data_19823 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19823 _Entry.PDB_ID 2MLJ 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 19823 _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 ILE HA H 2 4.891 4.891 4.686 0.205 19823 2 1 1 . 1 1 2 2 ILE H H 2 9.084 9.084 8.094 0.990 19823 3 1 1 . 1 1 3 3 GLY H H 3 8.699 8.699 8.034 0.665 19823 4 1 1 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.668 0.482 19823 5 1 1 . 1 1 4 4 ASP H H 4 8.972 8.972 8.635 0.337 19823 6 1 1 . 1 1 5 5 SER HA H 5 3.235 3.235 4.324 -1.089 19823 7 1 1 . 1 1 5 5 SER H H 5 7.597 7.597 7.714 -0.117 19823 8 1 1 . 1 1 6 6 GLY H H 6 8.185 8.185 8.331 -0.146 19823 9 1 1 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.613 0.225 19823 10 1 1 . 1 1 7 7 LEU H H 7 9.402 9.402 7.899 1.503 19823 11 1 1 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.978 0.025 19823 12 1 1 . 1 1 8 8 ARG H H 8 8.869 8.869 8.775 0.094 19823 13 1 1 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.700 -0.318 19823 14 1 1 . 1 1 9 9 GLU H H 9 7.985 7.985 8.166 -0.181 19823 15 1 1 . 1 1 10 10 SER HA H 10 4.685 4.685 4.613 0.072 19823 16 1 1 . 1 1 10 10 SER H H 10 7.851 7.851 7.732 0.119 19823 17 1 1 . 1 1 11 11 MET HA H 11 4.569 4.569 4.397 0.172 19823 18 1 1 . 1 1 11 11 MET H H 11 8.899 8.899 8.718 0.181 19823 19 1 1 . 1 1 12 12 SER HA H 12 4.724 4.724 4.417 0.307 19823 20 1 1 . 1 1 12 12 SER H H 12 8.304 8.304 7.854 0.450 19823 21 1 1 . 1 1 13 13 SER HA H 13 4.660 4.660 4.374 0.286 19823 22 1 1 . 1 1 13 13 SER H H 13 7.669 7.669 7.679 -0.010 19823 23 1 1 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.340 0.146 19823 24 1 1 . 1 1 14 14 GLN H H 14 8.919 8.919 8.442 0.477 19823 25 1 1 . 1 1 15 15 THR HA H 15 4.646 4.646 4.532 0.114 19823 26 1 1 . 1 1 15 15 THR H H 15 7.464 7.464 7.370 0.094 19823 27 1 1 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.929 0.206 19823 28 1 1 . 1 1 16 16 TYR H H 16 8.053 8.053 7.849 0.204 19823 29 1 1 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.048 0.439 19823 30 1 1 . 1 1 17 17 TRP H H 17 9.348 9.348 8.205 1.143 19823 31 1 2 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.646 0.245 19823 32 1 2 . 1 1 2 2 ILE H H 2 9.084 9.084 8.084 1.000 19823 33 1 2 . 1 1 3 3 GLY H H 3 8.699 8.699 8.015 0.684 19823 34 1 2 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.773 0.377 19823 35 1 2 . 1 1 4 4 ASP H H 4 8.972 8.972 8.665 0.307 19823 36 1 2 . 1 1 5 5 SER HA H 5 3.235 3.235 4.260 -1.025 19823 37 1 2 . 1 1 5 5 SER H H 5 7.597 7.597 7.680 -0.083 19823 38 1 2 . 1 1 6 6 GLY H H 6 8.185 8.185 8.348 -0.163 19823 39 1 2 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.638 0.200 19823 40 1 2 . 1 1 7 7 LEU H H 7 9.402 9.402 7.978 1.424 19823 41 1 2 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.705 0.298 19823 42 1 2 . 1 1 8 8 ARG H H 8 8.869 8.869 8.785 0.084 19823 43 1 2 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.741 -0.359 19823 44 1 2 . 1 1 9 9 GLU H H 9 7.985 7.985 8.064 -0.079 19823 45 1 2 . 1 1 10 10 SER HA H 10 4.685 4.685 4.743 -0.058 19823 46 1 2 . 1 1 10 10 SER H H 10 7.851 7.851 7.594 0.257 19823 47 1 2 . 1 1 11 11 MET HA H 11 4.569 4.569 4.323 0.246 19823 48 1 2 . 1 1 11 11 MET H H 11 8.899 8.899 8.450 0.449 19823 49 1 2 . 1 1 12 12 SER HA H 12 4.724 4.724 4.418 0.306 19823 50 1 2 . 1 1 12 12 SER H H 12 8.304 8.304 8.020 0.284 19823 51 1 2 . 1 1 13 13 SER HA H 13 4.660 4.660 4.353 0.307 19823 52 1 2 . 1 1 13 13 SER H H 13 7.669 7.669 7.569 0.100 19823 53 1 2 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.364 0.122 19823 54 1 2 . 1 1 14 14 GLN H H 14 8.919 8.919 8.383 0.536 19823 55 1 2 . 1 1 15 15 THR HA H 15 4.646 4.646 4.558 0.088 19823 56 1 2 . 1 1 15 15 THR H H 15 7.464 7.464 7.333 0.131 19823 57 1 2 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.935 0.200 19823 58 1 2 . 1 1 16 16 TYR H H 16 8.053 8.053 7.876 0.177 19823 59 1 2 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.042 0.445 19823 60 1 2 . 1 1 17 17 TRP H H 17 9.348 9.348 8.184 1.164 19823 61 1 3 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.614 0.277 19823 62 1 3 . 1 1 2 2 ILE H H 2 9.084 9.084 7.779 1.305 19823 63 1 3 . 1 1 3 3 GLY H H 3 8.699 8.699 8.063 0.636 19823 64 1 3 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.728 0.422 19823 65 1 3 . 1 1 4 4 ASP H H 4 8.972 8.972 8.597 0.375 19823 66 1 3 . 1 1 5 5 SER HA H 5 3.235 3.235 4.329 -1.094 19823 67 1 3 . 1 1 5 5 SER H H 5 7.597 7.597 7.753 -0.156 19823 68 1 3 . 