data_15250_sparta
save_entry_information
_Entry.Sf_category entry_information
_Entry.Sf_framecode entry_information
_Entry.ID 15250
_Entry.PDB_ID 1SUA
_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 1
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Conformer_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 1 A 6 6 TYR C C 6 177.807 177.653 0.154 1
1 2 . 1 1 1 A 6 6 TYR CA C 6 61.314 61.746 -0.432 1
1 3 . 1 1 1 A 6 6 TYR CB C 6 37.496 39.112 -1.616 1
1 4 . 1 1 1 A 7 7 GLY H H 7 8.722 8.407 0.315 1
1 5 . 1 1 1 A 7 7 GLY C C 7 174.931 175.834 -0.903 1
1 6 . 1 1 1 A 7 7 GLY CA C 7 46.728 46.975 -0.247 1
1 7 . 1 1 1 A 7 7 GLY N N 7 110.074 106.277 3.797 1
1 8 . 1 1 1 A 8 8 VAL H H 8 7.084 7.905 -0.821 1
1 9 . 1 1 1 A 8 8 VAL C C 8 178.021 177.478 0.543 1
1 10 . 1 1 1 A 8 8 VAL CA C 8 66.826 65.624 1.202 1
1 11 . 1 1 1 A 8 8 VAL CB C 8 32.064 31.752 0.312 1
1 12 . 1 1 1 A 8 8 VAL N N 8 119.468 122.283 -2.815 1
1 13 . 1 1 1 A 9 9 SER H H 9 7.304 8.229 -0.925 1
1 14 . 1 1 1 A 9 9 SER C C 9 178.704 176.278 2.426 1
1 15 . 1 1 1 A 9 9 SER CA C 9 61.518 61.623 -0.105 1
1 16 . 1 1 1 A 9 9 SER CB C 9 62.663 62.554 0.109 1
1 17 . 1 1 1 A 9 9 SER N N 9 113.504 115.556 -2.052 1
1 18 . 1 1 1 A 10 10 GLN H H 10 8.637 8.133 0.504 1
1 19 . 1 1 1 A 10 10 GLN C C 10 178.328 178.215 0.113 1
1 20 . 1 1 1 A 10 10 GLN CA C 10 59.681 58.960 0.721 1
1 21 . 1 1 1 A 10 10 GLN CB C 10 29.503 28.029 1.474 1
1 22 . 1 1 1 A 10 10 GLN N N 10 125.350 120.861 4.489 1
1 23 . 1 1 1 A 11 11 ILE H H 11 7.020 7.618 -0.598 1
1 24 . 1 1 1 A 11 11 ILE C C 11 173.870 175.491 -1.621 1
1 25 . 1 1 1 A 11 11 ILE CA C 11 61.766 60.801 0.965 1
1 26 . 1 1 1 A 11 11 ILE CB C 11 37.945 37.609 0.336 1
1 27 . 1 1 1 A 11 11 ILE N N 11 106.797 111.998 -5.201 1
1 28 . 1 1 1 A 12 12 LYS H H 12 7.840 7.925 -0.085 1
1 29 . 1 1 1 A 12 12 LYS C C 12 174.615 176.512 -1.897 1
1 30 . 1 1 1 A 12 12 LYS CA C 12 58.004 57.060 0.944 1
1 31 . 1 1 1 A 12 12 LYS CB C 12 28.464 29.055 -0.591 1
1 32 . 1 1 1 A 12 12 LYS N N 12 113.361 116.426 -3.065 1
1 33 . 1 1 1 A 13 13 ALA H H 13 7.255 7.914 -0.659 1
1 34 . 1 1 1 A 13 13 ALA CA C 13 55.595 56.821 -1.226 1
1 35 . 1 1 1 A 13 13 ALA CB C 13 17.693 17.665 0.028 1
1 36 . 1 1 1 A 13 13 ALA N N 13 118.001 120.020 -2.019 1
1 37 . 1 1 1 A 14 14 PRO C C 14 177.227 178.748 -1.521 1
1 38 . 1 1 1 A 14 14 PRO CA C 14 66.005 66.014 -0.009 1
1 39 . 1 1 1 A 14 14 PRO CB C 14 30.590 30.648 -0.058 1
1 40 . 1 1 1 A 15 15 ALA H H 15 7.320 8.287 -0.967 1
1 41 . 1 1 1 A 15 15 ALA C C 15 180.442 179.620 0.822 1
1 42 . 1 1 1 A 15 15 ALA CA C 15 54.893 54.838 0.055 1
1 43 . 1 1 1 A 15 15 ALA CB C 15 18.143 18.568 -0.425 1
1 44 . 1 1 1 A 15 15 ALA N N 15 118.830 118.778 0.052 1
1 45 . 1 1 1 A 16 16 LEU H H 16 7.269 7.703 -0.434 1
1 46 . 1 1 1 A 16 16 LEU C C 16 179.603 179.215 0.388 1
1 47 . 1 1 1 A 16 16 LEU CA C 16 56.392 56.992 -0.600 1
1 48 . 1 1 1 A 16 16 LEU CB C 16 40.022 41.695 -1.673 1
1 49 . 1 1 1 A 16 16 LEU N N 16 119.362 119.387 -0.025 1
1 50 . 1 1 1 A 17 17 HIS H H 17 7.628 8.267 -0.639 1
1 51 . 1 1 1 A 17 17 HIS C C 17 180.938 177.912 3.026 1
1 52 . 1 1 1 A 17 17 HIS CA C 17 57.745 59.930 -2.185 1
1 53 . 1 1 1 A 17 17 HIS CB C 17 31.084 29.676 1.408 1
1 54 . 1 1 1 A 17 17 HIS N N 17 120.715 118.156 2.559 1
1 55 . 1 1 1 A 18 18 SER H H 18 8.410 8.426 -0.016 1
1 56 . 1 1 1 A 18 18 SER C C 18 175.410 177.055 -1.645 1
1 57 . 1 1 1 A 18 18 SER CA C 18 61.495 61.724 -0.229 1
1 58 . 1 1 1 A 18 18 SER CB C 18 63.120 62.291 0.829 1
1 59 . 1 1 1 A 18 18 SER N N 18 114.198 115.931 -1.733 1
1 60 . 1 1 1 A 19 19 GLN H H 19 7.219 7.846 -0.627 1
1 61 . 1 1 1 A 19 19 GLN C C 19 175.257 175.975 -0.718 1
1 62 . 1 1 1 A 19 19 GLN CA C 19 55.973 55.740 0.233 1
1 63 . 1 1 1 A 19 19 GLN CB C 19 30.413 29.105 1.308 1
1 64 . 1 1 1 A 19 19 GLN N N 19 118.871 117.668 1.203 1
1 65 . 1 1 1 A 20 20 GLY H H 20 7.619 8.212 -0.593 1
1 66 . 1 1 1 A 20 20 GLY C C 20 173.488 173.544 -0.056 1
1 67 . 1 1 1 A 20 20 GLY CA C 20 44.552 45.202 -0.650 1
1 68 . 1 1 1 A 20 20 GLY N N 20 104.646 107.378 -2.732 1
1 69 . 1 1 1 A 21 21 TYR H H 21 7.758 7.944 -0.186 1
1 70 . 1 1 1 A 21 21 TYR C C 21 174.329 175.168 -0.839 1
1 71 . 1 1 1 A 21 21 TYR CA C 21 57.749 56.708 1.041 1
1 72 . 1 1 1 A 21 21 TYR CB C 21 37.883 39.578 -1.695 1
1 73 . 1 1 1 A 21 21 TYR N N 21 121.823 118.760 3.063 1
1 74 . 1 1 1 A 22 22 THR H H 22 8.849 8.879 -0.030 1
1 75 . 1 1 1 A 22 22 THR C C 22 175.342 174.854 0.488 1
1 76 . 1 1 1 A 22 22 THR CA C 22 60.361 61.077 -0.716 1
1 77 . 1 1 1 A 22 22 THR CB C 22 69.993 70.091 -0.098 1
1 78 . 1 1 1 A 22 22 THR N N 22 108.365 113.842 -5.477 1
1 79 . 1 1 1 A 23 23 GLY H H 23 8.064 7.992 0.072 1
1 80 . 1 1 1 A 23 23 GLY C C 23 171.892 174.670 -2.778 1
1 81 . 1 1 1 A 23 23 GLY CA C 23 45.145 45.988 -0.843 1
1 82 . 1 1 1 A 23 23 GLY N N 23 109.723 110.692 -0.969 1
1 83 . 1 1 1 A 24 24 SER H H 24 7.657 8.110 -0.453 1
1 84 . 1 1 1 A 24 24 SER C C 24 174.458 175.174 -0.716 1
1 85 . 1 1 1 A 24 24 SER CA C 24 60.160 58.739 1.421 1
1 86 . 1 1 1 A 24 24 SER CB C 24 63.121 62.963 0.158 1
1 87 . 1 1 1 A 24 24 SER N N 24 113.459 115.969 -2.510 1
1 88 . 1 1 1 A 25 25 ASN H H 25 8.635 8.983 -0.348 1
1 89 . 1 1 1 A 25 25 ASN C C 25 173.872 174.289 -0.417 1
1 90 . 1 1 1 A 25 25 ASN CA C 25 55.012 54.706 0.306 1
1 91 . 1 1 1 A 25 25 ASN CB C 25 37.688 37.240 0.448 1
1 92 . 1 1 1 A 25 25 ASN N N 25 116.822 120.074 -3.252 1
1 93 . 1 1 1 A 26 26 VAL H H 26 7.700 7.706 -0.006 1
1 94 . 1 1 1 A 26 26 VAL C C 26 175.013 174.880 0.133 1
1 95 . 1 1 1 A 26 26 VAL CA C 26 63.088 61.473 1.615 1
1 96 . 1 1 1 A 26 26 VAL CB C 26 32.347 33.504 -1.157 1
1 97 . 1 1 1 A 26 26 VAL N N 26 121.224 119.348 1.876 1
1 98 . 1 1 1 A 27 27 LYS H H 27 9.964 8.910 1.054 1
1 99 . 1 1 1 A 27 27 LYS C C 27 176.202 175.819 0.383 1
1 100 . 1 1 1 A 27 27 LYS CA C 27 56.539 56.075 0.464 1
1 101 . 1 1 1 A 27 27 LYS CB C 27 33.832 33.286 0.546 1
1 102 . 1 1 1 A 27 27 LYS N N 27 129.017 129.317 -0.300 1
1 103 . 1 1 1 A 28 28 VAL H H 28 9.341 9.010 0.331 1
1 104 . 1 1 1 A 28 28 VAL C C 28 174.539 174.495 0.044 1
1 105 . 1 1 1 A 28 28 VAL CA C 28 60.384 60.922 -0.538 1
1 106 . 1 1 1 A 28 28 VAL CB C 28 33.689 34.239 -0.550 1
1 107 . 1 1 1 A 28 28 VAL N N 28 125.284 125.578 -0.294 1
1 108 . 1 1 1 A 29 29 ALA H H 29 9.089 9.035 0.054 1
1 109 . 1 1 1 A 29 29 ALA C C 29 175.639 176.050 -0.411 1
1 110 . 1 1 1 A 29 29 ALA CA C 29 50.529 50.328 0.201 1
1 111 . 1 1 1 A 29 29 ALA CB C 29 19.374 20.733 -1.359 1
1 112 . 1 1 1 A 29 29 ALA N N 29 128.191 130.200 -2.009 1
1 113 . 1 1 1 A 30 30 VAL H H 30 9.043 9.122 -0.079 1
1 114 . 1 1 1 A 30 30 VAL CA C 30 63.113 61.906 1.207 1
1 115 . 1 1 1 A 30 30 VAL CB C 30 31.258 32.249 -0.991 1
1 116 . 1 1 1 A 30 30 VAL N N 30 126.830 123.554 3.276 1
1 117 . 1 1 1 A 31 31 ILE C C 31 174.959 174.344 0.615 1
1 118 . 1 1 1 A 31 31 ILE CA C 31 62.367 61.178 1.189 1
1 119 . 1 1 1 A 31 31 ILE CB C 31 35.461 36.925 -1.464 1
1 120 . 1 1 1 A 32 32 ASP H H 32 8.832 8.179 0.653 1
1 121 . 1 1 1 A 32 32 ASP C C 32 176.385 176.738 -0.353 1
1 122 . 1 1 1 A 32 32 ASP CA C 32 55.827 53.720 2.107 1
1 123 . 1 1 1 A 32 32 ASP CB C 32 45.495 45.244 0.251 1
1 124 . 1 1 1 A 32 32 ASP N N 32 131.862 129.735 2.127 1
1 125 . 1 1 1 A 33 33 SER H H 33 7.881 8.540 -0.659 1
1 126 . 1 1 1 A 33 33 SER C C 33 172.909 173.977 -1.068 1
1 127 . 1 1 1 A 33 33 SER CA C 33 60.034 58.757 1.277 1
1 128 . 1 1 1 A 33 33 SER CB C 33 64.679 63.079 1.600 1
1 129 . 1 1 1 A 33 33 SER N N 33 123.218 118.053 5.165 1
1 130 . 1 1 1 A 34 34 GLY H H 34 7.355 7.663 -0.308 1
1 131 . 1 1 1 A 34 34 GLY C C 34 171.537 172.878 -1.341 1
1 132 . 1 1 1 A 34 34 GLY CA C 34 43.920 44.048 -0.128 1
1 133 . 1 1 1 A 34 34 GLY N N 34 108.667 108.884 -0.217 1
1 134 . 1 1 1 A 35 35 ILE H H 35 7.272 8.101 -0.829 1
1 135 . 1 1 1 A 35 35 ILE C C 35 173.900 174.394 -0.494 1
1 136 . 1 1 1 A 35 35 ILE CA C 35 60.973 59.940 1.033 1
1 137 . 1 1 1 A 35 35 ILE CB C 35 43.293 41.722 1.571 1
1 138 . 1 1 1 A 35 35 ILE N N 35 111.649 118.076 -6.427 1
1 139 . 1 1 1 A 36 36 ASP H H 36 8.126 8.618 -0.492 1
1 140 . 1 1 1 A 36 36 ASP C C 36 175.698 176.686 -0.988 1
1 141 . 1 1 1 A 36 36 ASP CA C 36 53.432 53.059 0.373 1
1 142 . 1 1 1 A 36 36 ASP CB C 36 40.064 40.166 -0.102 1
1 143 . 1 1 1 A 36 36 ASP N N 36 123.220 126.500 -3.280 1
1 144 . 1 1 1 A 37 37 SER H H 37 7.785 8.783 -0.998 1
1 145 . 1 1 1 A 37 37 SER C C 37 174.152 175.540 -1.388 1
1 146 . 1 1 1 A 37 37 SER CA C 37 59.477 61.449 -1.972 1
1 147 . 1 1 1 A 37 37 SER CB C 37 63.404 63.126 0.278 1
1 148 . 1 1 1 A 37 37 SER N N 37 122.475 121.286 1.189 1
1 149 . 1 1 1 A 38 38 SER H H 38 8.363 7.791 0.572 1
1 150 . 1 1 1 A 38 38 SER C C 38 174.585 174.934 -0.349 1
1 151 . 1 1 1 A 38 38 SER CA C 38 59.438 59.850 -0.412 1
1 152 . 1 1 1 A 38 38 SER CB C 38 63.995 63.294 0.701 1
1 153 . 1 1 1 A 38 38 SER N N 38 117.749 114.797 2.952 1
1 154 . 1 1 1 A 39 39 HIS H H 39 7.379 7.603 -0.224 1
1 155 . 1 1 1 A 39 39 HIS CA C 39 56.547 55.072 1.475 1
1 156 . 1 1 1 A 39 39 HIS CB C 39 31.627 31.127 0.500 1
1 157 . 1 1 1 A 39 39 HIS N N 39 128.489 122.739 5.750 1
1 158 . 1 1 1 A 40 40 PRO C C 40 178.027 178.584 -0.557 1
1 159 . 1 1 1 A 40 40 PRO CA C 40 64.582 65.701 -1.119 1
1 160 . 1 1 1 A 40 40 PRO CB C 40 32.268 31.841 0.427 1
1 161 . 1 1 1 A 41 41 ASP H H 41 10.130 8.815 1.315 1
1 162 . 1 1 1 A 41 41 ASP C C 41 175.889 177.337 -1.448 1
1 163 . 1 1 1 A 41 41 ASP CA C 41 54.258 57.324 -3.066 1
1 164 . 1 1 1 A 41 41 ASP CB C 41 40.805 40.951 -0.146 1
1 165 . 1 1 1 A 41 41 ASP N N 41 118.089 117.793 0.296 1
1 166 . 1 1 1 A 42 42 LEU H H 42 7.595 7.738 -0.143 1
1 167 . 1 1 1 A 42 42 LEU C C 42 174.385 175.966 -1.581 1
1 168 . 1 1 1 A 42 42 LEU CA C 42 53.545 55.330 -1.785 1
1 169 . 1 1 1 A 42 42 LEU CB C 42 44.765 41.883 2.882 1
1 170 . 1 1 1 A 42 42 LEU N N 42 118.035 120.181 -2.146 1
1 171 . 1 1 1 A 43 43 ASN H H 43 6.188 8.890 -2.702 1
1 172 . 1 1 1 A 43 43 ASN C C 43 174.044 173.886 0.158 1
1 173 . 1 1 1 A 43 43 ASN CA C 43 52.308 51.832 0.476 1
1 174 . 1 1 1 A 43 43 ASN CB C 43 40.061 39.898 0.163 1
1 175 . 1 1 1 A 43 43 ASN N N 43 117.962 123.644 -5.682 1
1 176 . 1 1 1 A 44 44 VAL H H 44 8.379 8.970 -0.591 1
1 177 . 1 1 1 A 44 44 VAL C C 44 174.765 176.034 -1.269 1
1 178 . 1 1 1 A 44 44 VAL CA C 44 61.556 61.495 0.061 1
1 179 . 1 1 1 A 44 44 VAL CB C 44 33.222 32.930 0.292 1
1 180 . 1 1 1 A 44 44 VAL N N 44 123.712 126.829 -3.117 1
1 181 . 1 1 1 A 45 45 ALA H H 45 8.890 8.747 0.143 1
1 182 . 1 1 1 A 45 45 ALA C C 45 177.156 176.903 0.253 1
1 183 . 1 1 1 A 45 45 ALA CA C 45 52.915 53.054 -0.139 1
1 184 . 1 1 1 A 45 45 ALA CB C 45 19.228 19.569 -0.341 1
1 185 . 1 1 1 A 45 45 ALA N N 45 129.905 129.819 0.086 1
1 186 . 1 1 1 A 46 46 GLY H H 46 6.984 7.513 -0.529 1
1 187 . 1 1 1 A 46 46 GLY C C 46 172.015 171.675 0.340 1
1 188 . 1 1 1 A 46 46 GLY CA C 46 45.278 45.943 -0.665 1
1 189 . 1 1 1 A 46 46 GLY N N 46 102.581 103.122 -0.541 1
1 190 . 1 1 1 A 47 47 GLY H H 47 9.023 8.408 0.615 1
1 191 . 1 1 1 A 47 47 GLY C C 47 170.011 170.831 -0.820 1
1 192 . 1 1 1 A 47 47 GLY CA C 47 46.509 45.586 0.923 1
1 193 . 1 1 1 A 47 47 GLY N N 47 107.691 107.978 -0.287 1
1 194 . 1 1 1 A 48 48 ALA H H 48 7.999 8.295 -0.296 1
1 195 . 1 1 1 A 48 48 ALA C C 48 174.938 174.691 0.247 1
1 196 . 1 1 1 A 48 48 ALA CA C 48 51.791 50.840 0.951 1
1 197 . 1 1 1 A 48 48 ALA CB C 48 21.544 22.313 -0.769 1
1 198 . 1 1 1 A 48 48 ALA N N 48 118.075 120.912 -2.837 1
1 199 . 1 1 1 A 49 49 SER H H 49 8.326 8.771 -0.445 1
1 200 . 1 1 1 A 49 49 SER CA C 49 54.725 55.668 -0.943 1
1 201 . 1 1 1 A 49 49 SER CB C 49 64.694 64.707 -0.013 1
1 202 . 1 1 1 A 49 49 SER N N 49 112.671 114.043 -1.372 1
1 203 . 1 1 1 A 50 50 PHE C C 50 174.813 174.978 -0.165 1
1 204 . 1 1 1 A 55 55 THR C C 55 173.541 174.070 -0.529 1
1 205 . 1 1 1 A 57 57 PRO C C 57 173.439 177.625 -4.186 1
1 206 . 1 1 1 A 57 57 PRO CA C 57 64.081 64.295 -0.214 1
1 207 . 1 1 1 A 57 57 PRO CB C 57 31.270 31.360 -0.090 1
1 208 . 1 1 1 A 58 58 PHE H H 58 7.360 8.012 -0.652 1
1 209 . 1 1 1 A 58 58 PHE C C 58 174.610 175.442 -0.832 1
1 210 . 1 1 1 A 58 58 PHE CA C 58 55.004 58.522 -3.518 1
1 211 . 1 1 1 A 58 58 PHE CB C 58 37.033 38.803 -1.770 1
1 212 . 1 1 1 A 58 58 PHE N N 58 116.824 116.462 0.362 1
1 213 . 1 1 1 A 59 59 GLN H H 59 6.850 7.553 -0.703 1
1 214 . 1 1 1 A 59 59 GLN C C 59 173.865 173.663 0.202 1
1 215 . 1 1 1 A 59 59 GLN CA C 59 54.018 54.209 -0.191 1
1 216 . 1 1 1 A 59 59 GLN CB C 59 30.777 31.677 -0.900 1
1 217 . 1 1 1 A 59 59 GLN N N 59 118.794 120.799 -2.005 1
1 218 . 1 1 1 A 60 60 ASP H H 60 8.881 8.818 0.063 1
1 219 . 1 1 1 A 60 60 ASP C C 60 175.359 176.431 -1.072 1
1 220 . 1 1 1 A 60 60 ASP CA C 60 51.435 52.468 -1.033 1
1 221 . 1 1 1 A 60 60 ASP CB C 60 41.169 41.544 -0.375 1
1 222 . 1 1 1 A 60 60 ASP N N 60 125.787 127.167 -1.380 1
1 223 . 1 1 1 A 61 61 ASN H H 61 8.674 8.839 -0.165 1
1 224 . 1 1 1 A 61 61 ASN N N 61 121.351 123.248 -1.897 1
1 225 . 1 1 1 A 66 66 THR C C 66 175.118 175.790 -0.672 1
1 226 . 1 1 1 A 68 68 VAL H H 68 8.080 8.416 -0.336 1
1 227 . 1 1 1 A 68 68 VAL C C 68 178.767 178.178 0.589 1
1 228 . 1 1 1 A 68 68 VAL CA C 68 65.971 66.238 -0.267 1
1 229 . 1 1 1 A 68 68 VAL CB C 68 32.293 31.519 0.774 1
1 230 . 1 1 1 A 68 68 VAL N N 68 117.253 119.761 -2.508 1
1 231 . 1 1 1 A 69 69 ALA H H 69 8.546 8.287 0.259 1
1 232 . 1 1 1 A 69 69 ALA C C 69 179.179 179.952 -0.773 1
1 233 . 1 1 1 A 69 69 ALA CA C 69 55.568 55.227 0.341 1
1 234 . 1 1 1 A 69 69 ALA CB C 69 19.831 18.651 1.180 1
1 235 . 1 1 1 A 69 69 ALA N N 69 120.680 121.253 -0.573 1
1 236 . 1 1 1 A 70 70 GLY H H 70 7.686 8.297 -0.611 1
1 237 . 1 1 1 A 70 70 GLY C C 70 177.100 176.383 0.717 1
1 238 . 1 1 1 A 70 70 GLY CA C 70 47.411 47.110 0.301 1
1 239 . 1 1 1 A 70 70 GLY N N 70 102.553 105.968 -3.415 1
1 240 . 1 1 1 A 71 71 THR H H 71 7.396 7.947 -0.551 1
1 241 . 1 1 1 A 71 71 THR C C 71 175.544 176.557 -1.013 1
1 242 . 1 1 1 A 71 71 THR CA C 71 66.438 66.225 0.213 1
1 243 . 1 1 1 A 71 71 THR CB C 71 67.488 67.761 -0.273 1
1 244 . 1 1 1 A 71 71 THR N N 71 120.578 118.301 2.277 1
