213 33.165 32.275 0.890 1
1 722 . 11 3 2 C 29 29 LYS N N 213 120.820 119.466 1.354 1
1 723 . 11 3 2 C 30 30 ALA H H 214 7.865 8.486 -0.621 1
1 724 . 11 3 2 C 30 30 ALA HA H 214 4.217 4.148 0.069 1
1 728 . 11 3 2 C 30 30 ALA C C 214 177.041 179.954 -2.913 1
1 729 . 11 3 2 C 30 30 ALA CA C 214 54.104 54.804 -0.700 1
1 730 . 11 3 2 C 30 30 ALA CB C 214 19.496 18.471 1.025 1
1 731 . 11 3 2 C 30 30 ALA N N 214 121.571 121.624 -0.053 1
1 732 . 11 3 2 C 31 31 TRP H H 215 7.831 7.624 0.207 1
1 733 . 11 3 2 C 31 31 TRP HA H 215 4.598 4.260 0.338 1
1 742 . 11 3 2 C 31 31 TRP C C 215 178.088 177.827 0.261 1
1 743 . 11 3 2 C 31 31 TRP CA C 215 58.432 60.812 -2.380 1
1 744 . 11 3 2 C 31 31 TRP CB C 215 30.472 29.627 0.845 1
1 750 . 11 3 2 C 31 31 TRP N N 215 118.141 120.854 -2.713 1
1 752 . 11 3 2 C 32 32 VAL H H 216 7.594 8.162 -0.568 1
1 753 . 11 3 2 C 32 32 VAL HA H 216 3.978 3.953 0.025 1
1 761 . 11 3 2 C 32 32 VAL C C 216 176.574 178.347 -1.773 1
1 762 . 11 3 2 C 32 32 VAL CA C 216 63.329 65.685 -2.356 1
1 763 . 11 3 2 C 32 32 VAL CB C 216 33.373 31.342 2.031 1
1 766 . 11 3 2 C 32 32 VAL N N 216 118.287 118.884 -0.597 1
1 767 . 11 3 2 C 33 33 GLU H H 217 8.012 8.398 -0.386 1
1 768 . 11 3 2 C 33 33 GLU HA H 217 4.257 4.309 -0.052 1
1 773 . 11 3 2 C 33 33 GLU C C 217 176.164 177.865 -1.701 1
1 774 . 11 3 2 C 33 33 GLU CA C 217 57.409 58.525 -1.116 1
1 775 . 11 3 2 C 33 33 GLU CB C 217 30.978 28.981 1.997 1
1 777 . 11 3 2 C 33 33 GLU N N 217 122.535 121.672 0.863 1
1 778 . 11 3 2 C 34 34 SER H H 218 8.037 8.003 0.034 1
1 779 . 11 3 2 C 34 34 SER HA H 218 4.514 4.317 0.197 1
1 782 . 11 3 2 C 34 34 SER C C 218 176.451 175.416 1.035 1
1 783 . 11 3 2 C 34 34 SER CA C 218 58.987 60.596 -1.609 1
1 784 . 11 3 2 C 34 34 SER CB C 218 64.569 63.204 1.365 1
1 785 . 11 3 2 C 34 34 SER N N 218 117.058 114.696 2.362 1
1 6 . 12 1 1 A 2 2 ALA H H 2 8.191 9.045 -0.854 1
1 7 . 12 1 1 A 2 2 ALA CA C 2 51.957 54.714 -2.757 1
1 8 . 12 1 1 A 2 2 ALA CB C 2 19.580 18.796 0.784 1
1 9 . 12 1 1 A 2 2 ALA N N 2 124.666 126.791 -2.125 1
1 10 . 12 1 1 A 3 3 SER H H 3 8.829 8.205 0.624 1
1 11 . 12 1 1 A 3 3 SER CA C 3 57.221 62.242 -5.021 1
1 12 . 12 1 1 A 3 3 SER N N 3 119.917 113.035 6.882 1
1 13 . 12 1 1 A 4 4 PRO CA C 4 66.688 65.961 0.727 1
1 14 . 12 1 1 A 4 4 PRO CB C 4 32.553 30.842 1.711 1
1 15 . 12 1 1 A 5 5 LEU H H 5 9.146 7.216 1.930 1
1 16 . 12 1 1 A 5 5 LEU CA C 5 59.017 57.089 1.928 1
1 17 . 12 1 1 A 5 5 LEU CB C 5 42.341 42.026 0.315 1
1 18 . 12 1 1 A 5 5 LEU N N 5 117.902 116.628 1.274 1
1 19 . 12 1 1 A 6 6 ASP H H 6 7.572 8.463 -0.891 1
1 20 . 12 1 1 A 6 6 ASP CA C 6 57.997 57.358 0.639 1
1 21 . 12 1 1 A 6 6 ASP CB C 6 40.910 40.060 0.850 1
1 22 . 12 1 1 A 6 6 ASP N N 6 118.259 118.342 -0.083 1
1 23 . 12 1 1 A 7 7 GLN H H 7 8.660 8.215 0.445 1
1 24 . 12 1 1 A 7 7 GLN HA H 7 4.064 4.112 -0.048 1
1 29 . 12 1 1 A 7 7 GLN CA C 7 59.270 58.806 0.464 1
1 30 . 12 1 1 A 7 7 GLN CB C 7 28.468 28.020 0.448 1
1 31 . 12 1 1 A 7 7 GLN N N 7 119.558 118.277 1.281 1
1 32 . 12 1 1 A 8 8 ALA H H 8 8.253 7.694 0.559 1
1 33 . 12 1 1 A 8 8 ALA CA C 8 55.519 54.993 0.526 1
1 34 . 12 1 1 A 8 8 ALA CB C 8 18.113 18.403 -0.290 1
1 35 . 12 1 1 A 8 8 ALA N N 8 123.628 122.037 1.591 1
1 36 . 12 1 1 A 9 9 ILE H H 9 8.134 8.224 -0.090 1
1 37 . 12 1 1 A 9 9 ILE CA C 9 65.261 64.238 1.023 1
1 38 . 12 1 1 A 9 9 ILE CB C 9 37.023 37.236 -0.213 1
1 39 . 12 1 1 A 9 9 ILE N N 9 117.056 117.017 0.039 1
1 40 . 12 1 1 A 10 10 GLY H H 10 8.515 8.219 0.296 1
1 41 . 12 1 1 A 10 10 GLY HA3 H 10 3.773 3.727 0.046 1
1 42 . 12 1 1 A 10 10 GLY CA C 10 47.637 47.421 0.216 1
1 43 . 12 1 1 A 10 10 GLY N N 10 106.202 111.029 -4.827 1
1 44 . 12 1 1 A 11 11 LEU H H 11 8.212 8.275 -0.063 1
1 45 . 12 1 1 A 11 11 LEU CA C 11 58.354 57.703 0.651 1
1 46 . 12 1 1 A 11 11 LEU CB C 11 41.683 41.489 0.194 1
1 47 . 12 1 1 A 11 11 LEU N N 11 124.624 122.975 1.649 1
1 48 . 12 1 1 A 12 12 LEU H H 12 7.971 7.838 0.133 1
1 49 . 12 1 1 A 12 12 LEU HA H 12 4.144 4.251 -0.107 1
1 59 . 12 1 1 A 12 12 LEU CA C 12 58.691 58.468 0.223 1
1 60 . 12 1 1 A 12 12 LEU CB C 12 40.657 41.651 -0.994 1
1 61 . 12 1 1 A 12 12 LEU N N 12 118.095 118.262 -0.167 1
1 62 . 12 1 1 A 13 13 ILE H H 13 8.379 8.150 0.229 1
1 63 . 12 1 1 A 13 13 ILE CA C 13 66.405 65.218 1.187 1
1 64 . 12 1 1 A 13 13 ILE CB C 13 38.916 37.868 1.048 1
1 65 . 12 1 1 A 13 13 ILE N N 13 121.161 120.215 0.946 1
1 66 . 12 1 1 A 14 14 GLY H H 14 8.823 8.435 0.388 1
1 67 . 12 1 1 A 14 14 GLY HA2 H 14 4.147 3.717 0.430 1
1 68 . 12 1 1 A 14 14 GLY HA3 H 14 3.982 3.720 0.262 1
1 69 . 12 1 1 A 14 14 GLY CA C 14 47.750 46.995 0.755 1
1 70 . 12 1 1 A 14 14 GLY N N 14 108.982 107.625 1.357 1
1 71 . 12 1 1 A 15 15 ILE H H 15 8.681 8.150 0.531 1
1 72 . 12 1 1 A 15 15 ILE CA C 15 64.996 64.916 0.080 1
1 73 . 12 1 1 A 15 15 ILE CB C 15 37.107 37.851 -0.744 1
1 74 . 12 1 1 A 15 15 ILE N N 15 121.601 122.388 -0.787 1
1 75 . 12 1 1 A 16 16 PHE H H 16 7.103 8.662 -1.559 1
1 76 . 12 1 1 A 16 16 PHE CA C 16 62.910 61.254 1.656 1
1 77 . 12 1 1 A 16 16 PHE CB C 16 38.782 39.100 -0.318 1
1 78 . 12 1 1 A 16 16 PHE N N 16 118.660 121.024 -2.364 1
1 79 . 12 1 1 A 17 17 HIS H H 17 7.591 8.467 -0.876 1
1 80 . 12 1 1 A 17 17 HIS HA H 17 4.793 3.886 0.907 1
1 82 . 12 1 1 A 17 17 HIS CA C 17 58.125 58.895 -0.770 1
1 83 . 12 1 1 A 17 17 HIS CB C 17 29.584 30.029 -0.445 1
1 84 . 12 1 1 A 17 17 HIS N N 17 114.968 118.703 -3.735 1
1 85 . 12 1 1 A 18 18 LYS H H 18 8.144 8.322 -0.178 1
1 86 . 12 1 1 A 18 18 LYS CA C 18 58.975 59.197 -0.222 1
1 87 . 12 1 1 A 18 18 LYS CB C 18 32.379 32.040 0.339 1
1 88 . 12 1 1 A 18 18 LYS N N 18 122.373 118.748 3.625 1
1 89 . 12 1 1 A 19 19 TYR H H 19 6.999 7.414 -0.415 1
1 90 . 12 1 1 A 19 19 TYR CA C 19 60.318 60.547 -0.229 1
1 91 . 12 1 1 A 19 19 TYR CB C 19 40.355 38.383 1.972 1
1 92 . 12 1 1 A 19 19 TYR N N 19 113.614 118.456 -4.842 1
1 93 . 12 1 1 A 20 20 SER H H 20 8.432 7.969 0.463 1
1 94 . 12 1 1 A 20 20 SER CA C 20 61.897 62.179 -0.282 1
1 95 . 12 1 1 A 20 20 SER CB C 20 61.354 62.171 -0.817 1
1 96 . 12 1 1 A 20 20 SER N N 20 113.201 115.938 -2.737 1
1 97 . 12 1 1 A 21 21 GLY H H 21 7.678 7.773 -0.095 1
1 98 . 12 1 1 A 21 21 GLY HA2 H 21 4.195 3.384 0.811 1
1 99 . 12 1 1 A 21 21 GLY HA3 H 21 3.900 3.799 0.101 1
1 100 . 12 1 1 A 21 21 GLY CA C 21 45.628 45.900 -0.272 1
1 101 . 12 1 1 A 21 21 GLY N N 21 110.734 108.469 2.265 1
1 102 . 12 1 1 A 22 22 LYS H H 22 7.362 7.573 -0.211 1
1 103 . 12 1 1 A 22 22 LYS CA C 22 60.163 58.884 1.279 1
1 104 . 12 1 1 A 22 22 LYS CB C 22 32.554 32.148 0.406 1
1 105 . 12 1 1 A 22 22 LYS N N 22 122.161 120.804 1.357 1
1 106 . 12 1 1 A 23 23 GLU H H 23 9.639 7.984 1.655 1
1 107 . 12 1 1 A 23 23 GLU CA C 23 54.449 55.707 -1.258 1
1 108 . 12 1 1 A 23 23 GLU N N 23 116.288 115.583 0.705 1
1 109 . 12 1 1 A 24 24 GLY HA2 H 24 3.912 3.903 0.009 1
1 110 . 12 1 1 A 24 24 GLY HA3 H 24 3.787 3.906 -0.119 1
1 111 . 12 1 1 A 24 24 GLY CA C 24 45.898 45.572 0.326 1
1 112 . 12 1 1 A 25 25 ASP H H 25 8.204 7.855 0.349 1
1 113 . 12 1 1 A 25 25 ASP CA C 25 55.252 52.111 3.141 1
1 114 . 12 1 1 A 25 25 ASP N N 25 125.671 120.851 4.820 1
1 115 . 12 1 1 A 26 26 LYS CA C 26 57.851 56.412 1.439 1
1 116 . 12 1 1 A 26 26 LYS CB C 26 31.265 33.255 -1.990 1
1 117 . 12 1 1 A 27 27 HIS H H 27 9.763 9.094 0.669 1
1 118 . 12 1 1 A 27 27 HIS CA C 27 55.580 55.923 -0.343 1
1 119 . 12 1 1 A 27 27 HIS CB C 27 30.936 29.419 1.517 1
1 120 . 12 1 1 A 27 27 HIS N N 27 118.108 122.767 -4.659 1
1 121 . 12 1 1 A 28 28 THR H H 28 7.325 7.842 -0.517 1
1 126 . 12 1 1 A 28 28 THR CA C 28 60.128 60.221 -0.093 1
1 127 . 12 1 1 A 28 28 THR CB C 28 72.268 71.820 0.448 1
1 128 . 12 1 1 A 28 28 THR N N 28 106.920 114.781 -7.861 1
1 129 . 12 1 1 A 29 29 LEU H H 29 9.422 9.352 0.070 1
1 130 . 12 1 1 A 29 29 LEU HA H 29 5.368 5.052 0.316 1
1 140 . 12 1 1 A 29 29 LEU CA C 29 52.567 53.394 -0.827 1
1 141 . 12 1 1 A 29 29 LEU CB C 29 43.523 44.095 -0.572 1
1 142 . 12 1 1 A 29 29 LEU N N 29 125.021 127.545 -2.524 1
1 143 . 12 1 1 A 30 30 SER H H 30 10.485 8.891 1.594 1
1 144 . 12 1 1 A 30 30 SER CA C 30 56.653 57.204 -0.551 1
1 145 . 12 1 1 A 30 30 SER CB C 30 65.313 65.549 -0.236 1
1 146 . 12 1 1 A 30 30 SER N N 30 124.758 118.335 6.423 1
1 147 . 12 1 1 A 31 31 LYS H H 31 8.728 8.846 -0.118 1
1 148 . 12 1 1 A 31 31 LYS CA C 31 59.669 59.057 0.612 1
1 149 . 12 1 1 A 31 31 LYS CB C 31 31.763 31.888 -0.125 1
1 150 . 12 1 1 A 31 31 LYS N N 31 119.459 119.417 0.042 1
1 151 . 12 1 1 A 32 32 LYS H H 32 7.857 7.894 -0.037 1
1 152 . 12 1 1 A 32 32 LYS CA C 32 59.721 59.386 0.335 1
1 153 . 12 1 1 A 32 32 LYS CB C 32 32.901 32.222 0.679 1
1 154 . 12 1 1 A 32 32 LYS N N 32 117.933 119.803 -1.870 1
1 155 . 12 1 1 A 33 33 GLU H H 33 7.559 7.878 -0.319 1
1 156 . 12 1 1 A 33 33 GLU CA C 33 59.169 58.980 0.189 1
1 157 . 12 1 1 A 33 33 GLU CB C 33 31.014 29.270 1.744 1
1 158 . 12 1 1 A 33 33 GLU N N 33 120.407 119.403 1.004 1
1 159 . 12 1 1 A 34 34 LEU H H 34 8.833 8.446 0.387 1
1 160 . 12 1 1 A 34 34 LEU CA C 34 56.928 58.033 -1.105 1
1 161 . 12 1 1 A 34 34 LEU CB C 34 41.435 41.849 -0.414 1
1 162 . 12 1 1 A 34 34 LEU N N 34 117.677 121.337 -3.660 1
1 163 . 12 1 1 A 35 35 LYS H H 35 8.010 7.707 0.303 1
1 164 . 12 1 1 A 35 35 LYS CA C 35 60.692 60.098 0.594 1
1 165 . 12 1 1 A 35 35 LYS CB C 35 32.223 31.978 0.245 1
1 166 . 12 1 1 A 35 35 LYS N N 35 119.829 118.751 1.078 1
1 167 . 12 1 1 A 36 36 GLU H H 36 7.169 8.072 -0.903 1
1 168 . 12 1 1 A 36 36 GLU CA C 36 59.588 58.904 0.684 1
1 169 . 12 1 1 A 36 36 GLU CB C 36 29.342 29.653 -0.311 1
1 170 . 12 1 1 A 36 36 GLU N N 36 117.340 120.478 -3.138 1
1 171 . 12 1 1 A 37 37 LEU H H 37 7.478 7.582 -0.104 1
1 172 . 12 1 1 A 37 37 LEU CA C 37 59.674 57.702 1.972 1
1 173 . 12 1 1 A 37 37 LEU CB C 37 42.142 41.258 0.884 1
1 174 . 12 1 1 A 37 37 LEU N N 37 120.884 121.215 -0.331 1
1 175 . 12 1 1 A 38 38 ILE H H 38 8.377 8.093 0.284 1
1 176 . 12 1 1 A 38 38 ILE CA C 38 65.651 65.104 0.547 1
1 177 . 12 1 1 A 38 38 ILE N N 38 118.450 119.890 -1.440 1
1 178 . 12 1 1 A 39 39 GLN H H 39 8.217 8.093 0.124 1
1 179 . 12 1 1 A 39 39 GLN CA C 39 59.788 58.957 0.831 1
1 180 . 12 1 1 A 39 39 GLN CB C 39 29.278 28.069 1.209 1
1 181 . 12 1 1 A 39 39 GLN N N 39 113.091 118.254 -5.163 1
1 182 . 12 1 1 A 40 40 LYS H H 40 8.426 7.453 0.973 1
1 183 . 12 1 1 A 40 40 LYS CA C 40 57.807 58.918 -1.111 1
1 184 . 12 1 1 A 40 40 LYS CB C 40 33.942 32.298 1.644 1
1 185 . 12 1 1 A 40 40 LYS N N 40 114.771 120.428 -5.657 1
1 186 . 12 1 1 A 41 41 GLU H H 41 8.496 8.127 0.369 1
1 187 . 12 1 1 A 41 41 GLU CA C 41 55.395 58.701 -3.306 1
1 188 . 12 1 1 A 41 41 GLU CB C 41 29.260 30.396 -1.136 1
1 189 . 12 1 1 A 41 41 GLU N N 41 112.546 118.250 -5.704 1
1 190 . 12 1 1 A 42 42 LEU H H 42 7.267 8.162 -0.895 1
1 191 . 12 1 1 A 42 42 LEU CA C 42 53.776 54.058 -0.282 1
1 192 . 12 1 1 A 42 42 LEU N N 42 118.657 118.792 -0.135 1
1 193 . 12 1 1 A 44 44 ILE CA C 44 62.210 61.375 0.835 1
1 194 . 12 1 1 A 44 44 ILE CB C 44 38.247 38.914 -0.667 1
1 195 . 12 1 1 A 45 45 GLY H H 45 7.820 7.965 -0.145 1
1 196 . 12 1 1 A 45 45 GLY CA C 45 47.742 44.426 3.316 1
1 197 . 12 1 1 A 45 45 GLY N N 45 108.178 112.210 -4.032 1
1 198 . 12 1 1 A 46 46 SER H H 46 7.895 8.445 -0.550 1
1 199 . 12 1 1 A 46 46 SER CA C 46 59.958 57.894 2.064 1
1 200 . 12 1 1 A 46 46 SER CB C 46 63.450 61.823 1.627 1
1 201 . 12 1 1 A 46 46 SER N N 46 113.038 116.920 -3.882 1
1 202 . 12 1 1 A 47 47 LYS H H 47 7.736 7.778 -0.042 1
1 203 . 12 1 1 A 47 47 LYS CA C 47 55.636 54.818 0.818 1
1 204 . 12 1 1 A 47 47 LYS CB C 47 33.103 34.646 -1.543 1
1 205 . 12 1 1 A 47 47 LYS N N 47 119.422 121.080 -1.658 1
1 206 . 12 1 1 A 48 48 LEU H H 48 6.988 8.668 -1.680 1
1 207 . 12 1 1 A 48 48 LEU HA H 48 4.497 4.027 0.470 1
1 217 . 12 1 1 A 48 48 LEU CA C 48 54.517 57.049 -2.532 1
1 218 . 12 1 1 A 48 48 LEU CB C 48 42.987 41.871 1.116 1
1 219 . 12 1 1 A 48 48 LEU N N 48 118.908 117.827 1.081 1
1 220 . 12 1 1 A 49 49 GLN H H 49 9.206 8.074 1.132 1
1 221 . 12 1 1 A 49 49 GLN HA H 49 4.486 4.365 0.121 1
1 223 . 12 1 1 A 49 49 GLN CA C 49 54.785 57.963 -3.178 1
1 224 . 12 1 1 A 49 49 GLN CB C 49 29.636 28.526 1.110 1
1 225 . 12 1 1 A 49 49 GLN N N 49 121.275 118.166 3.109 1
1 226 . 12 1 1 A 50 50 ASP H H 50 8.854 8.066 0.788 1
1 227 . 12 1 1 A 50 50 ASP CA C 50 59.078 57.373 1.705 1
1 228 . 12 1 1 A 50 50 ASP CB C 50 40.632 41.712 -1.080 1
1 229 . 12 1 1 A 50 50 ASP N N 50 123.430 120.187 3.243 1
1 230 . 12 1 1 A 51 51 ALA H H 51 8.720 7.963 0.757 1
1 231 . 12 1 1 A 51 51 ALA CA C 51 55.281 54.871 0.410 1
1 232 . 12 1 1 A 51 51 ALA CB C 51 18.205 18.216 -0.011 1
1 233 . 12 1 1 A 51 51 ALA N N 51 117.829 121.212 -3.383 1
1 234 . 12 1 1 A 52 52 GLU H H 52 7.161 7.838 -0.677 1
1 235 . 12 1 1 A 52 52 GLU CA C 52 58.757 59.001 -0.244 1
1 236 . 12 1 1 A 52 52 GLU CB C 52 30.247 29.665 0.582 1
1 237 . 12 1 1 A 52 52 GLU N N 52 115.459 117.393 -1.934 1
1 238 . 12 1 1 A 53 53 ILE H H 53 7.962 7.613 0.349 1
1 239 . 12 1 1 A 53 53 ILE CA C 53 65.525 64.948 0.577 1
1 240 . 12 1 1 A 53 53 ILE CB C 53 37.289 37.672 -0.383 1
1 241 . 12 1 1 A 53 53 ILE N N 53 120.414 121.348 -0.934 1
1 242 . 12 1 1 A 54 54 VAL H H 54 8.132 8.074 0.058 1
1 243 . 12 1 1 A 54 54 VAL CA C 54 67.290 65.623 1.667 1
1 244 . 12 1 1 A 54 54 VAL CB C 54 31.434 31.303 0.131 1
1 245 . 12 1 1 A 54 54 VAL N N 54 119.775 117.312 2.463 1
1 246 . 12 1 1 A 55 55 LYS H H 55 7.155 7.994 -0.839 1
1 247 . 12 1 1 A 55 55 LYS CA C 55 59.131 59.135 -0.004 1
1 248 . 12 1 1 A 55 55 LYS CB C 55 32.131 31.939 0.192 1
1 249 . 12 1 1 A 55 55 LYS N N 55 119.175 120.912 -1.737 1
1 250 . 12 1 1 A 56 56 LEU H H 56 7.837 8.274 -0.437 1
1 251 . 12 1 1 A 56 56 LEU CA C 56 58.052 58.010 0.042 1
1 252 . 12 1 1 A 56 56 LEU CB C 56 41.878 41.574 0.304 1
1 253 . 12 1 1 A 56 56 LEU N N 56 119.679 121.113 -1.434 1
1 254 . 12 1 1 A 57 57 MET H H 57 8.385 8.738 -0.353 1
1 255 . 12 1 1 A 57 57 MET CA C 57 60.756 58.709 2.047 1
1 256 . 12 1 1 A 57 57 MET CB C 57 33.152 31.913 1.239 1
1 257 . 12 1 1 A 57 57 MET N N 57 115.116 119.404 -4.288 1
1 258 . 12 1 1 A 58 58 ASP H H 58 7.591 8.233 -0.642 1
1 259 . 12 1 1 A 58 58 ASP CA C 58 57.365 57.564 -0.199 1
1 260 . 12 1 1 A 58 58 ASP CB C 58 40.858 41.417 -0.559 1
1 261 . 12 1 1 A 58 58 ASP N N 58 118.197 119.746 -1.549 1
1 262 . 12 1 1 A 59 59 ASP H H 59 7.725 7.816 -0.091 1
1 263 . 12 1 1 A 59 59 ASP CA C 59 56.830 56.728 0.102 1
1 264 . 12 1 1 A 59 59 ASP CB C 59 40.567 40.460 0.107 1
1 265 . 12 1 1 A 59 59 ASP N N 59 118.481 117.638 0.843 1
1 266 . 12 1 1 A 60 60 LEU H H 60 7.703 7.693 0.010 1
1 267 . 12 1 1 A 60 60 LEU CA C 60 56.564 57.485 -0.921 1
1 268 . 12 1 1 A 60 60 LEU CB C 60 42.714 41.157 1.557 1
1 269 . 12 1 1 A 60 60 LEU N N 60 116.935 119.985 -3.050 1
1 270 . 12 1 1 A 61 61 ASP H H 61 7.143 8.576 -1.433 1
1 271 . 12 1 1 A 61 61 ASP HA H 61 4.690 4.420 0.270 1
1 274 . 12 1 1 A 61 61 ASP CA C 61 52.286 56.630 -4.344 1
1 275 . 12 1 1 A 61 61 ASP CB C 61 39.245 41.485 -2.240 1
1 276 . 12 1 1 A 61 61 ASP N N 61 116.605 119.217 -2.612 1
1 277 . 12 1 1 A 62 62 ARG H H 62 7.786 7.759 0.027 1
1 278 . 12 1 1 A 62 62 ARG CA C 62 58.328 59.177 -0.849 1
1 279 . 12 1 1 A 62 62 ARG CB C 62 30.106 30.174 -0.068 1
1 280 . 12 1 1 A 62 62 ARG N N 62 125.967 118.391 7.576 1
1 281 . 12 1 1 A 63 63 ASN H H 63 7.945 7.680 0.265 1
1 282 . 12 1 1 A 63 63 ASN CA C 63 51.863 55.342 -3.479 1
1 283 . 12 1 1 A 63 63 ASN CB C 63 36.809 39.387 -2.578 1
1 284 . 12 1 1 A 63 63 ASN N N 63 112.434 116.032 -3.598 1
1 285 . 12 1 1 A 64 64 LYS H H 64 7.477 7.618 -0.141 1
1 286 . 12 1 1 A 64 64 LYS CA C 64 56.524 55.978 0.546 1
1 287 . 12 1 1 A 64 64 LYS N N 64 114.197 118.179 -3.982 1
1 288 . 12 1 1 A 65 65 ASP H H 65 8.345 8.822 -0.477 1
1 289 . 12 1 1 A 65 65 ASP CA C 65 52.969 54.598 -1.629 1
1 290 . 12 1 1 A 65 65 ASP CB C 65 40.329 40.686 -0.357 1
1 291 . 12 1 1 A 65 65 ASP N N 65 118.581 125.516 -6.935 1
1 292 . 12 1 1 A 66 66 GLN H H 66 9.945 9.150 0.795 1
1 293 . 12 1 1 A 66 66 GLN CA C 66 58.132 57.664 0.468 1
1 294 . 12 1 1 A 66 66 GLN CB C 66 26.035 28.590 -2.555 1
1 295 . 12 1 1 A 66 66 GLN N N 66 113.203 119.610 -6.407 1
1 296 . 12 1 1 A 67 67 GLU H H 67 7.880 8.125 -0.245 1
1 297 . 12 1 1 A 67 67 GLU HA H 67 4.910 4.964 -0.054 1
1 302 . 12 1 1 A 67 67 GLU CA C 67 54.082 55.099 -1.017 1
1 303 . 12 1 1 A 67 67 GLU CB C 67 33.174 31.977 1.197 1
1 304 . 12 1 1 A 67 67 GLU N N 67 118.554 117.318 1.236 1
1 305 . 12 1 1 A 68 68 VAL H H 68 9.669 9.583 0.086 1
1 306 . 12 1 1 A 68 68 VAL HA H 68 5.465 4.586 0.879 1
1 314 . 12 1 1 A 68 68 VAL CA C 68 61.079 61.731 -0.652 1
1 315 . 12 1 1 A 68 68 VAL CB C 68 33.280 32.282 0.998 1
1 316 . 12 1 1 A 68 68 VAL N N 68 126.572 125.930 0.642 1
1 317 . 12 1 1 A 69 69 ASN H H 69 8.985 8.807 0.178 1
1 318 . 12 1 1 A 69 69 ASN CA C 69 50.812 52.963 -2.151 1
1 319 . 12 1 1 A 69 69 ASN CB C 69 38.609 39.438 -0.829 1
1 320 . 12 1 1 A 69 69 ASN N N 69 127.472 126.399 1.073 1
1 321 . 12 1 1 A 70 70 PHE H H 70 9.100 8.651 0.449 1
1 322 . 12 1 1 A 70 70 PHE CA C 70 63.279 61.826 1.453 1
1 323 . 12 1 1 A 70 70 PHE CB C 70 38.741 39.131 -0.390 1
1 324 . 12 1 1 A 70 70 PHE N N 70 119.972 126.417 -6.445 1
1 325 . 12 1 1 A 71 71 GLN H H 71 8.342 7.819 0.523 1
1 326 . 12 1 1 A 71 71 GLN HA H 71 3.923 3.819 0.104 1
1 329 . 12 1 1 A 71 71 GLN CA C 71 59.866 58.704 1.162 1
1 330 . 12 1 1 A 71 71 GLN CB C 71 27.878 28.327 -0.449 1
1 331 . 12 1 1 A 71 71 GLN N N 71 118.216 117.621 0.595 1
1 332 . 12 1 1 A 72 72 GLU H H 72 8.721 8.191 0.530 1
1 333 . 12 1 1 A 72 72 GLU HA H 72 4.147 4.083 0.064 1
1 338 . 12 1 1 A 72 72 GLU CA C 72 59.313 58.786 0.527 1
1 339 . 12 1 1 A 72 72 GLU CB C 72 30.233 29.704 0.529 1
1 340 . 12 1 1 A 72 72 GLU N N 72 121.455 118.900 2.555 1
1 341 . 12 1 1 A 73 73 TYR H H 73 8.536 8.086 0.450 1
1 342 . 12 1 1 A 73 73 TYR CA C 73 60.961 61.411 -0.450 1
1 343 . 12 1 1 A 73 73 TYR CB C 73 38.724 38.958 -0.234 1
1 344 . 12 1 1 A 73 73 TYR N N 73 123.356 122.025 1.331 1
1 345 . 12 1 1 A 74 74 ILE H H 74 8.642 7.821 0.821 1
1 346 . 12 1 1 A 74 74 ILE CA C 74 61.880 63.736 -1.856 1
1 347 . 12 1 1 A 74 74 ILE CB C 74 36.077 36.021 0.056 1
1 348 . 12 1 1 A 74 74 ILE N N 74 119.799 120.057 -0.258 1
1 349 . 12 1 1 A 75 75 THR H H 75 7.959 8.114 -0.155 1
1 354 . 12 1 1 A 75 75 THR CA C 75 67.056 66.816 0.240 1
1 355 . 12 1 1 A 75 75 THR CB C 75 68.386 68.506 -0.120 1
1 356 . 12 1 1 A 75 75 THR N N 75 119.486 118.070 1.416 1
1 357 . 12 1 1 A 76 76 PHE H H 76 7.450 8.242 -0.792 1
1 358 . 12 1 1 A 76 76 PHE CA C 76 59.010 61.797 -2.787 1
1 359 . 12 1 1 A 76 76 PHE CB C 76 38.139 39.179 -1.040 1
1 360 . 12 1 1 A 76 76 PHE N N 76 122.873 121.837 1.036 1
1 361 . 12 1 1 A 77 77 LEU H H 77 7.829 8.017 -0.188 1
1 362 . 12 1 1 A 77 77 LEU CA C 77 57.450 57.616 -0.166 1
1 363 . 12 1 1 A 77 77 LEU CB C 77 40.560 41.371 -0.811 1
1 364 . 12 1 1 A 77 77 LEU N N 77 117.405 118.482 -1.077 1
1 365 . 12 1 1 A 78 78 GLY H H 78 8.093 8.235 -0.142 1
1 366 . 12 1 1 A 78 78 GLY HA2 H 78 3.661 3.708 -0.047 1
1 367 . 12 1 1 A 78 78 GLY HA3 H 78 3.594 3.710 -0.116 1
1 368 . 12 1 1 A 78 78 GLY CA C 78 47.442 47.220 0.222 1
1 369 . 12 1 1 A 78 78 GLY N N 78 105.528 106.289 -0.761 1
1 370 . 12 1 1 A 79 79 ALA H H 79 7.759 7.709 0.050 1
1 371 . 12 1 1 A 79 79 ALA CA C 79 55.153 54.426 0.727 1
1 372 . 12 1 1 A 79 79 ALA CB C 79 17.768 18.488 -0.720 1
1 373 . 12 1 1 A 79 79 ALA N N 79 124.488 124.978 -0.490 1
1 374 . 12 1 1 A 80 80 LEU H H 80 7.963 8.026 -0.063 1
1 375 . 12 1 1 A 80 80 LEU CA C 80 57.464 57.612 -0.148 1
1 376 . 12 1 1 A 80 80 LEU CB C 80 41.496 41.062 0.434 1
1 377 . 12 1 1 A 80 80 LEU N N 80 117.869 120.514 -2.645 1
1 378 . 12 1 1 A 81 81 ALA H H 81 8.365 8.072 0.293 1
1 379 . 12 1 1 A 81 81 ALA CA C 81 55.475 55.049 0.426 1
1 380 . 12 1 1 A 81 81 ALA CB C 81 17.483 17.981 -0.498 1
1 381 . 12 1 1 A 81 81 ALA N N 81 119.054 120.481 -1.427 1
1 382 . 12 1 1 A 82 82 MET H H 82 8.112 7.625 0.487 1
1 383 . 12 1 1 A 82 82 MET CA C 82 59.516 57.181 2.335 1
1 384 . 12 1 1 A 82 82 MET CB C 82 32.550 31.136 1.414 1
1 385 . 12 1 1 A 82 82 MET N N 82 115.364 116.173 -0.809 1
1 386 . 12 1 1 A 83 83 ILE H H 83 7.981 7.310 0.671 1
1 387 . 12 1 1 A 83 83 ILE HA H 83 3.839 3.617 0.222 1
1 391 . 12 1 1 A 83 83 ILE CA C 83 64.467 64.725 -0.258 1
1 392 . 12 1 1 A 83 83 ILE CB C 83 37.312 37.364 -0.052 1
1 393 . 12 1 1 A 83 83 ILE N N 83 120.887 120.252 0.635 1
1 394 . 12 1 1 A 84 84 TYR H H 84 8.731 7.098 1.633 1
1 395 . 12 1 1 A 84 84 TYR N N 84 120.933 118.871 2.062 1
1 396 . 12 1 1 A 87 87 ALA H H 87 7.829 8.125 -0.296 1
1 397 . 12 1 1 A 87 87 ALA CA C 87 53.768 54.970 -1.202 1
1 398 . 12 1 1 A 87 87 ALA CB C 87 18.504 18.504 0.000 1
1 399 . 12 1 1 A 87 87 ALA N N 87 120.274 122.216 -1.942 1
1 400 . 12 1 1 A 88 88 LEU H H 88 7.499 8.110 -0.611 1
1 401 . 12 1 1 A 88 88 LEU CA C 88 55.605 58.027 -2.422 1
1 402 . 12 1 1 A 88 88 LEU CB C 88 42.047 41.464 0.583 1
1 403 . 12 1 1 A 88 88 LEU N N 88 117.356 119.426 -2.070 1
1 404 . 12 1 1 A 89 89 LYS H H 89 7.561 7.603 -0.042 1
1 405 . 12 1 1 A 89 89 LYS CA C 89 56.865 55.921 0.944 1
1 406 . 12 1 1 A 89 89 LYS CB C 89 32.592 32.924 -0.332 1
1 407 . 12 1 1 A 89 89 LYS N N 89 119.289 116.346 2.943 1
1 416 . 12 3 2 C 6 6 GLU H H 190 8.385 8.906 -0.521 1
1 417 . 12 3 2 C 6 6 GLU HA H 190 4.153 4.918 -0.765 1
1 422 . 12 3 2 C 6 6 GLU C C 190 175.031 177.739 -2.708 1
1 423 . 12 3 2 C 6 6 GLU CA C 190 58.866 54.629 4.237 1
1 424 . 12 3 2 C 6 6 GLU CB C 190 30.751 32.221 -1.470 1
1 426 . 12 3 2 C 6 6 GLU N N 190 122.715 123.482 -0.767 1
1 427 . 12 3 2 C 7 7 GLY H H 191 8.475 8.933 -0.458 1
1 428 . 12 3 2 C 7 7 GLY HA2 H 191 3.887 3.867 0.020 1
1 429 . 12 3 2 C 7 7 GLY HA3 H 191 3.887 3.868 0.019 1
1 430 . 12 3 2 C 7 7 GLY C C 191 177.922 176.147 1.775 1
1 431 . 12 3 2 C 7 7 GLY CA C 191 46.884 46.530 0.354 1
1 432 . 12 3 2 C 7 7 GLY N N 191 109.009 111.245 -2.236 1
1 433 . 12 3 2 C 8 8 LEU HA H 192 4.095 4.000 0.095 1
1 443 . 12 3 2 C 8 8 LEU CA C 192 58.154 58.297 -0.143 1
1 444 . 12 3 2 C 8 8 LEU CB C 192 42.789 41.467 1.322 1
1 448 . 12 3 2 C 9 9 MET H H 193 8.250 7.904 0.346 1
1 449 . 12 3 2 C 9 9 MET HA H 193 4.150 4.249 -0.099 1
1 457 . 12 3 2 C 9 9 MET C C 193 178.421 178.151 0.270 1
1 458 . 12 3 2 C 9 9 MET CA C 193 58.818 58.168 0.650 1
1 459 . 12 3 2 C 9 9 MET CB C 193 32.360 32.134 0.226 1
1 462 . 12 3 2 C 9 9 MET N N 193 117.049 118.283 -1.234 1
1 463 . 12 3 2 C 10 10 ASN H H 194 7.892 7.983 -0.091 1
1 464 . 12 3 2 C 10 10 ASN HA H 194 4.468 4.544 -0.076 1
1 469 . 12 3 2 C 10 10 ASN C C 194 178.099 176.535 1.564 1
1 470 . 12 3 2 C 10 10 ASN CA C 194 56.644 55.205 1.439 1
1 471 . 12 3 2 C 10 10 ASN CB C 194 39.100 38.436 0.664 1
1 472 . 12 3 2 C 10 10 ASN N N 194 117.034 119.116 -2.082 1
1 474 . 12 3 2 C 11 11 VAL H H 195 7.651 8.005 -0.354 1
1 475 . 12 3 2 C 11 11 VAL HA H 195 3.735 3.885 -0.150 1
1 483 . 12 3 2 C 11 11 VAL C C 195 177.657 178.383 -0.726 1
1 484 . 12 3 2 C 11 11 VAL CA C 195 66.710 65.418 1.292 1
1 485 . 12 3 2 C 11 11 VAL CB C 195 32.468 31.677 0.791 1
1 488 . 12 3 2 C 11 11 VAL N N 195 119.878 117.895 1.983 1
1 489 . 12 3 2 C 12 12 LEU H H 196 8.030 7.764 0.266 1
1 490 . 12 3 2 C 12 12 LEU HA H 196 4.013 4.038 -0.025 1
1 500 . 12 3 2 C 12 12 LEU C C 196 177.540 179.397 -1.857 1
1 501 . 12 3 2 C 12 12 LEU CA C 196 58.489 57.558 0.931 1
1 502 . 12 3 2 C 12 12 LEU CB C 196 42.457 41.428 1.029 1
1 506 . 12 3 2 C 12 12 LEU N N 196 119.499 120.333 -0.834 1
1 507 . 12 3 2 C 13 13 LYS H H 197 8.015 8.513 -0.498 1
1 508 . 12 3 2 C 13 13 LYS HA H 197 3.949 4.051 -0.102 1
1 517 . 12 3 2 C 13 13 LYS C C 197 178.419 178.612 -0.193 1
1 518 . 12 3 2 C 13 13 LYS CA C 197 60.191 59.777 0.414 1
1 519 . 12 3 2 C 13 13 LYS CB C 197 33.075 32.318 0.757 1
1 523 . 12 3 2 C 13 13 LYS N N 197 117.888 120.901 -3.013 1
1 524 . 12 3 2 C 14 14 LYS H H 198 7.506 7.913 -0.407 1
1 525 . 12 3 2 C 14 14 LYS HA H 198 4.127 4.114 0.013 1
1 534 . 12 3 2 C 14 14 LYS C C 198 178.262 178.752 -0.490 1
1 535 . 12 3 2 C 14 14 LYS CA C 198 59.161 59.096 0.065 1
1 536 . 12 3 2 C 14 14 LYS CB C 198 32.956 32.618 0.338 1
1 540 . 12 3 2 C 14 14 LYS N N 198 118.321 118.049 0.272 1
1 541 . 12 3 2 C 15 15 ILE H H 199 7.780 7.529 0.251 1
1 542 . 12 3 2 C 15 15 ILE HA H 199 3.787 3.994 -0.207 1
1 552 . 12 3 2 C 15 15 ILE C C 199 178.647 177.939 0.708 1
1 553 . 12 3 2 C 15 15 ILE CA C 199 64.912 63.069 1.843 1
1 554 . 12 3 2 C 15 15 ILE CB C 199 38.780 37.650 1.130 1
1 558 . 12 3 2 C 15 15 ILE N N 199 118.644 119.002 -0.358 1
1 559 . 12 3 2 C 16 16 TYR H H 200 7.918 8.267 -0.349 1
1 560 . 12 3 2 C 16 16 TYR HA H 200 4.252 4.082 0.170 1
1 567 . 12 3 2 C 16 16 TYR C C 200 177.806 177.336 0.470 1
1 568 . 12 3 2 C 16 16 TYR CA C 200 61.171 61.622 -0.451 1
1 569 . 12 3 2 C 16 16 TYR CB C 200 39.245 38.993 0.252 1
1 573 . 12 3 2 C 16 16 TYR N N 200 118.683 122.978 -4.295 1
1 574 . 12 3 2 C 17 17 GLU H H 201 8.089 8.273 -0.184 1
1 575 . 12 3 2 C 17 17 GLU HA H 201 4.124 4.165 -0.041 1
1 580 . 12 3 2 C 17 17 GLU C C 201 177.414 177.260 0.154 1
1 581 . 12 3 2 C 17 17 GLU CA C 201 58.784 58.132 0.652 1
1 582 . 12 3 2 C 17 17 GLU CB C 201 30.747 29.242 1.505 1
1 584 . 12 3 2 C 17 17 GLU N N 201 119.409 118.730 0.679 1
1 585 . 12 3 2 C 18 18 ASP H H 202 8.023 7.844 0.179 1
1 586 . 12 3 2 C 18 18 ASP HA H 202 4.657 4.578 0.079 1
1 589 . 12 3 2 C 18 18 ASP C C 202 177.346 177.358 -0.012 1
1 590 . 12 3 2 C 18 18 ASP CA C 202 55.496 55.258 0.238 1
1 591 . 12 3 2 C 18 18 ASP CB C 202 42.023 41.595 0.428 1
1 592 . 12 3 2 C 18 18 ASP N N 202 119.459 118.637 0.822 1
1 593 . 12 3 2 C 19 19 GLY H H 203 7.933 7.512 0.421 1
1 594 . 12 3 2 C 19 19 GLY HA2 H 203 3.938 4.001 -0.063 1
1 595 . 12 3 2 C 19 19 GLY HA3 H 203 3.938 4.041 -0.103 1
1 596 . 12 3 2 C 19 19 GLY C C 203 177.240 171.611 5.629 1
1 597 . 12 3 2 C 19 19 GLY CA C 203 46.309 44.796 1.513 1
1 598 . 12 3 2 C 19 19 GLY N N 203 108.518 106.309 2.209 1
1 599 . 12 3 2 C 20 20 ASP H H 204 8.091 8.347 -0.256 1
1 600 . 12 3 2 C 20 20 ASP HA H 204 4.616 5.241 -0.625 1
1 603 . 12 3 2 C 20 20 ASP C C 204 173.979 175.560 -1.581 1
1 604 . 12 3 2 C 20 20 ASP CA C 204 55.064 53.432 1.632 1
1 605 . 12 3 2 C 20 20 ASP CB C 204 42.203 43.893 -1.690 1
1 606 . 12 3 2 C 20 20 ASP N N 204 120.172 119.523 0.649 1
1 607 . 12 3 2 C 21 21 ASP H H 205 8.352 8.983 -0.631 1
1 608 . 12 3 2 C 21 21 ASP HA H 205 4.468 4.418 0.050 1
1 611 . 12 3 2 C 21 21 ASP C C 205 176.432 177.070 -0.638 1
1 612 . 12 3 2 C 21 21 ASP CA C 205 56.663 56.481 0.182 1
1 613 . 12 3 2 C 21 21 ASP CB C 205 41.918 40.924 0.994 1
1 614 . 12 3 2 C 21 21 ASP N N 205 121.515 125.318 -3.803 1
1 615 . 12 3 2 C 22 22 ASP H H 206 8.239 8.027 0.212 1
1 616 . 12 3 2 C 22 22 ASP HA H 206 4.455 4.561 -0.106 1
1 619 . 12 3 2 C 22 22 ASP C C 206 177.449 177.835 -0.386 1
1 620 . 12 3 2 C 22 22 ASP CA C 206 57.165 55.889 1.276 1
1 621 . 12 3 2 C 22 22 ASP CB C 206 41.820 41.154 0.666 1
1 622 . 12 3 2 C 22 22 ASP N N 206 120.156 118.419 1.737 1
1 623 . 12 3 2 C 23 23 MET H H 207 8.300 8.074 0.226 1
1 624 . 12 3 2 C 23 23 MET HA H 207 4.255 4.049 0.206 1
1 632 . 12 3 2 C 23 23 MET C C 207 178.412 178.081 0.331 1
1 633 . 12 3 2 C 23 23 MET CA C 207 58.065 58.712 -0.647 1
1 634 . 12 3 2 C 23 23 MET CB C 207 32.488 32.021 0.467 1
1 637 . 12 3 2 C 23 23 MET N N 207 120.707 119.652 1.055 1
1 638 . 12 3 2 C 24 24 LYS H H 208 8.047 8.108 -0.061 1
1 639 . 12 3 2 C 24 24 LYS HA H 208 3.946 4.063 -0.117 1
1 648 . 12 3 2 C 24 24 LYS C C 208 178.008 178.808 -0.800 1
1 649 . 12 3 2 C 24 24 LYS CA C 208 59.847 59.380 0.467 1
1 650 . 12 3 2 C 24 24 LYS CB C 208 32.983 32.262 0.721 1
1 654 . 12 3 2 C 24 24 LYS N N 208 119.504 118.280 1.224 1
1 655 . 12 3 2 C 25 25 ARG H H 209 7.891 7.900 -0.009 1
1 656 . 12 3 2 C 25 25 ARG HA H 209 4.168 4.131 0.037 1
1 663 . 12 3 2 C 25 25 ARG C C 209 178.100 178.537 -0.437 1
1 664 . 12 3 2 C 25 25 ARG CA C 209 58.810 58.907 -0.097 1
1 665 . 12 3 2 C 25 25 ARG CB C 209 31.080 30.180 0.900 1
1 668 . 12 3 2 C 25 25 ARG N N 209 118.378 119.699 -1.321 1
1 669 . 12 3 2 C 26 26 THR H H 210 7.869 8.144 -0.275 1
1 670 . 12 3 2 C 26 26 THR HA H 210 4.023 4.072 -0.049 1
1 675 . 12 3 2 C 26 26 THR C C 210 177.984 176.869 1.115 1
1 676 . 12 3 2 C 26 26 THR CA C 210 65.747 66.576 -0.829 1
1 677 . 12 3 2 C 26 26 THR CB C 210 69.683 68.655 1.028 1
1 679 . 12 3 2 C 26 26 THR N N 210 115.443 116.604 -1.161 1
1 680 . 12 3 2 C 27 27 ILE H H 211 7.901 8.263 -0.362 1
1 681 . 12 3 2 C 27 27 ILE HA H 211 4.142 3.664 0.478 1
1 691 . 12 3 2 C 27 27 ILE C C 211 175.595 178.479 -2.884 1
1 692 . 12 3 2 C 27 27 ILE CA C 211 63.528 65.953 -2.425 1
1 693 . 12 3 2 C 27 27 ILE CB C 211 38.982 37.866 1.116 1
1 697 . 12 3 2 C 27 27 ILE N N 211 121.265 121.513 -0.248 1
1 698 . 12 3 2 C 28 28 ASN HA H 212 4.465 4.367 0.098 1
1 703 . 12 3 2 C 28 28 ASN CA C 212 55.182 56.992 -1.810 1
1 704 . 12 3 2 C 28 28 ASN CB C 212 39.480 39.493 -0.013 1
1 706 . 12 3 2 C 29 29 LYS H H 213 7.968 8.078 -0.110 1
1 707 . 12 3 2 C 29 29 LYS HA H 213 4.072 4.059 0.013 1
1 716 . 12 3 2 C 29 29 LYS C C 213 176.218 178.914 -2.696 1
1 717 . 12 3 2 C 29 29 LYS CA C 213 58.489 59.046 -0.557 1
1 718 . 12 3 2 C 29 29 LYS CB C 213 33.165 32.135 1.030 1
1 722 . 12 3 2 C 29 29 LYS N N 213 120.820 118.242 2.578 1
1 723 . 12 3 2 C 30 30 ALA H H 214 7.865 8.161 -0.296 1
1 724 . 12 3 2 C 30 30 ALA HA H 214 4.217 4.162 0.055 1
1 728 . 12 3 2 C 30 30 ALA C C 214 177.041 179.835 -2.794 1
1 729 . 12 3 2 C 30 30 ALA CA C 214 54.104 54.943 -0.839 1
1 730 . 12 3 2 C 30 30 ALA CB C 214 19.496 18.389 1.107 1
1 731 . 12 3 2 C 30 30 ALA N N 214 121.571 121.539 0.032 1
1 732 . 12 3 2 C 31 31 TRP H H 215 7.831 7.959 -0.128 1
1 733 . 12 3 2 C 31 31 TRP HA H 215 4.598 4.422 0.176 1
1 742 . 12 3 2 C 31 31 TRP C C 215 178.088 179.351 -1.263 1
1 743 . 12 3 2 C 31 31 TRP CA C 215 58.432 60.266 -1.834 1
1 744 . 12 3 2 C 31 31 TRP CB C 215 30.472 29.502 0.970 1
1 750 . 12 3 2 C 31 31 TRP N N 215 118.141 118.549 -0.408 1
1 752 . 12 3 2 C 32 32 VAL H H 216 7.594 8.336 -0.742 1
1 753 . 12 3 2 C 32 32 VAL HA H 216 3.978 3.730 0.248 1
1 761 . 12 3 2 C 32 32 VAL C C 216 176.574 178.313 -1.739 1
1 762 . 12 3 2 C 32 32 VAL CA C 216 63.329 66.323 -2.994 1
1 763 . 12 3 2 C 32 32 VAL CB C 216 33.373 31.167 2.206 1
1 766 . 12 3 2 C 32 32 VAL N N 216 118.287 119.484 -1.197 1
1 767 . 12 3 2 C 33 33 GLU H H 217 8.012 8.652 -0.640 1
1 768 . 12 3 2 C 33 33 GLU HA H 217 4.257 4.241 0.016 1
1 773 . 12 3 2 C 33 33 GLU C C 217 176.164 176.740 -0.576 1
1 774 . 12 3 2 C 33 33 GLU CA C 217 57.409 58.153 -0.744 1
1 775 . 12 3 2 C 33 33 GLU CB C 217 30.978 29.001 1.977 1
1 777 . 12 3 2 C 33 33 GLU N N 217 122.535 118.971 3.564 1
1 778 . 12 3 2 C 34 34 SER H H 218 8.037 7.935 0.102 1
1 779 . 12 3 2 C 34 34 SER HA H 218 4.514 4.741 -0.227 1
1 782 . 12 3 2 C 34 34 SER C C 218 176.451 174.620 1.831 1
1 783 . 12 3 2 C 34 34 SER CA C 218 58.987 56.187 2.800 1
1 784 . 12 3 2 C 34 34 SER CB C 218 64.569 64.754 -0.185 1
1 785 . 12 3 2 C 34 34 SER N N 218 117.058 112.674 4.384 1
1 6 . 13 1 1 A 2 2 ALA H H 2 8.191 8.942 -0.751 1
1 7 . 13 1 1 A 2 2 ALA CA C 2 51.957 55.374 -3.417 1
1 8 . 13 1 1 A 2 2 ALA CB C 2 19.580 18.011 1.569 1
1 9 . 13 1 1 A 2 2 ALA N N 2 124.666 124.035 0.631 1
1 10 . 13 1 1 A 3 3 SER H H 3 8.829 8.180 0.649 1
1 11 . 13 1 1 A 3 3 SER CA C 3 57.221 62.807 -5.586 1
1 12 . 13 1 1 A 3 3 SER N N 3 119.917 112.981 6.936 1
1 13 . 13 1 1 A 4 4 PRO CA C 4 66.688 65.414 1.274 1
1 14 . 13 1 1 A 4 4 PRO CB C 4 32.553 31.047 1.506 1
1 15 . 13 1 1 A 5 5 LEU H H 5 9.146 7.567 1.579 1
1 16 . 13 1 1 A 5 5 LEU CA C 5 59.017 57.044 1.973 1
1 17 . 13 1 1 A 5 5 LEU CB C 5 42.341 42.270 0.071 1
1 18 . 13 1 1 A 5 5 LEU N N 5 117.902 117.738 0.164 1
1 19 . 13 1 1 A 6 6 ASP H H 6 7.572 8.485 -0.913 1
1 20 . 13 1 1 A 6 6 ASP CA C 6 57.997 57.637 0.360 1
1 21 . 13 1 1 A 6 6 ASP CB C 6 40.910 41.211 -0.301 1
1 22 . 13 1 1 A 6 6 ASP N N 6 118.259 119.310 -1.051 1
1 23 . 13 1 1 A 7 7 GLN H H 7 8.660 8.456 0.204 1
1 24 . 13 1 1 A 7 7 GLN HA H 7 4.064 4.093 -0.029 1
1 29 . 13 1 1 A 7 7 GLN CA C 7 59.270 58.831 0.439 1
1 30 . 13 1 1 A 7 7 GLN CB C 7 28.468 27.853 0.615 1
1 31 . 13 1 1 A 7 7 GLN N N 7 119.558 117.157 2.401 1
1 32 . 13 1 1 A 8 8 ALA H H 8 8.253 7.474 0.779 1
1 33 . 13 1 1 A 8 8 ALA CA C 8 55.519 55.014 0.505 1
1 34 . 13 1 1 A 8 8 ALA CB C 8 18.113 18.205 -0.092 1
1 35 . 13 1 1 A 8 8 ALA N N 8 123.628 122.019 1.609 1
1 36 . 13 1 1 A 9 9 ILE H H 9 8.134 8.304 -0.170 1
1 37 . 13 1 1 A 9 9 ILE CA C 9 65.261 64.489 0.772 1
1 38 . 13 1 1 A 9 9 ILE CB C 9 37.023 37.238 -0.215 1
1 39 . 13 1 1 A 9 9 ILE N N 9 117.056 117.009 0.047 1
1 40 . 13 1 1 A 10 10 GLY H H 10 8.515 8.413 0.102 1
1 41 . 13 1 1 A 10 10 GLY HA3 H 10 3.773 3.746 0.027 1
1 42 . 13 1 1 A 10 10 GLY CA C 10 47.637 47.019 0.618 1
1 43 . 13 1 1 A 10 10 GLY N N 10 106.202 110.792 -4.590 1
1 44 . 13 1 1 A 11 11 LEU H H 11 8.212 8.098 0.114 1
1 45 . 13 1 1 A 11 11 LEU CA C 11 58.354 57.624 0.730 1
1 46 . 13 1 1 A 11 11 LEU CB C 11 41.683 41.974 -0.291 1
1 47 . 13 1 1 A 11 11 LEU N N 11 124.624 123.529 1.095 1
1 48 . 13 1 1 A 12 12 LEU H H 12 7.971 7.804 0.167 1
1 49 . 13 1 1 A 12 12 LEU HA H 12 4.144 4.260 -0.116 1
1 59 . 13 1 1 A 12 12 LEU CA C 12 58.691 58.425 0.266 1
1 60 . 13 1 1 A 12 12 LEU CB C 12 40.657 41.533 -0.876 1
1 61 . 13 1 1 A 12 12 LEU N N 12 118.095 118.436 -0.341 1
1 62 . 13 1 1 A 13 13 ILE H H 13 8.379 8.212 0.167 1
1 63 . 13 1 1 A 13 13 ILE CA C 13 66.405 65.271 1.134 1
1 64 . 13 1 1 A 13 13 ILE CB C 13 38.916 37.867 1.049 1
1 65 . 13 1 1 A 13 13 ILE N N 13 121.161 120.131 1.030 1
1 66 . 13 1 1 A 14 14 GLY H H 14 8.823 8.638 0.185 1
1 67 . 13 1 1 A 14 14 GLY HA2 H 14 4.147 3.754 0.393 1
1 68 . 13 1 1 A 14 14 GLY HA3 H 14 3.982 3.766 0.216 1
1 69 . 13 1 1 A 14 14 GLY CA C 14 47.750 47.513 0.237 1
1 70 . 13 1 1 A 14 14 GLY N N 14 108.982 107.722 1.260 1
1 71 . 13 1 1 A 15 15 ILE H H 15 8.681 8.521 0.160 1
1 72 . 13 1 1 A 15 15 ILE CA C 15 64.996 64.539 0.457 1
1 73 . 13 1 1 A 15 15 ILE CB C 15 37.107 37.705 -0.598 1
1 74 . 13 1 1 A 15 15 ILE N N 15 121.601 122.697 -1.096 1
1 75 . 13 1 1 A 16 16 PHE H H 16 7.103 8.367 -1.264 1
1 76 . 13 1 1 A 16 16 PHE CA C 16 62.910 61.470 1.440 1
1 77 . 13 1 1 A 16 16 PHE CB C 16 38.782 39.636 -0.854 1
1 78 . 13 1 1 A 16 16 PHE N N 16 118.660 121.372 -2.712 1
1 79 . 13 1 1 A 17 17 HIS H H 17 7.591 8.786 -1.195 1
1 80 . 13 1 1 A 17 17 HIS HA H 17 4.793 4.340 0.453 1
1 82 . 13 1 1 A 17 17 HIS CA C 17 58.125 59.243 -1.118 1
1 83 . 13 1 1 A 17 17 HIS CB C 17 29.584 29.438 0.146 1
1 84 . 13 1 1 A 17 17 HIS N N 17 114.968 118.788 -3.820 1
1 85 . 13 1 1 A 18 18 LYS H H 18 8.144 8.642 -0.498 1
1 86 . 13 1 1 A 18 18 LYS CA C 18 58.975 58.741 0.234 1
1 87 . 13 1 1 A 18 18 LYS CB C 18 32.379 32.045 0.334 1
1 88 . 13 1 1 A 18 18 LYS N N 18 122.373 117.234 5.139 1
1 89 . 13 1 1 A 19 19 TYR H H 19 6.999 7.437 -0.438 1
1 90 . 13 1 1 A 19 19 TYR CA C 19 60.318 60.697 -0.379 1
1 91 . 13 1 1 A 19 19 TYR CB C 19 40.355 38.417 1.938 1
1 92 . 13 1 1 A 19 19 TYR N N 19 113.614 119.382 -5.768 1
1 93 . 13 1 1 A 20 20 SER H H 20 8.432 7.589 0.843 1
1 94 . 13 1 1 A 20 20 SER CA C 20 61.897 62.009 -0.112 1
1 95 . 13 1 1 A 20 20 SER CB C 20 61.354 62.660 -1.306 1
1 96 . 13 1 1 A 20 20 SER N N 20 113.201 115.978 -2.777 1
1 97 . 13 1 1 A 21 21 GLY H H 21 7.678 8.154 -0.476 1
1 98 . 13 1 1 A 21 21 GLY HA2 H 21 4.195 3.827 0.368 1
1 99 . 13 1 1 A 21 21 GLY HA3 H 21 3.900 3.830 0.070 1
1 100 . 13 1 1 A 21 21 GLY CA C 21 45.628 45.803 -0.175 1
1 101 . 13 1 1 A 21 21 GLY N N 21 110.734 108.504 2.230 1
1 102 . 13 1 1 A 22 22 LYS H H 22 7.362 7.553 -0.191 1
1 103 . 13 1 1 A 22 22 LYS CA C 22 60.163 58.499 1.664 1
1 104 . 13 1 1 A 22 22 LYS CB C 22 32.554 33.416 -0.862 1
1 105 . 13 1 1 A 22 22 LYS N N 22 122.161 120.808 1.353 1
1 106 . 13 1 1 A 23 23 GLU H H 23 9.639 8.401 1.238 1
1 107 . 13 1 1 A 23 23 GLU CA C 23 54.449 56.217 -1.768 1
1 108 . 13 1 1 A 23 23 GLU N N 23 116.288 113.708 2.580 1
1 109 . 13 1 1 A 24 24 GLY HA2 H 24 3.912 3.960 -0.048 1
1 110 . 13 1 1 A 24 24 GLY HA3 H 24 3.787 3.999 -0.212 1
1 111 . 13 1 1 A 24 24 GLY CA C 24 45.898 44.304 1.594 1
1 112 . 13 1 1 A 25 25 ASP H H 25 8.204 8.467 -0.263 1
1 113 . 13 1 1 A 25 25 ASP CA C 25 55.252 52.695 2.557 1
1 114 . 13 1 1 A 25 25 ASP N N 25 125.671 120.982 4.689 1
1 115 . 13 1 1 A 26 26 LYS CA C 26 57.851 58.511 -0.660 1
1 116 . 13 1 1 A 26 26 LYS CB C 26 31.265 32.007 -0.742 1
1 117 . 13 1 1 A 27 27 HIS H H 27 9.763 8.023 1.740 1
1 118 . 13 1 1 A 27 27 HIS CA C 27 55.580 56.111 -0.531 1
1 119 . 13 1 1 A 27 27 HIS CB C 27 30.936 31.230 -0.294 1
1 120 . 13 1 1 A 27 27 HIS N N 27 118.108 112.356 5.752 1
1 121 . 13 1 1 A 28 28 THR H H 28 7.325 7.255 0.070 1
1 126 . 13 1 1 A 28 28 THR CA C 28 60.128 60.587 -0.459 1
1 127 . 13 1 1 A 28 28 THR CB C 28 72.268 71.706 0.562 1
1 128 . 13 1 1 A 28 28 THR N N 28 106.920 113.566 -6.646 1
1 129 . 13 1 1 A 29 29 LEU H H 29 9.422 9.360 0.062 1
1 130 . 13 1 1 A 29 29 LEU HA H 29 5.368 5.062 0.306 1
1 140 . 13 1 1 A 29 29 LEU CA C 29 52.567 53.284 -0.717 1