1 1 6 6 GLY H H 6 8.185 8.185 8.340 -0.155 19823 69 1 3 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.605 0.233 19823 70 1 3 . 1 1 7 7 LEU H H 7 9.402 9.402 7.939 1.463 19823 71 1 3 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.683 0.320 19823 72 1 3 . 1 1 8 8 ARG H H 8 8.869 8.869 8.820 0.049 19823 73 1 3 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.830 -0.448 19823 74 1 3 . 1 1 9 9 GLU H H 9 7.985 7.985 8.302 -0.317 19823 75 1 3 . 1 1 10 10 SER HA H 10 4.685 4.685 4.767 -0.082 19823 76 1 3 . 1 1 10 10 SER H H 10 7.851 7.851 7.607 0.244 19823 77 1 3 . 1 1 11 11 MET HA H 11 4.569 4.569 4.279 0.290 19823 78 1 3 . 1 1 11 11 MET H H 11 8.899 8.899 8.504 0.395 19823 79 1 3 . 1 1 12 12 SER HA H 12 4.724 4.724 4.448 0.276 19823 80 1 3 . 1 1 12 12 SER H H 12 8.304 8.304 7.997 0.307 19823 81 1 3 . 1 1 13 13 SER HA H 13 4.660 4.660 4.370 0.290 19823 82 1 3 . 1 1 13 13 SER H H 13 7.669 7.669 7.603 0.066 19823 83 1 3 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.312 0.174 19823 84 1 3 . 1 1 14 14 GLN H H 14 8.919 8.919 8.558 0.361 19823 85 1 3 . 1 1 15 15 THR HA H 15 4.646 4.646 4.429 0.217 19823 86 1 3 . 1 1 15 15 THR H H 15 7.464 7.464 7.235 0.229 19823 87 1 3 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.997 0.138 19823 88 1 3 . 1 1 16 16 TYR H H 16 8.053 8.053 8.046 0.007 19823 89 1 3 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.020 0.467 19823 90 1 3 . 1 1 17 17 TRP H H 17 9.348 9.348 8.177 1.171 19823 91 1 4 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.604 0.287 19823 92 1 4 . 1 1 2 2 ILE H H 2 9.084 9.084 8.049 1.035 19823 93 1 4 . 1 1 3 3 GLY H H 3 8.699 8.699 8.115 0.584 19823 94 1 4 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.706 0.444 19823 95 1 4 . 1 1 4 4 ASP H H 4 8.972 8.972 8.562 0.410 19823 96 1 4 . 1 1 5 5 SER HA H 5 3.235 3.235 4.320 -1.085 19823 97 1 4 . 1 1 5 5 SER H H 5 7.597 7.597 7.659 -0.062 19823 98 1 4 . 1 1 6 6 GLY H H 6 8.185 8.185 8.327 -0.142 19823 99 1 4 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.601 0.237 19823 100 1 4 . 1 1 7 7 LEU H H 7 9.402 9.402 7.935 1.467 19823 101 1 4 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.747 0.256 19823 102 1 4 . 1 1 8 8 ARG H H 8 8.869 8.869 8.798 0.071 19823 103 1 4 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.776 -0.394 19823 104 1 4 . 1 1 9 9 GLU H H 9 7.985 7.985 8.160 -0.175 19823 105 1 4 . 1 1 10 10 SER HA H 10 4.685 4.685 4.664 0.021 19823 106 1 4 . 1 1 10 10 SER H H 10 7.851 7.851 7.570 0.281 19823 107 1 4 . 1 1 11 11 MET HA H 11 4.569 4.569 4.424 0.145 19823 108 1 4 . 1 1 11 11 MET H H 11 8.899 8.899 8.484 0.415 19823 109 1 4 . 1 1 12 12 SER HA H 12 4.724 4.724 4.479 0.245 19823 110 1 4 . 1 1 12 12 SER H H 12 8.304 8.304 7.981 0.323 19823 111 1 4 . 1 1 13 13 SER HA H 13 4.660 4.660 4.348 0.312 19823 112 1 4 . 1 1 13 13 SER H H 13 7.669 7.669 8.123 -0.454 19823 113 1 4 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.370 0.116 19823 114 1 4 . 1 1 14 14 GLN H H 14 8.919 8.919 8.423 0.496 19823 115 1 4 . 1 1 15 15 THR HA H 15 4.646 4.646 4.429 0.217 19823 116 1 4 . 1 1 15 15 THR H H 15 7.464 7.464 7.170 0.294 19823 117 1 4 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.945 0.190 19823 118 1 4 . 1 1 16 16 TYR H H 16 8.053 8.053 7.877 0.176 19823 119 1 4 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.032 0.455 19823 120 1 4 . 1 1 17 17 TRP H H 17 9.348 9.348 8.172 1.176 19823 121 1 5 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.553 0.338 19823 122 1 5 . 1 1 2 2 ILE H H 2 9.084 9.084 7.899 1.185 19823 123 1 5 . 1 1 3 3 GLY H H 3 8.699 8.699 8.058 0.641 19823 124 1 5 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.761 0.389 19823 125 1 5 . 1 1 4 4 ASP H H 4 8.972 8.972 8.679 0.293 19823 126 1 5 . 1 1 5 5 SER HA H 5 3.235 3.235 4.317 -1.082 19823 127 1 5 . 1 1 5 5 SER H H 5 7.597 7.597 7.691 -0.094 19823 128 1 5 . 1 1 6 6 GLY H H 6 8.185 8.185 8.350 -0.165 19823 129 1 5 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.693 0.145 19823 130 1 5 . 1 1 7 7 LEU H H 7 9.402 9.402 7.942 1.460 19823 131 1 5 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.742 0.261 19823 132 1 5 . 1 1 8 8 ARG H H 8 8.869 8.869 8.743 0.126 19823 133 1 5 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.743 -0.361 19823 134 1 5 . 1 1 9 9 GLU H H 9 7.985 7.985 8.099 -0.114 19823 135 1 5 . 1 1 10 10 SER HA H 10 4.685 4.685 4.626 0.059 19823 136 1 5 . 1 1 10 10 SER H H 10 7.851 7.851 7.599 0.252 19823 137 1 5 . 1 1 11 11 MET HA H 11 4.569 4.569 4.239 0.330 19823 138 1 5 . 1 1 11 11 MET H H 11 8.899 8.899 8.503 0.396 19823 139 1 5 . 