data_17908 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17908 _Entry.PDB_ID 2LIX save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 17908 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.719 0.005 17908 2 1 1 . 1 1 2 2 CYS H H 2 7.866 7.866 8.194 -0.328 17908 3 1 1 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.075 -0.062 17908 4 1 1 . 1 1 3 3 VAL H H 3 9.431 9.431 9.464 -0.033 17908 5 1 1 . 1 1 4 4 THR HA H 4 4.623 4.623 4.526 0.097 17908 6 1 1 . 1 1 4 4 THR H H 4 7.982 7.982 7.689 0.293 17908 7 1 1 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.449 -0.267 17908 8 1 1 . 1 1 5 5 HIS H H 5 8.195 8.195 8.535 -0.340 17908 9 1 1 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.836 0.167 17908 10 1 1 . 1 1 6 6 GLU H H 6 8.521 8.521 7.883 0.638 17908 11 1 1 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.437 0.013 17908 12 1 1 . 1 1 7 7 ASP H H 7 7.563 7.563 8.500 -0.937 17908 13 1 1 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.830 -0.024 17908 14 1 1 . 1 1 8 8 CYS H H 8 7.880 7.880 7.717 0.163 17908 15 1 1 . 1 1 9 9 THR HA H 9 3.881 3.881 3.938 -0.057 17908 16 1 1 . 1 1 9 9 THR H H 9 7.657 7.657 7.921 -0.264 17908 17 1 1 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.177 0.008 17908 18 1 1 . 1 1 10 10 LEU H H 10 7.974 7.974 7.913 0.061 17908 19 1 1 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.268 -0.087 17908 20 1 1 . 1 1 11 11 LEU H H 11 7.435 7.435 7.322 0.113 17908 21 1 1 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.214 0.065 17908 22 1 1 . 1 1 12 12 CYS H H 12 7.868 7.868 8.608 -0.740 17908 23 1 1 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.529 -0.161 17908 24 1 1 . 1 1 13 13 TYR H H 13 8.567 8.567 7.797 0.770 17908 25 1 1 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.442 0.382 17908 26 1 1 . 1 1 14 14 ASP H H 14 7.421 7.421 8.184 -0.763 17908 27 1 1 . 1 1 15 15 THR HA H 15 4.461 4.461 4.387 0.074 17908 28 1 1 . 1 1 15 15 THR H H 15 8.561 8.561 8.533 0.028 17908 29 1 1 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.640 0.535 17908 30 1 1 . 1 1 16 16 ILE H H 16 8.442 8.442 9.128 -0.686 17908 31 1 1 . 1 1 18 18 THR HA H 18 4.460 4.460 4.613 -0.153 17908 32 1 1 . 1 1 18 18 THR H H 18 7.432 7.432 7.871 -0.439 17908 33 1 1 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.531 0.306 17908 34 1 1 . 1 1 19 19 CYS H H 19 8.590 8.590 7.973 0.617 17908 35 1 1 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.429 -0.274 17908 36 1 1 . 1 1 20 20 VAL H H 20 8.966 8.966 8.525 0.441 17908 37 1 1 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.390 -0.193 17908 38 1 1 . 1 1 21 21 ASP H H 21 9.233 9.233 9.130 0.103 17908 39 1 1 . 1 1 22 22 GLY H H 22 7.878 7.878 8.297 -0.419 17908 40 1 1 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.634 0.202 17908 41 1 1 . 1 1 23 23 LYS H H 23 7.758 7.758 8.102 -0.344 17908 42 1 1 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.547 0.493 17908 43 1 1 . 1 1 24 24 CYS H H 24 8.644 8.644 8.730 -0.086 17908 44 1 1 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.515 -0.004 17908 45 1 1 . 1 1 25 25 LYS H H 25 9.542 9.542 8.948 0.594 17908 46 1 1 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.639 0.523 17908 47 1 1 . 1 1 26 26 CYS H H 26 8.747 8.747 8.706 0.041 17908 48 1 2 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.690 0.034 17908 49 1 2 . 1 1 2 2 CYS H H 2 7.866 7.866 8.207 -0.341 17908 50 1 2 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.003 0.010 17908 51 1 2 . 1 1 3 3 VAL H H 3 9.431 9.431 8.899 0.532 17908 52 1 2 . 1 1 4 4 THR HA H 4 4.623 4.623 4.492 0.131 17908 53 1 2 . 1 1 4 4 THR H H 4 7.982 7.982 7.456 0.526 17908 54 1 2 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.220 -0.038 17908 55 1 2 . 1 1 5 5 HIS H H 5 8.195 8.195 8.342 -0.147 17908 56 1 2 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.973 0.030 17908 57 1 2 . 1 1 6 6 GLU H H 6 8.521 8.521 8.097 0.424 17908 58 1 2 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.438 0.012 17908 59 1 2 . 1 1 7 7 ASP H H 7 7.563 7.563 7.767 -0.204 17908 60 1 2 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.828 -0.022 17908 61 1 2 . 1 1 8 8 CYS H H 8 7.880 7.880 7.901 -0.021 17908 62 1 2 . 1 1 9 9 THR HA H 9 3.881 3.881 3.954 -0.073 17908 63 1 2 . 1 1 9 9 THR H H 9 7.657 7.657 7.944 -0.287 17908 64 1 2 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.367 -0.182 17908 65 1 2 . 1 1 10 10 LEU H H 10 7.974 7.974 7.647 0.327 17908 66 1 2 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.337 -0.156 17908 67 1 2 . 1 1 11 11 LEU H H 11 7.435 7.435 7.849 -0.414 17908 68 1 2 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.278 0.001 17908 69 1 2 . 1 1 12 12 CYS H H 12 7.868 7.868 8.790 -0.922 17908 70 1 2 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.487 -0.119 17908 71 1 2 . 1 1 13 13 TYR H H 13 8.567 8.567 7.657 0.910 17908 72 1 2 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.483 0.341 17908 73 1 2 . 1 1 14 14 ASP H H 14 7.421 7.421 7.907 -0.486 17908 74 1 2 . 1 1 15 15 THR HA H 15 4.461 4.461 4.319 0.141 17908 75 1 2 . 1 1 15 15 THR H H 15 8.561 8.561 8.260 0.301 17908 76 1 2 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.972 0.203 17908 77 1 2 . 1 1 16 16 ILE H H 16 8.442 8.442 8.271 0.171 17908 78 1 2 . 1 1 18 18 THR HA H 18 4.460 4.460 4.579 -0.119 17908 79 1 2 . 1 1 18 18 THR H H 18 7.432 7.432 7.728 -0.296 17908 80 1 2 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.534 0.303 17908 81 1 2 . 1 1 19 19 CYS H H 19 8.590 8.590 7.846 0.744 17908 82 1 2 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.503 -0.348 17908 83 1 2 . 1 1 20 20 VAL H H 20 8.966 8.966 8.566 0.400 17908 84 1 2 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.402 -0.205 17908 85 1 2 . 1 1 21 21 ASP H H 21 9.233 9.233 9.060 0.173 17908 86 1 2 . 1 1 22 22 GLY H H 22 7.878 7.878 8.294 -0.416 17908 87 1 2 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.592 0.244 17908 88 1 2 . 1 1 23 23 LYS H H 23 7.758 7.758 7.986 -0.228 17908 89 1 2 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.474 0.566 17908 90 1 2 . 1 1 24 24 CYS H H 24 8.644 8.644 8.753 -0.109 17908 91 1 2 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.644 -0.133 17908 92 1 2 . 1 1 25 25 LYS H H 25 9.542 9.542 8.190 1.352 17908 93 1 2 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.772 0.390 17908 94 1 2 . 1 1 26 26 CYS H H 26 8.747 8.747 8.701 0.046 17908 95 1 3 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.727 -0.003 17908 96 1 3 . 1 1 2 2 CYS H H 2 7.866 7.866 8.155 -0.289 17908 97 1 3 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.963 0.050 17908 98 1 3 . 1 1 3 3 VAL H H 3 9.431 9.431 9.379 0.052 17908 99 1 3 . 1 1 4 4 THR HA H 4 4.623 4.623 4.506 0.117 17908 100 1 3 . 1 1 4 4 THR H H 4 7.982 7.982 7.294 0.688 17908 101 1 3 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.328 -0.146 17908 102 1 3 . 1 1 5 5 HIS H H 5 8.195 8.195 8.766 -0.571 17908 103 1 3 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.112 -0.109 17908 104 1 3 . 1 1 6 6 GLU H H 6 8.521 8.521 8.802 -0.281 17908 105 1 3 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.529 -0.079 17908 106 1 3 . 1 1 7 7 ASP H H 7 7.563 7.563 7.874 -0.311 17908 107 1 3 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.875 -0.069 17908 108 1 3 . 1 1 8 8 CYS H H 8 7.880 7.880 7.472 0.408 17908 109 1 3 . 1 1 9 9 THR HA H 9 3.881 3.881 3.981 -0.100 17908 110 1 3 . 1 1 9 9 THR H H 9 7.657 7.657 7.999 -0.342 17908 111 1 3 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.119 0.066 17908 112 1 3 . 1 1 10 10 LEU H H 10 7.974 7.974 7.744 0.230 17908 113 1 3 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.256 -0.075 17908 114 1 3 . 1 1 11 11 LEU H H 11 7.435 7.435 7.624 -0.189 17908 115 1 3 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.161 0.118 17908 116 1 3 . 1 1 12 12 CYS H H 12 7.868 7.868 8.670 -0.802 17908 117 1 3 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.528 -0.160 17908 118 1 3 . 1 1 13 13 TYR H H 13 8.567 8.567 7.683 0.884 17908 119 1 3 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.367 0.457 17908 120 1 3 . 1 1 14 14 ASP H H 14 7.421 7.421 8.230 -0.809 17908 121 1 3 . 1 1 15 15 THR HA H 15 4.461 4.461 4.357 0.104 17908 122 1 3 . 1 1 15 15 THR H H 15 8.561 8.561 8.285 0.276 17908 123 1 3 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.638 0.537 17908 124 1 3 . 1 1 16 16 ILE H H 16 8.442 8.442 8.918 -0.476 17908 125 1 3 . 1 1 18 18 THR HA H 18 4.460 4.460 4.363 0.097 17908 126 1 3 . 1 1 18 18 THR H H 18 7.432 7.432 7.556 -0.124 17908 127 1 3 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.536 0.301 17908 128 1 3 . 1 1 19 19 CYS H H 19 8.590 8.590 8.136 0.454 17908 129 1 3 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.436 -0.281 17908 130 1 3 . 1 1 20 20 VAL H H 20 8.966 8.966 8.490 0.476 17908 131 1 3 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.344 -0.147 17908 132 1 3 . 1 1 21 21 ASP H H 21 9.233 9.233 9.102 0.131 17908 133 1 3 . 1 1 22 22 GLY H H 22 7.878 7.878 8.512 -0.634 17908 134 1 3 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.491 0.345 17908 135 1 3 . 1 1 23 23 LYS H H 23 7.758 7.758 8.071 -0.313 17908 136 1 3 . 1 1 24 24 CYS HA H 24 5.040 5.040 5.023 0.017 17908 137 1 3 . 