1 141 . 13 1 1 A 29 29 LEU CB C 29 43.523 44.040 -0.517 1
1 142 . 13 1 1 A 29 29 LEU N N 29 125.021 128.446 -3.425 1
1 143 . 13 1 1 A 30 30 SER H H 30 10.485 8.749 1.736 1
1 144 . 13 1 1 A 30 30 SER CA C 30 56.653 57.092 -0.439 1
1 145 . 13 1 1 A 30 30 SER CB C 30 65.313 65.562 -0.249 1
1 146 . 13 1 1 A 30 30 SER N N 30 124.758 116.521 8.237 1
1 147 . 13 1 1 A 31 31 LYS H H 31 8.728 8.900 -0.172 1
1 148 . 13 1 1 A 31 31 LYS CA C 31 59.669 59.188 0.481 1
1 149 . 13 1 1 A 31 31 LYS CB C 31 31.763 32.032 -0.269 1
1 150 . 13 1 1 A 31 31 LYS N N 31 119.459 119.829 -0.370 1
1 151 . 13 1 1 A 32 32 LYS H H 32 7.857 7.934 -0.077 1
1 152 . 13 1 1 A 32 32 LYS CA C 32 59.721 59.448 0.273 1
1 153 . 13 1 1 A 32 32 LYS CB C 32 32.901 32.121 0.780 1
1 154 . 13 1 1 A 32 32 LYS N N 32 117.933 119.569 -1.636 1
1 155 . 13 1 1 A 33 33 GLU H H 33 7.559 7.938 -0.379 1
1 156 . 13 1 1 A 33 33 GLU CA C 33 59.169 58.886 0.283 1
1 157 . 13 1 1 A 33 33 GLU CB C 33 31.014 29.396 1.618 1
1 158 . 13 1 1 A 33 33 GLU N N 33 120.407 119.190 1.217 1
1 159 . 13 1 1 A 34 34 LEU H H 34 8.833 8.280 0.553 1
1 160 . 13 1 1 A 34 34 LEU CA C 34 56.928 57.686 -0.758 1
1 161 . 13 1 1 A 34 34 LEU CB C 34 41.435 41.426 0.009 1
1 162 . 13 1 1 A 34 34 LEU N N 34 117.677 121.106 -3.429 1
1 163 . 13 1 1 A 35 35 LYS H H 35 8.010 8.151 -0.141 1
1 164 . 13 1 1 A 35 35 LYS CA C 35 60.692 59.363 1.329 1
1 165 . 13 1 1 A 35 35 LYS CB C 35 32.223 32.078 0.145 1
1 166 . 13 1 1 A 35 35 LYS N N 35 119.829 118.847 0.982 1
1 167 . 13 1 1 A 36 36 GLU H H 36 7.169 7.874 -0.705 1
1 168 . 13 1 1 A 36 36 GLU CA C 36 59.588 58.788 0.800 1
1 169 . 13 1 1 A 36 36 GLU CB C 36 29.342 29.457 -0.115 1
1 170 . 13 1 1 A 36 36 GLU N N 36 117.340 118.837 -1.497 1
1 171 . 13 1 1 A 37 37 LEU H H 37 7.478 7.738 -0.260 1
1 172 . 13 1 1 A 37 37 LEU CA C 37 59.674 57.793 1.881 1
1 173 . 13 1 1 A 37 37 LEU CB C 37 42.142 41.120 1.022 1
1 174 . 13 1 1 A 37 37 LEU N N 37 120.884 120.433 0.451 1
1 175 . 13 1 1 A 38 38 ILE H H 38 8.377 8.119 0.258 1
1 176 . 13 1 1 A 38 38 ILE CA C 38 65.651 65.478 0.173 1
1 177 . 13 1 1 A 38 38 ILE N N 38 118.450 119.898 -1.448 1
1 178 . 13 1 1 A 39 39 GLN H H 39 8.217 7.798 0.419 1
1 179 . 13 1 1 A 39 39 GLN CA C 39 59.788 58.972 0.816 1
1 180 . 13 1 1 A 39 39 GLN CB C 39 29.278 27.966 1.312 1
1 181 . 13 1 1 A 39 39 GLN N N 39 113.091 118.073 -4.982 1
1 182 . 13 1 1 A 40 40 LYS H H 40 8.426 7.778 0.648 1
1 183 . 13 1 1 A 40 40 LYS CA C 40 57.807 59.088 -1.281 1
1 184 . 13 1 1 A 40 40 LYS CB C 40 33.942 32.649 1.293 1
1 185 . 13 1 1 A 40 40 LYS N N 40 114.771 120.752 -5.981 1
1 186 . 13 1 1 A 41 41 GLU H H 41 8.496 8.251 0.245 1
1 187 . 13 1 1 A 41 41 GLU CA C 41 55.395 58.730 -3.335 1
1 188 . 13 1 1 A 41 41 GLU CB C 41 29.260 29.765 -0.505 1
1 189 . 13 1 1 A 41 41 GLU N N 41 112.546 119.185 -6.639 1
1 190 . 13 1 1 A 42 42 LEU H H 42 7.267 8.026 -0.759 1
1 191 . 13 1 1 A 42 42 LEU CA C 42 53.776 56.503 -2.727 1
1 192 . 13 1 1 A 42 42 LEU N N 42 118.657 118.930 -0.273 1
1 193 . 13 1 1 A 44 44 ILE CA C 44 62.210 59.769 2.441 1
1 194 . 13 1 1 A 44 44 ILE CB C 44 38.247 40.899 -2.652 1
1 195 . 13 1 1 A 45 45 GLY H H 45 7.820 8.819 -0.999 1
1 196 . 13 1 1 A 45 45 GLY CA C 45 47.742 46.250 1.492 1
1 197 . 13 1 1 A 45 45 GLY N N 45 108.178 115.462 -7.284 1
1 198 . 13 1 1 A 46 46 SER H H 46 7.895 7.741 0.154 1
1 199 . 13 1 1 A 46 46 SER CA C 46 59.958 56.844 3.114 1
1 200 . 13 1 1 A 46 46 SER CB C 46 63.450 65.553 -2.103 1
1 201 . 13 1 1 A 46 46 SER N N 46 113.038 110.848 2.190 1
1 202 . 13 1 1 A 47 47 LYS H H 47 7.736 9.072 -1.336 1
1 203 . 13 1 1 A 47 47 LYS CA C 47 55.636 58.568 -2.932 1
1 204 . 13 1 1 A 47 47 LYS CB C 47 33.103 32.220 0.883 1
1 205 . 13 1 1 A 47 47 LYS N N 47 119.422 121.656 -2.234 1
1 206 . 13 1 1 A 48 48 LEU H H 48 6.988 7.718 -0.730 1
1 207 . 13 1 1 A 48 48 LEU HA H 48 4.497 4.109 0.388 1
1 217 . 13 1 1 A 48 48 LEU CA C 48 54.517 57.430 -2.913 1
1 218 . 13 1 1 A 48 48 LEU CB C 48 42.987 41.059 1.928 1
1 219 . 13 1 1 A 48 48 LEU N N 48 118.908 117.989 0.919 1
1 220 . 13 1 1 A 49 49 GLN H H 49 9.206 8.229 0.977 1
1 221 . 13 1 1 A 49 49 GLN HA H 49 4.486 4.273 0.213 1
1 223 . 13 1 1 A 49 49 GLN CA C 49 54.785 58.009 -3.224 1
1 224 . 13 1 1 A 49 49 GLN CB C 49 29.636 28.430 1.206 1
1 225 . 13 1 1 A 49 49 GLN N N 49 121.275 119.212 2.063 1
1 226 . 13 1 1 A 50 50 ASP H H 50 8.854 8.250 0.604 1
1 227 . 13 1 1 A 50 50 ASP CA C 50 59.078 57.616 1.462 1
1 228 . 13 1 1 A 50 50 ASP CB C 50 40.632 42.038 -1.406 1
1 229 . 13 1 1 A 50 50 ASP N N 50 123.430 120.044 3.386 1
1 230 . 13 1 1 A 51 51 ALA H H 51 8.720 8.200 0.520 1
1 231 . 13 1 1 A 51 51 ALA CA C 51 55.281 55.042 0.239 1
1 232 . 13 1 1 A 51 51 ALA CB C 51 18.205 18.237 -0.032 1
1 233 . 13 1 1 A 51 51 ALA N N 51 117.829 121.256 -3.427 1
1 234 . 13 1 1 A 52 52 GLU H H 52 7.161 7.776 -0.615 1
1 235 . 13 1 1 A 52 52 GLU CA C 52 58.757 59.144 -0.387 1
1 236 . 13 1 1 A 52 52 GLU CB C 52 30.247 29.803 0.444 1
1 237 . 13 1 1 A 52 52 GLU N N 52 115.459 117.527 -2.068 1
1 238 . 13 1 1 A 53 53 ILE H H 53 7.962 7.716 0.246 1
1 239 . 13 1 1 A 53 53 ILE CA C 53 65.525 65.150 0.375 1
1 240 . 13 1 1 A 53 53 ILE CB C 53 37.289 37.895 -0.606 1
1 241 . 13 1 1 A 53 53 ILE N N 53 120.414 121.160 -0.746 1
1 242 . 13 1 1 A 54 54 VAL H H 54 8.132 8.147 -0.015 1
1 243 . 13 1 1 A 54 54 VAL CA C 54 67.290 65.567 1.723 1
1 244 . 13 1 1 A 54 54 VAL CB C 54 31.434 31.172 0.262 1
1 245 . 13 1 1 A 54 54 VAL N N 54 119.775 117.133 2.642 1
1 246 . 13 1 1 A 55 55 LYS H H 55 7.155 7.997 -0.842 1
1 247 . 13 1 1 A 55 55 LYS CA C 55 59.131 59.395 -0.264 1
1 248 . 13 1 1 A 55 55 LYS CB C 55 32.131 32.026 0.105 1
1 249 . 13 1 1 A 55 55 LYS N N 55 119.175 120.937 -1.762 1
1 250 . 13 1 1 A 56 56 LEU H H 56 7.837 8.285 -0.448 1
1 251 . 13 1 1 A 56 56 LEU CA C 56 58.052 57.704 0.348 1
1 252 . 13 1 1 A 56 56 LEU CB C 56 41.878 41.554 0.324 1
1 253 . 13 1 1 A 56 56 LEU N N 56 119.679 121.002 -1.323 1
1 254 . 13 1 1 A 57 57 MET H H 57 8.385 8.672 -0.287 1
1 255 . 13 1 1 A 57 57 MET CA C 57 60.756 58.282 2.474 1
1 256 . 13 1 1 A 57 57 MET CB C 57 33.152 32.607 0.545 1
1 257 . 13 1 1 A 57 57 MET N N 57 115.116 117.025 -1.909 1
1 258 . 13 1 1 A 58 58 ASP H H 58 7.591 8.073 -0.482 1
1 259 . 13 1 1 A 58 58 ASP CA C 58 57.365 57.428 -0.063 1
1 260 . 13 1 1 A 58 58 ASP CB C 58 40.858 41.070 -0.212 1
1 261 . 13 1 1 A 58 58 ASP N N 58 118.197 120.122 -1.925 1
1 262 . 13 1 1 A 59 59 ASP H H 59 7.725 8.111 -0.386 1
1 263 . 13 1 1 A 59 59 ASP CA C 59 56.830 56.958 -0.128 1
1 264 . 13 1 1 A 59 59 ASP CB C 59 40.567 40.648 -0.081 1
1 265 . 13 1 1 A 59 59 ASP N N 59 118.481 117.985 0.496 1
1 266 . 13 1 1 A 60 60 LEU H H 60 7.703 7.567 0.136 1
1 267 . 13 1 1 A 60 60 LEU CA C 60 56.564 57.030 -0.466 1
1 268 . 13 1 1 A 60 60 LEU CB C 60 42.714 41.163 1.551 1
1 269 . 13 1 1 A 60 60 LEU N N 60 116.935 120.129 -3.194 1
1 270 . 13 1 1 A 61 61 ASP H H 61 7.143 8.311 -1.168 1
1 271 . 13 1 1 A 61 61 ASP HA H 61 4.690 4.486 0.204 1
1 274 . 13 1 1 A 61 61 ASP CA C 61 52.286 55.908 -3.622 1
1 275 . 13 1 1 A 61 61 ASP CB C 61 39.245 40.827 -1.582 1
1 276 . 13 1 1 A 61 61 ASP N N 61 116.605 118.753 -2.148 1
1 277 . 13 1 1 A 62 62 ARG H H 62 7.786 7.984 -0.198 1
1 278 . 13 1 1 A 62 62 ARG CA C 62 58.328 58.755 -0.427 1
1 279 . 13 1 1 A 62 62 ARG CB C 62 30.106 29.862 0.244 1
1 280 . 13 1 1 A 62 62 ARG N N 62 125.967 119.378 6.589 1
1 281 . 13 1 1 A 63 63 ASN H H 63 7.945 7.390 0.555 1
1 282 . 13 1 1 A 63 63 ASN CA C 63 51.863 55.801 -3.938 1
1 283 . 13 1 1 A 63 63 ASN CB C 63 36.809 39.094 -2.285 1
1 284 . 13 1 1 A 63 63 ASN N N 63 112.434 116.752 -4.318 1
1 285 . 13 1 1 A 64 64 LYS H H 64 7.477 7.411 0.066 1
1 286 . 13 1 1 A 64 64 LYS CA C 64 56.524 55.927 0.597 1
1 287 . 13 1 1 A 64 64 LYS N N 64 114.197 118.048 -3.851 1
1 288 . 13 1 1 A 65 65 ASP H H 65 8.345 9.191 -0.846 1
1 289 . 13 1 1 A 65 65 ASP CA C 65 52.969 55.804 -2.835 1
1 290 . 13 1 1 A 65 65 ASP CB C 65 40.329 39.935 0.394 1
1 291 . 13 1 1 A 65 65 ASP N N 65 118.581 124.862 -6.281 1
1 292 . 13 1 1 A 66 66 GLN H H 66 9.945 7.804 2.141 1
1 293 . 13 1 1 A 66 66 GLN CA C 66 58.132 55.567 2.565 1
1 294 . 13 1 1 A 66 66 GLN CB C 66 26.035 31.124 -5.089 1
1 295 . 13 1 1 A 66 66 GLN N N 66 113.203 116.480 -3.277 1
1 296 . 13 1 1 A 67 67 GLU H H 67 7.880 7.782 0.098 1
1 297 . 13 1 1 A 67 67 GLU HA H 67 4.910 4.670 0.240 1
1 302 . 13 1 1 A 67 67 GLU CA C 67 54.082 55.403 -1.321 1
1 303 . 13 1 1 A 67 67 GLU CB C 67 33.174 32.567 0.607 1
1 304 . 13 1 1 A 67 67 GLU N N 67 118.554 116.417 2.137 1
1 305 . 13 1 1 A 68 68 VAL H H 68 9.669 9.067 0.602 1
1 306 . 13 1 1 A 68 68 VAL HA H 68 5.465 4.632 0.833 1
1 314 . 13 1 1 A 68 68 VAL CA C 68 61.079 61.538 -0.459 1
1 315 . 13 1 1 A 68 68 VAL CB C 68 33.280 32.814 0.466 1
1 316 . 13 1 1 A 68 68 VAL N N 68 126.572 122.420 4.152 1
1 317 . 13 1 1 A 69 69 ASN H H 69 8.985 8.762 0.223 1
1 318 . 13 1 1 A 69 69 ASN CA C 69 50.812 53.562 -2.750 1
1 319 . 13 1 1 A 69 69 ASN CB C 69 38.609 40.835 -2.226 1
1 320 . 13 1 1 A 69 69 ASN N N 69 127.472 126.468 1.004 1
1 321 . 13 1 1 A 70 70 PHE H H 70 9.100 9.440 -0.340 1
1 322 . 13 1 1 A 70 70 PHE CA C 70 63.279 62.152 1.127 1
1 323 . 13 1 1 A 70 70 PHE CB C 70 38.741 39.542 -0.801 1
1 324 . 13 1 1 A 70 70 PHE N N 70 119.972 128.159 -8.187 1
1 325 . 13 1 1 A 71 71 GLN H H 71 8.342 8.216 0.126 1
1 326 . 13 1 1 A 71 71 GLN HA H 71 3.923 3.691 0.232 1
1 329 . 13 1 1 A 71 71 GLN CA C 71 59.866 58.508 1.358 1
1 330 . 13 1 1 A 71 71 GLN CB C 71 27.878 28.355 -0.477 1
1 331 . 13 1 1 A 71 71 GLN N N 71 118.216 117.191 1.025 1
1 332 . 13 1 1 A 72 72 GLU H H 72 8.721 7.613 1.108 1
1 333 . 13 1 1 A 72 72 GLU HA H 72 4.147 4.079 0.068 1
1 338 . 13 1 1 A 72 72 GLU CA C 72 59.313 59.320 -0.007 1
1 339 . 13 1 1 A 72 72 GLU CB C 72 30.233 29.334 0.899 1
1 340 . 13 1 1 A 72 72 GLU N N 72 121.455 119.642 1.813 1
1 341 . 13 1 1 A 73 73 TYR H H 73 8.536 8.169 0.367 1
1 342 . 13 1 1 A 73 73 TYR CA C 73 60.961 61.363 -0.402 1
1 343 . 13 1 1 A 73 73 TYR CB C 73 38.724 38.817 -0.093 1
1 344 . 13 1 1 A 73 73 TYR N N 73 123.356 121.044 2.312 1
1 345 . 13 1 1 A 74 74 ILE H H 74 8.642 7.897 0.745 1
1 346 . 13 1 1 A 74 74 ILE CA C 74 61.880 64.183 -2.303 1
1 347 . 13 1 1 A 74 74 ILE CB C 74 36.077 37.371 -1.294 1
1 348 . 13 1 1 A 74 74 ILE N N 74 119.799 120.549 -0.750 1
1 349 . 13 1 1 A 75 75 THR H H 75 7.959 7.823 0.136 1
1 354 . 13 1 1 A 75 75 THR CA C 75 67.056 66.778 0.278 1
1 355 . 13 1 1 A 75 75 THR CB C 75 68.386 68.497 -0.111 1
1 356 . 13 1 1 A 75 75 THR N N 75 119.486 117.640 1.846 1
1 357 . 13 1 1 A 76 76 PHE H H 76 7.450 8.474 -1.024 1
1 358 . 13 1 1 A 76 76 PHE CA C 76 59.010 61.535 -2.525 1
1 359 . 13 1 1 A 76 76 PHE CB C 76 38.139 39.223 -1.084 1
1 360 . 13 1 1 A 76 76 PHE N N 76 122.873 121.787 1.086 1
1 361 . 13 1 1 A 77 77 LEU H H 77 7.829 8.164 -0.335 1
1 362 . 13 1 1 A 77 77 LEU CA C 77 57.450 57.607 -0.157 1
1 363 . 13 1 1 A 77 77 LEU CB C 77 40.560 41.105 -0.545 1
1 364 . 13 1 1 A 77 77 LEU N N 77 117.405 118.564 -1.159 1
1 365 . 13 1 1 A 78 78 GLY H H 78 8.093 8.162 -0.069 1
1 366 . 13 1 1 A 78 78 GLY HA2 H 78 3.661 3.732 -0.071 1
1 367 . 13 1 1 A 78 78 GLY HA3 H 78 3.594 3.743 -0.149 1
1 368 . 13 1 1 A 78 78 GLY CA C 78 47.442 47.077 0.365 1
1 369 . 13 1 1 A 78 78 GLY N N 78 105.528 106.207 -0.679 1
1 370 . 13 1 1 A 79 79 ALA H H 79 7.759 7.770 -0.011 1
1 371 . 13 1 1 A 79 79 ALA CA C 79 55.153 54.727 0.426 1
1 372 . 13 1 1 A 79 79 ALA CB C 79 17.768 18.714 -0.946 1
1 373 . 13 1 1 A 79 79 ALA N N 79 124.488 125.099 -0.611 1
1 374 . 13 1 1 A 80 80 LEU H H 80 7.963 8.009 -0.046 1
1 375 . 13 1 1 A 80 80 LEU CA C 80 57.464 57.471 -0.007 1
1 376 . 13 1 1 A 80 80 LEU CB C 80 41.496 41.105 0.391 1
1 377 . 13 1 1 A 80 80 LEU N N 80 117.869 118.766 -0.897 1
1 378 . 13 1 1 A 81 81 ALA H H 81 8.365 8.040 0.325 1
1 379 . 13 1 1 A 81 81 ALA CA C 81 55.475 55.022 0.453 1
1 380 . 13 1 1 A 81 81 ALA CB C 81 17.483 17.859 -0.376 1
1 381 . 13 1 1 A 81 81 ALA N N 81 119.054 121.570 -2.516 1
1 382 . 13 1 1 A 82 82 MET H H 82 8.112 7.898 0.214 1
1 383 . 13 1 1 A 82 82 MET CA C 82 59.516 57.986 1.530 1
1 384 . 13 1 1 A 82 82 MET CB C 82 32.550 32.142 0.408 1
1 385 . 13 1 1 A 82 82 MET N N 82 115.364 118.033 -2.669 1
1 386 . 13 1 1 A 83 83 ILE H H 83 7.981 8.104 -0.123 1
1 387 . 13 1 1 A 83 83 ILE HA H 83 3.839 3.768 0.071 1
1 391 . 13 1 1 A 83 83 ILE CA C 83 64.467 64.510 -0.043 1
1 392 . 13 1 1 A 83 83 ILE CB C 83 37.312 36.997 0.315 1
1 393 . 13 1 1 A 83 83 ILE N N 83 120.887 119.450 1.437 1
1 394 . 13 1 1 A 84 84 TYR H H 84 8.731 7.865 0.866 1
1 395 . 13 1 1 A 84 84 TYR N N 84 120.933 119.481 1.452 1
1 396 . 13 1 1 A 87 87 ALA H H 87 7.829 7.647 0.182 1
1 397 . 13 1 1 A 87 87 ALA CA C 87 53.768 54.292 -0.524 1
1 398 . 13 1 1 A 87 87 ALA CB C 87 18.504 18.268 0.236 1
1 399 . 13 1 1 A 87 87 ALA N N 87 120.274 121.576 -1.302 1
1 400 . 13 1 1 A 88 88 LEU H H 88 7.499 7.551 -0.052 1
1 401 . 13 1 1 A 88 88 LEU CA C 88 55.605 54.605 1.000 1
1 402 . 13 1 1 A 88 88 LEU CB C 88 42.047 41.825 0.222 1
1 403 . 13 1 1 A 88 88 LEU N N 88 117.356 116.079 1.277 1
1 404 . 13 1 1 A 89 89 LYS H H 89 7.561 7.489 0.072 1
1 405 . 13 1 1 A 89 89 LYS CA C 89 56.865 55.922 0.943 1
1 406 . 13 1 1 A 89 89 LYS CB C 89 32.592 32.594 -0.002 1
1 407 . 13 1 1 A 89 89 LYS N N 89 119.289 118.227 1.062 1
1 416 . 13 3 2 C 6 6 GLU H H 190 8.385 8.775 -0.390 1
1 417 . 13 3 2 C 6 6 GLU HA H 190 4.153 5.122 -0.969 1
1 422 . 13 3 2 C 6 6 GLU C C 190 175.031 174.609 0.422 1
1 423 . 13 3 2 C 6 6 GLU CA C 190 58.866 55.091 3.775 1
1 424 . 13 3 2 C 6 6 GLU CB C 190 30.751 33.741 -2.990 1
1 426 . 13 3 2 C 6 6 GLU N N 190 122.715 119.210 3.505 1
1 427 . 13 3 2 C 7 7 GLY H H 191 8.475 8.432 0.043 1
1 428 . 13 3 2 C 7 7 GLY HA2 H 191 3.887 4.230 -0.343 1
1 429 . 13 3 2 C 7 7 GLY HA3 H 191 3.887 4.231 -0.344 1
1 430 . 13 3 2 C 7 7 GLY C C 191 177.922 174.643 3.279 1
1 431 . 13 3 2 C 7 7 GLY CA C 191 46.884 45.759 1.125 1
1 432 . 13 3 2 C 7 7 GLY N N 191 109.009 106.697 2.312 1
1 433 . 13 3 2 C 8 8 LEU HA H 192 4.095 4.012 0.083 1
1 443 . 13 3 2 C 8 8 LEU CA C 192 58.154 58.087 0.067 1
1 444 . 13 3 2 C 8 8 LEU CB C 192 42.789 41.576 1.213 1
1 448 . 13 3 2 C 9 9 MET H H 193 8.250 8.165 0.085 1
1 449 . 13 3 2 C 9 9 MET HA H 193 4.150 4.103 0.047 1
1 457 . 13 3 2 C 9 9 MET C C 193 178.421 178.009 0.412 1
1 458 . 13 3 2 C 9 9 MET CA C 193 58.818 58.619 0.199 1
1 459 . 13 3 2 C 9 9 MET CB C 193 32.360 32.016 0.344 1
1 462 . 13 3 2 C 9 9 MET N N 193 117.049 118.793 -1.744 1
1 463 . 13 3 2 C 10 10 ASN H H 194 7.892 7.884 0.008 1
1 464 . 13 3 2 C 10 10 ASN HA H 194 4.468 4.523 -0.055 1
1 469 . 13 3 2 C 10 10 ASN C C 194 178.099 177.118 0.981 1
1 470 . 13 3 2 C 10 10 ASN CA C 194 56.644 55.257 1.387 1
1 471 . 13 3 2 C 10 10 ASN CB C 194 39.100 38.405 0.695 1
1 472 . 13 3 2 C 10 10 ASN N N 194 117.034 118.391 -1.357 1
1 474 . 13 3 2 C 11 11 VAL H H 195 7.651 7.669 -0.018 1
1 475 . 13 3 2 C 11 11 VAL HA H 195 3.735 3.822 -0.087 1
1 483 . 13 3 2 C 11 11 VAL C C 195 177.657 178.294 -0.637 1
1 484 . 13 3 2 C 11 11 VAL CA C 195 66.710 65.590 1.120 1
1 485 . 13 3 2 C 11 11 VAL CB C 195 32.468 31.879 0.589 1
1 488 . 13 3 2 C 11 11 VAL N N 195 119.878 118.726 1.152 1
1 489 . 13 3 2 C 12 12 LEU H H 196 8.030 8.297 -0.267 1
1 490 . 13 3 2 C 12 12 LEU HA H 196 4.013 3.977 0.036 1
1 500 . 13 3 2 C 12 12 LEU C C 196 177.540 179.276 -1.736 1
1 501 . 13 3 2 C 12 12 LEU CA C 196 58.489 57.471 1.018 1
1 502 . 13 3 2 C 12 12 LEU CB C 196 42.457 41.009 1.448 1
1 506 . 13 3 2 C 12 12 LEU N N 196 119.499 119.762 -0.263 1
1 507 . 13 3 2 C 13 13 LYS H H 197 8.015 8.327 -0.312 1
1 508 . 13 3 2 C 13 13 LYS HA H 197 3.949 4.034 -0.085 1
1 517 . 13 3 2 C 13 13 LYS C C 197 178.419 178.956 -0.537 1
1 518 . 13 3 2 C 13 13 LYS CA C 197 60.191 59.697 0.494 1
1 519 . 13 3 2 C 13 13 LYS CB C 197 33.075 32.268 0.807 1
1 523 . 13 3 2 C 13 13 LYS N N 197 117.888 120.887 -2.999 1
1 524 . 13 3 2 C 14 14 LYS H H 198 7.506 7.780 -0.274 1
1 525 . 13 3 2 C 14 14 LYS HA H 198 4.127 4.102 0.025 1
1 534 . 13 3 2 C 14 14 LYS C C 198 178.262 178.380 -0.118 1
1 535 . 13 3 2 C 14 14 LYS CA C 198 59.161 58.218 0.943 1
1 536 . 13 3 2 C 14 14 LYS CB C 198 32.956 32.231 0.725 1
1 540 . 13 3 2 C 14 14 LYS N N 198 118.321 117.916 0.405 1
1 541 . 13 3 2 C 15 15 ILE H H 199 7.780 7.391 0.389 1
1 542 . 13 3 2 C 15 15 ILE HA H 199 3.787 3.951 -0.164 1
1 552 . 13 3 2 C 15 15 ILE C C 199 178.647 177.781 0.866 1
1 553 . 13 3 2 C 15 15 ILE CA C 199 64.912 63.412 1.500 1
1 554 . 13 3 2 C 15 15 ILE CB C 199 38.780 37.965 0.815 1
1 558 . 13 3 2 C 15 15 ILE N N 199 118.644 118.316 0.328 1
1 559 . 13 3 2 C 16 16 TYR H H 200 7.918 8.344 -0.426 1
1 560 . 13 3 2 C 16 16 TYR HA H 200 4.252 3.965 0.287 1
1 567 . 13 3 2 C 16 16 TYR C C 200 177.806 177.828 -0.022 1
1 568 . 13 3 2 C 16 16 TYR CA C 200 61.171 62.085 -0.914 1
1 569 . 13 3 2 C 16 16 TYR CB C 200 39.245 38.959 0.286 1
1 573 . 13 3 2 C 16 16 TYR N N 200 118.683 121.785 -3.102 1
1 574 . 13 3 2 C 17 17 GLU H H 201 8.089 8.800 -0.711 1
1 575 . 13 3 2 C 17 17 GLU HA H 201 4.124 3.969 0.155 1
1 580 . 13 3 2 C 17 17 GLU C C 201 177.414 177.645 -0.231 1
1 581 . 13 3 2 C 17 17 GLU CA C 201 58.784 57.928 0.856 1
1 582 . 13 3 2 C 17 17 GLU CB C 201 30.747 28.579 2.168 1
1 584 . 13 3 2 C 17 17 GLU N N 201 119.409 116.886 2.523 1
1 585 . 13 3 2 C 18 18 ASP H H 202 8.023 7.828 0.195 1
1 586 . 13 3 2 C 18 18 ASP HA H 202 4.657 4.655 0.002 1
1 589 . 13 3 2 C 18 18 ASP C C 202 177.346 176.138 1.208 1
1 590 . 13 3 2 C 18 18 ASP CA C 202 55.496 54.387 1.109 1
1 591 . 13 3 2 C 18 18 ASP CB C 202 42.023 41.615 0.408 1
1 592 . 13 3 2 C 18 18 ASP N N 202 119.459 119.630 -0.171 1
1 593 . 13 3 2 C 19 19 GLY H H 203 7.933 7.088 0.845 1
1 594 . 13 3 2 C 19 19 GLY HA2 H 203 3.938 4.014 -0.076 1
1 595 . 13 3 2 C 19 19 GLY HA3 H 203 3.938 4.030 -0.092 1
1 596 . 13 3 2 C 19 19 GLY C C 203 177.240 172.410 4.830 1
1 597 . 13 3 2 C 19 19 GLY CA C 203 46.309 45.069 1.240 1
1 598 . 13 3 2 C 19 19 GLY N N 203 108.518 106.217 2.301 1
1 599 . 13 3 2 C 20 20 ASP H H 204 8.091 8.635 -0.544 1
1 600 . 13 3 2 C 20 20 ASP HA H 204 4.616 5.076 -0.460 1
1 603 . 13 3 2 C 20 20 ASP C C 204 173.979 176.627 -2.648 1
1 604 . 13 3 2 C 20 20 ASP CA C 204 55.064 53.106 1.958 1
1 605 . 13 3 2 C 20 20 ASP CB C 204 42.203 40.934 1.269 1
1 606 . 13 3 2 C 20 20 ASP N N 204 120.172 117.893 2.279 1
1 607 . 13 3 2 C 21 21 ASP H H 205 8.352 8.045 0.307 1
1 608 . 13 3 2 C 21 21 ASP HA H 205 4.468 4.239 0.229 1
1 611 . 13 3 2 C 21 21 ASP C C 205 176.432 177.285 -0.853 1
1 612 . 13 3 2 C 21 21 ASP CA C 205 56.663 57.366 -0.703 1
1 613 . 13 3 2 C 21 21 ASP CB C 205 41.918 41.246 0.672 1
1 614 . 13 3 2 C 21 21 ASP N N 205 121.515 120.362 1.153 1
1 615 . 13 3 2 C 22 22 ASP H H 206 8.239 8.022 0.217 1
1 616 . 13 3 2 C 22 22 ASP HA H 206 4.455 4.508 -0.053 1
1 619 . 13 3 2 C 22 22 ASP C C 206 177.449 179.012 -1.563 1
1 620 . 13 3 2 C 22 22 ASP CA C 206 57.165 56.235 0.930 1
1 621 . 13 3 2 C 22 22 ASP CB C 206 41.820 40.529 1.291 1
1 622 . 13 3 2 C 22 22 ASP N N 206 120.156 118.015 2.141 1
1 623 . 13 3 2 C 23 23 MET H H 207 8.300 8.155 0.145 1
1 624 . 13 3 2 C 23 23 MET HA H 207 4.255 4.110 0.145 1
1 632 . 13 3 2 C 23 23 MET C C 207 178.412 178.628 -0.216 1
1 633 . 13 3 2 C 23 23 MET CA C 207 58.065 58.748 -0.683 1
1 634 . 13 3 2 C 23 23 MET CB C 207 32.488 33.020 -0.532 1
1 637 . 13 3 2 C 23 23 MET N N 207 120.707 118.801 1.906 1
1 638 . 13 3 2 C 24 24 LYS H H 208 8.047 7.534 0.513 1
1 639 . 13 3 2 C 24 24 LYS HA H 208 3.946 3.978 -0.032 1
1 648 . 13 3 2 C 24 24 LYS C C 208 178.008 178.536 -0.528 1
1 649 . 13 3 2 C 24 24 LYS CA C 208 59.847 59.999 -0.152 1
1 650 . 13 3 2 C 24 24 LYS CB C 208 32.983 32.210 0.773 1
1 654 . 13 3 2 C 24 24 LYS N N 208 119.504 118.904 0.600 1
1 655 . 13 3 2 C 25 25 ARG H H 209 7.891 7.871 0.020 1
1 656 . 13 3 2 C 25 25 ARG HA H 209 4.168 4.094 0.074 1
1 663 . 13 3 2 C 25 25 ARG C C 209 178.100 178.635 -0.535 1
1 664 . 13 3 2 C 25 25 ARG CA C 209 58.810 58.827 -0.017 1
1 665 . 13 3 2 C 25 25 ARG CB C 209 31.080 29.833 1.247 1
1 668 . 13 3 2 C 25 25 ARG N N 209 118.378 119.803 -1.425 1
1 669 . 13 3 2 C 26 26 THR H H 210 7.869 8.264 -0.395 1
1 670 . 13 3 2 C 26 26 THR HA H 210 4.023 4.083 -0.060 1
1 675 . 13 3 2 C 26 26 THR C C 210 177.984 176.938 1.046 1
1 676 . 13 3 2 C 26 26 THR CA C 210 65.747 66.678 -0.931 1
1 677 . 13 3 2 C 26 26 THR CB C 210 69.683 68.806 0.877 1
1 679 . 13 3 2 C 26 26 THR N N 210 115.443 115.650 -0.207 1
1 680 . 13 3 2 C 27 27 ILE H H 211 7.901 8.095 -0.194 1
1 681 . 13 3 2 C 27 27 ILE HA H 211 4.142 3.665 0.477 1
1 691 . 13 3 2 C 27 27 ILE C C 211 175.595 178.231 -2.636 1
1 692 . 13 3 2 C 27 27 ILE CA C 211 63.528 65.210 -1.682 1
1 693 . 13 3 2 C 27 27 ILE CB C 211 38.982 37.327 1.655 1
1 697 . 13 3 2 C 27 27 ILE N N 211 121.265 121.299 -0.034 1
1 698 . 13 3 2 C 28 28 ASN HA H 212 4.465 4.544 -0.079 1
1 703 . 13 3 2 C 28 28 ASN CA C 212 55.182 56.865 -1.683 1
1 704 . 13 3 2 C 28 28 ASN CB C 212 39.480 39.593 -0.113 1
1 706 . 13 3 2 C 29 29 LYS H H 213 7.968 8.018 -0.050 1
1 707 . 13 3 2 C 29 29 LYS HA H 213 4.072 3.967 0.105 1
1 716 . 13 3 2 C 29 29 LYS C C 213 176.218 179.779 -3.561 1
1 717 . 13 3 2 C 29 29 LYS CA C 213 58.489 59.773 -1.284 1
1 718 . 13 3 2 C 29 29 LYS CB C 213 33.165 32.358 0.807 1
1 722 . 13 3 2 C 29 29 LYS N N 213 120.820 117.802 3.018 1
1 723 . 13 3 2 C 30 30 ALA H H 214 7.865 8.248 -0.383 1
1 724 . 13 3 2 C 30 30 ALA HA H 214 4.217 4.167 0.050 1
1 728 . 13 3 2 C 30 30 ALA C C 214 177.041 179.772 -2.731 1
1 729 . 13 3 2 C 30 30 ALA CA C 214 54.104 54.945 -0.841 1
1 730 . 13 3 2 C 30 30 ALA CB C 214 19.496 18.350 1.146 1
1 731 . 13 3 2 C 30 30 ALA N N 214 121.571 121.413 0.158 1
1 732 . 13 3 2 C 31 31 TRP H H 215 7.831 7.696 0.135 1
1 733 . 13 3 2 C 31 31 TRP HA H 215 4.598 4.321 0.277 1
1 742 . 13 3 2 C 31 31 TRP C C 215 178.088 178.098 -0.010 1
1 743 . 13 3 2 C 31 31 TRP CA C 215 58.432 61.627 -3.195 1
1 744 . 13 3 2 C 31 31 TRP CB C 215 30.472 29.338 1.134 1
1 750 . 13 3 2 C 31 31 TRP N N 215 118.141 120.453 -2.312 1
1 752 . 13 3 2 C 32 32 VAL H H 216 7.594 8.783 -1.189 1
1 753 . 13 3 2 C 32 32 VAL HA H 216 3.978 3.172 0.806 1
1 761 . 13 3 2 C 32 32 VAL C C 216 176.574 178.059 -1.485 1
1 762 . 13 3 2 C 32 32 VAL CA C 216 63.329 66.340 -3.011 1
1 763 . 13 3 2 C 32 32 VAL CB C 216 33.373 31.277 2.096 1
1 766 . 13 3 2 C 32 32 VAL N N 216 118.287 119.798 -1.511 1
1 767 . 13 3 2 C 33 33 GLU H H 217 8.012 7.851 0.161 1
1 768 . 13 3 2 C 33 33 GLU HA H 217 4.257 4.173 0.084 1
1 773 . 13 3 2 C 33 33 GLU C C 217 176.164 177.350 -1.186 1
1 774 . 13 3 2 C 33 33 GLU CA C 217 57.409 58.311 -0.902 1
1 775 . 13 3 2 C 33 33 GLU CB C 217 30.978 29.346 1.632 1
1 777 . 13 3 2 C 33 33 GLU N N 217 122.535 119.603 2.932 1
1 778 . 13 3 2 C 34 34 SER H H 218 8.037 7.669 0.368 1
1 779 . 13 3 2 C 34 34 SER HA H 218 4.514 4.793 -0.279 1
1 782 . 13 3 2 C 34 34 SER C C 218 176.451 173.900 2.551 1
1 783 . 13 3 2 C 34 34 SER CA C 218 58.987 57.707 1.280 1
1 784 . 13 3 2 C 34 34 SER CB C 218 64.569 64.466 0.103 1
1 785 . 13 3 2 C 34 34 SER N N 218 117.058 113.641 3.417 1
1 6 . 14 1 1 A 2 2 ALA H H 2 8.191 8.540 -0.349 1
1 7 . 14 1 1 A 2 2 ALA CA C 2 51.957 51.467 0.490 1
1 8 . 14 1 1 A 2 2 ALA CB C 2 19.580 20.186 -0.606 1
1 9 . 14 1 1 A 2 2 ALA N N 2 124.666 123.062 1.604 1
1 10 . 14 1 1 A 3 3 SER H H 3 8.829 7.938 0.891 1
1 11 . 14 1 1 A 3 3 SER CA C 3 57.221 63.746 -6.525 1
1 12 . 14 1 1 A 3 3 SER N N 3 119.917 116.061 3.856 1
1 13 . 14 1 1 A 4 4 PRO CA C 4 66.688 65.779 0.909 1
1 14 . 14 1 1 A 4 4 PRO CB C 4 32.553 30.807 1.746 1
1 15 . 14 1 1 A 5 5 LEU H H 5 9.146 7.134 2.012 1
1 16 . 14 1 1 A 5 5 LEU CA C 5 59.017 56.996 2.021 1
1 17 . 14 1 1 A 5 5 LEU CB C 5 42.341 42.552 -0.211 1
1 18 . 14 1 1 A 5 5 LEU N N 5 117.902 116.305 1.597 1
1 19 . 14 1 1 A 6 6 ASP H H 6 7.572 8.406 -0.834 1
1 20 . 14 1 1 A 6 6 ASP CA C 6 57.997 57.752 0.245 1
1 21 . 14 1 1 A 6 6 ASP CB C 6 40.910 42.288 -1.378 1
1 22 . 14 1 1 A 6 6 ASP N N 6 118.259 119.368 -1.109 1
1 23 . 14 1 1 A 7 7 GLN H H 7 8.660 8.577 0.083 1
1 24 . 14 1 1 A 7 7 GLN HA H 7 4.064 4.091 -0.027 1
1 29 . 14 1 1 A 7 7 GLN CA C 7 59.270 58.754 0.516 1
1 30 . 14 1 1 A 7 7 GLN CB C 7 28.468 27.835 0.633 1
1 31 . 14 1 1 A 7 7 GLN N N 7 119.558 117.103 2.455 1
1 32 . 14 1 1 A 8 8 ALA H H 8 8.253 7.727 0.526 1
1 33 . 14 1 1 A 8 8 ALA CA C 8 55.519 54.919 0.600 1
1 34 . 14 1 1 A 8 8 ALA CB C 8 18.113 18.378 -0.265 1
1 35 . 14 1 1 A 8 8 ALA N N 8 123.628 122.038 1.590 1
1 36 . 14 1 1 A 9 9 ILE H H 9 8.134 8.144 -0.010 1
1 37 . 14 1 1 A 9 9 ILE CA C 9 65.261 64.619 0.642 1
1 38 . 14 1 1 A 9 9 ILE CB C 9 37.023 37.248 -0.225 1
1 39 . 14 1 1 A 9 9 ILE N N 9 117.056 117.215 -0.159 1
1 40 . 14 1 1 A 10 10 GLY H H 10 8.515 8.437 0.078 1
1 41 . 14 1 1 A 10 10 GLY HA3 H 10 3.773 3.784 -0.011 1
1 42 . 14 1 1 A 10 10 GLY CA C 10 47.637 47.036 0.601 1
1 43 . 14 1 1 A 10 10 GLY N N 10 106.202 110.904 -4.702 1
1 44 . 14 1 1 A 11 11 LEU H H 11 8.212 7.868 0.344 1
1 45 . 14 1 1 A 11 11 LEU CA C 11 58.354 57.893 0.461 1
1 46 . 14 1 1 A 11 11 LEU CB C 11 41.683 42.051 -0.368 1
1 47 . 14 1 1 A 11 11 LEU N N 11 124.624 123.343 1.281 1
1 48 . 14 1 1 A 12 12 LEU H H 12 7.971 7.908 0.063 1
1 49 . 14 1 1 A 12 12 LEU HA H 12 4.144 4.188 -0.044 1
1 59 . 14 1 1 A 12 12 LEU CA C 12 58.691 58.514 0.177 1
1 60 . 14 1 1 A 12 12 LEU CB C 12 40.657 41.494 -0.837 1
1 61 . 14 1 1 A 12 12 LEU N N 12 118.095 118.704 -0.609 1
1 62 . 14 1 1 A 13 13 ILE H H 13 8.379 8.540 -0.161 1
1 63 . 14 1 1 A 13 13 ILE CA C 13 66.405 65.103 1.302 1
1 64 . 14 1 1 A 13 13 ILE CB C 13 38.916 37.796 1.120 1
1 65 . 14 1 1 A 13 13 ILE N N 13 121.161 120.018 1.143 1
1 66 . 14 1 1 A 14 14 GLY H H 14 8.823 8.483 0.340 1
1 67 . 14 1 1 A 14 14 GLY HA2 H 14 4.147 3.741 0.406 1
1 68 . 14 1 1 A 14 14 GLY HA3 H 14 3.982 3.765 0.217 1
1 69 . 14 1 1 A 14 14 GLY CA C 14 47.750 47.525 0.225 1
1 70 . 14 1 1 A 14 14 GLY N N 14 108.982 107.651 1.331 1
1 71 . 14 1 1 A 15 15 ILE H H 15 8.681 8.486 0.195 1
1 72 . 14 1 1 A 15 15 ILE CA C 15 64.996 64.615 0.381 1
1 73 . 14 1 1 A 15 15 ILE CB C 15 37.107 37.566 -0.459 1
1 74 . 14 1 1 A 15 15 ILE N N 15 121.601 122.757 -1.156 1
1 75 . 14 1 1 A 16 16 PHE H H 16 7.103 8.645 -1.542 1
1 76 . 14 1 1 A 16 16 PHE CA C 16 62.910 61.459 1.451 1
1 77 . 14 1 1 A 16 16 PHE CB C 16 38.782 39.260 -0.478 1
1 78 . 14 1 1 A 16 16 PHE N N 16 118.660 120.792 -2.132 1
1 79 . 14 1 1 A 17 17 HIS H H 17 7.591 8.763 -1.172 1
1 80 . 14 1 1 A 17 17 HIS HA H 17 4.793 4.225 0.568 1
1 82 . 14 1 1 A 17 17 HIS CA C 17 58.125 59.553 -1.428 1
1 83 . 14 1 1 A 17 17 HIS CB C 17 29.584 30.029 -0.445 1
1 84 . 14 1 1 A 17 17 HIS N N 17 114.968 118.950 -3.982 1
1 85 . 14 1 1 A 18 18 LYS H H 18 8.144 8.073 0.071 1
1 86 . 14 1 1 A 18 18 LYS CA C 18 58.975 58.740 0.235 1
1 87 . 14 1 1 A 18 18 LYS CB C 18 32.379 31.917 0.462 1
1 88 . 14 1 1 A 18 18 LYS N N 18 122.373 117.523 4.850 1
1 89 . 14 1 1 A 19 19 TYR H H 19 6.999 7.204 -0.205 1
1 90 . 14 1 1 A 19 19 TYR CA C 19 60.318 60.870 -0.552 1
1 91 . 14 1 1 A 19 19 TYR CB C 19 40.355 38.132 2.223 1
1 92 . 14 1 1 A 19 19 TYR N N 19 113.614 119.110 -5.496 1
1 93 . 14 1 1 A 20 20 SER H H 20 8.432 7.608 0.824 1
1 94 . 14 1 1 A 20 20 SER CA C 20 61.897 62.195 -0.298 1
1 95 . 14 1 1 A 20 20 SER CB C 20 61.354 62.776 -1.422 1
1 96 . 14 1 1 A 20 20 SER N N 20 113.201 116.835 -3.634 1
1 97 . 14 1 1 A 21 21 GLY H H 21 7.678 7.873 -0.195 1
1 98 . 14 1 1 A 21 21 GLY HA2 H 21 4.195 3.837 0.358 1
1 99 . 14 1 1 A 21 21 GLY HA3 H 21 3.900 3.868 0.032 1
1 100 . 14 1 1 A 21 21 GLY CA C 21 45.628 45.491 0.137 1
1 101 . 14 1 1 A 21 21 GLY N N 21 110.734 108.496 2.238 1
1 102 . 14 1 1 A 22 22 LYS H H 22 7.362 7.624 -0.262 1
1 103 . 14 1 1 A 22 22 LYS CA C 22 60.163 59.314 0.849 1
1 104 . 14 1 1 A 22 22 LYS CB C 22 32.554 32.936 -0.382 1
1 105 . 14 1 1 A 22 22 LYS N N 22 122.161 119.970 2.191 1
1 106 . 14 1 1 A 23 23 GLU H H 23 9.639 8.230 1.409 1
1 107 . 14 1 1 A 23 23 GLU CA C 23 54.449 56.383 -1.934 1
1 108 . 14 1 1 A 23 23 GLU N N 23 116.288 113.055 3.233 1
1 109 . 14 1 1 A 24 24 GLY HA2 H 24 3.912 4.014 -0.102 1
1 110 . 14 1 1 A 24 24 GLY HA3 H 24 3.787 4.024 -0.237 1
1 111 . 14 1 1 A 24 24 GLY CA C 24 45.898 44.367 1.531 1
1 112 . 14 1 1 A 25 25 ASP H H 25 8.204 8.160 0.044 1
1 113 . 14 1 1 A 25 25 ASP CA C 25 55.252 54.563 0.689 1
1 114 . 14 1 1 A 25 25 ASP N N 25 125.671 119.757 5.914 1
1 115 . 14 1 1 A 26 26 LYS CA C 26 57.851 58.769 -0.918 1
1 116 . 14 1 1 A 26 26 LYS CB C 26 31.265 32.245 -0.980 1
1 117 . 14 1 1 A 27 27 HIS H H 27 9.763 7.944 1.819 1
1 118 . 14 1 1 A 27 27 HIS CA C 27 55.580 55.998 -0.418 1
1 119 . 14 1 1 A 27 27 HIS CB C 27 30.936 30.959 -0.023 1
1 120 . 14 1 1 A 27 27 HIS N N 27 118.108 115.663 2.445 1
1 121 . 14 1 1 A 28 28 THR H H 28 7.325 7.607 -0.282 1
1 126 . 14 1 1 A 28 28 THR CA C 28 60.128 59.794 0.334 1
1 127 . 14 1 1 A 28 28 THR CB C 28 72.268 71.724 0.544 1
1 128 . 14 1 1 A 28 28 THR N N 28 106.920 113.965 -7.045 1
1 129 . 14 1 1 A 29 29 LEU H H 29 9.422 9.113 0.309 1
1 130 . 14 1 1 A 29 29 LEU HA H 29 5.368 4.975 0.393 1
1 140 . 14 1 1 A 29 29 LEU CA C 29 52.567 53.361 -0.794 1
1 141 . 14 1 1 A 29 29 LEU CB C 29 43.523 45.637 -2.114 1
1 142 . 14 1 1 A 29 29 LEU N N 29 125.021 123.309 1.712 1
1 143 . 14 1 1 A 30 30 SER H H 30 10.485 9.017 1.468 1
1 144 . 14 1 1 A 30 30 SER CA C 30 56.653 57.944 -1.291 1
1 145 . 14 1 1 A 30 30 SER CB C 30 65.313 63.727 1.586 1
1 146 . 14 1 1 A 30 30 SER N N 30 124.758 119.309 5.449 1
1 147 . 14 1 1 A 31 31 LYS H H 31 8.728 8.711 0.017 1
1 148 . 14 1 1 A 31 31 LYS CA C 31 59.669 59.234 0.435 1
1 149 . 14 1 1 A 31 31 LYS CB C 31 31.763 31.949 -0.186 1
1 150 . 14 1 1 A 31 31 LYS N N 31 119.459 124.064 -4.605 1
1 151 . 14 1 1 A 32 32 LYS H H 32 7.857 7.995 -0.138 1
1 152 . 14 1 1 A 32 32 LYS CA C 32 59.721 59.660 0.061 1
1 153 . 14 1 1 A 32 32 LYS CB C 32 32.901 32.069 0.832 1
1 154 . 14 1 1 A 32 32 LYS N N 32 117.933 119.420 -1.487 1
1 155 . 14 1 1 A 33 33 GLU H H 33 7.559 7.967 -0.408 1
1 156 . 14 1 1 A 33 33 GLU CA C 33 59.169 58.932 0.237 1
1 157 . 14 1 1 A 33 33 GLU CB C 33 31.014 29.380 1.634 1
1 158 . 14 1 1 A 33 33 GLU N N 33 120.407 119.157 1.250 1
1 159 . 14 1 1 A 34 34 LEU H H 34 8.833 8.434 0.399 1
1 160 . 14 1 1 A 34 34 LEU CA C 34 56.928 57.719 -0.791 1
1 161 . 14 1 1 A 34 34 LEU CB C 34 41.435 41.414 0.021 1
1 162 . 14 1 1 A 34 34 LEU N N 34 117.677 120.871 -3.194 1
1 163 . 14 1 1 A 35 35 LYS H H 35 8.010 7.930 0.080 1
1 164 . 14 1 1 A 35 35 LYS CA C 35 60.692 59.748 0.944 1
1 165 . 14 1 1 A 35 35 LYS CB C 35 32.223 32.157 0.066 1
1 166 . 14 1 1 A 35 35 LYS N N 35 119.829 118.941 0.888 1
1 167 . 14 1 1 A 36 36 GLU H H 36 7.169 8.071 -0.902 1
1 168 . 14 1 1 A 36 36 GLU CA C 36 59.588 58.912 0.676 1
1 169 . 14 1 1 A 36 36 GLU CB C 36 29.342 29.630 -0.288 1
1 170 . 14 1 1 A 36 36 GLU N N 36 117.340 119.364 -2.024 1
1 171 . 14 1 1 A 37 37 LEU H H 37 7.478 7.612 -0.134 1
1 172 . 14 1 1 A 37 37 LEU CA C 37 59.674 57.671 2.003 1
1 173 . 14 1 1 A 37 37 LEU CB C 37 42.142 41.124 1.018 1
1 174 . 14 1 1 A 37 37 LEU N N 37 120.884 121.393 -0.509 1
1 175 . 14 1 1 A 38 38 ILE H H 38 8.377 8.335 0.042 1
1 176 . 14 1 1 A 38 38 ILE CA C 38 65.651 65.395 0.256 1
1 177 . 14 1 1 A 38 38 ILE N N 38 118.450 119.977 -1.527 1
1 178 . 14 1 1 A 39 39 GLN H H 39 8.217 8.024 0.193 1
1 179 . 14 1 1 A 39 39 GLN CA C 39 59.788 58.276 1.512 1
1 180 . 14 1 1 A 39 39 GLN CB C 39 29.278 28.330 0.948 1
1 181 . 14 1 1 A 39 39 GLN N N 39 113.091 117.706 -4.615 1
1 182 . 14 1 1 A 40 40 LYS H H 40 8.426 7.565 0.861 1
1 183 . 14 1 1 A 40 40 LYS CA C 40 57.807 58.805 -0.998 1
1 184 . 14 1 1 A 40 40 LYS CB C 40 33.942 33.190 0.752 1
1 185 . 14 1 1 A 40 40 LYS N N 40 114.771 119.786 -5.015 1
1 186 . 14 1 1 A 41 41 GLU H H 41 8.496 8.428 0.068 1
1 187 . 14 1 1 A 41 41 GLU CA C 41 55.395 58.791 -3.396 1
1 188 . 14 1 1 A 41 41 GLU CB C 41 29.260 30.351 -1.091 1
1 189 . 14 1 1 A 41 41 GLU N N 41 112.546 119.484 -6.938 1
1 190 . 14 1 1 A 42 42 LEU H H 42 7.267 7.911 -0.644 1
1 191 . 14 1 1 A 42 42 LEU CA C 42 53.776 57.289 -3.513 1
1 192 . 14 1 1 A 42 42 LEU N N 42 118.657 118.389 0.268 1
1 193 . 14 1 1 A 44 44 ILE CA C 44 62.210 61.297 0.913 1
1 194 . 14 1 1 A 44 44 ILE CB C 44 38.247 39.202 -0.955 1
1 195 . 14 1 1 A 45 45 GLY H H 45 7.820 8.175 -0.355 1
1 196 . 14 1 1 A 45 45 GLY CA C 45 47.742 46.496 1.246 1
1 197 . 14 1 1 A 45 45 GLY N N 45 108.178 110.552 -2.374 1
1 198 . 14 1 1 A 46 46 SER H H 46 7.895 8.917 -1.022 1
1 199 . 14 1 1 A 46 46 SER CA C 46 59.958 59.309 0.649 1
1 200 . 14 1 1 A 46 46 SER CB C 46 63.450 63.487 -0.037 1
1 201 . 14 1 1 A 46 46 SER N N 46 113.038 120.961 -7.923 1
1 202 . 14 1 1 A 47 47 LYS H H 47 7.736 6.861 0.875 1
1 203 . 14 1 1 A 47 47 LYS CA C 47 55.636 56.683 -1.047 1
1 204 . 14 1 1 A 47 47 LYS CB C 47 33.103 33.244 -0.141 1
1 205 . 14 1 1 A 47 47 LYS N N 47 119.422 123.018 -3.596 1
1 206 . 14 1 1 A 48 48 LEU H H 48 6.988 8.649 -1.661 1
1 207 . 14 1 1 A 48 48 LEU HA H 48 4.497 4.137 0.360 1
1 217 . 14 1 1 A 48 48 LEU CA C 48 54.517 56.923 -2.406 1
1 218 . 14 1 1 A 48 48 LEU CB C 48 42.987 41.454 1.533 1
1 219 . 14 1 1 A 48 48 LEU N N 48 118.908 126.188 -7.280 1
1 220 . 14 1 1 A 49 49 GLN H H 49 9.206 8.204 1.002 1
1 221 . 14 1 1 A 49 49 GLN HA H 49 4.486 4.319 0.167 1
1 223 . 14 1 1 A 49 49 GLN CA C 49 54.785 58.028 -3.243 1
1 224 . 14 1 1 A 49 49 GLN CB C 49 29.636 28.444 1.192 1
1 225 . 14 1 1 A 49 49 GLN N N 49 121.275 118.603 2.672 1
1 226 . 14 1 1 A 50 50 ASP H H 50 8.854 8.042 0.812 1
1 227 . 14 1 1 A 50 50 ASP CA C 50 59.078 57.487 1.591 1
1 228 . 14 1 1 A 50 50 ASP CB C 50 40.632 41.773 -1.141 1
1 229 . 14 1 1 A 50 50 ASP N N 50 123.430 120.155 3.275 1
1 230 . 14 1 1 A 51 51 ALA H H 51 8.720 8.063 0.657 1
1 231 . 14 1 1 A 51 51 ALA CA C 51 55.281 54.855 0.426 1
1 232 . 14 1 1 A 51 51 ALA CB C 51 18.205 18.115 0.090 1
1 233 . 14 1 1 A 51 51 ALA N N 51 117.829 121.245 -3.416 1
1 234 . 14 1 1 A 52 52 GLU H H 52 7.161 7.703 -0.542 1
1 235 . 14 1 1 A 52 52 GLU CA C 52 58.757 58.850 -0.093 1
1 236 . 14 1 1 A 52 52 GLU CB C 52 30.247 29.317 0.930 1
1 237 . 14 1 1 A 52 52 GLU N N 52 115.459 117.121 -1.662 1
1 238 . 14 1 1 A 53 53 ILE H H 53 7.962 7.845 0.117 1
1 239 . 14 1 1 A 53 53 ILE CA C 53 65.525 65.129 0.396 1
1 240 . 14 1 1 A 53 53 ILE CB C 53 37.289 37.973 -0.684 1
1 241 . 14 1 1 A 53 53 ILE N N 53 120.414 121.426 -1.012 1
1 242 . 14 1 1 A 54 54 VAL H H 54 8.132 8.143 -0.011 1
1 243 . 14 1 1 A 54 54 VAL CA C 54 67.290 65.386 1.904 1
1 244 . 14 1 1 A 54 54 VAL CB C 54 31.434 31.328 0.106 1
1 245 . 14 1 1 A 54 54 VAL N N 54 119.775 116.913 2.862 1
1 246 . 14 1 1 A 55 55 LYS H H 55 7.155 8.052 -0.897 1
1 247 . 14 1 1 A 55 55 LYS CA C 55 59.131 59.177 -0.046 1
1 248 . 14 1 1 A 55 55 LYS CB C 55 32.131 31.810 0.321 1
1 249 . 14 1 1 A 55 55 LYS N N 55 119.175 120.869 -1.694 1
1 250 . 14 1 1 A 56 56 LEU H H 56 7.837 8.330 -0.493 1
1 251 . 14 1 1 A 56 56 LEU CA C 56 58.052 58.028 0.024 1
1 252 . 14 1 1 A 56 56 LEU CB C 56 41.878 41.814 0.064 1
1 253 . 14 1 1 A 56 56 LEU N N 56 119.679 121.111 -1.432 1
1 254 . 14 1 1 A 57 57 MET H H 57 8.385 8.425 -0.040 1
1 255 . 14 1 1 A 57 57 MET CA C 57 60.756 58.079 2.677 1
1 256 . 14 1 1 A 57 57 MET CB C 57 33.152 32.560 0.592 1
1 257 . 14 1 1 A 57 57 MET N N 57 115.116 116.809 -1.693 1
1 258 . 14 1 1 A 58 58 ASP H H 58 7.591 8.147 -0.556 1
1 259 . 14 1 1 A 58 58 ASP CA C 58 57.365 56.691 0.674 1
1 260 . 14 1 1 A 58 58 ASP CB C 58 40.858 40.675 0.183 1
1 261 . 14 1 1 A 58 58 ASP N N 58 118.197 120.003 -1.806 1
1 262 . 14 1 1 A 59 59 ASP H H 59 7.725 7.929 -0.204 1
1 263 . 14 1 1 A 59 59 ASP CA C 59 56.830 57.419 -0.589 1
1 264 . 14 1 1 A 59 59 ASP CB C 59 40.567 41.050 -0.483 1
1 265 . 14 1 1 A 59 59 ASP N N 59 118.481 118.717 -0.236 1
1 266 . 14 1 1 A 60 60 LEU H H 60 7.703 8.202 -0.499 1
1 267 . 14 1 1 A 60 60 LEU CA C 60 56.564 57.698 -1.134 1
1 268 . 14 1 1 A 60 60 LEU CB C 60 42.714 40.875 1.839 1
1 269 . 14 1 1 A 60 60 LEU N N 60 116.935 121.147 -4.212 1
1 270 . 14 1 1 A 61 61 ASP H H 61 7.143 7.849 -0.706 1
1 271 . 14 1 1 A 61 61 ASP HA H 61 4.690 4.486 0.204 1
1 274 . 14 1 1 A 61 61 ASP CA C 61 52.286 55.710 -3.424 1
1 275 . 14 1 1 A 61 61 ASP CB C 61 39.245 40.792 -1.547 1
1 276 . 14 1 1 A 61 61 ASP N N 61 116.605 119.110 -2.505 1
1 277 . 14 1 1 A 62 62 ARG H H 62 7.786 7.896 -0.110 1
1 278 . 14 1 1 A 62 62 ARG CA C 62 58.328 59.023 -0.695 1
1 279 . 14 1 1 A 62 62 ARG CB C 62 30.106 29.716 0.390 1
1 280 . 14 1 1 A 62 62 ARG N N 62 125.967 120.010 5.957 1
1 281 . 14 1 1 A 63 63 ASN H H 63 7.945 7.919 0.026 1
1 282 . 14 1 1 A 63 63 ASN CA C 63 51.863 55.261 -3.398 1
1 283 . 14 1 1 A 63 63 ASN CB C 63 36.809 38.435 -1.626 1
1 284 . 14 1 1 A 63 63 ASN N N 63 112.434 117.588 -5.154 1
1 285 . 14 1 1 A 64 64 LYS H H 64 7.477 7.800 -0.323 1
1 286 . 14 1 1 A 64 64 LYS CA C 64 56.524 54.967 1.557 1
1 287 . 14 1 1 A 64 64 LYS N N 64 114.197 117.834 -3.637 1
1 288 . 14 1 1 A 65 65 ASP H H 65 8.345 8.671 -0.326 1
1 289 . 14 1 1 A 65 65 ASP CA C 65 52.969 53.350 -0.381 1