1 1 12 12 SER HA H 12 4.724 4.724 4.406 0.318 19823 140 1 5 . 1 1 12 12 SER H H 12 8.304 8.304 7.968 0.336 19823 141 1 5 . 1 1 13 13 SER HA H 13 4.660 4.660 4.368 0.292 19823 142 1 5 . 1 1 13 13 SER H H 13 7.669 7.669 7.546 0.123 19823 143 1 5 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.315 0.171 19823 144 1 5 . 1 1 14 14 GLN H H 14 8.919 8.919 8.380 0.539 19823 145 1 5 . 1 1 15 15 THR HA H 15 4.646 4.646 4.556 0.090 19823 146 1 5 . 1 1 15 15 THR H H 15 7.464 7.464 7.207 0.257 19823 147 1 5 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.872 0.263 19823 148 1 5 . 1 1 16 16 TYR H H 16 8.053 8.053 7.966 0.087 19823 149 1 5 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.038 0.449 19823 150 1 5 . 1 1 17 17 TRP H H 17 9.348 9.348 8.175 1.173 19823 151 1 6 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.628 0.263 19823 152 1 6 . 1 1 2 2 ILE H H 2 9.084 9.084 8.042 1.042 19823 153 1 6 . 1 1 3 3 GLY H H 3 8.699 8.699 8.082 0.617 19823 154 1 6 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.782 0.368 19823 155 1 6 . 1 1 4 4 ASP H H 4 8.972 8.972 8.650 0.322 19823 156 1 6 . 1 1 5 5 SER HA H 5 3.235 3.235 4.328 -1.093 19823 157 1 6 . 1 1 5 5 SER H H 5 7.597 7.597 7.676 -0.079 19823 158 1 6 . 1 1 6 6 GLY H H 6 8.185 8.185 8.329 -0.144 19823 159 1 6 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.645 0.193 19823 160 1 6 . 1 1 7 7 LEU H H 7 9.402 9.402 7.890 1.512 19823 161 1 6 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.754 0.249 19823 162 1 6 . 1 1 8 8 ARG H H 8 8.869 8.869 8.763 0.106 19823 163 1 6 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.757 -0.375 19823 164 1 6 . 1 1 9 9 GLU H H 9 7.985 7.985 8.181 -0.196 19823 165 1 6 . 1 1 10 10 SER HA H 10 4.685 4.685 4.659 0.026 19823 166 1 6 . 1 1 10 10 SER H H 10 7.851 7.851 7.544 0.307 19823 167 1 6 . 1 1 11 11 MET HA H 11 4.569 4.569 4.381 0.188 19823 168 1 6 . 1 1 11 11 MET H H 11 8.899 8.899 8.410 0.489 19823 169 1 6 . 1 1 12 12 SER HA H 12 4.724 4.724 4.474 0.250 19823 170 1 6 . 1 1 12 12 SER H H 12 8.304 8.304 7.925 0.379 19823 171 1 6 . 1 1 13 13 SER HA H 13 4.660 4.660 4.388 0.272 19823 172 1 6 . 1 1 13 13 SER H H 13 7.669 7.669 8.226 -0.557 19823 173 1 6 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.270 0.216 19823 174 1 6 . 1 1 14 14 GLN H H 14 8.919 8.919 8.666 0.253 19823 175 1 6 . 1 1 15 15 THR HA H 15 4.646 4.646 4.519 0.127 19823 176 1 6 . 1 1 15 15 THR H H 15 7.464 7.464 7.062 0.402 19823 177 1 6 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.937 0.198 19823 178 1 6 . 1 1 16 16 TYR H H 16 8.053 8.053 7.849 0.204 19823 179 1 6 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.031 0.456 19823 180 1 6 . 1 1 17 17 TRP H H 17 9.348 9.348 8.168 1.180 19823 181 1 7 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.515 0.376 19823 182 1 7 . 1 1 2 2 ILE H H 2 9.084 9.084 7.862 1.222 19823 183 1 7 . 1 1 3 3 GLY H H 3 8.699 8.699 8.034 0.665 19823 184 1 7 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.772 0.378 19823 185 1 7 . 1 1 4 4 ASP H H 4 8.972 8.972 8.662 0.310 19823 186 1 7 . 1 1 5 5 SER HA H 5 3.235 3.235 4.334 -1.099 19823 187 1 7 . 1 1 5 5 SER H H 5 7.597 7.597 7.743 -0.146 19823 188 1 7 . 1 1 6 6 GLY H H 6 8.185 8.185 8.366 -0.181 19823 189 1 7 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.605 0.233 19823 190 1 7 . 1 1 7 7 LEU H H 7 9.402 9.402 7.933 1.469 19823 191 1 7 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.672 0.331 19823 192 1 7 . 1 1 8 8 ARG H H 8 8.869 8.869 8.748 0.121 19823 193 1 7 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.803 -0.421 19823 194 1 7 . 1 1 9 9 GLU H H 9 7.985 7.985 8.151 -0.166 19823 195 1 7 . 1 1 10 10 SER HA H 10 4.685 4.685 4.636 0.049 19823 196 1 7 . 1 1 10 10 SER H H 10 7.851 7.851 7.541 0.310 19823 197 1 7 . 1 1 11 11 MET HA H 11 4.569 4.569 4.349 0.220 19823 198 1 7 . 1 1 11 11 MET H H 11 8.899 8.899 8.411 0.488 19823 199 1 7 . 1 1 12 12 SER HA H 12 4.724 4.724 4.381 0.343 19823 200 1 7 . 1 1 12 12 SER H H 12 8.304 8.304 7.846 0.458 19823 201 1 7 . 1 1 13 13 SER HA H 13 4.660 4.660 4.274 0.386 19823 202 1 7 . 1 1 13 13 SER H H 13 7.669 7.669 8.143 -0.474 19823 203 1 7 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.297 0.189 19823 204 1 7 . 1 1 14 14 GLN H H 14 8.919 8.919 8.382 0.537 19823 205 1 7 . 1 1 15 15 THR HA H 15 4.646 4.646 4.568 0.078 19823 206 1 7 . 1 1 15 15 THR H H 15 7.464 7.464 7.317 0.147 19823 207 1 7 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.896 0.239 19823 208 1 7 . 