1 1 24 24 CYS H H 24 8.644 8.644 8.657 -0.013 17908 138 1 3 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.545 -0.034 17908 139 1 3 . 1 1 25 25 LYS H H 25 9.542 9.542 8.536 1.006 17908 140 1 3 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.395 0.767 17908 141 1 3 . 1 1 26 26 CYS H H 26 8.747 8.747 8.785 -0.038 17908 142 1 4 . 1 1 2 2 CYS HA H 2 4.724 4.724 5.007 -0.283 17908 143 1 4 . 1 1 2 2 CYS H H 2 7.866 7.866 8.126 -0.260 17908 144 1 4 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.911 0.102 17908 145 1 4 . 1 1 3 3 VAL H H 3 9.431 9.431 9.392 0.039 17908 146 1 4 . 1 1 4 4 THR HA H 4 4.623 4.623 4.392 0.231 17908 147 1 4 . 1 1 4 4 THR H H 4 7.982 7.982 7.249 0.733 17908 148 1 4 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.289 -0.107 17908 149 1 4 . 1 1 5 5 HIS H H 5 8.195 8.195 8.651 -0.456 17908 150 1 4 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.986 0.017 17908 151 1 4 . 1 1 6 6 GLU H H 6 8.521 8.521 8.312 0.209 17908 152 1 4 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.522 -0.072 17908 153 1 4 . 1 1 7 7 ASP H H 7 7.563 7.563 8.094 -0.531 17908 154 1 4 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.797 0.009 17908 155 1 4 . 1 1 8 8 CYS H H 8 7.880 7.880 7.671 0.209 17908 156 1 4 . 1 1 9 9 THR HA H 9 3.881 3.881 3.850 0.031 17908 157 1 4 . 1 1 9 9 THR H H 9 7.657 7.657 7.892 -0.235 17908 158 1 4 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.192 -0.007 17908 159 1 4 . 1 1 10 10 LEU H H 10 7.974 7.974 7.720 0.254 17908 160 1 4 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.244 -0.063 17908 161 1 4 . 1 1 11 11 LEU H H 11 7.435 7.435 7.778 -0.343 17908 162 1 4 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.145 0.134 17908 163 1 4 . 1 1 12 12 CYS H H 12 7.868 7.868 8.738 -0.870 17908 164 1 4 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.637 -0.269 17908 165 1 4 . 1 1 13 13 TYR H H 13 8.567 8.567 7.751 0.816 17908 166 1 4 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.461 0.363 17908 167 1 4 . 1 1 14 14 ASP H H 14 7.421 7.421 8.142 -0.721 17908 168 1 4 . 1 1 15 15 THR HA H 15 4.461 4.461 4.461 0.000 17908 169 1 4 . 1 1 15 15 THR H H 15 8.561 8.561 8.311 0.250 17908 170 1 4 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.327 -0.152 17908 171 1 4 . 1 1 16 16 ILE H H 16 8.442 8.442 8.853 -0.411 17908 172 1 4 . 1 1 18 18 THR HA H 18 4.460 4.460 4.559 -0.099 17908 173 1 4 . 1 1 18 18 THR H H 18 7.432 7.432 7.798 -0.366 17908 174 1 4 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.616 0.221 17908 175 1 4 . 1 1 19 19 CYS H H 19 8.590 8.590 8.018 0.572 17908 176 1 4 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.461 -0.306 17908 177 1 4 . 1 1 20 20 VAL H H 20 8.966 8.966 8.280 0.686 17908 178 1 4 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.387 -0.190 17908 179 1 4 . 1 1 21 21 ASP H H 21 9.233 9.233 9.274 -0.041 17908 180 1 4 . 1 1 22 22 GLY H H 22 7.878 7.878 8.294 -0.416 17908 181 1 4 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.607 0.229 17908 182 1 4 . 1 1 23 23 LYS H H 23 7.758 7.758 8.017 -0.259 17908 183 1 4 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.524 0.516 17908 184 1 4 . 1 1 24 24 CYS H H 24 8.644 8.644 8.901 -0.257 17908 185 1 4 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.562 -0.051 17908 186 1 4 . 1 1 25 25 LYS H H 25 9.542 9.542 8.331 1.211 17908 187 1 4 . 1 1 26 26 CYS HA H 26 5.162 5.162 5.031 0.131 17908 188 1 4 . 1 1 26 26 CYS H H 26 8.747 8.747 8.543 0.204 17908 189 1 5 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.700 0.024 17908 190 1 5 . 1 1 2 2 CYS H H 2 7.866 7.866 8.176 -0.310 17908 191 1 5 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.022 -0.009 17908 192 1 5 . 1 1 3 3 VAL H H 3 9.431 9.431 9.354 0.077 17908 193 1 5 . 1 1 4 4 THR HA H 4 4.623 4.623 4.531 0.092 17908 194 1 5 . 1 1 4 4 THR H H 4 7.982 7.982 7.403 0.579 17908 195 1 5 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.292 -0.110 17908 196 1 5 . 1 1 5 5 HIS H H 5 8.195 8.195 8.594 -0.399 17908 197 1 5 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.964 0.039 17908 198 1 5 . 1 1 6 6 GLU H H 6 8.521 8.521 8.129 0.392 17908 199 1 5 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.447 0.003 17908 200 1 5 . 1 1 7 7 ASP H H 7 7.563 7.563 7.853 -0.290 17908 201 1 5 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.836 -0.030 17908 202 1 5 . 1 1 8 8 CYS H H 8 7.880 7.880 7.876 0.004 17908 203 1 5 . 1 1 9 9 THR HA H 9 3.881 3.881 3.988 -0.107 17908 204 1 5 . 1 1 9 9 THR H H 9 7.657 7.657 7.865 -0.208 17908 205 1 5 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.377 -0.192 17908 206 1 5 . 1 1 10 10 LEU H H 10 7.974 7.974 7.681 0.293 17908 207 1 5 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.345 -0.164 17908 208 1 5 . 1 1 11 11 LEU H H 11 7.435 7.435 7.678 -0.243 17908 209 1 5 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.353 -0.074 17908 210 1 5 . 1 1 12 12 CYS H H 12 7.868 7.868 8.574 -0.706 17908 211 1 5 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.491 -0.123 17908 212 1 5 . 1 1 13 13 TYR H H 13 8.567 8.567 7.813 0.754 17908 213 1 5 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.358 0.466 17908 214 1 5 . 1 1 14 14 ASP H H 14 7.421 7.421 8.095 -0.674 17908 215 1 5 . 1 1 15 15 THR HA H 15 4.461 4.461 4.655 -0.194 17908 216 1 5 . 1 1 15 15 THR H H 15 8.561 8.561 8.355 0.206 17908 217 1 5 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.644 0.531 17908 218 1 5 . 1 1 16 16 ILE H H 16 8.442 8.442 9.036 -0.594 17908 219 1 5 . 1 1 18 18 THR HA H 18 4.460 4.460 4.584 -0.124 17908 220 1 5 . 1 1 18 18 THR H H 18 7.432 7.432 8.068 -0.636 17908 221 1 5 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.560 0.277 17908 222 1 5 . 1 1 19 19 CYS H H 19 8.590 8.590 8.063 0.527 17908 223 1 5 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.562 -0.407 17908 224 1 5 . 1 1 20 20 VAL H H 20 8.966 8.966 8.469 0.497 17908 225 1 5 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.395 -0.198 17908 226 1 5 . 1 1 21 21 ASP H H 21 9.233 9.233 9.093 0.140 17908 227 1 5 . 1 1 22 22 GLY H H 22 7.878 7.878 8.284 -0.406 17908 228 1 5 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.588 0.248 17908 229 1 5 . 1 1 23 23 LYS H H 23 7.758 7.758 8.199 -0.441 17908 230 1 5 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.530 0.510 17908 231 1 5 . 1 1 24 24 CYS H H 24 8.644 8.644 8.559 0.085 17908 232 1 5 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.511 -0.000 17908 233 1 5 . 1 1 25 25 LYS H H 25 9.542 9.542 8.437 1.105 17908 234 1 5 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.632 0.530 17908 235 1 5 . 1 1 26 26 CYS H H 26 8.747 8.747 8.793 -0.046 17908 236 1 6 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.692 0.032 17908 237 1 6 . 1 1 2 2 CYS H H 2 7.866 7.866 8.096 -0.230 17908 238 1 6 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.361 -0.348 17908 239 1 6 . 1 1 3 3 VAL H H 3 9.431 9.431 8.911 0.520 17908 240 1 6 . 1 1 4 4 THR HA H 4 4.623 4.623 4.545 0.078 17908 241 1 6 . 1 1 4 4 THR H H 4 7.982 7.982 9.049 -1.067 17908 242 1 6 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.821 -0.639 17908 243 1 6 . 1 1 5 5 HIS H H 5 8.195 8.195 7.603 0.592 17908 244 1 6 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.023 -0.020 17908 245 1 6 . 1 1 6 6 GLU H H 6 8.521 8.521 8.276 0.245 17908 246 1 6 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.467 -0.017 17908 247 1 6 . 1 1 7 7 ASP H H 7 7.563 7.563 8.483 -0.920 17908 248 1 6 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.822 -0.016 17908 249 1 6 . 1 1 8 8 CYS H H 8 7.880 7.880 7.990 -0.110 17908 250 1 6 . 1 1 9 9 THR HA H 9 3.881 3.881 3.982 -0.102 17908 251 1 6 . 1 1 9 9 THR H H 9 7.657 7.657 7.949 -0.292 17908 252 1 6 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.338 -0.153 17908 253 1 6 . 1 1 10 10 LEU H H 10 7.974 7.974 7.647 0.327 17908 254 1 6 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.341 -0.160 17908 255 1 6 . 1 1 11 11 LEU H H 11 7.435 7.435 7.470 -0.035 17908 256 1 6 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.209 0.070 17908 257 1 6 . 1 1 12 12 CYS H H 12 7.868 7.868 8.676 -0.808 17908 258 1 6 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.517 -0.149 17908 259 1 6 . 1 1 13 13 TYR H H 13 8.567 8.567 7.758 0.809 17908 260 1 6 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.428 0.396 17908 261 1 6 . 1 1 14 14 ASP H H 14 7.421 7.421 8.310 -0.889 17908 262 1 6 . 1 1 15 15 THR HA H 15 4.461 4.461 4.671 -0.210 17908 263 1 6 . 1 1 15 15 THR H H 15 8.561 8.561 8.344 0.217 17908 264 1 6 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.630 0.545 17908 265 1 6 . 1 1 16 16 ILE H H 16 8.442 8.442 9.129 -0.687 17908 266 1 6 . 1 1 18 18 THR HA H 18 4.460 4.460 4.827 -0.367 17908 267 1 6 . 1 1 18 18 THR H H 18 7.432 7.432 7.845 -0.413 17908 268 1 6 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.564 0.273 17908 269 1 6 . 1 1 19 19 CYS H H 19 8.590 8.590 7.944 0.646 17908 270 1 6 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.445 -0.290 17908 271 1 6 . 1 1 20 20 VAL H H 20 8.966 8.966 8.464 0.502 17908 272 1 6 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.400 -0.203 17908 273 1 6 . 1 1 21 21 ASP H H 21 9.233 9.233 9.024 0.209 17908 274 1 6 . 1 1 22 22 GLY H H 22 7.878 7.878 8.377 -0.499 17908 275 1 6 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.556 0.280 17908 276 1 6 . 