1 290 . 14 1 1 A 65 65 ASP CB C 65 40.329 43.350 -3.021 1
1 291 . 14 1 1 A 65 65 ASP N N 65 118.581 120.693 -2.112 1
1 292 . 14 1 1 A 66 66 GLN H H 66 9.945 7.981 1.964 1
1 293 . 14 1 1 A 66 66 GLN CA C 66 58.132 57.082 1.050 1
1 294 . 14 1 1 A 66 66 GLN CB C 66 26.035 31.381 -5.346 1
1 295 . 14 1 1 A 66 66 GLN N N 66 113.203 118.407 -5.204 1
1 296 . 14 1 1 A 67 67 GLU H H 67 7.880 8.271 -0.391 1
1 297 . 14 1 1 A 67 67 GLU HA H 67 4.910 4.922 -0.012 1
1 302 . 14 1 1 A 67 67 GLU CA C 67 54.082 55.279 -1.197 1
1 303 . 14 1 1 A 67 67 GLU CB C 67 33.174 32.784 0.390 1
1 304 . 14 1 1 A 67 67 GLU N N 67 118.554 115.134 3.420 1
1 305 . 14 1 1 A 68 68 VAL H H 68 9.669 9.496 0.173 1
1 306 . 14 1 1 A 68 68 VAL HA H 68 5.465 4.976 0.489 1
1 314 . 14 1 1 A 68 68 VAL CA C 68 61.079 59.818 1.261 1
1 315 . 14 1 1 A 68 68 VAL CB C 68 33.280 34.447 -1.167 1
1 316 . 14 1 1 A 68 68 VAL N N 68 126.572 120.124 6.448 1
1 317 . 14 1 1 A 69 69 ASN H H 69 8.985 8.818 0.167 1
1 318 . 14 1 1 A 69 69 ASN CA C 69 50.812 53.371 -2.559 1
1 319 . 14 1 1 A 69 69 ASN CB C 69 38.609 40.314 -1.705 1
1 320 . 14 1 1 A 69 69 ASN N N 69 127.472 125.775 1.697 1
1 321 . 14 1 1 A 70 70 PHE H H 70 9.100 8.736 0.364 1
1 322 . 14 1 1 A 70 70 PHE CA C 70 63.279 61.829 1.450 1
1 323 . 14 1 1 A 70 70 PHE CB C 70 38.741 39.314 -0.573 1
1 324 . 14 1 1 A 70 70 PHE N N 70 119.972 126.967 -6.995 1
1 325 . 14 1 1 A 71 71 GLN H H 71 8.342 8.326 0.016 1
1 326 . 14 1 1 A 71 71 GLN HA H 71 3.923 3.657 0.266 1
1 329 . 14 1 1 A 71 71 GLN CA C 71 59.866 58.486 1.380 1
1 330 . 14 1 1 A 71 71 GLN CB C 71 27.878 28.553 -0.675 1
1 331 . 14 1 1 A 71 71 GLN N N 71 118.216 117.600 0.616 1
1 332 . 14 1 1 A 72 72 GLU H H 72 8.721 7.629 1.092 1
1 333 . 14 1 1 A 72 72 GLU HA H 72 4.147 4.070 0.077 1
1 338 . 14 1 1 A 72 72 GLU CA C 72 59.313 58.909 0.404 1
1 339 . 14 1 1 A 72 72 GLU CB C 72 30.233 29.445 0.788 1
1 340 . 14 1 1 A 72 72 GLU N N 72 121.455 119.871 1.584 1
1 341 . 14 1 1 A 73 73 TYR H H 73 8.536 8.025 0.511 1
1 342 . 14 1 1 A 73 73 TYR CA C 73 60.961 61.529 -0.568 1
1 343 . 14 1 1 A 73 73 TYR CB C 73 38.724 38.709 0.015 1
1 344 . 14 1 1 A 73 73 TYR N N 73 123.356 122.181 1.175 1
1 345 . 14 1 1 A 74 74 ILE H H 74 8.642 8.048 0.594 1
1 346 . 14 1 1 A 74 74 ILE CA C 74 61.880 64.366 -2.486 1
1 347 . 14 1 1 A 74 74 ILE CB C 74 36.077 36.905 -0.828 1
1 348 . 14 1 1 A 74 74 ILE N N 74 119.799 120.617 -0.818 1
1 349 . 14 1 1 A 75 75 THR H H 75 7.959 7.958 0.001 1
1 354 . 14 1 1 A 75 75 THR CA C 75 67.056 66.710 0.346 1
1 355 . 14 1 1 A 75 75 THR CB C 75 68.386 68.550 -0.164 1
1 356 . 14 1 1 A 75 75 THR N N 75 119.486 116.997 2.489 1
1 357 . 14 1 1 A 76 76 PHE H H 76 7.450 8.221 -0.771 1
1 358 . 14 1 1 A 76 76 PHE CA C 76 59.010 61.649 -2.639 1
1 359 . 14 1 1 A 76 76 PHE CB C 76 38.139 39.258 -1.119 1
1 360 . 14 1 1 A 76 76 PHE N N 76 122.873 122.510 0.363 1
1 361 . 14 1 1 A 77 77 LEU H H 77 7.829 8.274 -0.445 1
1 362 . 14 1 1 A 77 77 LEU CA C 77 57.450 57.548 -0.098 1
1 363 . 14 1 1 A 77 77 LEU CB C 77 40.560 41.067 -0.507 1
1 364 . 14 1 1 A 77 77 LEU N N 77 117.405 118.550 -1.145 1
1 365 . 14 1 1 A 78 78 GLY H H 78 8.093 8.235 -0.142 1
1 366 . 14 1 1 A 78 78 GLY HA2 H 78 3.661 3.709 -0.048 1
1 367 . 14 1 1 A 78 78 GLY HA3 H 78 3.594 3.723 -0.129 1
1 368 . 14 1 1 A 78 78 GLY CA C 78 47.442 47.015 0.427 1
1 369 . 14 1 1 A 78 78 GLY N N 78 105.528 106.243 -0.715 1
1 370 . 14 1 1 A 79 79 ALA H H 79 7.759 7.660 0.099 1
1 371 . 14 1 1 A 79 79 ALA CA C 79 55.153 54.628 0.525 1
1 372 . 14 1 1 A 79 79 ALA CB C 79 17.768 18.896 -1.128 1
1 373 . 14 1 1 A 79 79 ALA N N 79 124.488 125.037 -0.549 1
1 374 . 14 1 1 A 80 80 LEU H H 80 7.963 7.891 0.072 1
1 375 . 14 1 1 A 80 80 LEU CA C 80 57.464 57.451 0.013 1
1 376 . 14 1 1 A 80 80 LEU CB C 80 41.496 40.786 0.710 1
1 377 . 14 1 1 A 80 80 LEU N N 80 117.869 119.555 -1.686 1
1 378 . 14 1 1 A 81 81 ALA H H 81 8.365 8.142 0.223 1
1 379 . 14 1 1 A 81 81 ALA CA C 81 55.475 54.791 0.684 1
1 380 . 14 1 1 A 81 81 ALA CB C 81 17.483 18.021 -0.538 1
1 381 . 14 1 1 A 81 81 ALA N N 81 119.054 119.701 -0.647 1
1 382 . 14 1 1 A 82 82 MET H H 82 8.112 7.684 0.428 1
1 383 . 14 1 1 A 82 82 MET CA C 82 59.516 57.933 1.583 1
1 384 . 14 1 1 A 82 82 MET CB C 82 32.550 32.214 0.336 1
1 385 . 14 1 1 A 82 82 MET N N 82 115.364 117.493 -2.129 1
1 386 . 14 1 1 A 83 83 ILE H H 83 7.981 8.066 -0.085 1
1 387 . 14 1 1 A 83 83 ILE HA H 83 3.839 3.766 0.073 1
1 391 . 14 1 1 A 83 83 ILE CA C 83 64.467 64.927 -0.460 1
1 392 . 14 1 1 A 83 83 ILE CB C 83 37.312 37.188 0.124 1
1 393 . 14 1 1 A 83 83 ILE N N 83 120.887 119.565 1.322 1
1 394 . 14 1 1 A 84 84 TYR H H 84 8.731 7.974 0.757 1
1 395 . 14 1 1 A 84 84 TYR N N 84 120.933 119.386 1.547 1
1 396 . 14 1 1 A 87 87 ALA H H 87 7.829 8.242 -0.413 1
1 397 . 14 1 1 A 87 87 ALA CA C 87 53.768 54.801 -1.033 1
1 398 . 14 1 1 A 87 87 ALA CB C 87 18.504 18.432 0.072 1
1 399 . 14 1 1 A 87 87 ALA N N 87 120.274 122.840 -2.566 1
1 400 . 14 1 1 A 88 88 LEU H H 88 7.499 8.291 -0.792 1
1 401 . 14 1 1 A 88 88 LEU CA C 88 55.605 57.352 -1.747 1
1 402 . 14 1 1 A 88 88 LEU CB C 88 42.047 41.361 0.686 1
1 403 . 14 1 1 A 88 88 LEU N N 88 117.356 120.378 -3.022 1
1 404 . 14 1 1 A 89 89 LYS H H 89 7.561 7.982 -0.421 1
1 405 . 14 1 1 A 89 89 LYS CA C 89 56.865 59.415 -2.550 1
1 406 . 14 1 1 A 89 89 LYS CB C 89 32.592 31.958 0.634 1
1 407 . 14 1 1 A 89 89 LYS N N 89 119.289 119.744 -0.455 1
1 416 . 14 3 2 C 6 6 GLU H H 190 8.385 8.935 -0.550 1
1 417 . 14 3 2 C 6 6 GLU HA H 190 4.153 4.960 -0.807 1
1 422 . 14 3 2 C 6 6 GLU C C 190 175.031 175.170 -0.139 1
1 423 . 14 3 2 C 6 6 GLU CA C 190 58.866 54.741 4.125 1
1 424 . 14 3 2 C 6 6 GLU CB C 190 30.751 33.202 -2.451 1
1 426 . 14 3 2 C 6 6 GLU N N 190 122.715 118.719 3.996 1
1 427 . 14 3 2 C 7 7 GLY H H 191 8.475 8.800 -0.325 1
1 428 . 14 3 2 C 7 7 GLY HA2 H 191 3.887 4.111 -0.224 1
1 429 . 14 3 2 C 7 7 GLY HA3 H 191 3.887 4.111 -0.224 1
1 430 . 14 3 2 C 7 7 GLY C C 191 177.922 174.846 3.076 1
1 431 . 14 3 2 C 7 7 GLY CA C 191 46.884 44.733 2.151 1
1 432 . 14 3 2 C 7 7 GLY N N 191 109.009 107.341 1.668 1
1 433 . 14 3 2 C 8 8 LEU HA H 192 4.095 3.921 0.174 1
1 443 . 14 3 2 C 8 8 LEU CA C 192 58.154 58.099 0.055 1
1 444 . 14 3 2 C 8 8 LEU CB C 192 42.789 41.694 1.095 1
1 448 . 14 3 2 C 9 9 MET H H 193 8.250 8.173 0.077 1
1 449 . 14 3 2 C 9 9 MET HA H 193 4.150 4.099 0.051 1
1 457 . 14 3 2 C 9 9 MET C C 193 178.421 178.260 0.161 1
1 458 . 14 3 2 C 9 9 MET CA C 193 58.818 58.467 0.351 1
1 459 . 14 3 2 C 9 9 MET CB C 193 32.360 31.842 0.518 1
1 462 . 14 3 2 C 9 9 MET N N 193 117.049 118.749 -1.700 1
1 463 . 14 3 2 C 10 10 ASN H H 194 7.892 8.175 -0.283 1
1 464 . 14 3 2 C 10 10 ASN HA H 194 4.468 4.540 -0.072 1
1 469 . 14 3 2 C 10 10 ASN C C 194 178.099 176.571 1.528 1
1 470 . 14 3 2 C 10 10 ASN CA C 194 56.644 55.354 1.290 1
1 471 . 14 3 2 C 10 10 ASN CB C 194 39.100 38.609 0.491 1
1 472 . 14 3 2 C 10 10 ASN N N 194 117.034 118.766 -1.732 1
1 474 . 14 3 2 C 11 11 VAL H H 195 7.651 7.918 -0.267 1
1 475 . 14 3 2 C 11 11 VAL HA H 195 3.735 3.869 -0.134 1
1 483 . 14 3 2 C 11 11 VAL C C 195 177.657 178.179 -0.522 1
1 484 . 14 3 2 C 11 11 VAL CA C 195 66.710 65.070 1.640 1
1 485 . 14 3 2 C 11 11 VAL CB C 195 32.468 32.012 0.456 1
1 488 . 14 3 2 C 11 11 VAL N N 195 119.878 117.842 2.036 1
1 489 . 14 3 2 C 12 12 LEU H H 196 8.030 8.086 -0.056 1
1 490 . 14 3 2 C 12 12 LEU HA H 196 4.013 3.974 0.039 1
1 500 . 14 3 2 C 12 12 LEU C C 196 177.540 179.482 -1.942 1
1 501 . 14 3 2 C 12 12 LEU CA C 196 58.489 57.684 0.805 1
1 502 . 14 3 2 C 12 12 LEU CB C 196 42.457 40.904 1.553 1
1 506 . 14 3 2 C 12 12 LEU N N 196 119.499 120.239 -0.740 1
1 507 . 14 3 2 C 13 13 LYS H H 197 8.015 8.353 -0.338 1
1 508 . 14 3 2 C 13 13 LYS HA H 197 3.949 4.056 -0.107 1
1 517 . 14 3 2 C 13 13 LYS C C 197 178.419 179.164 -0.745 1
1 518 . 14 3 2 C 13 13 LYS CA C 197 60.191 59.583 0.608 1
1 519 . 14 3 2 C 13 13 LYS CB C 197 33.075 32.167 0.908 1
1 523 . 14 3 2 C 13 13 LYS N N 197 117.888 120.940 -3.052 1
1 524 . 14 3 2 C 14 14 LYS H H 198 7.506 7.750 -0.244 1
1 525 . 14 3 2 C 14 14 LYS HA H 198 4.127 4.110 0.017 1
1 534 . 14 3 2 C 14 14 LYS C C 198 178.262 178.737 -0.475 1
1 535 . 14 3 2 C 14 14 LYS CA C 198 59.161 58.361 0.800 1
1 536 . 14 3 2 C 14 14 LYS CB C 198 32.956 32.069 0.887 1
1 540 . 14 3 2 C 14 14 LYS N N 198 118.321 117.928 0.393 1
1 541 . 14 3 2 C 15 15 ILE H H 199 7.780 7.488 0.292 1
1 542 . 14 3 2 C 15 15 ILE HA H 199 3.787 3.955 -0.168 1
1 552 . 14 3 2 C 15 15 ILE C C 199 178.647 177.972 0.675 1
1 553 . 14 3 2 C 15 15 ILE CA C 199 64.912 63.538 1.374 1
1 554 . 14 3 2 C 15 15 ILE CB C 199 38.780 37.244 1.536 1
1 558 . 14 3 2 C 15 15 ILE N N 199 118.644 119.820 -1.176 1
1 559 . 14 3 2 C 16 16 TYR H H 200 7.918 8.283 -0.365 1
1 560 . 14 3 2 C 16 16 TYR HA H 200 4.252 4.089 0.163 1
1 567 . 14 3 2 C 16 16 TYR C C 200 177.806 177.425 0.381 1
1 568 . 14 3 2 C 16 16 TYR CA C 200 61.171 61.598 -0.427 1
1 569 . 14 3 2 C 16 16 TYR CB C 200 39.245 38.933 0.312 1
1 573 . 14 3 2 C 16 16 TYR N N 200 118.683 122.801 -4.118 1
1 574 . 14 3 2 C 17 17 GLU H H 201 8.089 8.633 -0.544 1
1 575 . 14 3 2 C 17 17 GLU HA H 201 4.124 4.177 -0.053 1
1 580 . 14 3 2 C 17 17 GLU C C 201 177.414 176.673 0.741 1
1 581 . 14 3 2 C 17 17 GLU CA C 201 58.784 58.060 0.724 1
1 582 . 14 3 2 C 17 17 GLU CB C 201 30.747 29.231 1.516 1
1 584 . 14 3 2 C 17 17 GLU N N 201 119.409 118.558 0.851 1
1 585 . 14 3 2 C 18 18 ASP H H 202 8.023 8.063 -0.040 1
1 586 . 14 3 2 C 18 18 ASP HA H 202 4.657 4.755 -0.098 1
1 589 . 14 3 2 C 18 18 ASP C C 202 177.346 176.371 0.975 1
1 590 . 14 3 2 C 18 18 ASP CA C 202 55.496 53.579 1.917 1
1 591 . 14 3 2 C 18 18 ASP CB C 202 42.023 41.110 0.913 1
1 592 . 14 3 2 C 18 18 ASP N N 202 119.459 119.331 0.128 1
1 593 . 14 3 2 C 19 19 GLY H H 203 7.933 7.792 0.141 1
1 594 . 14 3 2 C 19 19 GLY HA2 H 203 3.938 4.086 -0.148 1
1 595 . 14 3 2 C 19 19 GLY HA3 H 203 3.938 4.118 -0.180 1
1 596 . 14 3 2 C 19 19 GLY C C 203 177.240 173.010 4.230 1
1 597 . 14 3 2 C 19 19 GLY CA C 203 46.309 44.339 1.970 1
1 598 . 14 3 2 C 19 19 GLY N N 203 108.518 108.658 -0.140 1
1 599 . 14 3 2 C 20 20 ASP H H 204 8.091 8.513 -0.422 1
1 600 . 14 3 2 C 20 20 ASP HA H 204 4.616 5.363 -0.747 1
1 603 . 14 3 2 C 20 20 ASP C C 204 173.979 176.290 -2.311 1
1 604 . 14 3 2 C 20 20 ASP CA C 204 55.064 52.781 2.283 1
1 605 . 14 3 2 C 20 20 ASP CB C 204 42.203 45.036 -2.833 1
1 606 . 14 3 2 C 20 20 ASP N N 204 120.172 120.111 0.061 1
1 607 . 14 3 2 C 21 21 ASP H H 205 8.352 9.050 -0.698 1
1 608 . 14 3 2 C 21 21 ASP HA H 205 4.468 4.478 -0.010 1
1 611 . 14 3 2 C 21 21 ASP C C 205 176.432 177.616 -1.184 1
1 612 . 14 3 2 C 21 21 ASP CA C 205 56.663 55.565 1.098 1
1 613 . 14 3 2 C 21 21 ASP CB C 205 41.918 39.943 1.975 1
1 614 . 14 3 2 C 21 21 ASP N N 205 121.515 121.580 -0.065 1
1 615 . 14 3 2 C 22 22 ASP H H 206 8.239 8.134 0.105 1
1 616 . 14 3 2 C 22 22 ASP HA H 206 4.455 4.484 -0.029 1
1 619 . 14 3 2 C 22 22 ASP C C 206 177.449 178.890 -1.441 1
1 620 . 14 3 2 C 22 22 ASP CA C 206 57.165 56.811 0.354 1
1 621 . 14 3 2 C 22 22 ASP CB C 206 41.820 40.379 1.441 1
1 622 . 14 3 2 C 22 22 ASP N N 206 120.156 120.574 -0.418 1
1 623 . 14 3 2 C 23 23 MET H H 207 8.300 8.471 -0.171 1
1 624 . 14 3 2 C 23 23 MET HA H 207 4.255 4.181 0.074 1
1 632 . 14 3 2 C 23 23 MET C C 207 178.412 178.624 -0.212 1
1 633 . 14 3 2 C 23 23 MET CA C 207 58.065 58.683 -0.618 1
1 634 . 14 3 2 C 23 23 MET CB C 207 32.488 32.499 -0.011 1
1 637 . 14 3 2 C 23 23 MET N N 207 120.707 117.820 2.887 1
1 638 . 14 3 2 C 24 24 LYS H H 208 8.047 7.930 0.117 1
1 639 . 14 3 2 C 24 24 LYS HA H 208 3.946 3.993 -0.047 1
1 648 . 14 3 2 C 24 24 LYS C C 208 178.008 179.557 -1.549 1
1 649 . 14 3 2 C 24 24 LYS CA C 208 59.847 60.070 -0.223 1
1 650 . 14 3 2 C 24 24 LYS CB C 208 32.983 32.182 0.801 1
1 654 . 14 3 2 C 24 24 LYS N N 208 119.504 120.235 -0.731 1
1 655 . 14 3 2 C 25 25 ARG H H 209 7.891 7.427 0.464 1
1 656 . 14 3 2 C 25 25 ARG HA H 209 4.168 4.091 0.077 1
1 663 . 14 3 2 C 25 25 ARG C C 209 178.100 177.624 0.476 1
1 664 . 14 3 2 C 25 25 ARG CA C 209 58.810 58.636 0.174 1
1 665 . 14 3 2 C 25 25 ARG CB C 209 31.080 30.444 0.636 1
1 668 . 14 3 2 C 25 25 ARG N N 209 118.378 119.819 -1.441 1
1 669 . 14 3 2 C 26 26 THR H H 210 7.869 7.481 0.388 1
1 670 . 14 3 2 C 26 26 THR HA H 210 4.023 4.205 -0.182 1
1 675 . 14 3 2 C 26 26 THR C C 210 177.984 176.567 1.417 1
1 676 . 14 3 2 C 26 26 THR CA C 210 65.747 65.669 0.078 1
1 677 . 14 3 2 C 26 26 THR CB C 210 69.683 69.244 0.439 1
1 679 . 14 3 2 C 26 26 THR N N 210 115.443 114.120 1.323 1
1 680 . 14 3 2 C 27 27 ILE H H 211 7.901 8.282 -0.381 1
1 681 . 14 3 2 C 27 27 ILE HA H 211 4.142 3.739 0.403 1
1 691 . 14 3 2 C 27 27 ILE C C 211 175.595 178.180 -2.585 1
1 692 . 14 3 2 C 27 27 ILE CA C 211 63.528 65.678 -2.150 1
1 693 . 14 3 2 C 27 27 ILE CB C 211 38.982 37.849 1.133 1
1 697 . 14 3 2 C 27 27 ILE N N 211 121.265 121.189 0.076 1
1 698 . 14 3 2 C 28 28 ASN HA H 212 4.465 4.366 0.099 1
1 703 . 14 3 2 C 28 28 ASN CA C 212 55.182 56.636 -1.454 1
1 704 . 14 3 2 C 28 28 ASN CB C 212 39.480 39.550 -0.070 1
1 706 . 14 3 2 C 29 29 LYS H H 213 7.968 7.714 0.254 1
1 707 . 14 3 2 C 29 29 LYS HA H 213 4.072 3.973 0.099 1
1 716 . 14 3 2 C 29 29 LYS C C 213 176.218 179.601 -3.383 1
1 717 . 14 3 2 C 29 29 LYS CA C 213 58.489 59.563 -1.074 1
1 718 . 14 3 2 C 29 29 LYS CB C 213 33.165 32.267 0.898 1
1 722 . 14 3 2 C 29 29 LYS N N 213 120.820 117.633 3.187 1
1 723 . 14 3 2 C 30 30 ALA H H 214 7.865 8.154 -0.289 1
1 724 . 14 3 2 C 30 30 ALA HA H 214 4.217 4.159 0.058 1
1 728 . 14 3 2 C 30 30 ALA C C 214 177.041 179.707 -2.666 1
1 729 . 14 3 2 C 30 30 ALA CA C 214 54.104 54.925 -0.821 1
1 730 . 14 3 2 C 30 30 ALA CB C 214 19.496 18.302 1.194 1
1 731 . 14 3 2 C 30 30 ALA N N 214 121.571 121.702 -0.131 1
1 732 . 14 3 2 C 31 31 TRP H H 215 7.831 8.252 -0.421 1
1 733 . 14 3 2 C 31 31 TRP HA H 215 4.598 4.273 0.325 1
1 742 . 14 3 2 C 31 31 TRP C C 215 178.088 178.835 -0.747 1
1 743 . 14 3 2 C 31 31 TRP CA C 215 58.432 61.614 -3.182 1
1 744 . 14 3 2 C 31 31 TRP CB C 215 30.472 29.499 0.973 1
1 750 . 14 3 2 C 31 31 TRP N N 215 118.141 121.003 -2.862 1
1 752 . 14 3 2 C 32 32 VAL H H 216 7.594 8.768 -1.174 1
1 753 . 14 3 2 C 32 32 VAL HA H 216 3.978 3.770 0.208 1
1 761 . 14 3 2 C 32 32 VAL C C 216 176.574 178.354 -1.780 1
1 762 . 14 3 2 C 32 32 VAL CA C 216 63.329 66.667 -3.338 1
1 763 . 14 3 2 C 32 32 VAL CB C 216 33.373 31.393 1.980 1
1 766 . 14 3 2 C 32 32 VAL N N 216 118.287 120.088 -1.801 1
1 767 . 14 3 2 C 33 33 GLU H H 217 8.012 8.386 -0.374 1
1 768 . 14 3 2 C 33 33 GLU HA H 217 4.257 4.283 -0.026 1
1 773 . 14 3 2 C 33 33 GLU C C 217 176.164 177.940 -1.776 1
1 774 . 14 3 2 C 33 33 GLU CA C 217 57.409 58.538 -1.129 1
1 775 . 14 3 2 C 33 33 GLU CB C 217 30.978 28.955 2.023 1
1 777 . 14 3 2 C 33 33 GLU N N 217 122.535 120.137 2.398 1
1 778 . 14 3 2 C 34 34 SER H H 218 8.037 7.798 0.239 1
1 779 . 14 3 2 C 34 34 SER HA H 218 4.514 4.302 0.212 1
1 782 . 14 3 2 C 34 34 SER C C 218 176.451 176.508 -0.057 1
1 783 . 14 3 2 C 34 34 SER CA C 218 58.987 60.664 -1.677 1
1 784 . 14 3 2 C 34 34 SER CB C 218 64.569 63.184 1.385 1
1 785 . 14 3 2 C 34 34 SER N N 218 117.058 114.633 2.425 1
1 6 . 15 1 1 A 2 2 ALA H H 2 8.191 9.005 -0.814 1
1 7 . 15 1 1 A 2 2 ALA CA C 2 51.957 55.136 -3.179 1
1 8 . 15 1 1 A 2 2 ALA CB C 2 19.580 18.422 1.158 1
1 9 . 15 1 1 A 2 2 ALA N N 2 124.666 125.704 -1.038 1
1 10 . 15 1 1 A 3 3 SER H H 3 8.829 8.333 0.496 1
1 11 . 15 1 1 A 3 3 SER CA C 3 57.221 62.510 -5.289 1
1 12 . 15 1 1 A 3 3 SER N N 3 119.917 113.231 6.686 1
1 13 . 15 1 1 A 4 4 PRO CA C 4 66.688 65.615 1.073 1
1 14 . 15 1 1 A 4 4 PRO CB C 4 32.553 30.766 1.787 1
1 15 . 15 1 1 A 5 5 LEU H H 5 9.146 7.233 1.913 1
1 16 . 15 1 1 A 5 5 LEU CA C 5 59.017 57.010 2.007 1
1 17 . 15 1 1 A 5 5 LEU CB C 5 42.341 42.550 -0.209 1
1 18 . 15 1 1 A 5 5 LEU N N 5 117.902 116.518 1.384 1
1 19 . 15 1 1 A 6 6 ASP H H 6 7.572 8.462 -0.890 1
1 20 . 15 1 1 A 6 6 ASP CA C 6 57.997 58.058 -0.061 1
1 21 . 15 1 1 A 6 6 ASP CB C 6 40.910 42.178 -1.268 1
1 22 . 15 1 1 A 6 6 ASP N N 6 118.259 119.414 -1.155 1
1 23 . 15 1 1 A 7 7 GLN H H 7 8.660 8.578 0.082 1
1 24 . 15 1 1 A 7 7 GLN HA H 7 4.064 4.136 -0.072 1
1 29 . 15 1 1 A 7 7 GLN CA C 7 59.270 57.760 1.510 1
1 30 . 15 1 1 A 7 7 GLN CB C 7 28.468 27.285 1.183 1
1 31 . 15 1 1 A 7 7 GLN N N 7 119.558 116.982 2.576 1
1 32 . 15 1 1 A 8 8 ALA H H 8 8.253 7.964 0.289 1
1 33 . 15 1 1 A 8 8 ALA CA C 8 55.519 54.797 0.722 1
1 34 . 15 1 1 A 8 8 ALA CB C 8 18.113 18.699 -0.586 1
1 35 . 15 1 1 A 8 8 ALA N N 8 123.628 122.510 1.118 1
1 36 . 15 1 1 A 9 9 ILE H H 9 8.134 8.149 -0.015 1
1 37 . 15 1 1 A 9 9 ILE CA C 9 65.261 64.465 0.796 1
1 38 . 15 1 1 A 9 9 ILE CB C 9 37.023 37.241 -0.218 1
1 39 . 15 1 1 A 9 9 ILE N N 9 117.056 117.075 -0.019 1
1 40 . 15 1 1 A 10 10 GLY H H 10 8.515 8.548 -0.033 1
1 41 . 15 1 1 A 10 10 GLY HA3 H 10 3.773 3.780 -0.007 1
1 42 . 15 1 1 A 10 10 GLY CA C 10 47.637 46.877 0.760 1
1 43 . 15 1 1 A 10 10 GLY N N 10 106.202 110.716 -4.514 1
1 44 . 15 1 1 A 11 11 LEU H H 11 8.212 7.950 0.262 1
1 45 . 15 1 1 A 11 11 LEU CA C 11 58.354 57.635 0.719 1
1 46 . 15 1 1 A 11 11 LEU CB C 11 41.683 42.000 -0.317 1
1 47 . 15 1 1 A 11 11 LEU N N 11 124.624 123.320 1.304 1
1 48 . 15 1 1 A 12 12 LEU H H 12 7.971 7.879 0.092 1
1 49 . 15 1 1 A 12 12 LEU HA H 12 4.144 4.238 -0.094 1
1 59 . 15 1 1 A 12 12 LEU CA C 12 58.691 58.437 0.254 1
1 60 . 15 1 1 A 12 12 LEU CB C 12 40.657 41.596 -0.939 1
1 61 . 15 1 1 A 12 12 LEU N N 12 118.095 118.570 -0.475 1
1 62 . 15 1 1 A 13 13 ILE H H 13 8.379 8.142 0.237 1
1 63 . 15 1 1 A 13 13 ILE CA C 13 66.405 65.416 0.989 1
1 64 . 15 1 1 A 13 13 ILE CB C 13 38.916 38.270 0.646 1
1 65 . 15 1 1 A 13 13 ILE N N 13 121.161 120.516 0.645 1
1 66 . 15 1 1 A 14 14 GLY H H 14 8.823 8.528 0.295 1
1 67 . 15 1 1 A 14 14 GLY HA2 H 14 4.147 3.810 0.337 1
1 68 . 15 1 1 A 14 14 GLY HA3 H 14 3.982 3.831 0.151 1
1 69 . 15 1 1 A 14 14 GLY CA C 14 47.750 46.900 0.850 1
1 70 . 15 1 1 A 14 14 GLY N N 14 108.982 107.316 1.666 1
1 71 . 15 1 1 A 15 15 ILE H H 15 8.681 8.102 0.579 1
1 72 . 15 1 1 A 15 15 ILE CA C 15 64.996 64.680 0.316 1
1 73 . 15 1 1 A 15 15 ILE CB C 15 37.107 37.503 -0.396 1
1 74 . 15 1 1 A 15 15 ILE N N 15 121.601 122.324 -0.723 1
1 75 . 15 1 1 A 16 16 PHE H H 16 7.103 8.452 -1.349 1
1 76 . 15 1 1 A 16 16 PHE CA C 16 62.910 61.315 1.595 1
1 77 . 15 1 1 A 16 16 PHE CB C 16 38.782 39.086 -0.304 1
1 78 . 15 1 1 A 16 16 PHE N N 16 118.660 121.178 -2.518 1
1 79 . 15 1 1 A 17 17 HIS H H 17 7.591 8.440 -0.849 1
1 80 . 15 1 1 A 17 17 HIS HA H 17 4.793 4.423 0.370 1
1 82 . 15 1 1 A 17 17 HIS CA C 17 58.125 59.634 -1.509 1
1 83 . 15 1 1 A 17 17 HIS CB C 17 29.584 29.320 0.264 1
1 84 . 15 1 1 A 17 17 HIS N N 17 114.968 116.813 -1.845 1
1 85 . 15 1 1 A 18 18 LYS H H 18 8.144 8.450 -0.306 1
1 86 . 15 1 1 A 18 18 LYS CA C 18 58.975 59.054 -0.079 1
1 87 . 15 1 1 A 18 18 LYS CB C 18 32.379 32.126 0.253 1
1 88 . 15 1 1 A 18 18 LYS N N 18 122.373 121.175 1.198 1
1 89 . 15 1 1 A 19 19 TYR H H 19 6.999 7.518 -0.519 1
1 90 . 15 1 1 A 19 19 TYR CA C 19 60.318 60.865 -0.547 1
1 91 . 15 1 1 A 19 19 TYR CB C 19 40.355 38.200 2.155 1
1 92 . 15 1 1 A 19 19 TYR N N 19 113.614 118.395 -4.781 1
1 93 . 15 1 1 A 20 20 SER H H 20 8.432 7.951 0.481 1
1 94 . 15 1 1 A 20 20 SER CA C 20 61.897 62.603 -0.706 1
1 95 . 15 1 1 A 20 20 SER CB C 20 61.354 62.209 -0.855 1
1 96 . 15 1 1 A 20 20 SER N N 20 113.201 116.547 -3.346 1
1 97 . 15 1 1 A 21 21 GLY H H 21 7.678 8.157 -0.479 1
1 98 . 15 1 1 A 21 21 GLY HA2 H 21 4.195 3.933 0.262 1
1 99 . 15 1 1 A 21 21 GLY HA3 H 21 3.900 3.955 -0.055 1
1 100 . 15 1 1 A 21 21 GLY CA C 21 45.628 46.474 -0.846 1
1 101 . 15 1 1 A 21 21 GLY N N 21 110.734 108.311 2.423 1
1 102 . 15 1 1 A 22 22 LYS H H 22 7.362 7.447 -0.085 1
1 103 . 15 1 1 A 22 22 LYS CA C 22 60.163 59.084 1.079 1
1 104 . 15 1 1 A 22 22 LYS CB C 22 32.554 32.093 0.461 1
1 105 . 15 1 1 A 22 22 LYS N N 22 122.161 120.951 1.210 1
1 106 . 15 1 1 A 23 23 GLU H H 23 9.639 8.092 1.547 1
1 107 . 15 1 1 A 23 23 GLU CA C 23 54.449 56.385 -1.936 1
1 108 . 15 1 1 A 23 23 GLU N N 23 116.288 116.204 0.084 1
1 109 . 15 1 1 A 24 24 GLY HA2 H 24 3.912 4.109 -0.197 1
1 110 . 15 1 1 A 24 24 GLY HA3 H 24 3.787 4.114 -0.327 1
1 111 . 15 1 1 A 24 24 GLY CA C 24 45.898 45.086 0.812 1
1 112 . 15 1 1 A 25 25 ASP H H 25 8.204 8.396 -0.192 1
1 113 . 15 1 1 A 25 25 ASP CA C 25 55.252 54.336 0.916 1
1 114 . 15 1 1 A 25 25 ASP N N 25 125.671 121.849 3.822 1
1 115 . 15 1 1 A 26 26 LYS CA C 26 57.851 55.182 2.669 1
1 116 . 15 1 1 A 26 26 LYS CB C 26 31.265 36.301 -5.036 1
1 117 . 15 1 1 A 27 27 HIS H H 27 9.763 8.813 0.950 1
1 118 . 15 1 1 A 27 27 HIS CA C 27 55.580 56.495 -0.915 1
1 119 . 15 1 1 A 27 27 HIS CB C 27 30.936 30.297 0.639 1
1 120 . 15 1 1 A 27 27 HIS N N 27 118.108 121.315 -3.207 1
1 121 . 15 1 1 A 28 28 THR H H 28 7.325 7.694 -0.369 1
1 126 . 15 1 1 A 28 28 THR CA C 28 60.128 60.332 -0.204 1
1 127 . 15 1 1 A 28 28 THR CB C 28 72.268 71.851 0.417 1
1 128 . 15 1 1 A 28 28 THR N N 28 106.920 114.228 -7.308 1
1 129 . 15 1 1 A 29 29 LEU H H 29 9.422 9.260 0.162 1
1 130 . 15 1 1 A 29 29 LEU HA H 29 5.368 5.117 0.251 1
1 140 . 15 1 1 A 29 29 LEU CA C 29 52.567 53.480 -0.913 1
1 141 . 15 1 1 A 29 29 LEU CB C 29 43.523 45.408 -1.885 1
1 142 . 15 1 1 A 29 29 LEU N N 29 125.021 127.398 -2.377 1
1 143 . 15 1 1 A 30 30 SER H H 30 10.485 9.040 1.445 1
1 144 . 15 1 1 A 30 30 SER CA C 30 56.653 57.885 -1.232 1
1 145 . 15 1 1 A 30 30 SER CB C 30 65.313 63.798 1.515 1
1 146 . 15 1 1 A 30 30 SER N N 30 124.758 120.302 4.456 1
1 147 . 15 1 1 A 31 31 LYS H H 31 8.728 8.738 -0.010 1
1 148 . 15 1 1 A 31 31 LYS CA C 31 59.669 59.310 0.359 1
1 149 . 15 1 1 A 31 31 LYS CB C 31 31.763 31.955 -0.192 1
1 150 . 15 1 1 A 31 31 LYS N N 31 119.459 124.068 -4.609 1
1 151 . 15 1 1 A 32 32 LYS H H 32 7.857 8.003 -0.146 1
1 152 . 15 1 1 A 32 32 LYS CA C 32 59.721 59.216 0.505 1
1 153 . 15 1 1 A 32 32 LYS CB C 32 32.901 32.302 0.599 1
1 154 . 15 1 1 A 32 32 LYS N N 32 117.933 119.076 -1.143 1
1 155 . 15 1 1 A 33 33 GLU H H 33 7.559 7.814 -0.255 1
1 156 . 15 1 1 A 33 33 GLU CA C 33 59.169 58.921 0.248 1
1 157 . 15 1 1 A 33 33 GLU CB C 33 31.014 29.477 1.537 1
1 158 . 15 1 1 A 33 33 GLU N N 33 120.407 119.687 0.720 1
1 159 . 15 1 1 A 34 34 LEU H H 34 8.833 8.517 0.316 1
1 160 . 15 1 1 A 34 34 LEU CA C 34 56.928 57.908 -0.980 1
1 161 . 15 1 1 A 34 34 LEU CB C 34 41.435 41.566 -0.131 1
1 162 . 15 1 1 A 34 34 LEU N N 34 117.677 121.028 -3.351 1
1 163 . 15 1 1 A 35 35 LYS H H 35 8.010 8.075 -0.065 1
1 164 . 15 1 1 A 35 35 LYS CA C 35 60.692 59.507 1.185 1
1 165 . 15 1 1 A 35 35 LYS CB C 35 32.223 32.075 0.148 1
1 166 . 15 1 1 A 35 35 LYS N N 35 119.829 118.750 1.079 1
1 167 . 15 1 1 A 36 36 GLU H H 36 7.169 7.774 -0.605 1
1 168 . 15 1 1 A 36 36 GLU CA C 36 59.588 58.470 1.118 1
1 169 . 15 1 1 A 36 36 GLU CB C 36 29.342 29.305 0.037 1
1 170 . 15 1 1 A 36 36 GLU N N 36 117.340 118.971 -1.631 1
1 171 . 15 1 1 A 37 37 LEU H H 37 7.478 7.722 -0.244 1
1 172 . 15 1 1 A 37 37 LEU CA C 37 59.674 57.728 1.946 1
1 173 . 15 1 1 A 37 37 LEU CB C 37 42.142 41.070 1.072 1
1 174 . 15 1 1 A 37 37 LEU N N 37 120.884 120.370 0.514 1
1 175 . 15 1 1 A 38 38 ILE H H 38 8.377 8.340 0.037 1
1 176 . 15 1 1 A 38 38 ILE CA C 38 65.651 65.296 0.355 1
1 177 . 15 1 1 A 38 38 ILE N N 38 118.450 119.866 -1.416 1
1 178 . 15 1 1 A 39 39 GLN H H 39 8.217 8.057 0.160 1
1 179 . 15 1 1 A 39 39 GLN CA C 39 59.788 58.881 0.907 1
1 180 . 15 1 1 A 39 39 GLN CB C 39 29.278 28.317 0.961 1
1 181 . 15 1 1 A 39 39 GLN N N 39 113.091 117.866 -4.775 1
1 182 . 15 1 1 A 40 40 LYS H H 40 8.426 7.566 0.860 1
1 183 . 15 1 1 A 40 40 LYS CA C 40 57.807 59.017 -1.210 1
1 184 . 15 1 1 A 40 40 LYS CB C 40 33.942 33.046 0.896 1
1 185 . 15 1 1 A 40 40 LYS N N 40 114.771 120.286 -5.515 1
1 186 . 15 1 1 A 41 41 GLU H H 41 8.496 8.267 0.229 1
1 187 . 15 1 1 A 41 41 GLU CA C 41 55.395 57.369 -1.974 1
1 188 . 15 1 1 A 41 41 GLU CB C 41 29.260 29.830 -0.570 1
1 189 . 15 1 1 A 41 41 GLU N N 41 112.546 118.197 -5.651 1
1 190 . 15 1 1 A 42 42 LEU H H 42 7.267 7.754 -0.487 1
1 191 . 15 1 1 A 42 42 LEU CA C 42 53.776 53.465 0.311 1
1 192 . 15 1 1 A 42 42 LEU N N 42 118.657 120.012 -1.355 1
1 193 . 15 1 1 A 44 44 ILE CA C 44 62.210 59.825 2.385 1
1 194 . 15 1 1 A 44 44 ILE CB C 44 38.247 39.907 -1.660 1
1 195 . 15 1 1 A 45 45 GLY H H 45 7.820 8.807 -0.987 1
1 196 . 15 1 1 A 45 45 GLY CA C 45 47.742 46.112 1.630 1
1 197 . 15 1 1 A 45 45 GLY N N 45 108.178 115.264 -7.086 1
1 198 . 15 1 1 A 46 46 SER H H 46 7.895 8.158 -0.263 1
1 199 . 15 1 1 A 46 46 SER CA C 46 59.958 59.474 0.484 1
1 200 . 15 1 1 A 46 46 SER CB C 46 63.450 61.319 2.131 1
1 201 . 15 1 1 A 46 46 SER N N 46 113.038 109.814 3.224 1
1 202 . 15 1 1 A 47 47 LYS H H 47 7.736 7.941 -0.205 1
1 203 . 15 1 1 A 47 47 LYS CA C 47 55.636 56.062 -0.426 1
1 204 . 15 1 1 A 47 47 LYS CB C 47 33.103 33.576 -0.473 1
1 205 . 15 1 1 A 47 47 LYS N N 47 119.422 120.256 -0.834 1
1 206 . 15 1 1 A 48 48 LEU H H 48 6.988 8.897 -1.909 1
1 207 . 15 1 1 A 48 48 LEU HA H 48 4.497 4.146 0.351 1
1 217 . 15 1 1 A 48 48 LEU CA C 48 54.517 55.846 -1.329 1
1 218 . 15 1 1 A 48 48 LEU CB C 48 42.987 41.321 1.666 1
1 219 . 15 1 1 A 48 48 LEU N N 48 118.908 122.995 -4.087 1
1 220 . 15 1 1 A 49 49 GLN H H 49 9.206 8.233 0.973 1
1 221 . 15 1 1 A 49 49 GLN HA H 49 4.486 4.041 0.445 1
1 223 . 15 1 1 A 49 49 GLN CA C 49 54.785 58.468 -3.683 1
1 224 . 15 1 1 A 49 49 GLN CB C 49 29.636 28.805 0.831 1
1 225 . 15 1 1 A 49 49 GLN N N 49 121.275 120.513 0.762 1
1 226 . 15 1 1 A 50 50 ASP H H 50 8.854 8.473 0.381 1
1 227 . 15 1 1 A 50 50 ASP CA C 50 59.078 57.281 1.797 1
1 228 . 15 1 1 A 50 50 ASP CB C 50 40.632 41.584 -0.952 1
1 229 . 15 1 1 A 50 50 ASP N N 50 123.430 119.097 4.333 1
1 230 . 15 1 1 A 51 51 ALA H H 51 8.720 8.003 0.717 1
1 231 . 15 1 1 A 51 51 ALA CA C 51 55.281 54.888 0.393 1
1 232 . 15 1 1 A 51 51 ALA CB C 51 18.205 18.148 0.057 1
1 233 . 15 1 1 A 51 51 ALA N N 51 117.829 121.232 -3.403 1
1 234 . 15 1 1 A 52 52 GLU H H 52 7.161 7.848 -0.687 1
1 235 . 15 1 1 A 52 52 GLU CA C 52 58.757 58.896 -0.139 1
1 236 . 15 1 1 A 52 52 GLU CB C 52 30.247 29.320 0.927 1
1 237 . 15 1 1 A 52 52 GLU N N 52 115.459 117.430 -1.971 1
1 238 . 15 1 1 A 53 53 ILE H H 53 7.962 7.926 0.036 1
1 239 . 15 1 1 A 53 53 ILE CA C 53 65.525 65.124 0.401 1
1 240 . 15 1 1 A 53 53 ILE CB C 53 37.289 37.967 -0.678 1
1 241 . 15 1 1 A 53 53 ILE N N 53 120.414 121.285 -0.871 1
1 242 . 15 1 1 A 54 54 VAL H H 54 8.132 8.110 0.022 1
1 243 . 15 1 1 A 54 54 VAL CA C 54 67.290 65.607 1.683 1
1 244 . 15 1 1 A 54 54 VAL CB C 54 31.434 31.294 0.140 1
1 245 . 15 1 1 A 54 54 VAL N N 54 119.775 116.929 2.846 1
1 246 . 15 1 1 A 55 55 LYS H H 55 7.155 8.010 -0.855 1
1 247 . 15 1 1 A 55 55 LYS CA C 55 59.131 59.054 0.077 1
1 248 . 15 1 1 A 55 55 LYS CB C 55 32.131 31.873 0.258 1
1 249 . 15 1 1 A 55 55 LYS N N 55 119.175 120.975 -1.800 1
1 250 . 15 1 1 A 56 56 LEU H H 56 7.837 8.281 -0.444 1
1 251 . 15 1 1 A 56 56 LEU CA C 56 58.052 57.847 0.205 1
1 252 . 15 1 1 A 56 56 LEU CB C 56 41.878 41.681 0.197 1
1 253 . 15 1 1 A 56 56 LEU N N 56 119.679 121.056 -1.377 1
1 254 . 15 1 1 A 57 57 MET H H 57 8.385 8.692 -0.307 1
1 255 . 15 1 1 A 57 57 MET CA C 57 60.756 58.842 1.914 1
1 256 . 15 1 1 A 57 57 MET CB C 57 33.152 31.967 1.185 1
1 257 . 15 1 1 A 57 57 MET N N 57 115.116 119.733 -4.617 1
1 258 . 15 1 1 A 58 58 ASP H H 58 7.591 8.132 -0.541 1
1 259 . 15 1 1 A 58 58 ASP CA C 58 57.365 57.556 -0.191 1
1 260 . 15 1 1 A 58 58 ASP CB C 58 40.858 41.285 -0.427 1
1 261 . 15 1 1 A 58 58 ASP N N 58 118.197 119.802 -1.605 1
1 262 . 15 1 1 A 59 59 ASP H H 59 7.725 7.972 -0.247 1
1 263 . 15 1 1 A 59 59 ASP CA C 59 56.830 56.525 0.305 1
1 264 . 15 1 1 A 59 59 ASP CB C 59 40.567 40.751 -0.184 1
1 265 . 15 1 1 A 59 59 ASP N N 59 118.481 117.602 0.879 1
1 266 . 15 1 1 A 60 60 LEU H H 60 7.703 7.567 0.136 1
1 267 . 15 1 1 A 60 60 LEU CA C 60 56.564 57.236 -0.672 1
1 268 . 15 1 1 A 60 60 LEU CB C 60 42.714 41.406 1.308 1
1 269 . 15 1 1 A 60 60 LEU N N 60 116.935 118.750 -1.815 1
1 270 . 15 1 1 A 61 61 ASP H H 61 7.143 8.344 -1.201 1
1 271 . 15 1 1 A 61 61 ASP HA H 61 4.690 4.428 0.262 1
1 274 . 15 1 1 A 61 61 ASP CA C 61 52.286 56.628 -4.342 1
1 275 . 15 1 1 A 61 61 ASP CB C 61 39.245 41.380 -2.135 1
1 276 . 15 1 1 A 61 61 ASP N N 61 116.605 119.237 -2.632 1
1 277 . 15 1 1 A 62 62 ARG H H 62 7.786 7.856 -0.070 1
1 278 . 15 1 1 A 62 62 ARG CA C 62 58.328 58.781 -0.453 1
1 279 . 15 1 1 A 62 62 ARG CB C 62 30.106 29.973 0.133 1
1 280 . 15 1 1 A 62 62 ARG N N 62 125.967 118.918 7.049 1
1 281 . 15 1 1 A 63 63 ASN H H 63 7.945 7.748 0.197 1
1 282 . 15 1 1 A 63 63 ASN CA C 63 51.863 55.341 -3.478 1
1 283 . 15 1 1 A 63 63 ASN CB C 63 36.809 39.341 -2.532 1
1 284 . 15 1 1 A 63 63 ASN N N 63 112.434 115.821 -3.387 1
1 285 . 15 1 1 A 64 64 LYS H H 64 7.477 7.590 -0.113 1
1 286 . 15 1 1 A 64 64 LYS CA C 64 56.524 55.996 0.528 1
1 287 . 15 1 1 A 64 64 LYS N N 64 114.197 117.499 -3.302 1
1 288 . 15 1 1 A 65 65 ASP H H 65 8.345 8.644 -0.299 1
1 289 . 15 1 1 A 65 65 ASP CA C 65 52.969 55.462 -2.493 1
1 290 . 15 1 1 A 65 65 ASP CB C 65 40.329 40.467 -0.138 1
1 291 . 15 1 1 A 65 65 ASP N N 65 118.581 125.657 -7.076 1
1 292 . 15 1 1 A 66 66 GLN H H 66 9.945 9.102 0.843 1
1 293 . 15 1 1 A 66 66 GLN CA C 66 58.132 58.525 -0.393 1
1 294 . 15 1 1 A 66 66 GLN CB C 66 26.035 26.517 -0.482 1
1 295 . 15 1 1 A 66 66 GLN N N 66 113.203 119.378 -6.175 1
1 296 . 15 1 1 A 67 67 GLU H H 67 7.880 8.131 -0.251 1
1 297 . 15 1 1 A 67 67 GLU HA H 67 4.910 5.044 -0.134 1
1 302 . 15 1 1 A 67 67 GLU CA C 67 54.082 55.045 -0.963 1
1 303 . 15 1 1 A 67 67 GLU CB C 67 33.174 32.536 0.638 1
1 304 . 15 1 1 A 67 67 GLU N N 67 118.554 118.306 0.248 1
1 305 . 15 1 1 A 68 68 VAL H H 68 9.669 9.493 0.176 1
1 306 . 15 1 1 A 68 68 VAL HA H 68 5.465 4.657 0.808 1
1 314 . 15 1 1 A 68 68 VAL CA C 68 61.079 61.337 -0.258 1
1 315 . 15 1 1 A 68 68 VAL CB C 68 33.280 33.830 -0.550 1
1 316 . 15 1 1 A 68 68 VAL N N 68 126.572 124.082 2.490 1
1 317 . 15 1 1 A 69 69 ASN H H 69 8.985 8.874 0.111 1
1 318 . 15 1 1 A 69 69 ASN CA C 69 50.812 53.310 -2.498 1
1 319 . 15 1 1 A 69 69 ASN CB C 69 38.609 40.623 -2.014 1
1 320 . 15 1 1 A 69 69 ASN N N 69 127.472 125.733 1.739 1
1 321 . 15 1 1 A 70 70 PHE H H 70 9.100 8.905 0.195 1
1 322 . 15 1 1 A 70 70 PHE CA C 70 63.279 61.731 1.548 1
1 323 . 15 1 1 A 70 70 PHE CB C 70 38.741 39.122 -0.381 1
1 324 . 15 1 1 A 70 70 PHE N N 70 119.972 127.084 -7.112 1
1 325 . 15 1 1 A 71 71 GLN H H 71 8.342 8.224 0.118 1
1 326 . 15 1 1 A 71 71 GLN HA H 71 3.923 3.644 0.279 1
1 329 . 15 1 1 A 71 71 GLN CA C 71 59.866 58.553 1.313 1
1 330 . 15 1 1 A 71 71 GLN CB C 71 27.878 28.473 -0.595 1
1 331 . 15 1 1 A 71 71 GLN N N 71 118.216 117.654 0.562 1
1 332 . 15 1 1 A 72 72 GLU H H 72 8.721 7.693 1.028 1
1 333 . 15 1 1 A 72 72 GLU HA H 72 4.147 4.043 0.104 1
1 338 . 15 1 1 A 72 72 GLU CA C 72 59.313 58.686 0.627 1
1 339 . 15 1 1 A 72 72 GLU CB C 72 30.233 29.686 0.547 1
1 340 . 15 1 1 A 72 72 GLU N N 72 121.455 119.667 1.788 1
1 341 . 15 1 1 A 73 73 TYR H H 73 8.536 8.296 0.240 1
1 342 . 15 1 1 A 73 73 TYR CA C 73 60.961 61.342 -0.381 1
1 343 . 15 1 1 A 73 73 TYR CB C 73 38.724 38.791 -0.067 1
1 344 . 15 1 1 A 73 73 TYR N N 73 123.356 122.228 1.128 1
1 345 . 15 1 1 A 74 74 ILE H H 74 8.642 8.203 0.439 1
1 346 . 15 1 1 A 74 74 ILE CA C 74 61.880 64.419 -2.539 1
1 347 . 15 1 1 A 74 74 ILE CB C 74 36.077 37.435 -1.358 1
1 348 . 15 1 1 A 74 74 ILE N N 74 119.799 120.736 -0.937 1
1 349 . 15 1 1 A 75 75 THR H H 75 7.959 8.095 -0.136 1
1 354 . 15 1 1 A 75 75 THR CA C 75 67.056 66.722 0.334 1
1 355 . 15 1 1 A 75 75 THR CB C 75 68.386 68.519 -0.133 1
1 356 . 15 1 1 A 75 75 THR N N 75 119.486 117.677 1.809 1
1 357 . 15 1 1 A 76 76 PHE H H 76 7.450 8.362 -0.912 1
1 358 . 15 1 1 A 76 76 PHE CA C 76 59.010 61.659 -2.649 1
1 359 . 15 1 1 A 76 76 PHE CB C 76 38.139 39.222 -1.083 1
1 360 . 15 1 1 A 76 76 PHE N N 76 122.873 121.347 1.526 1
1 361 . 15 1 1 A 77 77 LEU H H 77 7.829 8.253 -0.424 1
1 362 . 15 1 1 A 77 77 LEU CA C 77 57.450 57.647 -0.197 1
1 363 . 15 1 1 A 77 77 LEU CB C 77 40.560 41.322 -0.762 1
1 364 . 15 1 1 A 77 77 LEU N N 77 117.405 118.566 -1.161 1
1 365 . 15 1 1 A 78 78 GLY H H 78 8.093 8.227 -0.134 1
1 366 . 15 1 1 A 78 78 GLY HA2 H 78 3.661 3.695 -0.034 1
1 367 . 15 1 1 A 78 78 GLY HA3 H 78 3.594 3.698 -0.104 1
1 368 . 15 1 1 A 78 78 GLY CA C 78 47.442 47.174 0.268 1
1 369 . 15 1 1 A 78 78 GLY N N 78 105.528 106.322 -0.794 1
1 370 . 15 1 1 A 79 79 ALA H H 79 7.759 7.872 -0.113 1
1 371 . 15 1 1 A 79 79 ALA CA C 79 55.153 54.759 0.394 1
1 372 . 15 1 1 A 79 79 ALA CB C 79 17.768 19.015 -1.247 1
1 373 . 15 1 1 A 79 79 ALA N N 79 124.488 125.080 -0.592 1
1 374 . 15 1 1 A 80 80 LEU H H 80 7.963 8.032 -0.069 1
1 375 . 15 1 1 A 80 80 LEU CA C 80 57.464 57.379 0.085 1
1 376 . 15 1 1 A 80 80 LEU CB C 80 41.496 41.003 0.493 1
1 377 . 15 1 1 A 80 80 LEU N N 80 117.869 119.725 -1.856 1
1 378 . 15 1 1 A 81 81 ALA H H 81 8.365 8.074 0.291 1
1 379 . 15 1 1 A 81 81 ALA CA C 81 55.475 54.768 0.707 1
1 380 . 15 1 1 A 81 81 ALA CB C 81 17.483 18.083 -0.600 1
1 381 . 15 1 1 A 81 81 ALA N N 81 119.054 120.025 -0.971 1
1 382 . 15 1 1 A 82 82 MET H H 82 8.112 7.431 0.681 1
1 383 . 15 1 1 A 82 82 MET CA C 82 59.516 57.973 1.543 1
1 384 . 15 1 1 A 82 82 MET CB C 82 32.550 32.218 0.332 1
1 385 . 15 1 1 A 82 82 MET N N 82 115.364 117.457 -2.093 1
1 386 . 15 1 1 A 83 83 ILE H H 83 7.981 7.337 0.644 1
1 387 . 15 1 1 A 83 83 ILE HA H 83 3.839 3.581 0.258 1
1 391 . 15 1 1 A 83 83 ILE CA C 83 64.467 65.322 -0.855 1
1 392 . 15 1 1 A 83 83 ILE CB C 83 37.312 37.639 -0.327 1
1 393 . 15 1 1 A 83 83 ILE N N 83 120.887 119.016 1.871 1
1 394 . 15 1 1 A 84 84 TYR H H 84 8.731 7.575 1.156 1
1 395 . 15 1 1 A 84 84 TYR N N 84 120.933 118.604 2.329 1
1 396 . 15 1 1 A 87 87 ALA H H 87 7.829 8.011 -0.182 1
1 397 . 15 1 1 A 87 87 ALA CA C 87 53.768 54.178 -0.410 1
1 398 . 15 1 1 A 87 87 ALA CB C 87 18.504 18.373 0.131 1
1 399 . 15 1 1 A 87 87 ALA N N 87 120.274 121.498 -1.224 1
1 400 . 15 1 1 A 88 88 LEU H H 88 7.499 7.385 0.114 1
1 401 . 15 1 1 A 88 88 LEU CA C 88 55.605 54.806 0.799 1
1 402 . 15 1 1 A 88 88 LEU CB C 88 42.047 41.710 0.337 1
1 403 . 15 1 1 A 88 88 LEU N N 88 117.356 116.560 0.796 1
1 404 . 15 1 1 A 89 89 LYS H H 89 7.561 7.839 -0.278 1
1 405 . 15 1 1 A 89 89 LYS CA C 89 56.865 55.782 1.083 1
1 406 . 15 1 1 A 89 89 LYS CB C 89 32.592 34.381 -1.789 1
1 407 . 15 1 1 A 89 89 LYS N N 89 119.289 114.793 4.496 1
1 416 . 15 3 2 C 6 6 GLU H H 190 8.385 8.520 -0.135 1
1 417 . 15 3 2 C 6 6 GLU HA H 190 4.153 4.847 -0.694 1
1 422 . 15 3 2 C 6 6 GLU C C 190 175.031 176.046 -1.015 1
1 423 . 15 3 2 C 6 6 GLU CA C 190 58.866 55.037 3.829 1
1 424 . 15 3 2 C 6 6 GLU CB C 190 30.751 33.308 -2.557 1
1 426 . 15 3 2 C 6 6 GLU N N 190 122.715 120.279 2.436 1
1 427 . 15 3 2 C 7 7 GLY H H 191 8.475 8.592 -0.117 1
1 428 . 15 3 2 C 7 7 GLY HA2 H 191 3.887 4.049 -0.162 1
1 429 . 15 3 2 C 7 7 GLY HA3 H 191 3.887 4.050 -0.163 1
1 430 . 15 3 2 C 7 7 GLY C C 191 177.922 174.500 3.422 1
1 431 . 15 3 2 C 7 7 GLY CA C 191 46.884 44.846 2.038 1
1 432 . 15 3 2 C 7 7 GLY N N 191 109.009 110.039 -1.030 1
1 433 . 15 3 2 C 8 8 LEU HA H 192 4.095 4.048 0.047 1
1 443 . 15 3 2 C 8 8 LEU CA C 192 58.154 58.086 0.068 1
1 444 . 15 3 2 C 8 8 LEU CB C 192 42.789 41.687 1.102 1
1 448 . 15 3 2 C 9 9 MET H H 193 8.250 8.258 -0.008 1
1 449 . 15 3 2 C 9 9 MET HA H 193 4.150 4.147 0.003 1
1 457 . 15 3 2 C 9 9 MET C C 193 178.421 178.336 0.085 1
1 458 . 15 3 2 C 9 9 MET CA C 193 58.818 58.117 0.701 1
1 459 . 15 3 2 C 9 9 MET CB C 193 32.360 31.460 0.900 1
1 462 . 15 3 2 C 9 9 MET N N 193 117.049 118.759 -1.710 1
1 463 . 15 3 2 C 10 10 ASN H H 194 7.892 8.107 -0.215 1
1 464 . 15 3 2 C 10 10 ASN HA H 194 4.468 4.490 -0.022 1
1 469 . 15 3 2 C 10 10 ASN C C 194 178.099 176.432 1.667 1
1 470 . 15 3 2 C 10 10 ASN CA C 194 56.644 55.668 0.976 1
1 471 . 15 3 2 C 10 10 ASN CB C 194 39.100 38.998 0.102 1
1 472 . 15 3 2 C 10 10 ASN N N 194 117.034 119.160 -2.126 1
1 474 . 15 3 2 C 11 11 VAL H H 195 7.651 7.810 -0.159 1
1 475 . 15 3 2 C 11 11 VAL HA H 195 3.735 3.861 -0.126 1
1 483 . 15 3 2 C 11 11 VAL C C 195 177.657 178.328 -0.671 1
1 484 . 15 3 2 C 11 11 VAL CA C 195 66.710 65.079 1.631 1
1 485 . 15 3 2 C 11 11 VAL CB C 195 32.468 32.070 0.398 1
1 488 . 15 3 2 C 11 11 VAL N N 195 119.878 117.904 1.974 1
1 489 . 15 3 2 C 12 12 LEU H H 196 8.030 8.153 -0.123 1
1 490 . 15 3 2 C 12 12 LEU HA H 196 4.013 3.993 0.020 1
1 500 . 15 3 2 C 12 12 LEU C C 196 177.540 179.351 -1.811 1
1 501 . 15 3 2 C 12 12 LEU CA C 196 58.489 57.473 1.016 1
1 502 . 15 3 2 C 12 12 LEU CB C 196 42.457 41.053 1.404 1
1 506 . 15 3 2 C 12 12 LEU N N 196 119.499 119.983 -0.484 1
1 507 . 15 3 2 C 13 13 LYS H H 197 8.015 8.216 -0.201 1
1 508 . 15 3 2 C 13 13 LYS HA H 197 3.949 3.954 -0.005 1
1 517 . 15 3 2 C 13 13 LYS C C 197 178.419 178.800 -0.381 1
1 518 . 15 3 2 C 13 13 LYS CA C 197 60.191 59.306 0.885 1