1 1 16 16 TYR H H 16 8.053 8.053 7.918 0.135 19823 209 1 7 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.037 0.450 19823 210 1 7 . 1 1 17 17 TRP H H 17 9.348 9.348 8.164 1.184 19823 211 1 8 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.638 0.253 19823 212 1 8 . 1 1 2 2 ILE H H 2 9.084 9.084 7.798 1.286 19823 213 1 8 . 1 1 3 3 GLY H H 3 8.699 8.699 8.079 0.620 19823 214 1 8 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.786 0.364 19823 215 1 8 . 1 1 4 4 ASP H H 4 8.972 8.972 8.659 0.313 19823 216 1 8 . 1 1 5 5 SER HA H 5 3.235 3.235 4.358 -1.123 19823 217 1 8 . 1 1 5 5 SER H H 5 7.597 7.597 7.775 -0.178 19823 218 1 8 . 1 1 6 6 GLY H H 6 8.185 8.185 8.361 -0.176 19823 219 1 8 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.642 0.196 19823 220 1 8 . 1 1 7 7 LEU H H 7 9.402 9.402 7.894 1.508 19823 221 1 8 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.755 0.248 19823 222 1 8 . 1 1 8 8 ARG H H 8 8.869 8.869 8.774 0.095 19823 223 1 8 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.717 -0.335 19823 224 1 8 . 1 1 9 9 GLU H H 9 7.985 7.985 8.286 -0.301 19823 225 1 8 . 1 1 10 10 SER HA H 10 4.685 4.685 4.649 0.036 19823 226 1 8 . 1 1 10 10 SER H H 10 7.851 7.851 7.542 0.309 19823 227 1 8 . 1 1 11 11 MET HA H 11 4.569 4.569 4.360 0.209 19823 228 1 8 . 1 1 11 11 MET H H 11 8.899 8.899 8.619 0.280 19823 229 1 8 . 1 1 12 12 SER HA H 12 4.724 4.724 4.430 0.294 19823 230 1 8 . 1 1 12 12 SER H H 12 8.304 8.304 7.916 0.388 19823 231 1 8 . 1 1 13 13 SER HA H 13 4.660 4.660 4.335 0.325 19823 232 1 8 . 1 1 13 13 SER H H 13 7.669 7.669 8.188 -0.519 19823 233 1 8 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.246 0.240 19823 234 1 8 . 1 1 14 14 GLN H H 14 8.919 8.919 8.557 0.362 19823 235 1 8 . 1 1 15 15 THR HA H 15 4.646 4.646 4.555 0.091 19823 236 1 8 . 1 1 15 15 THR H H 15 7.464 7.464 7.188 0.276 19823 237 1 8 . 1 1 16 16 TYR HA H 16 5.135 5.135 5.006 0.129 19823 238 1 8 . 1 1 16 16 TYR H H 16 8.053 8.053 8.004 0.049 19823 239 1 8 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.015 0.472 19823 240 1 8 . 1 1 17 17 TRP H H 17 9.348 9.348 8.189 1.159 19823 241 1 9 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.631 0.260 19823 242 1 9 . 1 1 2 2 ILE H H 2 9.084 9.084 8.049 1.035 19823 243 1 9 . 1 1 3 3 GLY H H 3 8.699 8.699 8.078 0.621 19823 244 1 9 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.723 0.427 19823 245 1 9 . 1 1 4 4 ASP H H 4 8.972 8.972 8.545 0.427 19823 246 1 9 . 1 1 5 5 SER HA H 5 3.235 3.235 4.340 -1.105 19823 247 1 9 . 1 1 5 5 SER H H 5 7.597 7.597 7.778 -0.181 19823 248 1 9 . 1 1 6 6 GLY H H 6 8.185 8.185 8.386 -0.201 19823 249 1 9 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.635 0.203 19823 250 1 9 . 1 1 7 7 LEU H H 7 9.402 9.402 8.008 1.394 19823 251 1 9 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.732 0.271 19823 252 1 9 . 1 1 8 8 ARG H H 8 8.869 8.869 8.787 0.082 19823 253 1 9 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.785 -0.403 19823 254 1 9 . 1 1 9 9 GLU H H 9 7.985 7.985 8.225 -0.240 19823 255 1 9 . 1 1 10 10 SER HA H 10 4.685 4.685 4.679 0.006 19823 256 1 9 . 1 1 10 10 SER H H 10 7.851 7.851 7.641 0.210 19823 257 1 9 . 1 1 11 11 MET HA H 11 4.569 4.569 4.418 0.151 19823 258 1 9 . 1 1 11 11 MET H H 11 8.899 8.899 8.660 0.239 19823 259 1 9 . 1 1 12 12 SER HA H 12 4.724 4.724 4.423 0.301 19823 260 1 9 . 1 1 12 12 SER H H 12 8.304 8.304 7.948 0.356 19823 261 1 9 . 1 1 13 13 SER HA H 13 4.660 4.660 4.348 0.312 19823 262 1 9 . 1 1 13 13 SER H H 13 7.669 7.669 8.168 -0.499 19823 263 1 9 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.294 0.192 19823 264 1 9 . 1 1 14 14 GLN H H 14 8.919 8.919 8.496 0.423 19823 265 1 9 . 1 1 15 15 THR HA H 15 4.646 4.646 4.463 0.183 19823 266 1 9 . 1 1 15 15 THR H H 15 7.464 7.464 7.395 0.069 19823 267 1 9 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.919 0.216 19823 268 1 9 . 1 1 16 16 TYR H H 16 8.053 8.053 7.904 0.149 19823 269 1 9 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.028 0.459 19823 270 1 9 . 1 1 17 17 TRP H H 17 9.348 9.348 8.167 1.181 19823 271 1 10 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.536 0.355 19823 272 1 10 . 1 1 2 2 ILE H H 2 9.084 9.084 7.812 1.272 19823 273 1 10 . 1 1 3 3 GLY H H 3 8.699 8.699 8.110 0.589 19823 274 1 10 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.646 0.504 19823 275 1 10 . 1 1 4 4 ASP H H 4 8.972 8.972 8.481 0.491 19823 276 1 10 . 1 1 5 5 SER HA H 5 3.235 3.235 4.207 -0.972 19823 277 1 10 . 1 1 5 5 SER H H 5 7.597 7.597 7.679 -0.082 19823 278 1 10 . 