1 1 23 23 LYS H H 23 7.758 7.758 8.107 -0.349 17908 277 1 6 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.543 0.497 17908 278 1 6 . 1 1 24 24 CYS H H 24 8.644 8.644 8.587 0.057 17908 279 1 6 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.509 0.002 17908 280 1 6 . 1 1 25 25 LYS H H 25 9.542 9.542 8.484 1.058 17908 281 1 6 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.587 0.575 17908 282 1 6 . 1 1 26 26 CYS H H 26 8.747 8.747 8.826 -0.079 17908 283 1 7 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.693 0.031 17908 284 1 7 . 1 1 2 2 CYS H H 2 7.866 7.866 7.924 -0.058 17908 285 1 7 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.875 0.138 17908 286 1 7 . 1 1 3 3 VAL H H 3 9.431 9.431 9.313 0.118 17908 287 1 7 . 1 1 4 4 THR HA H 4 4.623 4.623 4.373 0.250 17908 288 1 7 . 1 1 4 4 THR H H 4 7.982 7.982 7.304 0.678 17908 289 1 7 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.378 -0.196 17908 290 1 7 . 1 1 5 5 HIS H H 5 8.195 8.195 8.734 -0.539 17908 291 1 7 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.990 0.013 17908 292 1 7 . 1 1 6 6 GLU H H 6 8.521 8.521 9.011 -0.490 17908 293 1 7 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.527 -0.077 17908 294 1 7 . 1 1 7 7 ASP H H 7 7.563 7.563 7.806 -0.243 17908 295 1 7 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.863 -0.057 17908 296 1 7 . 1 1 8 8 CYS H H 8 7.880 7.880 7.742 0.138 17908 297 1 7 . 1 1 9 9 THR HA H 9 3.881 3.881 3.970 -0.089 17908 298 1 7 . 1 1 9 9 THR H H 9 7.657 7.657 7.944 -0.287 17908 299 1 7 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.270 -0.085 17908 300 1 7 . 1 1 10 10 LEU H H 10 7.974 7.974 7.627 0.347 17908 301 1 7 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.245 -0.064 17908 302 1 7 . 1 1 11 11 LEU H H 11 7.435 7.435 7.750 -0.315 17908 303 1 7 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.157 0.122 17908 304 1 7 . 1 1 12 12 CYS H H 12 7.868 7.868 8.710 -0.842 17908 305 1 7 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.547 -0.179 17908 306 1 7 . 1 1 13 13 TYR H H 13 8.567 8.567 7.760 0.807 17908 307 1 7 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.440 0.384 17908 308 1 7 . 1 1 14 14 ASP H H 14 7.421 7.421 7.970 -0.549 17908 309 1 7 . 1 1 15 15 THR HA H 15 4.461 4.461 4.173 0.288 17908 310 1 7 . 1 1 15 15 THR H H 15 8.561 8.561 8.515 0.046 17908 311 1 7 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.223 -0.048 17908 312 1 7 . 1 1 16 16 ILE H H 16 8.442 8.442 7.943 0.499 17908 313 1 7 . 1 1 18 18 THR HA H 18 4.460 4.460 4.076 0.384 17908 314 1 7 . 1 1 18 18 THR H H 18 7.432 7.432 8.016 -0.584 17908 315 1 7 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.627 0.210 17908 316 1 7 . 1 1 19 19 CYS H H 19 8.590 8.590 7.604 0.986 17908 317 1 7 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.473 -0.318 17908 318 1 7 . 1 1 20 20 VAL H H 20 8.966 8.966 8.574 0.392 17908 319 1 7 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.386 -0.189 17908 320 1 7 . 1 1 21 21 ASP H H 21 9.233 9.233 9.098 0.135 17908 321 1 7 . 1 1 22 22 GLY H H 22 7.878 7.878 8.329 -0.451 17908 322 1 7 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.619 0.217 17908 323 1 7 . 1 1 23 23 LYS H H 23 7.758 7.758 8.165 -0.407 17908 324 1 7 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.443 0.597 17908 325 1 7 . 1 1 24 24 CYS H H 24 8.644 8.644 8.676 -0.032 17908 326 1 7 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.519 -0.008 17908 327 1 7 . 1 1 25 25 LYS H H 25 9.542 9.542 8.332 1.210 17908 328 1 7 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.831 0.331 17908 329 1 7 . 1 1 26 26 CYS H H 26 8.747 8.747 8.753 -0.006 17908 330 1 8 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.731 -0.007 17908 331 1 8 . 1 1 2 2 CYS H H 2 7.866 7.866 8.175 -0.309 17908 332 1 8 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.084 -0.071 17908 333 1 8 . 1 1 3 3 VAL H H 3 9.431 9.431 9.466 -0.035 17908 334 1 8 . 1 1 4 4 THR HA H 4 4.623 4.623 4.484 0.139 17908 335 1 8 . 1 1 4 4 THR H H 4 7.982 7.982 7.620 0.362 17908 336 1 8 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.531 -0.349 17908 337 1 8 . 1 1 5 5 HIS H H 5 8.195 8.195 8.554 -0.359 17908 338 1 8 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.083 -0.080 17908 339 1 8 . 1 1 6 6 GLU H H 6 8.521 8.521 8.267 0.254 17908 340 1 8 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.448 0.002 17908 341 1 8 . 1 1 7 7 ASP H H 7 7.563 7.563 8.685 -1.122 17908 342 1 8 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.821 -0.015 17908 343 1 8 . 1 1 8 8 CYS H H 8 7.880 7.880 7.449 0.431 17908 344 1 8 . 1 1 9 9 THR HA H 9 3.881 3.881 3.954 -0.073 17908 345 1 8 . 1 1 9 9 THR H H 9 7.657 7.657 7.856 -0.199 17908 346 1 8 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.235 -0.050 17908 347 1 8 . 1 1 10 10 LEU H H 10 7.974 7.974 7.897 0.077 17908 348 1 8 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.255 -0.074 17908 349 1 8 . 1 1 11 11 LEU H H 11 7.435 7.435 7.624 -0.189 17908 350 1 8 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.203 0.076 17908 351 1 8 . 1 1 12 12 CYS H H 12 7.868 7.868 8.879 -1.011 17908 352 1 8 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.525 -0.157 17908 353 1 8 . 1 1 13 13 TYR H H 13 8.567 8.567 7.692 0.875 17908 354 1 8 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.451 0.373 17908 355 1 8 . 1 1 14 14 ASP H H 14 7.421 7.421 8.312 -0.891 17908 356 1 8 . 1 1 15 15 THR HA H 15 4.461 4.461 4.532 -0.071 17908 357 1 8 . 1 1 15 15 THR H H 15 8.561 8.561 8.506 0.055 17908 358 1 8 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.544 0.631 17908 359 1 8 . 1 1 16 16 ILE H H 16 8.442 8.442 8.992 -0.550 17908 360 1 8 . 1 1 18 18 THR HA H 18 4.460 4.460 4.609 -0.148 17908 361 1 8 . 1 1 18 18 THR H H 18 7.432 7.432 7.747 -0.315 17908 362 1 8 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.698 0.139 17908 363 1 8 . 1 1 19 19 CYS H H 19 8.590 8.590 8.132 0.458 17908 364 1 8 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.549 -0.394 17908 365 1 8 . 1 1 20 20 VAL H H 20 8.966 8.966 8.504 0.462 17908 366 1 8 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.387 -0.190 17908 367 1 8 . 1 1 21 21 ASP H H 21 9.233 9.233 9.041 0.192 17908 368 1 8 . 1 1 22 22 GLY H H 22 7.878 7.878 8.279 -0.401 17908 369 1 8 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.615 0.221 17908 370 1 8 . 1 1 23 23 LYS H H 23 7.758 7.758 8.147 -0.389 17908 371 1 8 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.763 0.277 17908 372 1 8 . 1 1 24 24 CYS H H 24 8.644 8.644 8.828 -0.184 17908 373 1 8 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.531 -0.020 17908 374 1 8 . 1 1 25 25 LYS H H 25 9.542 9.542 9.481 0.061 17908 375 1 8 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.751 0.411 17908 376 1 8 . 1 1 26 26 CYS H H 26 8.747 8.747 8.826 -0.079 17908 377 1 9 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.766 -0.042 17908 378 1 9 . 1 1 2 2 CYS H H 2 7.866 7.866 7.972 -0.106 17908 379 1 9 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.361 -0.348 17908 380 1 9 . 1 1 3 3 VAL H H 3 9.431 9.431 9.040 0.391 17908 381 1 9 . 1 1 4 4 THR HA H 4 4.623 4.623 4.582 0.041 17908 382 1 9 . 1 1 4 4 THR H H 4 7.982 7.982 8.943 -0.961 17908 383 1 9 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.820 -0.638 17908 384 1 9 . 1 1 5 5 HIS H H 5 8.195 8.195 7.642 0.553 17908 385 1 9 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.052 -0.049 17908 386 1 9 . 1 1 6 6 GLU H H 6 8.521 8.521 9.005 -0.484 17908 387 1 9 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.443 0.007 17908 388 1 9 . 1 1 7 7 ASP H H 7 7.563 7.563 8.719 -1.156 17908 389 1 9 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.809 -0.003 17908 390 1 9 . 1 1 8 8 CYS H H 8 7.880 7.880 7.883 -0.003 17908 391 1 9 . 1 1 9 9 THR HA H 9 3.881 3.881 4.043 -0.162 17908 392 1 9 . 1 1 9 9 THR H H 9 7.657 7.657 8.239 -0.582 17908 393 1 9 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.231 -0.046 17908 394 1 9 . 1 1 10 10 LEU H H 10 7.974 7.974 7.608 0.366 17908 395 1 9 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.414 -0.233 17908 396 1 9 . 1 1 11 11 LEU H H 11 7.435 7.435 7.679 -0.244 17908 397 1 9 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.078 0.201 17908 398 1 9 . 1 1 12 12 CYS H H 12 7.868 7.868 8.680 -0.812 17908 399 1 9 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.563 -0.195 17908 400 1 9 . 1 1 13 13 TYR H H 13 8.567 8.567 7.660 0.907 17908 401 1 9 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.322 0.502 17908 402 1 9 . 1 1 14 14 ASP H H 14 7.421 7.421 8.139 -0.718 17908 403 1 9 . 1 1 15 15 THR HA H 15 4.461 4.461 4.545 -0.084 17908 404 1 9 . 1 1 15 15 THR H H 15 8.561 8.561 8.278 0.283 17908 405 1 9 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.789 0.386 17908 406 1 9 . 1 1 16 16 ILE H H 16 8.442 8.442 8.721 -0.279 17908 407 1 9 . 1 1 18 18 THR HA H 18 4.460 4.460 4.446 0.014 17908 408 1 9 . 1 1 18 18 THR H H 18 7.432 7.432 8.074 -0.642 17908 409 1 9 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.878 -0.041 17908 410 1 9 . 1 1 19 19 CYS H H 19 8.590 8.590 7.515 1.075 17908 411 1 9 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.460 -0.305 17908 412 1 9 . 