1 245 . 1 1 1 A 72 72 VAL H H 72 7.454 8.192 -0.738 1
1 246 . 1 1 1 A 72 72 VAL C C 72 177.963 177.975 -0.012 1
1 247 . 1 1 1 A 72 72 VAL CA C 72 67.565 66.433 1.132 1
1 248 . 1 1 1 A 72 72 VAL CB C 72 30.780 31.646 -0.866 1
1 249 . 1 1 1 A 72 72 VAL N N 72 120.188 122.385 -2.197 1
1 250 . 1 1 1 A 73 73 LEU H H 73 7.332 8.214 -0.882 1
1 251 . 1 1 1 A 73 73 LEU C C 73 178.118 179.399 -1.281 1
1 252 . 1 1 1 A 73 73 LEU CA C 73 55.783 57.711 -1.928 1
1 253 . 1 1 1 A 73 73 LEU CB C 73 41.912 40.741 1.171 1
1 254 . 1 1 1 A 73 73 LEU N N 73 115.398 117.774 -2.376 1
1 265 . 1 1 1 A 76 76 ALA H H 85 8.827 7.810 1.017 1
1 266 . 1 1 1 A 76 76 ALA CA C 85 49.379 49.378 0.001 1
1 267 . 1 1 1 A 76 76 ALA CB C 85 19.124 19.061 0.063 1
1 268 . 1 1 1 A 76 76 ALA N N 85 123.318 122.146 1.172 1
1 269 . 1 1 1 A 77 77 PRO C C 86 178.571 177.756 0.815 1
1 270 . 1 1 1 A 77 77 PRO CA C 86 65.322 64.809 0.513 1
1 271 . 1 1 1 A 77 77 PRO CB C 86 32.642 31.918 0.724 1
1 272 . 1 1 1 A 78 78 SER H H 87 8.166 8.301 -0.135 1
1 273 . 1 1 1 A 78 78 SER C C 87 173.552 174.164 -0.612 1
1 274 . 1 1 1 A 78 78 SER CA C 87 56.808 58.389 -1.581 1
1 275 . 1 1 1 A 78 78 SER CB C 87 62.754 63.895 -1.141 1
1 276 . 1 1 1 A 78 78 SER N N 87 110.236 111.595 -1.359 1
1 277 . 1 1 1 A 79 79 ALA H H 88 7.632 7.367 0.265 1
1 278 . 1 1 1 A 79 79 ALA C C 88 176.549 177.515 -0.966 1
1 279 . 1 1 1 A 79 79 ALA CA C 88 52.807 52.537 0.270 1
1 280 . 1 1 1 A 79 79 ALA CB C 88 17.887 19.562 -1.675 1
1 281 . 1 1 1 A 79 79 ALA N N 88 124.474 125.290 -0.816 1
1 282 . 1 1 1 A 80 80 SER H H 89 8.689 8.684 0.005 1
1 283 . 1 1 1 A 80 80 SER C C 89 172.588 173.925 -1.337 1
1 284 . 1 1 1 A 80 80 SER CA C 89 57.786 58.530 -0.744 1
1 285 . 1 1 1 A 80 80 SER CB C 89 64.457 63.671 0.786 1
1 286 . 1 1 1 A 80 80 SER N N 89 116.414 119.229 -2.815 1
1 287 . 1 1 1 A 81 81 LEU H H 90 8.465 8.985 -0.520 1
1 288 . 1 1 1 A 81 81 LEU C C 90 176.033 174.379 1.654 1
1 289 . 1 1 1 A 81 81 LEU CA C 90 53.927 53.909 0.018 1
1 290 . 1 1 1 A 81 81 LEU CB C 90 45.006 44.262 0.744 1
1 291 . 1 1 1 A 81 81 LEU N N 90 125.111 128.778 -3.667 1
1 292 . 1 1 1 A 82 82 TYR H H 91 8.957 9.103 -0.146 1
1 293 . 1 1 1 A 82 82 TYR C C 91 174.981 174.754 0.227 1
1 294 . 1 1 1 A 82 82 TYR CA C 91 56.494 56.696 -0.202 1
1 295 . 1 1 1 A 82 82 TYR CB C 91 40.661 41.762 -1.101 1
1 296 . 1 1 1 A 82 82 TYR N N 91 119.875 124.597 -4.722 1
1 297 . 1 1 1 A 83 83 ALA H H 92 8.684 8.929 -0.245 1
1 298 . 1 1 1 A 83 83 ALA C C 92 173.325 175.758 -2.433 1
1 299 . 1 1 1 A 83 83 ALA CA C 92 51.133 50.529 0.604 1
1 300 . 1 1 1 A 83 83 ALA CB C 92 20.106 20.434 -0.328 1
1 301 . 1 1 1 A 83 83 ALA N N 92 127.148 126.652 0.496 1
1 302 . 1 1 1 A 84 84 VAL H H 93 7.637 9.028 -1.391 1
1 303 . 1 1 1 A 84 84 VAL C C 93 175.018 174.388 0.630 1
1 304 . 1 1 1 A 84 84 VAL CA C 93 60.668 61.234 -0.566 1
1 305 . 1 1 1 A 84 84 VAL CB C 93 31.418 32.589 -1.171 1
1 306 . 1 1 1 A 84 84 VAL N N 93 125.514 124.236 1.278 1
1 307 . 1 1 1 A 85 85 LYS H H 94 8.670 8.820 -0.150 1
1 308 . 1 1 1 A 85 85 LYS C C 94 174.869 176.478 -1.609 1
1 309 . 1 1 1 A 85 85 LYS CA C 94 56.344 56.301 0.043 1
1 310 . 1 1 1 A 85 85 LYS CB C 94 33.649 32.341 1.308 1
1 311 . 1 1 1 A 85 85 LYS N N 94 129.391 129.088 0.303 1
1 312 . 1 1 1 A 86 86 VAL H H 95 8.945 8.825 0.120 1
1 313 . 1 1 1 A 86 86 VAL C C 95 171.170 175.480 -4.310 1
1 314 . 1 1 1 A 86 86 VAL CA C 95 60.612 61.922 -1.310 1
1 315 . 1 1 1 A 86 86 VAL CB C 95 33.496 33.985 -0.489 1
1 316 . 1 1 1 A 86 86 VAL N N 95 118.856 120.403 -1.547 1
1 317 . 1 1 1 A 87 87 LEU H H 96 6.793 7.595 -0.802 1
1 318 . 1 1 1 A 87 87 LEU C C 96 176.801 176.680 0.121 1
1 319 . 1 1 1 A 87 87 LEU CA C 96 51.614 53.762 -2.148 1
1 320 . 1 1 1 A 87 87 LEU CB C 96 44.512 43.523 0.989 1
1 321 . 1 1 1 A 87 87 LEU N N 96 116.231 122.177 -5.946 1
1 322 . 1 1 1 A 88 88 GLY H H 97 8.326 8.541 -0.215 1
1 323 . 1 1 1 A 88 88 GLY C C 97 175.299 175.070 0.229 1
1 324 . 1 1 1 A 88 88 GLY CA C 97 43.580 43.935 -0.355 1
1 325 . 1 1 1 A 88 88 GLY N N 97 105.680 108.414 -2.734 1
1 326 . 1 1 1 A 89 89 ALA H H 98 9.601 8.783 0.818 1
1 327 . 1 1 1 A 89 89 ALA C C 98 179.069 178.727 0.342 1
1 328 . 1 1 1 A 89 89 ALA CA C 98 55.525 54.667 0.858 1
1 329 . 1 1 1 A 89 89 ALA CB C 98 19.175 18.621 0.554 1
1 330 . 1 1 1 A 89 89 ALA N N 98 123.650 122.138 1.512 1
1 331 . 1 1 1 A 90 90 ASP H H 99 8.369 7.899 0.470 1
1 332 . 1 1 1 A 90 90 ASP C C 99 177.666 176.856 0.810 1
1 333 . 1 1 1 A 90 90 ASP CA C 99 53.796 53.532 0.264 1
1 334 . 1 1 1 A 90 90 ASP CB C 99 39.934 40.845 -0.911 1
1 335 . 1 1 1 A 90 90 ASP N N 99 114.791 113.623 1.168 1
1 336 . 1 1 1 A 91 91 GLY H H 100 8.787 8.124 0.663 1
1 337 . 1 1 1 A 91 91 GLY CA C 100 45.604 44.993 0.611 1
1 338 . 1 1 1 A 91 91 GLY N N 100 108.611 109.795 -1.184 1
1 339 . 1 1 1 A 99 99 ILE C C 108 177.321 177.746 -0.425 1
1 340 . 1 1 1 A 99 99 ILE CA C 108 66.386 65.367 1.019 1
1 341 . 1 1 1 A 99 99 ILE CB C 108 40.561 37.585 2.976 1
1 342 . 1 1 1 A 100 100 ASN H H 109 7.658 8.809 -1.151 1
1 343 . 1 1 1 A 100 100 ASN C C 109 178.040 178.705 -0.665 1
1 344 . 1 1 1 A 100 100 ASN CA C 109 55.745 55.808 -0.063 1
1 345 . 1 1 1 A 100 100 ASN CB C 109 37.542 37.298 0.244 1
1 346 . 1 1 1 A 100 100 ASN N N 109 118.127 118.413 -0.286 1
1 347 . 1 1 1 A 101 101 GLY H H 110 7.812 8.252 -0.440 1
1 348 . 1 1 1 A 101 101 GLY C C 110 174.527 176.055 -1.528 1
1 349 . 1 1 1 A 101 101 GLY CA C 110 47.985 47.247 0.738 1
1 350 . 1 1 1 A 101 101 GLY N N 110 108.901 108.661 0.240 1
1 351 . 1 1 1 A 102 102 ILE H H 111 8.440 8.168 0.272 1
1 352 . 1 1 1 A 102 102 ILE C C 111 177.982 178.330 -0.348 1
1 353 . 1 1 1 A 102 102 ILE CA C 111 66.596 64.399 2.197 1
1 354 . 1 1 1 A 102 102 ILE CB C 111 37.989 37.454 0.535 1
1 355 . 1 1 1 A 102 102 ILE N N 111 123.912 122.419 1.493 1
1 356 . 1 1 1 A 103 103 GLU H H 112 8.564 8.078 0.486 1
1 357 . 1 1 1 A 103 103 GLU C C 112 180.057 178.872 1.185 1
1 358 . 1 1 1 A 103 103 GLU CA C 112 60.016 59.670 0.346 1
1 359 . 1 1 1 A 103 103 GLU CB C 112 28.740 29.286 -0.546 1
1 360 . 1 1 1 A 103 103 GLU N N 112 118.317 118.343 -0.026 1
1 361 . 1 1 1 A 104 104 TRP H H 113 8.157 8.092 0.065 1
1 362 . 1 1 1 A 104 104 TRP C C 113 179.017 178.210 0.807 1
1 363 . 1 1 1 A 104 104 TRP CA C 113 62.386 61.369 1.017 1
1 364 . 1 1 1 A 104 104 TRP CB C 113 29.734 29.373 0.361 1
1 365 . 1 1 1 A 104 104 TRP N N 113 121.908 122.025 -0.117 1
1 366 . 1 1 1 A 105 105 ALA H H 114 8.278 8.138 0.140 1
1 367 . 1 1 1 A 105 105 ALA C C 114 169.470 179.989 -10.519 1
1 368 . 1 1 1 A 105 105 ALA CA C 114 55.160 55.168 -0.008 1
1 369 . 1 1 1 A 105 105 ALA CB C 114 17.984 18.274 -0.290 1
1 370 . 1 1 1 A 105 105 ALA N N 114 122.626 120.769 1.857 1
1 371 . 1 1 1 A 106 106 ILE H H 115 8.086 7.942 0.144 1
1 372 . 1 1 1 A 106 106 ILE C C 115 179.582 177.830 1.752 1
1 373 . 1 1 1 A 106 106 ILE CA C 115 65.453 65.475 -0.022 1
1 374 . 1 1 1 A 106 106 ILE CB C 115 39.007 37.992 1.015 1
1 375 . 1 1 1 A 106 106 ILE N N 115 117.256 119.045 -1.789 1
1 376 . 1 1 1 A 107 107 ALA H H 116 7.938 8.374 -0.436 1
1 377 . 1 1 1 A 107 107 ALA C C 116 177.986 178.749 -0.763 1
1 378 . 1 1 1 A 107 107 ALA CA C 116 54.362 54.780 -0.418 1
1 379 . 1 1 1 A 107 107 ALA CB C 116 17.814 18.414 -0.600 1
1 380 . 1 1 1 A 107 107 ALA N N 116 121.796 121.580 0.216 1
1 381 . 1 1 1 A 108 108 ASN H H 117 7.112 7.701 -0.589 1
1 382 . 1 1 1 A 108 108 ASN C C 117 172.432 173.969 -1.537 1
1 383 . 1 1 1 A 108 108 ASN CA C 117 53.131 52.461 0.670 1
1 384 . 1 1 1 A 108 108 ASN CB C 117 37.993 37.837 0.156 1
1 385 . 1 1 1 A 108 108 ASN N N 117 112.535 113.809 -1.274 1
1 386 . 1 1 1 A 109 109 ASN H H 118 7.577 8.075 -0.498 1
1 387 . 1 1 1 A 109 109 ASN C C 118 174.502 174.469 0.033 1
1 388 . 1 1 1 A 109 109 ASN CA C 118 54.340 54.381 -0.041 1
1 389 . 1 1 1 A 109 109 ASN CB C 118 36.560 36.659 -0.099 1
1 390 . 1 1 1 A 109 109 ASN N N 118 113.483 114.696 -1.213 1
1 391 . 1 1 1 A 110 110 MET H H 119 7.409 7.810 -0.401 1
1 392 . 1 1 1 A 110 110 MET C C 119 174.612 175.556 -0.944 1
1 393 . 1 1 1 A 110 110 MET CA C 119 54.446 55.299 -0.853 1
1 394 . 1 1 1 A 110 110 MET CB C 119 33.856 32.656 1.200 1
1 395 . 1 1 1 A 110 110 MET N N 119 113.384 117.745 -4.361 1
1 396 . 1 1 1 A 111 111 ASP H H 120 8.407 8.805 -0.398 1
1 397 . 1 1 1 A 111 111 ASP C C 120 177.423 176.248 1.175 1
1 398 . 1 1 1 A 111 111 ASP CA C 120 56.843 56.791 0.052 1
1 399 . 1 1 1 A 111 111 ASP CB C 120 44.412 42.815 1.597 1
1 400 . 1 1 1 A 111 111 ASP N N 120 118.270 122.453 -4.183 1
1 401 . 1 1 1 A 112 112 VAL H H 121 8.065 7.866 0.199 1
1 402 . 1 1 1 A 112 112 VAL C C 121 174.467 174.655 -0.188 1
1 403 . 1 1 1 A 112 112 VAL CA C 121 59.929 60.359 -0.430 1
1 404 . 1 1 1 A 112 112 VAL CB C 121 37.221 35.633 1.588 1
1 405 . 1 1 1 A 112 112 VAL N N 121 118.512 117.523 0.989 1
1 406 . 1 1 1 A 113 113 ILE H H 122 9.244 8.903 0.341 1
1 407 . 1 1 1 A 113 113 ILE C C 122 172.849 174.098 -1.249 1
1 408 . 1 1 1 A 113 113 ILE CA C 122 60.240 60.012 0.228 1
1 409 . 1 1 1 A 113 113 ILE CB C 122 42.535 41.035 1.500 1
1 410 . 1 1 1 A 113 113 ILE N N 122 124.847 127.080 -2.233 1
1 411 . 1 1 1 A 114 114 ASN H H 123 8.834 8.907 -0.073 1
1 412 . 1 1 1 A 114 114 ASN C C 123 174.311 174.129 0.182 1
1 413 . 1 1 1 A 114 114 ASN CA C 123 53.033 51.877 1.156 1
1 414 . 1 1 1 A 114 114 ASN CB C 123 43.405 42.288 1.117 1
1 415 . 1 1 1 A 114 114 ASN N N 123 124.616 126.362 -1.746 1
1 416 . 1 1 1 A 115 115 MET H H 124 9.408 8.946 0.462 1
1 417 . 1 1 1 A 115 115 MET CA C 124 54.593 54.508 0.085 1
1 418 . 1 1 1 A 115 115 MET CB C 124 34.618 34.328 0.290 1
1 419 . 1 1 1 A 115 115 MET N N 124 126.877 125.408 1.469 1
1 420 . 1 1 1 A 127 127 LYS C C 136 177.508 178.461 -0.953 1
1 421 . 1 1 1 A 127 127 LYS CA C 136 59.413 58.597 0.816 1
1 422 . 1 1 1 A 127 127 LYS CB C 136 32.196 31.823 0.373 1
1 423 . 1 1 1 A 128 128 ALA H H 137 7.923 8.067 -0.144 1
1 424 . 1 1 1 A 128 128 ALA C C 137 180.387 179.626 0.761 1
1 425 . 1 1 1 A 128 128 ALA CA C 137 54.708 55.024 -0.316 1
1 426 . 1 1 1 A 128 128 ALA CB C 137 17.756 17.779 -0.023 1
1 427 . 1 1 1 A 128 128 ALA N N 137 117.347 121.422 -4.075 1
1 428 . 1 1 1 A 129 129 ALA H H 138 7.353 7.901 -0.548 1
1 429 . 1 1 1 A 129 129 ALA CA C 138 55.365 55.053 0.312 1
1 430 . 1 1 1 A 129 129 ALA CB C 138 18.718 18.945 -0.227 1
1 431 . 1 1 1 A 129 129 ALA N N 138 119.890 119.757 0.133 1
1 432 . 1 1 1 A 130 130 VAL C C 139 177.610 177.883 -0.273 1
1 433 . 1 1 1 A 130 130 VAL CA C 139 66.210 65.410 0.800 1
1 434 . 1 1 1 A 130 130 VAL CB C 139 31.122 31.645 -0.523 1
1 435 . 1 1 1 A 131 131 ASP H H 140 8.581 8.310 0.271 1
1 436 . 1 1 1 A 131 131 ASP C C 140 179.897 178.737 1.160 1
1 437 . 1 1 1 A 131 131 ASP CA C 140 57.574 57.320 0.254 1
1 438 . 1 1 1 A 131 131 ASP CB C 140 39.106 39.984 -0.878 1
1 439 . 1 1 1 A 131 131 ASP N N 140 121.919 122.791 -0.872 1
1 440 . 1 1 1 A 132 132 LYS H H 141 8.154 7.890 0.264 1
1 441 . 1 1 1 A 132 132 LYS C C 141 179.475 178.566 0.909 1
1 442 . 1 1 1 A 132 132 LYS CA C 141 59.343 58.553 0.790 1
1 443 . 1 1 1 A 132 132 LYS CB C 141 32.086 32.271 -0.185 1
1 444 . 1 1 1 A 132 132 LYS N N 141 122.626 121.071 1.555 1
1 445 . 1 1 1 A 133 133 ALA H H 142 8.013 8.111 -0.098 1
1 446 . 1 1 1 A 133 133 ALA C C 142 179.250 180.058 -0.808 1
1 447 . 1 1 1 A 133 133 ALA CA C 142 55.598 55.231 0.367 1
1 448 . 1 1 1 A 133 133 ALA CB C 142 16.226 18.150 -1.924 1
1 449 . 1 1 1 A 133 133 ALA N N 142 124.336 121.743 2.593 1
1 450 . 1 1 1 A 134 134 VAL H H 143 7.989 8.133 -0.144 1
1 451 . 1 1 1 A 134 134 VAL C C 143 181.099 178.091 3.008 1
1 452 . 1 1 1 A 134 134 VAL CA C 143 66.214 66.814 -0.600 1
1 453 . 1 1 1 A 134 134 VAL CB C 143 31.675 31.636 0.039 1
1 454 . 1 1 1 A 134 134 VAL N N 143 119.698 118.873 0.825 1
1 455 . 1 1 1 A 135 135 ALA H H 144 8.553 8.356 0.197 1
1 456 . 1 1 1 A 135 135 ALA C C 144 179.384 179.592 -0.208 1
1 457 . 1 1 1 A 135 135 ALA CA C 144 54.896 55.095 -0.199 1
1 458 . 1 1 1 A 135 135 ALA CB C 144 17.807 17.962 -0.155 1
1 459 . 1 1 1 A 135 135 ALA N N 144 125.717 121.936 3.781 1
1 460 . 1 1 1 A 136 136 SER H H 145 7.708 7.793 -0.085 1
1 461 . 1 1 1 A 136 136 SER C C 145 173.850 174.606 -0.756 1
1 462 . 1 1 1 A 136 136 SER CA C 145 59.051 58.801 0.250 1
1 463 . 1 1 1 A 136 136 SER CB C 145 63.706 63.586 0.120 1
1 464 . 1 1 1 A 136 136 SER N N 145 112.345 111.273 1.072 1
1 465 . 1 1 1 A 137 137 GLY H H 146 7.668 8.125 -0.457 1
1 466 . 1 1 1 A 137 137 GLY C C 146 174.396 174.582 -0.186 1
1 467 . 1 1 1 A 137 137 GLY CA C 146 44.850 45.230 -0.380 1
1 468 . 1 1 1 A 137 137 GLY N N 146 106.277 109.194 -2.917 1
1 469 . 1 1 1 A 138 138 VAL H H 147 7.927 7.755 0.172 1
1 470 . 1 1 1 A 138 138 VAL C C 147 176.830 174.906 1.924 1
1 471 . 1 1 1 A 138 138 VAL CA C 147 62.614 62.209 0.405 1
1 472 . 1 1 1 A 138 138 VAL CB C 147 32.978 32.077 0.901 1
1 473 . 1 1 1 A 138 138 VAL N N 147 122.591 122.547 0.044 1
1 474 . 1 1 1 A 139 139 VAL H H 148 8.066 8.566 -0.500 1
1 475 . 1 1 1 A 139 139 VAL C C 148 174.652 175.382 -0.730 1
1 476 . 1 1 1 A 139 139 VAL CA C 148 62.736 62.617 0.119 1
1 477 . 1 1 1 A 139 139 VAL CB C 148 32.559 31.871 0.688 1
1 478 . 1 1 1 A 139 139 VAL N N 148 126.667 127.806 -1.139 1
1 479 . 1 1 1 A 140 140 VAL H H 149 8.192 8.954 -0.762 1
1 480 . 1 1 1 A 140 140 VAL C C 149 174.046 175.040 -0.994 1
1 481 . 1 1 1 A 140 140 VAL CA C 149 62.746 60.918 1.828 1
1 482 . 1 1 1 A 140 140 VAL CB C 149 31.824 33.428 -1.604 1
1 483 . 1 1 1 A 140 140 VAL N N 149 128.705 128.564 0.141 1
1 484 . 1 1 1 A 141 141 VAL H H 150 8.676 9.078 -0.402 1
1 485 . 1 1 1 A 141 141 VAL C C 150 173.337 174.526 -1.189 1
1 486 . 1 1 1 A 141 141 VAL CA C 150 61.101 60.790 0.311 1
1 487 . 1 1 1 A 141 141 VAL CB C 150 34.702 34.612 0.090 1
1 488 . 1 1 1 A 141 141 VAL N N 150 130.739 128.241 2.498 1
1 489 . 1 1 1 A 142 142 ALA H H 151 9.471 8.496 0.975 1
1 490 . 1 1 1 A 142 142 ALA CA C 151 50.176 51.261 -1.085 1
1 491 . 1 1 1 A 142 142 ALA CB C 151 24.145 23.154 0.991 1
1 492 . 1 1 1 A 142 142 ALA N N 151 127.769 127.709 0.060 1
1 493 . 1 1 1 A 146 146 ASN C C 155 177.577 175.658 1.919 1