1 519 . 15 3 2 C 13 13 LYS CB C 197 33.075 32.007 1.068 1
1 523 . 15 3 2 C 13 13 LYS N N 197 117.888 121.103 -3.215 1
1 524 . 15 3 2 C 14 14 LYS H H 198 7.506 7.622 -0.116 1
1 525 . 15 3 2 C 14 14 LYS HA H 198 4.127 4.240 -0.113 1
1 534 . 15 3 2 C 14 14 LYS C C 198 178.262 177.178 1.084 1
1 535 . 15 3 2 C 14 14 LYS CA C 198 59.161 57.901 1.260 1
1 536 . 15 3 2 C 14 14 LYS CB C 198 32.956 32.227 0.729 1
1 540 . 15 3 2 C 14 14 LYS N N 198 118.321 117.495 0.826 1
1 541 . 15 3 2 C 15 15 ILE H H 199 7.780 7.889 -0.109 1
1 542 . 15 3 2 C 15 15 ILE HA H 199 3.787 4.096 -0.309 1
1 552 . 15 3 2 C 15 15 ILE C C 199 178.647 177.390 1.257 1
1 553 . 15 3 2 C 15 15 ILE CA C 199 64.912 62.444 2.468 1
1 554 . 15 3 2 C 15 15 ILE CB C 199 38.780 38.344 0.436 1
1 558 . 15 3 2 C 15 15 ILE N N 199 118.644 117.456 1.188 1
1 559 . 15 3 2 C 16 16 TYR H H 200 7.918 7.865 0.053 1
1 560 . 15 3 2 C 16 16 TYR HA H 200 4.252 4.035 0.217 1
1 567 . 15 3 2 C 16 16 TYR C C 200 177.806 177.275 0.531 1
1 568 . 15 3 2 C 16 16 TYR CA C 200 61.171 62.085 -0.914 1
1 569 . 15 3 2 C 16 16 TYR CB C 200 39.245 38.897 0.348 1
1 573 . 15 3 2 C 16 16 TYR N N 200 118.683 123.592 -4.909 1
1 574 . 15 3 2 C 17 17 GLU H H 201 8.089 8.303 -0.214 1
1 575 . 15 3 2 C 17 17 GLU HA H 201 4.124 4.148 -0.024 1
1 580 . 15 3 2 C 17 17 GLU C C 201 177.414 177.108 0.306 1
1 581 . 15 3 2 C 17 17 GLU CA C 201 58.784 57.877 0.907 1
1 582 . 15 3 2 C 17 17 GLU CB C 201 30.747 29.270 1.477 1
1 584 . 15 3 2 C 17 17 GLU N N 201 119.409 118.850 0.559 1
1 585 . 15 3 2 C 18 18 ASP H H 202 8.023 8.239 -0.216 1
1 586 . 15 3 2 C 18 18 ASP HA H 202 4.657 4.729 -0.072 1
1 589 . 15 3 2 C 18 18 ASP C C 202 177.346 178.038 -0.692 1
1 590 . 15 3 2 C 18 18 ASP CA C 202 55.496 55.748 -0.252 1
1 591 . 15 3 2 C 18 18 ASP CB C 202 42.023 41.580 0.443 1
1 592 . 15 3 2 C 18 18 ASP N N 202 119.459 120.065 -0.606 1
1 593 . 15 3 2 C 19 19 GLY H H 203 7.933 7.937 -0.004 1
1 594 . 15 3 2 C 19 19 GLY HA2 H 203 3.938 3.897 0.041 1
1 595 . 15 3 2 C 19 19 GLY HA3 H 203 3.938 3.904 0.034 1
1 596 . 15 3 2 C 19 19 GLY C C 203 177.240 173.453 3.787 1
1 597 . 15 3 2 C 19 19 GLY CA C 203 46.309 45.251 1.058 1
1 598 . 15 3 2 C 19 19 GLY N N 203 108.518 106.121 2.397 1
1 599 . 15 3 2 C 20 20 ASP H H 204 8.091 7.620 0.471 1
1 600 . 15 3 2 C 20 20 ASP HA H 204 4.616 4.069 0.547 1
1 603 . 15 3 2 C 20 20 ASP C C 204 173.979 176.506 -2.527 1
1 604 . 15 3 2 C 20 20 ASP CA C 204 55.064 54.820 0.244 1
1 605 . 15 3 2 C 20 20 ASP CB C 204 42.203 41.125 1.078 1
1 606 . 15 3 2 C 20 20 ASP N N 204 120.172 121.901 -1.729 1
1 607 . 15 3 2 C 21 21 ASP H H 205 8.352 8.931 -0.579 1
1 608 . 15 3 2 C 21 21 ASP HA H 205 4.468 4.520 -0.052 1
1 611 . 15 3 2 C 21 21 ASP C C 205 176.432 176.771 -0.339 1
1 612 . 15 3 2 C 21 21 ASP CA C 205 56.663 55.690 0.973 1
1 613 . 15 3 2 C 21 21 ASP CB C 205 41.918 40.596 1.322 1
1 614 . 15 3 2 C 21 21 ASP N N 205 121.515 125.606 -4.091 1
1 615 . 15 3 2 C 22 22 ASP H H 206 8.239 8.235 0.004 1
1 616 . 15 3 2 C 22 22 ASP HA H 206 4.455 4.491 -0.036 1
1 619 . 15 3 2 C 22 22 ASP C C 206 177.449 178.416 -0.967 1
1 620 . 15 3 2 C 22 22 ASP CA C 206 57.165 56.379 0.786 1
1 621 . 15 3 2 C 22 22 ASP CB C 206 41.820 40.487 1.333 1
1 622 . 15 3 2 C 22 22 ASP N N 206 120.156 118.341 1.815 1
1 623 . 15 3 2 C 23 23 MET H H 207 8.300 7.844 0.456 1
1 624 . 15 3 2 C 23 23 MET HA H 207 4.255 4.090 0.165 1
1 632 . 15 3 2 C 23 23 MET C C 207 178.412 177.950 0.462 1
1 633 . 15 3 2 C 23 23 MET CA C 207 58.065 58.484 -0.419 1
1 634 . 15 3 2 C 23 23 MET CB C 207 32.488 32.018 0.470 1
1 637 . 15 3 2 C 23 23 MET N N 207 120.707 119.636 1.071 1
1 638 . 15 3 2 C 24 24 LYS H H 208 8.047 8.257 -0.210 1
1 639 . 15 3 2 C 24 24 LYS HA H 208 3.946 4.042 -0.096 1
1 648 . 15 3 2 C 24 24 LYS C C 208 178.008 178.217 -0.209 1
1 649 . 15 3 2 C 24 24 LYS CA C 208 59.847 59.185 0.662 1
1 650 . 15 3 2 C 24 24 LYS CB C 208 32.983 31.965 1.018 1
1 654 . 15 3 2 C 24 24 LYS N N 208 119.504 117.917 1.587 1
1 655 . 15 3 2 C 25 25 ARG H H 209 7.891 7.893 -0.002 1
1 656 . 15 3 2 C 25 25 ARG HA H 209 4.168 4.160 0.008 1
1 663 . 15 3 2 C 25 25 ARG C C 209 178.100 178.947 -0.847 1
1 664 . 15 3 2 C 25 25 ARG CA C 209 58.810 58.547 0.263 1
1 665 . 15 3 2 C 25 25 ARG CB C 209 31.080 29.785 1.295 1
1 668 . 15 3 2 C 25 25 ARG N N 209 118.378 118.690 -0.312 1
1 669 . 15 3 2 C 26 26 THR H H 210 7.869 7.866 0.003 1
1 670 . 15 3 2 C 26 26 THR HA H 210 4.023 4.001 0.022 1
1 675 . 15 3 2 C 26 26 THR C C 210 177.984 176.558 1.426 1
1 676 . 15 3 2 C 26 26 THR CA C 210 65.747 67.038 -1.291 1
1 677 . 15 3 2 C 26 26 THR CB C 210 69.683 68.859 0.824 1
1 679 . 15 3 2 C 26 26 THR N N 210 115.443 116.394 -0.951 1
1 680 . 15 3 2 C 27 27 ILE H H 211 7.901 8.263 -0.362 1
1 681 . 15 3 2 C 27 27 ILE HA H 211 4.142 3.818 0.324 1
1 691 . 15 3 2 C 27 27 ILE C C 211 175.595 177.840 -2.245 1
1 692 . 15 3 2 C 27 27 ILE CA C 211 63.528 65.085 -1.557 1
1 693 . 15 3 2 C 27 27 ILE CB C 211 38.982 37.378 1.604 1
1 697 . 15 3 2 C 27 27 ILE N N 211 121.265 120.829 0.436 1
1 698 . 15 3 2 C 28 28 ASN HA H 212 4.465 4.355 0.110 1
1 703 . 15 3 2 C 28 28 ASN CA C 212 55.182 56.450 -1.268 1
1 704 . 15 3 2 C 28 28 ASN CB C 212 39.480 39.596 -0.116 1
1 706 . 15 3 2 C 29 29 LYS H H 213 7.968 8.290 -0.322 1
1 707 . 15 3 2 C 29 29 LYS HA H 213 4.072 4.054 0.018 1
1 716 . 15 3 2 C 29 29 LYS C C 213 176.218 178.902 -2.684 1
1 717 . 15 3 2 C 29 29 LYS CA C 213 58.489 59.051 -0.562 1
1 718 . 15 3 2 C 29 29 LYS CB C 213 33.165 32.111 1.054 1
1 722 . 15 3 2 C 29 29 LYS N N 213 120.820 118.169 2.651 1
1 723 . 15 3 2 C 30 30 ALA H H 214 7.865 7.987 -0.122 1
1 724 . 15 3 2 C 30 30 ALA HA H 214 4.217 4.150 0.067 1
1 728 . 15 3 2 C 30 30 ALA C C 214 177.041 179.784 -2.743 1
1 729 . 15 3 2 C 30 30 ALA CA C 214 54.104 54.922 -0.818 1
1 730 . 15 3 2 C 30 30 ALA CB C 214 19.496 18.408 1.088 1
1 731 . 15 3 2 C 30 30 ALA N N 214 121.571 121.325 0.246 1
1 732 . 15 3 2 C 31 31 TRP H H 215 7.831 8.113 -0.282 1
1 733 . 15 3 2 C 31 31 TRP HA H 215 4.598 4.326 0.272 1
1 742 . 15 3 2 C 31 31 TRP C C 215 178.088 177.894 0.194 1
1 743 . 15 3 2 C 31 31 TRP CA C 215 58.432 61.585 -3.153 1
1 744 . 15 3 2 C 31 31 TRP CB C 215 30.472 29.397 1.075 1
1 750 . 15 3 2 C 31 31 TRP N N 215 118.141 120.523 -2.382 1
1 752 . 15 3 2 C 32 32 VAL H H 216 7.594 8.449 -0.855 1
1 753 . 15 3 2 C 32 32 VAL HA H 216 3.978 3.710 0.268 1
1 761 . 15 3 2 C 32 32 VAL C C 216 176.574 178.659 -2.085 1
1 762 . 15 3 2 C 32 32 VAL CA C 216 63.329 66.339 -3.010 1
1 763 . 15 3 2 C 32 32 VAL CB C 216 33.373 31.386 1.987 1
1 766 . 15 3 2 C 32 32 VAL N N 216 118.287 119.877 -1.590 1
1 767 . 15 3 2 C 33 33 GLU H H 217 8.012 8.337 -0.325 1
1 768 . 15 3 2 C 33 33 GLU HA H 217 4.257 4.351 -0.094 1
1 773 . 15 3 2 C 33 33 GLU C C 217 176.164 178.261 -2.097 1
1 774 . 15 3 2 C 33 33 GLU CA C 217 57.409 58.353 -0.944 1
1 775 . 15 3 2 C 33 33 GLU CB C 217 30.978 29.276 1.702 1
1 777 . 15 3 2 C 33 33 GLU N N 217 122.535 121.580 0.955 1
1 778 . 15 3 2 C 34 34 SER H H 218 8.037 7.743 0.294 1
1 779 . 15 3 2 C 34 34 SER HA H 218 4.514 4.384 0.130 1
1 782 . 15 3 2 C 34 34 SER C C 218 176.451 174.955 1.496 1
1 783 . 15 3 2 C 34 34 SER CA C 218 58.987 59.611 -0.624 1
1 784 . 15 3 2 C 34 34 SER CB C 218 64.569 63.603 0.966 1
1 785 . 15 3 2 C 34 34 SER N N 218 117.058 112.629 4.429 1
1 6 . 16 1 1 A 2 2 ALA H H 2 8.191 8.828 -0.637 1
1 7 . 16 1 1 A 2 2 ALA CA C 2 51.957 55.017 -3.060 1
1 8 . 16 1 1 A 2 2 ALA CB C 2 19.580 17.014 2.566 1
1 9 . 16 1 1 A 2 2 ALA N N 2 124.666 121.669 2.997 1
1 10 . 16 1 1 A 3 3 SER H H 3 8.829 8.777 0.052 1
1 11 . 16 1 1 A 3 3 SER CA C 3 57.221 62.103 -4.882 1
1 12 . 16 1 1 A 3 3 SER N N 3 119.917 113.605 6.312 1
1 13 . 16 1 1 A 4 4 PRO CA C 4 66.688 65.603 1.085 1
1 14 . 16 1 1 A 4 4 PRO CB C 4 32.553 30.707 1.846 1
1 15 . 16 1 1 A 5 5 LEU H H 5 9.146 7.241 1.905 1
1 16 . 16 1 1 A 5 5 LEU CA C 5 59.017 57.015 2.002 1
1 17 . 16 1 1 A 5 5 LEU CB C 5 42.341 42.549 -0.208 1
1 18 . 16 1 1 A 5 5 LEU N N 5 117.902 116.687 1.215 1
1 19 . 16 1 1 A 6 6 ASP H H 6 7.572 8.363 -0.791 1
1 20 . 16 1 1 A 6 6 ASP CA C 6 57.997 57.974 0.023 1
1 21 . 16 1 1 A 6 6 ASP CB C 6 40.910 42.400 -1.490 1
1 22 . 16 1 1 A 6 6 ASP N N 6 118.259 119.335 -1.076 1
1 23 . 16 1 1 A 7 7 GLN H H 7 8.660 8.161 0.499 1
1 24 . 16 1 1 A 7 7 GLN HA H 7 4.064 4.134 -0.070 1
1 29 . 16 1 1 A 7 7 GLN CA C 7 59.270 57.986 1.284 1
1 30 . 16 1 1 A 7 7 GLN CB C 7 28.468 27.572 0.896 1
1 31 . 16 1 1 A 7 7 GLN N N 7 119.558 117.134 2.424 1
1 32 . 16 1 1 A 8 8 ALA H H 8 8.253 7.863 0.390 1
1 33 . 16 1 1 A 8 8 ALA CA C 8 55.519 54.808 0.711 1
1 34 . 16 1 1 A 8 8 ALA CB C 8 18.113 18.566 -0.453 1
1 35 . 16 1 1 A 8 8 ALA N N 8 123.628 122.536 1.092 1
1 36 . 16 1 1 A 9 9 ILE H H 9 8.134 8.269 -0.135 1
1 37 . 16 1 1 A 9 9 ILE CA C 9 65.261 64.485 0.776 1
1 38 . 16 1 1 A 9 9 ILE CB C 9 37.023 37.250 -0.227 1
1 39 . 16 1 1 A 9 9 ILE N N 9 117.056 117.047 0.009 1
1 40 . 16 1 1 A 10 10 GLY H H 10 8.515 8.605 -0.090 1
1 41 . 16 1 1 A 10 10 GLY HA3 H 10 3.773 3.784 -0.011 1
1 42 . 16 1 1 A 10 10 GLY CA C 10 47.637 46.834 0.803 1
1 43 . 16 1 1 A 10 10 GLY N N 10 106.202 110.852 -4.650 1
1 44 . 16 1 1 A 11 11 LEU H H 11 8.212 7.936 0.276 1
1 45 . 16 1 1 A 11 11 LEU CA C 11 58.354 57.573 0.781 1
1 46 . 16 1 1 A 11 11 LEU CB C 11 41.683 41.725 -0.042 1
1 47 . 16 1 1 A 11 11 LEU N N 11 124.624 123.570 1.054 1
1 48 . 16 1 1 A 12 12 LEU H H 12 7.971 7.868 0.103 1
1 49 . 16 1 1 A 12 12 LEU HA H 12 4.144 4.223 -0.079 1
1 59 . 16 1 1 A 12 12 LEU CA C 12 58.691 58.457 0.234 1
1 60 . 16 1 1 A 12 12 LEU CB C 12 40.657 41.473 -0.816 1
1 61 . 16 1 1 A 12 12 LEU N N 12 118.095 118.231 -0.136 1
1 62 . 16 1 1 A 13 13 ILE H H 13 8.379 8.321 0.058 1
1 63 . 16 1 1 A 13 13 ILE CA C 13 66.405 65.227 1.178 1
1 64 . 16 1 1 A 13 13 ILE CB C 13 38.916 37.982 0.934 1
1 65 . 16 1 1 A 13 13 ILE N N 13 121.161 120.202 0.959 1
1 66 . 16 1 1 A 14 14 GLY H H 14 8.823 8.382 0.441 1
1 67 . 16 1 1 A 14 14 GLY HA2 H 14 4.147 3.802 0.345 1
1 68 . 16 1 1 A 14 14 GLY HA3 H 14 3.982 3.809 0.173 1
1 69 . 16 1 1 A 14 14 GLY CA C 14 47.750 46.898 0.852 1
1 70 . 16 1 1 A 14 14 GLY N N 14 108.982 107.241 1.741 1
1 71 . 16 1 1 A 15 15 ILE H H 15 8.681 8.087 0.594 1
1 72 . 16 1 1 A 15 15 ILE CA C 15 64.996 64.683 0.313 1
1 73 . 16 1 1 A 15 15 ILE CB C 15 37.107 38.093 -0.986 1
1 74 . 16 1 1 A 15 15 ILE N N 15 121.601 122.318 -0.717 1
1 75 . 16 1 1 A 16 16 PHE H H 16 7.103 8.826 -1.723 1
1 76 . 16 1 1 A 16 16 PHE CA C 16 62.910 61.485 1.425 1
1 77 . 16 1 1 A 16 16 PHE CB C 16 38.782 39.476 -0.694 1
1 78 . 16 1 1 A 16 16 PHE N N 16 118.660 121.043 -2.383 1
1 79 . 16 1 1 A 17 17 HIS H H 17 7.591 8.634 -1.043 1
1 80 . 16 1 1 A 17 17 HIS HA H 17 4.793 4.154 0.639 1
1 82 . 16 1 1 A 17 17 HIS CA C 17 58.125 59.393 -1.268 1
1 83 . 16 1 1 A 17 17 HIS CB C 17 29.584 30.102 -0.518 1
1 84 . 16 1 1 A 17 17 HIS N N 17 114.968 118.705 -3.737 1
1 85 . 16 1 1 A 18 18 LYS H H 18 8.144 8.387 -0.243 1
1 86 . 16 1 1 A 18 18 LYS CA C 18 58.975 59.266 -0.291 1
1 87 . 16 1 1 A 18 18 LYS CB C 18 32.379 32.000 0.379 1
1 88 . 16 1 1 A 18 18 LYS N N 18 122.373 118.789 3.584 1
1 89 . 16 1 1 A 19 19 TYR H H 19 6.999 7.475 -0.476 1
1 90 . 16 1 1 A 19 19 TYR CA C 19 60.318 60.571 -0.253 1
1 91 . 16 1 1 A 19 19 TYR CB C 19 40.355 38.293 2.062 1
1 92 . 16 1 1 A 19 19 TYR N N 19 113.614 118.547 -4.933 1
1 93 . 16 1 1 A 20 20 SER H H 20 8.432 7.651 0.781 1
1 94 . 16 1 1 A 20 20 SER CA C 20 61.897 62.535 -0.638 1
1 95 . 16 1 1 A 20 20 SER CB C 20 61.354 62.257 -0.903 1
1 96 . 16 1 1 A 20 20 SER N N 20 113.201 116.112 -2.911 1
1 97 . 16 1 1 A 21 21 GLY H H 21 7.678 7.967 -0.289 1
1 98 . 16 1 1 A 21 21 GLY HA2 H 21 4.195 3.733 0.462 1
1 99 . 16 1 1 A 21 21 GLY HA3 H 21 3.900 3.774 0.126 1
1 100 . 16 1 1 A 21 21 GLY CA C 21 45.628 45.623 0.005 1
1 101 . 16 1 1 A 21 21 GLY N N 21 110.734 108.118 2.616 1
1 102 . 16 1 1 A 22 22 LYS H H 22 7.362 7.615 -0.253 1
1 103 . 16 1 1 A 22 22 LYS CA C 22 60.163 58.144 2.019 1
1 104 . 16 1 1 A 22 22 LYS CB C 22 32.554 33.467 -0.913 1
1 105 . 16 1 1 A 22 22 LYS N N 22 122.161 120.950 1.211 1
1 106 . 16 1 1 A 23 23 GLU H H 23 9.639 7.892 1.747 1
1 107 . 16 1 1 A 23 23 GLU CA C 23 54.449 54.735 -0.286 1
1 108 . 16 1 1 A 23 23 GLU N N 23 116.288 114.447 1.841 1
1 109 . 16 1 1 A 24 24 GLY HA2 H 24 3.912 3.997 -0.085 1
1 110 . 16 1 1 A 24 24 GLY HA3 H 24 3.787 4.002 -0.215 1
1 111 . 16 1 1 A 24 24 GLY CA C 24 45.898 44.990 0.908 1
1 112 . 16 1 1 A 25 25 ASP H H 25 8.204 8.460 -0.256 1
1 113 . 16 1 1 A 25 25 ASP CA C 25 55.252 52.787 2.465 1
1 114 . 16 1 1 A 25 25 ASP N N 25 125.671 120.146 5.525 1
1 115 . 16 1 1 A 26 26 LYS CA C 26 57.851 58.505 -0.654 1
1 116 . 16 1 1 A 26 26 LYS CB C 26 31.265 31.508 -0.243 1
1 117 . 16 1 1 A 27 27 HIS H H 27 9.763 8.978 0.785 1
1 118 . 16 1 1 A 27 27 HIS CA C 27 55.580 55.908 -0.328 1
1 119 . 16 1 1 A 27 27 HIS CB C 27 30.936 29.282 1.654 1
1 120 . 16 1 1 A 27 27 HIS N N 27 118.108 118.332 -0.224 1
1 121 . 16 1 1 A 28 28 THR H H 28 7.325 8.171 -0.846 1
1 126 . 16 1 1 A 28 28 THR CA C 28 60.128 60.095 0.033 1
1 127 . 16 1 1 A 28 28 THR CB C 28 72.268 72.305 -0.037 1
1 128 . 16 1 1 A 28 28 THR N N 28 106.920 115.574 -8.654 1
1 129 . 16 1 1 A 29 29 LEU H H 29 9.422 9.119 0.303 1
1 130 . 16 1 1 A 29 29 LEU HA H 29 5.368 4.968 0.400 1
1 140 . 16 1 1 A 29 29 LEU CA C 29 52.567 53.309 -0.742 1
1 141 . 16 1 1 A 29 29 LEU CB C 29 43.523 45.009 -1.486 1
1 142 . 16 1 1 A 29 29 LEU N N 29 125.021 125.042 -0.021 1
1 143 . 16 1 1 A 30 30 SER H H 30 10.485 8.805 1.680 1
1 144 . 16 1 1 A 30 30 SER CA C 30 56.653 57.012 -0.359 1
1 145 . 16 1 1 A 30 30 SER CB C 30 65.313 65.469 -0.156 1
1 146 . 16 1 1 A 30 30 SER N N 30 124.758 117.978 6.780 1
1 147 . 16 1 1 A 31 31 LYS H H 31 8.728 8.992 -0.264 1
1 148 . 16 1 1 A 31 31 LYS CA C 31 59.669 59.197 0.472 1
1 149 . 16 1 1 A 31 31 LYS CB C 31 31.763 32.023 -0.260 1
1 150 . 16 1 1 A 31 31 LYS N N 31 119.459 119.449 0.010 1
1 151 . 16 1 1 A 32 32 LYS H H 32 7.857 7.887 -0.030 1
1 152 . 16 1 1 A 32 32 LYS CA C 32 59.721 59.445 0.276 1
1 153 . 16 1 1 A 32 32 LYS CB C 32 32.901 32.356 0.545 1
1 154 . 16 1 1 A 32 32 LYS N N 32 117.933 119.569 -1.636 1
1 155 . 16 1 1 A 33 33 GLU H H 33 7.559 7.868 -0.309 1
1 156 . 16 1 1 A 33 33 GLU CA C 33 59.169 59.000 0.169 1
1 157 . 16 1 1 A 33 33 GLU CB C 33 31.014 29.285 1.729 1
1 158 . 16 1 1 A 33 33 GLU N N 33 120.407 119.280 1.127 1
1 159 . 16 1 1 A 34 34 LEU H H 34 8.833 8.361 0.472 1
1 160 . 16 1 1 A 34 34 LEU CA C 34 56.928 58.084 -1.156 1
1 161 . 16 1 1 A 34 34 LEU CB C 34 41.435 41.889 -0.454 1
1 162 . 16 1 1 A 34 34 LEU N N 34 117.677 121.168 -3.491 1
1 163 . 16 1 1 A 35 35 LYS H H 35 8.010 8.043 -0.033 1
1 164 . 16 1 1 A 35 35 LYS CA C 35 60.692 59.588 1.104 1
1 165 . 16 1 1 A 35 35 LYS CB C 35 32.223 31.867 0.356 1
1 166 . 16 1 1 A 35 35 LYS N N 35 119.829 118.586 1.243 1
1 167 . 16 1 1 A 36 36 GLU H H 36 7.169 8.079 -0.910 1
1 168 . 16 1 1 A 36 36 GLU CA C 36 59.588 58.986 0.602 1
1 169 . 16 1 1 A 36 36 GLU CB C 36 29.342 29.521 -0.179 1
1 170 . 16 1 1 A 36 36 GLU N N 36 117.340 119.593 -2.253 1
1 171 . 16 1 1 A 37 37 LEU H H 37 7.478 7.813 -0.335 1
1 172 . 16 1 1 A 37 37 LEU CA C 37 59.674 57.757 1.917 1
1 173 . 16 1 1 A 37 37 LEU CB C 37 42.142 40.869 1.273 1
1 174 . 16 1 1 A 37 37 LEU N N 37 120.884 120.246 0.638 1
1 175 . 16 1 1 A 38 38 ILE H H 38 8.377 8.180 0.197 1
1 176 . 16 1 1 A 38 38 ILE CA C 38 65.651 65.523 0.128 1
1 177 . 16 1 1 A 38 38 ILE N N 38 118.450 119.925 -1.475 1
1 178 . 16 1 1 A 39 39 GLN H H 39 8.217 8.273 -0.056 1
1 179 . 16 1 1 A 39 39 GLN CA C 39 59.788 58.760 1.028 1
1 180 . 16 1 1 A 39 39 GLN CB C 39 29.278 28.155 1.123 1
1 181 . 16 1 1 A 39 39 GLN N N 39 113.091 118.049 -4.958 1
1 182 . 16 1 1 A 40 40 LYS H H 40 8.426 7.699 0.727 1
1 183 . 16 1 1 A 40 40 LYS CA C 40 57.807 58.480 -0.673 1
1 184 . 16 1 1 A 40 40 LYS CB C 40 33.942 33.268 0.674 1
1 185 . 16 1 1 A 40 40 LYS N N 40 114.771 119.514 -4.743 1
1 186 . 16 1 1 A 41 41 GLU H H 41 8.496 8.413 0.083 1
1 187 . 16 1 1 A 41 41 GLU CA C 41 55.395 58.571 -3.176 1
1 188 . 16 1 1 A 41 41 GLU CB C 41 29.260 30.554 -1.294 1
1 189 . 16 1 1 A 41 41 GLU N N 41 112.546 118.305 -5.759 1
1 190 . 16 1 1 A 42 42 LEU H H 42 7.267 7.857 -0.590 1
1 191 . 16 1 1 A 42 42 LEU CA C 42 53.776 53.928 -0.152 1
1 192 . 16 1 1 A 42 42 LEU N N 42 118.657 121.678 -3.021 1
1 193 . 16 1 1 A 44 44 ILE CA C 44 62.210 61.270 0.940 1
1 194 . 16 1 1 A 44 44 ILE CB C 44 38.247 37.532 0.715 1
1 195 . 16 1 1 A 45 45 GLY H H 45 7.820 7.674 0.146 1
1 196 . 16 1 1 A 45 45 GLY CA C 45 47.742 44.219 3.523 1
1 197 . 16 1 1 A 45 45 GLY N N 45 108.178 111.885 -3.707 1
1 198 . 16 1 1 A 46 46 SER H H 46 7.895 8.430 -0.535 1
1 199 . 16 1 1 A 46 46 SER CA C 46 59.958 57.839 2.119 1
1 200 . 16 1 1 A 46 46 SER CB C 46 63.450 63.204 0.246 1
1 201 . 16 1 1 A 46 46 SER N N 46 113.038 115.455 -2.417 1
1 202 . 16 1 1 A 47 47 LYS H H 47 7.736 8.493 -0.757 1
1 203 . 16 1 1 A 47 47 LYS CA C 47 55.636 54.967 0.669 1
1 204 . 16 1 1 A 47 47 LYS CB C 47 33.103 36.277 -3.174 1
1 205 . 16 1 1 A 47 47 LYS N N 47 119.422 124.651 -5.229 1
1 206 . 16 1 1 A 48 48 LEU H H 48 6.988 8.698 -1.710 1
1 207 . 16 1 1 A 48 48 LEU HA H 48 4.497 4.598 -0.101 1
1 217 . 16 1 1 A 48 48 LEU CA C 48 54.517 54.860 -0.343 1
1 218 . 16 1 1 A 48 48 LEU CB C 48 42.987 42.449 0.538 1
1 219 . 16 1 1 A 48 48 LEU N N 48 118.908 125.521 -6.613 1
1 220 . 16 1 1 A 49 49 GLN H H 49 9.206 8.488 0.718 1
1 221 . 16 1 1 A 49 49 GLN HA H 49 4.486 4.687 -0.201 1
1 223 . 16 1 1 A 49 49 GLN CA C 49 54.785 54.949 -0.164 1
1 224 . 16 1 1 A 49 49 GLN CB C 49 29.636 29.480 0.156 1
1 225 . 16 1 1 A 49 49 GLN N N 49 121.275 122.530 -1.255 1
1 226 . 16 1 1 A 50 50 ASP H H 50 8.854 8.118 0.736 1
1 227 . 16 1 1 A 50 50 ASP CA C 50 59.078 57.001 2.077 1
1 228 . 16 1 1 A 50 50 ASP CB C 50 40.632 40.256 0.376 1
1 229 . 16 1 1 A 50 50 ASP N N 50 123.430 121.889 1.541 1
1 230 . 16 1 1 A 51 51 ALA H H 51 8.720 8.155 0.565 1
1 231 . 16 1 1 A 51 51 ALA CA C 51 55.281 54.873 0.408 1
1 232 . 16 1 1 A 51 51 ALA CB C 51 18.205 18.113 0.092 1
1 233 . 16 1 1 A 51 51 ALA N N 51 117.829 122.471 -4.642 1
1 234 . 16 1 1 A 52 52 GLU H H 52 7.161 7.790 -0.629 1
1 235 . 16 1 1 A 52 52 GLU CA C 52 58.757 59.221 -0.464 1
1 236 . 16 1 1 A 52 52 GLU CB C 52 30.247 29.992 0.255 1
1 237 . 16 1 1 A 52 52 GLU N N 52 115.459 117.668 -2.209 1
1 238 . 16 1 1 A 53 53 ILE H H 53 7.962 7.712 0.250 1
1 239 . 16 1 1 A 53 53 ILE CA C 53 65.525 64.633 0.892 1
1 240 . 16 1 1 A 53 53 ILE CB C 53 37.289 36.862 0.427 1
1 241 . 16 1 1 A 53 53 ILE N N 53 120.414 120.882 -0.468 1
1 242 . 16 1 1 A 54 54 VAL H H 54 8.132 8.286 -0.154 1
1 243 . 16 1 1 A 54 54 VAL CA C 54 67.290 65.618 1.672 1
1 244 . 16 1 1 A 54 54 VAL CB C 54 31.434 31.186 0.248 1
1 245 . 16 1 1 A 54 54 VAL N N 54 119.775 117.886 1.889 1
1 246 . 16 1 1 A 55 55 LYS H H 55 7.155 7.978 -0.823 1
1 247 . 16 1 1 A 55 55 LYS CA C 55 59.131 59.091 0.040 1
1 248 . 16 1 1 A 55 55 LYS CB C 55 32.131 31.865 0.266 1
1 249 . 16 1 1 A 55 55 LYS N N 55 119.175 120.949 -1.774 1
1 250 . 16 1 1 A 56 56 LEU H H 56 7.837 8.141 -0.304 1
1 251 . 16 1 1 A 56 56 LEU CA C 56 58.052 58.051 0.001 1
1 252 . 16 1 1 A 56 56 LEU CB C 56 41.878 41.356 0.522 1
1 253 . 16 1 1 A 56 56 LEU N N 56 119.679 121.162 -1.483 1
1 254 . 16 1 1 A 57 57 MET H H 57 8.385 8.729 -0.344 1
1 255 . 16 1 1 A 57 57 MET CA C 57 60.756 58.572 2.184 1
1 256 . 16 1 1 A 57 57 MET CB C 57 33.152 31.861 1.291 1
1 257 . 16 1 1 A 57 57 MET N N 57 115.116 119.185 -4.069 1
1 258 . 16 1 1 A 58 58 ASP H H 58 7.591 8.461 -0.870 1
1 259 . 16 1 1 A 58 58 ASP CA C 58 57.365 57.334 0.031 1
1 260 . 16 1 1 A 58 58 ASP CB C 58 40.858 41.062 -0.204 1
1 261 . 16 1 1 A 58 58 ASP N N 58 118.197 119.630 -1.433 1
1 262 . 16 1 1 A 59 59 ASP H H 59 7.725 7.858 -0.133 1
1 263 . 16 1 1 A 59 59 ASP CA C 59 56.830 56.889 -0.059 1
1 264 . 16 1 1 A 59 59 ASP CB C 59 40.567 40.765 -0.198 1
1 265 . 16 1 1 A 59 59 ASP N N 59 118.481 118.121 0.360 1
1 266 . 16 1 1 A 60 60 LEU H H 60 7.703 7.510 0.193 1
1 267 . 16 1 1 A 60 60 LEU CA C 60 56.564 57.763 -1.199 1
1 268 . 16 1 1 A 60 60 LEU CB C 60 42.714 41.181 1.533 1
1 269 . 16 1 1 A 60 60 LEU N N 60 116.935 120.775 -3.840 1
1 270 . 16 1 1 A 61 61 ASP H H 61 7.143 8.531 -1.388 1
1 271 . 16 1 1 A 61 61 ASP HA H 61 4.690 4.453 0.237 1
1 274 . 16 1 1 A 61 61 ASP CA C 61 52.286 56.479 -4.193 1
1 275 . 16 1 1 A 61 61 ASP CB C 61 39.245 41.382 -2.137 1
1 276 . 16 1 1 A 61 61 ASP N N 61 116.605 118.655 -2.050 1
1 277 . 16 1 1 A 62 62 ARG H H 62 7.786 7.814 -0.028 1
1 278 . 16 1 1 A 62 62 ARG CA C 62 58.328 58.660 -0.332 1
1 279 . 16 1 1 A 62 62 ARG CB C 62 30.106 29.882 0.224 1
1 280 . 16 1 1 A 62 62 ARG N N 62 125.967 119.050 6.917 1
1 281 . 16 1 1 A 63 63 ASN H H 63 7.945 7.838 0.107 1
1 282 . 16 1 1 A 63 63 ASN CA C 63 51.863 55.241 -3.378 1
1 283 . 16 1 1 A 63 63 ASN CB C 63 36.809 38.257 -1.448 1
1 284 . 16 1 1 A 63 63 ASN N N 63 112.434 116.669 -4.235 1
1 285 . 16 1 1 A 64 64 LYS H H 64 7.477 7.982 -0.505 1
1 286 . 16 1 1 A 64 64 LYS CA C 64 56.524 57.582 -1.058 1
1 287 . 16 1 1 A 64 64 LYS N N 64 114.197 118.941 -4.744 1
1 288 . 16 1 1 A 65 65 ASP H H 65 8.345 7.353 0.992 1
1 289 . 16 1 1 A 65 65 ASP CA C 65 52.969 55.747 -2.778 1
1 290 . 16 1 1 A 65 65 ASP CB C 65 40.329 43.183 -2.854 1
1 291 . 16 1 1 A 65 65 ASP N N 65 118.581 118.972 -0.391 1
1 292 . 16 1 1 A 66 66 GLN H H 66 9.945 8.096 1.849 1
1 293 . 16 1 1 A 66 66 GLN CA C 66 58.132 55.213 2.919 1
1 294 . 16 1 1 A 66 66 GLN CB C 66 26.035 29.420 -3.385 1
1 295 . 16 1 1 A 66 66 GLN N N 66 113.203 114.937 -1.734 1
1 296 . 16 1 1 A 67 67 GLU H H 67 7.880 7.840 0.040 1
1 297 . 16 1 1 A 67 67 GLU HA H 67 4.910 4.745 0.165 1
1 302 . 16 1 1 A 67 67 GLU CA C 67 54.082 55.349 -1.267 1
1 303 . 16 1 1 A 67 67 GLU CB C 67 33.174 32.606 0.568 1
1 304 . 16 1 1 A 67 67 GLU N N 67 118.554 117.201 1.353 1
1 305 . 16 1 1 A 68 68 VAL H H 68 9.669 9.197 0.472 1
1 306 . 16 1 1 A 68 68 VAL HA H 68 5.465 4.898 0.567 1
1 314 . 16 1 1 A 68 68 VAL CA C 68 61.079 59.872 1.207 1
1 315 . 16 1 1 A 68 68 VAL CB C 68 33.280 35.269 -1.989 1
1 316 . 16 1 1 A 68 68 VAL N N 68 126.572 115.878 10.694 1
1 317 . 16 1 1 A 69 69 ASN H H 69 8.985 8.861 0.124 1
1 318 . 16 1 1 A 69 69 ASN CA C 69 50.812 52.849 -2.037 1
1 319 . 16 1 1 A 69 69 ASN CB C 69 38.609 39.274 -0.665 1
1 320 . 16 1 1 A 69 69 ASN N N 69 127.472 123.813 3.659 1
1 321 . 16 1 1 A 70 70 PHE H H 70 9.100 8.767 0.333 1
1 322 . 16 1 1 A 70 70 PHE CA C 70 63.279 61.923 1.356 1
1 323 . 16 1 1 A 70 70 PHE CB C 70 38.741 39.376 -0.635 1
1 324 . 16 1 1 A 70 70 PHE N N 70 119.972 123.006 -3.034 1
1 325 . 16 1 1 A 71 71 GLN H H 71 8.342 8.036 0.306 1
1 326 . 16 1 1 A 71 71 GLN HA H 71 3.923 3.573 0.350 1
1 329 . 16 1 1 A 71 71 GLN CA C 71 59.866 58.346 1.520 1
1 330 . 16 1 1 A 71 71 GLN CB C 71 27.878 28.340 -0.462 1
1 331 . 16 1 1 A 71 71 GLN N N 71 118.216 117.178 1.038 1
1 332 . 16 1 1 A 72 72 GLU H H 72 8.721 8.133 0.588 1
1 333 . 16 1 1 A 72 72 GLU HA H 72 4.147 4.042 0.105 1
1 338 . 16 1 1 A 72 72 GLU CA C 72 59.313 58.852 0.461 1
1 339 . 16 1 1 A 72 72 GLU CB C 72 30.233 29.580 0.653 1
1 340 . 16 1 1 A 72 72 GLU N N 72 121.455 119.402 2.053 1
1 341 . 16 1 1 A 73 73 TYR H H 73 8.536 7.988 0.548 1
1 342 . 16 1 1 A 73 73 TYR CA C 73 60.961 61.429 -0.468 1
1 343 . 16 1 1 A 73 73 TYR CB C 73 38.724 38.738 -0.014 1
1 344 . 16 1 1 A 73 73 TYR N N 73 123.356 121.990 1.366 1
1 345 . 16 1 1 A 74 74 ILE H H 74 8.642 7.444 1.198 1
1 346 . 16 1 1 A 74 74 ILE CA C 74 61.880 63.719 -1.839 1
1 347 . 16 1 1 A 74 74 ILE CB C 74 36.077 36.307 -0.230 1
1 348 . 16 1 1 A 74 74 ILE N N 74 119.799 119.650 0.149 1
1 349 . 16 1 1 A 75 75 THR H H 75 7.959 8.031 -0.072 1
1 354 . 16 1 1 A 75 75 THR CA C 75 67.056 66.674 0.382 1
1 355 . 16 1 1 A 75 75 THR CB C 75 68.386 68.564 -0.178 1
1 356 . 16 1 1 A 75 75 THR N N 75 119.486 117.610 1.876 1
1 357 . 16 1 1 A 76 76 PHE H H 76 7.450 7.963 -0.513 1
1 358 . 16 1 1 A 76 76 PHE CA C 76 59.010 61.644 -2.634 1
1 359 . 16 1 1 A 76 76 PHE CB C 76 38.139 39.200 -1.061 1
1 360 . 16 1 1 A 76 76 PHE N N 76 122.873 122.007 0.866 1
1 361 . 16 1 1 A 77 77 LEU H H 77 7.829 8.184 -0.355 1
1 362 . 16 1 1 A 77 77 LEU CA C 77 57.450 57.599 -0.149 1
1 363 . 16 1 1 A 77 77 LEU CB C 77 40.560 40.820 -0.260 1
1 364 . 16 1 1 A 77 77 LEU N N 77 117.405 118.495 -1.090 1
1 365 . 16 1 1 A 78 78 GLY H H 78 8.093 7.948 0.145 1
1 366 . 16 1 1 A 78 78 GLY HA2 H 78 3.661 3.717 -0.056 1
1 367 . 16 1 1 A 78 78 GLY HA3 H 78 3.594 3.728 -0.134 1
1 368 . 16 1 1 A 78 78 GLY CA C 78 47.442 47.244 0.198 1
1 369 . 16 1 1 A 78 78 GLY N N 78 105.528 105.838 -0.310 1
1 370 . 16 1 1 A 79 79 ALA H H 79 7.759 7.497 0.262 1
1 371 . 16 1 1 A 79 79 ALA CA C 79 55.153 54.384 0.769 1
1 372 . 16 1 1 A 79 79 ALA CB C 79 17.768 18.294 -0.526 1
1 373 . 16 1 1 A 79 79 ALA N N 79 124.488 124.945 -0.457 1
1 374 . 16 1 1 A 80 80 LEU H H 80 7.963 7.959 0.004 1
1 375 . 16 1 1 A 80 80 LEU CA C 80 57.464 57.497 -0.033 1
1 376 . 16 1 1 A 80 80 LEU CB C 80 41.496 41.325 0.171 1
1 377 . 16 1 1 A 80 80 LEU N N 80 117.869 120.591 -2.722 1
1 378 . 16 1 1 A 81 81 ALA H H 81 8.365 8.531 -0.166 1
1 379 . 16 1 1 A 81 81 ALA CA C 81 55.475 55.386 0.089 1
1 380 . 16 1 1 A 81 81 ALA CB C 81 17.483 18.028 -0.545 1
1 381 . 16 1 1 A 81 81 ALA N N 81 119.054 121.293 -2.239 1
1 382 . 16 1 1 A 82 82 MET H H 82 8.112 7.930 0.182 1
1 383 . 16 1 1 A 82 82 MET CA C 82 59.516 58.228 1.288 1
1 384 . 16 1 1 A 82 82 MET CB C 82 32.550 32.487 0.063 1
1 385 . 16 1 1 A 82 82 MET N N 82 115.364 118.123 -2.759 1
1 386 . 16 1 1 A 83 83 ILE H H 83 7.981 8.048 -0.067 1
1 387 . 16 1 1 A 83 83 ILE HA H 83 3.839 3.732 0.107 1
1 391 . 16 1 1 A 83 83 ILE CA C 83 64.467 63.581 0.886 1
1 392 . 16 1 1 A 83 83 ILE CB C 83 37.312 37.304 0.008 1
1 393 . 16 1 1 A 83 83 ILE N N 83 120.887 120.043 0.844 1
1 394 . 16 1 1 A 84 84 TYR H H 84 8.731 7.359 1.372 1
1 395 . 16 1 1 A 84 84 TYR N N 84 120.933 121.570 -0.637 1
1 396 . 16 1 1 A 87 87 ALA H H 87 7.829 8.352 -0.523 1
1 397 . 16 1 1 A 87 87 ALA CA C 87 53.768 54.777 -1.009 1
1 398 . 16 1 1 A 87 87 ALA CB C 87 18.504 18.285 0.219 1
1 399 . 16 1 1 A 87 87 ALA N N 87 120.274 122.714 -2.440 1
1 400 . 16 1 1 A 88 88 LEU H H 88 7.499 7.823 -0.324 1
1 401 . 16 1 1 A 88 88 LEU CA C 88 55.605 57.661 -2.056 1
1 402 . 16 1 1 A 88 88 LEU CB C 88 42.047 40.938 1.109 1
1 403 . 16 1 1 A 88 88 LEU N N 88 117.356 119.005 -1.649 1
1 404 . 16 1 1 A 89 89 LYS H H 89 7.561 7.617 -0.056 1
1 405 . 16 1 1 A 89 89 LYS CA C 89 56.865 57.956 -1.091 1
1 406 . 16 1 1 A 89 89 LYS CB C 89 32.592 33.304 -0.712 1
1 407 . 16 1 1 A 89 89 LYS N N 89 119.289 119.667 -0.378 1
1 416 . 16 3 2 C 6 6 GLU H H 190 8.385 8.619 -0.234 1
1 417 . 16 3 2 C 6 6 GLU HA H 190 4.153 4.534 -0.381 1
1 422 . 16 3 2 C 6 6 GLU C C 190 175.031 177.833 -2.802 1
1 423 . 16 3 2 C 6 6 GLU CA C 190 58.866 56.691 2.175 1
1 424 . 16 3 2 C 6 6 GLU CB C 190 30.751 30.369 0.382 1
1 426 . 16 3 2 C 6 6 GLU N N 190 122.715 126.039 -3.324 1
1 427 . 16 3 2 C 7 7 GLY H H 191 8.475 8.354 0.121 1
1 428 . 16 3 2 C 7 7 GLY HA2 H 191 3.887 3.745 0.142 1
1 429 . 16 3 2 C 7 7 GLY HA3 H 191 3.887 3.747 0.140 1
1 430 . 16 3 2 C 7 7 GLY C C 191 177.922 175.695 2.227 1
1 431 . 16 3 2 C 7 7 GLY CA C 191 46.884 46.712 0.172 1
1 432 . 16 3 2 C 7 7 GLY N N 191 109.009 109.877 -0.868 1
1 433 . 16 3 2 C 8 8 LEU HA H 192 4.095 4.002 0.093 1
1 443 . 16 3 2 C 8 8 LEU CA C 192 58.154 57.982 0.172 1
1 444 . 16 3 2 C 8 8 LEU CB C 192 42.789 41.975 0.814 1
1 448 . 16 3 2 C 9 9 MET H H 193 8.250 8.424 -0.174 1
1 449 . 16 3 2 C 9 9 MET HA H 193 4.150 4.081 0.069 1
1 457 . 16 3 2 C 9 9 MET C C 193 178.421 178.439 -0.018 1
1 458 . 16 3 2 C 9 9 MET CA C 193 58.818 58.830 -0.012 1
1 459 . 16 3 2 C 9 9 MET CB C 193 32.360 32.289 0.071 1
1 462 . 16 3 2 C 9 9 MET N N 193 117.049 117.042 0.007 1
1 463 . 16 3 2 C 10 10 ASN H H 194 7.892 8.556 -0.664 1
1 464 . 16 3 2 C 10 10 ASN HA H 194 4.468 4.527 -0.059 1
1 469 . 16 3 2 C 10 10 ASN C C 194 178.099 176.419 1.680 1
1 470 . 16 3 2 C 10 10 ASN CA C 194 56.644 55.449 1.195 1
1 471 . 16 3 2 C 10 10 ASN CB C 194 39.100 38.966 0.134 1
1 472 . 16 3 2 C 10 10 ASN N N 194 117.034 118.816 -1.782 1
1 474 . 16 3 2 C 11 11 VAL H H 195 7.651 7.766 -0.115 1
1 475 . 16 3 2 C 11 11 VAL HA H 195 3.735 3.869 -0.134 1
1 483 . 16 3 2 C 11 11 VAL C C 195 177.657 178.321 -0.664 1
1 484 . 16 3 2 C 11 11 VAL CA C 195 66.710 65.169 1.541 1
1 485 . 16 3 2 C 11 11 VAL CB C 195 32.468 31.908 0.560 1
1 488 . 16 3 2 C 11 11 VAL N N 195 119.878 117.845 2.033 1
1 489 . 16 3 2 C 12 12 LEU H H 196 8.030 7.854 0.176 1
1 490 . 16 3 2 C 12 12 LEU HA H 196 4.013 4.011 0.002 1
1 500 . 16 3 2 C 12 12 LEU C C 196 177.540 179.288 -1.748 1
1 501 . 16 3 2 C 12 12 LEU CA C 196 58.489 57.585 0.904 1
1 502 . 16 3 2 C 12 12 LEU CB C 196 42.457 41.327 1.130 1
1 506 . 16 3 2 C 12 12 LEU N N 196 119.499 119.972 -0.473 1
1 507 . 16 3 2 C 13 13 LYS H H 197 8.015 8.444 -0.429 1
1 508 . 16 3 2 C 13 13 LYS HA H 197 3.949 4.070 -0.121 1
1 517 . 16 3 2 C 13 13 LYS C C 197 178.419 179.254 -0.835 1
1 518 . 16 3 2 C 13 13 LYS CA C 197 60.191 59.207 0.984 1
1 519 . 16 3 2 C 13 13 LYS CB C 197 33.075 32.057 1.018 1
1 523 . 16 3 2 C 13 13 LYS N N 197 117.888 121.123 -3.235 1
1 524 . 16 3 2 C 14 14 LYS H H 198 7.506 7.793 -0.287 1
1 525 . 16 3 2 C 14 14 LYS HA H 198 4.127 4.094 0.033 1
1 534 . 16 3 2 C 14 14 LYS C C 198 178.262 178.448 -0.186 1
1 535 . 16 3 2 C 14 14 LYS CA C 198 59.161 58.218 0.943 1
1 536 . 16 3 2 C 14 14 LYS CB C 198 32.956 32.254 0.702 1
1 540 . 16 3 2 C 14 14 LYS N N 198 118.321 118.107 0.214 1
1 541 . 16 3 2 C 15 15 ILE H H 199 7.780 7.333 0.447 1
1 542 . 16 3 2 C 15 15 ILE HA H 199 3.787 3.924 -0.137 1
1 552 . 16 3 2 C 15 15 ILE C C 199 178.647 177.857 0.790 1
1 553 . 16 3 2 C 15 15 ILE CA C 199 64.912 63.791 1.121 1
1 554 . 16 3 2 C 15 15 ILE CB C 199 38.780 38.043 0.737 1
1 558 . 16 3 2 C 15 15 ILE N N 199 118.644 118.600 0.044 1
1 559 . 16 3 2 C 16 16 TYR H H 200 7.918 8.388 -0.470 1
1 560 . 16 3 2 C 16 16 TYR HA H 200 4.252 3.954 0.298 1
1 567 . 16 3 2 C 16 16 TYR C C 200 177.806 177.187 0.619 1
1 568 . 16 3 2 C 16 16 TYR CA C 200 61.171 62.033 -0.862 1
1 569 . 16 3 2 C 16 16 TYR CB C 200 39.245 39.160 0.085 1
1 573 . 16 3 2 C 16 16 TYR N N 200 118.683 121.271 -2.588 1
1 574 . 16 3 2 C 17 17 GLU H H 201 8.089 8.563 -0.474 1
1 575 . 16 3 2 C 17 17 GLU HA H 201 4.124 4.080 0.044 1
1 580 . 16 3 2 C 17 17 GLU C C 201 177.414 176.929 0.485 1
1 581 . 16 3 2 C 17 17 GLU CA C 201 58.784 57.763 1.021 1
1 582 . 16 3 2 C 17 17 GLU CB C 201 30.747 29.264 1.483 1
1 584 . 16 3 2 C 17 17 GLU N N 201 119.409 118.750 0.659 1
1 585 . 16 3 2 C 18 18 ASP H H 202 8.023 8.112 -0.089 1
1 586 . 16 3 2 C 18 18 ASP HA H 202 4.657 4.891 -0.234 1
1 589 . 16 3 2 C 18 18 ASP C C 202 177.346 176.661 0.685 1
1 590 . 16 3 2 C 18 18 ASP CA C 202 55.496 54.836 0.660 1
1 591 . 16 3 2 C 18 18 ASP CB C 202 42.023 42.808 -0.785 1
1 592 . 16 3 2 C 18 18 ASP N N 202 119.459 119.454 0.005 1
1 593 . 16 3 2 C 19 19 GLY H H 203 7.933 7.937 -0.004 1
1 594 . 16 3 2 C 19 19 GLY HA2 H 203 3.938 4.047 -0.109 1
1 595 . 16 3 2 C 19 19 GLY HA3 H 203 3.938 4.067 -0.129 1
1 596 . 16 3 2 C 19 19 GLY C C 203 177.240 172.820 4.420 1
1 597 . 16 3 2 C 19 19 GLY CA C 203 46.309 45.242 1.067 1
1 598 . 16 3 2 C 19 19 GLY N N 203 108.518 107.834 0.684 1
1 599 . 16 3 2 C 20 20 ASP H H 204 8.091 8.531 -0.440 1
1 600 . 16 3 2 C 20 20 ASP HA H 204 4.616 4.565 0.051 1
1 603 . 16 3 2 C 20 20 ASP C C 204 173.979 177.167 -3.188 1
1 604 . 16 3 2 C 20 20 ASP CA C 204 55.064 54.615 0.449 1
1 605 . 16 3 2 C 20 20 ASP CB C 204 42.203 41.718 0.485 1
1 606 . 16 3 2 C 20 20 ASP N N 204 120.172 120.001 0.171 1
1 607 . 16 3 2 C 21 21 ASP H H 205 8.352 8.814 -0.462 1
1 608 . 16 3 2 C 21 21 ASP HA H 205 4.468 4.585 -0.117 1
1 611 . 16 3 2 C 21 21 ASP C C 205 176.432 176.027 0.405 1
1 612 . 16 3 2 C 21 21 ASP CA C 205 56.663 54.114 2.549 1
1 613 . 16 3 2 C 21 21 ASP CB C 205 41.918 40.143 1.775 1
1 614 . 16 3 2 C 21 21 ASP N N 205 121.515 121.863 -0.348 1
1 615 . 16 3 2 C 22 22 ASP H H 206 8.239 8.055 0.184 1
1 616 . 16 3 2 C 22 22 ASP HA H 206 4.455 4.414 0.041 1
1 619 . 16 3 2 C 22 22 ASP C C 206 177.449 178.556 -1.107 1
1 620 . 16 3 2 C 22 22 ASP CA C 206 57.165 57.147 0.018 1
1 621 . 16 3 2 C 22 22 ASP CB C 206 41.820 40.777 1.043 1
1 622 . 16 3 2 C 22 22 ASP N N 206 120.156 121.279 -1.123 1
1 623 . 16 3 2 C 23 23 MET H H 207 8.300 8.083 0.217 1
1 624 . 16 3 2 C 23 23 MET HA H 207 4.255 4.136 0.119 1
1 632 . 16 3 2 C 23 23 MET C C 207 178.412 178.064 0.348 1
1 633 . 16 3 2 C 23 23 MET CA C 207 58.065 58.698 -0.633 1
1 634 . 16 3 2 C 23 23 MET CB C 207 32.488 32.083 0.405 1
1 637 . 16 3 2 C 23 23 MET N N 207 120.707 119.850 0.857 1
1 638 . 16 3 2 C 24 24 LYS H H 208 8.047 8.330 -0.283 1
1 639 . 16 3 2 C 24 24 LYS HA H 208 3.946 4.132 -0.186 1
1 648 . 16 3 2 C 24 24 LYS C C 208 178.008 178.460 -0.452 1
1 649 . 16 3 2 C 24 24 LYS CA C 208 59.847 58.433 1.414 1
1 650 . 16 3 2 C 24 24 LYS CB C 208 32.983 31.300 1.683 1
1 654 . 16 3 2 C 24 24 LYS N N 208 119.504 117.741 1.763 1
1 655 . 16 3 2 C 25 25 ARG H H 209 7.891 7.886 0.005 1
1 656 . 16 3 2 C 25 25 ARG HA H 209 4.168 4.265 -0.097 1
1 663 . 16 3 2 C 25 25 ARG C C 209 178.100 178.321 -0.221 1
1 664 . 16 3 2 C 25 25 ARG CA C 209 58.810 58.394 0.416 1
1 665 . 16 3 2 C 25 25 ARG CB C 209 31.080 31.034 0.046 1
1 668 . 16 3 2 C 25 25 ARG N N 209 118.378 118.894 -0.516 1
1 669 . 16 3 2 C 26 26 THR H H 210 7.869 8.322 -0.453 1
1 670 . 16 3 2 C 26 26 THR HA H 210 4.023 4.055 -0.032 1
1 675 . 16 3 2 C 26 26 THR C C 210 177.984 176.800 1.184 1
1 676 . 16 3 2 C 26 26 THR CA C 210 65.747 66.906 -1.159 1
1 677 . 16 3 2 C 26 26 THR CB C 210 69.683 67.804 1.879 1
1 679 . 16 3 2 C 26 26 THR N N 210 115.443 118.321 -2.878 1
1 680 . 16 3 2 C 27 27 ILE H H 211 7.901 8.346 -0.445 1
1 681 . 16 3 2 C 27 27 ILE HA H 211 4.142 3.700 0.442 1
1 691 . 16 3 2 C 27 27 ILE C C 211 175.595 177.951 -2.356 1
1 692 . 16 3 2 C 27 27 ILE CA C 211 63.528 65.227 -1.699 1
1 693 . 16 3 2 C 27 27 ILE CB C 211 38.982 37.662 1.320 1
1 697 . 16 3 2 C 27 27 ILE N N 211 121.265 121.380 -0.115 1
1 698 . 16 3 2 C 28 28 ASN HA H 212 4.465 4.318 0.147 1
1 703 . 16 3 2 C 28 28 ASN CA C 212 55.182 57.310 -2.128 1
1 704 . 16 3 2 C 28 28 ASN CB C 212 39.480 39.778 -0.298 1
1 706 . 16 3 2 C 29 29 LYS H H 213 7.968 7.512 0.456 1
1 707 . 16 3 2 C 29 29 LYS HA H 213 4.072 4.012 0.060 1
1 716 . 16 3 2 C 29 29 LYS C C 213 176.218 179.973 -3.755 1
1 717 . 16 3 2 C 29 29 LYS CA C 213 58.489 59.622 -1.133 1
1 718 . 16 3 2 C 29 29 LYS CB C 213 33.165 32.304 0.861 1
1 722 . 16 3 2 C 29 29 LYS N N 213 120.820 118.085 2.735 1
1 723 . 16 3 2 C 30 30 ALA H H 214 7.865 8.151 -0.286 1
1 724 . 16 3 2 C 30 30 ALA HA H 214 4.217 4.153 0.064 1
1 728 . 16 3 2 C 30 30 ALA C C 214 177.041 179.833 -2.792 1
1 729 . 16 3 2 C 30 30 ALA CA C 214 54.104 54.857 -0.753 1
1 730 . 16 3 2 C 30 30 ALA CB C 214 19.496 17.971 1.525 1
1 731 . 16 3 2 C 30 30 ALA N N 214 121.571 121.702 -0.131 1
1 732 . 16 3 2 C 31 31 TRP H H 215 7.831 7.916 -0.085 1
1 733 . 16 3 2 C 31 31 TRP HA H 215 4.598 4.224 0.374 1
1 742 . 16 3 2 C 31 31 TRP C C 215 178.088 178.008 0.080 1
1 743 . 16 3 2 C 31 31 TRP CA C 215 58.432 61.492 -3.060 1
1 744 . 16 3 2 C 31 31 TRP CB C 215 30.472 29.267 1.205 1
1 750 . 16 3 2 C 31 31 TRP N N 215 118.141 120.698 -2.557 1
1 752 . 16 3 2 C 32 32 VAL H H 216 7.594 8.667 -1.073 1
1 753 . 16 3 2 C 32 32 VAL HA H 216 3.978 3.703 0.275 1
1 761 . 16 3 2 C 32 32 VAL C C 216 176.574 177.594 -1.020 1
1 762 . 16 3 2 C 32 32 VAL CA C 216 63.329 66.321 -2.992 1
1 763 . 16 3 2 C 32 32 VAL CB C 216 33.373 31.262 2.111 1
1 766 . 16 3 2 C 32 32 VAL N N 216 118.287 119.826 -1.539 1
1 767 . 16 3 2 C 33 33 GLU H H 217 8.012 8.932 -0.920 1
1 768 . 16 3 2 C 33 33 GLU HA H 217 4.257 4.220 0.037 1
1 773 . 16 3 2 C 33 33 GLU C C 217 176.164 177.461 -1.297 1
1 774 . 16 3 2 C 33 33 GLU CA C 217 57.409 58.166 -0.757 1
1 775 . 16 3 2 C 33 33 GLU CB C 217 30.978 28.161 2.817 1
1 777 . 16 3 2 C 33 33 GLU N N 217 122.535 119.817 2.718 1
1 778 . 16 3 2 C 34 34 SER H H 218 8.037 7.810 0.227 1
1 779 . 16 3 2 C 34 34 SER HA H 218 4.514 4.267 0.247 1
1 782 . 16 3 2 C 34 34 SER C C 218 176.451 175.998 0.453 1
1 783 . 16 3 2 C 34 34 SER CA C 218 58.987 61.003 -2.016 1
1 784 . 16 3 2 C 34 34 SER CB C 218 64.569 62.980 1.589 1
1 785 . 16 3 2 C 34 34 SER N N 218 117.058 116.627 0.431 1
1 6 . 17 1 1 A 2 2 ALA H H 2 8.191 8.586 -0.395 1
1 7 . 17 1 1 A 2 2 ALA CA C 2 51.957 51.424 0.533 1
1 8 . 17 1 1 A 2 2 ALA CB C 2 19.580 20.172 -0.592 1
1 9 . 17 1 1 A 2 2 ALA N N 2 124.666 124.775 -0.109 1
1 10 . 17 1 1 A 3 3 SER H H 3 8.829 8.145 0.684 1
1 11 . 17 1 1 A 3 3 SER CA C 3 57.221 63.019 -5.798 1
1 12 . 17 1 1 A 3 3 SER N N 3 119.917 114.484 5.433 1
1 13 . 17 1 1 A 4 4 PRO CA C 4 66.688 65.573 1.115 1
1 14 . 17 1 1 A 4 4 PRO CB C 4 32.553 30.737 1.816 1
1 15 . 17 1 1 A 5 5 LEU H H 5 9.146 7.336 1.810 1