1 1 20 20 VAL H H 20 8.966 8.966 8.468 0.498 17908 413 1 9 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.479 -0.282 17908 414 1 9 . 1 1 21 21 ASP H H 21 9.233 9.233 8.652 0.581 17908 415 1 9 . 1 1 22 22 GLY H H 22 7.878 7.878 8.324 -0.446 17908 416 1 9 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.615 0.221 17908 417 1 9 . 1 1 23 23 LYS H H 23 7.758 7.758 7.408 0.350 17908 418 1 9 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.920 0.120 17908 419 1 9 . 1 1 24 24 CYS H H 24 8.644 8.644 8.623 0.021 17908 420 1 9 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.478 0.033 17908 421 1 9 . 1 1 25 25 LYS H H 25 9.542 9.542 8.192 1.350 17908 422 1 9 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.506 0.656 17908 423 1 9 . 1 1 26 26 CYS H H 26 8.747 8.747 8.475 0.272 17908 424 1 10 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.510 0.214 17908 425 1 10 . 1 1 2 2 CYS H H 2 7.866 7.866 8.330 -0.464 17908 426 1 10 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.945 0.068 17908 427 1 10 . 1 1 3 3 VAL H H 3 9.431 9.431 8.795 0.636 17908 428 1 10 . 1 1 4 4 THR HA H 4 4.623 4.623 4.582 0.041 17908 429 1 10 . 1 1 4 4 THR H H 4 7.982 7.982 7.598 0.384 17908 430 1 10 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.258 -0.076 17908 431 1 10 . 1 1 5 5 HIS H H 5 8.195 8.195 9.110 -0.915 17908 432 1 10 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.024 -0.021 17908 433 1 10 . 1 1 6 6 GLU H H 6 8.521 8.521 8.731 -0.210 17908 434 1 10 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.522 -0.072 17908 435 1 10 . 1 1 7 7 ASP H H 7 7.563 7.563 7.980 -0.417 17908 436 1 10 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.744 0.062 17908 437 1 10 . 1 1 8 8 CYS H H 8 7.880 7.880 7.673 0.207 17908 438 1 10 . 1 1 9 9 THR HA H 9 3.881 3.881 3.967 -0.086 17908 439 1 10 . 1 1 9 9 THR H H 9 7.657 7.657 7.961 -0.304 17908 440 1 10 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.189 -0.004 17908 441 1 10 . 1 1 10 10 LEU H H 10 7.974 7.974 7.853 0.121 17908 442 1 10 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.326 -0.145 17908 443 1 10 . 1 1 11 11 LEU H H 11 7.435 7.435 7.619 -0.184 17908 444 1 10 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.205 0.074 17908 445 1 10 . 1 1 12 12 CYS H H 12 7.868 7.868 8.724 -0.856 17908 446 1 10 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.538 -0.170 17908 447 1 10 . 1 1 13 13 TYR H H 13 8.567 8.567 7.990 0.577 17908 448 1 10 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.286 0.538 17908 449 1 10 . 1 1 14 14 ASP H H 14 7.421 7.421 8.404 -0.983 17908 450 1 10 . 1 1 15 15 THR HA H 15 4.461 4.461 4.440 0.021 17908 451 1 10 . 1 1 15 15 THR H H 15 8.561 8.561 8.310 0.251 17908 452 1 10 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.323 -0.148 17908 453 1 10 . 1 1 16 16 ILE H H 16 8.442 8.442 7.931 0.511 17908 454 1 10 . 1 1 18 18 THR HA H 18 4.460 4.460 3.719 0.741 17908 455 1 10 . 1 1 18 18 THR H H 18 7.432 7.432 8.108 -0.676 17908 456 1 10 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.601 0.236 17908 457 1 10 . 1 1 19 19 CYS H H 19 8.590 8.590 7.839 0.751 17908 458 1 10 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.418 -0.263 17908 459 1 10 . 1 1 20 20 VAL H H 20 8.966 8.966 8.223 0.743 17908 460 1 10 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.337 -0.140 17908 461 1 10 . 1 1 21 21 ASP H H 21 9.233 9.233 9.135 0.098 17908 462 1 10 . 1 1 22 22 GLY H H 22 7.878 7.878 8.616 -0.738 17908 463 1 10 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.685 0.151 17908 464 1 10 . 1 1 23 23 LYS H H 23 7.758 7.758 8.000 -0.242 17908 465 1 10 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.319 0.721 17908 466 1 10 . 1 1 24 24 CYS H H 24 8.644 8.644 8.761 -0.117 17908 467 1 10 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.503 0.008 17908 468 1 10 . 1 1 25 25 LYS H H 25 9.542 9.542 8.656 0.886 17908 469 1 10 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.445 0.717 17908 470 1 10 . 1 1 26 26 CYS H H 26 8.747 8.747 8.893 -0.146 17908 471 1 11 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.508 0.216 17908 472 1 11 . 1 1 2 2 CYS H H 2 7.866 7.866 8.335 -0.469 17908 473 1 11 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.952 0.061 17908 474 1 11 . 1 1 3 3 VAL H H 3 9.431 9.431 9.401 0.030 17908 475 1 11 . 1 1 4 4 THR HA H 4 4.623 4.623 4.377 0.246 17908 476 1 11 . 1 1 4 4 THR H H 4 7.982 7.982 7.421 0.561 17908 477 1 11 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.155 0.027 17908 478 1 11 . 1 1 5 5 HIS H H 5 8.195 8.195 8.501 -0.306 17908 479 1 11 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.998 0.005 17908 480 1 11 . 1 1 6 6 GLU H H 6 8.521 8.521 8.662 -0.141 17908 481 1 11 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.501 -0.051 17908 482 1 11 . 1 1 7 7 ASP H H 7 7.563 7.563 8.027 -0.464 17908 483 1 11 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.769 0.037 17908 484 1 11 . 1 1 8 8 CYS H H 8 7.880 7.880 7.638 0.242 17908 485 1 11 . 1 1 9 9 THR HA H 9 3.881 3.881 4.060 -0.179 17908 486 1 11 . 1 1 9 9 THR H H 9 7.657 7.657 7.863 -0.206 17908 487 1 11 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.227 -0.042 17908 488 1 11 . 1 1 10 10 LEU H H 10 7.974 7.974 7.914 0.060 17908 489 1 11 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.257 -0.076 17908 490 1 11 . 1 1 11 11 LEU H H 11 7.435 7.435 7.270 0.165 17908 491 1 11 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.143 0.136 17908 492 1 11 . 1 1 12 12 CYS H H 12 7.868 7.868 8.729 -0.861 17908 493 1 11 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.537 -0.169 17908 494 1 11 . 1 1 13 13 TYR H H 13 8.567 8.567 7.775 0.792 17908 495 1 11 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.411 0.413 17908 496 1 11 . 1 1 14 14 ASP H H 14 7.421 7.421 8.015 -0.594 17908 497 1 11 . 1 1 15 15 THR HA H 15 4.461 4.461 4.411 0.050 17908 498 1 11 . 1 1 15 15 THR H H 15 8.561 8.561 8.205 0.356 17908 499 1 11 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.432 -0.257 17908 500 1 11 . 1 1 16 16 ILE H H 16 8.442 8.442 8.352 0.090 17908 501 1 11 . 1 1 18 18 THR HA H 18 4.460 4.460 4.501 -0.041 17908 502 1 11 . 1 1 18 18 THR H H 18 7.432 7.432 8.054 -0.622 17908 503 1 11 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.852 -0.015 17908 504 1 11 . 1 1 19 19 CYS H H 19 8.590 8.590 7.556 1.034 17908 505 1 11 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.472 -0.317 17908 506 1 11 . 1 1 20 20 VAL H H 20 8.966 8.966 8.207 0.759 17908 507 1 11 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.386 -0.189 17908 508 1 11 . 1 1 21 21 ASP H H 21 9.233 9.233 9.171 0.062 17908 509 1 11 . 1 1 22 22 GLY H H 22 7.878 7.878 8.535 -0.657 17908 510 1 11 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.634 0.202 17908 511 1 11 . 1 1 23 23 LYS H H 23 7.758 7.758 8.000 -0.242 17908 512 1 11 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.398 0.642 17908 513 1 11 . 1 1 24 24 CYS H H 24 8.644 8.644 8.830 -0.186 17908 514 1 11 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.543 -0.032 17908 515 1 11 . 1 1 25 25 LYS H H 25 9.542 9.542 8.533 1.009 17908 516 1 11 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.705 0.457 17908 517 1 11 . 1 1 26 26 CYS H H 26 8.747 8.747 8.656 0.091 17908 518 1 12 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.773 -0.049 17908 519 1 12 . 1 1 2 2 CYS H H 2 7.866 7.866 7.569 0.297 17908 520 1 12 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.146 -0.133 17908 521 1 12 . 1 1 3 3 VAL H H 3 9.431 9.431 8.607 0.824 17908 522 1 12 . 1 1 4 4 THR HA H 4 4.623 4.623 4.185 0.438 17908 523 1 12 . 1 1 4 4 THR H H 4 7.982 7.982 7.733 0.249 17908 524 1 12 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.900 -0.718 17908 525 1 12 . 1 1 5 5 HIS H H 5 8.195 8.195 8.175 0.020 17908 526 1 12 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.035 -0.032 17908 527 1 12 . 1 1 6 6 GLU H H 6 8.521 8.521 8.513 0.008 17908 528 1 12 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.511 -0.061 17908 529 1 12 . 1 1 7 7 ASP H H 7 7.563 7.563 8.859 -1.296 17908 530 1 12 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.738 0.068 17908 531 1 12 . 1 1 8 8 CYS H H 8 7.880 7.880 7.905 -0.025 17908 532 1 12 . 1 1 9 9 THR HA H 9 3.881 3.881 3.934 -0.053 17908 533 1 12 . 1 1 9 9 THR H H 9 7.657 7.657 8.120 -0.463 17908 534 1 12 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.178 0.007 17908 535 1 12 . 1 1 10 10 LEU H H 10 7.974 7.974 7.796 0.178 17908 536 1 12 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.234 -0.053 17908 537 1 12 . 1 1 11 11 LEU H H 11 7.435 7.435 7.581 -0.146 17908 538 1 12 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.162 0.117 17908 539 1 12 . 1 1 12 12 CYS H H 12 7.868 7.868 8.467 -0.599 17908 540 1 12 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.631 -0.263 17908 541 1 12 . 1 1 13 13 TYR H H 13 8.567 8.567 7.763 0.804 17908 542 1 12 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.432 0.392 17908 543 1 12 . 1 1 14 14 ASP H H 14 7.421 7.421 8.382 -0.961 17908 544 1 12 . 1 1 15 15 THR HA H 15 4.461 4.461 4.706 -0.245 17908 545 1 12 . 1 1 15 15 THR H H 15 8.561 8.561 8.412 0.149 17908 546 1 12 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.705 0.470 17908 547 1 12 . 