1 494 . 1 1 1 A 146 146 ASN CA C 155 50.911 52.402 -1.491 1
1 495 . 1 1 1 A 146 146 ASN CB C 155 38.375 39.021 -0.646 1
1 496 . 1 1 1 A 147 147 GLU H H 156 7.642 8.182 -0.540 1
1 497 . 1 1 1 A 147 147 GLU C C 156 177.005 177.309 -0.304 1
1 498 . 1 1 1 A 147 147 GLU CA C 156 55.716 56.434 -0.718 1
1 499 . 1 1 1 A 147 147 GLU CB C 156 30.281 30.702 -0.421 1
1 500 . 1 1 1 A 147 147 GLU N N 156 116.511 120.488 -3.977 1
1 501 . 1 1 1 A 148 148 GLY H H 157 7.663 7.971 -0.308 1
1 502 . 1 1 1 A 148 148 GLY C C 157 171.987 173.709 -1.722 1
1 503 . 1 1 1 A 148 148 GLY CA C 157 45.949 45.521 0.428 1
1 504 . 1 1 1 A 148 148 GLY N N 157 106.998 107.898 -0.900 1
1 505 . 1 1 1 A 149 149 THR H H 158 7.956 8.062 -0.106 1
1 506 . 1 1 1 A 149 149 THR C C 158 175.009 173.614 1.395 1
1 507 . 1 1 1 A 149 149 THR CA C 158 59.983 60.257 -0.274 1
1 508 . 1 1 1 A 149 149 THR CB C 158 71.045 71.436 -0.391 1
1 509 . 1 1 1 A 149 149 THR N N 158 110.597 113.786 -3.189 1
1 510 . 1 1 1 A 150 150 SER H H 159 9.892 8.749 1.143 1
1 511 . 1 1 1 A 150 150 SER C C 159 172.334 174.603 -2.269 1
1 512 . 1 1 1 A 150 150 SER CA C 159 56.418 56.899 -0.481 1
1 513 . 1 1 1 A 150 150 SER CB C 159 63.035 63.858 -0.823 1
1 514 . 1 1 1 A 150 150 SER N N 159 119.031 118.639 0.392 1
1 515 . 1 1 1 A 151 151 GLY H H 160 8.848 8.880 -0.032 1
1 516 . 1 1 1 A 151 151 GLY CA C 160 47.073 47.333 -0.260 1
1 517 . 1 1 1 A 151 151 GLY N N 160 114.654 117.123 -2.469 1
1 518 . 1 1 1 A 154 154 SER C C 163 177.379 175.369 2.010 1
1 519 . 1 1 1 A 154 154 SER CA C 163 57.430 57.559 -0.129 1
1 520 . 1 1 1 A 154 154 SER CB C 163 63.373 63.616 -0.243 1
1 521 . 1 1 1 A 155 155 THR H H 164 9.610 8.665 0.945 1
1 522 . 1 1 1 A 155 155 THR C C 164 176.334 174.801 1.533 1
1 523 . 1 1 1 A 155 155 THR CA C 164 59.923 62.215 -2.292 1
1 524 . 1 1 1 A 155 155 THR CB C 164 69.343 69.612 -0.269 1
1 525 . 1 1 1 A 155 155 THR N N 164 118.808 115.175 3.633 1
1 526 . 1 1 1 A 156 156 VAL H H 165 7.458 7.317 0.141 1
1 527 . 1 1 1 A 156 156 VAL C C 165 175.857 176.065 -0.208 1
1 528 . 1 1 1 A 156 156 VAL CA C 165 63.666 62.903 0.763 1
1 529 . 1 1 1 A 156 156 VAL CB C 165 31.579 31.608 -0.029 1
1 530 . 1 1 1 A 156 156 VAL N N 165 127.426 123.771 3.655 1
1 531 . 1 1 1 A 157 157 GLY H H 166 8.641 8.701 -0.060 1
1 532 . 1 1 1 A 157 157 GLY C C 166 171.879 172.533 -0.654 1
1 533 . 1 1 1 A 157 157 GLY CA C 166 45.995 44.399 1.596 1
1 534 . 1 1 1 A 157 157 GLY N N 166 104.439 115.202 -10.763 1
1 535 . 1 1 1 A 158 158 TYR H H 167 7.394 8.264 -0.870 1
1 536 . 1 1 1 A 158 158 TYR CA C 167 61.986 56.196 5.790 1
1 537 . 1 1 1 A 158 158 TYR CB C 167 34.054 39.153 -5.099 1
1 538 . 1 1 1 A 158 158 TYR N N 167 119.099 118.703 0.396 1
1 539 . 1 1 1 A 163 163 PRO C C 172 178.256 178.135 0.121 1
1 540 . 1 1 1 A 163 163 PRO CA C 172 64.633 65.274 -0.641 1
1 541 . 1 1 1 A 163 163 PRO CB C 172 31.523 31.910 -0.387 1
1 542 . 1 1 1 A 164 164 SER H H 173 7.893 8.008 -0.115 1
1 543 . 1 1 1 A 164 164 SER C C 173 172.746 174.274 -1.528 1
1 544 . 1 1 1 A 164 164 SER CA C 173 58.901 60.409 -1.508 1
1 545 . 1 1 1 A 164 164 SER CB C 173 62.763 62.853 -0.090 1
1 546 . 1 1 1 A 164 164 SER N N 173 111.354 110.094 1.260 1
1 547 . 1 1 1 A 165 165 VAL H H 174 7.580 7.843 -0.263 1
1 548 . 1 1 1 A 165 165 VAL C C 174 174.476 175.560 -1.084 1
1 549 . 1 1 1 A 165 165 VAL CA C 174 61.687 61.907 -0.220 1
1 550 . 1 1 1 A 165 165 VAL CB C 174 33.810 32.726 1.084 1
1 551 . 1 1 1 A 165 165 VAL N N 174 123.663 122.387 1.276 1
1 552 . 1 1 1 A 166 166 ILE H H 175 7.751 8.687 -0.936 1
1 553 . 1 1 1 A 166 166 ILE C C 175 173.514 175.322 -1.808 1
1 554 . 1 1 1 A 166 166 ILE CA C 175 61.545 62.728 -1.183 1
1 555 . 1 1 1 A 166 166 ILE CB C 175 38.562 37.258 1.304 1
1 556 . 1 1 1 A 166 166 ILE N N 175 124.752 128.835 -4.083 1
1 557 . 1 1 1 A 167 167 ALA H H 176 11.194 8.859 2.335 1
1 558 . 1 1 1 A 167 167 ALA C C 176 178.637 176.128 2.509 1
1 559 . 1 1 1 A 167 167 ALA CA C 176 50.798 50.343 0.455 1
1 560 . 1 1 1 A 167 167 ALA CB C 176 19.075 20.533 -1.458 1
1 561 . 1 1 1 A 167 167 ALA N N 176 131.783 131.159 0.624 1
1 562 . 1 1 1 A 168 168 VAL H H 177 8.558 8.800 -0.242 1
1 563 . 1 1 1 A 168 168 VAL C C 177 176.699 175.931 0.768 1
1 564 . 1 1 1 A 168 168 VAL CA C 177 61.460 61.226 0.234 1
1 565 . 1 1 1 A 168 168 VAL CB C 177 33.908 33.720 0.188 1
1 566 . 1 1 1 A 168 168 VAL N N 177 122.470 122.986 -0.516 1
1 567 . 1 1 1 A 169 169 GLY H H 178 9.089 9.042 0.047 1
1 568 . 1 1 1 A 169 169 GLY C C 178 171.692 172.122 -0.430 1
1 569 . 1 1 1 A 169 169 GLY CA C 178 44.076 43.795 0.281 1
1 570 . 1 1 1 A 169 169 GLY N N 178 117.704 115.527 2.177 1
1 571 . 1 1 1 A 170 170 ALA H H 179 7.983 8.459 -0.476 1
1 572 . 1 1 1 A 170 170 ALA C C 179 176.624 176.494 0.130 1
1 573 . 1 1 1 A 170 170 ALA CA C 179 49.813 50.295 -0.482 1
1 574 . 1 1 1 A 170 170 ALA CB C 179 24.269 21.740 2.529 1
1 575 . 1 1 1 A 170 170 ALA N N 179 117.964 121.770 -3.806 1
1 576 . 1 1 1 A 171 171 VAL H H 180 7.791 8.938 -1.147 1
1 577 . 1 1 1 A 171 171 VAL C C 180 175.521 175.566 -0.045 1
1 578 . 1 1 1 A 171 171 VAL CA C 180 58.158 59.239 -1.081 1
1 579 . 1 1 1 A 171 171 VAL CB C 180 35.769 34.960 0.809 1
1 580 . 1 1 1 A 171 171 VAL N N 180 112.019 116.644 -4.625 1
1 581 . 1 1 1 A 172 172 ASP H H 181 8.185 8.416 -0.231 1
1 582 . 1 1 1 A 172 172 ASP C C 181 178.643 178.328 0.315 1
1 583 . 1 1 1 A 172 172 ASP CA C 181 51.976 52.079 -0.103 1
1 584 . 1 1 1 A 172 172 ASP CB C 181 42.090 41.755 0.335 1
1 585 . 1 1 1 A 172 172 ASP N N 181 119.896 122.858 -2.962 1
1 586 . 1 1 1 A 173 173 SER H H 182 8.180 8.611 -0.431 1
1 587 . 1 1 1 A 173 173 SER C C 182 175.332 174.749 0.583 1
1 588 . 1 1 1 A 173 173 SER CA C 182 60.691 60.682 0.009 1
1 589 . 1 1 1 A 173 173 SER CB C 182 63.040 63.065 -0.025 1
1 590 . 1 1 1 A 173 173 SER N N 182 112.707 114.574 -1.867 1
1 591 . 1 1 1 A 174 174 SER H H 183 8.412 7.894 0.518 1
1 592 . 1 1 1 A 174 174 SER C C 183 173.911 174.267 -0.356 1
1 593 . 1 1 1 A 174 174 SER CA C 183 57.825 57.830 -0.005 1
1 594 . 1 1 1 A 174 174 SER CB C 183 64.213 62.941 1.272 1
1 595 . 1 1 1 A 174 174 SER N N 183 118.767 114.238 4.529 1
1 596 . 1 1 1 A 175 175 ASN H H 184 7.997 8.084 -0.087 1
1 597 . 1 1 1 A 175 175 ASN C C 184 173.254 173.988 -0.734 1
1 598 . 1 1 1 A 175 175 ASN CA C 184 55.122 54.978 0.144 1
1 599 . 1 1 1 A 175 175 ASN CB C 184 36.024 37.165 -1.141 1
1 600 . 1 1 1 A 175 175 ASN N N 184 113.302 114.783 -1.481 1
1 601 . 1 1 1 A 176 176 GLN H H 185 7.999 7.674 0.325 1
1 602 . 1 1 1 A 176 176 GLN C C 185 176.581 175.380 1.201 1
1 603 . 1 1 1 A 176 176 GLN CA C 185 54.572 55.313 -0.741 1
1 604 . 1 1 1 A 176 176 GLN CB C 185 29.469 30.274 -0.805 1
1 605 . 1 1 1 A 176 176 GLN N N 185 117.183 119.176 -1.993 1
1 606 . 1 1 1 A 177 177 ARG H H 186 8.180 8.318 -0.138 1
1 607 . 1 1 1 A 177 177 ARG C C 186 176.128 176.312 -0.184 1
1 608 . 1 1 1 A 177 177 ARG CA C 186 56.649 56.686 -0.037 1
1 609 . 1 1 1 A 177 177 ARG CB C 186 29.516 29.984 -0.468 1
1 610 . 1 1 1 A 177 177 ARG N N 186 123.309 126.429 -3.120 1
1 611 . 1 1 1 A 178 178 ALA H H 187 8.062 8.802 -0.740 1
1 612 . 1 1 1 A 178 178 ALA CA C 187 50.927 51.961 -1.034 1
1 613 . 1 1 1 A 178 178 ALA CB C 187 18.788 18.833 -0.045 1
1 614 . 1 1 1 A 178 178 ALA N N 187 131.060 130.145 0.915 1
1 615 . 1 1 1 A 179 179 SER C C 188 175.015 176.029 -1.014 1
1 616 . 1 1 1 A 179 179 SER CA C 188 61.371 61.882 -0.511 1
1 617 . 1 1 1 A 179 179 SER CB C 188 62.564 62.522 0.042 1
1 618 . 1 1 1 A 180 180 PHE H H 189 6.035 7.838 -1.803 1
1 619 . 1 1 1 A 180 180 PHE C C 189 176.413 176.161 0.252 1
1 620 . 1 1 1 A 180 180 PHE CA C 189 55.544 58.508 -2.964 1
1 621 . 1 1 1 A 180 180 PHE CB C 189 39.191 38.094 1.097 1
1 622 . 1 1 1 A 180 180 PHE N N 189 111.460 114.165 -2.705 1
1 623 . 1 1 1 A 181 181 SER H H 190 7.150 7.800 -0.650 1
1 624 . 1 1 1 A 181 181 SER C C 190 175.188 174.720 0.468 1
1 625 . 1 1 1 A 181 181 SER CA C 190 60.364 58.541 1.823 1
1 626 . 1 1 1 A 181 181 SER CB C 190 63.613 63.166 0.447 1
1 627 . 1 1 1 A 181 181 SER N N 190 118.723 117.011 1.712 1
1 628 . 1 1 1 A 182 182 SER H H 191 8.571 8.362 0.209 1
1 629 . 1 1 1 A 182 182 SER C C 191 171.151 174.612 -3.461 1
1 630 . 1 1 1 A 182 182 SER CA C 191 62.476 59.343 3.133 1
1 631 . 1 1 1 A 182 182 SER CB C 191 65.378 64.027 1.351 1
1 632 . 1 1 1 A 182 182 SER N N 191 127.069 123.256 3.813 1
1 633 . 1 1 1 A 183 183 VAL H H 192 7.401 8.755 -1.354 1
1 634 . 1 1 1 A 183 183 VAL C C 192 173.360 174.092 -0.732 1
1 635 . 1 1 1 A 183 183 VAL CA C 192 58.814 59.109 -0.295 1
1 636 . 1 1 1 A 183 183 VAL CB C 192 33.715 34.772 -1.057 1
1 637 . 1 1 1 A 183 183 VAL N N 192 110.286 119.904 -9.618 1
1 638 . 1 1 1 A 184 184 GLY H H 193 7.760 8.427 -0.667 1
1 639 . 1 1 1 A 184 184 GLY CA C 193 43.632 44.013 -0.381 1
1 640 . 1 1 1 A 184 184 GLY N N 193 107.046 108.388 -1.342 1
1 641 . 1 1 1 A 185 185 PRO C C 194 177.341 177.306 0.035 1
1 642 . 1 1 1 A 185 185 PRO CA C 194 63.986 64.935 -0.949 1
1 643 . 1 1 1 A 185 185 PRO CB C 194 31.734 31.918 -0.184 1
1 644 . 1 1 1 A 186 186 GLU H H 195 8.477 8.543 -0.066 1
1 645 . 1 1 1 A 186 186 GLU C C 195 174.026 176.465 -2.439 1
1 646 . 1 1 1 A 186 186 GLU CA C 195 57.153 57.336 -0.183 1
1 647 . 1 1 1 A 186 186 GLU CB C 195 28.291 30.033 -1.742 1
1 648 . 1 1 1 A 186 186 GLU N N 195 115.638 116.955 -1.317 1
1 649 . 1 1 1 A 187 187 LEU H H 196 6.774 7.306 -0.532 1
1 650 . 1 1 1 A 187 187 LEU C C 196 175.408 175.939 -0.531 1
1 651 . 1 1 1 A 187 187 LEU CA C 196 55.361 55.607 -0.246 1
1 652 . 1 1 1 A 187 187 LEU CB C 196 44.110 42.539 1.571 1
1 653 . 1 1 1 A 187 187 LEU N N 196 117.444 122.066 -4.622 1
1 654 . 1 1 1 A 188 188 ASP H H 197 7.950 8.894 -0.944 1
1 655 . 1 1 1 A 188 188 ASP C C 197 176.317 176.548 -0.231 1
1 656 . 1 1 1 A 188 188 ASP CA C 197 58.046 56.189 1.857 1
1 657 . 1 1 1 A 188 188 ASP CB C 197 44.690 41.647 3.043 1
1 658 . 1 1 1 A 188 188 ASP N N 197 123.323 126.071 -2.748 1
1 659 . 1 1 1 A 189 189 VAL H H 198 7.873 7.650 0.223 1
1 660 . 1 1 1 A 189 189 VAL C C 198 172.481 174.066 -1.585 1
1 661 . 1 1 1 A 189 189 VAL CA C 198 58.669 59.072 -0.403 1
1 662 . 1 1 1 A 189 189 VAL CB C 198 37.877 35.532 2.345 1
1 663 . 1 1 1 A 189 189 VAL N N 198 108.103 112.515 -4.412 1
1 664 . 1 1 1 A 190 190 MET H H 199 8.399 8.750 -0.351 1
1 665 . 1 1 1 A 190 190 MET C C 199 175.209 175.095 0.114 1
1 666 . 1 1 1 A 190 190 MET CA C 199 51.535 53.910 -2.375 1
1 667 . 1 1 1 A 190 190 MET CB C 199 36.293 35.188 1.105 1
1 668 . 1 1 1 A 190 190 MET N N 199 113.686 120.893 -7.207 1
1 669 . 1 1 1 A 191 191 ALA H H 200 8.477 8.683 -0.206 1
1 670 . 1 1 1 A 191 191 ALA CA C 200 50.019 49.962 0.057 1
1 671 . 1 1 1 A 191 191 ALA CB C 200 20.869 22.476 -1.607 1
1 672 . 1 1 1 A 191 191 ALA N N 200 118.761 124.032 -5.271 1
1 673 . 1 1 1 A 194 194 VAL C C 203 174.914 175.845 -0.931 1
1 674 . 1 1 1 A 194 194 VAL CA C 203 61.992 61.537 0.455 1
1 675 . 1 1 1 A 194 194 VAL CB C 203 34.076 32.968 1.108 1
1 676 . 1 1 1 A 195 195 SER H H 204 9.591 8.572 1.019 1
1 677 . 1 1 1 A 195 195 SER C C 204 172.988 173.657 -0.669 1
1 678 . 1 1 1 A 195 195 SER CA C 204 58.898 58.491 0.407 1
1 679 . 1 1 1 A 195 195 SER CB C 204 61.165 61.605 -0.440 1
1 680 . 1 1 1 A 195 195 SER N N 204 125.344 120.122 5.222 1
1 681 . 1 1 1 A 196 196 ILE H H 205 8.460 7.998 0.462 1
1 682 . 1 1 1 A 196 196 ILE C C 205 176.486 175.479 1.007 1
1 683 . 1 1 1 A 196 196 ILE CA C 205 57.448 60.785 -3.337 1
1 684 . 1 1 1 A 196 196 ILE CB C 205 36.272 38.152 -1.880 1
1 685 . 1 1 1 A 196 196 ILE N N 205 120.321 121.061 -0.740 1
1 686 . 1 1 1 A 197 197 VAL H H 206 8.827 8.756 0.071 1
1 687 . 1 1 1 A 197 197 VAL C C 206 175.187 175.381 -0.194 1
1 688 . 1 1 1 A 197 197 VAL CA C 206 63.136 61.535 1.601 1
1 689 . 1 1 1 A 197 197 VAL CB C 206 31.434 32.955 -1.521 1
1 690 . 1 1 1 A 197 197 VAL N N 206 128.666 125.905 2.761 1
1 691 . 1 1 1 A 198 198 SER H H 207 8.172 8.859 -0.687 1
1 692 . 1 1 1 A 198 198 SER C C 207 173.084 173.146 -0.062 1
1 693 . 1 1 1 A 198 198 SER CA C 207 53.983 55.846 -1.863 1
1 694 . 1 1 1 A 198 198 SER CB C 207 60.888 65.115 -4.227 1
1 695 . 1 1 1 A 198 198 SER N N 207 120.690 120.503 0.187 1
1 696 . 1 1 1 A 199 199 THR H H 208 8.133 8.465 -0.332 1
1 697 . 1 1 1 A 199 199 THR C C 208 173.515 174.484 -0.969 1
1 698 . 1 1 1 A 199 199 THR CA C 208 60.662 62.335 -1.673 1
1 699 . 1 1 1 A 199 199 THR CB C 208 70.183 69.101 1.082 1
1 700 . 1 1 1 A 199 199 THR N N 208 111.660 115.467 -3.807 1
1 701 . 1 1 1 A 200 200 LEU H H 209 7.820 8.343 -0.523 1
1 702 . 1 1 1 A 200 200 LEU CA C 209 50.850 51.141 -0.291 1
1 703 . 1 1 1 A 200 200 LEU CB C 209 44.889 45.450 -0.561 1
1 704 . 1 1 1 A 200 200 LEU N N 209 118.617 126.548 -7.931 1
1 705 . 1 1 1 A 201 201 PRO C C 210 176.234 177.436 -1.202 1
1 706 . 1 1 1 A 201 201 PRO CA C 210 63.471 63.816 -0.345 1
1 707 . 1 1 1 A 201 201 PRO CB C 210 32.422 31.484 0.938 1
1 708 . 1 1 1 A 202 202 GLY H H 211 8.174 8.774 -0.600 1
1 709 . 1 1 1 A 202 202 GLY C C 211 176.073 174.230 1.843 1
1 710 . 1 1 1 A 202 202 GLY CA C 211 46.329 46.260 0.069 1
1 711 . 1 1 1 A 202 202 GLY N N 211 109.801 111.609 -1.808 1
1 712 . 1 1 1 A 203 203 ASN H H 212 8.358 8.612 -0.254 1
1 713 . 1 1 1 A 203 203 ASN C C 212 173.793 173.795 -0.002 1
1 714 . 1 1 1 A 203 203 ASN CA C 212 53.125 53.602 -0.477 1
1 715 . 1 1 1 A 203 203 ASN CB C 212 35.940 36.966 -1.026 1
1 716 . 1 1 1 A 203 203 ASN N N 212 115.720 115.333 0.387 1
1 717 . 1 1 1 A 204 204 LYS H H 213 6.834 7.443 -0.609 1
1 718 . 1 1 1 A 204 204 LYS C C 213 175.795 175.063 0.732 1
1 719 . 1 1 1 A 204 204 LYS CA C 213 54.858 54.511 0.347 1
1 720 . 1 1 1 A 204 204 LYS CB C 213 37.472 36.295 1.177 1
1 721 . 1 1 1 A 204 204 LYS N N 213 116.253 116.824 -0.571 1
1 722 . 1 1 1 A 205 205 TYR H H 214 8.315 8.787 -0.472 1
1 723 . 1 1 1 A 205 205 TYR C C 214 176.049 175.486 0.563 1
1 724 . 1 1 1 A 205 205 TYR CA C 214 57.525 56.094 1.431 1
1 725 . 1 1 1 A 205 205 TYR CB C 214 43.449 43.039 0.410 1
1 726 . 1 1 1 A 205 205 TYR N N 214 119.605 119.473 0.132 1
1 727 . 1 1 1 A 206 206 GLY H H 215 8.960 8.446 0.514 1