1 16 . 17 1 1 A 5 5 LEU CA C 5 59.017 56.987 2.030 1
1 17 . 17 1 1 A 5 5 LEU CB C 5 42.341 42.590 -0.249 1
1 18 . 17 1 1 A 5 5 LEU N N 5 117.902 116.726 1.176 1
1 19 . 17 1 1 A 6 6 ASP H H 6 7.572 8.556 -0.984 1
1 20 . 17 1 1 A 6 6 ASP CA C 6 57.997 57.828 0.169 1
1 21 . 17 1 1 A 6 6 ASP CB C 6 40.910 42.016 -1.106 1
1 22 . 17 1 1 A 6 6 ASP N N 6 118.259 119.386 -1.127 1
1 23 . 17 1 1 A 7 7 GLN H H 7 8.660 8.460 0.200 1
1 24 . 17 1 1 A 7 7 GLN HA H 7 4.064 4.126 -0.062 1
1 29 . 17 1 1 A 7 7 GLN CA C 7 59.270 58.100 1.170 1
1 30 . 17 1 1 A 7 7 GLN CB C 7 28.468 27.608 0.860 1
1 31 . 17 1 1 A 7 7 GLN N N 7 119.558 116.893 2.665 1
1 32 . 17 1 1 A 8 8 ALA H H 8 8.253 7.811 0.442 1
1 33 . 17 1 1 A 8 8 ALA CA C 8 55.519 54.776 0.743 1
1 34 . 17 1 1 A 8 8 ALA CB C 8 18.113 18.654 -0.541 1
1 35 . 17 1 1 A 8 8 ALA N N 8 123.628 122.149 1.479 1
1 36 . 17 1 1 A 9 9 ILE H H 9 8.134 8.338 -0.204 1
1 37 . 17 1 1 A 9 9 ILE CA C 9 65.261 64.615 0.646 1
1 38 . 17 1 1 A 9 9 ILE CB C 9 37.023 37.266 -0.243 1
1 39 . 17 1 1 A 9 9 ILE N N 9 117.056 117.087 -0.031 1
1 40 . 17 1 1 A 10 10 GLY H H 10 8.515 8.487 0.028 1
1 41 . 17 1 1 A 10 10 GLY HA3 H 10 3.773 3.751 0.022 1
1 42 . 17 1 1 A 10 10 GLY CA C 10 47.637 46.932 0.705 1
1 43 . 17 1 1 A 10 10 GLY N N 10 106.202 110.623 -4.421 1
1 44 . 17 1 1 A 11 11 LEU H H 11 8.212 8.157 0.055 1
1 45 . 17 1 1 A 11 11 LEU CA C 11 58.354 57.582 0.772 1
1 46 . 17 1 1 A 11 11 LEU CB C 11 41.683 41.772 -0.089 1
1 47 . 17 1 1 A 11 11 LEU N N 11 124.624 123.644 0.980 1
1 48 . 17 1 1 A 12 12 LEU H H 12 7.971 8.064 -0.093 1
1 49 . 17 1 1 A 12 12 LEU HA H 12 4.144 4.274 -0.130 1
1 59 . 17 1 1 A 12 12 LEU CA C 12 58.691 58.453 0.238 1
1 60 . 17 1 1 A 12 12 LEU CB C 12 40.657 41.533 -0.876 1
1 61 . 17 1 1 A 12 12 LEU N N 12 118.095 118.493 -0.398 1
1 62 . 17 1 1 A 13 13 ILE H H 13 8.379 8.529 -0.150 1
1 63 . 17 1 1 A 13 13 ILE CA C 13 66.405 65.453 0.952 1
1 64 . 17 1 1 A 13 13 ILE CB C 13 38.916 37.861 1.055 1
1 65 . 17 1 1 A 13 13 ILE N N 13 121.161 120.033 1.128 1
1 66 . 17 1 1 A 14 14 GLY H H 14 8.823 8.584 0.239 1
1 67 . 17 1 1 A 14 14 GLY HA2 H 14 4.147 3.841 0.306 1
1 68 . 17 1 1 A 14 14 GLY HA3 H 14 3.982 3.856 0.126 1
1 69 . 17 1 1 A 14 14 GLY CA C 14 47.750 47.519 0.231 1
1 70 . 17 1 1 A 14 14 GLY N N 14 108.982 107.709 1.273 1
1 71 . 17 1 1 A 15 15 ILE H H 15 8.681 8.708 -0.027 1
1 72 . 17 1 1 A 15 15 ILE CA C 15 64.996 64.475 0.521 1
1 73 . 17 1 1 A 15 15 ILE CB C 15 37.107 37.248 -0.141 1
1 74 . 17 1 1 A 15 15 ILE N N 15 121.601 122.644 -1.043 1
1 75 . 17 1 1 A 16 16 PHE H H 16 7.103 8.416 -1.313 1
1 76 . 17 1 1 A 16 16 PHE CA C 16 62.910 61.448 1.462 1
1 77 . 17 1 1 A 16 16 PHE CB C 16 38.782 39.202 -0.420 1
1 78 . 17 1 1 A 16 16 PHE N N 16 118.660 121.847 -3.187 1
1 79 . 17 1 1 A 17 17 HIS H H 17 7.591 8.765 -1.174 1
1 80 . 17 1 1 A 17 17 HIS HA H 17 4.793 4.579 0.214 1
1 82 . 17 1 1 A 17 17 HIS CA C 17 58.125 59.178 -1.053 1
1 83 . 17 1 1 A 17 17 HIS CB C 17 29.584 29.208 0.376 1
1 84 . 17 1 1 A 17 17 HIS N N 17 114.968 117.721 -2.753 1
1 85 . 17 1 1 A 18 18 LYS H H 18 8.144 8.386 -0.242 1
1 86 . 17 1 1 A 18 18 LYS CA C 18 58.975 59.576 -0.601 1
1 87 . 17 1 1 A 18 18 LYS CB C 18 32.379 32.187 0.192 1
1 88 . 17 1 1 A 18 18 LYS N N 18 122.373 120.171 2.202 1
1 89 . 17 1 1 A 19 19 TYR H H 19 6.999 7.442 -0.443 1
1 90 . 17 1 1 A 19 19 TYR CA C 19 60.318 60.703 -0.385 1
1 91 . 17 1 1 A 19 19 TYR CB C 19 40.355 38.399 1.956 1
1 92 . 17 1 1 A 19 19 TYR N N 19 113.614 118.634 -5.020 1
1 93 . 17 1 1 A 20 20 SER H H 20 8.432 8.185 0.247 1
1 94 . 17 1 1 A 20 20 SER CA C 20 61.897 61.200 0.697 1
1 95 . 17 1 1 A 20 20 SER CB C 20 61.354 62.157 -0.803 1
1 96 . 17 1 1 A 20 20 SER N N 20 113.201 116.278 -3.077 1
1 97 . 17 1 1 A 21 21 GLY H H 21 7.678 8.288 -0.610 1
1 98 . 17 1 1 A 21 21 GLY HA2 H 21 4.195 3.968 0.227 1
1 99 . 17 1 1 A 21 21 GLY HA3 H 21 3.900 3.984 -0.084 1
1 100 . 17 1 1 A 21 21 GLY CA C 21 45.628 46.423 -0.795 1
1 101 . 17 1 1 A 21 21 GLY N N 21 110.734 109.926 0.808 1
1 102 . 17 1 1 A 22 22 LYS H H 22 7.362 7.463 -0.101 1
1 103 . 17 1 1 A 22 22 LYS CA C 22 60.163 59.556 0.607 1
1 104 . 17 1 1 A 22 22 LYS CB C 22 32.554 32.225 0.329 1
1 105 . 17 1 1 A 22 22 LYS N N 22 122.161 121.763 0.398 1
1 106 . 17 1 1 A 23 23 GLU H H 23 9.639 7.932 1.707 1
1 107 . 17 1 1 A 23 23 GLU CA C 23 54.449 56.138 -1.689 1
1 108 . 17 1 1 A 23 23 GLU N N 23 116.288 116.159 0.129 1
1 109 . 17 1 1 A 24 24 GLY HA2 H 24 3.912 3.940 -0.028 1
1 110 . 17 1 1 A 24 24 GLY HA3 H 24 3.787 3.945 -0.158 1
1 111 . 17 1 1 A 24 24 GLY CA C 24 45.898 45.549 0.349 1
1 112 . 17 1 1 A 25 25 ASP H H 25 8.204 7.849 0.355 1
1 113 . 17 1 1 A 25 25 ASP CA C 25 55.252 52.927 2.325 1
1 114 . 17 1 1 A 25 25 ASP N N 25 125.671 120.344 5.327 1
1 115 . 17 1 1 A 26 26 LYS CA C 26 57.851 56.782 1.069 1
1 116 . 17 1 1 A 26 26 LYS CB C 26 31.265 33.972 -2.707 1
1 117 . 17 1 1 A 27 27 HIS H H 27 9.763 8.493 1.270 1
1 118 . 17 1 1 A 27 27 HIS CA C 27 55.580 56.707 -1.127 1
1 119 . 17 1 1 A 27 27 HIS CB C 27 30.936 30.121 0.815 1
1 120 . 17 1 1 A 27 27 HIS N N 27 118.108 116.922 1.186 1
1 121 . 17 1 1 A 28 28 THR H H 28 7.325 7.662 -0.337 1
1 126 . 17 1 1 A 28 28 THR CA C 28 60.128 60.395 -0.267 1
1 127 . 17 1 1 A 28 28 THR CB C 28 72.268 71.099 1.169 1
1 128 . 17 1 1 A 28 28 THR N N 28 106.920 112.992 -6.072 1
1 129 . 17 1 1 A 29 29 LEU H H 29 9.422 8.900 0.522 1
1 130 . 17 1 1 A 29 29 LEU HA H 29 5.368 5.105 0.263 1
1 140 . 17 1 1 A 29 29 LEU CA C 29 52.567 53.503 -0.936 1
1 141 . 17 1 1 A 29 29 LEU CB C 29 43.523 45.116 -1.593 1
1 142 . 17 1 1 A 29 29 LEU N N 29 125.021 127.250 -2.229 1
1 143 . 17 1 1 A 30 30 SER H H 30 10.485 8.218 2.267 1
1 144 . 17 1 1 A 30 30 SER CA C 30 56.653 57.084 -0.431 1
1 145 . 17 1 1 A 30 30 SER CB C 30 65.313 65.507 -0.194 1
1 146 . 17 1 1 A 30 30 SER N N 30 124.758 116.223 8.535 1
1 147 . 17 1 1 A 31 31 LYS H H 31 8.728 8.385 0.343 1
1 148 . 17 1 1 A 31 31 LYS CA C 31 59.669 59.228 0.441 1
1 149 . 17 1 1 A 31 31 LYS CB C 31 31.763 32.001 -0.238 1
1 150 . 17 1 1 A 31 31 LYS N N 31 119.459 119.840 -0.381 1
1 151 . 17 1 1 A 32 32 LYS H H 32 7.857 8.072 -0.215 1
1 152 . 17 1 1 A 32 32 LYS CA C 32 59.721 59.126 0.595 1
1 153 . 17 1 1 A 32 32 LYS CB C 32 32.901 31.905 0.996 1
1 154 . 17 1 1 A 32 32 LYS N N 32 117.933 118.868 -0.935 1
1 155 . 17 1 1 A 33 33 GLU H H 33 7.559 7.789 -0.230 1
1 156 . 17 1 1 A 33 33 GLU CA C 33 59.169 58.855 0.314 1
1 157 . 17 1 1 A 33 33 GLU CB C 33 31.014 29.502 1.512 1
1 158 . 17 1 1 A 33 33 GLU N N 33 120.407 119.150 1.257 1
1 159 . 17 1 1 A 34 34 LEU H H 34 8.833 8.249 0.584 1
1 160 . 17 1 1 A 34 34 LEU CA C 34 56.928 57.726 -0.798 1
1 161 . 17 1 1 A 34 34 LEU CB C 34 41.435 41.374 0.061 1
1 162 . 17 1 1 A 34 34 LEU N N 34 117.677 120.892 -3.215 1
1 163 . 17 1 1 A 35 35 LYS H H 35 8.010 8.224 -0.214 1
1 164 . 17 1 1 A 35 35 LYS CA C 35 60.692 59.681 1.011 1
1 165 . 17 1 1 A 35 35 LYS CB C 35 32.223 32.160 0.063 1
1 166 . 17 1 1 A 35 35 LYS N N 35 119.829 118.831 0.998 1
1 167 . 17 1 1 A 36 36 GLU H H 36 7.169 7.882 -0.713 1
1 168 . 17 1 1 A 36 36 GLU CA C 36 59.588 58.740 0.848 1
1 169 . 17 1 1 A 36 36 GLU CB C 36 29.342 29.455 -0.113 1
1 170 . 17 1 1 A 36 36 GLU N N 36 117.340 118.997 -1.657 1
1 171 . 17 1 1 A 37 37 LEU H H 37 7.478 7.707 -0.229 1
1 172 . 17 1 1 A 37 37 LEU CA C 37 59.674 57.716 1.958 1
1 173 . 17 1 1 A 37 37 LEU CB C 37 42.142 40.918 1.224 1
1 174 . 17 1 1 A 37 37 LEU N N 37 120.884 120.462 0.422 1
1 175 . 17 1 1 A 38 38 ILE H H 38 8.377 8.095 0.282 1
1 176 . 17 1 1 A 38 38 ILE CA C 38 65.651 65.569 0.082 1
1 177 . 17 1 1 A 38 38 ILE N N 38 118.450 120.048 -1.598 1
1 178 . 17 1 1 A 39 39 GLN H H 39 8.217 8.218 -0.001 1
1 179 . 17 1 1 A 39 39 GLN CA C 39 59.788 58.866 0.922 1
1 180 . 17 1 1 A 39 39 GLN CB C 39 29.278 28.393 0.885 1
1 181 . 17 1 1 A 39 39 GLN N N 39 113.091 118.103 -5.012 1
1 182 . 17 1 1 A 40 40 LYS H H 40 8.426 7.803 0.623 1
1 183 . 17 1 1 A 40 40 LYS CA C 40 57.807 58.887 -1.080 1
1 184 . 17 1 1 A 40 40 LYS CB C 40 33.942 33.086 0.856 1
1 185 . 17 1 1 A 40 40 LYS N N 40 114.771 119.472 -4.701 1
1 186 . 17 1 1 A 41 41 GLU H H 41 8.496 8.252 0.244 1
1 187 . 17 1 1 A 41 41 GLU CA C 41 55.395 58.390 -2.995 1
1 188 . 17 1 1 A 41 41 GLU CB C 41 29.260 30.507 -1.247 1
1 189 . 17 1 1 A 41 41 GLU N N 41 112.546 117.382 -4.836 1
1 190 . 17 1 1 A 42 42 LEU H H 42 7.267 8.091 -0.824 1
1 191 . 17 1 1 A 42 42 LEU CA C 42 53.776 53.912 -0.136 1
1 192 . 17 1 1 A 42 42 LEU N N 42 118.657 119.000 -0.343 1
1 193 . 17 1 1 A 44 44 ILE CA C 44 62.210 60.532 1.678 1
1 194 . 17 1 1 A 44 44 ILE CB C 44 38.247 36.897 1.350 1
1 195 . 17 1 1 A 45 45 GLY H H 45 7.820 8.468 -0.648 1
1 196 . 17 1 1 A 45 45 GLY CA C 45 47.742 46.555 1.187 1
1 197 . 17 1 1 A 45 45 GLY N N 45 108.178 112.480 -4.302 1
1 198 . 17 1 1 A 46 46 SER H H 46 7.895 7.778 0.117 1
1 199 . 17 1 1 A 46 46 SER CA C 46 59.958 59.515 0.443 1
1 200 . 17 1 1 A 46 46 SER CB C 46 63.450 64.679 -1.229 1
1 201 . 17 1 1 A 46 46 SER N N 46 113.038 113.614 -0.576 1
1 202 . 17 1 1 A 47 47 LYS H H 47 7.736 7.982 -0.246 1
1 203 . 17 1 1 A 47 47 LYS CA C 47 55.636 58.578 -2.942 1
1 204 . 17 1 1 A 47 47 LYS CB C 47 33.103 30.285 2.818 1
1 205 . 17 1 1 A 47 47 LYS N N 47 119.422 115.413 4.009 1
1 206 . 17 1 1 A 48 48 LEU H H 48 6.988 8.370 -1.382 1
1 207 . 17 1 1 A 48 48 LEU HA H 48 4.497 3.942 0.555 1
1 217 . 17 1 1 A 48 48 LEU CA C 48 54.517 57.504 -2.987 1
1 218 . 17 1 1 A 48 48 LEU CB C 48 42.987 41.019 1.968 1
1 219 . 17 1 1 A 48 48 LEU N N 48 118.908 119.776 -0.868 1
1 220 . 17 1 1 A 49 49 GLN H H 49 9.206 8.378 0.828 1
1 221 . 17 1 1 A 49 49 GLN HA H 49 4.486 4.309 0.177 1
1 223 . 17 1 1 A 49 49 GLN CA C 49 54.785 57.880 -3.095 1
1 224 . 17 1 1 A 49 49 GLN CB C 49 29.636 28.098 1.538 1
1 225 . 17 1 1 A 49 49 GLN N N 49 121.275 118.011 3.264 1
1 226 . 17 1 1 A 50 50 ASP H H 50 8.854 8.053 0.801 1
1 227 . 17 1 1 A 50 50 ASP CA C 50 59.078 57.345 1.733 1
1 228 . 17 1 1 A 50 50 ASP CB C 50 40.632 41.705 -1.073 1
1 229 . 17 1 1 A 50 50 ASP N N 50 123.430 120.767 2.663 1
1 230 . 17 1 1 A 51 51 ALA H H 51 8.720 7.827 0.893 1
1 231 . 17 1 1 A 51 51 ALA CA C 51 55.281 54.955 0.326 1
1 232 . 17 1 1 A 51 51 ALA CB C 51 18.205 18.093 0.112 1
1 233 . 17 1 1 A 51 51 ALA N N 51 117.829 121.249 -3.420 1
1 234 . 17 1 1 A 52 52 GLU H H 52 7.161 7.729 -0.568 1
1 235 . 17 1 1 A 52 52 GLU CA C 52 58.757 58.885 -0.128 1
1 236 . 17 1 1 A 52 52 GLU CB C 52 30.247 29.357 0.890 1
1 237 . 17 1 1 A 52 52 GLU N N 52 115.459 117.592 -2.133 1
1 238 . 17 1 1 A 53 53 ILE H H 53 7.962 7.808 0.154 1
1 239 . 17 1 1 A 53 53 ILE CA C 53 65.525 65.142 0.383 1
1 240 . 17 1 1 A 53 53 ILE CB C 53 37.289 37.934 -0.645 1
1 241 . 17 1 1 A 53 53 ILE N N 53 120.414 121.409 -0.995 1
1 242 . 17 1 1 A 54 54 VAL H H 54 8.132 8.124 0.008 1
1 243 . 17 1 1 A 54 54 VAL CA C 54 67.290 65.534 1.756 1
1 244 . 17 1 1 A 54 54 VAL CB C 54 31.434 31.177 0.257 1
1 245 . 17 1 1 A 54 54 VAL N N 54 119.775 117.053 2.722 1
1 246 . 17 1 1 A 55 55 LYS H H 55 7.155 8.027 -0.872 1
1 247 . 17 1 1 A 55 55 LYS CA C 55 59.131 59.389 -0.258 1
1 248 . 17 1 1 A 55 55 LYS CB C 55 32.131 32.150 -0.019 1
1 249 . 17 1 1 A 55 55 LYS N N 55 119.175 120.739 -1.564 1
1 250 . 17 1 1 A 56 56 LEU H H 56 7.837 8.326 -0.489 1
1 251 . 17 1 1 A 56 56 LEU CA C 56 58.052 57.824 0.228 1
1 252 . 17 1 1 A 56 56 LEU CB C 56 41.878 41.660 0.218 1
1 253 . 17 1 1 A 56 56 LEU N N 56 119.679 121.045 -1.366 1
1 254 . 17 1 1 A 57 57 MET H H 57 8.385 8.731 -0.346 1
1 255 . 17 1 1 A 57 57 MET CA C 57 60.756 58.686 2.070 1
1 256 . 17 1 1 A 57 57 MET CB C 57 33.152 31.827 1.325 1
1 257 . 17 1 1 A 57 57 MET N N 57 115.116 119.661 -4.545 1
1 258 . 17 1 1 A 58 58 ASP H H 58 7.591 8.063 -0.472 1
1 259 . 17 1 1 A 58 58 ASP CA C 58 57.365 57.546 -0.181 1
1 260 . 17 1 1 A 58 58 ASP CB C 58 40.858 41.191 -0.333 1
1 261 . 17 1 1 A 58 58 ASP N N 58 118.197 119.726 -1.529 1
1 262 . 17 1 1 A 59 59 ASP H H 59 7.725 8.022 -0.297 1
1 263 . 17 1 1 A 59 59 ASP CA C 59 56.830 57.217 -0.387 1
1 264 . 17 1 1 A 59 59 ASP CB C 59 40.567 40.182 0.385 1
1 265 . 17 1 1 A 59 59 ASP N N 59 118.481 118.219 0.262 1
1 266 . 17 1 1 A 60 60 LEU H H 60 7.703 7.670 0.033 1
1 267 . 17 1 1 A 60 60 LEU CA C 60 56.564 57.261 -0.697 1
1 268 . 17 1 1 A 60 60 LEU CB C 60 42.714 41.468 1.246 1
1 269 . 17 1 1 A 60 60 LEU N N 60 116.935 120.240 -3.305 1
1 270 . 17 1 1 A 61 61 ASP H H 61 7.143 8.335 -1.192 1
1 271 . 17 1 1 A 61 61 ASP HA H 61 4.690 4.430 0.260 1
1 274 . 17 1 1 A 61 61 ASP CA C 61 52.286 56.365 -4.079 1
1 275 . 17 1 1 A 61 61 ASP CB C 61 39.245 41.259 -2.014 1
1 276 . 17 1 1 A 61 61 ASP N N 61 116.605 118.620 -2.015 1
1 277 . 17 1 1 A 62 62 ARG H H 62 7.786 7.710 0.076 1
1 278 . 17 1 1 A 62 62 ARG CA C 62 58.328 58.436 -0.108 1
1 279 . 17 1 1 A 62 62 ARG CB C 62 30.106 29.964 0.142 1
1 280 . 17 1 1 A 62 62 ARG N N 62 125.967 118.869 7.098 1
1 281 . 17 1 1 A 63 63 ASN H H 63 7.945 7.475 0.470 1
1 282 . 17 1 1 A 63 63 ASN CA C 63 51.863 55.853 -3.990 1
1 283 . 17 1 1 A 63 63 ASN CB C 63 36.809 38.594 -1.785 1
1 284 . 17 1 1 A 63 63 ASN N N 63 112.434 117.302 -4.868 1
1 285 . 17 1 1 A 64 64 LYS H H 64 7.477 7.947 -0.470 1
1 286 . 17 1 1 A 64 64 LYS CA C 64 56.524 56.552 -0.028 1
1 287 . 17 1 1 A 64 64 LYS N N 64 114.197 118.126 -3.929 1
1 288 . 17 1 1 A 65 65 ASP H H 65 8.345 8.539 -0.194 1
1 289 . 17 1 1 A 65 65 ASP CA C 65 52.969 55.064 -2.095 1
1 290 . 17 1 1 A 65 65 ASP CB C 65 40.329 39.829 0.500 1
1 291 . 17 1 1 A 65 65 ASP N N 65 118.581 119.621 -1.040 1
1 292 . 17 1 1 A 66 66 GLN H H 66 9.945 7.946 1.999 1
1 293 . 17 1 1 A 66 66 GLN CA C 66 58.132 56.346 1.786 1
1 294 . 17 1 1 A 66 66 GLN CB C 66 26.035 30.856 -4.821 1
1 295 . 17 1 1 A 66 66 GLN N N 66 113.203 115.731 -2.528 1
1 296 . 17 1 1 A 67 67 GLU H H 67 7.880 7.682 0.198 1
1 297 . 17 1 1 A 67 67 GLU HA H 67 4.910 4.922 -0.012 1
1 302 . 17 1 1 A 67 67 GLU CA C 67 54.082 54.944 -0.862 1
1 303 . 17 1 1 A 67 67 GLU CB C 67 33.174 34.352 -1.178 1
1 304 . 17 1 1 A 67 67 GLU N N 67 118.554 118.639 -0.085 1
1 305 . 17 1 1 A 68 68 VAL H H 68 9.669 9.233 0.436 1
1 306 . 17 1 1 A 68 68 VAL HA H 68 5.465 4.620 0.845 1
1 314 . 17 1 1 A 68 68 VAL CA C 68 61.079 61.642 -0.563 1
1 315 . 17 1 1 A 68 68 VAL CB C 68 33.280 32.708 0.572 1
1 316 . 17 1 1 A 68 68 VAL N N 68 126.572 122.574 3.998 1
1 317 . 17 1 1 A 69 69 ASN H H 69 8.985 8.771 0.214 1
1 318 . 17 1 1 A 69 69 ASN CA C 69 50.812 53.280 -2.468 1
1 319 . 17 1 1 A 69 69 ASN CB C 69 38.609 40.435 -1.826 1
1 320 . 17 1 1 A 69 69 ASN N N 69 127.472 126.573 0.899 1
1 321 . 17 1 1 A 70 70 PHE H H 70 9.100 9.244 -0.144 1
1 322 . 17 1 1 A 70 70 PHE CA C 70 63.279 61.982 1.297 1
1 323 . 17 1 1 A 70 70 PHE CB C 70 38.741 39.466 -0.725 1
1 324 . 17 1 1 A 70 70 PHE N N 70 119.972 127.584 -7.612 1
1 325 . 17 1 1 A 71 71 GLN H H 71 8.342 8.352 -0.010 1
1 326 . 17 1 1 A 71 71 GLN HA H 71 3.923 3.739 0.184 1
1 329 . 17 1 1 A 71 71 GLN CA C 71 59.866 58.476 1.390 1
1 330 . 17 1 1 A 71 71 GLN CB C 71 27.878 28.591 -0.713 1
1 331 . 17 1 1 A 71 71 GLN N N 71 118.216 117.341 0.875 1
1 332 . 17 1 1 A 72 72 GLU H H 72 8.721 7.963 0.758 1
1 333 . 17 1 1 A 72 72 GLU HA H 72 4.147 4.080 0.067 1
1 338 . 17 1 1 A 72 72 GLU CA C 72 59.313 59.351 -0.038 1
1 339 . 17 1 1 A 72 72 GLU CB C 72 30.233 29.440 0.793 1
1 340 . 17 1 1 A 72 72 GLU N N 72 121.455 119.661 1.794 1
1 341 . 17 1 1 A 73 73 TYR H H 73 8.536 8.074 0.462 1
1 342 . 17 1 1 A 73 73 TYR CA C 73 60.961 61.270 -0.309 1
1 343 . 17 1 1 A 73 73 TYR CB C 73 38.724 38.869 -0.145 1
1 344 . 17 1 1 A 73 73 TYR N N 73 123.356 120.843 2.513 1
1 345 . 17 1 1 A 74 74 ILE H H 74 8.642 7.804 0.838 1
1 346 . 17 1 1 A 74 74 ILE CA C 74 61.880 64.022 -2.142 1
1 347 . 17 1 1 A 74 74 ILE CB C 74 36.077 37.320 -1.243 1
1 348 . 17 1 1 A 74 74 ILE N N 74 119.799 120.373 -0.574 1
1 349 . 17 1 1 A 75 75 THR H H 75 7.959 7.656 0.303 1
1 354 . 17 1 1 A 75 75 THR CA C 75 67.056 66.757 0.299 1
1 355 . 17 1 1 A 75 75 THR CB C 75 68.386 68.514 -0.128 1
1 356 . 17 1 1 A 75 75 THR N N 75 119.486 117.672 1.814 1
1 357 . 17 1 1 A 76 76 PHE H H 76 7.450 8.445 -0.995 1
1 358 . 17 1 1 A 76 76 PHE CA C 76 59.010 61.690 -2.680 1
1 359 . 17 1 1 A 76 76 PHE CB C 76 38.139 39.234 -1.095 1
1 360 . 17 1 1 A 76 76 PHE N N 76 122.873 121.845 1.028 1
1 361 . 17 1 1 A 77 77 LEU H H 77 7.829 8.462 -0.633 1
1 362 . 17 1 1 A 77 77 LEU CA C 77 57.450 57.647 -0.197 1
1 363 . 17 1 1 A 77 77 LEU CB C 77 40.560 40.985 -0.425 1
1 364 . 17 1 1 A 77 77 LEU N N 77 117.405 118.473 -1.068 1
1 365 . 17 1 1 A 78 78 GLY H H 78 8.093 8.094 -0.001 1
1 366 . 17 1 1 A 78 78 GLY HA2 H 78 3.661 3.738 -0.077 1
1 367 . 17 1 1 A 78 78 GLY HA3 H 78 3.594 3.746 -0.152 1
1 368 . 17 1 1 A 78 78 GLY CA C 78 47.442 47.139 0.303 1
1 369 . 17 1 1 A 78 78 GLY N N 78 105.528 106.222 -0.694 1
1 370 . 17 1 1 A 79 79 ALA H H 79 7.759 7.567 0.192 1
1 371 . 17 1 1 A 79 79 ALA CA C 79 55.153 54.605 0.548 1
1 372 . 17 1 1 A 79 79 ALA CB C 79 17.768 18.418 -0.650 1
1 373 . 17 1 1 A 79 79 ALA N N 79 124.488 125.114 -0.626 1
1 374 . 17 1 1 A 80 80 LEU H H 80 7.963 8.011 -0.048 1
1 375 . 17 1 1 A 80 80 LEU CA C 80 57.464 57.647 -0.183 1
1 376 . 17 1 1 A 80 80 LEU CB C 80 41.496 41.191 0.305 1
1 377 . 17 1 1 A 80 80 LEU N N 80 117.869 120.104 -2.235 1
1 378 . 17 1 1 A 81 81 ALA H H 81 8.365 8.365 0.000 1
1 379 . 17 1 1 A 81 81 ALA CA C 81 55.475 55.252 0.223 1
1 380 . 17 1 1 A 81 81 ALA CB C 81 17.483 17.733 -0.250 1
1 381 . 17 1 1 A 81 81 ALA N N 81 119.054 120.445 -1.391 1
1 382 . 17 1 1 A 82 82 MET H H 82 8.112 8.119 -0.007 1
1 383 . 17 1 1 A 82 82 MET CA C 82 59.516 57.582 1.934 1
1 384 . 17 1 1 A 82 82 MET CB C 82 32.550 31.733 0.817 1
1 385 . 17 1 1 A 82 82 MET N N 82 115.364 116.010 -0.646 1
1 386 . 17 1 1 A 83 83 ILE H H 83 7.981 7.807 0.174 1
1 387 . 17 1 1 A 83 83 ILE HA H 83 3.839 3.698 0.141 1
1 391 . 17 1 1 A 83 83 ILE CA C 83 64.467 64.349 0.118 1
1 392 . 17 1 1 A 83 83 ILE CB C 83 37.312 37.068 0.244 1
1 393 . 17 1 1 A 83 83 ILE N N 83 120.887 120.668 0.219 1
1 394 . 17 1 1 A 84 84 TYR H H 84 8.731 7.598 1.133 1
1 395 . 17 1 1 A 84 84 TYR N N 84 120.933 119.920 1.013 1
1 396 . 17 1 1 A 87 87 ALA H H 87 7.829 7.711 0.118 1
1 397 . 17 1 1 A 87 87 ALA CA C 87 53.768 54.219 -0.451 1
1 398 . 17 1 1 A 87 87 ALA CB C 87 18.504 18.288 0.216 1
1 399 . 17 1 1 A 87 87 ALA N N 87 120.274 121.786 -1.512 1
1 400 . 17 1 1 A 88 88 LEU H H 88 7.499 7.537 -0.038 1
1 401 . 17 1 1 A 88 88 LEU CA C 88 55.605 54.448 1.157 1
1 402 . 17 1 1 A 88 88 LEU CB C 88 42.047 42.373 -0.326 1
1 403 . 17 1 1 A 88 88 LEU N N 88 117.356 115.704 1.652 1
1 404 . 17 1 1 A 89 89 LYS H H 89 7.561 7.785 -0.224 1
1 405 . 17 1 1 A 89 89 LYS CA C 89 56.865 58.703 -1.838 1
1 406 . 17 1 1 A 89 89 LYS CB C 89 32.592 32.638 -0.046 1
1 407 . 17 1 1 A 89 89 LYS N N 89 119.289 119.321 -0.032 1
1 416 . 17 3 2 C 6 6 GLU H H 190 8.385 8.189 0.196 1
1 417 . 17 3 2 C 6 6 GLU HA H 190 4.153 4.301 -0.148 1
1 422 . 17 3 2 C 6 6 GLU C C 190 175.031 176.766 -1.735 1
1 423 . 17 3 2 C 6 6 GLU CA C 190 58.866 57.027 1.839 1
1 424 . 17 3 2 C 6 6 GLU CB C 190 30.751 31.064 -0.313 1
1 426 . 17 3 2 C 6 6 GLU N N 190 122.715 121.766 0.949 1
1 427 . 17 3 2 C 7 7 GLY H H 191 8.475 8.379 0.096 1
1 428 . 17 3 2 C 7 7 GLY HA2 H 191 3.887 4.185 -0.298 1
1 429 . 17 3 2 C 7 7 GLY HA3 H 191 3.887 4.187 -0.300 1
1 430 . 17 3 2 C 7 7 GLY C C 191 177.922 175.434 2.488 1
1 431 . 17 3 2 C 7 7 GLY CA C 191 46.884 45.316 1.568 1
1 432 . 17 3 2 C 7 7 GLY N N 191 109.009 112.858 -3.849 1
1 433 . 17 3 2 C 8 8 LEU HA H 192 4.095 3.996 0.099 1
1 443 . 17 3 2 C 8 8 LEU CA C 192 58.154 58.399 -0.245 1
1 444 . 17 3 2 C 8 8 LEU CB C 192 42.789 41.685 1.104 1
1 448 . 17 3 2 C 9 9 MET H H 193 8.250 8.415 -0.165 1
1 449 . 17 3 2 C 9 9 MET HA H 193 4.150 4.218 -0.068 1
1 457 . 17 3 2 C 9 9 MET C C 193 178.421 178.072 0.349 1
1 458 . 17 3 2 C 9 9 MET CA C 193 58.818 57.933 0.885 1
1 459 . 17 3 2 C 9 9 MET CB C 193 32.360 32.322 0.038 1
1 462 . 17 3 2 C 9 9 MET N N 193 117.049 117.865 -0.816 1
1 463 . 17 3 2 C 10 10 ASN H H 194 7.892 7.911 -0.019 1
1 464 . 17 3 2 C 10 10 ASN HA H 194 4.468 4.530 -0.062 1
1 469 . 17 3 2 C 10 10 ASN C C 194 178.099 177.324 0.775 1
1 470 . 17 3 2 C 10 10 ASN CA C 194 56.644 55.443 1.201 1
1 471 . 17 3 2 C 10 10 ASN CB C 194 39.100 38.405 0.695 1
1 472 . 17 3 2 C 10 10 ASN N N 194 117.034 118.947 -1.913 1
1 474 . 17 3 2 C 11 11 VAL H H 195 7.651 7.537 0.114 1
1 475 . 17 3 2 C 11 11 VAL HA H 195 3.735 3.807 -0.072 1
1 483 . 17 3 2 C 11 11 VAL C C 195 177.657 178.269 -0.612 1
1 484 . 17 3 2 C 11 11 VAL CA C 195 66.710 65.984 0.726 1
1 485 . 17 3 2 C 11 11 VAL CB C 195 32.468 31.974 0.494 1
1 488 . 17 3 2 C 11 11 VAL N N 195 119.878 118.905 0.973 1
1 489 . 17 3 2 C 12 12 LEU H H 196 8.030 8.425 -0.395 1
1 490 . 17 3 2 C 12 12 LEU HA H 196 4.013 4.037 -0.024 1
1 500 . 17 3 2 C 12 12 LEU C C 196 177.540 179.336 -1.796 1
1 501 . 17 3 2 C 12 12 LEU CA C 196 58.489 57.258 1.231 1
1 502 . 17 3 2 C 12 12 LEU CB C 196 42.457 41.028 1.429 1
1 506 . 17 3 2 C 12 12 LEU N N 196 119.499 119.453 0.046 1
1 507 . 17 3 2 C 13 13 LYS H H 197 8.015 8.217 -0.202 1
1 508 . 17 3 2 C 13 13 LYS HA H 197 3.949 4.109 -0.160 1
1 517 . 17 3 2 C 13 13 LYS C C 197 178.419 179.173 -0.754 1
1 518 . 17 3 2 C 13 13 LYS CA C 197 60.191 59.303 0.888 1
1 519 . 17 3 2 C 13 13 LYS CB C 197 33.075 32.023 1.052 1
1 523 . 17 3 2 C 13 13 LYS N N 197 117.888 121.291 -3.403 1
1 524 . 17 3 2 C 14 14 LYS H H 198 7.506 7.701 -0.195 1
1 525 . 17 3 2 C 14 14 LYS HA H 198 4.127 4.199 -0.072 1
1 534 . 17 3 2 C 14 14 LYS C C 198 178.262 177.683 0.579 1
1 535 . 17 3 2 C 14 14 LYS CA C 198 59.161 58.252 0.909 1
1 536 . 17 3 2 C 14 14 LYS CB C 198 32.956 32.504 0.452 1
1 540 . 17 3 2 C 14 14 LYS N N 198 118.321 117.944 0.377 1
1 541 . 17 3 2 C 15 15 ILE H H 199 7.780 7.459 0.321 1
1 542 . 17 3 2 C 15 15 ILE HA H 199 3.787 3.973 -0.186 1
1 552 . 17 3 2 C 15 15 ILE C C 199 178.647 177.775 0.872 1
1 553 . 17 3 2 C 15 15 ILE CA C 199 64.912 63.042 1.870 1
1 554 . 17 3 2 C 15 15 ILE CB C 199 38.780 37.828 0.952 1
1 558 . 17 3 2 C 15 15 ILE N N 199 118.644 117.726 0.918 1
1 559 . 17 3 2 C 16 16 TYR H H 200 7.918 8.640 -0.722 1
1 560 . 17 3 2 C 16 16 TYR HA H 200 4.252 4.034 0.218 1
1 567 . 17 3 2 C 16 16 TYR C C 200 177.806 177.779 0.027 1
1 568 . 17 3 2 C 16 16 TYR CA C 200 61.171 61.846 -0.675 1
1 569 . 17 3 2 C 16 16 TYR CB C 200 39.245 39.080 0.165 1
1 573 . 17 3 2 C 16 16 TYR N N 200 118.683 122.660 -3.977 1
1 574 . 17 3 2 C 17 17 GLU H H 201 8.089 8.678 -0.589 1
1 575 . 17 3 2 C 17 17 GLU HA H 201 4.124 4.067 0.057 1
1 580 . 17 3 2 C 17 17 GLU C C 201 177.414 177.606 -0.192 1
1 581 . 17 3 2 C 17 17 GLU CA C 201 58.784 58.023 0.761 1
1 582 . 17 3 2 C 17 17 GLU CB C 201 30.747 28.304 2.443 1
1 584 . 17 3 2 C 17 17 GLU N N 201 119.409 117.183 2.226 1
1 585 . 17 3 2 C 18 18 ASP H H 202 8.023 8.100 -0.077 1
1 586 . 17 3 2 C 18 18 ASP HA H 202 4.657 4.613 0.044 1
1 589 . 17 3 2 C 18 18 ASP C C 202 177.346 177.292 0.054 1
1 590 . 17 3 2 C 18 18 ASP CA C 202 55.496 55.730 -0.234 1
1 591 . 17 3 2 C 18 18 ASP CB C 202 42.023 41.223 0.800 1
1 592 . 17 3 2 C 18 18 ASP N N 202 119.459 119.653 -0.194 1
1 593 . 17 3 2 C 19 19 GLY H H 203 7.933 8.209 -0.276 1
1 594 . 17 3 2 C 19 19 GLY HA2 H 203 3.938 3.891 0.047 1
1 595 . 17 3 2 C 19 19 GLY HA3 H 203 3.938 3.915 0.023 1
1 596 . 17 3 2 C 19 19 GLY C C 203 177.240 172.905 4.335 1
1 597 . 17 3 2 C 19 19 GLY CA C 203 46.309 47.089 -0.780 1
1 598 . 17 3 2 C 19 19 GLY N N 203 108.518 107.530 0.988 1
1 599 . 17 3 2 C 20 20 ASP H H 204 8.091 8.193 -0.102 1
1 600 . 17 3 2 C 20 20 ASP HA H 204 4.616 4.909 -0.293 1
1 603 . 17 3 2 C 20 20 ASP C C 204 173.979 174.226 -0.247 1
1 604 . 17 3 2 C 20 20 ASP CA C 204 55.064 53.107 1.957 1
1 605 . 17 3 2 C 20 20 ASP CB C 204 42.203 43.119 -0.916 1
1 606 . 17 3 2 C 20 20 ASP N N 204 120.172 122.437 -2.265 1
1 607 . 17 3 2 C 21 21 ASP H H 205 8.352 8.680 -0.328 1
1 608 . 17 3 2 C 21 21 ASP HA H 205 4.468 4.885 -0.417 1
1 611 . 17 3 2 C 21 21 ASP C C 205 176.432 176.981 -0.549 1
1 612 . 17 3 2 C 21 21 ASP CA C 205 56.663 54.041 2.622 1
1 613 . 17 3 2 C 21 21 ASP CB C 205 41.918 44.031 -2.113 1
1 614 . 17 3 2 C 21 21 ASP N N 205 121.515 120.742 0.773 1
1 615 . 17 3 2 C 22 22 ASP H H 206 8.239 8.016 0.223 1
1 616 . 17 3 2 C 22 22 ASP HA H 206 4.455 4.543 -0.088 1
1 619 . 17 3 2 C 22 22 ASP C C 206 177.449 179.281 -1.832 1
1 620 . 17 3 2 C 22 22 ASP CA C 206 57.165 56.494 0.671 1
1 621 . 17 3 2 C 22 22 ASP CB C 206 41.820 40.304 1.516 1
1 622 . 17 3 2 C 22 22 ASP N N 206 120.156 119.964 0.192 1
1 623 . 17 3 2 C 23 23 MET H H 207 8.300 8.055 0.245 1
1 624 . 17 3 2 C 23 23 MET HA H 207 4.255 4.093 0.162 1
1 632 . 17 3 2 C 23 23 MET C C 207 178.412 178.087 0.325 1
1 633 . 17 3 2 C 23 23 MET CA C 207 58.065 58.800 -0.735 1
1 634 . 17 3 2 C 23 23 MET CB C 207 32.488 32.864 -0.376 1
1 637 . 17 3 2 C 23 23 MET N N 207 120.707 119.378 1.329 1
1 638 . 17 3 2 C 24 24 LYS H H 208 8.047 7.853 0.194 1
1 639 . 17 3 2 C 24 24 LYS HA H 208 3.946 4.078 -0.132 1
1 648 . 17 3 2 C 24 24 LYS C C 208 178.008 178.003 0.005 1
1 649 . 17 3 2 C 24 24 LYS CA C 208 59.847 59.018 0.829 1
1 650 . 17 3 2 C 24 24 LYS CB C 208 32.983 31.641 1.342 1
1 654 . 17 3 2 C 24 24 LYS N N 208 119.504 117.439 2.065 1
1 655 . 17 3 2 C 25 25 ARG H H 209 7.891 7.798 0.093 1
1 656 . 17 3 2 C 25 25 ARG HA H 209 4.168 4.317 -0.149 1
1 663 . 17 3 2 C 25 25 ARG C C 209 178.100 177.358 0.742 1
1 664 . 17 3 2 C 25 25 ARG CA C 209 58.810 57.265 1.545 1
1 665 . 17 3 2 C 25 25 ARG CB C 209 31.080 30.762 0.318 1
1 668 . 17 3 2 C 25 25 ARG N N 209 118.378 118.780 -0.402 1
1 669 . 17 3 2 C 26 26 THR H H 210 7.869 7.576 0.293 1
1 670 . 17 3 2 C 26 26 THR HA H 210 4.023 4.161 -0.138 1
1 675 . 17 3 2 C 26 26 THR C C 210 177.984 176.553 1.431 1
1 676 . 17 3 2 C 26 26 THR CA C 210 65.747 65.487 0.260 1
1 677 . 17 3 2 C 26 26 THR CB C 210 69.683 69.390 0.293 1
1 679 . 17 3 2 C 26 26 THR N N 210 115.443 114.051 1.392 1
1 680 . 17 3 2 C 27 27 ILE H H 211 7.901 8.216 -0.315 1
1 681 . 17 3 2 C 27 27 ILE HA H 211 4.142 3.633 0.509 1
1 691 . 17 3 2 C 27 27 ILE C C 211 175.595 177.975 -2.380 1
1 692 . 17 3 2 C 27 27 ILE CA C 211 63.528 65.121 -1.593 1
1 693 . 17 3 2 C 27 27 ILE CB C 211 38.982 37.309 1.673 1
1 697 . 17 3 2 C 27 27 ILE N N 211 121.265 120.455 0.810 1
1 698 . 17 3 2 C 28 28 ASN HA H 212 4.465 4.406 0.059 1
1 703 . 17 3 2 C 28 28 ASN CA C 212 55.182 56.207 -1.025 1
1 704 . 17 3 2 C 28 28 ASN CB C 212 39.480 39.087 0.393 1
1 706 . 17 3 2 C 29 29 LYS H H 213 7.968 8.289 -0.321 1
1 707 . 17 3 2 C 29 29 LYS HA H 213 4.072 4.070 0.002 1
1 716 . 17 3 2 C 29 29 LYS C C 213 176.218 178.786 -2.568 1
1 717 . 17 3 2 C 29 29 LYS CA C 213 58.489 59.052 -0.563 1
1 718 . 17 3 2 C 29 29 LYS CB C 213 33.165 32.298 0.867 1
1 722 . 17 3 2 C 29 29 LYS N N 213 120.820 118.058 2.762 1
1 723 . 17 3 2 C 30 30 ALA H H 214 7.865 7.500 0.365 1
1 724 . 17 3 2 C 30 30 ALA HA H 214 4.217 4.147 0.070 1
1 728 . 17 3 2 C 30 30 ALA C C 214 177.041 179.915 -2.874 1
1 729 . 17 3 2 C 30 30 ALA CA C 214 54.104 54.940 -0.836 1
1 730 . 17 3 2 C 30 30 ALA CB C 214 19.496 18.531 0.965 1
1 731 . 17 3 2 C 30 30 ALA N N 214 121.571 121.245 0.326 1
1 732 . 17 3 2 C 31 31 TRP H H 215 7.831 7.727 0.104 1
1 733 . 17 3 2 C 31 31 TRP HA H 215 4.598 4.245 0.353 1
1 742 . 17 3 2 C 31 31 TRP C C 215 178.088 178.012 0.076 1
1 743 . 17 3 2 C 31 31 TRP CA C 215 58.432 61.429 -2.997 1
1 744 . 17 3 2 C 31 31 TRP CB C 215 30.472 29.334 1.138 1
1 750 . 17 3 2 C 31 31 TRP N N 215 118.141 120.299 -2.158 1
1 752 . 17 3 2 C 32 32 VAL H H 216 7.594 8.753 -1.159 1
1 753 . 17 3 2 C 32 32 VAL HA H 216 3.978 3.791 0.187 1
1 761 . 17 3 2 C 32 32 VAL C C 216 176.574 178.198 -1.624 1
1 762 . 17 3 2 C 32 32 VAL CA C 216 63.329 66.397 -3.068 1
1 763 . 17 3 2 C 32 32 VAL CB C 216 33.373 31.332 2.041 1
1 766 . 17 3 2 C 32 32 VAL N N 216 118.287 120.099 -1.812 1
1 767 . 17 3 2 C 33 33 GLU H H 217 8.012 8.838 -0.826 1
1 768 . 17 3 2 C 33 33 GLU HA H 217 4.257 4.179 0.078 1
1 773 . 17 3 2 C 33 33 GLU C C 217 176.164 177.602 -1.438 1
1 774 . 17 3 2 C 33 33 GLU CA C 217 57.409 58.560 -1.151 1
1 775 . 17 3 2 C 33 33 GLU CB C 217 30.978 27.894 3.084 1
1 777 . 17 3 2 C 33 33 GLU N N 217 122.535 120.194 2.341 1
1 778 . 17 3 2 C 34 34 SER H H 218 8.037 7.343 0.694 1
1 779 . 17 3 2 C 34 34 SER HA H 218 4.514 4.459 0.055 1
1 782 . 17 3 2 C 34 34 SER C C 218 176.451 175.222 1.229 1
1 783 . 17 3 2 C 34 34 SER CA C 218 58.987 59.039 -0.052 1
1 784 . 17 3 2 C 34 34 SER CB C 218 64.569 63.595 0.974 1
1 785 . 17 3 2 C 34 34 SER N N 218 117.058 115.590 1.468 1
1 6 . 18 1 1 A 2 2 ALA H H 2 8.191 9.077 -0.886 1
1 7 . 18 1 1 A 2 2 ALA CA C 2 51.957 55.076 -3.119 1
1 8 . 18 1 1 A 2 2 ALA CB C 2 19.580 18.432 1.148 1
1 9 . 18 1 1 A 2 2 ALA N N 2 124.666 127.075 -2.409 1
1 10 . 18 1 1 A 3 3 SER H H 3 8.829 8.330 0.499 1
1 11 . 18 1 1 A 3 3 SER CA C 3 57.221 62.549 -5.328 1
1 12 . 18 1 1 A 3 3 SER N N 3 119.917 113.210 6.707 1
1 13 . 18 1 1 A 4 4 PRO CA C 4 66.688 65.517 1.171 1
1 14 . 18 1 1 A 4 4 PRO CB C 4 32.553 30.771 1.782 1
1 15 . 18 1 1 A 5 5 LEU H H 5 9.146 7.257 1.889 1
1 16 . 18 1 1 A 5 5 LEU CA C 5 59.017 57.004 2.013 1
1 17 . 18 1 1 A 5 5 LEU CB C 5 42.341 42.529 -0.188 1
1 18 . 18 1 1 A 5 5 LEU N N 5 117.902 116.884 1.018 1
1 19 . 18 1 1 A 6 6 ASP H H 6 7.572 8.727 -1.155 1
1 20 . 18 1 1 A 6 6 ASP CA C 6 57.997 57.520 0.477 1
1 21 . 18 1 1 A 6 6 ASP CB C 6 40.910 40.072 0.838 1
1 22 . 18 1 1 A 6 6 ASP N N 6 118.259 118.451 -0.192 1
1 23 . 18 1 1 A 7 7 GLN H H 7 8.660 8.323 0.337 1
1 24 . 18 1 1 A 7 7 GLN HA H 7 4.064 4.149 -0.085 1
1 29 . 18 1 1 A 7 7 GLN CA C 7 59.270 57.655 1.615 1
1 30 . 18 1 1 A 7 7 GLN CB C 7 28.468 27.284 1.184 1
1 31 . 18 1 1 A 7 7 GLN N N 7 119.558 117.757 1.801 1
1 32 . 18 1 1 A 8 8 ALA H H 8 8.253 7.937 0.316 1
1 33 . 18 1 1 A 8 8 ALA CA C 8 55.519 54.856 0.663 1
1 34 . 18 1 1 A 8 8 ALA CB C 8 18.113 18.896 -0.783 1
1 35 . 18 1 1 A 8 8 ALA N N 8 123.628 122.521 1.107 1
1 36 . 18 1 1 A 9 9 ILE H H 9 8.134 8.264 -0.130 1
1 37 . 18 1 1 A 9 9 ILE CA C 9 65.261 64.467 0.794 1
1 38 . 18 1 1 A 9 9 ILE CB C 9 37.023 37.209 -0.186 1
1 39 . 18 1 1 A 9 9 ILE N N 9 117.056 117.093 -0.037 1
1 40 . 18 1 1 A 10 10 GLY H H 10 8.515 8.653 -0.138 1
1 41 . 18 1 1 A 10 10 GLY HA3 H 10 3.773 3.781 -0.008 1
1 42 . 18 1 1 A 10 10 GLY CA C 10 47.637 46.846 0.791 1
1 43 . 18 1 1 A 10 10 GLY N N 10 106.202 110.914 -4.712 1
1 44 . 18 1 1 A 11 11 LEU H H 11 8.212 8.015 0.197 1
1 45 . 18 1 1 A 11 11 LEU CA C 11 58.354 57.622 0.732 1
1 46 . 18 1 1 A 11 11 LEU CB C 11 41.683 42.059 -0.376 1
1 47 . 18 1 1 A 11 11 LEU N N 11 124.624 123.382 1.242 1
1 48 . 18 1 1 A 12 12 LEU H H 12 7.971 7.900 0.071 1
1 49 . 18 1 1 A 12 12 LEU HA H 12 4.144 4.184 -0.040 1
1 59 . 18 1 1 A 12 12 LEU CA C 12 58.691 58.496 0.195 1
1 60 . 18 1 1 A 12 12 LEU CB C 12 40.657 41.582 -0.925 1
1 61 . 18 1 1 A 12 12 LEU N N 12 118.095 118.833 -0.738 1
1 62 . 18 1 1 A 13 13 ILE H H 13 8.379 8.393 -0.014 1
1 63 . 18 1 1 A 13 13 ILE CA C 13 66.405 65.355 1.050 1
1 64 . 18 1 1 A 13 13 ILE CB C 13 38.916 38.108 0.808 1
1 65 . 18 1 1 A 13 13 ILE N N 13 121.161 120.018 1.143 1
1 66 . 18 1 1 A 14 14 GLY H H 14 8.823 8.510 0.313 1
1 67 . 18 1 1 A 14 14 GLY HA2 H 14 4.147 3.734 0.413 1
1 68 . 18 1 1 A 14 14 GLY HA3 H 14 3.982 3.759 0.223 1
1 69 . 18 1 1 A 14 14 GLY CA C 14 47.750 47.403 0.347 1
1 70 . 18 1 1 A 14 14 GLY N N 14 108.982 107.419 1.563 1
1 71 . 18 1 1 A 15 15 ILE H H 15 8.681 8.519 0.162 1
1 72 . 18 1 1 A 15 15 ILE CA C 15 64.996 64.862 0.134 1
1 73 . 18 1 1 A 15 15 ILE CB C 15 37.107 37.896 -0.789 1
1 74 . 18 1 1 A 15 15 ILE N N 15 121.601 122.683 -1.082 1
1 75 . 18 1 1 A 16 16 PHE H H 16 7.103 8.419 -1.316 1
1 76 . 18 1 1 A 16 16 PHE CA C 16 62.910 61.696 1.214 1
1 77 . 18 1 1 A 16 16 PHE CB C 16 38.782 38.858 -0.076 1
1 78 . 18 1 1 A 16 16 PHE N N 16 118.660 120.437 -1.777 1
1 79 . 18 1 1 A 17 17 HIS H H 17 7.591 8.698 -1.107 1
1 80 . 18 1 1 A 17 17 HIS HA H 17 4.793 4.663 0.130 1
1 82 . 18 1 1 A 17 17 HIS CA C 17 58.125 59.518 -1.393 1
1 83 . 18 1 1 A 17 17 HIS CB C 17 29.584 29.660 -0.076 1
1 84 . 18 1 1 A 17 17 HIS N N 17 114.968 117.506 -2.538 1
1 85 . 18 1 1 A 18 18 LYS H H 18 8.144 8.154 -0.010 1
1 86 . 18 1 1 A 18 18 LYS CA C 18 58.975 59.068 -0.093 1
1 87 . 18 1 1 A 18 18 LYS CB C 18 32.379 32.130 0.249 1
1 88 . 18 1 1 A 18 18 LYS N N 18 122.373 120.756 1.617 1
1 89 . 18 1 1 A 19 19 TYR H H 19 6.999 7.284 -0.285 1
1 90 . 18 1 1 A 19 19 TYR CA C 19 60.318 60.567 -0.249 1
1 91 . 18 1 1 A 19 19 TYR CB C 19 40.355 38.591 1.764 1
1 92 . 18 1 1 A 19 19 TYR N N 19 113.614 118.676 -5.062 1
1 93 . 18 1 1 A 20 20 SER H H 20 8.432 8.521 -0.089 1
1 94 . 18 1 1 A 20 20 SER CA C 20 61.897 60.509 1.388 1
1 95 . 18 1 1 A 20 20 SER CB C 20 61.354 62.549 -1.195 1
1 96 . 18 1 1 A 20 20 SER N N 20 113.201 116.158 -2.957 1
1 97 . 18 1 1 A 21 21 GLY H H 21 7.678 8.335 -0.657 1
1 98 . 18 1 1 A 21 21 GLY HA2 H 21 4.195 3.875 0.320 1
1 99 . 18 1 1 A 21 21 GLY HA3 H 21 3.900 3.877 0.023 1
1 100 . 18 1 1 A 21 21 GLY CA C 21 45.628 45.944 -0.316 1
1 101 . 18 1 1 A 21 21 GLY N N 21 110.734 110.844 -0.110 1
1 102 . 18 1 1 A 22 22 LYS H H 22 7.362 7.524 -0.162 1
1 103 . 18 1 1 A 22 22 LYS CA C 22 60.163 58.566 1.597 1
1 104 . 18 1 1 A 22 22 LYS CB C 22 32.554 33.439 -0.885 1
1 105 . 18 1 1 A 22 22 LYS N N 22 122.161 120.813 1.348 1
1 106 . 18 1 1 A 23 23 GLU H H 23 9.639 8.359 1.280 1
1 107 . 18 1 1 A 23 23 GLU CA C 23 54.449 56.223 -1.774 1
1 108 . 18 1 1 A 23 23 GLU N N 23 116.288 113.850 2.438 1
1 109 . 18 1 1 A 24 24 GLY HA2 H 24 3.912 3.967 -0.055 1
1 110 . 18 1 1 A 24 24 GLY HA3 H 24 3.787 4.006 -0.219 1
1 111 . 18 1 1 A 24 24 GLY CA C 24 45.898 44.245 1.653 1
1 112 . 18 1 1 A 25 25 ASP H H 25 8.204 8.595 -0.391 1
1 113 . 18 1 1 A 25 25 ASP CA C 25 55.252 52.768 2.484 1
1 114 . 18 1 1 A 25 25 ASP N N 25 125.671 121.109 4.562 1
1 115 . 18 1 1 A 26 26 LYS CA C 26 57.851 58.669 -0.818 1
1 116 . 18 1 1 A 26 26 LYS CB C 26 31.265 31.889 -0.624 1
1 117 . 18 1 1 A 27 27 HIS H H 27 9.763 7.859 1.904 1
1 118 . 18 1 1 A 27 27 HIS CA C 27 55.580 55.251 0.329 1
1 119 . 18 1 1 A 27 27 HIS CB C 27 30.936 31.583 -0.647 1
1 120 . 18 1 1 A 27 27 HIS N N 27 118.108 112.837 5.271 1
1 121 . 18 1 1 A 28 28 THR H H 28 7.325 7.544 -0.219 1
1 126 . 18 1 1 A 28 28 THR CA C 28 60.128 61.066 -0.938 1
1 127 . 18 1 1 A 28 28 THR CB C 28 72.268 71.411 0.857 1
1 128 . 18 1 1 A 28 28 THR N N 28 106.920 113.136 -6.216 1
1 129 . 18 1 1 A 29 29 LEU H H 29 9.422 9.041 0.381 1
1 130 . 18 1 1 A 29 29 LEU HA H 29 5.368 5.237 0.131 1
1 140 . 18 1 1 A 29 29 LEU CA C 29 52.567 53.312 -0.745 1
1 141 . 18 1 1 A 29 29 LEU CB C 29 43.523 44.598 -1.075 1
1 142 . 18 1 1 A 29 29 LEU N N 29 125.021 127.779 -2.758 1
1 143 . 18 1 1 A 30 30 SER H H 30 10.485 8.608 1.877 1
1 144 . 18 1 1 A 30 30 SER CA C 30 56.653 57.189 -0.536 1
1 145 . 18 1 1 A 30 30 SER CB C 30 65.313 65.561 -0.248 1
1 146 . 18 1 1 A 30 30 SER N N 30 124.758 116.382 8.376 1
1 147 . 18 1 1 A 31 31 LYS H H 31 8.728 8.913 -0.185 1
1 148 . 18 1 1 A 31 31 LYS CA C 31 59.669 59.320 0.349 1
1 149 . 18 1 1 A 31 31 LYS CB C 31 31.763 31.994 -0.231 1
1 150 . 18 1 1 A 31 31 LYS N N 31 119.459 119.386 0.073 1
1 151 . 18 1 1 A 32 32 LYS H H 32 7.857 8.002 -0.145 1
1 152 . 18 1 1 A 32 32 LYS CA C 32 59.721 59.464 0.257 1
1 153 . 18 1 1 A 32 32 LYS CB C 32 32.901 32.047 0.854 1
1 154 . 18 1 1 A 32 32 LYS N N 32 117.933 119.557 -1.624 1
1 155 . 18 1 1 A 33 33 GLU H H 33 7.559 7.769 -0.210 1
1 156 . 18 1 1 A 33 33 GLU CA C 33 59.169 58.561 0.608 1
1 157 . 18 1 1 A 33 33 GLU CB C 33 31.014 29.342 1.672 1
1 158 . 18 1 1 A 33 33 GLU N N 33 120.407 118.975 1.432 1
1 159 . 18 1 1 A 34 34 LEU H H 34 8.833 8.442 0.391 1
1 160 . 18 1 1 A 34 34 LEU CA C 34 56.928 57.843 -0.915 1
1 161 . 18 1 1 A 34 34 LEU CB C 34 41.435 41.726 -0.291 1
1 162 . 18 1 1 A 34 34 LEU N N 34 117.677 121.470 -3.793 1
1 163 . 18 1 1 A 35 35 LYS H H 35 8.010 8.155 -0.145 1
1 164 . 18 1 1 A 35 35 LYS CA C 35 60.692 59.657 1.035 1
1 165 . 18 1 1 A 35 35 LYS CB C 35 32.223 32.148 0.075 1
1 166 . 18 1 1 A 35 35 LYS N N 35 119.829 118.824 1.005 1
1 167 . 18 1 1 A 36 36 GLU H H 36 7.169 7.723 -0.554 1
1 168 . 18 1 1 A 36 36 GLU CA C 36 59.588 58.907 0.681 1
1 169 . 18 1 1 A 36 36 GLU CB C 36 29.342 29.480 -0.138 1
1 170 . 18 1 1 A 36 36 GLU N N 36 117.340 118.950 -1.610 1
1 171 . 18 1 1 A 37 37 LEU H H 37 7.478 7.313 0.165 1
1 172 . 18 1 1 A 37 37 LEU CA C 37 59.674 57.659 2.015 1
1 173 . 18 1 1 A 37 37 LEU CB C 37 42.142 41.137 1.005 1
1 174 . 18 1 1 A 37 37 LEU N N 37 120.884 119.902 0.982 1
1 175 . 18 1 1 A 38 38 ILE H H 38 8.377 7.776 0.601 1
1 176 . 18 1 1 A 38 38 ILE CA C 38 65.651 64.055 1.596 1
1 177 . 18 1 1 A 38 38 ILE N N 38 118.450 114.141 4.309 1
1 178 . 18 1 1 A 39 39 GLN H H 39 8.217 8.253 -0.036 1
1 179 . 18 1 1 A 39 39 GLN CA C 39 59.788 59.003 0.785 1
1 180 . 18 1 1 A 39 39 GLN CB C 39 29.278 27.935 1.343 1
1 181 . 18 1 1 A 39 39 GLN N N 39 113.091 120.563 -7.472 1