1 1 6 6 GLY H H 6 8.185 8.185 8.315 -0.130 19823 279 1 10 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.641 0.197 19823 280 1 10 . 1 1 7 7 LEU H H 7 9.402 9.402 7.883 1.519 19823 281 1 10 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.851 0.152 19823 282 1 10 . 1 1 8 8 ARG H H 8 8.869 8.869 8.767 0.102 19823 283 1 10 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.800 -0.418 19823 284 1 10 . 1 1 9 9 GLU H H 9 7.985 7.985 8.191 -0.206 19823 285 1 10 . 1 1 10 10 SER HA H 10 4.685 4.685 4.622 0.063 19823 286 1 10 . 1 1 10 10 SER H H 10 7.851 7.851 7.707 0.144 19823 287 1 10 . 1 1 11 11 MET HA H 11 4.569 4.569 4.295 0.274 19823 288 1 10 . 1 1 11 11 MET H H 11 8.899 8.899 8.825 0.074 19823 289 1 10 . 1 1 12 12 SER HA H 12 4.724 4.724 4.384 0.340 19823 290 1 10 . 1 1 12 12 SER H H 12 8.304 8.304 8.141 0.163 19823 291 1 10 . 1 1 13 13 SER HA H 13 4.660 4.660 4.407 0.253 19823 292 1 10 . 1 1 13 13 SER H H 13 7.669 7.669 7.592 0.077 19823 293 1 10 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.357 0.129 19823 294 1 10 . 1 1 14 14 GLN H H 14 8.919 8.919 8.422 0.497 19823 295 1 10 . 1 1 15 15 THR HA H 15 4.646 4.646 4.539 0.107 19823 296 1 10 . 1 1 15 15 THR H H 15 7.464 7.464 7.251 0.213 19823 297 1 10 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.954 0.181 19823 298 1 10 . 1 1 16 16 TYR H H 16 8.053 8.053 7.871 0.182 19823 299 1 10 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.046 0.441 19823 300 1 10 . 1 1 17 17 TRP H H 17 9.348 9.348 8.180 1.168 19823 301 1 11 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.554 0.337 19823 302 1 11 . 1 1 2 2 ILE H H 2 9.084 9.084 7.904 1.180 19823 303 1 11 . 1 1 3 3 GLY H H 3 8.699 8.699 8.139 0.560 19823 304 1 11 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.810 0.340 19823 305 1 11 . 1 1 4 4 ASP H H 4 8.972 8.972 8.656 0.316 19823 306 1 11 . 1 1 5 5 SER HA H 5 3.235 3.235 4.344 -1.109 19823 307 1 11 . 1 1 5 5 SER H H 5 7.597 7.597 7.575 0.022 19823 308 1 11 . 1 1 6 6 GLY H H 6 8.185 8.185 8.330 -0.145 19823 309 1 11 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.609 0.229 19823 310 1 11 . 1 1 7 7 LEU H H 7 9.402 9.402 7.923 1.479 19823 311 1 11 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.743 0.260 19823 312 1 11 . 1 1 8 8 ARG H H 8 8.869 8.869 8.800 0.069 19823 313 1 11 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.686 -0.304 19823 314 1 11 . 1 1 9 9 GLU H H 9 7.985 7.985 8.137 -0.152 19823 315 1 11 . 1 1 10 10 SER HA H 10 4.685 4.685 4.621 0.064 19823 316 1 11 . 1 1 10 10 SER H H 10 7.851 7.851 7.583 0.268 19823 317 1 11 . 1 1 11 11 MET HA H 11 4.569 4.569 4.294 0.275 19823 318 1 11 . 1 1 11 11 MET H H 11 8.899 8.899 8.335 0.564 19823 319 1 11 . 1 1 12 12 SER HA H 12 4.724 4.724 4.411 0.313 19823 320 1 11 . 1 1 12 12 SER H H 12 8.304 8.304 7.808 0.496 19823 321 1 11 . 1 1 13 13 SER HA H 13 4.660 4.660 4.388 0.272 19823 322 1 11 . 1 1 13 13 SER H H 13 7.669 7.669 7.585 0.084 19823 323 1 11 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.285 0.201 19823 324 1 11 . 1 1 14 14 GLN H H 14 8.919 8.919 8.431 0.488 19823 325 1 11 . 1 1 15 15 THR HA H 15 4.646 4.646 4.514 0.132 19823 326 1 11 . 1 1 15 15 THR H H 15 7.464 7.464 7.264 0.200 19823 327 1 11 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.907 0.228 19823 328 1 11 . 1 1 16 16 TYR H H 16 8.053 8.053 7.964 0.089 19823 329 1 11 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.023 0.464 19823 330 1 11 . 1 1 17 17 TRP H H 17 9.348 9.348 8.206 1.142 19823 331 1 12 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.602 0.289 19823 332 1 12 . 1 1 2 2 ILE H H 2 9.084 9.084 8.047 1.037 19823 333 1 12 . 1 1 3 3 GLY H H 3 8.699 8.699 8.020 0.679 19823 334 1 12 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.774 0.376 19823 335 1 12 . 1 1 4 4 ASP H H 4 8.972 8.972 8.686 0.286 19823 336 1 12 . 1 1 5 5 SER HA H 5 3.235 3.235 4.338 -1.103 19823 337 1 12 . 1 1 5 5 SER H H 5 7.597 7.597 7.592 0.005 19823 338 1 12 . 1 1 6 6 GLY H H 6 8.185 8.185 8.340 -0.155 19823 339 1 12 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.637 0.201 19823 340 1 12 . 1 1 7 7 LEU H H 7 9.402 9.402 7.920 1.482 19823 341 1 12 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.753 0.250 19823 342 1 12 . 1 1 8 8 ARG H H 8 8.869 8.869 8.739 0.130 19823 343 1 12 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.800 -0.418 19823 344 1 12 . 1 1 9 9 GLU H H 9 7.985 7.985 8.118 -0.133 19823 345 1 12 . 1 1 10 10 SER HA H 10 4.685 4.685 4.617 0.068 19823 346 1 12 . 1 1 10 10 SER H H 10 7.851 7.851 7.695 0.156 19823 347 1 12 . 