1 1 16 16 ILE H H 16 8.442 8.442 9.006 -0.564 17908 548 1 12 . 1 1 18 18 THR HA H 18 4.460 4.460 4.827 -0.367 17908 549 1 12 . 1 1 18 18 THR H H 18 7.432 7.432 7.642 -0.210 17908 550 1 12 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.554 0.283 17908 551 1 12 . 1 1 19 19 CYS H H 19 8.590 8.590 7.762 0.828 17908 552 1 12 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.215 -0.060 17908 553 1 12 . 1 1 20 20 VAL H H 20 8.966 8.966 8.400 0.566 17908 554 1 12 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.303 -0.106 17908 555 1 12 . 1 1 21 21 ASP H H 21 9.233 9.233 8.093 1.140 17908 556 1 12 . 1 1 22 22 GLY H H 22 7.878 7.878 8.067 -0.189 17908 557 1 12 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.627 0.209 17908 558 1 12 . 1 1 23 23 LYS H H 23 7.758 7.758 7.853 -0.095 17908 559 1 12 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.675 0.365 17908 560 1 12 . 1 1 24 24 CYS H H 24 8.644 8.644 8.664 -0.020 17908 561 1 12 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.611 -0.100 17908 562 1 12 . 1 1 25 25 LYS H H 25 9.542 9.542 8.281 1.261 17908 563 1 12 . 1 1 26 26 CYS HA H 26 5.162 5.162 5.234 -0.072 17908 564 1 12 . 1 1 26 26 CYS H H 26 8.747 8.747 8.619 0.128 17908 565 1 13 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.860 -0.136 17908 566 1 13 . 1 1 2 2 CYS H H 2 7.866 7.866 8.250 -0.384 17908 567 1 13 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.977 0.036 17908 568 1 13 . 1 1 3 3 VAL H H 3 9.431 9.431 9.238 0.193 17908 569 1 13 . 1 1 4 4 THR HA H 4 4.623 4.623 4.523 0.100 17908 570 1 13 . 1 1 4 4 THR H H 4 7.982 7.982 7.541 0.441 17908 571 1 13 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.335 -0.153 17908 572 1 13 . 1 1 5 5 HIS H H 5 8.195 8.195 9.085 -0.890 17908 573 1 13 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.747 0.256 17908 574 1 13 . 1 1 6 6 GLU H H 6 8.521 8.521 8.259 0.262 17908 575 1 13 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.450 0.000 17908 576 1 13 . 1 1 7 7 ASP H H 7 7.563 7.563 7.820 -0.257 17908 577 1 13 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.676 0.130 17908 578 1 13 . 1 1 8 8 CYS H H 8 7.880 7.880 7.651 0.229 17908 579 1 13 . 1 1 9 9 THR HA H 9 3.881 3.881 3.993 -0.112 17908 580 1 13 . 1 1 9 9 THR H H 9 7.657 7.657 8.077 -0.420 17908 581 1 13 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.196 -0.011 17908 582 1 13 . 1 1 10 10 LEU H H 10 7.974 7.974 7.886 0.088 17908 583 1 13 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.245 -0.064 17908 584 1 13 . 1 1 11 11 LEU H H 11 7.435 7.435 7.320 0.115 17908 585 1 13 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.152 0.127 17908 586 1 13 . 1 1 12 12 CYS H H 12 7.868 7.868 8.690 -0.822 17908 587 1 13 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.553 -0.185 17908 588 1 13 . 1 1 13 13 TYR H H 13 8.567 8.567 8.279 0.288 17908 589 1 13 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.488 0.336 17908 590 1 13 . 1 1 14 14 ASP H H 14 7.421 7.421 8.226 -0.805 17908 591 1 13 . 1 1 15 15 THR HA H 15 4.461 4.461 4.288 0.173 17908 592 1 13 . 1 1 15 15 THR H H 15 8.561 8.561 8.434 0.127 17908 593 1 13 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.662 0.513 17908 594 1 13 . 1 1 16 16 ILE H H 16 8.442 8.442 9.053 -0.611 17908 595 1 13 . 1 1 18 18 THR HA H 18 4.460 4.460 4.541 -0.081 17908 596 1 13 . 1 1 18 18 THR H H 18 7.432 7.432 7.698 -0.266 17908 597 1 13 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.815 0.022 17908 598 1 13 . 1 1 19 19 CYS H H 19 8.590 8.590 8.128 0.462 17908 599 1 13 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.462 -0.307 17908 600 1 13 . 1 1 20 20 VAL H H 20 8.966 8.966 8.881 0.085 17908 601 1 13 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.403 -0.206 17908 602 1 13 . 1 1 21 21 ASP H H 21 9.233 9.233 9.004 0.229 17908 603 1 13 . 1 1 22 22 GLY H H 22 7.878 7.878 8.295 -0.417 17908 604 1 13 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.623 0.213 17908 605 1 13 . 1 1 23 23 LYS H H 23 7.758 7.758 8.098 -0.340 17908 606 1 13 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.645 0.395 17908 607 1 13 . 1 1 24 24 CYS H H 24 8.644 8.644 8.679 -0.035 17908 608 1 13 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.531 -0.020 17908 609 1 13 . 1 1 25 25 LYS H H 25 9.542 9.542 8.852 0.690 17908 610 1 13 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.777 0.385 17908 611 1 13 . 1 1 26 26 CYS H H 26 8.747 8.747 8.722 0.025 17908 612 1 14 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.799 -0.075 17908 613 1 14 . 1 1 2 2 CYS H H 2 7.866 7.866 7.637 0.229 17908 614 1 14 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.430 -0.417 17908 615 1 14 . 1 1 3 3 VAL H H 3 9.431 9.431 9.161 0.270 17908 616 1 14 . 1 1 4 4 THR HA H 4 4.623 4.623 4.614 0.009 17908 617 1 14 . 1 1 4 4 THR H H 4 7.982 7.982 9.070 -1.088 17908 618 1 14 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.917 -0.735 17908 619 1 14 . 1 1 5 5 HIS H H 5 8.195 8.195 7.552 0.643 17908 620 1 14 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.971 0.032 17908 621 1 14 . 1 1 6 6 GLU H H 6 8.521 8.521 7.687 0.834 17908 622 1 14 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.438 0.012 17908 623 1 14 . 1 1 7 7 ASP H H 7 7.563 7.563 8.774 -1.211 17908 624 1 14 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.833 -0.027 17908 625 1 14 . 1 1 8 8 CYS H H 8 7.880 7.880 7.987 -0.107 17908 626 1 14 . 1 1 9 9 THR HA H 9 3.881 3.881 4.037 -0.156 17908 627 1 14 . 1 1 9 9 THR H H 9 7.657 7.657 7.938 -0.281 17908 628 1 14 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.437 -0.252 17908 629 1 14 . 1 1 10 10 LEU H H 10 7.974 7.974 7.551 0.423 17908 630 1 14 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.302 -0.121 17908 631 1 14 . 1 1 11 11 LEU H H 11 7.435 7.435 7.704 -0.269 17908 632 1 14 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.209 0.070 17908 633 1 14 . 1 1 12 12 CYS H H 12 7.868 7.868 8.804 -0.936 17908 634 1 14 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.558 -0.190 17908 635 1 14 . 1 1 13 13 TYR H H 13 8.567 8.567 7.931 0.636 17908 636 1 14 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.374 0.450 17908 637 1 14 . 1 1 14 14 ASP H H 14 7.421 7.421 8.226 -0.805 17908 638 1 14 . 1 1 15 15 THR HA H 15 4.461 4.461 4.636 -0.175 17908 639 1 14 . 1 1 15 15 THR H H 15 8.561 8.561 8.410 0.151 17908 640 1 14 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.740 0.435 17908 641 1 14 . 1 1 16 16 ILE H H 16 8.442 8.442 8.516 -0.074 17908 642 1 14 . 1 1 18 18 THR HA H 18 4.460 4.460 4.752 -0.292 17908 643 1 14 . 1 1 18 18 THR H H 18 7.432 7.432 7.772 -0.340 17908 644 1 14 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.967 -0.130 17908 645 1 14 . 1 1 19 19 CYS H H 19 8.590 8.590 7.783 0.807 17908 646 1 14 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.461 -0.306 17908 647 1 14 . 1 1 20 20 VAL H H 20 8.966 8.966 8.503 0.463 17908 648 1 14 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.336 -0.139 17908 649 1 14 . 1 1 21 21 ASP H H 21 9.233 9.233 9.052 0.181 17908 650 1 14 . 1 1 22 22 GLY H H 22 7.878 7.878 8.267 -0.389 17908 651 1 14 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.620 0.216 17908 652 1 14 . 1 1 23 23 LYS H H 23 7.758 7.758 8.030 -0.272 17908 653 1 14 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.450 0.590 17908 654 1 14 . 1 1 24 24 CYS H H 24 8.644 8.644 8.641 0.003 17908 655 1 14 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.545 -0.034 17908 656 1 14 . 1 1 25 25 LYS H H 25 9.542 9.542 8.450 1.092 17908 657 1 14 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.529 0.633 17908 658 1 14 . 1 1 26 26 CYS H H 26 8.747 8.747 8.767 -0.020 17908 659 1 15 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.716 0.008 17908 660 1 15 . 1 1 2 2 CYS H H 2 7.866 7.866 7.766 0.100 17908 661 1 15 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.250 -0.237 17908 662 1 15 . 1 1 3 3 VAL H H 3 9.431 9.431 9.354 0.077 17908 663 1 15 . 1 1 4 4 THR HA H 4 4.623 4.623 4.545 0.078 17908 664 1 15 . 1 1 4 4 THR H H 4 7.982 7.982 7.497 0.485 17908 665 1 15 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.386 -0.204 17908 666 1 15 . 1 1 5 5 HIS H H 5 8.195 8.195 8.497 -0.302 17908 667 1 15 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.116 -0.113 17908 668 1 15 . 1 1 6 6 GLU H H 6 8.521 8.521 8.103 0.418 17908 669 1 15 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.429 0.021 17908 670 1 15 . 1 1 7 7 ASP H H 7 7.563 7.563 8.382 -0.819 17908 671 1 15 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.891 -0.085 17908 672 1 15 . 1 1 8 8 CYS H H 8 7.880 7.880 7.518 0.362 17908 673 1 15 . 1 1 9 9 THR HA H 9 3.881 3.881 4.089 -0.208 17908 674 1 15 . 1 1 9 9 THR H H 9 7.657 7.657 7.907 -0.250 17908 675 1 15 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.226 -0.041 17908 676 1 15 . 1 1 10 10 LEU H H 10 7.974 7.974 7.647 0.327 17908 677 1 15 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.421 -0.240 17908 678 1 15 . 1 1 11 11 LEU H H 11 7.435 7.435 7.201 0.234 17908 679 1 15 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.204 0.075 17908 680 1 15 . 1 1 12 12 CYS H H 12 7.868 7.868 8.784 -0.916 17908 681 1 15 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.523 -0.155 17908 682 1 15 . 