1 728 . 1 1 1 A 206 206 GLY C C 215 172.841 171.796 1.045 1
1 729 . 1 1 1 A 206 206 GLY CA C 215 45.976 46.143 -0.167 1
1 730 . 1 1 1 A 206 206 GLY N N 215 105.632 109.839 -4.207 1
1 731 . 1 1 1 A 207 207 ALA H H 216 8.829 8.047 0.782 1
1 732 . 1 1 1 A 207 207 ALA C C 216 180.583 176.897 3.686 1
1 733 . 1 1 1 A 207 207 ALA CA C 216 50.932 51.574 -0.642 1
1 734 . 1 1 1 A 207 207 ALA CB C 216 20.308 20.142 0.166 1
1 735 . 1 1 1 A 207 207 ALA N N 216 124.703 123.004 1.699 1
1 736 . 1 1 1 A 208 208 LYS H H 217 8.209 8.803 -0.594 1
1 737 . 1 1 1 A 208 208 LYS C C 217 175.273 175.152 0.121 1
1 738 . 1 1 1 A 208 208 LYS CA C 217 56.160 54.730 1.430 1
1 739 . 1 1 1 A 208 208 LYS CB C 217 39.575 36.350 3.225 1
1 740 . 1 1 1 A 208 208 LYS N N 217 120.321 122.561 -2.240 1
1 741 . 1 1 1 A 209 209 SER H H 218 8.321 8.673 -0.352 1
1 742 . 1 1 1 A 209 209 SER C C 218 172.904 173.514 -0.610 1
1 743 . 1 1 1 A 209 209 SER CA C 218 56.496 57.222 -0.726 1
1 744 . 1 1 1 A 209 209 SER CB C 218 66.322 66.142 0.180 1
1 745 . 1 1 1 A 209 209 SER N N 218 114.693 118.496 -3.803 1
1 746 . 1 1 1 A 210 210 GLY H H 219 8.930 8.401 0.529 1
1 747 . 1 1 1 A 210 210 GLY CA C 219 46.025 44.517 1.508 1
1 748 . 1 1 1 A 210 210 GLY N N 219 110.756 110.409 0.347 1
1 749 . 1 1 1 A 216 216 PRO C C 225 179.288 179.242 0.046 1
1 750 . 1 1 1 A 216 216 PRO CA C 225 65.442 65.480 -0.038 1
1 751 . 1 1 1 A 216 216 PRO CB C 225 32.532 31.467 1.065 1
1 752 . 1 1 1 A 217 217 HIS H H 226 7.601 7.675 -0.074 1
1 753 . 1 1 1 A 217 217 HIS C C 226 177.206 177.847 -0.641 1
1 754 . 1 1 1 A 217 217 HIS CA C 226 62.532 60.375 2.157 1
1 755 . 1 1 1 A 217 217 HIS CB C 226 28.155 29.791 -1.636 1
1 756 . 1 1 1 A 217 217 HIS N N 226 116.973 116.641 0.332 1
1 757 . 1 1 1 A 218 218 VAL H H 227 7.356 7.644 -0.288 1
1 758 . 1 1 1 A 218 218 VAL C C 227 177.244 177.824 -0.580 1
1 759 . 1 1 1 A 218 218 VAL CA C 227 65.305 65.915 -0.610 1
1 760 . 1 1 1 A 218 218 VAL CB C 227 30.314 31.710 -1.396 1
1 761 . 1 1 1 A 218 218 VAL N N 227 119.112 119.701 -0.589 1
1 762 . 1 1 1 A 219 219 ALA H H 228 8.347 8.346 0.001 1
1 763 . 1 1 1 A 219 219 ALA C C 228 179.324 179.981 -0.657 1
1 764 . 1 1 1 A 219 219 ALA CA C 228 55.640 55.319 0.321 1
1 765 . 1 1 1 A 219 219 ALA CB C 228 18.188 18.501 -0.313 1
1 766 . 1 1 1 A 219 219 ALA N N 228 122.937 122.603 0.334 1
1 767 . 1 1 1 A 220 220 GLY H H 229 8.558 8.278 0.280 1
1 768 . 1 1 1 A 220 220 GLY C C 229 175.194 176.090 -0.896 1
1 769 . 1 1 1 A 220 220 GLY CA C 229 46.861 47.025 -0.164 1
1 770 . 1 1 1 A 220 220 GLY N N 229 102.398 103.754 -1.356 1
1 771 . 1 1 1 A 221 221 ALA H H 230 7.925 7.992 -0.067 1
1 772 . 1 1 1 A 221 221 ALA C C 230 178.786 179.397 -0.611 1
1 773 . 1 1 1 A 221 221 ALA CA C 230 55.514 54.674 0.840 1
1 774 . 1 1 1 A 221 221 ALA CB C 230 19.161 18.444 0.717 1
1 775 . 1 1 1 A 221 221 ALA N N 230 125.030 124.779 0.251 1
1 776 . 1 1 1 A 222 222 ALA H H 231 8.361 8.189 0.172 1
1 777 . 1 1 1 A 222 222 ALA C C 231 178.090 179.487 -1.397 1
1 778 . 1 1 1 A 222 222 ALA CA C 231 55.277 55.149 0.128 1
1 779 . 1 1 1 A 222 222 ALA CB C 231 17.706 18.433 -0.727 1
1 780 . 1 1 1 A 222 222 ALA N N 231 118.838 120.172 -1.334 1
1 781 . 1 1 1 A 223 223 ALA H H 232 7.482 7.876 -0.394 1
1 782 . 1 1 1 A 223 223 ALA C C 232 179.266 180.081 -0.815 1
1 783 . 1 1 1 A 223 223 ALA CA C 232 55.000 55.160 -0.160 1
1 784 . 1 1 1 A 223 223 ALA CB C 232 16.649 18.466 -1.817 1
1 785 . 1 1 1 A 223 223 ALA N N 232 117.957 121.153 -3.196 1
1 786 . 1 1 1 A 224 224 LEU H H 233 8.099 8.000 0.099 1
1 787 . 1 1 1 A 224 224 LEU C C 233 180.450 179.154 1.296 1
1 788 . 1 1 1 A 224 224 LEU CA C 233 62.279 58.261 4.018 1
1 789 . 1 1 1 A 224 224 LEU CB C 233 42.811 42.132 0.679 1
1 790 . 1 1 1 A 224 224 LEU N N 233 117.284 118.404 -1.120 1
1 791 . 1 1 1 A 225 225 ILE H H 234 8.114 8.109 0.005 1
1 792 . 1 1 1 A 225 225 ILE C C 234 177.670 178.036 -0.366 1
1 793 . 1 1 1 A 225 225 ILE CA C 234 66.486 65.671 0.815 1
1 794 . 1 1 1 A 225 225 ILE CB C 234 37.922 38.100 -0.178 1
1 795 . 1 1 1 A 225 225 ILE N N 234 119.445 119.778 -0.333 1
1 796 . 1 1 1 A 226 226 LEU H H 235 8.093 8.328 -0.235 1
1 797 . 1 1 1 A 226 226 LEU C C 235 177.612 179.580 -1.968 1
1 798 . 1 1 1 A 226 226 LEU CA C 235 57.029 57.704 -0.675 1
1 799 . 1 1 1 A 226 226 LEU CB C 235 42.598 41.111 1.487 1
1 800 . 1 1 1 A 226 226 LEU N N 235 119.414 118.915 0.499 1
1 801 . 1 1 1 A 227 227 SER H H 236 7.691 8.234 -0.543 1
1 802 . 1 1 1 A 227 227 SER C C 236 174.703 176.559 -1.856 1
1 803 . 1 1 1 A 227 227 SER CA C 236 60.415 61.542 -1.127 1
1 804 . 1 1 1 A 227 227 SER CB C 236 64.041 62.439 1.602 1
1 805 . 1 1 1 A 227 227 SER N N 236 112.589 113.628 -1.039 1
1 806 . 1 1 1 A 228 228 LYS H H 237 6.976 7.725 -0.749 1
1 807 . 1 1 1 A 228 228 LYS C C 237 174.915 176.286 -1.371 1
1 808 . 1 1 1 A 228 228 LYS CA C 237 57.784 57.788 -0.004 1
1 809 . 1 1 1 A 228 228 LYS CB C 237 33.643 32.891 0.752 1
1 810 . 1 1 1 A 228 228 LYS N N 237 123.239 121.735 1.504 1
1 811 . 1 1 1 A 229 229 HIS H H 238 7.969 8.001 -0.032 1
1 812 . 1 1 1 A 229 229 HIS CA C 238 51.362 52.673 -1.311 1
1 813 . 1 1 1 A 229 229 HIS CB C 238 26.743 28.892 -2.149 1
1 814 . 1 1 1 A 229 229 HIS N N 238 116.273 114.880 1.393 1
1 815 . 1 1 1 A 230 230 PRO C C 239 177.434 178.625 -1.191 1
1 816 . 1 1 1 A 230 230 PRO CA C 239 64.963 65.071 -0.108 1
1 817 . 1 1 1 A 230 230 PRO CB C 239 31.707 31.844 -0.137 1
1 818 . 1 1 1 A 231 231 ASN H H 240 8.354 8.446 -0.092 1
1 819 . 1 1 1 A 231 231 ASN C C 240 176.347 176.208 0.139 1
1 820 . 1 1 1 A 231 231 ASN CA C 240 52.694 54.569 -1.875 1
1 821 . 1 1 1 A 231 231 ASN CB C 240 38.000 37.915 0.085 1
1 822 . 1 1 1 A 231 231 ASN N N 240 112.415 113.535 -1.120 1
1 823 . 1 1 1 A 232 232 TRP H H 241 7.949 7.483 0.466 1
1 824 . 1 1 1 A 232 232 TRP C C 241 176.238 176.402 -0.164 1
1 825 . 1 1 1 A 232 232 TRP CA C 241 56.553 58.215 -1.662 1
1 826 . 1 1 1 A 232 232 TRP CB C 241 29.576 30.277 -0.701 1
1 827 . 1 1 1 A 232 232 TRP N N 241 123.927 121.137 2.790 1
1 828 . 1 1 1 A 233 233 THR H H 242 8.340 8.683 -0.343 1
1 829 . 1 1 1 A 233 233 THR C C 242 175.757 175.981 -0.224 1
1 830 . 1 1 1 A 233 233 THR CA C 242 59.957 60.650 -0.693 1
1 831 . 1 1 1 A 233 233 THR CB C 242 72.159 70.946 1.213 1
1 832 . 1 1 1 A 233 233 THR N N 242 110.110 116.179 -6.069 1
1 833 . 1 1 1 A 234 234 ASN H H 243 9.138 9.166 -0.028 1
1 834 . 1 1 1 A 234 234 ASN C C 243 177.644 177.760 -0.116 1
1 835 . 1 1 1 A 234 234 ASN CA C 243 56.455 56.131 0.324 1
1 836 . 1 1 1 A 234 234 ASN CB C 243 35.289 37.322 -2.033 1
1 837 . 1 1 1 A 234 234 ASN N N 243 119.515 119.734 -0.219 1
1 838 . 1 1 1 A 235 235 THR H H 244 7.785 8.130 -0.345 1
1 839 . 1 1 1 A 235 235 THR C C 244 176.708 176.784 -0.076 1
1 840 . 1 1 1 A 235 235 THR CA C 244 65.707 65.841 -0.134 1
1 841 . 1 1 1 A 235 235 THR CB C 244 68.365 68.461 -0.096 1
1 842 . 1 1 1 A 235 235 THR N N 244 117.004 112.127 4.877 1
1 843 . 1 1 1 A 236 236 GLN H H 245 7.488 7.900 -0.412 1
1 844 . 1 1 1 A 236 236 GLN C C 245 178.779 178.795 -0.016 1
1 845 . 1 1 1 A 236 236 GLN CA C 245 59.025 58.488 0.537 1
1 846 . 1 1 1 A 236 236 GLN CB C 245 28.871 28.071 0.800 1
1 847 . 1 1 1 A 236 236 GLN N N 245 123.702 121.686 2.016 1
1 848 . 1 1 1 A 237 237 VAL H H 246 8.561 8.116 0.445 1
1 849 . 1 1 1 A 237 237 VAL C C 246 174.973 177.896 -2.923 1
1 850 . 1 1 1 A 237 237 VAL CA C 246 67.557 66.945 0.612 1
1 851 . 1 1 1 A 237 237 VAL CB C 246 31.689 31.719 -0.030 1
1 852 . 1 1 1 A 237 237 VAL N N 246 120.793 120.553 0.240 1
1 853 . 1 1 1 A 238 238 ARG H H 247 8.422 8.250 0.172 1
1 854 . 1 1 1 A 238 238 ARG C C 247 177.393 178.753 -1.360 1
1 855 . 1 1 1 A 238 238 ARG CA C 247 61.003 59.780 1.223 1
1 856 . 1 1 1 A 238 238 ARG CB C 247 29.487 29.934 -0.447 1
1 857 . 1 1 1 A 238 238 ARG N N 247 118.337 120.736 -2.399 1
1 858 . 1 1 1 A 239 239 SER H H 248 8.292 8.166 0.126 1
1 859 . 1 1 1 A 239 239 SER C C 248 176.468 176.228 0.240 1
1 860 . 1 1 1 A 239 239 SER CA C 248 61.834 61.906 -0.072 1
1 861 . 1 1 1 A 239 239 SER CB C 248 62.753 62.707 0.046 1
1 862 . 1 1 1 A 239 239 SER N N 248 112.939 116.915 -3.976 1
1 863 . 1 1 1 A 240 240 SER H H 249 8.048 8.075 -0.027 1
1 864 . 1 1 1 A 240 240 SER C C 249 177.427 177.082 0.345 1
1 865 . 1 1 1 A 240 240 SER CA C 249 62.801 61.916 0.885 1
1 866 . 1 1 1 A 240 240 SER CB C 249 63.181 63.147 0.034 1
1 867 . 1 1 1 A 240 240 SER N N 249 116.435 116.698 -0.263 1
1 868 . 1 1 1 A 241 241 LEU H H 250 7.806 8.349 -0.543 1
1 869 . 1 1 1 A 241 241 LEU C C 250 179.075 178.746 0.329 1
1 870 . 1 1 1 A 241 241 LEU CA C 250 57.562 58.141 -0.579 1
1 871 . 1 1 1 A 241 241 LEU CB C 250 43.178 41.571 1.607 1
1 872 . 1 1 1 A 241 241 LEU N N 250 120.876 122.317 -1.441 1
1 873 . 1 1 1 A 242 242 GLU H H 251 8.217 8.216 0.001 1
1 874 . 1 1 1 A 242 242 GLU C C 251 177.482 178.517 -1.035 1
1 875 . 1 1 1 A 242 242 GLU CA C 251 59.940 59.772 0.168 1
1 876 . 1 1 1 A 242 242 GLU CB C 251 30.214 29.386 0.828 1
1 877 . 1 1 1 A 242 242 GLU N N 251 115.363 117.243 -1.880 1
1 878 . 1 1 1 A 243 243 ASN H H 252 8.249 8.083 0.166 1
1 879 . 1 1 1 A 243 243 ASN C C 252 176.725 176.466 0.259 1
1 880 . 1 1 1 A 243 243 ASN CA C 252 54.313 55.049 -0.736 1
1 881 . 1 1 1 A 243 243 ASN CB C 252 39.145 38.855 0.290 1
1 882 . 1 1 1 A 243 243 ASN N N 252 112.581 115.631 -3.050 1
1 883 . 1 1 1 A 244 244 THR H H 253 7.064 7.433 -0.369 1
1 884 . 1 1 1 A 244 244 THR C C 253 173.805 174.449 -0.644 1
1 885 . 1 1 1 A 244 244 THR CA C 253 61.253 61.047 0.206 1
1 886 . 1 1 1 A 244 244 THR CB C 253 69.064 69.347 -0.283 1
1 887 . 1 1 1 A 244 244 THR N N 253 106.778 106.064 0.714 1
1 888 . 1 1 1 A 245 245 THR H H 254 6.752 7.697 -0.945 1
1 889 . 1 1 1 A 245 245 THR C C 254 176.520 174.296 2.224 1
1 890 . 1 1 1 A 245 245 THR CA C 254 61.095 61.775 -0.680 1
1 891 . 1 1 1 A 245 245 THR CB C 254 70.211 70.078 0.133 1
1 892 . 1 1 1 A 245 245 THR N N 254 110.013 116.713 -6.700 1
1 893 . 1 1 1 A 246 246 THR H H 255 9.002 8.601 0.401 1
1 894 . 1 1 1 A 246 246 THR C C 255 174.046 174.306 -0.260 1
1 895 . 1 1 1 A 246 246 THR CA C 255 62.125 62.290 -0.165 1
1 896 . 1 1 1 A 246 246 THR CB C 255 70.080 69.466 0.614 1
1 897 . 1 1 1 A 246 246 THR N N 255 118.283 118.683 -0.400 1
1 898 . 1 1 1 A 247 247 LYS H H 256 8.653 8.587 0.066 1
1 899 . 1 1 1 A 247 247 LYS C C 256 176.495 176.038 0.457 1
1 900 . 1 1 1 A 247 247 LYS CA C 256 58.196 56.829 1.367 1
1 901 . 1 1 1 A 247 247 LYS CB C 256 32.051 32.328 -0.277 1
1 902 . 1 1 1 A 247 247 LYS N N 256 130.585 127.278 3.307 1
1 903 . 1 1 1 A 248 248 LEU H H 257 7.590 8.584 -0.994 1
1 904 . 1 1 1 A 248 248 LEU C C 257 175.427 176.274 -0.847 1
1 905 . 1 1 1 A 248 248 LEU CA C 257 53.573 53.777 -0.204 1
1 906 . 1 1 1 A 248 248 LEU CB C 257 44.044 42.512 1.532 1
1 907 . 1 1 1 A 248 248 LEU N N 257 123.580 126.334 -2.754 1
1 908 . 1 1 1 A 249 249 GLY H H 258 6.038 8.413 -2.375 1
1 909 . 1 1 1 A 249 249 GLY CA C 258 44.505 44.418 0.087 1
1 910 . 1 1 1 A 249 249 GLY N N 258 104.458 110.273 -5.815 1
1 911 . 1 1 1 A 252 252 PHE C C 261 173.011 176.387 -3.376 1
1 912 . 1 1 1 A 252 252 PHE CA C 261 61.956 61.287 0.669 1
1 913 . 1 1 1 A 252 252 PHE CB C 261 39.806 38.809 0.997 1
1 914 . 1 1 1 A 253 253 TYR H H 262 7.090 7.799 -0.709 1
1 915 . 1 1 1 A 253 253 TYR C C 262 175.949 176.884 -0.935 1
1 916 . 1 1 1 A 253 253 TYR CA C 262 58.704 59.787 -1.083 1
1 917 . 1 1 1 A 253 253 TYR CB C 262 41.525 39.828 1.697 1
1 918 . 1 1 1 A 253 253 TYR N N 262 108.894 114.703 -5.809 1
1 919 . 1 1 1 A 254 254 TYR H H 263 7.877 7.745 0.132 1
1 920 . 1 1 1 A 254 254 TYR C C 263 175.348 176.325 -0.977 1
1 921 . 1 1 1 A 254 254 TYR CA C 263 58.396 58.343 0.053 1
1 922 . 1 1 1 A 254 254 TYR CB C 263 41.999 40.200 1.799 1
1 923 . 1 1 1 A 254 254 TYR N N 263 113.679 114.607 -0.928 1
1 924 . 1 1 1 A 255 255 GLY H H 264 8.259 8.165 0.094 1
1 925 . 1 1 1 A 255 255 GLY C C 264 175.387 175.625 -0.238 1
1 926 . 1 1 1 A 255 255 GLY CA C 264 46.461 46.963 -0.502 1
1 927 . 1 1 1 A 255 255 GLY N N 264 110.025 108.865 1.160 1
1 928 . 1 1 1 A 256 256 LYS H H 265 8.944 8.579 0.365 1
1 929 . 1 1 1 A 256 256 LYS C C 265 177.327 176.766 0.561 1
1 930 . 1 1 1 A 256 256 LYS CA C 265 57.358 56.712 0.646 1
1 931 . 1 1 1 A 256 256 LYS CB C 265 32.368 32.928 -0.560 1
1 932 . 1 1 1 A 256 256 LYS N N 265 123.502 126.117 -2.615 1
1 933 . 1 1 1 A 257 257 GLY H H 266 8.244 7.581 0.663 1
1 934 . 1 1 1 A 257 257 GLY C C 266 172.120 172.558 -0.438 1
1 935 . 1 1 1 A 257 257 GLY CA C 266 43.700 43.889 -0.189 1
1 936 . 1 1 1 A 257 257 GLY N N 266 107.567 106.407 1.160 1
1 937 . 1 1 1 A 258 258 LEU H H 267 8.249 8.268 -0.019 1
1 938 . 1 1 1 A 258 258 LEU C C 267 176.837 176.253 0.584 1
1 939 . 1 1 1 A 258 258 LEU CA C 267 54.098 54.419 -0.321 1
1 940 . 1 1 1 A 258 258 LEU CB C 267 45.318 43.957 1.361 1
1 941 . 1 1 1 A 258 258 LEU N N 267 121.495 121.843 -0.348 1
1 942 . 1 1 1 A 259 259 ILE H H 268 7.096 8.405 -1.309 1
1 943 . 1 1 1 A 259 259 ILE C C 268 173.752 175.460 -1.708 1
1 944 . 1 1 1 A 259 259 ILE CA C 268 62.748 61.125 1.623 1
1 945 . 1 1 1 A 259 259 ILE CB C 268 39.704 38.867 0.837 1
1 946 . 1 1 1 A 259 259 ILE N N 268 117.229 120.457 -3.228 1
1 947 . 1 1 1 A 260 260 ASN H H 269 9.260 8.484 0.776 1
1 948 . 1 1 1 A 260 260 ASN C C 269 175.696 175.336 0.360 1
1 949 . 1 1 1 A 260 260 ASN CA C 269 51.399 51.956 -0.557 1
1 950 . 1 1 1 A 260 260 ASN CB C 269 39.410 39.053 0.357 1
1 951 . 1 1 1 A 260 260 ASN N N 269 120.141 124.096 -3.955 1
1 952 . 1 1 1 A 261 261 VAL H H 270 8.795 8.437 0.358 1
1 953 . 1 1 1 A 261 261 VAL C C 270 175.284 176.916 -1.632 1
1 954 . 1 1 1 A 261 261 VAL CA C 270 65.165 64.864 0.301 1
1 955 . 1 1 1 A 261 261 VAL CB C 270 32.413 31.831 0.582 1
1 956 . 1 1 1 A 261 261 VAL N N 270 120.394 125.383 -4.989 1
1 957 . 1 1 1 A 262 262 GLU H H 271 7.246 8.099 -0.853 1
1 958 . 1 1 1 A 262 262 GLU C C 271 178.586 178.572 0.014 1
1 959 . 1 1 1 A 262 262 GLU CA C 271 59.864 59.304 0.560 1
1 960 . 1 1 1 A 262 262 GLU CB C 271 29.297 29.527 -0.230 1
1 961 . 1 1 1 A 262 262 GLU N N 271 121.072 120.993 0.079 1
1 962 . 1 1 1 A 263 263 ALA H H 272 7.254 8.120 -0.866 1