1 1 11 11 MET HA H 11 4.569 4.569 4.372 0.197 19823 348 1 12 . 1 1 11 11 MET H H 11 8.899 8.899 8.709 0.190 19823 349 1 12 . 1 1 12 12 SER HA H 12 4.724 4.724 4.438 0.286 19823 350 1 12 . 1 1 12 12 SER H H 12 8.304 8.304 7.955 0.349 19823 351 1 12 . 1 1 13 13 SER HA H 13 4.660 4.660 4.472 0.188 19823 352 1 12 . 1 1 13 13 SER H H 13 7.669 7.669 7.618 0.051 19823 353 1 12 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.429 0.057 19823 354 1 12 . 1 1 14 14 GLN H H 14 8.919 8.919 8.409 0.510 19823 355 1 12 . 1 1 15 15 THR HA H 15 4.646 4.646 4.576 0.070 19823 356 1 12 . 1 1 15 15 THR H H 15 7.464 7.464 7.326 0.138 19823 357 1 12 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.893 0.242 19823 358 1 12 . 1 1 16 16 TYR H H 16 8.053 8.053 7.887 0.166 19823 359 1 12 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.056 0.431 19823 360 1 12 . 1 1 17 17 TRP H H 17 9.348 9.348 8.252 1.096 19823 361 1 13 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.614 0.277 19823 362 1 13 . 1 1 2 2 ILE H H 2 9.084 9.084 7.765 1.319 19823 363 1 13 . 1 1 3 3 GLY H H 3 8.699 8.699 8.205 0.494 19823 364 1 13 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.644 0.506 19823 365 1 13 . 1 1 4 4 ASP H H 4 8.972 8.972 8.482 0.490 19823 366 1 13 . 1 1 5 5 SER HA H 5 3.235 3.235 4.290 -1.055 19823 367 1 13 . 1 1 5 5 SER H H 5 7.597 7.597 7.752 -0.155 19823 368 1 13 . 1 1 6 6 GLY H H 6 8.185 8.185 8.339 -0.154 19823 369 1 13 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.631 0.207 19823 370 1 13 . 1 1 7 7 LEU H H 7 9.402 9.402 7.890 1.512 19823 371 1 13 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.751 0.252 19823 372 1 13 . 1 1 8 8 ARG H H 8 8.869 8.869 8.820 0.049 19823 373 1 13 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.792 -0.410 19823 374 1 13 . 1 1 9 9 GLU H H 9 7.985 7.985 8.290 -0.305 19823 375 1 13 . 1 1 10 10 SER HA H 10 4.685 4.685 4.635 0.050 19823 376 1 13 . 1 1 10 10 SER H H 10 7.851 7.851 7.623 0.228 19823 377 1 13 . 1 1 11 11 MET HA H 11 4.569 4.569 4.295 0.274 19823 378 1 13 . 1 1 11 11 MET H H 11 8.899 8.899 8.505 0.394 19823 379 1 13 . 1 1 12 12 SER HA H 12 4.724 4.724 4.319 0.405 19823 380 1 13 . 1 1 12 12 SER H H 12 8.304 8.304 7.996 0.308 19823 381 1 13 . 1 1 13 13 SER HA H 13 4.660 4.660 4.360 0.300 19823 382 1 13 . 1 1 13 13 SER H H 13 7.669 7.669 7.587 0.082 19823 383 1 13 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.303 0.183 19823 384 1 13 . 1 1 14 14 GLN H H 14 8.919 8.919 8.366 0.553 19823 385 1 13 . 1 1 15 15 THR HA H 15 4.646 4.646 4.581 0.065 19823 386 1 13 . 1 1 15 15 THR H H 15 7.464 7.464 7.352 0.112 19823 387 1 13 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.995 0.140 19823 388 1 13 . 1 1 16 16 TYR H H 16 8.053 8.053 8.094 -0.041 19823 389 1 13 . 1 1 17 17 TRP HA H 17 5.487 5.487 4.999 0.488 19823 390 1 13 . 1 1 17 17 TRP H H 17 9.348 9.348 8.179 1.169 19823 391 1 14 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.557 0.334 19823 392 1 14 . 1 1 2 2 ILE H H 2 9.084 9.084 7.910 1.174 19823 393 1 14 . 1 1 3 3 GLY H H 3 8.699 8.699 8.141 0.558 19823 394 1 14 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.713 0.437 19823 395 1 14 . 1 1 4 4 ASP H H 4 8.972 8.972 8.641 0.331 19823 396 1 14 . 1 1 5 5 SER HA H 5 3.235 3.235 4.297 -1.062 19823 397 1 14 . 1 1 5 5 SER H H 5 7.597 7.597 7.628 -0.031 19823 398 1 14 . 1 1 6 6 GLY H H 6 8.185 8.185 8.320 -0.135 19823 399 1 14 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.580 0.258 19823 400 1 14 . 1 1 7 7 LEU H H 7 9.402 9.402 7.949 1.453 19823 401 1 14 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.878 0.125 19823 402 1 14 . 1 1 8 8 ARG H H 8 8.869 8.869 8.812 0.057 19823 403 1 14 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.700 -0.318 19823 404 1 14 . 1 1 9 9 GLU H H 9 7.985 7.985 8.066 -0.081 19823 405 1 14 . 1 1 10 10 SER HA H 10 4.685 4.685 4.742 -0.057 19823 406 1 14 . 1 1 10 10 SER H H 10 7.851 7.851 7.610 0.241 19823 407 1 14 . 1 1 11 11 MET HA H 11 4.569 4.569 4.311 0.258 19823 408 1 14 . 1 1 11 11 MET H H 11 8.899 8.899 8.500 0.399 19823 409 1 14 . 1 1 12 12 SER HA H 12 4.724 4.724 4.472 0.252 19823 410 1 14 . 1 1 12 12 SER H H 12 8.304 8.304 8.039 0.265 19823 411 1 14 . 1 1 13 13 SER HA H 13 4.660 4.660 4.372 0.288 19823 412 1 14 . 1 1 13 13 SER H H 13 7.669 7.669 7.579 0.091 19823 413 1 14 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.278 0.208 19823 414 1 14 . 1 1 14 14 GLN H H 14 8.919 8.919 8.272 0.647 19823 415 1 14 . 