1 182 . 18 1 1 A 40 40 LYS H H 40 8.426 7.470 0.956 1
1 183 . 18 1 1 A 40 40 LYS CA C 40 57.807 59.429 -1.622 1
1 184 . 18 1 1 A 40 40 LYS CB C 40 33.942 32.455 1.487 1
1 185 . 18 1 1 A 40 40 LYS N N 40 114.771 120.783 -6.012 1
1 186 . 18 1 1 A 41 41 GLU H H 41 8.496 8.588 -0.092 1
1 187 . 18 1 1 A 41 41 GLU CA C 41 55.395 58.852 -3.457 1
1 188 . 18 1 1 A 41 41 GLU CB C 41 29.260 30.178 -0.918 1
1 189 . 18 1 1 A 41 41 GLU N N 41 112.546 118.797 -6.251 1
1 190 . 18 1 1 A 42 42 LEU H H 42 7.267 7.753 -0.486 1
1 191 . 18 1 1 A 42 42 LEU CA C 42 53.776 54.045 -0.269 1
1 192 . 18 1 1 A 42 42 LEU N N 42 118.657 117.111 1.546 1
1 193 . 18 1 1 A 44 44 ILE CA C 44 62.210 62.224 -0.014 1
1 194 . 18 1 1 A 44 44 ILE CB C 44 38.247 36.853 1.394 1
1 195 . 18 1 1 A 45 45 GLY H H 45 7.820 8.855 -1.035 1
1 196 . 18 1 1 A 45 45 GLY CA C 45 47.742 45.370 2.372 1
1 197 . 18 1 1 A 45 45 GLY N N 45 108.178 115.407 -7.229 1
1 198 . 18 1 1 A 46 46 SER H H 46 7.895 7.769 0.126 1
1 199 . 18 1 1 A 46 46 SER CA C 46 59.958 56.560 3.398 1
1 200 . 18 1 1 A 46 46 SER CB C 46 63.450 66.371 -2.921 1
1 201 . 18 1 1 A 46 46 SER N N 46 113.038 113.301 -0.263 1
1 202 . 18 1 1 A 47 47 LYS H H 47 7.736 8.539 -0.803 1
1 203 . 18 1 1 A 47 47 LYS CA C 47 55.636 57.006 -1.370 1
1 204 . 18 1 1 A 47 47 LYS CB C 47 33.103 32.440 0.663 1
1 205 . 18 1 1 A 47 47 LYS N N 47 119.422 125.583 -6.161 1
1 206 . 18 1 1 A 48 48 LEU H H 48 6.988 8.713 -1.725 1
1 207 . 18 1 1 A 48 48 LEU HA H 48 4.497 4.334 0.163 1
1 217 . 18 1 1 A 48 48 LEU CA C 48 54.517 54.059 0.458 1
1 218 . 18 1 1 A 48 48 LEU CB C 48 42.987 39.761 3.226 1
1 219 . 18 1 1 A 48 48 LEU N N 48 118.908 122.960 -4.052 1
1 220 . 18 1 1 A 49 49 GLN H H 49 9.206 8.252 0.954 1
1 221 . 18 1 1 A 49 49 GLN HA H 49 4.486 4.048 0.438 1
1 223 . 18 1 1 A 49 49 GLN CA C 49 54.785 58.340 -3.555 1
1 224 . 18 1 1 A 49 49 GLN CB C 49 29.636 27.980 1.656 1
1 225 . 18 1 1 A 49 49 GLN N N 49 121.275 120.829 0.446 1
1 226 . 18 1 1 A 50 50 ASP H H 50 8.854 8.468 0.386 1
1 227 . 18 1 1 A 50 50 ASP CA C 50 59.078 57.480 1.598 1
1 228 . 18 1 1 A 50 50 ASP CB C 50 40.632 42.023 -1.391 1
1 229 . 18 1 1 A 50 50 ASP N N 50 123.430 120.406 3.024 1
1 230 . 18 1 1 A 51 51 ALA H H 51 8.720 7.897 0.823 1
1 231 . 18 1 1 A 51 51 ALA CA C 51 55.281 54.849 0.432 1
1 232 . 18 1 1 A 51 51 ALA CB C 51 18.205 18.122 0.083 1
1 233 . 18 1 1 A 51 51 ALA N N 51 117.829 121.184 -3.355 1
1 234 . 18 1 1 A 52 52 GLU H H 52 7.161 7.732 -0.571 1
1 235 . 18 1 1 A 52 52 GLU CA C 52 58.757 59.173 -0.416 1
1 236 . 18 1 1 A 52 52 GLU CB C 52 30.247 29.832 0.415 1
1 237 . 18 1 1 A 52 52 GLU N N 52 115.459 117.842 -2.383 1
1 238 . 18 1 1 A 53 53 ILE H H 53 7.962 7.906 0.056 1
1 239 . 18 1 1 A 53 53 ILE CA C 53 65.525 65.116 0.409 1
1 240 . 18 1 1 A 53 53 ILE CB C 53 37.289 37.914 -0.625 1
1 241 . 18 1 1 A 53 53 ILE N N 53 120.414 120.997 -0.583 1
1 242 . 18 1 1 A 54 54 VAL H H 54 8.132 8.117 0.015 1
1 243 . 18 1 1 A 54 54 VAL CA C 54 67.290 65.413 1.877 1
1 244 . 18 1 1 A 54 54 VAL CB C 54 31.434 31.149 0.285 1
1 245 . 18 1 1 A 54 54 VAL N N 54 119.775 116.862 2.913 1
1 246 . 18 1 1 A 55 55 LYS H H 55 7.155 8.042 -0.887 1
1 247 . 18 1 1 A 55 55 LYS CA C 55 59.131 59.252 -0.121 1
1 248 . 18 1 1 A 55 55 LYS CB C 55 32.131 32.044 0.087 1
1 249 . 18 1 1 A 55 55 LYS N N 55 119.175 120.853 -1.678 1
1 250 . 18 1 1 A 56 56 LEU H H 56 7.837 8.191 -0.354 1
1 251 . 18 1 1 A 56 56 LEU CA C 56 58.052 58.058 -0.006 1
1 252 . 18 1 1 A 56 56 LEU CB C 56 41.878 41.279 0.599 1
1 253 . 18 1 1 A 56 56 LEU N N 56 119.679 121.209 -1.530 1
1 254 . 18 1 1 A 57 57 MET H H 57 8.385 8.841 -0.456 1
1 255 . 18 1 1 A 57 57 MET CA C 57 60.756 58.742 2.014 1
1 256 . 18 1 1 A 57 57 MET CB C 57 33.152 31.891 1.261 1
1 257 . 18 1 1 A 57 57 MET N N 57 115.116 119.500 -4.384 1
1 258 . 18 1 1 A 58 58 ASP H H 58 7.591 8.338 -0.747 1
1 259 . 18 1 1 A 58 58 ASP CA C 58 57.365 57.614 -0.249 1
1 260 . 18 1 1 A 58 58 ASP CB C 58 40.858 41.523 -0.665 1
1 261 . 18 1 1 A 58 58 ASP N N 58 118.197 119.724 -1.527 1
1 262 . 18 1 1 A 59 59 ASP H H 59 7.725 8.258 -0.533 1
1 263 . 18 1 1 A 59 59 ASP CA C 59 56.830 57.347 -0.517 1
1 264 . 18 1 1 A 59 59 ASP CB C 59 40.567 40.253 0.314 1
1 265 . 18 1 1 A 59 59 ASP N N 59 118.481 118.565 -0.084 1
1 266 . 18 1 1 A 60 60 LEU H H 60 7.703 7.878 -0.175 1
1 267 . 18 1 1 A 60 60 LEU CA C 60 56.564 57.669 -1.105 1
1 268 . 18 1 1 A 60 60 LEU CB C 60 42.714 41.354 1.360 1
1 269 . 18 1 1 A 60 60 LEU N N 60 116.935 120.891 -3.956 1
1 270 . 18 1 1 A 61 61 ASP H H 61 7.143 8.380 -1.237 1
1 271 . 18 1 1 A 61 61 ASP HA H 61 4.690 4.327 0.363 1
1 274 . 18 1 1 A 61 61 ASP CA C 61 52.286 56.654 -4.368 1
1 275 . 18 1 1 A 61 61 ASP CB C 61 39.245 40.715 -1.470 1
1 276 . 18 1 1 A 61 61 ASP N N 61 116.605 118.849 -2.244 1
1 277 . 18 1 1 A 62 62 ARG H H 62 7.786 8.019 -0.233 1
1 278 . 18 1 1 A 62 62 ARG CA C 62 58.328 58.398 -0.070 1
1 279 . 18 1 1 A 62 62 ARG CB C 62 30.106 30.017 0.089 1
1 280 . 18 1 1 A 62 62 ARG N N 62 125.967 119.229 6.738 1
1 281 . 18 1 1 A 63 63 ASN H H 63 7.945 8.057 -0.112 1
1 282 . 18 1 1 A 63 63 ASN CA C 63 51.863 55.632 -3.769 1
1 283 . 18 1 1 A 63 63 ASN CB C 63 36.809 38.501 -1.692 1
1 284 . 18 1 1 A 63 63 ASN N N 63 112.434 116.676 -4.242 1
1 285 . 18 1 1 A 64 64 LYS H H 64 7.477 7.881 -0.404 1
1 286 . 18 1 1 A 64 64 LYS CA C 64 56.524 57.122 -0.598 1
1 287 . 18 1 1 A 64 64 LYS N N 64 114.197 116.782 -2.585 1
1 288 . 18 1 1 A 65 65 ASP H H 65 8.345 7.806 0.539 1
1 289 . 18 1 1 A 65 65 ASP CA C 65 52.969 55.743 -2.774 1
1 290 . 18 1 1 A 65 65 ASP CB C 65 40.329 42.388 -2.059 1
1 291 . 18 1 1 A 65 65 ASP N N 65 118.581 115.235 3.346 1
1 292 . 18 1 1 A 66 66 GLN H H 66 9.945 8.182 1.763 1
1 293 . 18 1 1 A 66 66 GLN CA C 66 58.132 55.257 2.875 1
1 294 . 18 1 1 A 66 66 GLN CB C 66 26.035 30.159 -4.124 1
1 295 . 18 1 1 A 66 66 GLN N N 66 113.203 116.487 -3.284 1
1 296 . 18 1 1 A 67 67 GLU H H 67 7.880 7.425 0.455 1
1 297 . 18 1 1 A 67 67 GLU HA H 67 4.910 4.743 0.167 1
1 302 . 18 1 1 A 67 67 GLU CA C 67 54.082 55.307 -1.225 1
1 303 . 18 1 1 A 67 67 GLU CB C 67 33.174 32.884 0.290 1
1 304 . 18 1 1 A 67 67 GLU N N 67 118.554 117.244 1.310 1
1 305 . 18 1 1 A 68 68 VAL H H 68 9.669 9.102 0.567 1
1 306 . 18 1 1 A 68 68 VAL HA H 68 5.465 4.662 0.803 1
1 314 . 18 1 1 A 68 68 VAL CA C 68 61.079 61.448 -0.369 1
1 315 . 18 1 1 A 68 68 VAL CB C 68 33.280 34.699 -1.419 1
1 316 . 18 1 1 A 68 68 VAL N N 68 126.572 121.252 5.320 1
1 317 . 18 1 1 A 69 69 ASN H H 69 8.985 8.976 0.009 1
1 318 . 18 1 1 A 69 69 ASN CA C 69 50.812 51.933 -1.121 1
1 319 . 18 1 1 A 69 69 ASN CB C 69 38.609 39.047 -0.438 1
1 320 . 18 1 1 A 69 69 ASN N N 69 127.472 127.250 0.222 1
1 321 . 18 1 1 A 70 70 PHE H H 70 9.100 9.236 -0.136 1
1 322 . 18 1 1 A 70 70 PHE CA C 70 63.279 62.662 0.617 1
1 323 . 18 1 1 A 70 70 PHE CB C 70 38.741 39.093 -0.352 1
1 324 . 18 1 1 A 70 70 PHE N N 70 119.972 120.100 -0.128 1
1 325 . 18 1 1 A 71 71 GLN H H 71 8.342 8.220 0.122 1
1 326 . 18 1 1 A 71 71 GLN HA H 71 3.923 3.756 0.167 1
1 329 . 18 1 1 A 71 71 GLN CA C 71 59.866 58.367 1.499 1
1 330 . 18 1 1 A 71 71 GLN CB C 71 27.878 28.689 -0.811 1
1 331 . 18 1 1 A 71 71 GLN N N 71 118.216 118.046 0.170 1
1 332 . 18 1 1 A 72 72 GLU H H 72 8.721 8.242 0.479 1
1 333 . 18 1 1 A 72 72 GLU HA H 72 4.147 4.081 0.066 1
1 338 . 18 1 1 A 72 72 GLU CA C 72 59.313 59.215 0.098 1
1 339 . 18 1 1 A 72 72 GLU CB C 72 30.233 29.590 0.643 1
1 340 . 18 1 1 A 72 72 GLU N N 72 121.455 119.330 2.125 1
1 341 . 18 1 1 A 73 73 TYR H H 73 8.536 8.306 0.230 1
1 342 . 18 1 1 A 73 73 TYR CA C 73 60.961 61.234 -0.273 1
1 343 . 18 1 1 A 73 73 TYR CB C 73 38.724 38.885 -0.161 1
1 344 . 18 1 1 A 73 73 TYR N N 73 123.356 121.924 1.432 1
1 345 . 18 1 1 A 74 74 ILE H H 74 8.642 7.556 1.086 1
1 346 . 18 1 1 A 74 74 ILE CA C 74 61.880 63.769 -1.889 1
1 347 . 18 1 1 A 74 74 ILE CB C 74 36.077 36.822 -0.745 1
1 348 . 18 1 1 A 74 74 ILE N N 74 119.799 119.755 0.044 1
1 349 . 18 1 1 A 75 75 THR H H 75 7.959 8.302 -0.343 1
1 354 . 18 1 1 A 75 75 THR CA C 75 67.056 66.564 0.492 1
1 355 . 18 1 1 A 75 75 THR CB C 75 68.386 68.526 -0.140 1
1 356 . 18 1 1 A 75 75 THR N N 75 119.486 117.558 1.928 1
1 357 . 18 1 1 A 76 76 PHE H H 76 7.450 7.969 -0.519 1
1 358 . 18 1 1 A 76 76 PHE CA C 76 59.010 61.373 -2.363 1
1 359 . 18 1 1 A 76 76 PHE CB C 76 38.139 39.093 -0.954 1
1 360 . 18 1 1 A 76 76 PHE N N 76 122.873 122.246 0.627 1
1 361 . 18 1 1 A 77 77 LEU H H 77 7.829 8.197 -0.368 1
1 362 . 18 1 1 A 77 77 LEU CA C 77 57.450 57.694 -0.244 1
1 363 . 18 1 1 A 77 77 LEU CB C 77 40.560 41.357 -0.797 1
1 364 . 18 1 1 A 77 77 LEU N N 77 117.405 118.549 -1.144 1
1 365 . 18 1 1 A 78 78 GLY H H 78 8.093 8.237 -0.144 1
1 366 . 18 1 1 A 78 78 GLY HA2 H 78 3.661 3.682 -0.021 1
1 367 . 18 1 1 A 78 78 GLY HA3 H 78 3.594 3.688 -0.094 1
1 368 . 18 1 1 A 78 78 GLY CA C 78 47.442 47.075 0.367 1
1 369 . 18 1 1 A 78 78 GLY N N 78 105.528 106.255 -0.727 1
1 370 . 18 1 1 A 79 79 ALA H H 79 7.759 7.441 0.318 1
1 371 . 18 1 1 A 79 79 ALA CA C 79 55.153 54.569 0.584 1
1 372 . 18 1 1 A 79 79 ALA CB C 79 17.768 18.570 -0.802 1
1 373 . 18 1 1 A 79 79 ALA N N 79 124.488 125.019 -0.531 1
1 374 . 18 1 1 A 80 80 LEU H H 80 7.963 7.952 0.011 1
1 375 . 18 1 1 A 80 80 LEU CA C 80 57.464 57.346 0.118 1
1 376 . 18 1 1 A 80 80 LEU CB C 80 41.496 40.839 0.657 1
1 377 . 18 1 1 A 80 80 LEU N N 80 117.869 119.578 -1.709 1
1 378 . 18 1 1 A 81 81 ALA H H 81 8.365 8.110 0.255 1
1 379 . 18 1 1 A 81 81 ALA CA C 81 55.475 54.666 0.809 1
1 380 . 18 1 1 A 81 81 ALA CB C 81 17.483 18.108 -0.625 1
1 381 . 18 1 1 A 81 81 ALA N N 81 119.054 119.712 -0.658 1
1 382 . 18 1 1 A 82 82 MET H H 82 8.112 7.615 0.497 1
1 383 . 18 1 1 A 82 82 MET CA C 82 59.516 57.901 1.615 1
1 384 . 18 1 1 A 82 82 MET CB C 82 32.550 32.193 0.357 1
1 385 . 18 1 1 A 82 82 MET N N 82 115.364 117.429 -2.065 1
1 386 . 18 1 1 A 83 83 ILE H H 83 7.981 7.882 0.099 1
1 387 . 18 1 1 A 83 83 ILE HA H 83 3.839 3.598 0.241 1
1 391 . 18 1 1 A 83 83 ILE CA C 83 64.467 65.121 -0.654 1
1 392 . 18 1 1 A 83 83 ILE CB C 83 37.312 37.517 -0.205 1
1 393 . 18 1 1 A 83 83 ILE N N 83 120.887 119.400 1.487 1
1 394 . 18 1 1 A 84 84 TYR H H 84 8.731 7.530 1.201 1
1 395 . 18 1 1 A 84 84 TYR N N 84 120.933 119.167 1.766 1
1 396 . 18 1 1 A 87 87 ALA H H 87 7.829 7.930 -0.101 1
1 397 . 18 1 1 A 87 87 ALA CA C 87 53.768 54.271 -0.503 1
1 398 . 18 1 1 A 87 87 ALA CB C 87 18.504 18.388 0.116 1
1 399 . 18 1 1 A 87 87 ALA N N 87 120.274 120.919 -0.645 1
1 400 . 18 1 1 A 88 88 LEU H H 88 7.499 7.708 -0.209 1
1 401 . 18 1 1 A 88 88 LEU CA C 88 55.605 53.787 1.818 1
1 402 . 18 1 1 A 88 88 LEU CB C 88 42.047 42.073 -0.026 1
1 403 . 18 1 1 A 88 88 LEU N N 88 117.356 112.646 4.710 1
1 404 . 18 1 1 A 89 89 LYS H H 89 7.561 7.567 -0.006 1
1 405 . 18 1 1 A 89 89 LYS CA C 89 56.865 56.529 0.336 1
1 406 . 18 1 1 A 89 89 LYS CB C 89 32.592 32.873 -0.281 1
1 407 . 18 1 1 A 89 89 LYS N N 89 119.289 119.463 -0.174 1
1 416 . 18 3 2 C 6 6 GLU H H 190 8.385 8.125 0.260 1
1 417 . 18 3 2 C 6 6 GLU HA H 190 4.153 4.366 -0.213 1
1 422 . 18 3 2 C 6 6 GLU C C 190 175.031 177.159 -2.128 1
1 423 . 18 3 2 C 6 6 GLU CA C 190 58.866 57.167 1.699 1
1 424 . 18 3 2 C 6 6 GLU CB C 190 30.751 30.037 0.714 1
1 426 . 18 3 2 C 6 6 GLU N N 190 122.715 120.513 2.202 1
1 427 . 18 3 2 C 7 7 GLY H H 191 8.475 8.035 0.440 1
1 428 . 18 3 2 C 7 7 GLY HA2 H 191 3.887 3.980 -0.093 1
1 429 . 18 3 2 C 7 7 GLY HA3 H 191 3.887 3.981 -0.094 1
1 430 . 18 3 2 C 7 7 GLY C C 191 177.922 175.214 2.708 1
1 431 . 18 3 2 C 7 7 GLY CA C 191 46.884 45.510 1.374 1
1 432 . 18 3 2 C 7 7 GLY N N 191 109.009 108.456 0.553 1
1 433 . 18 3 2 C 8 8 LEU HA H 192 4.095 3.909 0.186 1
1 443 . 18 3 2 C 8 8 LEU CA C 192 58.154 58.118 0.036 1
1 444 . 18 3 2 C 8 8 LEU CB C 192 42.789 41.744 1.045 1
1 448 . 18 3 2 C 9 9 MET H H 193 8.250 8.222 0.028 1
1 449 . 18 3 2 C 9 9 MET HA H 193 4.150 4.098 0.052 1
1 457 . 18 3 2 C 9 9 MET C C 193 178.421 178.415 0.006 1
1 458 . 18 3 2 C 9 9 MET CA C 193 58.818 58.725 0.093 1
1 459 . 18 3 2 C 9 9 MET CB C 193 32.360 31.668 0.692 1
1 462 . 18 3 2 C 9 9 MET N N 193 117.049 118.739 -1.690 1
1 463 . 18 3 2 C 10 10 ASN H H 194 7.892 8.262 -0.370 1
1 464 . 18 3 2 C 10 10 ASN HA H 194 4.468 4.483 -0.015 1
1 469 . 18 3 2 C 10 10 ASN C C 194 178.099 176.524 1.575 1
1 470 . 18 3 2 C 10 10 ASN CA C 194 56.644 55.599 1.045 1
1 471 . 18 3 2 C 10 10 ASN CB C 194 39.100 38.866 0.234 1
1 472 . 18 3 2 C 10 10 ASN N N 194 117.034 118.860 -1.826 1
1 474 . 18 3 2 C 11 11 VAL H H 195 7.651 7.957 -0.306 1
1 475 . 18 3 2 C 11 11 VAL HA H 195 3.735 3.866 -0.131 1
1 483 . 18 3 2 C 11 11 VAL C C 195 177.657 178.169 -0.512 1
1 484 . 18 3 2 C 11 11 VAL CA C 195 66.710 65.052 1.658 1
1 485 . 18 3 2 C 11 11 VAL CB C 195 32.468 32.106 0.362 1
1 488 . 18 3 2 C 11 11 VAL N N 195 119.878 117.979 1.899 1
1 489 . 18 3 2 C 12 12 LEU H H 196 8.030 8.157 -0.127 1
1 490 . 18 3 2 C 12 12 LEU HA H 196 4.013 3.976 0.037 1
1 500 . 18 3 2 C 12 12 LEU C C 196 177.540 179.738 -2.198 1
1 501 . 18 3 2 C 12 12 LEU CA C 196 58.489 57.854 0.635 1
1 502 . 18 3 2 C 12 12 LEU CB C 196 42.457 41.242 1.215 1
1 506 . 18 3 2 C 12 12 LEU N N 196 119.499 120.388 -0.889 1
1 507 . 18 3 2 C 13 13 LYS H H 197 8.015 8.621 -0.606 1
1 508 . 18 3 2 C 13 13 LYS HA H 197 3.949 4.129 -0.180 1
1 517 . 18 3 2 C 13 13 LYS C C 197 178.419 177.894 0.525 1
1 518 . 18 3 2 C 13 13 LYS CA C 197 60.191 58.619 1.572 1
1 519 . 18 3 2 C 13 13 LYS CB C 197 33.075 31.408 1.667 1
1 523 . 18 3 2 C 13 13 LYS N N 197 117.888 118.476 -0.588 1
1 524 . 18 3 2 C 14 14 LYS H H 198 7.506 7.617 -0.111 1
1 525 . 18 3 2 C 14 14 LYS HA H 198 4.127 4.169 -0.042 1
1 534 . 18 3 2 C 14 14 LYS C C 198 178.262 179.198 -0.936 1
1 535 . 18 3 2 C 14 14 LYS CA C 198 59.161 58.410 0.751 1
1 536 . 18 3 2 C 14 14 LYS CB C 198 32.956 32.011 0.945 1
1 540 . 18 3 2 C 14 14 LYS N N 198 118.321 118.212 0.109 1
1 541 . 18 3 2 C 15 15 ILE H H 199 7.780 8.015 -0.235 1
1 542 . 18 3 2 C 15 15 ILE HA H 199 3.787 3.912 -0.125 1
1 552 . 18 3 2 C 15 15 ILE C C 199 178.647 177.986 0.661 1
1 553 . 18 3 2 C 15 15 ILE CA C 199 64.912 63.227 1.685 1
1 554 . 18 3 2 C 15 15 ILE CB C 199 38.780 36.333 2.447 1
1 558 . 18 3 2 C 15 15 ILE N N 199 118.644 120.771 -2.127 1
1 559 . 18 3 2 C 16 16 TYR H H 200 7.918 8.412 -0.494 1
1 560 . 18 3 2 C 16 16 TYR HA H 200 4.252 4.032 0.220 1
1 567 . 18 3 2 C 16 16 TYR C C 200 177.806 177.382 0.424 1
1 568 . 18 3 2 C 16 16 TYR CA C 200 61.171 61.739 -0.568 1
1 569 . 18 3 2 C 16 16 TYR CB C 200 39.245 39.109 0.136 1
1 573 . 18 3 2 C 16 16 TYR N N 200 118.683 122.862 -4.179 1
1 574 . 18 3 2 C 17 17 GLU H H 201 8.089 8.448 -0.359 1
1 575 . 18 3 2 C 17 17 GLU HA H 201 4.124 4.346 -0.222 1
1 580 . 18 3 2 C 17 17 GLU C C 201 177.414 178.645 -1.231 1
1 581 . 18 3 2 C 17 17 GLU CA C 201 58.784 58.437 0.347 1
1 582 . 18 3 2 C 17 17 GLU CB C 201 30.747 29.211 1.536 1
1 584 . 18 3 2 C 17 17 GLU N N 201 119.409 118.509 0.900 1
1 585 . 18 3 2 C 18 18 ASP H H 202 8.023 7.610 0.413 1
1 586 . 18 3 2 C 18 18 ASP HA H 202 4.657 4.592 0.065 1
1 589 . 18 3 2 C 18 18 ASP C C 202 177.346 176.281 1.065 1
1 590 . 18 3 2 C 18 18 ASP CA C 202 55.496 54.666 0.830 1
1 591 . 18 3 2 C 18 18 ASP CB C 202 42.023 41.353 0.670 1
1 592 . 18 3 2 C 18 18 ASP N N 202 119.459 118.627 0.832 1
1 593 . 18 3 2 C 19 19 GLY H H 203 7.933 7.534 0.399 1
1 594 . 18 3 2 C 19 19 GLY HA2 H 203 3.938 3.791 0.147 1
1 595 . 18 3 2 C 19 19 GLY HA3 H 203 3.938 3.864 0.074 1
1 596 . 18 3 2 C 19 19 GLY C C 203 177.240 174.385 2.855 1
1 597 . 18 3 2 C 19 19 GLY CA C 203 46.309 46.450 -0.141 1
1 598 . 18 3 2 C 19 19 GLY N N 203 108.518 107.913 0.605 1
1 599 . 18 3 2 C 20 20 ASP H H 204 8.091 8.107 -0.016 1
1 600 . 18 3 2 C 20 20 ASP HA H 204 4.616 4.566 0.050 1
1 603 . 18 3 2 C 20 20 ASP C C 204 173.979 177.345 -3.366 1
1 604 . 18 3 2 C 20 20 ASP CA C 204 55.064 54.658 0.406 1
1 605 . 18 3 2 C 20 20 ASP CB C 204 42.203 41.765 0.438 1
1 606 . 18 3 2 C 20 20 ASP N N 204 120.172 120.416 -0.244 1
1 607 . 18 3 2 C 21 21 ASP H H 205 8.352 9.360 -1.008 1
1 608 . 18 3 2 C 21 21 ASP HA H 205 4.468 4.389 0.079 1
1 611 . 18 3 2 C 21 21 ASP C C 205 176.432 177.340 -0.908 1
1 612 . 18 3 2 C 21 21 ASP CA C 205 56.663 56.319 0.344 1
1 613 . 18 3 2 C 21 21 ASP CB C 205 41.918 40.799 1.119 1
1 614 . 18 3 2 C 21 21 ASP N N 205 121.515 127.564 -6.049 1
1 615 . 18 3 2 C 22 22 ASP H H 206 8.239 8.017 0.222 1
1 616 . 18 3 2 C 22 22 ASP HA H 206 4.455 4.502 -0.047 1
1 619 . 18 3 2 C 22 22 ASP C C 206 177.449 178.441 -0.992 1
1 620 . 18 3 2 C 22 22 ASP CA C 206 57.165 56.498 0.667 1
1 621 . 18 3 2 C 22 22 ASP CB C 206 41.820 40.546 1.274 1
1 622 . 18 3 2 C 22 22 ASP N N 206 120.156 118.477 1.679 1
1 623 . 18 3 2 C 23 23 MET H H 207 8.300 7.854 0.446 1
1 624 . 18 3 2 C 23 23 MET HA H 207 4.255 4.084 0.171 1
1 632 . 18 3 2 C 23 23 MET C C 207 178.412 178.098 0.314 1
1 633 . 18 3 2 C 23 23 MET CA C 207 58.065 58.581 -0.516 1
1 634 . 18 3 2 C 23 23 MET CB C 207 32.488 32.025 0.463 1
1 637 . 18 3 2 C 23 23 MET N N 207 120.707 119.606 1.101 1
1 638 . 18 3 2 C 24 24 LYS H H 208 8.047 8.054 -0.007 1
1 639 . 18 3 2 C 24 24 LYS HA H 208 3.946 3.957 -0.011 1
1 648 . 18 3 2 C 24 24 LYS C C 208 178.008 179.672 -1.664 1
1 649 . 18 3 2 C 24 24 LYS CA C 208 59.847 60.006 -0.159 1
1 650 . 18 3 2 C 24 24 LYS CB C 208 32.983 32.111 0.872 1
1 654 . 18 3 2 C 24 24 LYS N N 208 119.504 118.748 0.756 1
1 655 . 18 3 2 C 25 25 ARG H H 209 7.891 7.794 0.097 1
1 656 . 18 3 2 C 25 25 ARG HA H 209 4.168 4.080 0.088 1
1 663 . 18 3 2 C 25 25 ARG C C 209 178.100 178.541 -0.441 1
1 664 . 18 3 2 C 25 25 ARG CA C 209 58.810 59.403 -0.593 1
1 665 . 18 3 2 C 25 25 ARG CB C 209 31.080 30.500 0.580 1
1 668 . 18 3 2 C 25 25 ARG N N 209 118.378 119.574 -1.196 1
1 669 . 18 3 2 C 26 26 THR H H 210 7.869 8.413 -0.544 1
1 670 . 18 3 2 C 26 26 THR HA H 210 4.023 4.006 0.017 1
1 675 . 18 3 2 C 26 26 THR C C 210 177.984 176.357 1.627 1
1 676 . 18 3 2 C 26 26 THR CA C 210 65.747 67.082 -1.335 1
1 677 . 18 3 2 C 26 26 THR CB C 210 69.683 67.887 1.796 1
1 679 . 18 3 2 C 26 26 THR N N 210 115.443 118.859 -3.416 1
1 680 . 18 3 2 C 27 27 ILE H H 211 7.901 8.161 -0.260 1
1 681 . 18 3 2 C 27 27 ILE HA H 211 4.142 3.837 0.305 1
1 691 . 18 3 2 C 27 27 ILE C C 211 175.595 178.990 -3.395 1
1 692 . 18 3 2 C 27 27 ILE CA C 211 63.528 65.056 -1.528 1
1 693 . 18 3 2 C 27 27 ILE CB C 211 38.982 37.576 1.406 1
1 697 . 18 3 2 C 27 27 ILE N N 211 121.265 121.245 0.020 1
1 698 . 18 3 2 C 28 28 ASN HA H 212 4.465 4.442 0.023 1
1 703 . 18 3 2 C 28 28 ASN CA C 212 55.182 56.458 -1.276 1
1 704 . 18 3 2 C 28 28 ASN CB C 212 39.480 38.923 0.557 1
1 706 . 18 3 2 C 29 29 LYS H H 213 7.968 7.897 0.071 1
1 707 . 18 3 2 C 29 29 LYS HA H 213 4.072 4.113 -0.041 1
1 716 . 18 3 2 C 29 29 LYS C C 213 176.218 178.966 -2.748 1
1 717 . 18 3 2 C 29 29 LYS CA C 213 58.489 59.149 -0.660 1
1 718 . 18 3 2 C 29 29 LYS CB C 213 33.165 31.848 1.317 1
1 722 . 18 3 2 C 29 29 LYS N N 213 120.820 118.172 2.648 1
1 723 . 18 3 2 C 30 30 ALA H H 214 7.865 8.365 -0.500 1
1 724 . 18 3 2 C 30 30 ALA HA H 214 4.217 4.294 -0.077 1
1 728 . 18 3 2 C 30 30 ALA C C 214 177.041 179.812 -2.771 1
1 729 . 18 3 2 C 30 30 ALA CA C 214 54.104 54.945 -0.841 1
1 730 . 18 3 2 C 30 30 ALA CB C 214 19.496 18.165 1.331 1
1 731 . 18 3 2 C 30 30 ALA N N 214 121.571 121.581 -0.010 1
1 732 . 18 3 2 C 31 31 TRP H H 215 7.831 7.997 -0.166 1
1 733 . 18 3 2 C 31 31 TRP HA H 215 4.598 4.273 0.325 1
1 742 . 18 3 2 C 31 31 TRP C C 215 178.088 177.968 0.120 1
1 743 . 18 3 2 C 31 31 TRP CA C 215 58.432 61.519 -3.087 1
1 744 . 18 3 2 C 31 31 TRP CB C 215 30.472 29.740 0.732 1
1 750 . 18 3 2 C 31 31 TRP N N 215 118.141 120.575 -2.434 1
1 752 . 18 3 2 C 32 32 VAL H H 216 7.594 7.935 -0.341 1
1 753 . 18 3 2 C 32 32 VAL HA H 216 3.978 3.942 0.036 1
1 761 . 18 3 2 C 32 32 VAL C C 216 176.574 178.209 -1.635 1
1 762 . 18 3 2 C 32 32 VAL CA C 216 63.329 65.795 -2.466 1
1 763 . 18 3 2 C 32 32 VAL CB C 216 33.373 31.925 1.448 1
1 766 . 18 3 2 C 32 32 VAL N N 216 118.287 119.401 -1.114 1
1 767 . 18 3 2 C 33 33 GLU H H 217 8.012 8.778 -0.766 1
1 768 . 18 3 2 C 33 33 GLU HA H 217 4.257 4.238 0.019 1
1 773 . 18 3 2 C 33 33 GLU C C 217 176.164 176.678 -0.514 1
1 774 . 18 3 2 C 33 33 GLU CA C 217 57.409 57.973 -0.564 1
1 775 . 18 3 2 C 33 33 GLU CB C 217 30.978 28.471 2.507 1
1 777 . 18 3 2 C 33 33 GLU N N 217 122.535 119.641 2.894 1
1 778 . 18 3 2 C 34 34 SER H H 218 8.037 7.897 0.140 1
1 779 . 18 3 2 C 34 34 SER HA H 218 4.514 4.431 0.083 1
1 782 . 18 3 2 C 34 34 SER C C 218 176.451 173.981 2.470 1
1 783 . 18 3 2 C 34 34 SER CA C 218 58.987 56.958 2.029 1
1 784 . 18 3 2 C 34 34 SER CB C 218 64.569 61.272 3.297 1
1 785 . 18 3 2 C 34 34 SER N N 218 117.058 116.624 0.434 1
1 6 . 19 1 1 A 2 2 ALA H H 2 8.191 7.786 0.405 1
1 7 . 19 1 1 A 2 2 ALA CA C 2 51.957 55.055 -3.098 1
1 8 . 19 1 1 A 2 2 ALA CB C 2 19.580 17.098 2.482 1
1 9 . 19 1 1 A 2 2 ALA N N 2 124.666 120.185 4.481 1
1 10 . 19 1 1 A 3 3 SER H H 3 8.829 8.600 0.229 1
1 11 . 19 1 1 A 3 3 SER CA C 3 57.221 62.094 -4.873 1
1 12 . 19 1 1 A 3 3 SER N N 3 119.917 113.811 6.106 1
1 13 . 19 1 1 A 4 4 PRO CA C 4 66.688 65.884 0.804 1
1 14 . 19 1 1 A 4 4 PRO CB C 4 32.553 30.682 1.871 1
1 15 . 19 1 1 A 5 5 LEU H H 5 9.146 7.554 1.592 1
1 16 . 19 1 1 A 5 5 LEU CA C 5 59.017 57.061 1.956 1
1 17 . 19 1 1 A 5 5 LEU CB C 5 42.341 42.206 0.135 1
1 18 . 19 1 1 A 5 5 LEU N N 5 117.902 116.689 1.213 1
1 19 . 19 1 1 A 6 6 ASP H H 6 7.572 8.500 -0.928 1
1 20 . 19 1 1 A 6 6 ASP CA C 6 57.997 57.959 0.038 1
1 21 . 19 1 1 A 6 6 ASP CB C 6 40.910 42.020 -1.110 1
1 22 . 19 1 1 A 6 6 ASP N N 6 118.259 119.360 -1.101 1
1 23 . 19 1 1 A 7 7 GLN H H 7 8.660 8.209 0.451 1
1 24 . 19 1 1 A 7 7 GLN HA H 7 4.064 4.220 -0.156 1
1 29 . 19 1 1 A 7 7 GLN CA C 7 59.270 57.361 1.909 1
1 30 . 19 1 1 A 7 7 GLN CB C 7 28.468 27.169 1.299 1
1 31 . 19 1 1 A 7 7 GLN N N 7 119.558 116.953 2.605 1
1 32 . 19 1 1 A 8 8 ALA H H 8 8.253 7.816 0.437 1
1 33 . 19 1 1 A 8 8 ALA CA C 8 55.519 54.862 0.657 1
1 34 . 19 1 1 A 8 8 ALA CB C 8 18.113 19.017 -0.904 1
1 35 . 19 1 1 A 8 8 ALA N N 8 123.628 122.667 0.961 1
1 36 . 19 1 1 A 9 9 ILE H H 9 8.134 8.194 -0.060 1
1 37 . 19 1 1 A 9 9 ILE CA C 9 65.261 64.478 0.783 1
1 38 . 19 1 1 A 9 9 ILE CB C 9 37.023 37.403 -0.380 1
1 39 . 19 1 1 A 9 9 ILE N N 9 117.056 117.018 0.038 1
1 40 . 19 1 1 A 10 10 GLY H H 10 8.515 8.549 -0.034 1
1 41 . 19 1 1 A 10 10 GLY HA3 H 10 3.773 3.785 -0.012 1
1 42 . 19 1 1 A 10 10 GLY CA C 10 47.637 46.754 0.883 1
1 43 . 19 1 1 A 10 10 GLY N N 10 106.202 110.761 -4.559 1
1 44 . 19 1 1 A 11 11 LEU H H 11 8.212 8.037 0.175 1
1 45 . 19 1 1 A 11 11 LEU CA C 11 58.354 57.883 0.471 1
1 46 . 19 1 1 A 11 11 LEU CB C 11 41.683 42.091 -0.408 1
1 47 . 19 1 1 A 11 11 LEU N N 11 124.624 123.449 1.175 1
1 48 . 19 1 1 A 12 12 LEU H H 12 7.971 7.814 0.157 1
1 49 . 19 1 1 A 12 12 LEU HA H 12 4.144 4.171 -0.027 1
1 59 . 19 1 1 A 12 12 LEU CA C 12 58.691 58.302 0.389 1
1 60 . 19 1 1 A 12 12 LEU CB C 12 40.657 41.635 -0.978 1
1 61 . 19 1 1 A 12 12 LEU N N 12 118.095 118.584 -0.489 1
1 62 . 19 1 1 A 13 13 ILE H H 13 8.379 8.085 0.294 1
1 63 . 19 1 1 A 13 13 ILE CA C 13 66.405 65.049 1.356 1
1 64 . 19 1 1 A 13 13 ILE CB C 13 38.916 37.731 1.185 1
1 65 . 19 1 1 A 13 13 ILE N N 13 121.161 120.170 0.991 1
1 66 . 19 1 1 A 14 14 GLY H H 14 8.823 8.112 0.711 1
1 67 . 19 1 1 A 14 14 GLY HA2 H 14 4.147 3.718 0.429 1
1 68 . 19 1 1 A 14 14 GLY HA3 H 14 3.982 3.731 0.251 1
1 69 . 19 1 1 A 14 14 GLY CA C 14 47.750 47.410 0.340 1
1 70 . 19 1 1 A 14 14 GLY N N 14 108.982 107.670 1.312 1
1 71 . 19 1 1 A 15 15 ILE H H 15 8.681 8.451 0.230 1
1 72 . 19 1 1 A 15 15 ILE CA C 15 64.996 64.593 0.403 1
1 73 . 19 1 1 A 15 15 ILE CB C 15 37.107 37.780 -0.673 1
1 74 . 19 1 1 A 15 15 ILE N N 15 121.601 122.827 -1.226 1
1 75 . 19 1 1 A 16 16 PHE H H 16 7.103 8.633 -1.530 1
1 76 . 19 1 1 A 16 16 PHE CA C 16 62.910 61.456 1.454 1
1 77 . 19 1 1 A 16 16 PHE CB C 16 38.782 39.235 -0.453 1
1 78 . 19 1 1 A 16 16 PHE N N 16 118.660 120.855 -2.195 1
1 79 . 19 1 1 A 17 17 HIS H H 17 7.591 8.581 -0.990 1
1 80 . 19 1 1 A 17 17 HIS HA H 17 4.793 4.320 0.473 1
1 82 . 19 1 1 A 17 17 HIS CA C 17 58.125 58.895 -0.770 1
1 83 . 19 1 1 A 17 17 HIS CB C 17 29.584 29.547 0.037 1
1 84 . 19 1 1 A 17 17 HIS N N 17 114.968 118.446 -3.478 1
1 85 . 19 1 1 A 18 18 LYS H H 18 8.144 8.072 0.072 1
1 86 . 19 1 1 A 18 18 LYS CA C 18 58.975 58.971 0.004 1
1 87 . 19 1 1 A 18 18 LYS CB C 18 32.379 32.087 0.292 1
1 88 . 19 1 1 A 18 18 LYS N N 18 122.373 118.732 3.641 1
1 89 . 19 1 1 A 19 19 TYR H H 19 6.999 7.479 -0.480 1
1 90 . 19 1 1 A 19 19 TYR CA C 19 60.318 60.544 -0.226 1
1 91 . 19 1 1 A 19 19 TYR CB C 19 40.355 38.462 1.893 1
1 92 . 19 1 1 A 19 19 TYR N N 19 113.614 118.414 -4.800 1
1 93 . 19 1 1 A 20 20 SER H H 20 8.432 7.577 0.855 1
1 94 . 19 1 1 A 20 20 SER CA C 20 61.897 62.388 -0.491 1
1 95 . 19 1 1 A 20 20 SER CB C 20 61.354 62.017 -0.663 1
1 96 . 19 1 1 A 20 20 SER N N 20 113.201 116.630 -3.429 1
1 97 . 19 1 1 A 21 21 GLY H H 21 7.678 8.145 -0.467 1
1 98 . 19 1 1 A 21 21 GLY HA2 H 21 4.195 3.702 0.493 1
1 99 . 19 1 1 A 21 21 GLY HA3 H 21 3.900 3.736 0.164 1
1 100 . 19 1 1 A 21 21 GLY CA C 21 45.628 46.323 -0.695 1
1 101 . 19 1 1 A 21 21 GLY N N 21 110.734 108.571 2.163 1
1 102 . 19 1 1 A 22 22 LYS H H 22 7.362 7.612 -0.250 1
1 103 . 19 1 1 A 22 22 LYS CA C 22 60.163 58.898 1.265 1
1 104 . 19 1 1 A 22 22 LYS CB C 22 32.554 32.300 0.254 1
1 105 . 19 1 1 A 22 22 LYS N N 22 122.161 120.477 1.684 1
1 106 . 19 1 1 A 23 23 GLU H H 23 9.639 7.528 2.111 1
1 107 . 19 1 1 A 23 23 GLU CA C 23 54.449 56.165 -1.716 1
1 108 . 19 1 1 A 23 23 GLU N N 23 116.288 115.524 0.764 1
1 109 . 19 1 1 A 24 24 GLY HA2 H 24 3.912 3.874 0.038 1
1 110 . 19 1 1 A 24 24 GLY HA3 H 24 3.787 3.889 -0.102 1
1 111 . 19 1 1 A 24 24 GLY CA C 24 45.898 45.469 0.429 1
1 112 . 19 1 1 A 25 25 ASP H H 25 8.204 7.951 0.253 1
1 113 . 19 1 1 A 25 25 ASP CA C 25 55.252 54.022 1.230 1
1 114 . 19 1 1 A 25 25 ASP N N 25 125.671 120.893 4.778 1
1 115 . 19 1 1 A 26 26 LYS CA C 26 57.851 55.520 2.331 1
1 116 . 19 1 1 A 26 26 LYS CB C 26 31.265 33.348 -2.083 1
1 117 . 19 1 1 A 27 27 HIS H H 27 9.763 8.075 1.688 1
1 118 . 19 1 1 A 27 27 HIS CA C 27 55.580 56.443 -0.863 1
1 119 . 19 1 1 A 27 27 HIS CB C 27 30.936 29.699 1.237 1
1 120 . 19 1 1 A 27 27 HIS N N 27 118.108 119.750 -1.642 1
1 121 . 19 1 1 A 28 28 THR H H 28 7.325 7.953 -0.628 1
1 126 . 19 1 1 A 28 28 THR CA C 28 60.128 60.639 -0.511 1
1 127 . 19 1 1 A 28 28 THR CB C 28 72.268 72.807 -0.539 1
1 128 . 19 1 1 A 28 28 THR N N 28 106.920 110.044 -3.124 1
1 129 . 19 1 1 A 29 29 LEU H H 29 9.422 8.897 0.525 1
1 130 . 19 1 1 A 29 29 LEU HA H 29 5.368 4.819 0.549 1
1 140 . 19 1 1 A 29 29 LEU CA C 29 52.567 53.855 -1.288 1
1 141 . 19 1 1 A 29 29 LEU CB C 29 43.523 44.700 -1.177 1
1 142 . 19 1 1 A 29 29 LEU N N 29 125.021 119.086 5.935 1
1 143 . 19 1 1 A 30 30 SER H H 30 10.485 8.688 1.797 1
1 144 . 19 1 1 A 30 30 SER CA C 30 56.653 57.217 -0.564 1
1 145 . 19 1 1 A 30 30 SER CB C 30 65.313 65.064 0.249 1
1 146 . 19 1 1 A 30 30 SER N N 30 124.758 115.650 9.108 1
1 147 . 19 1 1 A 31 31 LYS H H 31 8.728 8.887 -0.159 1
1 148 . 19 1 1 A 31 31 LYS CA C 31 59.669 58.898 0.771 1
1 149 . 19 1 1 A 31 31 LYS CB C 31 31.763 31.982 -0.219 1
1 150 . 19 1 1 A 31 31 LYS N N 31 119.459 119.979 -0.520 1
1 151 . 19 1 1 A 32 32 LYS H H 32 7.857 8.012 -0.155 1
1 152 . 19 1 1 A 32 32 LYS CA C 32 59.721 59.603 0.118 1
1 153 . 19 1 1 A 32 32 LYS CB C 32 32.901 32.183 0.718 1
1 154 . 19 1 1 A 32 32 LYS N N 32 117.933 119.884 -1.951 1
1 155 . 19 1 1 A 33 33 GLU H H 33 7.559 7.874 -0.315 1
1 156 . 19 1 1 A 33 33 GLU CA C 33 59.169 58.992 0.177 1
1 157 . 19 1 1 A 33 33 GLU CB C 33 31.014 29.381 1.633 1
1 158 . 19 1 1 A 33 33 GLU N N 33 120.407 119.214 1.193 1
1 159 . 19 1 1 A 34 34 LEU H H 34 8.833 8.355 0.478 1
1 160 . 19 1 1 A 34 34 LEU CA C 34 56.928 57.979 -1.051 1
1 161 . 19 1 1 A 34 34 LEU CB C 34 41.435 41.788 -0.353 1
1 162 . 19 1 1 A 34 34 LEU N N 34 117.677 121.204 -3.527 1
1 163 . 19 1 1 A 35 35 LYS H H 35 8.010 7.853 0.157 1
1 164 . 19 1 1 A 35 35 LYS CA C 35 60.692 59.065 1.627 1
1 165 . 19 1 1 A 35 35 LYS CB C 35 32.223 31.912 0.311 1
1 166 . 19 1 1 A 35 35 LYS N N 35 119.829 118.599 1.230 1
1 167 . 19 1 1 A 36 36 GLU H H 36 7.169 7.932 -0.763 1
1 168 . 19 1 1 A 36 36 GLU CA C 36 59.588 58.993 0.595 1
1 169 . 19 1 1 A 36 36 GLU CB C 36 29.342 29.551 -0.209 1
1 170 . 19 1 1 A 36 36 GLU N N 36 117.340 119.007 -1.667 1
1 171 . 19 1 1 A 37 37 LEU H H 37 7.478 7.942 -0.464 1
1 172 . 19 1 1 A 37 37 LEU CA C 37 59.674 57.642 2.032 1
1 173 . 19 1 1 A 37 37 LEU CB C 37 42.142 40.874 1.268 1
1 174 . 19 1 1 A 37 37 LEU N N 37 120.884 120.113 0.771 1
1 175 . 19 1 1 A 38 38 ILE H H 38 8.377 7.939 0.438 1
1 176 . 19 1 1 A 38 38 ILE CA C 38 65.651 65.340 0.311 1
1 177 . 19 1 1 A 38 38 ILE N N 38 118.450 119.990 -1.540 1
1 178 . 19 1 1 A 39 39 GLN H H 39 8.217 8.005 0.212 1
1 179 . 19 1 1 A 39 39 GLN CA C 39 59.788 58.339 1.449 1
1 180 . 19 1 1 A 39 39 GLN CB C 39 29.278 28.215 1.063 1
1 181 . 19 1 1 A 39 39 GLN N N 39 113.091 117.797 -4.706 1
1 182 . 19 1 1 A 40 40 LYS H H 40 8.426 7.826 0.600 1
1 183 . 19 1 1 A 40 40 LYS CA C 40 57.807 58.501 -0.694 1
1 184 . 19 1 1 A 40 40 LYS CB C 40 33.942 33.203 0.739 1
1 185 . 19 1 1 A 40 40 LYS N N 40 114.771 119.672 -4.901 1
1 186 . 19 1 1 A 41 41 GLU H H 41 8.496 8.427 0.069 1
1 187 . 19 1 1 A 41 41 GLU CA C 41 55.395 58.646 -3.251 1
1 188 . 19 1 1 A 41 41 GLU CB C 41 29.260 30.515 -1.255 1
1 189 . 19 1 1 A 41 41 GLU N N 41 112.546 118.569 -6.023 1
1 190 . 19 1 1 A 42 42 LEU H H 42 7.267 7.762 -0.495 1
1 191 . 19 1 1 A 42 42 LEU CA C 42 53.776 54.090 -0.314 1
1 192 . 19 1 1 A 42 42 LEU N N 42 118.657 120.098 -1.441 1
1 193 . 19 1 1 A 44 44 ILE CA C 44 62.210 61.486 0.724 1
1 194 . 19 1 1 A 44 44 ILE CB C 44 38.247 38.191 0.056 1
1 195 . 19 1 1 A 45 45 GLY H H 45 7.820 8.011 -0.191 1
1 196 . 19 1 1 A 45 45 GLY CA C 45 47.742 45.650 2.092 1
1 197 . 19 1 1 A 45 45 GLY N N 45 108.178 112.146 -3.968 1
1 198 . 19 1 1 A 46 46 SER H H 46 7.895 7.929 -0.034 1
1 199 . 19 1 1 A 46 46 SER CA C 46 59.958 57.853 2.105 1
1 200 . 19 1 1 A 46 46 SER CB C 46 63.450 63.619 -0.169 1
1 201 . 19 1 1 A 46 46 SER N N 46 113.038 116.640 -3.602 1
1 202 . 19 1 1 A 47 47 LYS H H 47 7.736 9.096 -1.360 1
1 203 . 19 1 1 A 47 47 LYS CA C 47 55.636 58.238 -2.602 1
1 204 . 19 1 1 A 47 47 LYS CB C 47 33.103 32.141 0.962 1
1 205 . 19 1 1 A 47 47 LYS N N 47 119.422 129.118 -9.696 1
1 206 . 19 1 1 A 48 48 LEU H H 48 6.988 7.481 -0.493 1
1 207 . 19 1 1 A 48 48 LEU HA H 48 4.497 4.099 0.398 1
1 217 . 19 1 1 A 48 48 LEU CA C 48 54.517 57.136 -2.619 1
1 218 . 19 1 1 A 48 48 LEU CB C 48 42.987 41.212 1.775 1
1 219 . 19 1 1 A 48 48 LEU N N 48 118.908 117.738 1.170 1
1 220 . 19 1 1 A 49 49 GLN H H 49 9.206 8.147 1.059 1
1 221 . 19 1 1 A 49 49 GLN HA H 49 4.486 4.277 0.209 1
1 223 . 19 1 1 A 49 49 GLN CA C 49 54.785 58.000 -3.215 1
1 224 . 19 1 1 A 49 49 GLN CB C 49 29.636 28.526 1.110 1
1 225 . 19 1 1 A 49 49 GLN N N 49 121.275 119.242 2.033 1
1 226 . 19 1 1 A 50 50 ASP H H 50 8.854 8.179 0.675 1
1 227 . 19 1 1 A 50 50 ASP CA C 50 59.078 57.860 1.218 1
1 228 . 19 1 1 A 50 50 ASP CB C 50 40.632 42.275 -1.643 1
1 229 . 19 1 1 A 50 50 ASP N N 50 123.430 120.404 3.026 1
1 230 . 19 1 1 A 51 51 ALA H H 51 8.720 8.154 0.566 1
1 231 . 19 1 1 A 51 51 ALA CA C 51 55.281 54.859 0.422 1
1 232 . 19 1 1 A 51 51 ALA CB C 51 18.205 17.988 0.217 1
1 233 . 19 1 1 A 51 51 ALA N N 51 117.829 121.191 -3.362 1
1 234 . 19 1 1 A 52 52 GLU H H 52 7.161 7.824 -0.663 1
1 235 . 19 1 1 A 52 52 GLU CA C 52 58.757 59.292 -0.535 1
1 236 . 19 1 1 A 52 52 GLU CB C 52 30.247 30.005 0.242 1
1 237 . 19 1 1 A 52 52 GLU N N 52 115.459 117.701 -2.242 1
1 238 . 19 1 1 A 53 53 ILE H H 53 7.962 7.775 0.187 1
1 239 . 19 1 1 A 53 53 ILE CA C 53 65.525 65.127 0.398 1
1 240 . 19 1 1 A 53 53 ILE CB C 53 37.289 37.432 -0.143 1
1 241 . 19 1 1 A 53 53 ILE N N 53 120.414 120.855 -0.441 1
1 242 . 19 1 1 A 54 54 VAL H H 54 8.132 8.202 -0.070 1
1 243 . 19 1 1 A 54 54 VAL CA C 54 67.290 65.634 1.656 1
1 244 . 19 1 1 A 54 54 VAL CB C 54 31.434 31.198 0.236 1
1 245 . 19 1 1 A 54 54 VAL N N 54 119.775 117.428 2.347 1
1 246 . 19 1 1 A 55 55 LYS H H 55 7.155 7.993 -0.838 1
1 247 . 19 1 1 A 55 55 LYS CA C 55 59.131 58.854 0.277 1
1 248 . 19 1 1 A 55 55 LYS CB C 55 32.131 31.683 0.448 1
1 249 . 19 1 1 A 55 55 LYS N N 55 119.175 121.001 -1.826 1
1 250 . 19 1 1 A 56 56 LEU H H 56 7.837 7.928 -0.091 1
1 251 . 19 1 1 A 56 56 LEU CA C 56 58.052 57.955 0.097 1
1 252 . 19 1 1 A 56 56 LEU CB C 56 41.878 41.763 0.115 1
1 253 . 19 1 1 A 56 56 LEU N N 56 119.679 120.998 -1.319 1
1 254 . 19 1 1 A 57 57 MET H H 57 8.385 8.696 -0.311 1
1 255 . 19 1 1 A 57 57 MET CA C 57 60.756 58.522 2.234 1
1 256 . 19 1 1 A 57 57 MET CB C 57 33.152 32.167 0.985 1
1 257 . 19 1 1 A 57 57 MET N N 57 115.116 119.123 -4.007 1
1 258 . 19 1 1 A 58 58 ASP H H 58 7.591 8.452 -0.861 1
1 259 . 19 1 1 A 58 58 ASP CA C 58 57.365 57.209 0.156 1
1 260 . 19 1 1 A 58 58 ASP CB C 58 40.858 41.305 -0.447 1
1 261 . 19 1 1 A 58 58 ASP N N 58 118.197 119.570 -1.373 1
1 262 . 19 1 1 A 59 59 ASP H H 59 7.725 7.564 0.161 1
1 263 . 19 1 1 A 59 59 ASP CA C 59 56.830 56.546 0.284 1
1 264 . 19 1 1 A 59 59 ASP CB C 59 40.567 40.864 -0.297 1
1 265 . 19 1 1 A 59 59 ASP N N 59 118.481 119.205 -0.724 1
1 266 . 19 1 1 A 60 60 LEU H H 60 7.703 7.839 -0.136 1
1 267 . 19 1 1 A 60 60 LEU CA C 60 56.564 57.558 -0.994 1
1 268 . 19 1 1 A 60 60 LEU CB C 60 42.714 40.947 1.767 1
1 269 . 19 1 1 A 60 60 LEU N N 60 116.935 119.571 -2.636 1
1 270 . 19 1 1 A 61 61 ASP H H 61 7.143 8.453 -1.310 1
1 271 . 19 1 1 A 61 61 ASP HA H 61 4.690 4.564 0.126 1
1 274 . 19 1 1 A 61 61 ASP CA C 61 52.286 56.969 -4.683 1
1 275 . 19 1 1 A 61 61 ASP CB C 61 39.245 41.205 -1.960 1
1 276 . 19 1 1 A 61 61 ASP N N 61 116.605 119.862 -3.257 1
1 277 . 19 1 1 A 62 62 ARG H H 62 7.786 7.776 0.010 1
1 278 . 19 1 1 A 62 62 ARG CA C 62 58.328 58.904 -0.576 1
1 279 . 19 1 1 A 62 62 ARG CB C 62 30.106 29.989 0.117 1
1 280 . 19 1 1 A 62 62 ARG N N 62 125.967 119.596 6.371 1
1 281 . 19 1 1 A 63 63 ASN H H 63 7.945 7.573 0.372 1
1 282 . 19 1 1 A 63 63 ASN CA C 63 51.863 55.178 -3.315 1
1 283 . 19 1 1 A 63 63 ASN CB C 63 36.809 39.545 -2.736 1
1 284 . 19 1 1 A 63 63 ASN N N 63 112.434 116.151 -3.717 1
1 285 . 19 1 1 A 64 64 LYS H H 64 7.477 7.220 0.257 1
1 286 . 19 1 1 A 64 64 LYS CA C 64 56.524 55.855 0.669 1
1 287 . 19 1 1 A 64 64 LYS N N 64 114.197 118.359 -4.162 1
1 288 . 19 1 1 A 65 65 ASP H H 65 8.345 8.758 -0.413 1
1 289 . 19 1 1 A 65 65 ASP CA C 65 52.969 55.286 -2.317 1
1 290 . 19 1 1 A 65 65 ASP CB C 65 40.329 40.381 -0.052 1
1 291 . 19 1 1 A 65 65 ASP N N 65 118.581 125.337 -6.756 1
1 292 . 19 1 1 A 66 66 GLN H H 66 9.945 9.166 0.779 1
1 293 . 19 1 1 A 66 66 GLN CA C 66 58.132 58.540 -0.408 1
1 294 . 19 1 1 A 66 66 GLN CB C 66 26.035 26.470 -0.435 1
1 295 . 19 1 1 A 66 66 GLN N N 66 113.203 117.062 -3.859 1
1 296 . 19 1 1 A 67 67 GLU H H 67 7.880 8.268 -0.388 1
1 297 . 19 1 1 A 67 67 GLU HA H 67 4.910 4.934 -0.024 1
1 302 . 19 1 1 A 67 67 GLU CA C 67 54.082 54.906 -0.824 1
1 303 . 19 1 1 A 67 67 GLU CB C 67 33.174 32.152 1.022 1
1 304 . 19 1 1 A 67 67 GLU N N 67 118.554 119.875 -1.321 1
1 305 . 19 1 1 A 68 68 VAL H H 68 9.669 9.215 0.454 1
1 306 . 19 1 1 A 68 68 VAL HA H 68 5.465 4.393 1.072 1
1 314 . 19 1 1 A 68 68 VAL CA C 68 61.079 62.125 -1.046 1
1 315 . 19 1 1 A 68 68 VAL CB C 68 33.280 32.284 0.996 1
1 316 . 19 1 1 A 68 68 VAL N N 68 126.572 127.486 -0.914 1
1 317 . 19 1 1 A 69 69 ASN H H 69 8.985 8.760 0.225 1
1 318 . 19 1 1 A 69 69 ASN CA C 69 50.812 53.442 -2.630 1
1 319 . 19 1 1 A 69 69 ASN CB C 69 38.609 40.785 -2.176 1
1 320 . 19 1 1 A 69 69 ASN N N 69 127.472 126.771 0.701 1
1 321 . 19 1 1 A 70 70 PHE H H 70 9.100 9.445 -0.345 1
1 322 . 19 1 1 A 70 70 PHE CA C 70 63.279 61.846 1.433 1
1 323 . 19 1 1 A 70 70 PHE CB C 70 38.741 39.346 -0.605 1
1 324 . 19 1 1 A 70 70 PHE N N 70 119.972 127.567 -7.595 1
1 325 . 19 1 1 A 71 71 GLN H H 71 8.342 8.157 0.185 1
1 326 . 19 1 1 A 71 71 GLN HA H 71 3.923 3.564 0.359 1
1 329 . 19 1 1 A 71 71 GLN CA C 71 59.866 58.299 1.567 1
1 330 . 19 1 1 A 71 71 GLN CB C 71 27.878 28.515 -0.637 1
1 331 . 19 1 1 A 71 71 GLN N N 71 118.216 117.139 1.077 1
1 332 . 19 1 1 A 72 72 GLU H H 72 8.721 8.187 0.534 1
1 333 . 19 1 1 A 72 72 GLU HA H 72 4.147 4.113 0.034 1
1 338 . 19 1 1 A 72 72 GLU CA C 72 59.313 58.700 0.613 1
1 339 . 19 1 1 A 72 72 GLU CB C 72 30.233 29.485 0.748 1
1 340 . 19 1 1 A 72 72 GLU N N 72 121.455 119.890 1.565 1
1 341 . 19 1 1 A 73 73 TYR H H 73 8.536 8.164 0.372 1
1 342 . 19 1 1 A 73 73 TYR CA C 73 60.961 61.478 -0.517 1
1 343 . 19 1 1 A 73 73 TYR CB C 73 38.724 38.837 -0.113 1
1 344 . 19 1 1 A 73 73 TYR N N 73 123.356 122.690 0.666 1
1 345 . 19 1 1 A 74 74 ILE H H 74 8.642 7.687 0.955 1
1 346 . 19 1 1 A 74 74 ILE CA C 74 61.880 63.799 -1.919 1
1 347 . 19 1 1 A 74 74 ILE CB C 74 36.077 36.263 -0.186 1