1 963 . 1 1 1 A 263 263 ALA C C 272 180.636 179.751 0.885 1
1 964 . 1 1 1 A 263 263 ALA CA C 272 53.884 54.939 -1.055 1
1 965 . 1 1 1 A 263 263 ALA CB C 272 18.931 18.270 0.661 1
1 966 . 1 1 1 A 263 263 ALA N N 272 120.861 120.937 -0.076 1
1 967 . 1 1 1 A 264 264 ALA H H 273 8.250 8.201 0.049 1
1 968 . 1 1 1 A 264 264 ALA C C 273 178.734 179.940 -1.206 1
1 969 . 1 1 1 A 264 264 ALA CA C 273 54.740 55.014 -0.274 1
1 970 . 1 1 1 A 264 264 ALA CB C 273 19.549 18.438 1.111 1
1 971 . 1 1 1 A 264 264 ALA N N 273 120.399 120.493 -0.094 1
1 972 . 1 1 1 A 265 265 ALA H H 274 7.740 7.688 0.052 1
1 973 . 1 1 1 A 265 265 ALA C C 274 177.067 176.897 0.170 1
1 974 . 1 1 1 A 265 265 ALA CA C 274 52.104 52.322 -0.218 1
1 975 . 1 1 1 A 265 265 ALA CB C 274 19.982 19.347 0.635 1
1 976 . 1 1 1 A 265 265 ALA N N 274 114.673 119.091 -4.418 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 193 1.443 1
2 1 1 1 "RMS(OBS, PRED)" CA 208 1.123 1
3 1 1 1 "RMS(OBS, PRED)" CB 185 1.164 1
4 1 1 1 "RMS(OBS, PRED)" H 190 0.630 1
5 1 1 1 "RMS(OBS, PRED)" HA 0 0.000 1
6 1 1 1 "RMS(OBS, PRED)" N 190 2.967 1
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Conformer_type "average"
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Assigned_chem_shift_list_ID
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.PDB_asym_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entity_delta_chem_shifts_ID
1 1 . 1 1 A 6 6 TYR C C 6 177.807 177.653 0.154 2
1 2 . 1 1 A 6 6 TYR CA C 6 61.314 61.746 -0.432 2
1 3 . 1 1 A 6 6 TYR CB C 6 37.496 39.112 -1.616 2
1 4 . 1 1 A 7 7 GLY H H 7 8.722 8.407 0.315 2
1 5 . 1 1 A 7 7 GLY C C 7 174.931 175.834 -0.903 2
1 6 . 1 1 A 7 7 GLY CA C 7 46.728 46.975 -0.247 2
1 7 . 1 1 A 7 7 GLY N N 7 110.074 106.277 3.797 2
1 8 . 1 1 A 8 8 VAL H H 8 7.084 7.905 -0.821 2
1 9 . 1 1 A 8 8 VAL C C 8 178.021 177.478 0.543 2
1 10 . 1 1 A 8 8 VAL CA C 8 66.826 65.624 1.202 2
1 11 . 1 1 A 8 8 VAL CB C 8 32.064 31.752 0.312 2
1 12 . 1 1 A 8 8 VAL N N 8 119.468 122.283 -2.815 2
1 13 . 1 1 A 9 9 SER H H 9 7.304 8.229 -0.925 2
1 14 . 1 1 A 9 9 SER C C 9 178.704 176.278 2.426 2
1 15 . 1 1 A 9 9 SER CA C 9 61.518 61.623 -0.105 2
1 16 . 1 1 A 9 9 SER CB C 9 62.663 62.554 0.109 2
1 17 . 1 1 A 9 9 SER N N 9 113.504 115.556 -2.052 2
1 18 . 1 1 A 10 10 GLN H H 10 8.637 8.133 0.504 2
1 19 . 1 1 A 10 10 GLN C C 10 178.328 178.215 0.113 2
1 20 . 1 1 A 10 10 GLN CA C 10 59.681 58.960 0.721 2
1 21 . 1 1 A 10 10 GLN CB C 10 29.503 28.029 1.474 2
1 22 . 1 1 A 10 10 GLN N N 10 125.350 120.861 4.489 2
1 23 . 1 1 A 11 11 ILE H H 11 7.020 7.618 -0.598 2
1 24 . 1 1 A 11 11 ILE C C 11 173.870 175.491 -1.621 2
1 25 . 1 1 A 11 11 ILE CA C 11 61.766 60.801 0.965 2
1 26 . 1 1 A 11 11 ILE CB C 11 37.945 37.609 0.336 2
1 27 . 1 1 A 11 11 ILE N N 11 106.797 111.998 -5.201 2
1 28 . 1 1 A 12 12 LYS H H 12 7.840 7.925 -0.085 2
1 29 . 1 1 A 12 12 LYS C C 12 174.615 176.512 -1.897 2
1 30 . 1 1 A 12 12 LYS CA C 12 58.004 57.060 0.944 2
1 31 . 1 1 A 12 12 LYS CB C 12 28.464 29.055 -0.591 2
1 32 . 1 1 A 12 12 LYS N N 12 113.361 116.426 -3.065 2
1 33 . 1 1 A 13 13 ALA H H 13 7.255 7.914 -0.659 2
1 34 . 1 1 A 13 13 ALA CA C 13 55.595 56.821 -1.226 2
1 35 . 1 1 A 13 13 ALA CB C 13 17.693 17.665 0.028 2
1 36 . 1 1 A 13 13 ALA N N 13 118.001 120.020 -2.019 2
1 37 . 1 1 A 14 14 PRO C C 14 177.227 178.748 -1.521 2
1 38 . 1 1 A 14 14 PRO CA C 14 66.005 66.014 -0.009 2
1 39 . 1 1 A 14 14 PRO CB C 14 30.590 30.648 -0.058 2
1 40 . 1 1 A 15 15 ALA H H 15 7.320 8.287 -0.967 2
1 41 . 1 1 A 15 15 ALA C C 15 180.442 179.620 0.822 2
1 42 . 1 1 A 15 15 ALA CA C 15 54.893 54.838 0.055 2
1 43 . 1 1 A 15 15 ALA CB C 15 18.143 18.568 -0.425 2
1 44 . 1 1 A 15 15 ALA N N 15 118.830 118.778 0.052 2
1 45 . 1 1 A 16 16 LEU H H 16 7.269 7.703 -0.434 2
1 46 . 1 1 A 16 16 LEU C C 16 179.603 179.215 0.388 2
1 47 . 1 1 A 16 16 LEU CA C 16 56.392 56.992 -0.600 2
1 48 . 1 1 A 16 16 LEU CB C 16 40.022 41.695 -1.673 2
1 49 . 1 1 A 16 16 LEU N N 16 119.362 119.387 -0.025 2
1 50 . 1 1 A 17 17 HIS H H 17 7.628 8.267 -0.639 2
1 51 . 1 1 A 17 17 HIS C C 17 180.938 177.912 3.026 2
1 52 . 1 1 A 17 17 HIS CA C 17 57.745 59.930 -2.185 2
1 53 . 1 1 A 17 17 HIS CB C 17 31.084 29.676 1.408 2
1 54 . 1 1 A 17 17 HIS N N 17 120.715 118.156 2.559 2
1 55 . 1 1 A 18 18 SER H H 18 8.410 8.426 -0.016 2
1 56 . 1 1 A 18 18 SER C C 18 175.410 177.055 -1.645 2
1 57 . 1 1 A 18 18 SER CA C 18 61.495 61.724 -0.229 2
1 58 . 1 1 A 18 18 SER CB C 18 63.120 62.291 0.829 2
1 59 . 1 1 A 18 18 SER N N 18 114.198 115.931 -1.733 2
1 60 . 1 1 A 19 19 GLN H H 19 7.219 7.846 -0.627 2
1 61 . 1 1 A 19 19 GLN C C 19 175.257 175.975 -0.718 2
1 62 . 1 1 A 19 19 GLN CA C 19 55.973 55.740 0.233 2
1 63 . 1 1 A 19 19 GLN CB C 19 30.413 29.105 1.308 2
1 64 . 1 1 A 19 19 GLN N N 19 118.871 117.668 1.203 2
1 65 . 1 1 A 20 20 GLY H H 20 7.619 8.212 -0.593 2
1 66 . 1 1 A 20 20 GLY C C 20 173.488 173.544 -0.056 2
1 67 . 1 1 A 20 20 GLY CA C 20 44.552 45.202 -0.650 2
1 68 . 1 1 A 20 20 GLY N N 20 104.646 107.378 -2.732 2
1 69 . 1 1 A 21 21 TYR H H 21 7.758 7.944 -0.186 2
1 70 . 1 1 A 21 21 TYR C C 21 174.329 175.168 -0.839 2
1 71 . 1 1 A 21 21 TYR CA C 21 57.749 56.708 1.041 2
1 72 . 1 1 A 21 21 TYR CB C 21 37.883 39.578 -1.695 2
1 73 . 1 1 A 21 21 TYR N N 21 121.823 118.760 3.063 2
1 74 . 1 1 A 22 22 THR H H 22 8.849 8.879 -0.030 2
1 75 . 1 1 A 22 22 THR C C 22 175.342 174.854 0.488 2
1 76 . 1 1 A 22 22 THR CA C 22 60.361 61.077 -0.716 2
1 77 . 1 1 A 22 22 THR CB C 22 69.993 70.091 -0.098 2
1 78 . 1 1 A 22 22 THR N N 22 108.365 113.842 -5.477 2
1 79 . 1 1 A 23 23 GLY H H 23 8.064 7.992 0.072 2
1 80 . 1 1 A 23 23 GLY C C 23 171.892 174.670 -2.778 2
1 81 . 1 1 A 23 23 GLY CA C 23 45.145 45.988 -0.843 2
1 82 . 1 1 A 23 23 GLY N N 23 109.723 110.692 -0.969 2
1 83 . 1 1 A 24 24 SER H H 24 7.657 8.110 -0.453 2
1 84 . 1 1 A 24 24 SER C C 24 174.458 175.174 -0.716 2
1 85 . 1 1 A 24 24 SER CA C 24 60.160 58.739 1.421 2
1 86 . 1 1 A 24 24 SER CB C 24 63.121 62.963 0.158 2
1 87 . 1 1 A 24 24 SER N N 24 113.459 115.969 -2.510 2
1 88 . 1 1 A 25 25 ASN H H 25 8.635 8.983 -0.348 2
1 89 . 1 1 A 25 25 ASN C C 25 173.872 174.289 -0.417 2
1 90 . 1 1 A 25 25 ASN CA C 25 55.012 54.706 0.306 2
1 91 . 1 1 A 25 25 ASN CB C 25 37.688 37.240 0.448 2
1 92 . 1 1 A 25 25 ASN N N 25 116.822 120.074 -3.252 2
1 93 . 1 1 A 26 26 VAL H H 26 7.700 7.706 -0.006 2
1 94 . 1 1 A 26 26 VAL C C 26 175.013 174.880 0.133 2
1 95 . 1 1 A 26 26 VAL CA C 26 63.088 61.473 1.615 2
1 96 . 1 1 A 26 26 VAL CB C 26 32.347 33.504 -1.157 2
1 97 . 1 1 A 26 26 VAL N N 26 121.224 119.348 1.876 2
1 98 . 1 1 A 27 27 LYS H H 27 9.964 8.910 1.054 2
1 99 . 1 1 A 27 27 LYS C C 27 176.202 175.819 0.383 2
1 100 . 1 1 A 27 27 LYS CA C 27 56.539 56.075 0.464 2
1 101 . 1 1 A 27 27 LYS CB C 27 33.832 33.286 0.546 2
1 102 . 1 1 A 27 27 LYS N N 27 129.017 129.317 -0.300 2
1 103 . 1 1 A 28 28 VAL H H 28 9.341 9.010 0.331 2
1 104 . 1 1 A 28 28 VAL C C 28 174.539 174.495 0.044 2
1 105 . 1 1 A 28 28 VAL CA C 28 60.384 60.922 -0.538 2
1 106 . 1 1 A 28 28 VAL CB C 28 33.689 34.239 -0.550 2
1 107 . 1 1 A 28 28 VAL N N 28 125.284 125.578 -0.294 2
1 108 . 1 1 A 29 29 ALA H H 29 9.089 9.035 0.054 2
1 109 . 1 1 A 29 29 ALA C C 29 175.639 176.050 -0.411 2
1 110 . 1 1 A 29 29 ALA CA C 29 50.529 50.328 0.201 2
1 111 . 1 1 A 29 29 ALA CB C 29 19.374 20.733 -1.359 2
1 112 . 1 1 A 29 29 ALA N N 29 128.191 130.200 -2.009 2
1 113 . 1 1 A 30 30 VAL H H 30 9.043 9.122 -0.079 2
1 114 . 1 1 A 30 30 VAL CA C 30 63.113 61.906 1.207 2
1 115 . 1 1 A 30 30 VAL CB C 30 31.258 32.249 -0.991 2
1 116 . 1 1 A 30 30 VAL N N 30 126.830 123.554 3.276 2
1 117 . 1 1 A 31 31 ILE C C 31 174.959 174.344 0.615 2
1 118 . 1 1 A 31 31 ILE CA C 31 62.367 61.178 1.189 2
1 119 . 1 1 A 31 31 ILE CB C 31 35.461 36.925 -1.464 2
1 120 . 1 1 A 32 32 ASP H H 32 8.832 8.179 0.653 2
1 121 . 1 1 A 32 32 ASP C C 32 176.385 176.738 -0.353 2
1 122 . 1 1 A 32 32 ASP CA C 32 55.827 53.720 2.107 2
1 123 . 1 1 A 32 32 ASP CB C 32 45.495 45.244 0.251 2
1 124 . 1 1 A 32 32 ASP N N 32 131.862 129.735 2.127 2
1 125 . 1 1 A 33 33 SER H H 33 7.881 8.540 -0.659 2
1 126 . 1 1 A 33 33 SER C C 33 172.909 173.977 -1.068 2
1 127 . 1 1 A 33 33 SER CA C 33 60.034 58.757 1.277 2
1 128 . 1 1 A 33 33 SER CB C 33 64.679 63.079 1.600 2
1 129 . 1 1 A 33 33 SER N N 33 123.218 118.053 5.165 2
1 130 . 1 1 A 34 34 GLY H H 34 7.355 7.663 -0.308 2
1 131 . 1 1 A 34 34 GLY C C 34 171.537 172.878 -1.341 2
1 132 . 1 1 A 34 34 GLY CA C 34 43.920 44.048 -0.128 2
1 133 . 1 1 A 34 34 GLY N N 34 108.667 108.884 -0.217 2
1 134 . 1 1 A 35 35 ILE H H 35 7.272 8.101 -0.829 2
1 135 . 1 1 A 35 35 ILE C C 35 173.900 174.394 -0.494 2
1 136 . 1 1 A 35 35 ILE CA C 35 60.973 59.940 1.033 2
1 137 . 1 1 A 35 35 ILE CB C 35 43.293 41.722 1.571 2
1 138 . 1 1 A 35 35 ILE N N 35 111.649 118.076 -6.427 2
1 139 . 1 1 A 36 36 ASP H H 36 8.126 8.618 -0.492 2
1 140 . 1 1 A 36 36 ASP C C 36 175.698 176.686 -0.988 2
1 141 . 1 1 A 36 36 ASP CA C 36 53.432 53.059 0.373 2
1 142 . 1 1 A 36 36 ASP CB C 36 40.064 40.166 -0.102 2
1 143 . 1 1 A 36 36 ASP N N 36 123.220 126.500 -3.280 2
1 144 . 1 1 A 37 37 SER H H 37 7.785 8.783 -0.998 2
1 145 . 1 1 A 37 37 SER C C 37 174.152 175.540 -1.388 2
1 146 . 1 1 A 37 37 SER CA C 37 59.477 61.449 -1.972 2
1 147 . 1 1 A 37 37 SER CB C 37 63.404 63.126 0.278 2
1 148 . 1 1 A 37 37 SER N N 37 122.475 121.286 1.189 2
1 149 . 1 1 A 38 38 SER H H 38 8.363 7.791 0.572 2
1 150 . 1 1 A 38 38 SER C C 38 174.585 174.934 -0.349 2
1 151 . 1 1 A 38 38 SER CA C 38 59.438 59.850 -0.412 2
1 152 . 1 1 A 38 38 SER CB C 38 63.995 63.294 0.701 2
1 153 . 1 1 A 38 38 SER N N 38 117.749 114.797 2.952 2
1 154 . 1 1 A 39 39 HIS H H 39 7.379 7.603 -0.224 2
1 155 . 1 1 A 39 39 HIS CA C 39 56.547 55.072 1.475 2
1 156 . 1 1 A 39 39 HIS CB C 39 31.627 31.127 0.500 2
1 157 . 1 1 A 39 39 HIS N N 39 128.489 122.739 5.750 2
1 158 . 1 1 A 40 40 PRO C C 40 178.027 178.584 -0.557 2
1 159 . 1 1 A 40 40 PRO CA C 40 64.582 65.701 -1.119 2
1 160 . 1 1 A 40 40 PRO CB C 40 32.268 31.841 0.427 2
1 161 . 1 1 A 41 41 ASP H H 41 10.130 8.815 1.315 2
1 162 . 1 1 A 41 41 ASP C C 41 175.889 177.337 -1.448 2
1 163 . 1 1 A 41 41 ASP CA C 41 54.258 57.324 -3.066 2
1 164 . 1 1 A 41 41 ASP CB C 41 40.805 40.951 -0.146 2
1 165 . 1 1 A 41 41 ASP N N 41 118.089 117.793 0.296 2
1 166 . 1 1 A 42 42 LEU H H 42 7.595 7.738 -0.143 2
1 167 . 1 1 A 42 42 LEU C C 42 174.385 175.966 -1.581 2
1 168 . 1 1 A 42 42 LEU CA C 42 53.545 55.330 -1.785 2
1 169 . 1 1 A 42 42 LEU CB C 42 44.765 41.883 2.882 2
1 170 . 1 1 A 42 42 LEU N N 42 118.035 120.181 -2.146 2
1 171 . 1 1 A 43 43 ASN H H 43 6.188 8.890 -2.702 2
1 172 . 1 1 A 43 43 ASN C C 43 174.044 173.886 0.158 2
1 173 . 1 1 A 43 43 ASN CA C 43 52.308 51.832 0.476 2
1 174 . 1 1 A 43 43 ASN CB C 43 40.061 39.898 0.163 2
1 175 . 1 1 A 43 43 ASN N N 43 117.962 123.644 -5.682 2
1 176 . 1 1 A 44 44 VAL H H 44 8.379 8.970 -0.591 2
1 177 . 1 1 A 44 44 VAL C C 44 174.765 176.034 -1.269 2
1 178 . 1 1 A 44 44 VAL CA C 44 61.556 61.495 0.061 2
1 179 . 1 1 A 44 44 VAL CB C 44 33.222 32.930 0.292 2
1 180 . 1 1 A 44 44 VAL N N 44 123.712 126.829 -3.117 2
1 181 . 1 1 A 45 45 ALA H H 45 8.890 8.747 0.143 2
1 182 . 1 1 A 45 45 ALA C C 45 177.156 176.903 0.253 2
1 183 . 1 1 A 45 45 ALA CA C 45 52.915 53.054 -0.139 2
1 184 . 1 1 A 45 45 ALA CB C 45 19.228 19.569 -0.341 2
1 185 . 1 1 A 45 45 ALA N N 45 129.905 129.819 0.086 2
1 186 . 1 1 A 46 46 GLY H H 46 6.984 7.513 -0.529 2
1 187 . 1 1 A 46 46 GLY C C 46 172.015 171.675 0.340 2
1 188 . 1 1 A 46 46 GLY CA C 46 45.278 45.943 -0.665 2
1 189 . 1 1 A 46 46 GLY N N 46 102.581 103.122 -0.541 2
1 190 . 1 1 A 47 47 GLY H H 47 9.023 8.408 0.615 2
1 191 . 1 1 A 47 47 GLY C C 47 170.011 170.831 -0.820 2
1 192 . 1 1 A 47 47 GLY CA C 47 46.509 45.586 0.923 2
1 193 . 1 1 A 47 47 GLY N N 47 107.691 107.978 -0.287 2
1 194 . 1 1 A 48 48 ALA H H 48 7.999 8.295 -0.296 2
1 195 . 1 1 A 48 48 ALA C C 48 174.938 174.691 0.247 2
1 196 . 1 1 A 48 48 ALA CA C 48 51.791 50.840 0.951 2
1 197 . 1 1 A 48 48 ALA CB C 48 21.544 22.313 -0.769 2
1 198 . 1 1 A 48 48 ALA N N 48 118.075 120.912 -2.837 2
1 199 . 1 1 A 49 49 SER H H 49 8.326 8.771 -0.445 2
1 200 . 1 1 A 49 49 SER CA C 49 54.725 55.668 -0.943 2
1 201 . 1 1 A 49 49 SER CB C 49 64.694 64.707 -0.013 2
1 202 . 1 1 A 49 49 SER N N 49 112.671 114.043 -1.372 2
1 203 . 1 1 A 50 50 PHE C C 50 174.813 174.978 -0.165 2
1 204 . 1 1 A 55 55 THR C C 55 173.541 174.070 -0.529 2
1 205 . 1 1 A 57 57 PRO C C 57 173.439 177.625 -4.186 2
1 206 . 1 1 A 57 57 PRO CA C 57 64.081 64.295 -0.214 2
1 207 . 1 1 A 57 57 PRO CB C 57 31.270 31.360 -0.090 2
1 208 . 1 1 A 58 58 PHE H H 58 7.360 8.012 -0.652 2
1 209 . 1 1 A 58 58 PHE C C 58 174.610 175.442 -0.832 2
1 210 . 1 1 A 58 58 PHE CA C 58 55.004 58.522 -3.518 2
1 211 . 1 1 A 58 58 PHE CB C 58 37.033 38.803 -1.770 2
1 212 . 1 1 A 58 58 PHE N N 58 116.824 116.462 0.362 2
1 213 . 1 1 A 59 59 GLN H H 59 6.850 7.553 -0.703 2
1 214 . 1 1 A 59 59 GLN C C 59 173.865 173.663 0.202 2
1 215 . 1 1 A 59 59 GLN CA C 59 54.018 54.209 -0.191 2
1 216 . 1 1 A 59 59 GLN CB C 59 30.777 31.677 -0.900 2
1 217 . 1 1 A 59 59 GLN N N 59 118.794 120.799 -2.005 2
1 218 . 1 1 A 60 60 ASP H H 60 8.881 8.818 0.063 2
1 219 . 1 1 A 60 60 ASP C C 60 175.359 176.431 -1.072 2
1 220 . 1 1 A 60 60 ASP CA C 60 51.435 52.468 -1.033 2
1 221 . 1 1 A 60 60 ASP CB C 60 41.169 41.544 -0.375 2
1 222 . 1 1 A 60 60 ASP N N 60 125.787 127.167 -1.380 2
1 223 . 1 1 A 61 61 ASN H H 61 8.674 8.839 -0.165 2
1 224 . 1 1 A 61 61 ASN N N 61 121.351 123.248 -1.897 2
1 225 . 1 1 A 66 66 THR C C 66 175.118 175.790 -0.672 2
1 226 . 1 1 A 68 68 VAL H H 68 8.080 8.416 -0.336 2
1 227 . 1 1 A 68 68 VAL C C 68 178.767 178.178 0.589 2
1 228 . 1 1 A 68 68 VAL CA C 68 65.971 66.238 -0.267 2
1 229 . 1 1 A 68 68 VAL CB C 68 32.293 31.519 0.774 2
1 230 . 1 1 A 68 68 VAL N N 68 117.253 119.761 -2.508 2
1 231 . 1 1 A 69 69 ALA H H 69 8.546 8.287 0.259 2
1 232 . 1 1 A 69 69 ALA C C 69 179.179 179.952 -0.773 2
1 233 . 1 1 A 69 69 ALA CA C 69 55.568 55.227 0.341 2