1 1 13 13 TYR H H 13 8.567 8.567 7.744 0.823 17908 683 1 15 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.360 0.464 17908 684 1 15 . 1 1 14 14 ASP H H 14 7.421 7.421 8.139 -0.718 17908 685 1 15 . 1 1 15 15 THR HA H 15 4.461 4.461 4.547 -0.086 17908 686 1 15 . 1 1 15 15 THR H H 15 8.561 8.561 8.357 0.204 17908 687 1 15 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.664 0.511 17908 688 1 15 . 1 1 16 16 ILE H H 16 8.442 8.442 9.100 -0.658 17908 689 1 15 . 1 1 18 18 THR HA H 18 4.460 4.460 4.687 -0.227 17908 690 1 15 . 1 1 18 18 THR H H 18 7.432 7.432 7.630 -0.198 17908 691 1 15 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.489 0.348 17908 692 1 15 . 1 1 19 19 CYS H H 19 8.590 8.590 7.879 0.711 17908 693 1 15 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.446 -0.291 17908 694 1 15 . 1 1 20 20 VAL H H 20 8.966 8.966 8.568 0.398 17908 695 1 15 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.403 -0.206 17908 696 1 15 . 1 1 21 21 ASP H H 21 9.233 9.233 9.018 0.215 17908 697 1 15 . 1 1 22 22 GLY H H 22 7.878 7.878 8.232 -0.354 17908 698 1 15 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.647 0.189 17908 699 1 15 . 1 1 23 23 LYS H H 23 7.758 7.758 8.073 -0.315 17908 700 1 15 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.646 0.394 17908 701 1 15 . 1 1 24 24 CYS H H 24 8.644 8.644 8.717 -0.073 17908 702 1 15 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.464 0.047 17908 703 1 15 . 1 1 25 25 LYS H H 25 9.542 9.542 8.335 1.207 17908 704 1 15 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.471 0.691 17908 705 1 15 . 1 1 26 26 CYS H H 26 8.747 8.747 8.757 -0.010 17908 706 1 16 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.790 -0.066 17908 707 1 16 . 1 1 2 2 CYS H H 2 7.866 7.866 8.164 -0.298 17908 708 1 16 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.987 0.026 17908 709 1 16 . 1 1 3 3 VAL H H 3 9.431 9.431 8.958 0.473 17908 710 1 16 . 1 1 4 4 THR HA H 4 4.623 4.623 4.385 0.238 17908 711 1 16 . 1 1 4 4 THR H H 4 7.982 7.982 7.292 0.690 17908 712 1 16 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.325 -0.143 17908 713 1 16 . 1 1 5 5 HIS H H 5 8.195 8.195 8.845 -0.650 17908 714 1 16 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.072 -0.069 17908 715 1 16 . 1 1 6 6 GLU H H 6 8.521 8.521 8.849 -0.328 17908 716 1 16 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.473 -0.023 17908 717 1 16 . 1 1 7 7 ASP H H 7 7.563 7.563 7.905 -0.342 17908 718 1 16 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.743 0.063 17908 719 1 16 . 1 1 8 8 CYS H H 8 7.880 7.880 7.653 0.227 17908 720 1 16 . 1 1 9 9 THR HA H 9 3.881 3.881 4.092 -0.211 17908 721 1 16 . 1 1 9 9 THR H H 9 7.657 7.657 8.095 -0.438 17908 722 1 16 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.435 -0.250 17908 723 1 16 . 1 1 10 10 LEU H H 10 7.974 7.974 7.547 0.427 17908 724 1 16 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.449 -0.268 17908 725 1 16 . 1 1 11 11 LEU H H 11 7.435 7.435 7.539 -0.104 17908 726 1 16 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.297 -0.018 17908 727 1 16 . 1 1 12 12 CYS H H 12 7.868 7.868 8.598 -0.730 17908 728 1 16 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.556 -0.188 17908 729 1 16 . 1 1 13 13 TYR H H 13 8.567 8.567 7.939 0.628 17908 730 1 16 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.342 0.482 17908 731 1 16 . 1 1 14 14 ASP H H 14 7.421 7.421 7.665 -0.244 17908 732 1 16 . 1 1 15 15 THR HA H 15 4.461 4.461 4.041 0.420 17908 733 1 16 . 1 1 15 15 THR H H 15 8.561 8.561 8.247 0.314 17908 734 1 16 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.091 0.084 17908 735 1 16 . 1 1 16 16 ILE H H 16 8.442 8.442 7.751 0.691 17908 736 1 16 . 1 1 18 18 THR HA H 18 4.460 4.460 4.139 0.321 17908 737 1 16 . 1 1 18 18 THR H H 18 7.432 7.432 7.686 -0.254 17908 738 1 16 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.417 0.420 17908 739 1 16 . 1 1 19 19 CYS H H 19 8.590 8.590 7.541 1.049 17908 740 1 16 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.468 -0.313 17908 741 1 16 . 1 1 20 20 VAL H H 20 8.966 8.966 8.287 0.679 17908 742 1 16 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.354 -0.157 17908 743 1 16 . 1 1 21 21 ASP H H 21 9.233 9.233 9.072 0.161 17908 744 1 16 . 1 1 22 22 GLY H H 22 7.878 7.878 8.572 -0.694 17908 745 1 16 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.660 0.176 17908 746 1 16 . 1 1 23 23 LYS H H 23 7.758 7.758 8.221 -0.463 17908 747 1 16 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.534 0.506 17908 748 1 16 . 1 1 24 24 CYS H H 24 8.644 8.644 8.627 0.017 17908 749 1 16 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.505 0.006 17908 750 1 16 . 1 1 25 25 LYS H H 25 9.542 9.542 8.488 1.054 17908 751 1 16 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.615 0.547 17908 752 1 16 . 1 1 26 26 CYS H H 26 8.747 8.747 8.674 0.073 17908 753 1 17 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.493 0.231 17908 754 1 17 . 1 1 2 2 CYS H H 2 7.866 7.866 8.073 -0.207 17908 755 1 17 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.828 0.185 17908 756 1 17 . 1 1 3 3 VAL H H 3 9.431 9.431 8.846 0.585 17908 757 1 17 . 1 1 4 4 THR HA H 4 4.623 4.623 4.289 0.334 17908 758 1 17 . 1 1 4 4 THR H H 4 7.982 7.982 7.552 0.430 17908 759 1 17 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.295 -0.113 17908 760 1 17 . 1 1 5 5 HIS H H 5 8.195 8.195 7.863 0.332 17908 761 1 17 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.062 -0.059 17908 762 1 17 . 1 1 6 6 GLU H H 6 8.521 8.521 8.882 -0.361 17908 763 1 17 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.513 -0.063 17908 764 1 17 . 1 1 7 7 ASP H H 7 7.563 7.563 7.907 -0.344 17908 765 1 17 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.787 0.019 17908 766 1 17 . 1 1 8 8 CYS H H 8 7.880 7.880 7.770 0.110 17908 767 1 17 . 1 1 9 9 THR HA H 9 3.881 3.881 4.043 -0.162 17908 768 1 17 . 1 1 9 9 THR H H 9 7.657 7.657 7.941 -0.284 17908 769 1 17 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.178 0.007 17908 770 1 17 . 1 1 10 10 LEU H H 10 7.974 7.974 7.946 0.028 17908 771 1 17 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.319 -0.138 17908 772 1 17 . 1 1 11 11 LEU H H 11 7.435 7.435 7.572 -0.137 17908 773 1 17 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.095 0.184 17908 774 1 17 . 1 1 12 12 CYS H H 12 7.868 7.868 8.773 -0.905 17908 775 1 17 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.534 -0.166 17908 776 1 17 . 1 1 13 13 TYR H H 13 8.567 8.567 7.724 0.843 17908 777 1 17 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.362 0.462 17908 778 1 17 . 1 1 14 14 ASP H H 14 7.421 7.421 8.235 -0.814 17908 779 1 17 . 1 1 15 15 THR HA H 15 4.461 4.461 4.252 0.209 17908 780 1 17 . 1 1 15 15 THR H H 15 8.561 8.561 8.416 0.145 17908 781 1 17 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.175 0.000 17908 782 1 17 . 1 1 16 16 ILE H H 16 8.442 8.442 8.210 0.232 17908 783 1 17 . 1 1 18 18 THR HA H 18 4.460 4.460 4.738 -0.278 17908 784 1 17 . 1 1 18 18 THR H H 18 7.432 7.432 8.109 -0.677 17908 785 1 17 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.647 0.190 17908 786 1 17 . 1 1 19 19 CYS H H 19 8.590 8.590 7.421 1.169 17908 787 1 17 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.153 0.002 17908 788 1 17 . 1 1 20 20 VAL H H 20 8.966 8.966 8.259 0.707 17908 789 1 17 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.265 -0.068 17908 790 1 17 . 1 1 21 21 ASP H H 21 9.233 9.233 8.163 1.070 17908 791 1 17 . 1 1 22 22 GLY H H 22 7.878 7.878 7.869 0.009 17908 792 1 17 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.718 0.118 17908 793 1 17 . 1 1 23 23 LYS H H 23 7.758 7.758 7.826 -0.068 17908 794 1 17 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.433 0.607 17908 795 1 17 . 1 1 24 24 CYS H H 24 8.644 8.644 8.737 -0.093 17908 796 1 17 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.383 0.128 17908 797 1 17 . 1 1 25 25 LYS H H 25 9.542 9.542 8.033 1.509 17908 798 1 17 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.541 0.621 17908 799 1 17 . 1 1 26 26 CYS H H 26 8.747 8.747 8.668 0.079 17908 800 1 18 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.844 -0.120 17908 801 1 18 . 1 1 2 2 CYS H H 2 7.866 7.866 7.854 0.012 17908 802 1 18 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.275 -0.262 17908 803 1 18 . 1 1 3 3 VAL H H 3 9.431 9.431 8.446 0.985 17908 804 1 18 . 1 1 4 4 THR HA H 4 4.623 4.623 4.436 0.187 17908 805 1 18 . 1 1 4 4 THR H H 4 7.982 7.982 7.322 0.660 17908 806 1 18 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.330 -0.148 17908 807 1 18 . 1 1 5 5 HIS H H 5 8.195 8.195 8.671 -0.476 17908 808 1 18 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.095 -0.092 17908 809 1 18 . 1 1 6 6 GLU H H 6 8.521 8.521 8.437 0.084 17908 810 1 18 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.441 0.009 17908 811 1 18 . 1 1 7 7 ASP H H 7 7.563 7.563 8.468 -0.905 17908 812 1 18 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.740 0.066 17908 813 1 18 . 1 1 8 8 CYS H H 8 7.880 7.880 7.641 0.239 17908 814 1 18 . 1 1 9 9 THR HA H 9 3.881 3.881 4.027 -0.146 17908 815 1 18 . 1 1 9 9 THR H H 9 7.657 7.657 7.842 -0.185 17908 816 1 18 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.207 -0.022 17908 817 1 18 . 