1 348 . 19 1 1 A 74 74 ILE N N 74 119.799 120.206 -0.407 1
1 349 . 19 1 1 A 75 75 THR H H 75 7.959 8.135 -0.176 1
1 354 . 19 1 1 A 75 75 THR CA C 75 67.056 66.567 0.489 1
1 355 . 19 1 1 A 75 75 THR CB C 75 68.386 68.523 -0.137 1
1 356 . 19 1 1 A 75 75 THR N N 75 119.486 118.030 1.456 1
1 357 . 19 1 1 A 76 76 PHE H H 76 7.450 7.782 -0.332 1
1 358 . 19 1 1 A 76 76 PHE CA C 76 59.010 61.578 -2.568 1
1 359 . 19 1 1 A 76 76 PHE CB C 76 38.139 39.088 -0.949 1
1 360 . 19 1 1 A 76 76 PHE N N 76 122.873 122.529 0.344 1
1 361 . 19 1 1 A 77 77 LEU H H 77 7.829 8.132 -0.303 1
1 362 . 19 1 1 A 77 77 LEU CA C 77 57.450 57.597 -0.147 1
1 363 . 19 1 1 A 77 77 LEU CB C 77 40.560 41.174 -0.614 1
1 364 . 19 1 1 A 77 77 LEU N N 77 117.405 118.386 -0.981 1
1 365 . 19 1 1 A 78 78 GLY H H 78 8.093 8.159 -0.066 1
1 366 . 19 1 1 A 78 78 GLY HA2 H 78 3.661 3.725 -0.064 1
1 367 . 19 1 1 A 78 78 GLY HA3 H 78 3.594 3.737 -0.143 1
1 368 . 19 1 1 A 78 78 GLY CA C 78 47.442 46.802 0.640 1
1 369 . 19 1 1 A 78 78 GLY N N 78 105.528 106.087 -0.559 1
1 370 . 19 1 1 A 79 79 ALA H H 79 7.759 7.612 0.147 1
1 371 . 19 1 1 A 79 79 ALA CA C 79 55.153 54.413 0.740 1
1 372 . 19 1 1 A 79 79 ALA CB C 79 17.768 18.381 -0.613 1
1 373 . 19 1 1 A 79 79 ALA N N 79 124.488 124.447 0.041 1
1 374 . 19 1 1 A 80 80 LEU H H 80 7.963 7.773 0.190 1
1 375 . 19 1 1 A 80 80 LEU CA C 80 57.464 57.545 -0.081 1
1 376 . 19 1 1 A 80 80 LEU CB C 80 41.496 40.808 0.688 1
1 377 . 19 1 1 A 80 80 LEU N N 80 117.869 119.974 -2.105 1
1 378 . 19 1 1 A 81 81 ALA H H 81 8.365 8.034 0.331 1
1 379 . 19 1 1 A 81 81 ALA CA C 81 55.475 54.583 0.892 1
1 380 . 19 1 1 A 81 81 ALA CB C 81 17.483 18.239 -0.756 1
1 381 . 19 1 1 A 81 81 ALA N N 81 119.054 119.754 -0.700 1
1 382 . 19 1 1 A 82 82 MET H H 82 8.112 7.731 0.381 1
1 383 . 19 1 1 A 82 82 MET CA C 82 59.516 57.549 1.967 1
1 384 . 19 1 1 A 82 82 MET CB C 82 32.550 32.067 0.483 1
1 385 . 19 1 1 A 82 82 MET N N 82 115.364 115.973 -0.609 1
1 386 . 19 1 1 A 83 83 ILE H H 83 7.981 7.720 0.261 1
1 387 . 19 1 1 A 83 83 ILE HA H 83 3.839 3.804 0.035 1
1 391 . 19 1 1 A 83 83 ILE CA C 83 64.467 64.826 -0.359 1
1 392 . 19 1 1 A 83 83 ILE CB C 83 37.312 37.281 0.031 1
1 393 . 19 1 1 A 83 83 ILE N N 83 120.887 120.505 0.382 1
1 394 . 19 1 1 A 84 84 TYR H H 84 8.731 8.060 0.671 1
1 395 . 19 1 1 A 84 84 TYR N N 84 120.933 119.153 1.780 1
1 396 . 19 1 1 A 87 87 ALA H H 87 7.829 8.088 -0.259 1
1 397 . 19 1 1 A 87 87 ALA CA C 87 53.768 54.313 -0.545 1
1 398 . 19 1 1 A 87 87 ALA CB C 87 18.504 18.448 0.056 1
1 399 . 19 1 1 A 87 87 ALA N N 87 120.274 122.056 -1.782 1
1 400 . 19 1 1 A 88 88 LEU H H 88 7.499 7.623 -0.124 1
1 401 . 19 1 1 A 88 88 LEU CA C 88 55.605 55.698 -0.093 1
1 402 . 19 1 1 A 88 88 LEU CB C 88 42.047 42.104 -0.057 1
1 403 . 19 1 1 A 88 88 LEU N N 88 117.356 117.077 0.279 1
1 404 . 19 1 1 A 89 89 LYS H H 89 7.561 7.682 -0.121 1
1 405 . 19 1 1 A 89 89 LYS CA C 89 56.865 57.633 -0.768 1
1 406 . 19 1 1 A 89 89 LYS CB C 89 32.592 33.685 -1.093 1
1 407 . 19 1 1 A 89 89 LYS N N 89 119.289 119.262 0.027 1
1 416 . 19 3 2 C 6 6 GLU H H 190 8.385 8.110 0.275 1
1 417 . 19 3 2 C 6 6 GLU HA H 190 4.153 4.657 -0.504 1
1 422 . 19 3 2 C 6 6 GLU C C 190 175.031 175.415 -0.384 1
1 423 . 19 3 2 C 6 6 GLU CA C 190 58.866 54.891 3.975 1
1 424 . 19 3 2 C 6 6 GLU CB C 190 30.751 32.564 -1.813 1
1 426 . 19 3 2 C 6 6 GLU N N 190 122.715 118.306 4.409 1
1 427 . 19 3 2 C 7 7 GLY H H 191 8.475 8.681 -0.206 1
1 428 . 19 3 2 C 7 7 GLY HA2 H 191 3.887 4.030 -0.143 1
1 429 . 19 3 2 C 7 7 GLY HA3 H 191 3.887 4.031 -0.144 1
1 430 . 19 3 2 C 7 7 GLY C C 191 177.922 175.206 2.716 1
1 431 . 19 3 2 C 7 7 GLY CA C 191 46.884 45.521 1.363 1
1 432 . 19 3 2 C 7 7 GLY N N 191 109.009 110.452 -1.443 1
1 433 . 19 3 2 C 8 8 LEU HA H 192 4.095 3.955 0.140 1
1 443 . 19 3 2 C 8 8 LEU CA C 192 58.154 58.184 -0.030 1
1 444 . 19 3 2 C 8 8 LEU CB C 192 42.789 42.271 0.518 1
1 448 . 19 3 2 C 9 9 MET H H 193 8.250 8.347 -0.097 1
1 449 . 19 3 2 C 9 9 MET HA H 193 4.150 4.158 -0.008 1
1 457 . 19 3 2 C 9 9 MET C C 193 178.421 178.432 -0.011 1
1 458 . 19 3 2 C 9 9 MET CA C 193 58.818 58.406 0.412 1
1 459 . 19 3 2 C 9 9 MET CB C 193 32.360 31.804 0.556 1
1 462 . 19 3 2 C 9 9 MET N N 193 117.049 116.803 0.246 1
1 463 . 19 3 2 C 10 10 ASN H H 194 7.892 8.435 -0.543 1
1 464 . 19 3 2 C 10 10 ASN HA H 194 4.468 4.520 -0.052 1
1 469 . 19 3 2 C 10 10 ASN C C 194 178.099 176.534 1.565 1
1 470 . 19 3 2 C 10 10 ASN CA C 194 56.644 55.666 0.978 1
1 471 . 19 3 2 C 10 10 ASN CB C 194 39.100 39.066 0.034 1
1 472 . 19 3 2 C 10 10 ASN N N 194 117.034 119.040 -2.006 1
1 474 . 19 3 2 C 11 11 VAL H H 195 7.651 7.694 -0.043 1
1 475 . 19 3 2 C 11 11 VAL HA H 195 3.735 3.865 -0.130 1
1 483 . 19 3 2 C 11 11 VAL C C 195 177.657 178.339 -0.682 1
1 484 . 19 3 2 C 11 11 VAL CA C 195 66.710 65.154 1.556 1
1 485 . 19 3 2 C 11 11 VAL CB C 195 32.468 31.914 0.554 1
1 488 . 19 3 2 C 11 11 VAL N N 195 119.878 118.006 1.872 1
1 489 . 19 3 2 C 12 12 LEU H H 196 8.030 7.948 0.082 1
1 490 . 19 3 2 C 12 12 LEU HA H 196 4.013 3.987 0.026 1
1 500 . 19 3 2 C 12 12 LEU C C 196 177.540 179.307 -1.767 1
1 501 . 19 3 2 C 12 12 LEU CA C 196 58.489 57.522 0.967 1
1 502 . 19 3 2 C 12 12 LEU CB C 196 42.457 41.087 1.370 1
1 506 . 19 3 2 C 12 12 LEU N N 196 119.499 120.008 -0.509 1
1 507 . 19 3 2 C 13 13 LYS H H 197 8.015 8.407 -0.392 1
1 508 . 19 3 2 C 13 13 LYS HA H 197 3.949 4.076 -0.127 1
1 517 . 19 3 2 C 13 13 LYS C C 197 178.419 179.234 -0.815 1
1 518 . 19 3 2 C 13 13 LYS CA C 197 60.191 59.494 0.697 1
1 519 . 19 3 2 C 13 13 LYS CB C 197 33.075 32.149 0.926 1
1 523 . 19 3 2 C 13 13 LYS N N 197 117.888 121.045 -3.157 1
1 524 . 19 3 2 C 14 14 LYS H H 198 7.506 7.803 -0.297 1
1 525 . 19 3 2 C 14 14 LYS HA H 198 4.127 4.081 0.046 1
1 534 . 19 3 2 C 14 14 LYS C C 198 178.262 178.479 -0.217 1
1 535 . 19 3 2 C 14 14 LYS CA C 198 59.161 58.192 0.969 1
1 536 . 19 3 2 C 14 14 LYS CB C 198 32.956 32.282 0.674 1
1 540 . 19 3 2 C 14 14 LYS N N 198 118.321 118.043 0.278 1
1 541 . 19 3 2 C 15 15 ILE H H 199 7.780 7.325 0.455 1
1 542 . 19 3 2 C 15 15 ILE HA H 199 3.787 3.959 -0.172 1
1 552 . 19 3 2 C 15 15 ILE C C 199 178.647 177.936 0.711 1
1 553 . 19 3 2 C 15 15 ILE CA C 199 64.912 63.816 1.096 1
1 554 . 19 3 2 C 15 15 ILE CB C 199 38.780 37.870 0.910 1
1 558 . 19 3 2 C 15 15 ILE N N 199 118.644 118.606 0.038 1
1 559 . 19 3 2 C 16 16 TYR H H 200 7.918 8.278 -0.360 1
1 560 . 19 3 2 C 16 16 TYR HA H 200 4.252 4.063 0.189 1
1 567 . 19 3 2 C 16 16 TYR C C 200 177.806 177.768 0.038 1
1 568 . 19 3 2 C 16 16 TYR CA C 200 61.171 61.668 -0.497 1
1 569 . 19 3 2 C 16 16 TYR CB C 200 39.245 39.107 0.138 1
1 573 . 19 3 2 C 16 16 TYR N N 200 118.683 121.398 -2.715 1
1 574 . 19 3 2 C 17 17 GLU H H 201 8.089 9.070 -0.981 1
1 575 . 19 3 2 C 17 17 GLU HA H 201 4.124 3.967 0.157 1
1 580 . 19 3 2 C 17 17 GLU C C 201 177.414 177.745 -0.331 1
1 581 . 19 3 2 C 17 17 GLU CA C 201 58.784 58.094 0.690 1
1 582 . 19 3 2 C 17 17 GLU CB C 201 30.747 27.818 2.929 1
1 584 . 19 3 2 C 17 17 GLU N N 201 119.409 117.137 2.272 1
1 585 . 19 3 2 C 18 18 ASP H H 202 8.023 7.761 0.262 1
1 586 . 19 3 2 C 18 18 ASP HA H 202 4.657 4.612 0.045 1
1 589 . 19 3 2 C 18 18 ASP C C 202 177.346 176.220 1.126 1
1 590 . 19 3 2 C 18 18 ASP CA C 202 55.496 55.157 0.339 1
1 591 . 19 3 2 C 18 18 ASP CB C 202 42.023 42.168 -0.145 1
1 592 . 19 3 2 C 18 18 ASP N N 202 119.459 119.714 -0.255 1
1 593 . 19 3 2 C 19 19 GLY H H 203 7.933 7.968 -0.035 1
1 594 . 19 3 2 C 19 19 GLY HA2 H 203 3.938 3.982 -0.044 1
1 595 . 19 3 2 C 19 19 GLY HA3 H 203 3.938 4.045 -0.107 1
1 596 . 19 3 2 C 19 19 GLY C C 203 177.240 172.017 5.223 1
1 597 . 19 3 2 C 19 19 GLY CA C 203 46.309 44.891 1.418 1
1 598 . 19 3 2 C 19 19 GLY N N 203 108.518 106.729 1.789 1
1 599 . 19 3 2 C 20 20 ASP H H 204 8.091 8.363 -0.272 1
1 600 . 19 3 2 C 20 20 ASP HA H 204 4.616 5.288 -0.672 1
1 603 . 19 3 2 C 20 20 ASP C C 204 173.979 175.364 -1.385 1
1 604 . 19 3 2 C 20 20 ASP CA C 204 55.064 53.383 1.681 1
1 605 . 19 3 2 C 20 20 ASP CB C 204 42.203 44.000 -1.797 1
1 606 . 19 3 2 C 20 20 ASP N N 204 120.172 120.541 -0.369 1
1 607 . 19 3 2 C 21 21 ASP H H 205 8.352 8.809 -0.457 1
1 608 . 19 3 2 C 21 21 ASP HA H 205 4.468 4.583 -0.115 1
1 611 . 19 3 2 C 21 21 ASP C C 205 176.432 177.576 -1.144 1
1 612 . 19 3 2 C 21 21 ASP CA C 205 56.663 55.833 0.830 1
1 613 . 19 3 2 C 21 21 ASP CB C 205 41.918 41.056 0.862 1
1 614 . 19 3 2 C 21 21 ASP N N 205 121.515 124.813 -3.298 1
1 615 . 19 3 2 C 22 22 ASP H H 206 8.239 8.101 0.138 1
1 616 . 19 3 2 C 22 22 ASP HA H 206 4.455 4.616 -0.161 1
1 619 . 19 3 2 C 22 22 ASP C C 206 177.449 178.414 -0.965 1
1 620 . 19 3 2 C 22 22 ASP CA C 206 57.165 56.593 0.572 1
1 621 . 19 3 2 C 22 22 ASP CB C 206 41.820 40.130 1.690 1
1 622 . 19 3 2 C 22 22 ASP N N 206 120.156 118.982 1.174 1
1 623 . 19 3 2 C 23 23 MET H H 207 8.300 7.990 0.310 1
1 624 . 19 3 2 C 23 23 MET HA H 207 4.255 4.066 0.189 1
1 632 . 19 3 2 C 23 23 MET C C 207 178.412 178.090 0.322 1
1 633 . 19 3 2 C 23 23 MET CA C 207 58.065 58.541 -0.476 1
1 634 . 19 3 2 C 23 23 MET CB C 207 32.488 31.947 0.541 1
1 637 . 19 3 2 C 23 23 MET N N 207 120.707 119.637 1.070 1
1 638 . 19 3 2 C 24 24 LYS H H 208 8.047 8.075 -0.028 1
1 639 . 19 3 2 C 24 24 LYS HA H 208 3.946 3.962 -0.016 1
1 648 . 19 3 2 C 24 24 LYS C C 208 178.008 179.539 -1.531 1
1 649 . 19 3 2 C 24 24 LYS CA C 208 59.847 60.145 -0.298 1
1 650 . 19 3 2 C 24 24 LYS CB C 208 32.983 32.042 0.941 1
1 654 . 19 3 2 C 24 24 LYS N N 208 119.504 118.878 0.626 1
1 655 . 19 3 2 C 25 25 ARG H H 209 7.891 7.866 0.025 1
1 656 . 19 3 2 C 25 25 ARG HA H 209 4.168 4.138 0.030 1
1 663 . 19 3 2 C 25 25 ARG C C 209 178.100 179.066 -0.966 1
1 664 . 19 3 2 C 25 25 ARG CA C 209 58.810 58.853 -0.043 1
1 665 . 19 3 2 C 25 25 ARG CB C 209 31.080 29.836 1.244 1
1 668 . 19 3 2 C 25 25 ARG N N 209 118.378 119.047 -0.669 1
1 669 . 19 3 2 C 26 26 THR H H 210 7.869 8.359 -0.490 1
1 670 . 19 3 2 C 26 26 THR HA H 210 4.023 4.057 -0.034 1
1 675 . 19 3 2 C 26 26 THR C C 210 177.984 176.848 1.136 1
1 676 . 19 3 2 C 26 26 THR CA C 210 65.747 66.979 -1.232 1
1 677 . 19 3 2 C 26 26 THR CB C 210 69.683 67.986 1.697 1
1 679 . 19 3 2 C 26 26 THR N N 210 115.443 118.454 -3.011 1
1 680 . 19 3 2 C 27 27 ILE H H 211 7.901 8.134 -0.233 1
1 681 . 19 3 2 C 27 27 ILE HA H 211 4.142 3.706 0.436 1
1 691 . 19 3 2 C 27 27 ILE C C 211 175.595 178.235 -2.640 1
1 692 . 19 3 2 C 27 27 ILE CA C 211 63.528 65.006 -1.478 1
1 693 . 19 3 2 C 27 27 ILE CB C 211 38.982 37.459 1.523 1
1 697 . 19 3 2 C 27 27 ILE N N 211 121.265 121.431 -0.166 1
1 698 . 19 3 2 C 28 28 ASN HA H 212 4.465 4.307 0.158 1
1 703 . 19 3 2 C 28 28 ASN CA C 212 55.182 57.014 -1.832 1
1 704 . 19 3 2 C 28 28 ASN CB C 212 39.480 39.696 -0.216 1
1 706 . 19 3 2 C 29 29 LYS H H 213 7.968 8.223 -0.255 1
1 707 . 19 3 2 C 29 29 LYS HA H 213 4.072 4.047 0.025 1
1 716 . 19 3 2 C 29 29 LYS C C 213 176.218 178.775 -2.557 1
1 717 . 19 3 2 C 29 29 LYS CA C 213 58.489 59.590 -1.101 1
1 718 . 19 3 2 C 29 29 LYS CB C 213 33.165 32.402 0.763 1
1 722 . 19 3 2 C 29 29 LYS N N 213 120.820 119.317 1.503 1
1 723 . 19 3 2 C 30 30 ALA H H 214 7.865 8.324 -0.459 1
1 724 . 19 3 2 C 30 30 ALA HA H 214 4.217 4.279 -0.062 1
1 728 . 19 3 2 C 30 30 ALA C C 214 177.041 179.422 -2.381 1
1 729 . 19 3 2 C 30 30 ALA CA C 214 54.104 54.794 -0.690 1
1 730 . 19 3 2 C 30 30 ALA CB C 214 19.496 18.155 1.341 1
1 731 . 19 3 2 C 30 30 ALA N N 214 121.571 120.425 1.146 1
1 732 . 19 3 2 C 31 31 TRP H H 215 7.831 7.708 0.123 1
1 733 . 19 3 2 C 31 31 TRP HA H 215 4.598 4.576 0.022 1
1 742 . 19 3 2 C 31 31 TRP C C 215 178.088 178.743 -0.655 1
1 743 . 19 3 2 C 31 31 TRP CA C 215 58.432 59.339 -0.907 1
1 744 . 19 3 2 C 31 31 TRP CB C 215 30.472 30.396 0.076 1
1 750 . 19 3 2 C 31 31 TRP N N 215 118.141 117.727 0.414 1
1 752 . 19 3 2 C 32 32 VAL H H 216 7.594 8.289 -0.695 1
1 753 . 19 3 2 C 32 32 VAL HA H 216 3.978 3.841 0.137 1
1 761 . 19 3 2 C 32 32 VAL C C 216 176.574 178.298 -1.724 1
1 762 . 19 3 2 C 32 32 VAL CA C 216 63.329 66.047 -2.718 1
1 763 . 19 3 2 C 32 32 VAL CB C 216 33.373 31.540 1.833 1
1 766 . 19 3 2 C 32 32 VAL N N 216 118.287 119.866 -1.579 1
1 767 . 19 3 2 C 33 33 GLU H H 217 8.012 8.950 -0.938 1
1 768 . 19 3 2 C 33 33 GLU HA H 217 4.257 4.250 0.007 1
1 773 . 19 3 2 C 33 33 GLU C C 217 176.164 177.544 -1.380 1
1 774 . 19 3 2 C 33 33 GLU CA C 217 57.409 58.335 -0.926 1
1 775 . 19 3 2 C 33 33 GLU CB C 217 30.978 28.120 2.858 1
1 777 . 19 3 2 C 33 33 GLU N N 217 122.535 120.287 2.248 1
1 778 . 19 3 2 C 34 34 SER H H 218 8.037 8.192 -0.155 1
1 779 . 19 3 2 C 34 34 SER HA H 218 4.514 4.216 0.298 1
1 782 . 19 3 2 C 34 34 SER C C 218 176.451 175.808 0.643 1
1 783 . 19 3 2 C 34 34 SER CA C 218 58.987 61.196 -2.209 1
1 784 . 19 3 2 C 34 34 SER CB C 218 64.569 63.154 1.415 1
1 785 . 19 3 2 C 34 34 SER N N 218 117.058 117.395 -0.337 1
1 6 . 20 1 1 A 2 2 ALA H H 2 8.191 8.941 -0.750 1
1 7 . 20 1 1 A 2 2 ALA CA C 2 51.957 52.674 -0.717 1
1 8 . 20 1 1 A 2 2 ALA CB C 2 19.580 18.747 0.833 1
1 9 . 20 1 1 A 2 2 ALA N N 2 124.666 126.260 -1.594 1
1 10 . 20 1 1 A 3 3 SER H H 3 8.829 8.023 0.806 1
1 11 . 20 1 1 A 3 3 SER CA C 3 57.221 62.954 -5.733 1
1 12 . 20 1 1 A 3 3 SER N N 3 119.917 114.617 5.300 1
1 13 . 20 1 1 A 4 4 PRO CA C 4 66.688 65.579 1.109 1
1 14 . 20 1 1 A 4 4 PRO CB C 4 32.553 30.865 1.688 1
1 15 . 20 1 1 A 5 5 LEU H H 5 9.146 7.379 1.767 1
1 16 . 20 1 1 A 5 5 LEU CA C 5 59.017 57.008 2.009 1
1 17 . 20 1 1 A 5 5 LEU CB C 5 42.341 42.544 -0.203 1
1 18 . 20 1 1 A 5 5 LEU N N 5 117.902 116.997 0.905 1
1 19 . 20 1 1 A 6 6 ASP H H 6 7.572 8.515 -0.943 1
1 20 . 20 1 1 A 6 6 ASP CA C 6 57.997 57.584 0.413 1
1 21 . 20 1 1 A 6 6 ASP CB C 6 40.910 41.794 -0.884 1
1 22 . 20 1 1 A 6 6 ASP N N 6 118.259 119.438 -1.179 1
1 23 . 20 1 1 A 7 7 GLN H H 7 8.660 8.430 0.230 1
1 24 . 20 1 1 A 7 7 GLN HA H 7 4.064 4.087 -0.023 1
1 29 . 20 1 1 A 7 7 GLN CA C 7 59.270 58.353 0.917 1
1 30 . 20 1 1 A 7 7 GLN CB C 7 28.468 27.721 0.747 1
1 31 . 20 1 1 A 7 7 GLN N N 7 119.558 117.027 2.531 1
1 32 . 20 1 1 A 8 8 ALA H H 8 8.253 7.859 0.394 1
1 33 . 20 1 1 A 8 8 ALA CA C 8 55.519 54.797 0.722 1
1 34 . 20 1 1 A 8 8 ALA CB C 8 18.113 18.642 -0.529 1
1 35 . 20 1 1 A 8 8 ALA N N 8 123.628 121.758 1.870 1
1 36 . 20 1 1 A 9 9 ILE H H 9 8.134 8.197 -0.063 1
1 37 . 20 1 1 A 9 9 ILE CA C 9 65.261 64.599 0.662 1
1 38 . 20 1 1 A 9 9 ILE CB C 9 37.023 37.245 -0.222 1
1 39 . 20 1 1 A 9 9 ILE N N 9 117.056 117.044 0.012 1
1 40 . 20 1 1 A 10 10 GLY H H 10 8.515 8.344 0.171 1
1 41 . 20 1 1 A 10 10 GLY HA3 H 10 3.773 3.798 -0.025 1
1 42 . 20 1 1 A 10 10 GLY CA C 10 47.637 46.779 0.858 1
1 43 . 20 1 1 A 10 10 GLY N N 10 106.202 110.702 -4.500 1
1 44 . 20 1 1 A 11 11 LEU H H 11 8.212 7.912 0.300 1
1 45 . 20 1 1 A 11 11 LEU CA C 11 58.354 57.485 0.869 1
1 46 . 20 1 1 A 11 11 LEU CB C 11 41.683 41.748 -0.065 1
1 47 . 20 1 1 A 11 11 LEU N N 11 124.624 123.613 1.011 1
1 48 . 20 1 1 A 12 12 LEU H H 12 7.971 7.889 0.082 1
1 49 . 20 1 1 A 12 12 LEU HA H 12 4.144 4.149 -0.005 1
1 59 . 20 1 1 A 12 12 LEU CA C 12 58.691 58.467 0.224 1
1 60 . 20 1 1 A 12 12 LEU CB C 12 40.657 41.358 -0.701 1
1 61 . 20 1 1 A 12 12 LEU N N 12 118.095 118.810 -0.715 1
1 62 . 20 1 1 A 13 13 ILE H H 13 8.379 8.529 -0.150 1
1 63 . 20 1 1 A 13 13 ILE CA C 13 66.405 65.424 0.981 1
1 64 . 20 1 1 A 13 13 ILE CB C 13 38.916 38.337 0.579 1
1 65 . 20 1 1 A 13 13 ILE N N 13 121.161 120.163 0.998 1
1 66 . 20 1 1 A 14 14 GLY H H 14 8.823 8.514 0.309 1
1 67 . 20 1 1 A 14 14 GLY HA2 H 14 4.147 3.743 0.404 1
1 68 . 20 1 1 A 14 14 GLY HA3 H 14 3.982 3.771 0.211 1
1 69 . 20 1 1 A 14 14 GLY CA C 14 47.750 47.130 0.620 1
1 70 . 20 1 1 A 14 14 GLY N N 14 108.982 107.300 1.682 1
1 71 . 20 1 1 A 15 15 ILE H H 15 8.681 8.437 0.244 1
1 72 . 20 1 1 A 15 15 ILE CA C 15 64.996 64.770 0.226 1
1 73 . 20 1 1 A 15 15 ILE CB C 15 37.107 37.940 -0.833 1
1 74 . 20 1 1 A 15 15 ILE N N 15 121.601 122.591 -0.990 1
1 75 . 20 1 1 A 16 16 PHE H H 16 7.103 8.627 -1.524 1
1 76 . 20 1 1 A 16 16 PHE CA C 16 62.910 61.762 1.148 1
1 77 . 20 1 1 A 16 16 PHE CB C 16 38.782 38.800 -0.018 1
1 78 . 20 1 1 A 16 16 PHE N N 16 118.660 120.893 -2.233 1
1 79 . 20 1 1 A 17 17 HIS H H 17 7.591 8.657 -1.066 1
1 80 . 20 1 1 A 17 17 HIS HA H 17 4.793 4.850 -0.057 1
1 82 . 20 1 1 A 17 17 HIS CA C 17 58.125 59.715 -1.590 1
1 83 . 20 1 1 A 17 17 HIS CB C 17 29.584 29.038 0.546 1
1 84 . 20 1 1 A 17 17 HIS N N 17 114.968 116.787 -1.819 1
1 85 . 20 1 1 A 18 18 LYS H H 18 8.144 8.179 -0.035 1
1 86 . 20 1 1 A 18 18 LYS CA C 18 58.975 59.036 -0.061 1
1 87 . 20 1 1 A 18 18 LYS CB C 18 32.379 31.999 0.380 1
1 88 . 20 1 1 A 18 18 LYS N N 18 122.373 121.705 0.668 1
1 89 . 20 1 1 A 19 19 TYR H H 19 6.999 7.769 -0.770 1
1 90 . 20 1 1 A 19 19 TYR CA C 19 60.318 60.597 -0.279 1
1 91 . 20 1 1 A 19 19 TYR CB C 19 40.355 38.499 1.856 1
1 92 . 20 1 1 A 19 19 TYR N N 19 113.614 118.622 -5.008 1
1 93 . 20 1 1 A 20 20 SER H H 20 8.432 8.477 -0.045 1
1 94 . 20 1 1 A 20 20 SER CA C 20 61.897 60.888 1.009 1
1 95 . 20 1 1 A 20 20 SER CB C 20 61.354 62.235 -0.881 1
1 96 . 20 1 1 A 20 20 SER N N 20 113.201 115.626 -2.425 1
1 97 . 20 1 1 A 21 21 GLY H H 21 7.678 7.943 -0.265 1
1 98 . 20 1 1 A 21 21 GLY HA2 H 21 4.195 3.858 0.337 1
1 99 . 20 1 1 A 21 21 GLY HA3 H 21 3.900 3.869 0.031 1
1 100 . 20 1 1 A 21 21 GLY CA C 21 45.628 46.532 -0.904 1
1 101 . 20 1 1 A 21 21 GLY N N 21 110.734 110.049 0.685 1
1 102 . 20 1 1 A 22 22 LYS H H 22 7.362 7.376 -0.014 1
1 103 . 20 1 1 A 22 22 LYS CA C 22 60.163 58.074 2.089 1
1 104 . 20 1 1 A 22 22 LYS CB C 22 32.554 33.897 -1.343 1
1 105 . 20 1 1 A 22 22 LYS N N 22 122.161 120.917 1.244 1
1 106 . 20 1 1 A 23 23 GLU H H 23 9.639 7.493 2.146 1
1 107 . 20 1 1 A 23 23 GLU CA C 23 54.449 55.372 -0.923 1
1 108 . 20 1 1 A 23 23 GLU N N 23 116.288 116.242 0.046 1
1 109 . 20 1 1 A 24 24 GLY HA2 H 24 3.912 4.008 -0.096 1
1 110 . 20 1 1 A 24 24 GLY HA3 H 24 3.787 4.020 -0.233 1
1 111 . 20 1 1 A 24 24 GLY CA C 24 45.898 44.524 1.374 1
1 112 . 20 1 1 A 25 25 ASP H H 25 8.204 8.438 -0.234 1
1 113 . 20 1 1 A 25 25 ASP CA C 25 55.252 54.505 0.747 1
1 114 . 20 1 1 A 25 25 ASP N N 25 125.671 121.883 3.788 1
1 115 . 20 1 1 A 26 26 LYS CA C 26 57.851 58.904 -1.053 1
1 116 . 20 1 1 A 26 26 LYS CB C 26 31.265 32.500 -1.235 1
1 117 . 20 1 1 A 27 27 HIS H H 27 9.763 7.980 1.783 1
1 118 . 20 1 1 A 27 27 HIS CA C 27 55.580 57.299 -1.719 1
1 119 . 20 1 1 A 27 27 HIS CB C 27 30.936 30.214 0.722 1
1 120 . 20 1 1 A 27 27 HIS N N 27 118.108 118.761 -0.653 1
1 121 . 20 1 1 A 28 28 THR H H 28 7.325 7.791 -0.466 1
1 126 . 20 1 1 A 28 28 THR CA C 28 60.128 60.238 -0.110 1
1 127 . 20 1 1 A 28 28 THR CB C 28 72.268 72.923 -0.655 1
1 128 . 20 1 1 A 28 28 THR N N 28 106.920 111.583 -4.663 1
1 129 . 20 1 1 A 29 29 LEU H H 29 9.422 9.352 0.070 1
1 130 . 20 1 1 A 29 29 LEU HA H 29 5.368 4.825 0.543 1
1 140 . 20 1 1 A 29 29 LEU CA C 29 52.567 53.264 -0.697 1
1 141 . 20 1 1 A 29 29 LEU CB C 29 43.523 45.407 -1.884 1
1 142 . 20 1 1 A 29 29 LEU N N 29 125.021 122.270 2.751 1
1 143 . 20 1 1 A 30 30 SER H H 30 10.485 8.816 1.669 1
1 144 . 20 1 1 A 30 30 SER CA C 30 56.653 58.242 -1.589 1
1 145 . 20 1 1 A 30 30 SER CB C 30 65.313 63.877 1.436 1
1 146 . 20 1 1 A 30 30 SER N N 30 124.758 119.211 5.547 1
1 147 . 20 1 1 A 31 31 LYS H H 31 8.728 8.894 -0.166 1
1 148 . 20 1 1 A 31 31 LYS CA C 31 59.669 59.318 0.351 1
1 149 . 20 1 1 A 31 31 LYS CB C 31 31.763 31.977 -0.214 1
1 150 . 20 1 1 A 31 31 LYS N N 31 119.459 123.623 -4.164 1
1 151 . 20 1 1 A 32 32 LYS H H 32 7.857 8.107 -0.250 1
1 152 . 20 1 1 A 32 32 LYS CA C 32 59.721 58.917 0.804 1
1 153 . 20 1 1 A 32 32 LYS CB C 32 32.901 31.855 1.046 1
1 154 . 20 1 1 A 32 32 LYS N N 32 117.933 118.906 -0.973 1
1 155 . 20 1 1 A 33 33 GLU H H 33 7.559 7.955 -0.396 1
1 156 . 20 1 1 A 33 33 GLU CA C 33 59.169 58.926 0.243 1
1 157 . 20 1 1 A 33 33 GLU CB C 33 31.014 29.123 1.891 1
1 158 . 20 1 1 A 33 33 GLU N N 33 120.407 119.593 0.814 1
1 159 . 20 1 1 A 34 34 LEU H H 34 8.833 8.225 0.608 1
1 160 . 20 1 1 A 34 34 LEU CA C 34 56.928 57.761 -0.833 1
1 161 . 20 1 1 A 34 34 LEU CB C 34 41.435 41.633 -0.198 1
1 162 . 20 1 1 A 34 34 LEU N N 34 117.677 121.319 -3.642 1
1 163 . 20 1 1 A 35 35 LYS H H 35 8.010 8.074 -0.064 1
1 164 . 20 1 1 A 35 35 LYS CA C 35 60.692 59.893 0.799 1
1 165 . 20 1 1 A 35 35 LYS CB C 35 32.223 32.165 0.058 1
1 166 . 20 1 1 A 35 35 LYS N N 35 119.829 118.890 0.939 1
1 167 . 20 1 1 A 36 36 GLU H H 36 7.169 7.732 -0.563 1
1 168 . 20 1 1 A 36 36 GLU CA C 36 59.588 59.133 0.455 1
1 169 . 20 1 1 A 36 36 GLU CB C 36 29.342 29.539 -0.197 1
1 170 . 20 1 1 A 36 36 GLU N N 36 117.340 119.763 -2.423 1
1 171 . 20 1 1 A 37 37 LEU H H 37 7.478 7.993 -0.515 1
1 172 . 20 1 1 A 37 37 LEU CA C 37 59.674 57.709 1.965 1
1 173 . 20 1 1 A 37 37 LEU CB C 37 42.142 40.929 1.213 1
1 174 . 20 1 1 A 37 37 LEU N N 37 120.884 121.221 -0.337 1
1 175 . 20 1 1 A 38 38 ILE H H 38 8.377 8.157 0.220 1
1 176 . 20 1 1 A 38 38 ILE CA C 38 65.651 65.581 0.070 1
1 177 . 20 1 1 A 38 38 ILE N N 38 118.450 119.963 -1.513 1
1 178 . 20 1 1 A 39 39 GLN H H 39 8.217 8.130 0.087 1
1 179 . 20 1 1 A 39 39 GLN CA C 39 59.788 58.816 0.972 1
1 180 . 20 1 1 A 39 39 GLN CB C 39 29.278 28.261 1.017 1
1 181 . 20 1 1 A 39 39 GLN N N 39 113.091 118.066 -4.975 1
1 182 . 20 1 1 A 40 40 LYS H H 40 8.426 7.813 0.613 1
1 183 . 20 1 1 A 40 40 LYS CA C 40 57.807 59.005 -1.198 1
1 184 . 20 1 1 A 40 40 LYS CB C 40 33.942 32.854 1.088 1
1 185 . 20 1 1 A 40 40 LYS N N 40 114.771 120.118 -5.347 1
1 186 . 20 1 1 A 41 41 GLU H H 41 8.496 8.449 0.047 1
1 187 . 20 1 1 A 41 41 GLU CA C 41 55.395 58.981 -3.586 1
1 188 . 20 1 1 A 41 41 GLU CB C 41 29.260 30.080 -0.820 1
1 189 . 20 1 1 A 41 41 GLU N N 41 112.546 119.227 -6.681 1
1 190 . 20 1 1 A 42 42 LEU H H 42 7.267 7.601 -0.334 1
1 191 . 20 1 1 A 42 42 LEU CA C 42 53.776 56.748 -2.972 1
1 192 . 20 1 1 A 42 42 LEU N N 42 118.657 118.634 0.023 1
1 193 . 20 1 1 A 44 44 ILE CA C 44 62.210 59.688 2.522 1
1 194 . 20 1 1 A 44 44 ILE CB C 44 38.247 41.397 -3.150 1
1 195 . 20 1 1 A 45 45 GLY H H 45 7.820 8.584 -0.764 1
1 196 . 20 1 1 A 45 45 GLY CA C 45 47.742 44.388 3.354 1
1 197 . 20 1 1 A 45 45 GLY N N 45 108.178 116.445 -8.267 1
1 198 . 20 1 1 A 46 46 SER H H 46 7.895 8.532 -0.637 1
1 199 . 20 1 1 A 46 46 SER CA C 46 59.958 57.440 2.518 1
1 200 . 20 1 1 A 46 46 SER CB C 46 63.450 61.835 1.615 1
1 201 . 20 1 1 A 46 46 SER N N 46 113.038 115.172 -2.134 1
1 202 . 20 1 1 A 47 47 LYS H H 47 7.736 8.330 -0.594 1
1 203 . 20 1 1 A 47 47 LYS CA C 47 55.636 57.886 -2.250 1
1 204 . 20 1 1 A 47 47 LYS CB C 47 33.103 32.363 0.740 1
1 205 . 20 1 1 A 47 47 LYS N N 47 119.422 118.856 0.566 1
1 206 . 20 1 1 A 48 48 LEU H H 48 6.988 8.303 -1.315 1
1 207 . 20 1 1 A 48 48 LEU HA H 48 4.497 3.922 0.575 1
1 217 . 20 1 1 A 48 48 LEU CA C 48 54.517 58.512 -3.995 1
1 218 . 20 1 1 A 48 48 LEU CB C 48 42.987 41.125 1.862 1
1 219 . 20 1 1 A 48 48 LEU N N 48 118.908 116.476 2.432 1
1 220 . 20 1 1 A 49 49 GLN H H 49 9.206 8.184 1.022 1
1 221 . 20 1 1 A 49 49 GLN HA H 49 4.486 4.025 0.461 1
1 223 . 20 1 1 A 49 49 GLN CA C 49 54.785 58.553 -3.768 1
1 224 . 20 1 1 A 49 49 GLN CB C 49 29.636 28.121 1.515 1
1 225 . 20 1 1 A 49 49 GLN N N 49 121.275 118.865 2.410 1
1 226 . 20 1 1 A 50 50 ASP H H 50 8.854 8.187 0.667 1
1 227 . 20 1 1 A 50 50 ASP CA C 50 59.078 56.421 2.657 1
1 228 . 20 1 1 A 50 50 ASP CB C 50 40.632 40.971 -0.339 1
1 229 . 20 1 1 A 50 50 ASP N N 50 123.430 119.547 3.883 1
1 230 . 20 1 1 A 51 51 ALA H H 51 8.720 8.368 0.352 1
1 231 . 20 1 1 A 51 51 ALA CA C 51 55.281 54.898 0.383 1
1 232 . 20 1 1 A 51 51 ALA CB C 51 18.205 18.077 0.128 1
1 233 . 20 1 1 A 51 51 ALA N N 51 117.829 121.117 -3.288 1
1 234 . 20 1 1 A 52 52 GLU H H 52 7.161 7.666 -0.505 1
1 235 . 20 1 1 A 52 52 GLU CA C 52 58.757 59.188 -0.431 1
1 236 . 20 1 1 A 52 52 GLU CB C 52 30.247 30.054 0.193 1
1 237 . 20 1 1 A 52 52 GLU N N 52 115.459 117.606 -2.147 1
1 238 . 20 1 1 A 53 53 ILE H H 53 7.962 7.543 0.419 1
1 239 . 20 1 1 A 53 53 ILE CA C 53 65.525 64.337 1.188 1
1 240 . 20 1 1 A 53 53 ILE CB C 53 37.289 36.467 0.822 1
1 241 . 20 1 1 A 53 53 ILE N N 53 120.414 121.064 -0.650 1
1 242 . 20 1 1 A 54 54 VAL H H 54 8.132 8.330 -0.198 1
1 243 . 20 1 1 A 54 54 VAL CA C 54 67.290 65.706 1.584 1
1 244 . 20 1 1 A 54 54 VAL CB C 54 31.434 31.395 0.039 1
1 245 . 20 1 1 A 54 54 VAL N N 54 119.775 118.464 1.311 1
1 246 . 20 1 1 A 55 55 LYS H H 55 7.155 8.007 -0.852 1
1 247 . 20 1 1 A 55 55 LYS CA C 55 59.131 59.355 -0.224 1
1 248 . 20 1 1 A 55 55 LYS CB C 55 32.131 32.096 0.035 1
1 249 . 20 1 1 A 55 55 LYS N N 55 119.175 121.266 -2.091 1
1 250 . 20 1 1 A 56 56 LEU H H 56 7.837 7.905 -0.068 1
1 251 . 20 1 1 A 56 56 LEU CA C 56 58.052 58.041 0.011 1
1 252 . 20 1 1 A 56 56 LEU CB C 56 41.878 41.339 0.539 1
1 253 . 20 1 1 A 56 56 LEU N N 56 119.679 120.632 -0.953 1
1 254 . 20 1 1 A 57 57 MET H H 57 8.385 8.720 -0.335 1
1 255 . 20 1 1 A 57 57 MET CA C 57 60.756 58.750 2.006 1
1 256 . 20 1 1 A 57 57 MET CB C 57 33.152 31.844 1.308 1
1 257 . 20 1 1 A 57 57 MET N N 57 115.116 119.261 -4.145 1
1 258 . 20 1 1 A 58 58 ASP H H 58 7.591 8.296 -0.705 1
1 259 . 20 1 1 A 58 58 ASP CA C 58 57.365 57.011 0.354 1
1 260 . 20 1 1 A 58 58 ASP CB C 58 40.858 40.779 0.079 1
1 261 . 20 1 1 A 58 58 ASP N N 58 118.197 119.507 -1.310 1
1 262 . 20 1 1 A 59 59 ASP H H 59 7.725 7.970 -0.245 1
1 263 . 20 1 1 A 59 59 ASP CA C 59 56.830 56.708 0.122 1
1 264 . 20 1 1 A 59 59 ASP CB C 59 40.567 40.585 -0.018 1
1 265 . 20 1 1 A 59 59 ASP N N 59 118.481 118.327 0.154 1
1 266 . 20 1 1 A 60 60 LEU H H 60 7.703 7.587 0.116 1
1 267 . 20 1 1 A 60 60 LEU CA C 60 56.564 57.271 -0.707 1
1 268 . 20 1 1 A 60 60 LEU CB C 60 42.714 41.351 1.363 1
1 269 . 20 1 1 A 60 60 LEU N N 60 116.935 120.178 -3.243 1
1 270 . 20 1 1 A 61 61 ASP H H 61 7.143 8.347 -1.204 1
1 271 . 20 1 1 A 61 61 ASP HA H 61 4.690 4.462 0.228 1
1 274 . 20 1 1 A 61 61 ASP CA C 61 52.286 56.456 -4.170 1
1 275 . 20 1 1 A 61 61 ASP CB C 61 39.245 41.613 -2.368 1
1 276 . 20 1 1 A 61 61 ASP N N 61 116.605 118.987 -2.382 1
1 277 . 20 1 1 A 62 62 ARG H H 62 7.786 8.126 -0.340 1
1 278 . 20 1 1 A 62 62 ARG CA C 62 58.328 58.803 -0.475 1
1 279 . 20 1 1 A 62 62 ARG CB C 62 30.106 29.850 0.256 1
1 280 . 20 1 1 A 62 62 ARG N N 62 125.967 118.813 7.154 1
1 281 . 20 1 1 A 63 63 ASN H H 63 7.945 7.889 0.056 1
1 282 . 20 1 1 A 63 63 ASN CA C 63 51.863 56.521 -4.658 1
1 283 . 20 1 1 A 63 63 ASN CB C 63 36.809 38.779 -1.970 1
1 284 . 20 1 1 A 63 63 ASN N N 63 112.434 117.100 -4.666 1
1 285 . 20 1 1 A 64 64 LYS H H 64 7.477 7.538 -0.061 1
1 286 . 20 1 1 A 64 64 LYS CA C 64 56.524 57.227 -0.703 1
1 287 . 20 1 1 A 64 64 LYS N N 64 114.197 117.651 -3.454 1
1 288 . 20 1 1 A 65 65 ASP H H 65 8.345 8.667 -0.322 1
1 289 . 20 1 1 A 65 65 ASP CA C 65 52.969 55.780 -2.811 1
1 290 . 20 1 1 A 65 65 ASP CB C 65 40.329 43.741 -3.412 1
1 291 . 20 1 1 A 65 65 ASP N N 65 118.581 120.828 -2.247 1
1 292 . 20 1 1 A 66 66 GLN H H 66 9.945 8.282 1.663 1
1 293 . 20 1 1 A 66 66 GLN CA C 66 58.132 55.356 2.776 1
1 294 . 20 1 1 A 66 66 GLN CB C 66 26.035 30.734 -4.699 1
1 295 . 20 1 1 A 66 66 GLN N N 66 113.203 115.731 -2.528 1
1 296 . 20 1 1 A 67 67 GLU H H 67 7.880 7.962 -0.082 1
1 297 . 20 1 1 A 67 67 GLU HA H 67 4.910 5.095 -0.185 1
1 302 . 20 1 1 A 67 67 GLU CA C 67 54.082 54.990 -0.908 1
1 303 . 20 1 1 A 67 67 GLU CB C 67 33.174 32.768 0.406 1
1 304 . 20 1 1 A 67 67 GLU N N 67 118.554 116.941 1.613 1
1 305 . 20 1 1 A 68 68 VAL H H 68 9.669 9.122 0.547 1
1 306 . 20 1 1 A 68 68 VAL HA H 68 5.465 4.627 0.838 1
1 314 . 20 1 1 A 68 68 VAL CA C 68 61.079 61.213 -0.134 1
1 315 . 20 1 1 A 68 68 VAL CB C 68 33.280 33.963 -0.683 1
1 316 . 20 1 1 A 68 68 VAL N N 68 126.572 122.996 3.576 1
1 317 . 20 1 1 A 69 69 ASN H H 69 8.985 8.546 0.439 1
1 318 . 20 1 1 A 69 69 ASN CA C 69 50.812 52.092 -1.280 1
1 319 . 20 1 1 A 69 69 ASN CB C 69 38.609 40.778 -2.169 1
1 320 . 20 1 1 A 69 69 ASN N N 69 127.472 125.781 1.691 1
1 321 . 20 1 1 A 70 70 PHE H H 70 9.100 8.737 0.363 1
1 322 . 20 1 1 A 70 70 PHE CA C 70 63.279 62.112 1.167 1
1 323 . 20 1 1 A 70 70 PHE CB C 70 38.741 39.695 -0.954 1
1 324 . 20 1 1 A 70 70 PHE N N 70 119.972 126.658 -6.686 1
1 325 . 20 1 1 A 71 71 GLN H H 71 8.342 8.145 0.197 1
1 326 . 20 1 1 A 71 71 GLN HA H 71 3.923 3.828 0.095 1
1 329 . 20 1 1 A 71 71 GLN CA C 71 59.866 58.564 1.302 1
1 330 . 20 1 1 A 71 71 GLN CB C 71 27.878 28.356 -0.478 1
1 331 . 20 1 1 A 71 71 GLN N N 71 118.216 118.032 0.184 1
1 332 . 20 1 1 A 72 72 GLU H H 72 8.721 8.041 0.680 1
1 333 . 20 1 1 A 72 72 GLU HA H 72 4.147 4.139 0.008 1
1 338 . 20 1 1 A 72 72 GLU CA C 72 59.313 58.813 0.500 1
1 339 . 20 1 1 A 72 72 GLU CB C 72 30.233 29.412 0.821 1
1 340 . 20 1 1 A 72 72 GLU N N 72 121.455 119.891 1.564 1
1 341 . 20 1 1 A 73 73 TYR H H 73 8.536 8.038 0.498 1
1 342 . 20 1 1 A 73 73 TYR CA C 73 60.961 61.541 -0.580 1
1 343 . 20 1 1 A 73 73 TYR CB C 73 38.724 38.830 -0.106 1
1 344 . 20 1 1 A 73 73 TYR N N 73 123.356 122.445 0.911 1
1 345 . 20 1 1 A 74 74 ILE H H 74 8.642 7.781 0.861 1
1 346 . 20 1 1 A 74 74 ILE CA C 74 61.880 64.078 -2.198 1
1 347 . 20 1 1 A 74 74 ILE CB C 74 36.077 36.994 -0.917 1
1 348 . 20 1 1 A 74 74 ILE N N 74 119.799 120.636 -0.837 1
1 349 . 20 1 1 A 75 75 THR H H 75 7.959 8.259 -0.300 1
1 354 . 20 1 1 A 75 75 THR CA C 75 67.056 66.814 0.242 1
1 355 . 20 1 1 A 75 75 THR CB C 75 68.386 68.519 -0.133 1
1 356 . 20 1 1 A 75 75 THR N N 75 119.486 117.825 1.661 1
1 357 . 20 1 1 A 76 76 PHE H H 76 7.450 8.339 -0.889 1
1 358 . 20 1 1 A 76 76 PHE CA C 76 59.010 61.720 -2.710 1
1 359 . 20 1 1 A 76 76 PHE CB C 76 38.139 39.221 -1.082 1
1 360 . 20 1 1 A 76 76 PHE N N 76 122.873 121.856 1.017 1
1 361 . 20 1 1 A 77 77 LEU H H 77 7.829 8.229 -0.400 1
1 362 . 20 1 1 A 77 77 LEU CA C 77 57.450 57.665 -0.215 1
1 363 . 20 1 1 A 77 77 LEU CB C 77 40.560 41.181 -0.621 1
1 364 . 20 1 1 A 77 77 LEU N N 77 117.405 118.528 -1.123 1
1 365 . 20 1 1 A 78 78 GLY H H 78 8.093 8.216 -0.123 1
1 366 . 20 1 1 A 78 78 GLY HA2 H 78 3.661 3.764 -0.103 1
1 367 . 20 1 1 A 78 78 GLY HA3 H 78 3.594 3.770 -0.176 1
1 368 . 20 1 1 A 78 78 GLY CA C 78 47.442 47.179 0.263 1
1 369 . 20 1 1 A 78 78 GLY N N 78 105.528 106.235 -0.707 1
1 370 . 20 1 1 A 79 79 ALA H H 79 7.759 7.736 0.023 1
1 371 . 20 1 1 A 79 79 ALA CA C 79 55.153 54.641 0.512 1
1 372 . 20 1 1 A 79 79 ALA CB C 79 17.768 18.469 -0.701 1
1 373 . 20 1 1 A 79 79 ALA N N 79 124.488 125.205 -0.717 1
1 374 . 20 1 1 A 80 80 LEU H H 80 7.963 8.054 -0.091 1
1 375 . 20 1 1 A 80 80 LEU CA C 80 57.464 57.709 -0.245 1
1 376 . 20 1 1 A 80 80 LEU CB C 80 41.496 41.360 0.136 1
1 377 . 20 1 1 A 80 80 LEU N N 80 117.869 120.088 -2.219 1
1 378 . 20 1 1 A 81 81 ALA H H 81 8.365 8.353 0.012 1
1 379 . 20 1 1 A 81 81 ALA CA C 81 55.475 55.127 0.348 1
1 380 . 20 1 1 A 81 81 ALA CB C 81 17.483 18.128 -0.645 1
1 381 . 20 1 1 A 81 81 ALA N N 81 119.054 120.443 -1.389 1
1 382 . 20 1 1 A 82 82 MET H H 82 8.112 7.840 0.272 1
1 383 . 20 1 1 A 82 82 MET CA C 82 59.516 58.144 1.372 1
1 384 . 20 1 1 A 82 82 MET CB C 82 32.550 32.207 0.343 1
1 385 . 20 1 1 A 82 82 MET N N 82 115.364 117.918 -2.554 1
1 386 . 20 1 1 A 83 83 ILE H H 83 7.981 8.125 -0.144 1
1 387 . 20 1 1 A 83 83 ILE HA H 83 3.839 3.551 0.288 1
1 391 . 20 1 1 A 83 83 ILE CA C 83 64.467 65.149 -0.682 1
1 392 . 20 1 1 A 83 83 ILE CB C 83 37.312 37.472 -0.160 1
1 393 . 20 1 1 A 83 83 ILE N N 83 120.887 119.580 1.307 1
1 394 . 20 1 1 A 84 84 TYR H H 84 8.731 7.839 0.892 1
1 395 . 20 1 1 A 84 84 TYR N N 84 120.933 119.160 1.773 1
1 396 . 20 1 1 A 87 87 ALA H H 87 7.829 7.627 0.202 1
1 397 . 20 1 1 A 87 87 ALA CA C 87 53.768 54.184 -0.416 1
1 398 . 20 1 1 A 87 87 ALA CB C 87 18.504 18.362 0.142 1
1 399 . 20 1 1 A 87 87 ALA N N 87 120.274 121.320 -1.046 1
1 400 . 20 1 1 A 88 88 LEU H H 88 7.499 7.314 0.185 1
1 401 . 20 1 1 A 88 88 LEU CA C 88 55.605 54.738 0.867 1
1 402 . 20 1 1 A 88 88 LEU CB C 88 42.047 41.842 0.205 1
1 403 . 20 1 1 A 88 88 LEU N N 88 117.356 116.022 1.334 1
1 404 . 20 1 1 A 89 89 LYS H H 89 7.561 7.690 -0.129 1
1 405 . 20 1 1 A 89 89 LYS CA C 89 56.865 56.067 0.798 1
1 406 . 20 1 1 A 89 89 LYS CB C 89 32.592 34.046 -1.454 1
1 407 . 20 1 1 A 89 89 LYS N N 89 119.289 117.311 1.978 1
1 416 . 20 3 2 C 6 6 GLU H H 190 8.385 8.538 -0.153 1
1 417 . 20 3 2 C 6 6 GLU HA H 190 4.153 4.369 -0.216 1
1 422 . 20 3 2 C 6 6 GLU C C 190 175.031 177.449 -2.418 1
1 423 . 20 3 2 C 6 6 GLU CA C 190 58.866 56.591 2.275 1
1 424 . 20 3 2 C 6 6 GLU CB C 190 30.751 30.373 0.378 1
1 426 . 20 3 2 C 6 6 GLU N N 190 122.715 122.730 -0.015 1
1 427 . 20 3 2 C 7 7 GLY H H 191 8.475 8.612 -0.137 1
1 428 . 20 3 2 C 7 7 GLY HA2 H 191 3.887 4.086 -0.199 1
1 429 . 20 3 2 C 7 7 GLY HA3 H 191 3.887 4.087 -0.200 1
1 430 . 20 3 2 C 7 7 GLY C C 191 177.922 174.866 3.056 1
1 431 . 20 3 2 C 7 7 GLY CA C 191 46.884 45.002 1.882 1
1 432 . 20 3 2 C 7 7 GLY N N 191 109.009 110.023 -1.014 1
1 433 . 20 3 2 C 8 8 LEU HA H 192 4.095 3.911 0.184 1
1 443 . 20 3 2 C 8 8 LEU CA C 192 58.154 58.107 0.047 1
1 444 . 20 3 2 C 8 8 LEU CB C 192 42.789 41.722 1.067 1
1 448 . 20 3 2 C 9 9 MET H H 193 8.250 8.179 0.071 1
1 449 . 20 3 2 C 9 9 MET HA H 193 4.150 4.158 -0.008 1
1 457 . 20 3 2 C 9 9 MET C C 193 178.421 178.154 0.267 1
1 458 . 20 3 2 C 9 9 MET CA C 193 58.818 58.524 0.294 1
1 459 . 20 3 2 C 9 9 MET CB C 193 32.360 31.838 0.522 1
1 462 . 20 3 2 C 9 9 MET N N 193 117.049 118.742 -1.693 1
1 463 . 20 3 2 C 10 10 ASN H H 194 7.892 8.123 -0.231 1
1 464 . 20 3 2 C 10 10 ASN HA H 194 4.468 4.546 -0.078 1
1 469 . 20 3 2 C 10 10 ASN C C 194 178.099 176.669 1.430 1
1 470 . 20 3 2 C 10 10 ASN CA C 194 56.644 55.258 1.386 1
1 471 . 20 3 2 C 10 10 ASN CB C 194 39.100 38.417 0.683 1
1 472 . 20 3 2 C 10 10 ASN N N 194 117.034 118.637 -1.603 1
1 474 . 20 3 2 C 11 11 VAL H H 195 7.651 7.665 -0.014 1
1 475 . 20 3 2 C 11 11 VAL HA H 195 3.735 3.870 -0.135 1
1 483 . 20 3 2 C 11 11 VAL C C 195 177.657 178.260 -0.603 1
1 484 . 20 3 2 C 11 11 VAL CA C 195 66.710 65.031 1.679 1
1 485 . 20 3 2 C 11 11 VAL CB C 195 32.468 32.183 0.285 1
1 488 . 20 3 2 C 11 11 VAL N N 195 119.878 117.693 2.185 1
1 489 . 20 3 2 C 12 12 LEU H H 196 8.030 8.357 -0.327 1
1 490 . 20 3 2 C 12 12 LEU HA H 196 4.013 4.019 -0.006 1
1 500 . 20 3 2 C 12 12 LEU C C 196 177.540 179.384 -1.844 1
1 501 . 20 3 2 C 12 12 LEU CA C 196 58.489 57.442 1.047 1
1 502 . 20 3 2 C 12 12 LEU CB C 196 42.457 41.010 1.447 1
1 506 . 20 3 2 C 12 12 LEU N N 196 119.499 119.382 0.117 1
1 507 . 20 3 2 C 13 13 LYS H H 197 8.015 8.338 -0.323 1
1 508 . 20 3 2 C 13 13 LYS HA H 197 3.949 4.093 -0.144 1
1 517 . 20 3 2 C 13 13 LYS C C 197 178.419 179.004 -0.585 1
1 518 . 20 3 2 C 13 13 LYS CA C 197 60.191 59.296 0.895 1
1 519 . 20 3 2 C 13 13 LYS CB C 197 33.075 32.029 1.046 1
1 523 . 20 3 2 C 13 13 LYS N N 197 117.888 121.350 -3.462 1
1 524 . 20 3 2 C 14 14 LYS H H 198 7.506 7.497 0.009 1
1 525 . 20 3 2 C 14 14 LYS HA H 198 4.127 4.068 0.059 1
1 534 . 20 3 2 C 14 14 LYS C C 198 178.262 179.327 -1.065 1
1 535 . 20 3 2 C 14 14 LYS CA C 198 59.161 58.917 0.244 1
1 536 . 20 3 2 C 14 14 LYS CB C 198 32.956 31.662 1.294 1
1 540 . 20 3 2 C 14 14 LYS N N 198 118.321 118.525 -0.204 1
1 541 . 20 3 2 C 15 15 ILE H H 199 7.780 8.036 -0.256 1
1 542 . 20 3 2 C 15 15 ILE HA H 199 3.787 3.889 -0.102 1
1 552 . 20 3 2 C 15 15 ILE C C 199 178.647 178.030 0.617 1
1 553 . 20 3 2 C 15 15 ILE CA C 199 64.912 64.221 0.691 1
1 554 . 20 3 2 C 15 15 ILE CB C 199 38.780 36.924 1.856 1
1 558 . 20 3 2 C 15 15 ILE N N 199 118.644 120.792 -2.148 1
1 559 . 20 3 2 C 16 16 TYR H H 200 7.918 8.506 -0.588 1
1 560 . 20 3 2 C 16 16 TYR HA H 200 4.252 4.019 0.233 1
1 567 . 20 3 2 C 16 16 TYR C C 200 177.806 177.986 -0.180 1
1 568 . 20 3 2 C 16 16 TYR CA C 200 61.171 62.098 -0.927 1
1 569 . 20 3 2 C 16 16 TYR CB C 200 39.245 38.932 0.313 1
1 573 . 20 3 2 C 16 16 TYR N N 200 118.683 122.484 -3.801 1
1 574 . 20 3 2 C 17 17 GLU H H 201 8.089 8.385 -0.296 1
1 575 . 20 3 2 C 17 17 GLU HA H 201 4.124 4.027 0.097 1
1 580 . 20 3 2 C 17 17 GLU C C 201 177.414 178.050 -0.636 1
1 581 . 20 3 2 C 17 17 GLU CA C 201 58.784 57.607 1.177 1
1 582 . 20 3 2 C 17 17 GLU CB C 201 30.747 28.904 1.843 1
1 584 . 20 3 2 C 17 17 GLU N N 201 119.409 117.204 2.205 1
1 585 . 20 3 2 C 18 18 ASP H H 202 8.023 7.899 0.124 1
1 586 . 20 3 2 C 18 18 ASP HA H 202 4.657 4.522 0.135 1
1 589 . 20 3 2 C 18 18 ASP C C 202 177.346 176.291 1.055 1
1 590 . 20 3 2 C 18 18 ASP CA C 202 55.496 55.323 0.173 1
1 591 . 20 3 2 C 18 18 ASP CB C 202 42.023 41.842 0.181 1
1 592 . 20 3 2 C 18 18 ASP N N 202 119.459 120.133 -0.674 1
1 593 . 20 3 2 C 19 19 GLY H H 203 7.933 7.463 0.470 1
1 594 . 20 3 2 C 19 19 GLY HA2 H 203 3.938 4.051 -0.113 1
1 595 . 20 3 2 C 19 19 GLY HA3 H 203 3.938 4.057 -0.119 1
1 596 . 20 3 2 C 19 19 GLY C C 203 177.240 170.706 6.534 1
1 597 . 20 3 2 C 19 19 GLY CA C 203 46.309 45.544 0.765 1
1 598 . 20 3 2 C 19 19 GLY N N 203 108.518 105.836 2.682 1
1 599 . 20 3 2 C 20 20 ASP H H 204 8.091 8.617 -0.526 1
1 600 . 20 3 2 C 20 20 ASP HA H 204 4.616 5.321 -0.705 1