1 234 . 1 1 A 69 69 ALA CB C 69 19.831 18.651 1.180 2
1 235 . 1 1 A 69 69 ALA N N 69 120.680 121.253 -0.573 2
1 236 . 1 1 A 70 70 GLY H H 70 7.686 8.297 -0.611 2
1 237 . 1 1 A 70 70 GLY C C 70 177.100 176.383 0.717 2
1 238 . 1 1 A 70 70 GLY CA C 70 47.411 47.110 0.301 2
1 239 . 1 1 A 70 70 GLY N N 70 102.553 105.968 -3.415 2
1 240 . 1 1 A 71 71 THR H H 71 7.396 7.947 -0.551 2
1 241 . 1 1 A 71 71 THR C C 71 175.544 176.557 -1.013 2
1 242 . 1 1 A 71 71 THR CA C 71 66.438 66.225 0.213 2
1 243 . 1 1 A 71 71 THR CB C 71 67.488 67.761 -0.273 2
1 244 . 1 1 A 71 71 THR N N 71 120.578 118.301 2.277 2
1 245 . 1 1 A 72 72 VAL H H 72 7.454 8.192 -0.738 2
1 246 . 1 1 A 72 72 VAL C C 72 177.963 177.975 -0.012 2
1 247 . 1 1 A 72 72 VAL CA C 72 67.565 66.433 1.132 2
1 248 . 1 1 A 72 72 VAL CB C 72 30.780 31.646 -0.866 2
1 249 . 1 1 A 72 72 VAL N N 72 120.188 122.385 -2.197 2
1 250 . 1 1 A 73 73 LEU H H 73 7.332 8.214 -0.882 2
1 251 . 1 1 A 73 73 LEU C C 73 178.118 179.399 -1.281 2
1 252 . 1 1 A 73 73 LEU CA C 73 55.783 57.711 -1.928 2
1 253 . 1 1 A 73 73 LEU CB C 73 41.912 40.741 1.171 2
1 254 . 1 1 A 73 73 LEU N N 73 115.398 117.774 -2.376 2
1 265 . 1 1 A 76 76 ALA H H 85 8.827 7.810 1.017 2
1 266 . 1 1 A 76 76 ALA CA C 85 49.379 49.378 0.001 2
1 267 . 1 1 A 76 76 ALA CB C 85 19.124 19.061 0.063 2
1 268 . 1 1 A 76 76 ALA N N 85 123.318 122.146 1.172 2
1 269 . 1 1 A 77 77 PRO C C 86 178.571 177.756 0.815 2
1 270 . 1 1 A 77 77 PRO CA C 86 65.322 64.809 0.513 2
1 271 . 1 1 A 77 77 PRO CB C 86 32.642 31.918 0.724 2
1 272 . 1 1 A 78 78 SER H H 87 8.166 8.301 -0.135 2
1 273 . 1 1 A 78 78 SER C C 87 173.552 174.164 -0.612 2
1 274 . 1 1 A 78 78 SER CA C 87 56.808 58.389 -1.581 2
1 275 . 1 1 A 78 78 SER CB C 87 62.754 63.895 -1.141 2
1 276 . 1 1 A 78 78 SER N N 87 110.236 111.595 -1.359 2
1 277 . 1 1 A 79 79 ALA H H 88 7.632 7.367 0.265 2
1 278 . 1 1 A 79 79 ALA C C 88 176.549 177.515 -0.966 2
1 279 . 1 1 A 79 79 ALA CA C 88 52.807 52.537 0.270 2
1 280 . 1 1 A 79 79 ALA CB C 88 17.887 19.562 -1.675 2
1 281 . 1 1 A 79 79 ALA N N 88 124.474 125.290 -0.816 2
1 282 . 1 1 A 80 80 SER H H 89 8.689 8.684 0.005 2
1 283 . 1 1 A 80 80 SER C C 89 172.588 173.925 -1.337 2
1 284 . 1 1 A 80 80 SER CA C 89 57.786 58.530 -0.744 2
1 285 . 1 1 A 80 80 SER CB C 89 64.457 63.671 0.786 2
1 286 . 1 1 A 80 80 SER N N 89 116.414 119.229 -2.815 2
1 287 . 1 1 A 81 81 LEU H H 90 8.465 8.985 -0.520 2
1 288 . 1 1 A 81 81 LEU C C 90 176.033 174.379 1.654 2
1 289 . 1 1 A 81 81 LEU CA C 90 53.927 53.909 0.018 2
1 290 . 1 1 A 81 81 LEU CB C 90 45.006 44.262 0.744 2
1 291 . 1 1 A 81 81 LEU N N 90 125.111 128.778 -3.667 2
1 292 . 1 1 A 82 82 TYR H H 91 8.957 9.103 -0.146 2
1 293 . 1 1 A 82 82 TYR C C 91 174.981 174.754 0.227 2
1 294 . 1 1 A 82 82 TYR CA C 91 56.494 56.696 -0.202 2
1 295 . 1 1 A 82 82 TYR CB C 91 40.661 41.762 -1.101 2
1 296 . 1 1 A 82 82 TYR N N 91 119.875 124.597 -4.722 2
1 297 . 1 1 A 83 83 ALA H H 92 8.684 8.929 -0.245 2
1 298 . 1 1 A 83 83 ALA C C 92 173.325 175.758 -2.433 2
1 299 . 1 1 A 83 83 ALA CA C 92 51.133 50.529 0.604 2
1 300 . 1 1 A 83 83 ALA CB C 92 20.106 20.434 -0.328 2
1 301 . 1 1 A 83 83 ALA N N 92 127.148 126.652 0.496 2
1 302 . 1 1 A 84 84 VAL H H 93 7.637 9.028 -1.391 2
1 303 . 1 1 A 84 84 VAL C C 93 175.018 174.388 0.630 2
1 304 . 1 1 A 84 84 VAL CA C 93 60.668 61.234 -0.566 2
1 305 . 1 1 A 84 84 VAL CB C 93 31.418 32.589 -1.171 2
1 306 . 1 1 A 84 84 VAL N N 93 125.514 124.236 1.278 2
1 307 . 1 1 A 85 85 LYS H H 94 8.670 8.820 -0.150 2
1 308 . 1 1 A 85 85 LYS C C 94 174.869 176.478 -1.609 2
1 309 . 1 1 A 85 85 LYS CA C 94 56.344 56.301 0.043 2
1 310 . 1 1 A 85 85 LYS CB C 94 33.649 32.341 1.308 2
1 311 . 1 1 A 85 85 LYS N N 94 129.391 129.088 0.303 2
1 312 . 1 1 A 86 86 VAL H H 95 8.945 8.825 0.120 2
1 313 . 1 1 A 86 86 VAL C C 95 171.170 175.480 -4.310 2
1 314 . 1 1 A 86 86 VAL CA C 95 60.612 61.922 -1.310 2
1 315 . 1 1 A 86 86 VAL CB C 95 33.496 33.985 -0.489 2
1 316 . 1 1 A 86 86 VAL N N 95 118.856 120.403 -1.547 2
1 317 . 1 1 A 87 87 LEU H H 96 6.793 7.595 -0.802 2
1 318 . 1 1 A 87 87 LEU C C 96 176.801 176.680 0.121 2
1 319 . 1 1 A 87 87 LEU CA C 96 51.614 53.762 -2.148 2
1 320 . 1 1 A 87 87 LEU CB C 96 44.512 43.523 0.989 2
1 321 . 1 1 A 87 87 LEU N N 96 116.231 122.177 -5.946 2
1 322 . 1 1 A 88 88 GLY H H 97 8.326 8.541 -0.215 2
1 323 . 1 1 A 88 88 GLY C C 97 175.299 175.070 0.229 2
1 324 . 1 1 A 88 88 GLY CA C 97 43.580 43.935 -0.355 2
1 325 . 1 1 A 88 88 GLY N N 97 105.680 108.414 -2.734 2
1 326 . 1 1 A 89 89 ALA H H 98 9.601 8.783 0.818 2
1 327 . 1 1 A 89 89 ALA C C 98 179.069 178.727 0.342 2
1 328 . 1 1 A 89 89 ALA CA C 98 55.525 54.667 0.858 2
1 329 . 1 1 A 89 89 ALA CB C 98 19.175 18.621 0.554 2
1 330 . 1 1 A 89 89 ALA N N 98 123.650 122.138 1.512 2
1 331 . 1 1 A 90 90 ASP H H 99 8.369 7.899 0.470 2
1 332 . 1 1 A 90 90 ASP C C 99 177.666 176.856 0.810 2
1 333 . 1 1 A 90 90 ASP CA C 99 53.796 53.532 0.264 2
1 334 . 1 1 A 90 90 ASP CB C 99 39.934 40.845 -0.911 2
1 335 . 1 1 A 90 90 ASP N N 99 114.791 113.623 1.168 2
1 336 . 1 1 A 91 91 GLY H H 100 8.787 8.124 0.663 2
1 337 . 1 1 A 91 91 GLY CA C 100 45.604 44.993 0.611 2
1 338 . 1 1 A 91 91 GLY N N 100 108.611 109.795 -1.184 2
1 339 . 1 1 A 99 99 ILE C C 108 177.321 177.746 -0.425 2
1 340 . 1 1 A 99 99 ILE CA C 108 66.386 65.367 1.019 2
1 341 . 1 1 A 99 99 ILE CB C 108 40.561 37.585 2.976 2
1 342 . 1 1 A 100 100 ASN H H 109 7.658 8.809 -1.151 2
1 343 . 1 1 A 100 100 ASN C C 109 178.040 178.705 -0.665 2
1 344 . 1 1 A 100 100 ASN CA C 109 55.745 55.808 -0.063 2
1 345 . 1 1 A 100 100 ASN CB C 109 37.542 37.298 0.244 2
1 346 . 1 1 A 100 100 ASN N N 109 118.127 118.413 -0.286 2
1 347 . 1 1 A 101 101 GLY H H 110 7.812 8.252 -0.440 2
1 348 . 1 1 A 101 101 GLY C C 110 174.527 176.055 -1.528 2
1 349 . 1 1 A 101 101 GLY CA C 110 47.985 47.247 0.738 2
1 350 . 1 1 A 101 101 GLY N N 110 108.901 108.661 0.240 2
1 351 . 1 1 A 102 102 ILE H H 111 8.440 8.168 0.272 2
1 352 . 1 1 A 102 102 ILE C C 111 177.982 178.330 -0.348 2
1 353 . 1 1 A 102 102 ILE CA C 111 66.596 64.399 2.197 2
1 354 . 1 1 A 102 102 ILE CB C 111 37.989 37.454 0.535 2
1 355 . 1 1 A 102 102 ILE N N 111 123.912 122.419 1.493 2
1 356 . 1 1 A 103 103 GLU H H 112 8.564 8.078 0.486 2
1 357 . 1 1 A 103 103 GLU C C 112 180.057 178.872 1.185 2
1 358 . 1 1 A 103 103 GLU CA C 112 60.016 59.670 0.346 2
1 359 . 1 1 A 103 103 GLU CB C 112 28.740 29.286 -0.546 2
1 360 . 1 1 A 103 103 GLU N N 112 118.317 118.343 -0.026 2
1 361 . 1 1 A 104 104 TRP H H 113 8.157 8.092 0.065 2
1 362 . 1 1 A 104 104 TRP C C 113 179.017 178.210 0.807 2
1 363 . 1 1 A 104 104 TRP CA C 113 62.386 61.369 1.017 2
1 364 . 1 1 A 104 104 TRP CB C 113 29.734 29.373 0.361 2
1 365 . 1 1 A 104 104 TRP N N 113 121.908 122.025 -0.117 2
1 366 . 1 1 A 105 105 ALA H H 114 8.278 8.138 0.140 2
1 367 . 1 1 A 105 105 ALA C C 114 169.470 179.989 -10.519 2
1 368 . 1 1 A 105 105 ALA CA C 114 55.160 55.168 -0.008 2
1 369 . 1 1 A 105 105 ALA CB C 114 17.984 18.274 -0.290 2
1 370 . 1 1 A 105 105 ALA N N 114 122.626 120.769 1.857 2
1 371 . 1 1 A 106 106 ILE H H 115 8.086 7.942 0.144 2
1 372 . 1 1 A 106 106 ILE C C 115 179.582 177.830 1.752 2
1 373 . 1 1 A 106 106 ILE CA C 115 65.453 65.475 -0.022 2
1 374 . 1 1 A 106 106 ILE CB C 115 39.007 37.992 1.015 2
1 375 . 1 1 A 106 106 ILE N N 115 117.256 119.045 -1.789 2
1 376 . 1 1 A 107 107 ALA H H 116 7.938 8.374 -0.436 2
1 377 . 1 1 A 107 107 ALA C C 116 177.986 178.749 -0.763 2
1 378 . 1 1 A 107 107 ALA CA C 116 54.362 54.780 -0.418 2
1 379 . 1 1 A 107 107 ALA CB C 116 17.814 18.414 -0.600 2
1 380 . 1 1 A 107 107 ALA N N 116 121.796 121.580 0.216 2
1 381 . 1 1 A 108 108 ASN H H 117 7.112 7.701 -0.589 2
1 382 . 1 1 A 108 108 ASN C C 117 172.432 173.969 -1.537 2
1 383 . 1 1 A 108 108 ASN CA C 117 53.131 52.461 0.670 2
1 384 . 1 1 A 108 108 ASN CB C 117 37.993 37.837 0.156 2
1 385 . 1 1 A 108 108 ASN N N 117 112.535 113.809 -1.274 2
1 386 . 1 1 A 109 109 ASN H H 118 7.577 8.075 -0.498 2
1 387 . 1 1 A 109 109 ASN C C 118 174.502 174.469 0.033 2
1 388 . 1 1 A 109 109 ASN CA C 118 54.340 54.381 -0.041 2
1 389 . 1 1 A 109 109 ASN CB C 118 36.560 36.659 -0.099 2
1 390 . 1 1 A 109 109 ASN N N 118 113.483 114.696 -1.213 2
1 391 . 1 1 A 110 110 MET H H 119 7.409 7.810 -0.401 2
1 392 . 1 1 A 110 110 MET C C 119 174.612 175.556 -0.944 2
1 393 . 1 1 A 110 110 MET CA C 119 54.446 55.299 -0.853 2
1 394 . 1 1 A 110 110 MET CB C 119 33.856 32.656 1.200 2
1 395 . 1 1 A 110 110 MET N N 119 113.384 117.745 -4.361 2
1 396 . 1 1 A 111 111 ASP H H 120 8.407 8.805 -0.398 2
1 397 . 1 1 A 111 111 ASP C C 120 177.423 176.248 1.175 2
1 398 . 1 1 A 111 111 ASP CA C 120 56.843 56.791 0.052 2
1 399 . 1 1 A 111 111 ASP CB C 120 44.412 42.815 1.597 2
1 400 . 1 1 A 111 111 ASP N N 120 118.270 122.453 -4.183 2
1 401 . 1 1 A 112 112 VAL H H 121 8.065 7.866 0.199 2
1 402 . 1 1 A 112 112 VAL C C 121 174.467 174.655 -0.188 2
1 403 . 1 1 A 112 112 VAL CA C 121 59.929 60.359 -0.430 2
1 404 . 1 1 A 112 112 VAL CB C 121 37.221 35.633 1.588 2
1 405 . 1 1 A 112 112 VAL N N 121 118.512 117.523 0.989 2
1 406 . 1 1 A 113 113 ILE H H 122 9.244 8.903 0.341 2
1 407 . 1 1 A 113 113 ILE C C 122 172.849 174.098 -1.249 2
1 408 . 1 1 A 113 113 ILE CA C 122 60.240 60.012 0.228 2
1 409 . 1 1 A 113 113 ILE CB C 122 42.535 41.035 1.500 2
1 410 . 1 1 A 113 113 ILE N N 122 124.847 127.080 -2.233 2
1 411 . 1 1 A 114 114 ASN H H 123 8.834 8.907 -0.073 2
1 412 . 1 1 A 114 114 ASN C C 123 174.311 174.129 0.182 2
1 413 . 1 1 A 114 114 ASN CA C 123 53.033 51.877 1.156 2
1 414 . 1 1 A 114 114 ASN CB C 123 43.405 42.288 1.117 2
1 415 . 1 1 A 114 114 ASN N N 123 124.616 126.362 -1.746 2
1 416 . 1 1 A 115 115 MET H H 124 9.408 8.946 0.462 2
1 417 . 1 1 A 115 115 MET CA C 124 54.593 54.508 0.085 2
1 418 . 1 1 A 115 115 MET CB C 124 34.618 34.328 0.290 2
1 419 . 1 1 A 115 115 MET N N 124 126.877 125.408 1.469 2
1 420 . 1 1 A 127 127 LYS C C 136 177.508 178.461 -0.953 2
1 421 . 1 1 A 127 127 LYS CA C 136 59.413 58.597 0.816 2
1 422 . 1 1 A 127 127 LYS CB C 136 32.196 31.823 0.373 2
1 423 . 1 1 A 128 128 ALA H H 137 7.923 8.067 -0.144 2
1 424 . 1 1 A 128 128 ALA C C 137 180.387 179.626 0.761 2
1 425 . 1 1 A 128 128 ALA CA C 137 54.708 55.024 -0.316 2
1 426 . 1 1 A 128 128 ALA CB C 137 17.756 17.779 -0.023 2
1 427 . 1 1 A 128 128 ALA N N 137 117.347 121.422 -4.075 2
1 428 . 1 1 A 129 129 ALA H H 138 7.353 7.901 -0.548 2
1 429 . 1 1 A 129 129 ALA CA C 138 55.365 55.053 0.312 2
1 430 . 1 1 A 129 129 ALA CB C 138 18.718 18.945 -0.227 2
1 431 . 1 1 A 129 129 ALA N N 138 119.890 119.757 0.133 2
1 432 . 1 1 A 130 130 VAL C C 139 177.610 177.883 -0.273 2
1 433 . 1 1 A 130 130 VAL CA C 139 66.210 65.410 0.800 2
1 434 . 1 1 A 130 130 VAL CB C 139 31.122 31.645 -0.523 2
1 435 . 1 1 A 131 131 ASP H H 140 8.581 8.310 0.271 2
1 436 . 1 1 A 131 131 ASP C C 140 179.897 178.737 1.160 2
1 437 . 1 1 A 131 131 ASP CA C 140 57.574 57.320 0.254 2
1 438 . 1 1 A 131 131 ASP CB C 140 39.106 39.984 -0.878 2
1 439 . 1 1 A 131 131 ASP N N 140 121.919 122.791 -0.872 2
1 440 . 1 1 A 132 132 LYS H H 141 8.154 7.890 0.264 2
1 441 . 1 1 A 132 132 LYS C C 141 179.475 178.566 0.909 2
1 442 . 1 1 A 132 132 LYS CA C 141 59.343 58.553 0.790 2
1 443 . 1 1 A 132 132 LYS CB C 141 32.086 32.271 -0.185 2
1 444 . 1 1 A 132 132 LYS N N 141 122.626 121.071 1.555 2
1 445 . 1 1 A 133 133 ALA H H 142 8.013 8.111 -0.098 2
1 446 . 1 1 A 133 133 ALA C C 142 179.250 180.058 -0.808 2
1 447 . 1 1 A 133 133 ALA CA C 142 55.598 55.231 0.367 2
1 448 . 1 1 A 133 133 ALA CB C 142 16.226 18.150 -1.924 2
1 449 . 1 1 A 133 133 ALA N N 142 124.336 121.743 2.593 2
1 450 . 1 1 A 134 134 VAL H H 143 7.989 8.133 -0.144 2
1 451 . 1 1 A 134 134 VAL C C 143 181.099 178.091 3.008 2
1 452 . 1 1 A 134 134 VAL CA C 143 66.214 66.814 -0.600 2
1 453 . 1 1 A 134 134 VAL CB C 143 31.675 31.636 0.039 2
1 454 . 1 1 A 134 134 VAL N N 143 119.698 118.873 0.825 2
1 455 . 1 1 A 135 135 ALA H H 144 8.553 8.356 0.197 2
1 456 . 1 1 A 135 135 ALA C C 144 179.384 179.592 -0.208 2
1 457 . 1 1 A 135 135 ALA CA C 144 54.896 55.095 -0.199 2
1 458 . 1 1 A 135 135 ALA CB C 144 17.807 17.962 -0.155 2
1 459 . 1 1 A 135 135 ALA N N 144 125.717 121.936 3.781 2
1 460 . 1 1 A 136 136 SER H H 145 7.708 7.793 -0.085 2
1 461 . 1 1 A 136 136 SER C C 145 173.850 174.606 -0.756 2
1 462 . 1 1 A 136 136 SER CA C 145 59.051 58.801 0.250 2
1 463 . 1 1 A 136 136 SER CB C 145 63.706 63.586 0.120 2
1 464 . 1 1 A 136 136 SER N N 145 112.345 111.273 1.072 2
1 465 . 1 1 A 137 137 GLY H H 146 7.668 8.125 -0.457 2
1 466 . 1 1 A 137 137 GLY C C 146 174.396 174.582 -0.186 2
1 467 . 1 1 A 137 137 GLY CA C 146 44.850 45.230 -0.380 2
1 468 . 1 1 A 137 137 GLY N N 146 106.277 109.194 -2.917 2
1 469 . 1 1 A 138 138 VAL H H 147 7.927 7.755 0.172 2
1 470 . 1 1 A 138 138 VAL C C 147 176.830 174.906 1.924 2
1 471 . 1 1 A 138 138 VAL CA C 147 62.614 62.209 0.405 2
1 472 . 1 1 A 138 138 VAL CB C 147 32.978 32.077 0.901 2
1 473 . 1 1 A 138 138 VAL N N 147 122.591 122.547 0.044 2
1 474 . 1 1 A 139 139 VAL H H 148 8.066 8.566 -0.500 2
1 475 . 1 1 A 139 139 VAL C C 148 174.652 175.382 -0.730 2
1 476 . 1 1 A 139 139 VAL CA C 148 62.736 62.617 0.119 2
1 477 . 1 1 A 139 139 VAL CB C 148 32.559 31.871 0.688 2
1 478 . 1 1 A 139 139 VAL N N 148 126.667 127.806 -1.139 2
1 479 . 1 1 A 140 140 VAL H H 149 8.192 8.954 -0.762 2
1 480 . 1 1 A 140 140 VAL C C 149 174.046 175.040 -0.994 2
1 481 . 1 1 A 140 140 VAL CA C 149 62.746 60.918 1.828 2
1 482 . 1 1 A 140 140 VAL CB C 149 31.824 33.428 -1.604 2
1 483 . 1 1 A 140 140 VAL N N 149 128.705 128.564 0.141 2
1 484 . 1 1 A 141 141 VAL H H 150 8.676 9.078 -0.402 2
1 485 . 1 1 A 141 141 VAL C C 150 173.337 174.526 -1.189 2
1 486 . 1 1 A 141 141 VAL CA C 150 61.101 60.790 0.311 2
1 487 . 1 1 A 141 141 VAL CB C 150 34.702 34.612 0.090 2
1 488 . 1 1 A 141 141 VAL N N 150 130.739 128.241 2.498 2
1 489 . 1 1 A 142 142 ALA H H 151 9.471 8.496 0.975 2
1 490 . 1 1 A 142 142 ALA CA C 151 50.176 51.261 -1.085 2
1 491 . 1 1 A 142 142 ALA CB C 151 24.145 23.154 0.991 2