1 1 10 10 LEU H H 10 7.974 7.974 7.658 0.316 17908 818 1 18 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.331 -0.150 17908 819 1 18 . 1 1 11 11 LEU H H 11 7.435 7.435 7.532 -0.097 17908 820 1 18 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.321 -0.042 17908 821 1 18 . 1 1 12 12 CYS H H 12 7.868 7.868 8.764 -0.896 17908 822 1 18 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.536 -0.168 17908 823 1 18 . 1 1 13 13 TYR H H 13 8.567 8.567 7.934 0.633 17908 824 1 18 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.390 0.434 17908 825 1 18 . 1 1 14 14 ASP H H 14 7.421 7.421 7.963 -0.542 17908 826 1 18 . 1 1 15 15 THR HA H 15 4.461 4.461 4.211 0.250 17908 827 1 18 . 1 1 15 15 THR H H 15 8.561 8.561 8.534 0.027 17908 828 1 18 . 1 1 16 16 ILE HA H 16 4.175 4.175 4.130 0.045 17908 829 1 18 . 1 1 16 16 ILE H H 16 8.442 8.442 8.010 0.432 17908 830 1 18 . 1 1 18 18 THR HA H 18 4.460 4.460 4.055 0.405 17908 831 1 18 . 1 1 18 18 THR H H 18 7.432 7.432 7.702 -0.270 17908 832 1 18 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.422 0.415 17908 833 1 18 . 1 1 19 19 CYS H H 19 8.590 8.590 7.495 1.095 17908 834 1 18 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.207 -0.052 17908 835 1 18 . 1 1 20 20 VAL H H 20 8.966 8.966 8.742 0.224 17908 836 1 18 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.244 -0.047 17908 837 1 18 . 1 1 21 21 ASP H H 21 9.233 9.233 8.152 1.081 17908 838 1 18 . 1 1 22 22 GLY H H 22 7.878 7.878 8.067 -0.189 17908 839 1 18 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.658 0.178 17908 840 1 18 . 1 1 23 23 LYS H H 23 7.758 7.758 7.530 0.228 17908 841 1 18 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.608 0.432 17908 842 1 18 . 1 1 24 24 CYS H H 24 8.644 8.644 8.617 0.027 17908 843 1 18 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.495 0.016 17908 844 1 18 . 1 1 25 25 LYS H H 25 9.542 9.542 8.425 1.117 17908 845 1 18 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.954 0.208 17908 846 1 18 . 1 1 26 26 CYS H H 26 8.747 8.747 8.524 0.223 17908 847 1 19 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.858 -0.134 17908 848 1 19 . 1 1 2 2 CYS H H 2 7.866 7.866 8.356 -0.490 17908 849 1 19 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.781 0.232 17908 850 1 19 . 1 1 3 3 VAL H H 3 9.431 9.431 9.410 0.021 17908 851 1 19 . 1 1 4 4 THR HA H 4 4.623 4.623 4.521 0.102 17908 852 1 19 . 1 1 4 4 THR H H 4 7.982 7.982 7.403 0.579 17908 853 1 19 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.240 -0.058 17908 854 1 19 . 1 1 5 5 HIS H H 5 8.195 8.195 8.933 -0.738 17908 855 1 19 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.705 0.298 17908 856 1 19 . 1 1 6 6 GLU H H 6 8.521 8.521 7.832 0.689 17908 857 1 19 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.489 -0.039 17908 858 1 19 . 1 1 7 7 ASP H H 7 7.563 7.563 7.862 -0.299 17908 859 1 19 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.824 -0.018 17908 860 1 19 . 1 1 8 8 CYS H H 8 7.880 7.880 7.792 0.088 17908 861 1 19 . 1 1 9 9 THR HA H 9 3.881 3.881 3.916 -0.035 17908 862 1 19 . 1 1 9 9 THR H H 9 7.657 7.657 7.858 -0.201 17908 863 1 19 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.157 0.028 17908 864 1 19 . 1 1 10 10 LEU H H 10 7.974 7.974 7.921 0.053 17908 865 1 19 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.322 -0.141 17908 866 1 19 . 1 1 11 11 LEU H H 11 7.435 7.435 7.295 0.140 17908 867 1 19 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.162 0.117 17908 868 1 19 . 1 1 12 12 CYS H H 12 7.868 7.868 8.634 -0.766 17908 869 1 19 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.572 -0.203 17908 870 1 19 . 1 1 13 13 TYR H H 13 8.567 8.567 7.807 0.760 17908 871 1 19 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.324 0.500 17908 872 1 19 . 1 1 14 14 ASP H H 14 7.421 7.421 8.372 -0.951 17908 873 1 19 . 1 1 15 15 THR HA H 15 4.461 4.461 4.640 -0.179 17908 874 1 19 . 1 1 15 15 THR H H 15 8.561 8.561 8.327 0.234 17908 875 1 19 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.561 0.614 17908 876 1 19 . 1 1 16 16 ILE H H 16 8.442 8.442 9.064 -0.622 17908 877 1 19 . 1 1 18 18 THR HA H 18 4.460 4.460 4.662 -0.202 17908 878 1 19 . 1 1 18 18 THR H H 18 7.432 7.432 7.792 -0.360 17908 879 1 19 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.763 0.074 17908 880 1 19 . 1 1 19 19 CYS H H 19 8.590 8.590 7.526 1.064 17908 881 1 19 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.440 -0.285 17908 882 1 19 . 1 1 20 20 VAL H H 20 8.966 8.966 7.949 1.017 17908 883 1 19 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.354 -0.157 17908 884 1 19 . 1 1 21 21 ASP H H 21 9.233 9.233 9.207 0.026 17908 885 1 19 . 1 1 22 22 GLY H H 22 7.878 7.878 8.561 -0.683 17908 886 1 19 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.677 0.159 17908 887 1 19 . 1 1 23 23 LYS H H 23 7.758 7.758 8.052 -0.294 17908 888 1 19 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.376 0.664 17908 889 1 19 . 1 1 24 24 CYS H H 24 8.644 8.644 8.728 -0.084 17908 890 1 19 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.469 0.042 17908 891 1 19 . 1 1 25 25 LYS H H 25 9.542 9.542 8.255 1.287 17908 892 1 19 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.460 0.702 17908 893 1 19 . 1 1 26 26 CYS H H 26 8.747 8.747 8.893 -0.146 17908 894 1 20 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.769 -0.045 17908 895 1 20 . 1 1 2 2 CYS H H 2 7.866 7.866 7.953 -0.087 17908 896 1 20 . 1 1 3 3 VAL HA H 3 4.013 4.013 3.714 0.299 17908 897 1 20 . 1 1 3 3 VAL H H 3 9.431 9.431 9.564 -0.133 17908 898 1 20 . 1 1 4 4 THR HA H 4 4.623 4.623 4.188 0.435 17908 899 1 20 . 1 1 4 4 THR H H 4 7.982 7.982 8.060 -0.078 17908 900 1 20 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.921 -0.739 17908 901 1 20 . 1 1 5 5 HIS H H 5 8.195 8.195 8.011 0.184 17908 902 1 20 . 1 1 6 6 GLU HA H 6 4.003 4.003 4.058 -0.055 17908 903 1 20 . 1 1 6 6 GLU H H 6 8.521 8.521 8.349 0.172 17908 904 1 20 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.496 -0.046 17908 905 1 20 . 1 1 7 7 ASP H H 7 7.563 7.563 8.833 -1.270 17908 906 1 20 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.870 -0.064 17908 907 1 20 . 1 1 8 8 CYS H H 8 7.880 7.880 7.840 0.040 17908 908 1 20 . 1 1 9 9 THR HA H 9 3.881 3.881 4.042 -0.161 17908 909 1 20 . 1 1 9 9 THR H H 9 7.657 7.657 8.106 -0.449 17908 910 1 20 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.458 -0.273 17908 911 1 20 . 1 1 10 10 LEU H H 10 7.974 7.974 7.624 0.350 17908 912 1 20 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.272 -0.091 17908 913 1 20 . 1 1 11 11 LEU H H 11 7.435 7.435 7.689 -0.254 17908 914 1 20 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.235 0.044 17908 915 1 20 . 1 1 12 12 CYS H H 12 7.868 7.868 8.745 -0.877 17908 916 1 20 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.470 -0.102 17908 917 1 20 . 1 1 13 13 TYR H H 13 8.567 8.567 7.788 0.779 17908 918 1 20 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.423 0.401 17908 919 1 20 . 1 1 14 14 ASP H H 14 7.421 7.421 7.993 -0.572 17908 920 1 20 . 1 1 15 15 THR HA H 15 4.461 4.461 4.280 0.181 17908 921 1 20 . 1 1 15 15 THR H H 15 8.561 8.561 8.233 0.328 17908 922 1 20 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.783 0.392 17908 923 1 20 . 1 1 16 16 ILE H H 16 8.442 8.442 8.403 0.039 17908 924 1 20 . 1 1 18 18 THR HA H 18 4.460 4.460 4.302 0.158 17908 925 1 20 . 1 1 18 18 THR H H 18 7.432 7.432 8.000 -0.568 17908 926 1 20 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.718 0.119 17908 927 1 20 . 1 1 19 19 CYS H H 19 8.590 8.590 7.483 1.107 17908 928 1 20 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.405 -0.250 17908 929 1 20 . 1 1 20 20 VAL H H 20 8.966 8.966 8.488 0.478 17908 930 1 20 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.367 -0.170 17908 931 1 20 . 1 1 21 21 ASP H H 21 9.233 9.233 9.101 0.132 17908 932 1 20 . 1 1 22 22 GLY H H 22 7.878 7.878 8.618 -0.740 17908 933 1 20 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.586 0.250 17908 934 1 20 . 1 1 23 23 LYS H H 23 7.758 7.758 7.900 -0.142 17908 935 1 20 . 1 1 24 24 CYS HA H 24 5.040 5.040 5.026 0.014 17908 936 1 20 . 1 1 24 24 CYS H H 24 8.644 8.644 8.689 -0.045 17908 937 1 20 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.560 -0.049 17908 938 1 20 . 1 1 25 25 LYS H H 25 9.542 9.542 8.598 0.944 17908 939 1 20 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.794 0.368 17908 940 1 20 . 