1 603 . 20 3 2 C 20 20 ASP C C 204 173.979 174.201 -0.222 1
1 604 . 20 3 2 C 20 20 ASP CA C 204 55.064 53.130 1.934 1
1 605 . 20 3 2 C 20 20 ASP CB C 204 42.203 43.883 -1.680 1
1 606 . 20 3 2 C 20 20 ASP N N 204 120.172 117.950 2.222 1
1 607 . 20 3 2 C 21 21 ASP H H 205 8.352 8.658 -0.306 1
1 608 . 20 3 2 C 21 21 ASP HA H 205 4.468 4.668 -0.200 1
1 611 . 20 3 2 C 21 21 ASP C C 205 176.432 176.819 -0.387 1
1 612 . 20 3 2 C 21 21 ASP CA C 205 56.663 55.925 0.738 1
1 613 . 20 3 2 C 21 21 ASP CB C 205 41.918 42.138 -0.220 1
1 614 . 20 3 2 C 21 21 ASP N N 205 121.515 119.090 2.425 1
1 615 . 20 3 2 C 22 22 ASP H H 206 8.239 8.864 -0.625 1
1 616 . 20 3 2 C 22 22 ASP HA H 206 4.455 4.565 -0.110 1
1 619 . 20 3 2 C 22 22 ASP C C 206 177.449 178.398 -0.949 1
1 620 . 20 3 2 C 22 22 ASP CA C 206 57.165 56.935 0.230 1
1 621 . 20 3 2 C 22 22 ASP CB C 206 41.820 40.059 1.761 1
1 622 . 20 3 2 C 22 22 ASP N N 206 120.156 121.250 -1.094 1
1 623 . 20 3 2 C 23 23 MET H H 207 8.300 8.192 0.108 1
1 624 . 20 3 2 C 23 23 MET HA H 207 4.255 3.971 0.284 1
1 632 . 20 3 2 C 23 23 MET C C 207 178.412 178.285 0.127 1
1 633 . 20 3 2 C 23 23 MET CA C 207 58.065 58.874 -0.809 1
1 634 . 20 3 2 C 23 23 MET CB C 207 32.488 32.024 0.464 1
1 637 . 20 3 2 C 23 23 MET N N 207 120.707 119.559 1.148 1
1 638 . 20 3 2 C 24 24 LYS H H 208 8.047 7.583 0.464 1
1 639 . 20 3 2 C 24 24 LYS HA H 208 3.946 4.208 -0.262 1
1 648 . 20 3 2 C 24 24 LYS C C 208 178.008 179.114 -1.106 1
1 649 . 20 3 2 C 24 24 LYS CA C 208 59.847 58.917 0.930 1
1 650 . 20 3 2 C 24 24 LYS CB C 208 32.983 32.634 0.349 1
1 654 . 20 3 2 C 24 24 LYS N N 208 119.504 119.144 0.360 1
1 655 . 20 3 2 C 25 25 ARG H H 209 7.891 7.958 -0.067 1
1 656 . 20 3 2 C 25 25 ARG HA H 209 4.168 4.120 0.048 1
1 663 . 20 3 2 C 25 25 ARG C C 209 178.100 178.485 -0.385 1
1 664 . 20 3 2 C 25 25 ARG CA C 209 58.810 58.959 -0.149 1
1 665 . 20 3 2 C 25 25 ARG CB C 209 31.080 30.739 0.341 1
1 668 . 20 3 2 C 25 25 ARG N N 209 118.378 119.132 -0.754 1
1 669 . 20 3 2 C 26 26 THR H H 210 7.869 8.519 -0.650 1
1 670 . 20 3 2 C 26 26 THR HA H 210 4.023 3.990 0.033 1
1 675 . 20 3 2 C 26 26 THR C C 210 177.984 177.075 0.909 1
1 676 . 20 3 2 C 26 26 THR CA C 210 65.747 67.052 -1.305 1
1 677 . 20 3 2 C 26 26 THR CB C 210 69.683 68.365 1.318 1
1 679 . 20 3 2 C 26 26 THR N N 210 115.443 117.001 -1.558 1
1 680 . 20 3 2 C 27 27 ILE H H 211 7.901 7.779 0.122 1
1 681 . 20 3 2 C 27 27 ILE HA H 211 4.142 3.824 0.318 1
1 691 . 20 3 2 C 27 27 ILE C C 211 175.595 178.185 -2.590 1
1 692 . 20 3 2 C 27 27 ILE CA C 211 63.528 64.555 -1.027 1
1 693 . 20 3 2 C 27 27 ILE CB C 211 38.982 37.636 1.346 1
1 697 . 20 3 2 C 27 27 ILE N N 211 121.265 117.529 3.736 1
1 698 . 20 3 2 C 28 28 ASN HA H 212 4.465 4.557 -0.092 1
1 703 . 20 3 2 C 28 28 ASN CA C 212 55.182 55.824 -0.642 1
1 704 . 20 3 2 C 28 28 ASN CB C 212 39.480 38.349 1.131 1
1 706 . 20 3 2 C 29 29 LYS H H 213 7.968 7.770 0.198 1
1 707 . 20 3 2 C 29 29 LYS HA H 213 4.072 4.009 0.063 1
1 716 . 20 3 2 C 29 29 LYS C C 213 176.218 179.717 -3.499 1
1 717 . 20 3 2 C 29 29 LYS CA C 213 58.489 59.656 -1.167 1
1 718 . 20 3 2 C 29 29 LYS CB C 213 33.165 32.343 0.822 1
1 722 . 20 3 2 C 29 29 LYS N N 213 120.820 118.997 1.823 1
1 723 . 20 3 2 C 30 30 ALA H H 214 7.865 8.295 -0.430 1
1 724 . 20 3 2 C 30 30 ALA HA H 214 4.217 4.159 0.058 1
1 728 . 20 3 2 C 30 30 ALA C C 214 177.041 179.762 -2.721 1
1 729 . 20 3 2 C 30 30 ALA CA C 214 54.104 54.950 -0.846 1
1 730 . 20 3 2 C 30 30 ALA CB C 214 19.496 18.253 1.243 1
1 731 . 20 3 2 C 30 30 ALA N N 214 121.571 121.770 -0.199 1
1 732 . 20 3 2 C 31 31 TRP H H 215 7.831 7.464 0.367 1
1 733 . 20 3 2 C 31 31 TRP HA H 215 4.598 4.307 0.291 1
1 742 . 20 3 2 C 31 31 TRP C C 215 178.088 178.087 0.001 1
1 743 . 20 3 2 C 31 31 TRP CA C 215 58.432 61.649 -3.217 1
1 744 . 20 3 2 C 31 31 TRP CB C 215 30.472 29.226 1.246 1
1 750 . 20 3 2 C 31 31 TRP N N 215 118.141 120.367 -2.226 1
1 752 . 20 3 2 C 32 32 VAL H H 216 7.594 8.581 -0.987 1
1 753 . 20 3 2 C 32 32 VAL HA H 216 3.978 3.450 0.528 1
1 761 . 20 3 2 C 32 32 VAL C C 216 176.574 177.703 -1.129 1
1 762 . 20 3 2 C 32 32 VAL CA C 216 63.329 64.946 -1.617 1
1 763 . 20 3 2 C 32 32 VAL CB C 216 33.373 31.380 1.993 1
1 766 . 20 3 2 C 32 32 VAL N N 216 118.287 119.359 -1.072 1
1 767 . 20 3 2 C 33 33 GLU H H 217 8.012 8.426 -0.414 1
1 768 . 20 3 2 C 33 33 GLU HA H 217 4.257 4.140 0.117 1
1 773 . 20 3 2 C 33 33 GLU C C 217 176.164 177.330 -1.166 1
1 774 . 20 3 2 C 33 33 GLU CA C 217 57.409 58.688 -1.279 1
1 775 . 20 3 2 C 33 33 GLU CB C 217 30.978 29.175 1.803 1
1 777 . 20 3 2 C 33 33 GLU N N 217 122.535 121.813 0.722 1
1 778 . 20 3 2 C 34 34 SER H H 218 8.037 7.268 0.769 1
1 779 . 20 3 2 C 34 34 SER HA H 218 4.514 4.475 0.039 1
1 782 . 20 3 2 C 34 34 SER C C 218 176.451 174.157 2.294 1
1 783 . 20 3 2 C 34 34 SER CA C 218 58.987 58.621 0.366 1
1 784 . 20 3 2 C 34 34 SER CB C 218 64.569 63.794 0.775 1
1 785 . 20 3 2 C 34 34 SER N N 218 117.058 113.925 3.133 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 84 1.548 1
3 1 1 1 "RMS(OBS, PRED)" CB 72 1.061 1
4 1 1 1 "RMS(OBS, PRED)" H 81 0.716 1
5 1 1 1 "RMS(OBS, PRED)" HA 21 0.343 1
6 1 1 1 "RMS(OBS, PRED)" N 81 3.040 1
7 1 1 2 "RMS(OBS, PRED)" C 27 1.669 1
8 1 1 2 "RMS(OBS, PRED)" CA 29 1.364 1
9 1 1 2 "RMS(OBS, PRED)" CB 27 1.194 1
10 1 1 2 "RMS(OBS, PRED)" H 27 0.442 1
11 1 1 2 "RMS(OBS, PRED)" HA 31 0.163 1
12 1 1 2 "RMS(OBS, PRED)" N 27 1.926 1
13 1 2 1 "RMS(OBS, PRED)" C 0 0.000 1
14 1 2 1 "RMS(OBS, PRED)" CA 84 1.542 1
15 1 2 1 "RMS(OBS, PRED)" CB 72 1.188 1
16 1 2 1 "RMS(OBS, PRED)" H 81 0.659 1
17 1 2 1 "RMS(OBS, PRED)" HA 21 0.307 1
18 1 2 1 "RMS(OBS, PRED)" N 81 3.285 1
19 1 2 2 "RMS(OBS, PRED)" C 27 1.812 1
20 1 2 2 "RMS(OBS, PRED)" CA 29 1.626 1
21 1 2 2 "RMS(OBS, PRED)" CB 27 1.315 1
22 1 2 2 "RMS(OBS, PRED)" H 27 0.367 1
23 1 2 2 "RMS(OBS, PRED)" HA 31 0.242 1
24 1 2 2 "RMS(OBS, PRED)" N 27 1.692 1
25 1 3 1 "RMS(OBS, PRED)" C 0 0.000 1
26 1 3 1 "RMS(OBS, PRED)" CA 84 1.432 1
27 1 3 1 "RMS(OBS, PRED)" CB 72 0.932 1
28 1 3 1 "RMS(OBS, PRED)" H 81 0.617 1
29 1 3 1 "RMS(OBS, PRED)" HA 21 0.290 1
30 1 3 1 "RMS(OBS, PRED)" N 81 3.389 1
31 1 3 2 "RMS(OBS, PRED)" C 27 1.844 1
32 1 3 2 "RMS(OBS, PRED)" CA 29 1.598 1
33 1 3 2 "RMS(OBS, PRED)" CB 27 1.369 1
34 1 3 2 "RMS(OBS, PRED)" H 27 0.482 1
35 1 3 2 "RMS(OBS, PRED)" HA 31 0.226 1
36 1 3 2 "RMS(OBS, PRED)" N 27 1.836 1
37 1 4 1 "RMS(OBS, PRED)" C 0 0.000 1
38 1 4 1 "RMS(OBS, PRED)" CA 84 1.464 1
39 1 4 1 "RMS(OBS, PRED)" CB 72 1.197 1
40 1 4 1 "RMS(OBS, PRED)" H 81 0.652 1
41 1 4 1 "RMS(OBS, PRED)" HA 21 0.286 1
42 1 4 1 "RMS(OBS, PRED)" N 81 3.265 1
43 1 4 2 "RMS(OBS, PRED)" C 27 1.994 1
44 1 4 2 "RMS(OBS, PRED)" CA 29 1.530 1
45 1 4 2 "RMS(OBS, PRED)" CB 27 1.159 1
46 1 4 2 "RMS(OBS, PRED)" H 27 0.422 1
47 1 4 2 "RMS(OBS, PRED)" HA 31 0.191 1
48 1 4 2 "RMS(OBS, PRED)" N 27 2.148 1
49 1 5 1 "RMS(OBS, PRED)" C 0 0.000 1
50 1 5 1 "RMS(OBS, PRED)" CA 84 1.503 1
51 1 5 1 "RMS(OBS, PRED)" CB 72 1.321 1
52 1 5 1 "RMS(OBS, PRED)" H 81 0.689 1
53 1 5 1 "RMS(OBS, PRED)" HA 21 0.263 1
54 1 5 1 "RMS(OBS, PRED)" N 81 3.244 1
55 1 5 2 "RMS(OBS, PRED)" C 27 1.862 1
56 1 5 2 "RMS(OBS, PRED)" CA 29 1.300 1
57 1 5 2 "RMS(OBS, PRED)" CB 27 1.140 1
58 1 5 2 "RMS(OBS, PRED)" H 27 0.491 1
59 1 5 2 "RMS(OBS, PRED)" HA 31 0.214 1
60 1 5 2 "RMS(OBS, PRED)" N 27 2.189 1
61 1 6 1 "RMS(OBS, PRED)" C 0 0.000 1
62 1 6 1 "RMS(OBS, PRED)" CA 84 1.444 1
63 1 6 1 "RMS(OBS, PRED)" CB 72 1.301 1
64 1 6 1 "RMS(OBS, PRED)" H 81 0.672 1
65 1 6 1 "RMS(OBS, PRED)" HA 21 0.239 1
66 1 6 1 "RMS(OBS, PRED)" N 81 3.290 1
67 1 6 2 "RMS(OBS, PRED)" C 27 1.503 1
68 1 6 2 "RMS(OBS, PRED)" CA 29 1.195 1
69 1 6 2 "RMS(OBS, PRED)" CB 27 1.216 1
70 1 6 2 "RMS(OBS, PRED)" H 27 0.405 1
71 1 6 2 "RMS(OBS, PRED)" HA 31 0.260 1
72 1 6 2 "RMS(OBS, PRED)" N 27 1.901 1
73 1 7 1 "RMS(OBS, PRED)" C 0 0.000 1
74 1 7 1 "RMS(OBS, PRED)" CA 84 1.729 1
75 1 7 1 "RMS(OBS, PRED)" CB 72 1.132 1
76 1 7 1 "RMS(OBS, PRED)" H 81 0.730 1
77 1 7 1 "RMS(OBS, PRED)" HA 21 0.303 1
78 1 7 1 "RMS(OBS, PRED)" N 81 3.197 1
79 1 7 2 "RMS(OBS, PRED)" C 27 1.903 1
80 1 7 2 "RMS(OBS, PRED)" CA 29 1.361 1
81 1 7 2 "RMS(OBS, PRED)" CB 27 1.122 1
82 1 7 2 "RMS(OBS, PRED)" H 27 0.419 1
83 1 7 2 "RMS(OBS, PRED)" HA 31 0.203 1
84 1 7 2 "RMS(OBS, PRED)" N 27 2.147 1
85 1 8 1 "RMS(OBS, PRED)" C 0 0.000 1
86 1 8 1 "RMS(OBS, PRED)" CA 84 1.653 1
87 1 8 1 "RMS(OBS, PRED)" CB 72 1.363 1
88 1 8 1 "RMS(OBS, PRED)" H 81 0.630 1
89 1 8 1 "RMS(OBS, PRED)" HA 21 0.315 1
90 1 8 1 "RMS(OBS, PRED)" N 81 3.361 1
91 1 8 2 "RMS(OBS, PRED)" C 27 1.943 1
92 1 8 2 "RMS(OBS, PRED)" CA 29 1.316 1
93 1 8 2 "RMS(OBS, PRED)" CB 27 1.175 1
94 1 8 2 "RMS(OBS, PRED)" H 27 0.408 1
95 1 8 2 "RMS(OBS, PRED)" HA 31 0.175 1
96 1 8 2 "RMS(OBS, PRED)" N 27 1.655 1
97 1 9 1 "RMS(OBS, PRED)" C 0 0.000 1
98 1 9 1 "RMS(OBS, PRED)" CA 84 1.587 1
99 1 9 1 "RMS(OBS, PRED)" CB 72 1.008 1
100 1 9 1 "RMS(OBS, PRED)" H 81 0.671 1
101 1 9 1 "RMS(OBS, PRED)" HA 21 0.309 1
102 1 9 1 "RMS(OBS, PRED)" N 81 3.501 1
103 1 9 2 "RMS(OBS, PRED)" C 27 1.881 1
104 1 9 2 "RMS(OBS, PRED)" CA 29 1.227 1
105 1 9 2 "RMS(OBS, PRED)" CB 27 1.090 1
106 1 9 2 "RMS(OBS, PRED)" H 27 0.411 1
107 1 9 2 "RMS(OBS, PRED)" HA 31 0.205 1
108 1 9 2 "RMS(OBS, PRED)" N 27 2.048 1
109 1 10 1 "RMS(OBS, PRED)" C 0 0.000 1
110 1 10 1 "RMS(OBS, PRED)" CA 84 1.506 1
111 1 10 1 "RMS(OBS, PRED)" CB 72 1.206 1
112 1 10 1 "RMS(OBS, PRED)" H 81 0.624 1
113 1 10 1 "RMS(OBS, PRED)" HA 21 0.284 1
114 1 10 1 "RMS(OBS, PRED)" N 81 2.927 1
115 1 10 2 "RMS(OBS, PRED)" C 27 1.837 1
116 1 10 2 "RMS(OBS, PRED)" CA 29 1.530 1
117 1 10 2 "RMS(OBS, PRED)" CB 27 1.244 1
118 1 10 2 "RMS(OBS, PRED)" H 27 0.345 1
119 1 10 2 "RMS(OBS, PRED)" HA 31 0.248 1
120 1 10 2 "RMS(OBS, PRED)" N 27 2.604 1
121 1 11 1 "RMS(OBS, PRED)" C 0 0.000 1
122 1 11 1 "RMS(OBS, PRED)" CA 84 1.560 1
123 1 11 1 "RMS(OBS, PRED)" CB 72 1.167 1
124 1 11 1 "RMS(OBS, PRED)" H 81 0.692 1
125 1 11 1 "RMS(OBS, PRED)" HA 21 0.400 1
126 1 11 1 "RMS(OBS, PRED)" N 81 2.997 1
127 1 11 2 "RMS(OBS, PRED)" C 27 1.750 1
128 1 11 2 "RMS(OBS, PRED)" CA 29 1.420 1
129 1 11 2 "RMS(OBS, PRED)" CB 27 1.211 1
130 1 11 2 "RMS(OBS, PRED)" H 27 0.360 1
131 1 11 2 "RMS(OBS, PRED)" HA 31 0.178 1
132 1 11 2 "RMS(OBS, PRED)" N 27 1.792 1
133 1 12 1 "RMS(OBS, PRED)" C 0 0.000 1
134 1 12 1 "RMS(OBS, PRED)" CA 84 1.538 1
135 1 12 1 "RMS(OBS, PRED)" CB 72 0.998 1
136 1 12 1 "RMS(OBS, PRED)" H 81 0.677 1
137 1 12 1 "RMS(OBS, PRED)" HA 21 0.373 1
138 1 12 1 "RMS(OBS, PRED)" N 81 3.201 1
139 1 12 2 "RMS(OBS, PRED)" C 27 1.825 1
140 1 12 2 "RMS(OBS, PRED)" CA 29 1.538 1
141 1 12 2 "RMS(OBS, PRED)" CB 27 1.087 1
142 1 12 2 "RMS(OBS, PRED)" H 27 0.367 1
143 1 12 2 "RMS(OBS, PRED)" HA 31 0.230 1
144 1 12 2 "RMS(OBS, PRED)" N 27 2.091 1
145 1 13 1 "RMS(OBS, PRED)" C 0 0.000 1
146 1 13 1 "RMS(OBS, PRED)" CA 84 1.668 1
147 1 13 1 "RMS(OBS, PRED)" CB 72 1.142 1
148 1 13 1 "RMS(OBS, PRED)" H 81 0.689 1
149 1 13 1 "RMS(OBS, PRED)" HA 21 0.297 1
150 1 13 1 "RMS(OBS, PRED)" N 81 3.315 1
151 1 13 2 "RMS(OBS, PRED)" C 27 1.865 1
152 1 13 2 "RMS(OBS, PRED)" CA 29 1.509 1
153 1 13 2 "RMS(OBS, PRED)" CB 27 1.244 1
154 1 13 2 "RMS(OBS, PRED)" H 27 0.423 1
155 1 13 2 "RMS(OBS, PRED)" HA 31 0.300 1
156 1 13 2 "RMS(OBS, PRED)" N 27 2.045 1
157 1 14 1 "RMS(OBS, PRED)" C 0 0.000 1
158 1 14 1 "RMS(OBS, PRED)" CA 84 1.572 1
159 1 14 1 "RMS(OBS, PRED)" CB 72 1.168 1
160 1 14 1 "RMS(OBS, PRED)" H 81 0.698 1
161 1 14 1 "RMS(OBS, PRED)" HA 21 0.264 1
162 1 14 1 "RMS(OBS, PRED)" N 81 3.337 1
163 1 14 2 "RMS(OBS, PRED)" C 27 1.779 1
164 1 14 2 "RMS(OBS, PRED)" CA 29 1.678 1
165 1 14 2 "RMS(OBS, PRED)" CB 27 1.347 1
166 1 14 2 "RMS(OBS, PRED)" H 27 0.412 1
167 1 14 2 "RMS(OBS, PRED)" HA 31 0.253 1
168 1 14 2 "RMS(OBS, PRED)" N 27 2.000 1
169 1 15 1 "RMS(OBS, PRED)" C 0 0.000 1
170 1 15 1 "RMS(OBS, PRED)" CA 84 1.517 1
171 1 15 1 "RMS(OBS, PRED)" CB 72 1.162 1
172 1 15 1 "RMS(OBS, PRED)" H 81 0.633 1
173 1 15 1 "RMS(OBS, PRED)" HA 21 0.298 1
174 1 15 1 "RMS(OBS, PRED)" N 81 3.167 1
175 1 15 2 "RMS(OBS, PRED)" C 27 1.739 1
176 1 15 2 "RMS(OBS, PRED)" CA 29 1.518 1
177 1 15 2 "RMS(OBS, PRED)" CB 27 1.196 1
178 1 15 2 "RMS(OBS, PRED)" H 27 0.300 1
179 1 15 2 "RMS(OBS, PRED)" HA 31 0.212 1
180 1 15 2 "RMS(OBS, PRED)" N 27 2.195 1
181 1 16 1 "RMS(OBS, PRED)" C 0 0.000 1
182 1 16 1 "RMS(OBS, PRED)" CA 84 1.516 1
183 1 16 1 "RMS(OBS, PRED)" CB 72 1.113 1
184 1 16 1 "RMS(OBS, PRED)" H 81 0.705 1
185 1 16 1 "RMS(OBS, PRED)" HA 21 0.283 1
186 1 16 1 "RMS(OBS, PRED)" N 81 3.297 1
187 1 16 2 "RMS(OBS, PRED)" C 27 1.806 1
188 1 16 2 "RMS(OBS, PRED)" CA 29 1.448 1
189 1 16 2 "RMS(OBS, PRED)" CB 27 1.234 1
190 1 16 2 "RMS(OBS, PRED)" H 27 0.431 1
191 1 16 2 "RMS(OBS, PRED)" HA 31 0.183 1
192 1 16 2 "RMS(OBS, PRED)" N 27 1.701 1
193 1 17 1 "RMS(OBS, PRED)" C 0 0.000 1
194 1 17 1 "RMS(OBS, PRED)" CA 84 1.529 1
195 1 17 1 "RMS(OBS, PRED)" CB 72 1.176 1
196 1 17 1 "RMS(OBS, PRED)" H 81 0.694 1
197 1 17 1 "RMS(OBS, PRED)" HA 21 0.276 1
198 1 17 1 "RMS(OBS, PRED)" N 81 2.918 1
199 1 17 2 "RMS(OBS, PRED)" C 27 1.607 1
200 1 17 2 "RMS(OBS, PRED)" CA 29 1.416 1
201 1 17 2 "RMS(OBS, PRED)" CB 27 1.289 1
202 1 17 2 "RMS(OBS, PRED)" H 27 0.420 1
203 1 17 2 "RMS(OBS, PRED)" HA 31 0.194 1
204 1 17 2 "RMS(OBS, PRED)" N 27 1.893 1
205 1 18 1 "RMS(OBS, PRED)" C 0 0.000 1
206 1 18 1 "RMS(OBS, PRED)" CA 84 1.605 1
207 1 18 1 "RMS(OBS, PRED)" CB 72 1.138 1
208 1 18 1 "RMS(OBS, PRED)" H 81 0.703 1
209 1 18 1 "RMS(OBS, PRED)" HA 21 0.276 1
210 1 18 1 "RMS(OBS, PRED)" N 81 3.241 1
211 1 18 2 "RMS(OBS, PRED)" C 27 1.826 1
212 1 18 2 "RMS(OBS, PRED)" CA 29 1.259 1
213 1 18 2 "RMS(OBS, PRED)" CB 27 1.379 1
214 1 18 2 "RMS(OBS, PRED)" H 27 0.406 1
215 1 18 2 "RMS(OBS, PRED)" HA 31 0.137 1
216 1 18 2 "RMS(OBS, PRED)" N 27 2.122 1
217 1 19 1 "RMS(OBS, PRED)" C 0 0.000 1
218 1 19 1 "RMS(OBS, PRED)" CA 84 1.555 1
219 1 19 1 "RMS(OBS, PRED)" CB 72 1.018 1
220 1 19 1 "RMS(OBS, PRED)" H 81 0.656 1
221 1 19 1 "RMS(OBS, PRED)" HA 21 0.359 1
222 1 19 1 "RMS(OBS, PRED)" N 81 3.248 1
223 1 19 2 "RMS(OBS, PRED)" C 27 1.723 1
224 1 19 2 "RMS(OBS, PRED)" CA 29 1.395 1
225 1 19 2 "RMS(OBS, PRED)" CB 27 1.352 1
226 1 19 2 "RMS(OBS, PRED)" H 27 0.412 1
227 1 19 2 "RMS(OBS, PRED)" HA 31 0.209 1
228 1 19 2 "RMS(OBS, PRED)" N 27 1.861 1
229 1 20 1 "RMS(OBS, PRED)" C 0 0.000 1
230 1 20 1 "RMS(OBS, PRED)" CA 84 1.728 1
231 1 20 1 "RMS(OBS, PRED)" CB 72 1.245 1
232 1 20 1 "RMS(OBS, PRED)" H 81 0.686 1
233 1 20 1 "RMS(OBS, PRED)" HA 21 0.326 1
234 1 20 1 "RMS(OBS, PRED)" N 81 2.910 1
235 1 20 2 "RMS(OBS, PRED)" C 27 2.007 1
236 1 20 2 "RMS(OBS, PRED)" CA 29 1.263 1
237 1 20 2 "RMS(OBS, PRED)" CB 27 1.190 1
238 1 20 2 "RMS(OBS, PRED)" H 27 0.419 1
239 1 20 2 "RMS(OBS, PRED)" HA 31 0.226 1
240 1 20 2 "RMS(OBS, PRED)" N 27 2.010 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 6 . 1 1 A 2 2 ALA H H 2 8.191 8.704 -0.513 2
1 7 . 1 1 A 2 2 ALA CA C 2 51.957 53.756 -1.799 2
1 8 . 1 1 A 2 2 ALA CB C 2 19.580 18.576 1.004 2
1 9 . 1 1 A 2 2 ALA N N 2 124.666 124.819 -0.153 2
1 10 . 1 1 A 3 3 SER H H 3 8.829 8.265 0.564 2
1 11 . 1 1 A 3 3 SER CA C 3 57.221 62.831 -5.610 2
1 12 . 1 1 A 3 3 SER N N 3 119.917 114.041 5.876 2
1 13 . 1 1 A 4 4 PRO CA C 4 66.688 65.657 1.031 2
1 14 . 1 1 A 4 4 PRO CB C 4 32.553 30.809 1.744 2
1 15 . 1 1 A 5 5 LEU H H 5 9.146 7.362 1.784 2
1 16 . 1 1 A 5 5 LEU CA C 5 59.017 57.022 1.995 2
1 17 . 1 1 A 5 5 LEU CB C 5 42.341 42.416 -0.075 2
1 18 . 1 1 A 5 5 LEU N N 5 117.902 116.881 1.021 2
1 24 . 1 1 A 7 7 GLN HA H 7 4.064 4.120 -0.056 2
1 30 . 1 1 A 7 7 GLN CB C 7 28.468 27.632 0.836 2
1 32 . 1 1 A 8 8 ALA H H 8 8.253 7.829 0.424 2
1 35 . 1 1 A 8 8 ALA N N 8 123.628 122.227 1.401 2
1 41 . 1 1 A 10 10 GLY HA3 H 10 3.773 3.761 0.012 2
1 67 . 1 1 A 14 14 GLY HA2 H 14 4.147 3.751 0.396 2
1 68 . 1 1 A 14 14 GLY HA3 H 14 3.982 3.764 0.218 2
1 91 . 1 1 A 19 19 TYR CB C 19 40.355 38.364 1.991 2
1 98 . 1 1 A 21 21 GLY HA2 H 21 4.195 3.805 0.390 2
1 99 . 1 1 A 21 21 GLY HA3 H 21 3.900 3.850 0.050 2
1 109 . 1 1 A 24 24 GLY HA2 H 24 3.912 3.974 -0.062 2
1 110 . 1 1 A 24 24 GLY HA3 H 24 3.787 3.986 -0.199 2
1 121 . 1 1 A 28 28 THR H H 28 7.325 7.759 -0.434 2
1 128 . 1 1 A 28 28 THR N N 28 106.920 113.094 -6.174 2
1 163 . 1 1 A 35 35 LYS H H 35 8.010 8.020 -0.010 2
1 164 . 1 1 A 35 35 LYS CA C 35 60.692 59.714 0.978 2
1 165 . 1 1 A 35 35 LYS CB C 35 32.223 32.103 0.120 2
1 166 . 1 1 A 35 35 LYS N N 35 119.829 118.796 1.033 2
1 167 . 1 1 A 36 36 GLU H H 36 7.169 7.991 -0.822 2
1 168 . 1 1 A 36 36 GLU CA C 36 59.588 58.938 0.650 2
1 169 . 1 1 A 36 36 GLU CB C 36 29.342 29.449 -0.107 2
1 170 . 1 1 A 36 36 GLU N N 36 117.340 119.426 -2.086 2
1 171 . 1 1 A 37 37 LEU H H 37 7.478 7.760 -0.282 2
1 172 . 1 1 A 37 37 LEU CA C 37 59.674 57.703 1.971 2
1 173 . 1 1 A 37 37 LEU CB C 37 42.142 41.037 1.105 2
1 174 . 1 1 A 37 37 LEU N N 37 120.884 120.910 -0.026 2
1 175 . 1 1 A 38 38 ILE H H 38 8.377 8.122 0.255 2
1 176 . 1 1 A 38 38 ILE CA C 38 65.651 65.244 0.407 2
1 177 . 1 1 A 38 38 ILE N N 38 118.450 119.366 -0.916 2
1 178 . 1 1 A 39 39 GLN H H 39 8.217 8.124 0.093 2
1 179 . 1 1 A 39 39 GLN CA C 39 59.788 58.779 1.009 2
1 180 . 1 1 A 39 39 GLN CB C 39 29.278 28.199 1.079 2
1 181 . 1 1 A 39 39 GLN N N 39 113.091 118.336 -5.245 2
1 182 . 1 1 A 40 40 LYS H H 40 8.426 7.824 0.602 2
1 183 . 1 1 A 40 40 LYS CA C 40 57.807 58.894 -1.087 2
1 184 . 1 1 A 40 40 LYS CB C 40 33.942 32.916 1.026 2
1 185 . 1 1 A 40 40 LYS N N 40 114.771 119.744 -4.973 2
1 186 . 1 1 A 41 41 GLU H H 41 8.496 8.328 0.169 2
1 187 . 1 1 A 41 41 GLU CA C 41 55.395 58.525 -3.130 2
1 188 . 1 1 A 41 41 GLU CB C 41 29.260 30.325 -1.065 2
1 189 . 1 1 A 41 41 GLU N N 41 112.546 118.524 -5.978 2
1 190 . 1 1 A 42 42 LEU H H 42 7.267 7.891 -0.624 2
1 191 . 1 1 A 42 42 LEU CA C 42 53.776 54.619 -0.843 2
1 192 . 1 1 A 42 42 LEU N N 42 118.657 119.442 -0.785 2
1 193 . 1 1 A 44 44 ILE CA C 44 62.210 60.876 1.334 2
1 194 . 1 1 A 44 44 ILE CB C 44 38.247 38.758 -0.511 2
1 195 . 1 1 A 45 45 GLY H H 45 7.820 8.338 -0.518 2
1 196 . 1 1 A 45 45 GLY CA C 45 47.742 45.608 2.134 2
1 197 . 1 1 A 45 45 GLY N N 45 108.178 113.050 -4.872 2
1 198 . 1 1 A 46 46 SER H H 46 7.895 8.280 -0.385 2
1 199 . 1 1 A 46 46 SER CA C 46 59.958 58.592 1.366 2
1 200 . 1 1 A 46 46 SER CB C 46 63.450 63.179 0.271 2
1 201 . 1 1 A 46 46 SER N N 46 113.038 115.837 -2.799 2
1 202 . 1 1 A 47 47 LYS H H 47 7.736 8.002 -0.266 2
1 203 . 1 1 A 47 47 LYS CA C 47 55.636 56.753 -1.117 2
1 204 . 1 1 A 47 47 LYS CB C 47 33.103 32.899 0.204 2
1 205 . 1 1 A 47 47 LYS N N 47 119.422 121.275 -1.853 2
1 206 . 1 1 A 48 48 LEU H H 48 6.988 8.418 -1.430 2
1 207 . 1 1 A 48 48 LEU HA H 48 4.497 4.178 0.319 2
1 217 . 1 1 A 48 48 LEU CA C 48 54.517 56.464 -1.947 2
1 218 . 1 1 A 48 48 LEU CB C 48 42.987 41.513 1.474 2
1 219 . 1 1 A 48 48 LEU N N 48 118.908 122.015 -3.107 2
1 220 . 1 1 A 49 49 GLN H H 49 9.206 8.320 0.886 2
1 221 . 1 1 A 49 49 GLN HA H 49 4.486 4.315 0.171 2
1 223 . 1 1 A 49 49 GLN CA C 49 54.785 57.390 -2.605 2
1 224 . 1 1 A 49 49 GLN CB C 49 29.636 28.854 0.782 2
1 225 . 1 1 A 49 49 GLN N N 49 121.275 120.154 1.121 2
1 226 . 1 1 A 50 50 ASP H H 50 8.854 8.204 0.650 2
1 227 . 1 1 A 50 50 ASP CA C 50 59.078 57.459 1.619 2
1 228 . 1 1 A 50 50 ASP CB C 50 40.632 41.689 -1.057 2
1 229 . 1 1 A 50 50 ASP N N 50 123.430 120.552 2.878 2
1 230 . 1 1 A 51 51 ALA H H 51 8.720 8.046 0.674 2
1 231 . 1 1 A 51 51 ALA CA C 51 55.281 54.885 0.396 2
1 232 . 1 1 A 51 51 ALA CB C 51 18.205 18.138 0.067 2
1 233 . 1 1 A 51 51 ALA N N 51 117.829 121.291 -3.462 2
1 234 . 1 1 A 52 52 GLU H H 52 7.161 7.780 -0.619 2
1 235 . 1 1 A 52 52 GLU CA C 52 58.757 59.032 -0.275 2
1 236 . 1 1 A 52 52 GLU CB C 52 30.247 29.632 0.615 2
1 237 . 1 1 A 52 52 GLU N N 52 115.459 117.474 -2.015 2
1 238 . 1 1 A 53 53 ILE H H 53 7.962 7.865 0.097 2
1 239 . 1 1 A 53 53 ILE CA C 53 65.525 64.997 0.528 2
1 240 . 1 1 A 53 53 ILE CB C 53 37.289 37.652 -0.363 2
1 241 . 1 1 A 53 53 ILE N N 53 120.414 121.230 -0.816 2
1 242 . 1 1 A 54 54 VAL H H 54 8.132 8.129 0.003 2
1 243 . 1 1 A 54 54 VAL CA C 54 67.290 65.547 1.743 2
1 244 . 1 1 A 54 54 VAL CB C 54 31.434 31.256 0.178 2
1 245 . 1 1 A 54 54 VAL N N 54 119.775 117.230 2.545 2
1 246 . 1 1 A 55 55 LYS H H 55 7.155 8.012 -0.857 2
1 247 . 1 1 A 55 55 LYS CA C 55 59.131 59.164 -0.033 2
1 248 . 1 1 A 55 55 LYS CB C 55 32.131 31.929 0.202 2
1 249 . 1 1 A 55 55 LYS N N 55 119.175 120.929 -1.754 2
1 250 . 1 1 A 56 56 LEU H H 56 7.837 8.222 -0.385 2
1 251 . 1 1 A 56 56 LEU CA C 56 58.052 57.936 0.116 2
1 252 . 1 1 A 56 56 LEU CB C 56 41.878 41.576 0.302 2
1 253 . 1 1 A 56 56 LEU N N 56 119.679 121.093 -1.414 2
1 254 . 1 1 A 57 57 MET H H 57 8.385 8.718 -0.333 2
1 255 . 1 1 A 57 57 MET CA C 57 60.756 58.618 2.138 2
1 256 . 1 1 A 57 57 MET CB C 57 33.152 32.076 1.076 2
1 257 . 1 1 A 57 57 MET N N 57 115.116 118.949 -3.833 2
1 258 . 1 1 A 58 58 ASP H H 58 7.591 8.221 -0.630 2
1 259 . 1 1 A 58 58 ASP CA C 58 57.365 57.384 -0.019 2
1 260 . 1 1 A 58 58 ASP CB C 58 40.858 41.303 -0.445 2
1 261 . 1 1 A 58 58 ASP N N 58 118.197 119.767 -1.570 2
1 262 . 1 1 A 59 59 ASP H H 59 7.725 7.978 -0.253 2
1 263 . 1 1 A 59 59 ASP CA C 59 56.830 56.955 -0.125 2
1 264 . 1 1 A 59 59 ASP CB C 59 40.567 40.735 -0.168 2
1 265 . 1 1 A 59 59 ASP N N 59 118.481 118.459 0.022 2
1 266 . 1 1 A 60 60 LEU H H 60 7.703 7.784 -0.081 2
1 267 . 1 1 A 60 60 LEU CA C 60 56.564 57.512 -0.948 2
1 268 . 1 1 A 60 60 LEU CB C 60 42.714 41.248 1.466 2
1 269 . 1 1 A 60 60 LEU N N 60 116.935 120.153 -3.218 2
1 270 . 1 1 A 61 61 ASP H H 61 7.143 8.380 -1.237 2
1 271 . 1 1 A 61 61 ASP HA H 61 4.690 4.444 0.246 2
1 274 . 1 1 A 61 61 ASP CA C 61 52.286 56.540 -4.254 2
1 275 . 1 1 A 61 61 ASP CB C 61 39.245 41.086 -1.841 2
1 276 . 1 1 A 61 61 ASP N N 61 116.605 119.062 -2.457 2
1 277 . 1 1 A 62 62 ARG H H 62 7.786 7.936 -0.150 2
1 278 . 1 1 A 62 62 ARG CA C 62 58.328 58.637 -0.309 2
1 279 . 1 1 A 62 62 ARG CB C 62 30.106 29.756 0.350 2
1 280 . 1 1 A 62 62 ARG N N 62 125.967 118.903 7.064 2
1 281 . 1 1 A 63 63 ASN H H 63 7.945 7.786 0.159 2
1 282 . 1 1 A 63 63 ASN CA C 63 51.863 55.459 -3.596 2
1 283 . 1 1 A 63 63 ASN CB C 63 36.809 38.928 -2.119 2
1 284 . 1 1 A 63 63 ASN N N 63 112.434 116.745 -4.311 2
1 285 . 1 1 A 64 64 LYS H H 64 7.477 7.703 -0.226 2
1 286 . 1 1 A 64 64 LYS CA C 64 56.524 56.174 0.350 2
1 287 . 1 1 A 64 64 LYS N N 64 114.197 117.753 -3.556 2
1 288 . 1 1 A 65 65 ASP H H 65 8.345 8.619 -0.274 2
1 289 . 1 1 A 65 65 ASP CA C 65 52.969 55.451 -2.482 2
1 290 . 1 1 A 65 65 ASP CB C 65 40.329 41.658 -1.329 2
1 291 . 1 1 A 65 65 ASP N N 65 118.581 122.243 -3.662 2
1 292 . 1 1 A 66 66 GLN H H 66 9.945 8.334 1.611 2
1 293 . 1 1 A 66 66 GLN CA C 66 58.132 56.714 1.418 2
1 294 . 1 1 A 66 66 GLN CB C 66 26.035 29.685 -3.650 2
1 295 . 1 1 A 66 66 GLN N N 66 113.203 117.609 -4.406 2
1 296 . 1 1 A 67 67 GLU H H 67 7.880 7.871 0.009 2
1 297 . 1 1 A 67 67 GLU HA H 67 4.910 4.898 0.012 2
1 302 . 1 1 A 67 67 GLU CA C 67 54.082 55.101 -1.019 2
1 303 . 1 1 A 67 67 GLU CB C 67 33.174 33.016 0.158 2
1 304 . 1 1 A 67 67 GLU N N 67 118.554 116.888 1.666 2
1 305 . 1 1 A 68 68 VAL H H 68 9.669 9.256 0.413 2
1 306 . 1 1 A 68 68 VAL HA H 68 5.465 4.667 0.798 2
1 314 . 1 1 A 68 68 VAL CA C 68 61.079 61.330 -0.251 2
1 315 . 1 1 A 68 68 VAL CB C 68 33.280 33.576 -0.296 2
1 316 . 1 1 A 68 68 VAL N N 68 126.572 122.441 4.131 2
1 317 . 1 1 A 69 69 ASN H H 69 8.985 8.780 0.206 2
1 318 . 1 1 A 69 69 ASN CA C 69 50.812 53.201 -2.389 2
1 319 . 1 1 A 69 69 ASN CB C 69 38.609 40.256 -1.647 2
1 320 . 1 1 A 69 69 ASN N N 69 127.472 126.156 1.316 2
1 321 . 1 1 A 70 70 PHE H H 70 9.100 9.072 0.028 2
1 322 . 1 1 A 70 70 PHE CA C 70 63.279 61.984 1.295 2
1 323 . 1 1 A 70 70 PHE CB C 70 38.741 39.391 -0.650 2
1 324 . 1 1 A 70 70 PHE N N 70 119.972 126.332 -6.360 2
1 325 . 1 1 A 71 71 GLN H H 71 8.342 8.168 0.174 2
1 326 . 1 1 A 71 71 GLN HA H 71 3.923 3.680 0.243 2
1 329 . 1 1 A 71 71 GLN CA C 71 59.866 58.469 1.397 2
1 330 . 1 1 A 71 71 GLN CB C 71 27.878 28.404 -0.526 2
1 331 . 1 1 A 71 71 GLN N N 71 118.216 117.479 0.737 2
1 332 . 1 1 A 72 72 GLU H H 72 8.721 7.919 0.802 2
1 333 . 1 1 A 72 72 GLU HA H 72 4.147 4.078 0.069 2
1 338 . 1 1 A 72 72 GLU CA C 72 59.313 58.934 0.379 2
1 339 . 1 1 A 72 72 GLU CB C 72 30.233 29.512 0.721 2
1 340 . 1 1 A 72 72 GLU N N 72 121.455 119.626 1.829 2
1 341 . 1 1 A 73 73 TYR H H 73 8.536 8.093 0.443 2
1 342 . 1 1 A 73 73 TYR CA C 73 60.961 61.412 -0.451 2
1 343 . 1 1 A 73 73 TYR CB C 73 38.724 38.812 -0.088 2
1 344 . 1 1 A 73 73 TYR N N 73 123.356 122.017 1.338 2
1 345 . 1 1 A 74 74 ILE H H 74 8.642 7.832 0.810 2
1 346 . 1 1 A 74 74 ILE CA C 74 61.880 64.040 -2.160 2
1 347 . 1 1 A 74 74 ILE CB C 74 36.077 36.970 -0.893 2
1 348 . 1 1 A 74 74 ILE N N 74 119.799 120.266 -0.467 2
1 349 . 1 1 A 75 75 THR H H 75 7.959 8.080 -0.121 2
1 354 . 1 1 A 75 75 THR CA C 75 67.056 66.717 0.339 2
1 355 . 1 1 A 75 75 THR CB C 75 68.386 68.559 -0.173 2
1 356 . 1 1 A 75 75 THR N N 75 119.486 117.741 1.745 2
1 357 . 1 1 A 76 76 PHE H H 76 7.450 8.215 -0.765 2
1 358 . 1 1 A 76 76 PHE CA C 76 59.010 61.654 -2.644 2
1 359 . 1 1 A 76 76 PHE CB C 76 38.139 39.193 -1.054 2
1 360 . 1 1 A 76 76 PHE N N 76 122.873 122.031 0.842 2
1 361 . 1 1 A 77 77 LEU H H 77 7.829 8.244 -0.415 2
1 362 . 1 1 A 77 77 LEU CA C 77 57.450 57.622 -0.172 2
1 363 . 1 1 A 77 77 LEU CB C 77 40.560 41.110 -0.550 2
1 364 . 1 1 A 77 77 LEU N N 77 117.405 118.488 -1.083 2
1 365 . 1 1 A 78 78 GLY H H 78 8.093 8.167 -0.074 2
1 366 . 1 1 A 78 78 GLY HA2 H 78 3.661 3.718 -0.057 2
1 367 . 1 1 A 78 78 GLY HA3 H 78 3.594 3.725 -0.131 2
1 368 . 1 1 A 78 78 GLY CA C 78 47.442 47.130 0.312 2
1 369 . 1 1 A 78 78 GLY N N 78 105.528 106.157 -0.629 2
1 370 . 1 1 A 79 79 ALA H H 79 7.759 7.633 0.126 2
1 371 . 1 1 A 79 79 ALA CA C 79 55.153 54.573 0.580 2
1 372 . 1 1 A 79 79 ALA CB C 79 17.768 18.550 -0.782 2
1 373 . 1 1 A 79 79 ALA N N 79 124.488 125.007 -0.519 2
1 374 . 1 1 A 80 80 LEU H H 80 7.963 7.936 0.027 2
1 375 . 1 1 A 80 80 LEU CA C 80 57.464 57.473 -0.009 2
1 376 . 1 1 A 80 80 LEU CB C 80 41.496 41.071 0.425 2
1 377 . 1 1 A 80 80 LEU N N 80 117.869 119.925 -2.056 2
1 378 . 1 1 A 81 81 ALA H H 81 8.365 8.206 0.159 2
1 379 . 1 1 A 81 81 ALA CA C 81 55.475 55.020 0.455 2
1 380 . 1 1 A 81 81 ALA CB C 81 17.483 18.076 -0.593 2
1 381 . 1 1 A 81 81 ALA N N 81 119.054 120.471 -1.417 2
1 382 . 1 1 A 82 82 MET H H 82 8.112 7.763 0.349 2
1 383 . 1 1 A 82 82 MET CA C 82 59.516 57.919 1.597 2
1 384 . 1 1 A 82 82 MET CB C 82 32.550 32.161 0.389 2
1 385 . 1 1 A 82 82 MET N N 82 115.364 117.437 -2.073 2
1 386 . 1 1 A 83 83 ILE H H 83 7.981 7.940 0.041 2
1 387 . 1 1 A 83 83 ILE HA H 83 3.839 3.687 0.152 2
1 391 . 1 1 A 83 83 ILE CA C 83 64.467 64.514 -0.047 2
1 392 . 1 1 A 83 83 ILE CB C 83 37.312 37.328 -0.016 2
1 393 . 1 1 A 83 83 ILE N N 83 120.887 119.836 1.051 2
1 394 . 1 1 A 84 84 TYR H H 84 8.731 7.686 1.045 2
1 395 . 1 1 A 84 84 TYR N N 84 120.933 120.091 0.842 2
1 396 . 1 1 A 87 87 ALA H H 87 7.829 8.007 -0.178 2
1 397 . 1 1 A 87 87 ALA CA C 87 53.768 54.535 -0.767 2
1 398 . 1 1 A 87 87 ALA CB C 87 18.504 18.368 0.136 2
1 399 . 1 1 A 87 87 ALA N N 87 120.274 121.913 -1.639 2
1 400 . 1 1 A 88 88 LEU H H 88 7.499 7.740 -0.241 2
1 401 . 1 1 A 88 88 LEU CA C 88 55.605 55.624 -0.019 2
1 402 . 1 1 A 88 88 LEU CB C 88 42.047 41.674 0.373 2
1 403 . 1 1 A 88 88 LEU N N 88 117.356 117.486 -0.130 2
1 404 . 1 1 A 89 89 LYS H H 89 7.561 7.753 -0.192 2
1 405 . 1 1 A 89 89 LYS CA C 89 56.865 56.991 -0.126 2
1 406 . 1 1 A 89 89 LYS CB C 89 32.592 33.730 -1.138 2
1 407 . 1 1 A 89 89 LYS N N 89 119.289 118.353 0.936 2
1 416 . 3 2 C 6 6 GLU H H 190 8.385 8.519 -0.134 2
1 417 . 3 2 C 6 6 GLU HA H 190 4.153 4.523 -0.370 2
1 422 . 3 2 C 6 6 GLU C C 190 175.031 176.613 -1.582 2
1 423 . 3 2 C 6 6 GLU CA C 190 58.866 56.875 1.991 2
1 424 . 3 2 C 6 6 GLU CB C 190 30.751 36.301 -5.550 2
1 426 . 3 2 C 6 6 GLU N N 190 122.715 120.196 2.519 2
1 427 . 3 2 C 7 7 GLY H H 191 8.475 8.404 0.071 2
1 428 . 3 2 C 7 7 GLY HA2 H 191 3.887 4.018 -0.131 2
1 429 . 3 2 C 7 7 GLY HA3 H 191 3.887 4.019 -0.132 2
1 430 . 3 2 C 7 7 GLY C C 191 177.922 175.107 2.815 2
1 431 . 3 2 C 7 7 GLY CA C 191 46.884 51.936 -5.052 2
1 432 . 3 2 C 7 7 GLY N N 191 109.009 113.397 -4.388 2
1 433 . 3 2 C 8 8 LEU HA H 192 4.095 3.955 0.140 2
1 443 . 3 2 C 8 8 LEU CA C 192 58.154 56.523 1.631 2
1 444 . 3 2 C 8 8 LEU CB C 192 42.789 30.160 12.629 2
1 448 . 3 2 C 9 9 MET H H 193 8.250 8.260 -0.010 2
1 449 . 3 2 C 9 9 MET HA H 193 4.150 4.153 -0.003 2
1 457 . 3 2 C 9 9 MET C C 193 178.421 178.227 0.194 2
1 458 . 3 2 C 9 9 MET CA C 193 58.818 61.448 -2.630 2
1 459 . 3 2 C 9 9 MET CB C 193 32.360 34.631 -2.271 2
1 462 . 3 2 C 9 9 MET N N 193 117.049 117.556 -0.507 2
1 463 . 3 2 C 10 10 ASN H H 194 7.892 8.327 -0.435 2
1 464 . 3 2 C 10 10 ASN HA H 194 4.468 4.527 -0.059 2
1 469 . 3 2 C 10 10 ASN C C 194 178.099 176.628 1.471 2
1 470 . 3 2 C 10 10 ASN CA C 194 56.644 51.175 5.469 2
1 471 . 3 2 C 10 10 ASN CB C 194 39.100 38.666 0.434 2
1 472 . 3 2 C 10 10 ASN N N 194 117.034 114.795 2.239 2
1 474 . 3 2 C 11 11 VAL H H 195 7.651 7.950 -0.299 2
1 475 . 3 2 C 11 11 VAL HA H 195 3.735 3.859 -0.124 2
1 483 . 3 2 C 11 11 VAL C C 195 177.657 178.243 -0.586 2
1 484 . 3 2 C 11 11 VAL CA C 195 66.710 61.412 5.298 2
1 485 . 3 2 C 11 11 VAL CB C 195 32.468 36.902 -4.434 2
1 488 . 3 2 C 11 11 VAL N N 195 119.878 120.735 -0.857 2
1 489 . 3 2 C 12 12 LEU H H 196 8.030 8.005 0.024 2
1 490 . 3 2 C 12 12 LEU HA H 196 4.013 4.103 -0.090 2
1 500 . 3 2 C 12 12 LEU C C 196 177.540 179.399 -1.859 2
1 501 . 3 2 C 12 12 LEU CA C 196 58.489 58.046 0.443 2
1 502 . 3 2 C 12 12 LEU CB C 196 42.457 41.385 1.072 2
1 506 . 3 2 C 12 12 LEU N N 196 119.499 119.297 0.202 2
1 507 . 3 2 C 13 13 LYS H H 197 8.015 8.341 -0.326 2
1 508 . 3 2 C 13 13 LYS HA H 197 3.949 4.050 -0.101 2
1 517 . 3 2 C 13 13 LYS C C 197 178.419 178.947 -0.528 2
1 518 . 3 2 C 13 13 LYS CA C 197 60.191 62.374 -2.183 2
1 519 . 3 2 C 13 13 LYS CB C 197 33.075 35.023 -1.948 2
1 523 . 3 2 C 13 13 LYS N N 197 117.888 120.427 -2.539 2
1 524 . 3 2 C 14 14 LYS H H 198 7.506 8.106 -0.600 2
1 525 . 3 2 C 14 14 LYS HA H 198 4.127 4.127 0.000 2
1 534 . 3 2 C 14 14 LYS C C 198 178.262 178.487 -0.225 2
1 535 . 3 2 C 14 14 LYS CA C 198 59.161 52.849 6.312 2
1 536 . 3 2 C 14 14 LYS CB C 198 32.956 32.126 0.830 2
1 540 . 3 2 C 14 14 LYS N N 198 118.321 112.806 5.515 2
1 541 . 3 2 C 15 15 ILE H H 199 7.780 7.995 -0.215 2
1 542 . 3 2 C 15 15 ILE HA H 199 3.787 3.952 -0.165 2
1 552 . 3 2 C 15 15 ILE C C 199 178.647 177.861 0.786 2
1 553 . 3 2 C 15 15 ILE CA C 199 64.912 64.082 0.830 2
1 554 . 3 2 C 15 15 ILE CB C 199 38.780 37.661 1.119 2
1 558 . 3 2 C 15 15 ILE N N 199 118.644 120.781 -2.137 2
1 559 . 3 2 C 16 16 TYR H H 200 7.918 8.450 -0.532 2
1 560 . 3 2 C 16 16 TYR HA H 200 4.252 4.022 0.230 2
1 567 . 3 2 C 16 16 TYR C C 200 177.806 177.552 0.254 2
1 568 . 3 2 C 16 16 TYR CA C 200 61.171 61.702 -0.531 2
1 569 . 3 2 C 16 16 TYR CB C 200 39.245 39.109 0.136 2
1 573 . 3 2 C 16 16 TYR N N 200 118.683 121.680 -2.997 2
1 574 . 3 2 C 17 17 GLU H H 201 8.089 8.577 -0.488 2
1 575 . 3 2 C 17 17 GLU HA H 201 4.124 4.217 -0.093 2
1 580 . 3 2 C 17 17 GLU C C 201 177.414 177.224 0.190 2
1 581 . 3 2 C 17 17 GLU CA C 201 58.784 58.632 0.152 2
1 582 . 3 2 C 17 17 GLU CB C 201 30.747 29.344 1.403 2
1 584 . 3 2 C 17 17 GLU N N 201 119.409 118.102 1.307 2
1 585 . 3 2 C 18 18 ASP H H 202 8.023 8.130 -0.107 2
1 586 . 3 2 C 18 18 ASP HA H 202 4.657 4.721 -0.064 2
1 589 . 3 2 C 18 18 ASP C C 202 177.346 176.485 0.861 2
1 590 . 3 2 C 18 18 ASP CA C 202 55.496 56.786 -1.290 2
1 591 . 3 2 C 18 18 ASP CB C 202 42.023 36.870 5.153 2
1 592 . 3 2 C 18 18 ASP N N 202 119.459 119.131 0.328 2
1 593 . 3 2 C 19 19 GLY H H 203 7.933 7.574 0.359 2
1 594 . 3 2 C 19 19 GLY HA2 H 203 3.938 4.008 -0.070 2
1 595 . 3 2 C 19 19 GLY HA3 H 203 3.938 4.034 -0.096 2
1 596 . 3 2 C 19 19 GLY C C 203 177.240 172.679 4.561 2
1 597 . 3 2 C 19 19 GLY CA C 203 46.309 52.947 -6.638 2
1 598 . 3 2 C 19 19 GLY N N 203 108.518 113.107 -4.589 2
1 599 . 3 2 C 20 20 ASP H H 204 8.091 8.160 -0.069 2
1 600 . 3 2 C 20 20 ASP HA H 204 4.616 4.853 -0.237 2
1 603 . 3 2 C 20 20 ASP C C 204 173.979 176.001 -2.022 2
1 604 . 3 2 C 20 20 ASP CA C 204 55.064 57.867 -2.803 2
1 605 . 3 2 C 20 20 ASP CB C 204 42.203 52.476 -10.273 2
1 606 . 3 2 C 20 20 ASP N N 204 120.172 118.264 1.908 2
1 607 . 3 2 C 21 21 ASP H H 205 8.352 8.416 -0.064 2
1 608 . 3 2 C 21 21 ASP HA H 205 4.468 4.574 -0.106 2
1 611 . 3 2 C 21 21 ASP C C 205 176.432 177.145 -0.713 2
1 612 . 3 2 C 21 21 ASP CA C 205 56.663 50.769 5.894 2
1 613 . 3 2 C 21 21 ASP CB C 205 41.918 41.604 0.314 2
1 614 . 3 2 C 21 21 ASP N N 205 121.515 116.402 5.113 2
1 615 . 3 2 C 22 22 ASP H H 206 8.239 7.887 0.352 2
1 616 . 3 2 C 22 22 ASP HA H 206 4.455 4.510 -0.055 2
1 619 . 3 2 C 22 22 ASP C C 206 177.449 178.626 -1.177 2
1 620 . 3 2 C 22 22 ASP CA C 206 57.165 57.685 -0.520 2
1 621 . 3 2 C 22 22 ASP CB C 206 41.820 36.565 5.255 2
1 622 . 3 2 C 22 22 ASP N N 206 120.156 120.098 0.058 2
1 623 . 3 2 C 23 23 MET H H 207 8.300 8.040 0.260 2
1 624 . 3 2 C 23 23 MET HA H 207 4.255 4.070 0.185 2
1 632 . 3 2 C 23 23 MET C C 207 178.412 178.227 0.185 2
1 633 . 3 2 C 23 23 MET CA C 207 58.065 57.389 0.676 2
1 634 . 3 2 C 23 23 MET CB C 207 32.488 32.258 0.230 2
1 637 . 3 2 C 23 23 MET N N 207 120.707 117.423 3.284 2
1 638 . 3 2 C 24 24 LYS H H 208 8.047 8.032 0.015 2
1 639 . 3 2 C 24 24 LYS HA H 208 3.946 4.041 -0.095 2
1 648 . 3 2 C 24 24 LYS C C 208 178.008 178.853 -0.845 2
1 649 . 3 2 C 24 24 LYS CA C 208 59.847 52.200 7.647 2
1 650 . 3 2 C 24 24 LYS CB C 208 32.983 31.995 0.988 2
1 654 . 3 2 C 24 24 LYS N N 208 119.504 118.387 1.117 2
1 655 . 3 2 C 25 25 ARG H H 209 7.891 8.067 -0.176 2
1 656 . 3 2 C 25 25 ARG HA H 209 4.168 4.125 0.044 2
1 663 . 3 2 C 25 25 ARG C C 209 178.100 178.602 -0.502 2
1 664 . 3 2 C 25 25 ARG CA C 209 58.810 56.355 2.455 2
1 665 . 3 2 C 25 25 ARG CB C 209 31.080 30.299 0.781 2
1 668 . 3 2 C 25 25 ARG N N 209 118.378 119.931 -1.553 2
1 669 . 3 2 C 26 26 THR H H 210 7.869 8.174 -0.305 2
1 670 . 3 2 C 26 26 THR HA H 210 4.023 4.045 -0.022 2
1 675 . 3 2 C 26 26 THR C C 210 177.984 176.656 1.328 2
1 676 . 3 2 C 26 26 THR CA C 210 65.747 61.916 3.831 2
1 677 . 3 2 C 26 26 THR CB C 210 69.683 50.925 18.758 2
1 679 . 3 2 C 26 26 THR N N 210 115.443 117.457 -2.015 2
1 680 . 3 2 C 27 27 ILE H H 211 7.901 8.271 -0.370 2
1 681 . 3 2 C 27 27 ILE HA H 211 4.142 3.663 0.479 2
1 691 . 3 2 C 27 27 ILE C C 211 175.595 178.134 -2.539 2
1 692 . 3 2 C 27 27 ILE CA C 211 63.528 60.654 2.874 2
1 693 . 3 2 C 27 27 ILE CB C 211 38.982 33.796 5.186 2
1 697 . 3 2 C 27 27 ILE N N 211 121.265 119.195 2.070 2
1 698 . 3 2 C 28 28 ASN HA H 212 4.465 4.417 0.048 2
1 703 . 3 2 C 28 28 ASN CA C 212 55.182 58.552 -3.370 2
1 704 . 3 2 C 28 28 ASN CB C 212 39.480 55.649 -16.169 2
1 706 . 3 2 C 29 29 LYS H H 213 7.968 8.622 -0.654 2
1 707 . 3 2 C 29 29 LYS HA H 213 4.072 4.549 -0.477 2
1 716 . 3 2 C 29 29 LYS C C 213 176.218 179.220 -3.002 2
1 717 . 3 2 C 29 29 LYS CA C 213 58.489 56.349 2.140 2
1 718 . 3 2 C 29 29 LYS CB C 213 33.165 38.468 -5.303 2
1 722 . 3 2 C 29 29 LYS N N 213 120.820 122.012 -1.192 2
1 723 . 3 2 C 30 30 ALA H H 214 7.865 8.465 -0.600 2
1 724 . 3 2 C 30 30 ALA HA H 214 4.217 4.189 0.028 2
1 728 . 3 2 C 30 30 ALA C C 214 177.041 179.756 -2.714 2
1 729 . 3 2 C 30 30 ALA CA C 214 54.104 56.167 -2.063 2
1 730 . 3 2 C 30 30 ALA CB C 214 19.496 41.558 -22.062 2
1 731 . 3 2 C 30 30 ALA N N 214 121.571 119.718 1.853 2
1 732 . 3 2 C 31 31 TRP H H 215 7.831 8.303 -0.472 2
1 733 . 3 2 C 31 31 TRP HA H 215 4.598 4.364 0.234 2
1 742 . 3 2 C 31 31 TRP C C 215 178.088 178.346 -0.258 2
1 743 . 3 2 C 31 31 TRP CA C 215 58.432 60.131 -1.699 2
1 744 . 3 2 C 31 31 TRP CB C 215 30.472 30.796 -0.324 2
1 750 . 3 2 C 31 31 TRP N N 215 118.141 120.740 -2.599 2
1 752 . 3 2 C 32 32 VAL H H 216 7.594 8.268 -0.674 2
1 753 . 3 2 C 32 32 VAL HA H 216 3.978 3.693 0.285 2
1 761 . 3 2 C 32 32 VAL C C 216 176.574 178.161 -1.587 2
1 762 . 3 2 C 32 32 VAL CA C 216 63.329 62.696 0.633 2
1 763 . 3 2 C 32 32 VAL CB C 216 33.373 31.726 1.647 2
1 766 . 3 2 C 32 32 VAL N N 216 118.287 119.621 -1.334 2
1 767 . 3 2 C 33 33 GLU H H 217 8.012 8.160 -0.148 2
1 768 . 3 2 C 33 33 GLU HA H 217 4.257 4.206 0.051 2
1 773 . 3 2 C 33 33 GLU C C 217 176.164 177.523 -1.359 2
1 774 . 3 2 C 33 33 GLU CA C 217 57.409 58.720 -1.311 2
1 775 . 3 2 C 33 33 GLU CB C 217 30.978 29.048 1.930 2
1 777 . 3 2 C 33 33 GLU N N 217 122.535 119.830 2.705 2
1 778 . 3 2 C 34 34 SER H H 218 8.037 8.018 0.019 2
1 779 . 3 2 C 34 34 SER HA H 218 4.514 4.484 0.030 2
1 782 . 3 2 C 34 34 SER C C 218 176.451 174.723 1.728 2
1 783 . 3 2 C 34 34 SER CA C 218 58.987 58.465 0.522 2
1 784 . 3 2 C 34 34 SER CB C 218 64.569 52.617 11.952 2
1 785 . 3 2 C 34 34 SER N N 218 117.058 118.059 -1.001 2
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