1 492 . 1 1 A 142 142 ALA N N 151 127.769 127.709 0.060 2
1 493 . 1 1 A 146 146 ASN C C 155 177.577 175.658 1.919 2
1 494 . 1 1 A 146 146 ASN CA C 155 50.911 52.402 -1.491 2
1 495 . 1 1 A 146 146 ASN CB C 155 38.375 39.021 -0.646 2
1 496 . 1 1 A 147 147 GLU H H 156 7.642 8.182 -0.540 2
1 497 . 1 1 A 147 147 GLU C C 156 177.005 177.309 -0.304 2
1 498 . 1 1 A 147 147 GLU CA C 156 55.716 56.434 -0.718 2
1 499 . 1 1 A 147 147 GLU CB C 156 30.281 30.702 -0.421 2
1 500 . 1 1 A 147 147 GLU N N 156 116.511 120.488 -3.977 2
1 501 . 1 1 A 148 148 GLY H H 157 7.663 7.971 -0.308 2
1 502 . 1 1 A 148 148 GLY C C 157 171.987 173.709 -1.722 2
1 503 . 1 1 A 148 148 GLY CA C 157 45.949 45.521 0.428 2
1 504 . 1 1 A 148 148 GLY N N 157 106.998 107.898 -0.900 2
1 505 . 1 1 A 149 149 THR H H 158 7.956 8.062 -0.106 2
1 506 . 1 1 A 149 149 THR C C 158 175.009 173.614 1.395 2
1 507 . 1 1 A 149 149 THR CA C 158 59.983 60.257 -0.274 2
1 508 . 1 1 A 149 149 THR CB C 158 71.045 71.436 -0.391 2
1 509 . 1 1 A 149 149 THR N N 158 110.597 113.786 -3.189 2
1 510 . 1 1 A 150 150 SER H H 159 9.892 8.749 1.143 2
1 511 . 1 1 A 150 150 SER C C 159 172.334 174.603 -2.269 2
1 512 . 1 1 A 150 150 SER CA C 159 56.418 56.899 -0.481 2
1 513 . 1 1 A 150 150 SER CB C 159 63.035 63.858 -0.823 2
1 514 . 1 1 A 150 150 SER N N 159 119.031 118.639 0.392 2
1 515 . 1 1 A 151 151 GLY H H 160 8.848 8.880 -0.032 2
1 516 . 1 1 A 151 151 GLY CA C 160 47.073 47.333 -0.260 2
1 517 . 1 1 A 151 151 GLY N N 160 114.654 117.123 -2.469 2
1 518 . 1 1 A 154 154 SER C C 163 177.379 175.369 2.010 2
1 519 . 1 1 A 154 154 SER CA C 163 57.430 57.559 -0.129 2
1 520 . 1 1 A 154 154 SER CB C 163 63.373 63.616 -0.243 2
1 521 . 1 1 A 155 155 THR H H 164 9.610 8.665 0.945 2
1 522 . 1 1 A 155 155 THR C C 164 176.334 174.801 1.533 2
1 523 . 1 1 A 155 155 THR CA C 164 59.923 62.215 -2.292 2
1 524 . 1 1 A 155 155 THR CB C 164 69.343 69.612 -0.269 2
1 525 . 1 1 A 155 155 THR N N 164 118.808 115.175 3.633 2
1 526 . 1 1 A 156 156 VAL H H 165 7.458 7.317 0.141 2
1 527 . 1 1 A 156 156 VAL C C 165 175.857 176.065 -0.208 2
1 528 . 1 1 A 156 156 VAL CA C 165 63.666 62.903 0.763 2
1 529 . 1 1 A 156 156 VAL CB C 165 31.579 31.608 -0.029 2
1 530 . 1 1 A 156 156 VAL N N 165 127.426 123.771 3.655 2
1 531 . 1 1 A 157 157 GLY H H 166 8.641 8.701 -0.060 2
1 532 . 1 1 A 157 157 GLY C C 166 171.879 172.533 -0.654 2
1 533 . 1 1 A 157 157 GLY CA C 166 45.995 44.399 1.596 2
1 534 . 1 1 A 157 157 GLY N N 166 104.439 115.202 -10.763 2
1 535 . 1 1 A 158 158 TYR H H 167 7.394 8.264 -0.870 2
1 536 . 1 1 A 158 158 TYR CA C 167 61.986 56.196 5.790 2
1 537 . 1 1 A 158 158 TYR CB C 167 34.054 39.153 -5.099 2
1 538 . 1 1 A 158 158 TYR N N 167 119.099 118.703 0.396 2
1 539 . 1 1 A 163 163 PRO C C 172 178.256 178.135 0.121 2
1 540 . 1 1 A 163 163 PRO CA C 172 64.633 65.274 -0.641 2
1 541 . 1 1 A 163 163 PRO CB C 172 31.523 31.910 -0.387 2
1 542 . 1 1 A 164 164 SER H H 173 7.893 8.008 -0.115 2
1 543 . 1 1 A 164 164 SER C C 173 172.746 174.274 -1.528 2
1 544 . 1 1 A 164 164 SER CA C 173 58.901 60.409 -1.508 2
1 545 . 1 1 A 164 164 SER CB C 173 62.763 62.853 -0.090 2
1 546 . 1 1 A 164 164 SER N N 173 111.354 110.094 1.260 2
1 547 . 1 1 A 165 165 VAL H H 174 7.580 7.843 -0.263 2
1 548 . 1 1 A 165 165 VAL C C 174 174.476 175.560 -1.084 2
1 549 . 1 1 A 165 165 VAL CA C 174 61.687 61.907 -0.220 2
1 550 . 1 1 A 165 165 VAL CB C 174 33.810 32.726 1.084 2
1 551 . 1 1 A 165 165 VAL N N 174 123.663 122.387 1.276 2
1 552 . 1 1 A 166 166 ILE H H 175 7.751 8.687 -0.936 2
1 553 . 1 1 A 166 166 ILE C C 175 173.514 175.322 -1.808 2
1 554 . 1 1 A 166 166 ILE CA C 175 61.545 62.728 -1.183 2
1 555 . 1 1 A 166 166 ILE CB C 175 38.562 37.258 1.304 2
1 556 . 1 1 A 166 166 ILE N N 175 124.752 128.835 -4.083 2
1 557 . 1 1 A 167 167 ALA H H 176 11.194 8.859 2.335 2
1 558 . 1 1 A 167 167 ALA C C 176 178.637 176.128 2.509 2
1 559 . 1 1 A 167 167 ALA CA C 176 50.798 50.343 0.455 2
1 560 . 1 1 A 167 167 ALA CB C 176 19.075 20.533 -1.458 2
1 561 . 1 1 A 167 167 ALA N N 176 131.783 131.159 0.624 2
1 562 . 1 1 A 168 168 VAL H H 177 8.558 8.800 -0.242 2
1 563 . 1 1 A 168 168 VAL C C 177 176.699 175.931 0.768 2
1 564 . 1 1 A 168 168 VAL CA C 177 61.460 61.226 0.234 2
1 565 . 1 1 A 168 168 VAL CB C 177 33.908 33.720 0.188 2
1 566 . 1 1 A 168 168 VAL N N 177 122.470 122.986 -0.516 2
1 567 . 1 1 A 169 169 GLY H H 178 9.089 9.042 0.047 2
1 568 . 1 1 A 169 169 GLY C C 178 171.692 172.122 -0.430 2
1 569 . 1 1 A 169 169 GLY CA C 178 44.076 43.795 0.281 2
1 570 . 1 1 A 169 169 GLY N N 178 117.704 115.527 2.177 2
1 571 . 1 1 A 170 170 ALA H H 179 7.983 8.459 -0.476 2
1 572 . 1 1 A 170 170 ALA C C 179 176.624 176.494 0.130 2
1 573 . 1 1 A 170 170 ALA CA C 179 49.813 50.295 -0.482 2
1 574 . 1 1 A 170 170 ALA CB C 179 24.269 21.740 2.529 2
1 575 . 1 1 A 170 170 ALA N N 179 117.964 121.770 -3.806 2
1 576 . 1 1 A 171 171 VAL H H 180 7.791 8.938 -1.147 2
1 577 . 1 1 A 171 171 VAL C C 180 175.521 175.566 -0.045 2
1 578 . 1 1 A 171 171 VAL CA C 180 58.158 59.239 -1.081 2
1 579 . 1 1 A 171 171 VAL CB C 180 35.769 34.960 0.809 2
1 580 . 1 1 A 171 171 VAL N N 180 112.019 116.644 -4.625 2
1 581 . 1 1 A 172 172 ASP H H 181 8.185 8.416 -0.231 2
1 582 . 1 1 A 172 172 ASP C C 181 178.643 178.328 0.315 2
1 583 . 1 1 A 172 172 ASP CA C 181 51.976 52.079 -0.103 2
1 584 . 1 1 A 172 172 ASP CB C 181 42.090 41.755 0.335 2
1 585 . 1 1 A 172 172 ASP N N 181 119.896 122.858 -2.962 2
1 586 . 1 1 A 173 173 SER H H 182 8.180 8.611 -0.431 2
1 587 . 1 1 A 173 173 SER C C 182 175.332 174.749 0.583 2
1 588 . 1 1 A 173 173 SER CA C 182 60.691 60.682 0.009 2
1 589 . 1 1 A 173 173 SER CB C 182 63.040 63.065 -0.025 2
1 590 . 1 1 A 173 173 SER N N 182 112.707 114.574 -1.867 2
1 591 . 1 1 A 174 174 SER H H 183 8.412 7.894 0.518 2
1 592 . 1 1 A 174 174 SER C C 183 173.911 174.267 -0.356 2
1 593 . 1 1 A 174 174 SER CA C 183 57.825 57.830 -0.005 2
1 594 . 1 1 A 174 174 SER CB C 183 64.213 62.941 1.272 2
1 595 . 1 1 A 174 174 SER N N 183 118.767 114.238 4.529 2
1 596 . 1 1 A 175 175 ASN H H 184 7.997 8.084 -0.087 2
1 597 . 1 1 A 175 175 ASN C C 184 173.254 173.988 -0.734 2
1 598 . 1 1 A 175 175 ASN CA C 184 55.122 54.978 0.144 2
1 599 . 1 1 A 175 175 ASN CB C 184 36.024 37.165 -1.141 2
1 600 . 1 1 A 175 175 ASN N N 184 113.302 114.783 -1.481 2
1 601 . 1 1 A 176 176 GLN H H 185 7.999 7.674 0.325 2
1 602 . 1 1 A 176 176 GLN C C 185 176.581 175.380 1.201 2
1 603 . 1 1 A 176 176 GLN CA C 185 54.572 55.313 -0.741 2
1 604 . 1 1 A 176 176 GLN CB C 185 29.469 30.274 -0.805 2
1 605 . 1 1 A 176 176 GLN N N 185 117.183 119.176 -1.993 2
1 606 . 1 1 A 177 177 ARG H H 186 8.180 8.318 -0.138 2
1 607 . 1 1 A 177 177 ARG C C 186 176.128 176.312 -0.184 2
1 608 . 1 1 A 177 177 ARG CA C 186 56.649 56.686 -0.037 2
1 609 . 1 1 A 177 177 ARG CB C 186 29.516 29.984 -0.468 2
1 610 . 1 1 A 177 177 ARG N N 186 123.309 126.429 -3.120 2
1 611 . 1 1 A 178 178 ALA H H 187 8.062 8.802 -0.740 2
1 612 . 1 1 A 178 178 ALA CA C 187 50.927 51.961 -1.034 2
1 613 . 1 1 A 178 178 ALA CB C 187 18.788 18.833 -0.045 2
1 614 . 1 1 A 178 178 ALA N N 187 131.060 130.145 0.915 2
1 615 . 1 1 A 179 179 SER C C 188 175.015 176.029 -1.014 2
1 616 . 1 1 A 179 179 SER CA C 188 61.371 61.882 -0.511 2
1 617 . 1 1 A 179 179 SER CB C 188 62.564 62.522 0.042 2
1 618 . 1 1 A 180 180 PHE H H 189 6.035 7.838 -1.803 2
1 619 . 1 1 A 180 180 PHE C C 189 176.413 176.161 0.252 2
1 620 . 1 1 A 180 180 PHE CA C 189 55.544 58.508 -2.964 2
1 621 . 1 1 A 180 180 PHE CB C 189 39.191 38.094 1.097 2
1 622 . 1 1 A 180 180 PHE N N 189 111.460 114.165 -2.705 2
1 623 . 1 1 A 181 181 SER H H 190 7.150 7.800 -0.650 2
1 624 . 1 1 A 181 181 SER C C 190 175.188 174.720 0.468 2
1 625 . 1 1 A 181 181 SER CA C 190 60.364 58.541 1.823 2
1 626 . 1 1 A 181 181 SER CB C 190 63.613 63.166 0.447 2
1 627 . 1 1 A 181 181 SER N N 190 118.723 117.011 1.712 2
1 628 . 1 1 A 182 182 SER H H 191 8.571 8.362 0.209 2
1 629 . 1 1 A 182 182 SER C C 191 171.151 174.612 -3.461 2
1 630 . 1 1 A 182 182 SER CA C 191 62.476 59.343 3.133 2
1 631 . 1 1 A 182 182 SER CB C 191 65.378 64.027 1.351 2
1 632 . 1 1 A 182 182 SER N N 191 127.069 123.256 3.813 2
1 633 . 1 1 A 183 183 VAL H H 192 7.401 8.755 -1.354 2
1 634 . 1 1 A 183 183 VAL C C 192 173.360 174.092 -0.732 2
1 635 . 1 1 A 183 183 VAL CA C 192 58.814 59.109 -0.295 2
1 636 . 1 1 A 183 183 VAL CB C 192 33.715 34.772 -1.057 2
1 637 . 1 1 A 183 183 VAL N N 192 110.286 119.904 -9.618 2
1 638 . 1 1 A 184 184 GLY H H 193 7.760 8.427 -0.667 2
1 639 . 1 1 A 184 184 GLY CA C 193 43.632 44.013 -0.381 2
1 640 . 1 1 A 184 184 GLY N N 193 107.046 108.388 -1.342 2
1 641 . 1 1 A 185 185 PRO C C 194 177.341 177.306 0.035 2
1 642 . 1 1 A 185 185 PRO CA C 194 63.986 64.935 -0.949 2
1 643 . 1 1 A 185 185 PRO CB C 194 31.734 31.918 -0.184 2
1 644 . 1 1 A 186 186 GLU H H 195 8.477 8.543 -0.066 2
1 645 . 1 1 A 186 186 GLU C C 195 174.026 176.465 -2.439 2
1 646 . 1 1 A 186 186 GLU CA C 195 57.153 57.336 -0.183 2
1 647 . 1 1 A 186 186 GLU CB C 195 28.291 30.033 -1.742 2
1 648 . 1 1 A 186 186 GLU N N 195 115.638 116.955 -1.317 2
1 649 . 1 1 A 187 187 LEU H H 196 6.774 7.306 -0.532 2
1 650 . 1 1 A 187 187 LEU C C 196 175.408 175.939 -0.531 2
1 651 . 1 1 A 187 187 LEU CA C 196 55.361 55.607 -0.246 2
1 652 . 1 1 A 187 187 LEU CB C 196 44.110 42.539 1.571 2
1 653 . 1 1 A 187 187 LEU N N 196 117.444 122.066 -4.622 2
1 654 . 1 1 A 188 188 ASP H H 197 7.950 8.894 -0.944 2
1 655 . 1 1 A 188 188 ASP C C 197 176.317 176.548 -0.231 2
1 656 . 1 1 A 188 188 ASP CA C 197 58.046 56.189 1.857 2
1 657 . 1 1 A 188 188 ASP CB C 197 44.690 41.647 3.043 2
1 658 . 1 1 A 188 188 ASP N N 197 123.323 126.071 -2.748 2
1 659 . 1 1 A 189 189 VAL H H 198 7.873 7.650 0.223 2
1 660 . 1 1 A 189 189 VAL C C 198 172.481 174.066 -1.585 2
1 661 . 1 1 A 189 189 VAL CA C 198 58.669 59.072 -0.403 2
1 662 . 1 1 A 189 189 VAL CB C 198 37.877 35.532 2.345 2
1 663 . 1 1 A 189 189 VAL N N 198 108.103 112.515 -4.412 2
1 664 . 1 1 A 190 190 MET H H 199 8.399 8.750 -0.351 2
1 665 . 1 1 A 190 190 MET C C 199 175.209 175.095 0.114 2
1 666 . 1 1 A 190 190 MET CA C 199 51.535 53.910 -2.375 2
1 667 . 1 1 A 190 190 MET CB C 199 36.293 35.188 1.105 2
1 668 . 1 1 A 190 190 MET N N 199 113.686 120.893 -7.207 2
1 669 . 1 1 A 191 191 ALA H H 200 8.477 8.683 -0.206 2
1 670 . 1 1 A 191 191 ALA CA C 200 50.019 49.962 0.057 2
1 671 . 1 1 A 191 191 ALA CB C 200 20.869 22.476 -1.607 2
1 672 . 1 1 A 191 191 ALA N N 200 118.761 124.032 -5.271 2
1 673 . 1 1 A 194 194 VAL C C 203 174.914 175.845 -0.931 2
1 674 . 1 1 A 194 194 VAL CA C 203 61.992 61.537 0.455 2
1 675 . 1 1 A 194 194 VAL CB C 203 34.076 32.968 1.108 2
1 676 . 1 1 A 195 195 SER H H 204 9.591 8.572 1.019 2
1 677 . 1 1 A 195 195 SER C C 204 172.988 173.657 -0.669 2
1 678 . 1 1 A 195 195 SER CA C 204 58.898 58.491 0.407 2
1 679 . 1 1 A 195 195 SER CB C 204 61.165 61.605 -0.440 2
1 680 . 1 1 A 195 195 SER N N 204 125.344 120.122 5.222 2
1 681 . 1 1 A 196 196 ILE H H 205 8.460 7.998 0.462 2
1 682 . 1 1 A 196 196 ILE C C 205 176.486 175.479 1.007 2
1 683 . 1 1 A 196 196 ILE CA C 205 57.448 60.785 -3.337 2
1 684 . 1 1 A 196 196 ILE CB C 205 36.272 38.152 -1.880 2
1 685 . 1 1 A 196 196 ILE N N 205 120.321 121.061 -0.740 2
1 686 . 1 1 A 197 197 VAL H H 206 8.827 8.756 0.071 2
1 687 . 1 1 A 197 197 VAL C C 206 175.187 175.381 -0.194 2
1 688 . 1 1 A 197 197 VAL CA C 206 63.136 61.535 1.601 2
1 689 . 1 1 A 197 197 VAL CB C 206 31.434 32.955 -1.521 2
1 690 . 1 1 A 197 197 VAL N N 206 128.666 125.905 2.761 2
1 691 . 1 1 A 198 198 SER H H 207 8.172 8.859 -0.687 2
1 692 . 1 1 A 198 198 SER C C 207 173.084 173.146 -0.062 2
1 693 . 1 1 A 198 198 SER CA C 207 53.983 55.846 -1.863 2
1 694 . 1 1 A 198 198 SER CB C 207 60.888 65.115 -4.227 2
1 695 . 1 1 A 198 198 SER N N 207 120.690 120.503 0.187 2
1 696 . 1 1 A 199 199 THR H H 208 8.133 8.465 -0.332 2
1 697 . 1 1 A 199 199 THR C C 208 173.515 174.484 -0.969 2
1 698 . 1 1 A 199 199 THR CA C 208 60.662 62.335 -1.673 2
1 699 . 1 1 A 199 199 THR CB C 208 70.183 69.101 1.082 2
1 700 . 1 1 A 199 199 THR N N 208 111.660 115.467 -3.807 2
1 701 . 1 1 A 200 200 LEU H H 209 7.820 8.343 -0.523 2
1 702 . 1 1 A 200 200 LEU CA C 209 50.850 51.141 -0.291 2
1 703 . 1 1 A 200 200 LEU CB C 209 44.889 45.450 -0.561 2
1 704 . 1 1 A 200 200 LEU N N 209 118.617 126.548 -7.931 2
1 705 . 1 1 A 201 201 PRO C C 210 176.234 177.436 -1.202 2
1 706 . 1 1 A 201 201 PRO CA C 210 63.471 63.816 -0.345 2
1 707 . 1 1 A 201 201 PRO CB C 210 32.422 31.484 0.938 2
1 708 . 1 1 A 202 202 GLY H H 211 8.174 8.774 -0.600 2
1 709 . 1 1 A 202 202 GLY C C 211 176.073 174.230 1.843 2
1 710 . 1 1 A 202 202 GLY CA C 211 46.329 46.260 0.069 2
1 711 . 1 1 A 202 202 GLY N N 211 109.801 111.609 -1.808 2
1 712 . 1 1 A 203 203 ASN H H 212 8.358 8.612 -0.254 2
1 713 . 1 1 A 203 203 ASN C C 212 173.793 173.795 -0.002 2
1 714 . 1 1 A 203 203 ASN CA C 212 53.125 53.602 -0.477 2
1 715 . 1 1 A 203 203 ASN CB C 212 35.940 36.966 -1.026 2
1 716 . 1 1 A 203 203 ASN N N 212 115.720 115.333 0.387 2
1 717 . 1 1 A 204 204 LYS H H 213 6.834 7.443 -0.609 2
1 718 . 1 1 A 204 204 LYS C C 213 175.795 175.063 0.732 2
1 719 . 1 1 A 204 204 LYS CA C 213 54.858 54.511 0.347 2
1 720 . 1 1 A 204 204 LYS CB C 213 37.472 36.295 1.177 2
1 721 . 1 1 A 204 204 LYS N N 213 116.253 116.824 -0.571 2
1 722 . 1 1 A 205 205 TYR H H 214 8.315 8.787 -0.472 2
1 723 . 1 1 A 205 205 TYR C C 214 176.049 175.486 0.563 2
1 724 . 1 1 A 205 205 TYR CA C 214 57.525 56.094 1.431 2
1 725 . 1 1 A 205 205 TYR CB C 214 43.449 43.039 0.410 2
1 726 . 1 1 A 205 205 TYR N N 214 119.605 119.473 0.132 2
1 727 . 1 1 A 206 206 GLY H H 215 8.960 8.446 0.514 2
1 728 . 1 1 A 206 206 GLY C C 215 172.841 171.796 1.045 2
1 729 . 1 1 A 206 206 GLY CA C 215 45.976 46.143 -0.167 2
1 730 . 1 1 A 206 206 GLY N N 215 105.632 109.839 -4.207 2
1 731 . 1 1 A 207 207 ALA H H 216 8.829 8.047 0.782 2
1 732 . 1 1 A 207 207 ALA C C 216 180.583 176.897 3.686 2
1 733 . 1 1 A 207 207 ALA CA C 216 50.932 51.574 -0.642 2