1 1 26 26 CYS H H 26 8.747 8.747 8.604 0.143 17908 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 0 0.000 0.000 0.000 17908 2 1 1 "Average Difference" HA 25 0.266 -0.099 0.252 17908 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17908 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17908 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17908 6 1 1 "Average Difference" HN 24 0.472 0.063 0.477 17908 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 17908 8 1 2 "Average Difference" HA 25 0.245 -0.076 0.237 17908 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17908 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17908 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17908 12 1 2 "Average Difference" HN 24 0.509 -0.085 0.512 17908 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 17908 14 1 3 "Average Difference" HA 25 0.268 -0.099 0.254 17908 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17908 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17908 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17908 18 1 3 "Average Difference" HN 24 0.491 0.024 0.501 17908 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 17908 20 1 4 "Average Difference" HA 25 0.228 -0.049 0.227 17908 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17908 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17908 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17908 24 1 4 "Average Difference" HN 24 0.514 -0.001 0.525 17908 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 17908 26 1 5 "Average Difference" HA 25 0.273 -0.071 0.269 17908 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17908 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17908 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17908 30 1 5 "Average Difference" HN 24 0.478 0.012 0.488 17908 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 17908 32 1 6 "Average Difference" HA 25 0.312 -0.035 0.316 17908 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17908 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17908 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17908 36 1 6 "Average Difference" HN 24 0.575 0.050 0.585 17908 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 17908 38 1 7 "Average Difference" HA 25 0.259 -0.102 0.243 17908 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17908 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17908 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17908 42 1 7 "Average Difference" HN 24 0.525 -0.023 0.536 17908 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 17908 44 1 8 "Average Difference" HA 25 0.255 -0.056 0.254 17908 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17908 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17908 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17908 48 1 8 "Average Difference" HN 24 0.490 0.117 0.486 17908 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 17908 50 1 9 "Average Difference" HA 25 0.276 -0.010 0.281 17908 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17908 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17908 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17908 54 1 9 "Average Difference" HN 24 0.646 -0.009 0.660 17908 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 17908 56 1 10 "Average Difference" HA 25 0.328 -0.139 0.304 17908 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17908 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17908 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17908 60 1 10 "Average Difference" HN 24 0.554 0.045 0.564 17908 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 17908 62 1 11 "Average Difference" HA 25 0.252 -0.078 0.245 17908 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17908 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17908 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17908 66 1 11 "Average Difference" HN 24 0.518 -0.021 0.529 17908 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 17908 68 1 12 "Average Difference" HA 25 0.273 -0.025 0.277 17908 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17908 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17908 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17908 72 1 12 "Average Difference" HN 24 0.614 -0.079 0.622 17908 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 17908 74 1 13 "Average Difference" HA 25 0.243 -0.091 0.230 17908 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17908 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17908 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17908 78 1 13 "Average Difference" HN 24 0.431 0.084 0.432 17908 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 17908 80 1 14 "Average Difference" HA 25 0.321 -0.006 0.328 17908 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17908 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17908 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17908 84 1 14 "Average Difference" HN 24 0.599 0.003 0.612 17908 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 17908 86 1 15 "Average Difference" HA 25 0.289 -0.064 0.288 17908 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17908 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17908 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17908 90 1 15 "Average Difference" HN 24 0.520 -0.040 0.529 17908 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 17908 92 1 16 "Average Difference" HA 25 0.298 -0.103 0.285 17908 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17908 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 17908 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17908 96 1 16 "Average Difference" HN 24 0.536 -0.081 0.541 17908 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 17908 98 1 17 "Average Difference" HA 25 0.244 -0.092 0.231 17908 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17908 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 17908 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17908 102 1 17 "Average Difference" HN 24 0.615 -0.140 0.612 17908 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 17908 104 1 18 "Average Difference" HA 25 0.225 -0.080 0.215 17908 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17908 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 17908 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17908 108 1 18 "Average Difference" HN 24 0.585 -0.159 0.575 17908 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 17908 110 1 19 "Average Difference" HA 25 0.314 -0.121 0.296 17908 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17908 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 17908 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17908 114 1 19 "Average Difference" HN 24 0.605 -0.013 0.618 17908 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 17908 116 1 20 "Average Difference" HA 25 0.287 -0.061 0.286 17908 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17908 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 17908 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17908 120 1 20 "Average Difference" HN 24 0.547 0.022 0.558 17908 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.Model_type average _Entity_delta_chem_shifts.Entry_ID 17908 _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.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_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.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 CYS HA H 2 4.724 4.724 4.732 -0.008 17908 2 1 . 1 1 2 2 CYS H H 2 7.866 7.866 8.066 -0.200 17908 3 1 . 1 1 3 3 VAL HA H 3 4.013 4.013 4.047 -0.034 17908 4 1 . 1 1 3 3 VAL H H 3 9.431 9.431 9.150 0.281 17908 5 1 . 1 1 4 4 THR HA H 4 4.623 4.623 4.454 0.169 17908 6 1 . 1 1 4 4 THR H H 4 7.982 7.982 7.725 0.257 17908 7 1 . 1 1 5 5 HIS HA H 5 4.182 4.182 4.460 -0.277 17908 8 1 . 1 1 5 5 HIS H H 5 8.195 8.195 8.433 -0.238 17908 9 1 . 1 1 6 6 GLU HA H 6 4.003 4.003 3.995 0.008 17908 10 1 . 1 1 6 6 GLU H H 6 8.521 8.521 8.404 0.117 17908 11 1 . 1 1 7 7 ASP HA H 7 4.450 4.450 4.476 -0.026 17908 12 1 . 1 1 7 7 ASP H H 7 7.563 7.563 8.230 -0.667 17908 13 1 . 1 1 8 8 CYS HA H 8 4.806 4.806 4.805 0.001 17908 14 1 . 1 1 8 8 CYS H H 8 7.880 7.880 7.738 0.142 17908 15 1 . 1 1 9 9 THR HA H 9 3.881 3.881 3.993 -0.112 17908 16 1 . 1 1 9 9 THR H H 9 7.657 7.657 7.966 -0.309 17908 17 1 . 1 1 10 10 LEU HA H 10 4.185 4.185 4.260 -0.075 17908 18 1 . 1 1 10 10 LEU H H 10 7.974 7.974 7.741 0.233 17908 19 1 . 1 1 11 11 LEU HA H 11 4.181 4.181 4.309 -0.128 17908 20 1 . 1 1 11 11 LEU H H 11 7.435 7.435 7.555 -0.120 17908 21 1 . 1 1 12 12 CYS HA H 12 4.279 4.279 4.199 0.080 17908 22 1 . 1 1 12 12 CYS H H 12 7.868 7.868 8.702 -0.834 17908 23 1 . 1 1 13 13 TYR HA H 13 4.368 4.368 4.542 -0.174 17908 24 1 . 1 1 13 13 TYR H H 13 8.567 8.567 7.812 0.755 17908 25 1 . 1 1 14 14 ASP HA H 14 4.824 4.824 4.397 0.427 17908 26 1 . 1 1 14 14 ASP H H 14 7.421 7.421 8.145 -0.724 17908 27 1 . 1 1 15 15 THR HA H 15 4.461 4.461 4.428 0.033 17908 28 1 . 1 1 15 15 THR H H 15 8.561 8.561 8.364 0.197 17908 29 1 . 1 1 16 16 ILE HA H 16 4.175 4.175 3.884 0.291 17908 30 1 . 1 1 16 16 ILE H H 16 8.442 8.442 8.619 -0.177 17908 31 1 . 1 1 18 18 THR HA H 18 4.460 4.460 4.479 -0.019 17908 32 1 . 1 1 18 18 THR H H 18 7.432 7.432 7.845 -0.413 17908 33 1 . 1 1 19 19 CYS HA H 19 4.837 4.837 4.639 0.198 17908 34 1 . 1 1 19 19 CYS H H 19 8.590 8.590 7.782 0.808 17908 35 1 . 1 1 20 20 VAL HA H 20 4.155 4.155 4.423 -0.268 17908 36 1 . 1 1 20 20 VAL H H 20 8.966 8.966 8.442 0.524 17908 37 1 . 1 1 21 21 ASP HA H 21 4.197 4.197 4.366 -0.169 17908 38 1 . 1 1 21 21 ASP H H 21 9.233 9.233 8.932 0.301 17908 39 1 . 1 1 22 22 GLY H H 22 7.878 7.878 8.334 -0.456 17908 40 1 . 1 1 23 23 LYS HA H 23 4.836 4.836 4.623 0.213 17908 41 1 . 1 1 23 23 LYS H H 23 7.758 7.758 7.989 -0.231 17908 42 1 . 1 1 24 24 CYS HA H 24 5.040 5.040 4.594 0.446 17908 43 1 . 1 1 24 24 CYS H H 24 8.644 8.644 8.700 -0.056 17908 44 1 . 1 1 25 25 LYS HA H 25 4.511 4.511 4.521 -0.010 17908 45 1 . 1 1 25 25 LYS H H 25 9.542 9.542 8.492 1.050 17908 46 1 . 1 1 26 26 CYS HA H 26 5.162 5.162 4.683 0.479 17908 47 1 . 1 1 26 26 CYS H H 26 8.747 8.747 8.709 0.038 17908 stop_ save_