1 734 . 1 1 A 207 207 ALA CB C 216 20.308 20.142 0.166 2
1 735 . 1 1 A 207 207 ALA N N 216 124.703 123.004 1.699 2
1 736 . 1 1 A 208 208 LYS H H 217 8.209 8.803 -0.594 2
1 737 . 1 1 A 208 208 LYS C C 217 175.273 175.152 0.121 2
1 738 . 1 1 A 208 208 LYS CA C 217 56.160 54.730 1.430 2
1 739 . 1 1 A 208 208 LYS CB C 217 39.575 36.350 3.225 2
1 740 . 1 1 A 208 208 LYS N N 217 120.321 122.561 -2.240 2
1 741 . 1 1 A 209 209 SER H H 218 8.321 8.673 -0.352 2
1 742 . 1 1 A 209 209 SER C C 218 172.904 173.514 -0.610 2
1 743 . 1 1 A 209 209 SER CA C 218 56.496 57.222 -0.726 2
1 744 . 1 1 A 209 209 SER CB C 218 66.322 66.142 0.180 2
1 745 . 1 1 A 209 209 SER N N 218 114.693 118.496 -3.803 2
1 746 . 1 1 A 210 210 GLY H H 219 8.930 8.401 0.529 2
1 747 . 1 1 A 210 210 GLY CA C 219 46.025 44.517 1.508 2
1 748 . 1 1 A 210 210 GLY N N 219 110.756 110.409 0.347 2
1 749 . 1 1 A 216 216 PRO C C 225 179.288 179.242 0.046 2
1 750 . 1 1 A 216 216 PRO CA C 225 65.442 65.480 -0.038 2
1 751 . 1 1 A 216 216 PRO CB C 225 32.532 31.467 1.065 2
1 752 . 1 1 A 217 217 HIS H H 226 7.601 7.675 -0.074 2
1 753 . 1 1 A 217 217 HIS C C 226 177.206 177.847 -0.641 2
1 754 . 1 1 A 217 217 HIS CA C 226 62.532 60.375 2.157 2
1 755 . 1 1 A 217 217 HIS CB C 226 28.155 29.791 -1.636 2
1 756 . 1 1 A 217 217 HIS N N 226 116.973 116.641 0.332 2
1 757 . 1 1 A 218 218 VAL H H 227 7.356 7.644 -0.288 2
1 758 . 1 1 A 218 218 VAL C C 227 177.244 177.824 -0.580 2
1 759 . 1 1 A 218 218 VAL CA C 227 65.305 65.915 -0.610 2
1 760 . 1 1 A 218 218 VAL CB C 227 30.314 31.710 -1.396 2
1 761 . 1 1 A 218 218 VAL N N 227 119.112 119.701 -0.589 2
1 762 . 1 1 A 219 219 ALA H H 228 8.347 8.346 0.001 2
1 763 . 1 1 A 219 219 ALA C C 228 179.324 179.981 -0.657 2
1 764 . 1 1 A 219 219 ALA CA C 228 55.640 55.319 0.321 2
1 765 . 1 1 A 219 219 ALA CB C 228 18.188 18.501 -0.313 2
1 766 . 1 1 A 219 219 ALA N N 228 122.937 122.603 0.334 2
1 767 . 1 1 A 220 220 GLY H H 229 8.558 8.278 0.280 2
1 768 . 1 1 A 220 220 GLY C C 229 175.194 176.090 -0.896 2
1 769 . 1 1 A 220 220 GLY CA C 229 46.861 47.025 -0.164 2
1 770 . 1 1 A 220 220 GLY N N 229 102.398 103.754 -1.356 2
1 771 . 1 1 A 221 221 ALA H H 230 7.925 7.992 -0.067 2
1 772 . 1 1 A 221 221 ALA C C 230 178.786 179.397 -0.611 2
1 773 . 1 1 A 221 221 ALA CA C 230 55.514 54.674 0.840 2
1 774 . 1 1 A 221 221 ALA CB C 230 19.161 18.444 0.717 2
1 775 . 1 1 A 221 221 ALA N N 230 125.030 124.779 0.251 2
1 776 . 1 1 A 222 222 ALA H H 231 8.361 8.189 0.172 2
1 777 . 1 1 A 222 222 ALA C C 231 178.090 179.487 -1.397 2
1 778 . 1 1 A 222 222 ALA CA C 231 55.277 55.149 0.128 2
1 779 . 1 1 A 222 222 ALA CB C 231 17.706 18.433 -0.727 2
1 780 . 1 1 A 222 222 ALA N N 231 118.838 120.172 -1.334 2
1 781 . 1 1 A 223 223 ALA H H 232 7.482 7.876 -0.394 2
1 782 . 1 1 A 223 223 ALA C C 232 179.266 180.081 -0.815 2
1 783 . 1 1 A 223 223 ALA CA C 232 55.000 55.160 -0.160 2
1 784 . 1 1 A 223 223 ALA CB C 232 16.649 18.466 -1.817 2
1 785 . 1 1 A 223 223 ALA N N 232 117.957 121.153 -3.196 2
1 786 . 1 1 A 224 224 LEU H H 233 8.099 8.000 0.099 2
1 787 . 1 1 A 224 224 LEU C C 233 180.450 179.154 1.296 2
1 788 . 1 1 A 224 224 LEU CA C 233 62.279 58.261 4.018 2
1 789 . 1 1 A 224 224 LEU CB C 233 42.811 42.132 0.679 2
1 790 . 1 1 A 224 224 LEU N N 233 117.284 118.404 -1.120 2
1 791 . 1 1 A 225 225 ILE H H 234 8.114 8.109 0.005 2
1 792 . 1 1 A 225 225 ILE C C 234 177.670 178.036 -0.366 2
1 793 . 1 1 A 225 225 ILE CA C 234 66.486 65.671 0.815 2
1 794 . 1 1 A 225 225 ILE CB C 234 37.922 38.100 -0.178 2
1 795 . 1 1 A 225 225 ILE N N 234 119.445 119.778 -0.333 2
1 796 . 1 1 A 226 226 LEU H H 235 8.093 8.328 -0.235 2
1 797 . 1 1 A 226 226 LEU C C 235 177.612 179.580 -1.968 2
1 798 . 1 1 A 226 226 LEU CA C 235 57.029 57.704 -0.675 2
1 799 . 1 1 A 226 226 LEU CB C 235 42.598 41.111 1.487 2
1 800 . 1 1 A 226 226 LEU N N 235 119.414 118.915 0.499 2
1 801 . 1 1 A 227 227 SER H H 236 7.691 8.234 -0.543 2
1 802 . 1 1 A 227 227 SER C C 236 174.703 176.559 -1.856 2
1 803 . 1 1 A 227 227 SER CA C 236 60.415 61.542 -1.127 2
1 804 . 1 1 A 227 227 SER CB C 236 64.041 62.439 1.602 2
1 805 . 1 1 A 227 227 SER N N 236 112.589 113.628 -1.039 2
1 806 . 1 1 A 228 228 LYS H H 237 6.976 7.725 -0.749 2
1 807 . 1 1 A 228 228 LYS C C 237 174.915 176.286 -1.371 2
1 808 . 1 1 A 228 228 LYS CA C 237 57.784 57.788 -0.004 2
1 809 . 1 1 A 228 228 LYS CB C 237 33.643 32.891 0.752 2
1 810 . 1 1 A 228 228 LYS N N 237 123.239 121.735 1.504 2
1 811 . 1 1 A 229 229 HIS H H 238 7.969 8.001 -0.032 2
1 812 . 1 1 A 229 229 HIS CA C 238 51.362 52.673 -1.311 2
1 813 . 1 1 A 229 229 HIS CB C 238 26.743 28.892 -2.149 2
1 814 . 1 1 A 229 229 HIS N N 238 116.273 114.880 1.393 2
1 815 . 1 1 A 230 230 PRO C C 239 177.434 178.625 -1.191 2
1 816 . 1 1 A 230 230 PRO CA C 239 64.963 65.071 -0.108 2
1 817 . 1 1 A 230 230 PRO CB C 239 31.707 31.844 -0.137 2
1 818 . 1 1 A 231 231 ASN H H 240 8.354 8.446 -0.092 2
1 819 . 1 1 A 231 231 ASN C C 240 176.347 176.208 0.139 2
1 820 . 1 1 A 231 231 ASN CA C 240 52.694 54.569 -1.875 2
1 821 . 1 1 A 231 231 ASN CB C 240 38.000 37.915 0.085 2
1 822 . 1 1 A 231 231 ASN N N 240 112.415 113.535 -1.120 2
1 823 . 1 1 A 232 232 TRP H H 241 7.949 7.483 0.466 2
1 824 . 1 1 A 232 232 TRP C C 241 176.238 176.402 -0.164 2
1 825 . 1 1 A 232 232 TRP CA C 241 56.553 58.215 -1.662 2
1 826 . 1 1 A 232 232 TRP CB C 241 29.576 30.277 -0.701 2
1 827 . 1 1 A 232 232 TRP N N 241 123.927 121.137 2.790 2
1 828 . 1 1 A 233 233 THR H H 242 8.340 8.683 -0.343 2
1 829 . 1 1 A 233 233 THR C C 242 175.757 175.981 -0.224 2
1 830 . 1 1 A 233 233 THR CA C 242 59.957 60.650 -0.693 2
1 831 . 1 1 A 233 233 THR CB C 242 72.159 70.946 1.213 2
1 832 . 1 1 A 233 233 THR N N 242 110.110 116.179 -6.069 2
1 833 . 1 1 A 234 234 ASN H H 243 9.138 9.166 -0.028 2
1 834 . 1 1 A 234 234 ASN C C 243 177.644 177.760 -0.116 2
1 835 . 1 1 A 234 234 ASN CA C 243 56.455 56.131 0.324 2
1 836 . 1 1 A 234 234 ASN CB C 243 35.289 37.322 -2.033 2
1 837 . 1 1 A 234 234 ASN N N 243 119.515 119.734 -0.219 2
1 838 . 1 1 A 235 235 THR H H 244 7.785 8.130 -0.345 2
1 839 . 1 1 A 235 235 THR C C 244 176.708 176.784 -0.076 2
1 840 . 1 1 A 235 235 THR CA C 244 65.707 65.841 -0.134 2
1 841 . 1 1 A 235 235 THR CB C 244 68.365 68.461 -0.096 2
1 842 . 1 1 A 235 235 THR N N 244 117.004 112.127 4.877 2
1 843 . 1 1 A 236 236 GLN H H 245 7.488 7.900 -0.412 2
1 844 . 1 1 A 236 236 GLN C C 245 178.779 178.795 -0.016 2
1 845 . 1 1 A 236 236 GLN CA C 245 59.025 58.488 0.537 2
1 846 . 1 1 A 236 236 GLN CB C 245 28.871 28.071 0.800 2
1 847 . 1 1 A 236 236 GLN N N 245 123.702 121.686 2.016 2
1 848 . 1 1 A 237 237 VAL H H 246 8.561 8.116 0.445 2
1 849 . 1 1 A 237 237 VAL C C 246 174.973 177.896 -2.923 2
1 850 . 1 1 A 237 237 VAL CA C 246 67.557 66.945 0.612 2
1 851 . 1 1 A 237 237 VAL CB C 246 31.689 31.719 -0.030 2
1 852 . 1 1 A 237 237 VAL N N 246 120.793 120.553 0.240 2
1 853 . 1 1 A 238 238 ARG H H 247 8.422 8.250 0.172 2
1 854 . 1 1 A 238 238 ARG C C 247 177.393 178.753 -1.360 2
1 855 . 1 1 A 238 238 ARG CA C 247 61.003 59.780 1.223 2
1 856 . 1 1 A 238 238 ARG CB C 247 29.487 29.934 -0.447 2
1 857 . 1 1 A 238 238 ARG N N 247 118.337 120.736 -2.399 2
1 858 . 1 1 A 239 239 SER H H 248 8.292 8.166 0.126 2
1 859 . 1 1 A 239 239 SER C C 248 176.468 176.228 0.240 2
1 860 . 1 1 A 239 239 SER CA C 248 61.834 61.906 -0.072 2
1 861 . 1 1 A 239 239 SER CB C 248 62.753 62.707 0.046 2
1 862 . 1 1 A 239 239 SER N N 248 112.939 116.915 -3.976 2
1 863 . 1 1 A 240 240 SER H H 249 8.048 8.075 -0.027 2
1 864 . 1 1 A 240 240 SER C C 249 177.427 177.082 0.345 2
1 865 . 1 1 A 240 240 SER CA C 249 62.801 61.916 0.885 2
1 866 . 1 1 A 240 240 SER CB C 249 63.181 63.147 0.034 2
1 867 . 1 1 A 240 240 SER N N 249 116.435 116.698 -0.263 2
1 868 . 1 1 A 241 241 LEU H H 250 7.806 8.349 -0.543 2
1 869 . 1 1 A 241 241 LEU C C 250 179.075 178.746 0.329 2
1 870 . 1 1 A 241 241 LEU CA C 250 57.562 58.141 -0.579 2
1 871 . 1 1 A 241 241 LEU CB C 250 43.178 41.571 1.607 2
1 872 . 1 1 A 241 241 LEU N N 250 120.876 122.317 -1.441 2
1 873 . 1 1 A 242 242 GLU H H 251 8.217 8.216 0.001 2
1 874 . 1 1 A 242 242 GLU C C 251 177.482 178.517 -1.035 2
1 875 . 1 1 A 242 242 GLU CA C 251 59.940 59.772 0.168 2
1 876 . 1 1 A 242 242 GLU CB C 251 30.214 29.386 0.828 2
1 877 . 1 1 A 242 242 GLU N N 251 115.363 117.243 -1.880 2
1 878 . 1 1 A 243 243 ASN H H 252 8.249 8.083 0.166 2
1 879 . 1 1 A 243 243 ASN C C 252 176.725 176.466 0.259 2
1 880 . 1 1 A 243 243 ASN CA C 252 54.313 55.049 -0.736 2
1 881 . 1 1 A 243 243 ASN CB C 252 39.145 38.855 0.290 2
1 882 . 1 1 A 243 243 ASN N N 252 112.581 115.631 -3.050 2
1 883 . 1 1 A 244 244 THR H H 253 7.064 7.433 -0.369 2
1 884 . 1 1 A 244 244 THR C C 253 173.805 174.449 -0.644 2
1 885 . 1 1 A 244 244 THR CA C 253 61.253 61.047 0.206 2
1 886 . 1 1 A 244 244 THR CB C 253 69.064 69.347 -0.283 2
1 887 . 1 1 A 244 244 THR N N 253 106.778 106.064 0.714 2
1 888 . 1 1 A 245 245 THR H H 254 6.752 7.697 -0.945 2
1 889 . 1 1 A 245 245 THR C C 254 176.520 174.296 2.224 2
1 890 . 1 1 A 245 245 THR CA C 254 61.095 61.775 -0.680 2
1 891 . 1 1 A 245 245 THR CB C 254 70.211 70.078 0.133 2
1 892 . 1 1 A 245 245 THR N N 254 110.013 116.713 -6.700 2
1 893 . 1 1 A 246 246 THR H H 255 9.002 8.601 0.401 2
1 894 . 1 1 A 246 246 THR C C 255 174.046 174.306 -0.260 2
1 895 . 1 1 A 246 246 THR CA C 255 62.125 62.290 -0.165 2
1 896 . 1 1 A 246 246 THR CB C 255 70.080 69.466 0.614 2
1 897 . 1 1 A 246 246 THR N N 255 118.283 118.683 -0.400 2
1 898 . 1 1 A 247 247 LYS H H 256 8.653 8.587 0.066 2
1 899 . 1 1 A 247 247 LYS C C 256 176.495 176.038 0.457 2
1 900 . 1 1 A 247 247 LYS CA C 256 58.196 56.829 1.367 2
1 901 . 1 1 A 247 247 LYS CB C 256 32.051 32.328 -0.277 2
1 902 . 1 1 A 247 247 LYS N N 256 130.585 127.278 3.307 2
1 903 . 1 1 A 248 248 LEU H H 257 7.590 8.584 -0.994 2
1 904 . 1 1 A 248 248 LEU C C 257 175.427 176.274 -0.847 2
1 905 . 1 1 A 248 248 LEU CA C 257 53.573 53.777 -0.204 2
1 906 . 1 1 A 248 248 LEU CB C 257 44.044 42.512 1.532 2
1 907 . 1 1 A 248 248 LEU N N 257 123.580 126.334 -2.754 2
1 908 . 1 1 A 249 249 GLY H H 258 6.038 8.413 -2.375 2
1 909 . 1 1 A 249 249 GLY CA C 258 44.505 44.418 0.087 2
1 910 . 1 1 A 249 249 GLY N N 258 104.458 110.273 -5.815 2
1 911 . 1 1 A 252 252 PHE C C 261 173.011 176.387 -3.376 2
1 912 . 1 1 A 252 252 PHE CA C 261 61.956 61.287 0.669 2
1 913 . 1 1 A 252 252 PHE CB C 261 39.806 38.809 0.997 2
1 914 . 1 1 A 253 253 TYR H H 262 7.090 7.799 -0.709 2
1 915 . 1 1 A 253 253 TYR C C 262 175.949 176.884 -0.935 2
1 916 . 1 1 A 253 253 TYR CA C 262 58.704 59.787 -1.083 2
1 917 . 1 1 A 253 253 TYR CB C 262 41.525 39.828 1.697 2
1 918 . 1 1 A 253 253 TYR N N 262 108.894 114.703 -5.809 2
1 919 . 1 1 A 254 254 TYR H H 263 7.877 7.745 0.132 2
1 920 . 1 1 A 254 254 TYR C C 263 175.348 176.325 -0.977 2
1 921 . 1 1 A 254 254 TYR CA C 263 58.396 58.343 0.053 2
1 922 . 1 1 A 254 254 TYR CB C 263 41.999 40.200 1.799 2
1 923 . 1 1 A 254 254 TYR N N 263 113.679 114.607 -0.928 2
1 924 . 1 1 A 255 255 GLY H H 264 8.259 8.165 0.094 2
1 925 . 1 1 A 255 255 GLY C C 264 175.387 175.625 -0.238 2
1 926 . 1 1 A 255 255 GLY CA C 264 46.461 46.963 -0.502 2
1 927 . 1 1 A 255 255 GLY N N 264 110.025 108.865 1.160 2
1 928 . 1 1 A 256 256 LYS H H 265 8.944 8.579 0.365 2
1 929 . 1 1 A 256 256 LYS C C 265 177.327 176.766 0.561 2
1 930 . 1 1 A 256 256 LYS CA C 265 57.358 56.712 0.646 2
1 931 . 1 1 A 256 256 LYS CB C 265 32.368 32.928 -0.560 2
1 932 . 1 1 A 256 256 LYS N N 265 123.502 126.117 -2.615 2
1 933 . 1 1 A 257 257 GLY H H 266 8.244 7.581 0.663 2
1 934 . 1 1 A 257 257 GLY C C 266 172.120 172.558 -0.438 2
1 935 . 1 1 A 257 257 GLY CA C 266 43.700 43.889 -0.189 2
1 936 . 1 1 A 257 257 GLY N N 266 107.567 106.407 1.160 2
1 937 . 1 1 A 258 258 LEU H H 267 8.249 8.268 -0.019 2
1 938 . 1 1 A 258 258 LEU C C 267 176.837 176.253 0.584 2
1 939 . 1 1 A 258 258 LEU CA C 267 54.098 54.419 -0.321 2
1 940 . 1 1 A 258 258 LEU CB C 267 45.318 43.957 1.361 2
1 941 . 1 1 A 258 258 LEU N N 267 121.495 121.843 -0.348 2
1 942 . 1 1 A 259 259 ILE H H 268 7.096 8.405 -1.309 2
1 943 . 1 1 A 259 259 ILE C C 268 173.752 175.460 -1.708 2
1 944 . 1 1 A 259 259 ILE CA C 268 62.748 61.125 1.623 2
1 945 . 1 1 A 259 259 ILE CB C 268 39.704 38.867 0.837 2
1 946 . 1 1 A 259 259 ILE N N 268 117.229 120.457 -3.228 2
1 947 . 1 1 A 260 260 ASN H H 269 9.260 8.484 0.776 2
1 948 . 1 1 A 260 260 ASN C C 269 175.696 175.336 0.360 2
1 949 . 1 1 A 260 260 ASN CA C 269 51.399 51.956 -0.557 2
1 950 . 1 1 A 260 260 ASN CB C 269 39.410 39.053 0.357 2
1 951 . 1 1 A 260 260 ASN N N 269 120.141 124.096 -3.955 2
1 952 . 1 1 A 261 261 VAL H H 270 8.795 8.437 0.358 2
1 953 . 1 1 A 261 261 VAL C C 270 175.284 176.916 -1.632 2
1 954 . 1 1 A 261 261 VAL CA C 270 65.165 64.864 0.301 2
1 955 . 1 1 A 261 261 VAL CB C 270 32.413 31.831 0.582 2
1 956 . 1 1 A 261 261 VAL N N 270 120.394 125.383 -4.989 2
1 957 . 1 1 A 262 262 GLU H H 271 7.246 8.099 -0.853 2
1 958 . 1 1 A 262 262 GLU C C 271 178.586 178.572 0.014 2
1 959 . 1 1 A 262 262 GLU CA C 271 59.864 59.304 0.560 2
1 960 . 1 1 A 262 262 GLU CB C 271 29.297 29.527 -0.230 2
1 961 . 1 1 A 262 262 GLU N N 271 121.072 120.993 0.079 2
1 962 . 1 1 A 263 263 ALA H H 272 7.254 8.120 -0.866 2
1 963 . 1 1 A 263 263 ALA C C 272 180.636 179.751 0.885 2
1 964 . 1 1 A 263 263 ALA CA C 272 53.884 54.939 -1.055 2
1 965 . 1 1 A 263 263 ALA CB C 272 18.931 18.270 0.661 2
1 966 . 1 1 A 263 263 ALA N N 272 120.861 120.937 -0.076 2
1 967 . 1 1 A 264 264 ALA H H 273 8.250 8.201 0.049 2
1 968 . 1 1 A 264 264 ALA C C 273 178.734 179.940 -1.206 2
1 969 . 1 1 A 264 264 ALA CA C 273 54.740 55.014 -0.274 2
1 970 . 1 1 A 264 264 ALA CB C 273 19.549 18.438 1.111 2
1 971 . 1 1 A 264 264 ALA N N 273 120.399 120.493 -0.094 2
1 972 . 1 1 A 265 265 ALA H H 274 7.740 7.688 0.052 2
1 973 . 1 1 A 265 265 ALA C C 274 177.067 176.897 0.170 2
1 974 . 1 1 A 265 265 ALA CA C 274 52.104 52.322 -0.218 2
1 975 . 1 1 A 265 265 ALA CB C 274 19.982 19.347 0.635 2
1 976 . 1 1 A 265 265 ALA N N 274 114.673 119.091 -4.418 2
stop_
save_