1 1 15 15 THR HA H 15 4.646 4.646 4.562 0.084 19823 416 1 14 . 1 1 15 15 THR H H 15 7.464 7.464 7.250 0.214 19823 417 1 14 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.938 0.197 19823 418 1 14 . 1 1 16 16 TYR H H 16 8.053 8.053 7.890 0.163 19823 419 1 14 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.042 0.445 19823 420 1 14 . 1 1 17 17 TRP H H 17 9.348 9.348 8.178 1.170 19823 421 1 15 . 1 1 2 2 ILE HA H 2 4.891 4.891 4.559 0.332 19823 422 1 15 . 1 1 2 2 ILE H H 2 9.084 9.084 7.882 1.202 19823 423 1 15 . 1 1 3 3 GLY H H 3 8.699 8.699 8.079 0.620 19823 424 1 15 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.720 0.430 19823 425 1 15 . 1 1 4 4 ASP H H 4 8.972 8.972 8.639 0.333 19823 426 1 15 . 1 1 5 5 SER HA H 5 3.235 3.235 4.310 -1.075 19823 427 1 15 . 1 1 5 5 SER H H 5 7.597 7.597 7.659 -0.062 19823 428 1 15 . 1 1 6 6 GLY H H 6 8.185 8.185 8.322 -0.137 19823 429 1 15 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.621 0.217 19823 430 1 15 . 1 1 7 7 LEU H H 7 9.402 9.402 7.917 1.485 19823 431 1 15 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.930 0.073 19823 432 1 15 . 1 1 8 8 ARG H H 8 8.869 8.869 8.763 0.106 19823 433 1 15 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.701 -0.319 19823 434 1 15 . 1 1 9 9 GLU H H 9 7.985 7.985 8.053 -0.068 19823 435 1 15 . 1 1 10 10 SER HA H 10 4.685 4.685 4.747 -0.062 19823 436 1 15 . 1 1 10 10 SER H H 10 7.851 7.851 7.578 0.273 19823 437 1 15 . 1 1 11 11 MET HA H 11 4.569 4.569 4.259 0.310 19823 438 1 15 . 1 1 11 11 MET H H 11 8.899 8.899 8.419 0.480 19823 439 1 15 . 1 1 12 12 SER HA H 12 4.724 4.724 4.407 0.317 19823 440 1 15 . 1 1 12 12 SER H H 12 8.304 8.304 7.873 0.431 19823 441 1 15 . 1 1 13 13 SER HA H 13 4.660 4.660 4.307 0.353 19823 442 1 15 . 1 1 13 13 SER H H 13 7.669 7.669 7.594 0.075 19823 443 1 15 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.265 0.221 19823 444 1 15 . 1 1 14 14 GLN H H 14 8.919 8.919 8.359 0.560 19823 445 1 15 . 1 1 15 15 THR HA H 15 4.646 4.646 4.492 0.154 19823 446 1 15 . 1 1 15 15 THR H H 15 7.464 7.464 7.377 0.087 19823 447 1 15 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.977 0.158 19823 448 1 15 . 1 1 16 16 TYR H H 16 8.053 8.053 7.864 0.189 19823 449 1 15 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.046 0.441 19823 450 1 15 . 1 1 17 17 TRP H H 17 9.348 9.348 8.210 1.138 19823 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 19823 2 1 1 "Average Difference" HA 18 0.396 -0.055 0.404 19823 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19823 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19823 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19823 6 1 1 "Average Difference" HN 16 0.597 -0.363 0.490 19823 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19823 8 1 2 "Average Difference" HA 18 0.389 -0.064 0.395 19823 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19823 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19823 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19823 12 1 2 "Average Difference" HN 16 0.596 -0.392 0.464 19823 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19823 14 1 3 "Average Difference" HA 18 0.414 -0.068 0.421 19823 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19823 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19823 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19823 18 1 3 "Average Difference" HN 16 0.633 -0.374 0.528 19823 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19823 20 1 4 "Average Difference" HA 18 0.401 -0.070 0.406 19823 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19823 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19823 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19823 24 1 4 "Average Difference" HN 16 0.617 -0.368 0.512 19823 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19823 26 1 5 "Average Difference" HA 18 0.407 -0.083 0.411 19823 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19823 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19823 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19823 30 1 5 "Average Difference" HN 16 0.622 -0.406 0.486 19823 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19823 32 1 6 "Average Difference" HA 18 0.397 -0.064 0.403 19823 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19823 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19823 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19823 36 1 6 "Average Difference" HN 16 0.631 -0.365 0.532 19823 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19823 38 1 7 "Average Difference" HA 18 0.419 -0.085 0.422 19823 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19823 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19823 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19823 42 1 7 "Average Difference" HN 16 0.651 -0.380 0.546 19823 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19823 44 1 8 "Average Difference" HA 18 0.405 -0.066 0.412 19823 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19823 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19823 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19823 48 1 8 "Average Difference" HN 16 0.648 -0.342 0.568 19823 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19823 50 1 9 "Average Difference" HA 18 0.408 -0.076 0.412 19823 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19823 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19823 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19823 54 1 9 "Average Difference" HN 16 0.602 -0.316 0.529 19823 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19823 56 1 10 "Average Difference" HA 18 0.395 -0.074 0.399 19823 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19823 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19823 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19823 60 1 10 "Average Difference" HN 16 0.629 -0.380 0.518 19823 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19823 62 1 11 "Average Difference" HA 18 0.405 -0.080 0.408 19823 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19823 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19823 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19823 66 1 11 "Average Difference" HN 16 0.626 -0.416 0.483 19823 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19823 68 1 12 "Average Difference" HA 18 0.398 -0.052 0.406 19823 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19823 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19823 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19823 72 1 12 "Average Difference" HN 16 0.590 -0.374 0.471 19823 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19823 74 1 13 "Average Difference" HA 18 0.416 -0.081 0.420 19823 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19823 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19823 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19823 78 1 13 "Average Difference" HN 16 0.645 -0.378 0.539 19823 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19823 80 1 14 "Average Difference" HA 18 0.396 -0.064 0.402 19823 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19823 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19823 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19823 84 1 14 "Average Difference" HN 16 0.617 -0.407 0.479 19823 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19823 86 1 15 "Average Difference" HA 18 0.406 -0.069 0.412 19823 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19823 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19823 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19823 90 1 15 "Average Difference" HN 16 0.629 -0.420 0.484 19823 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 19823 _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 ILE HA H 2 4.891 4.891 4.596 0.295 19823 2 1 . 1 1 2 2 ILE H H 2 9.084 9.084 7.932 1.152 19823 3 1 . 1 1 3 3 GLY H H 3 8.699 8.699 8.083 0.616 19823 4 1 . 1 1 4 4 ASP HA H 4 5.150 5.150 4.734 0.416 19823 5 1 . 1 1 4 4 ASP H H 4 8.972 8.972 8.616 0.356 19823 6 1 . 1 1 5 5 SER HA H 5 3.235 3.235 4.313 -1.078 19823 7 1 . 1 1 5 5 SER H H 5 7.597 7.597 7.690 -0.093 19823 8 1 . 1 1 6 6 GLY H H 6 8.185 8.185 8.340 -0.155 19823 9 1 . 1 1 7 7 LEU HA H 7 4.838 4.838 4.626 0.212 19823 10 1 . 1 1 7 7 LEU H H 7 9.402 9.402 7.927 1.475 19823 11 1 . 1 1 8 8 ARG HA H 8 4.003 4.003 3.778 0.225 19823 12 1 . 1 1 8 8 ARG H H 8 8.869 8.869 8.780 0.089 19823 13 1 . 1 1 9 9 GLU HA H 9 3.382 3.382 3.755 -0.373 19823 14 1 . 1 1 9 9 GLU H H 9 7.985 7.985 8.166 -0.181 19823 15 1 . 1 1 10 10 SER HA H 10 4.685 4.685 4.668 0.017 19823 16 1 . 1 1 10 10 SER H H 10 7.851 7.851 7.611 0.240 19823 17 1 . 1 1 11 11 MET HA H 11 4.569 4.569 4.333 0.236 19823 18 1 . 1 1 11 11 MET H H 11 8.899 8.899 8.537 0.362 19823 19 1 . 1 1 12 12 SER HA H 12 4.724 4.724 4.420 0.304 19823 20 1 . 1 1 12 12 SER H H 12 8.304 8.304 7.951 0.353 19823 21 1 . 1 1 13 13 SER HA H 13 4.660 4.660 4.364 0.296 19823 22 1 . 1 1 13 13 SER H H 13 7.669 7.669 7.787 -0.118 19823 23 1 . 1 1 14 14 GLN HA H 14 4.486 4.486 4.315 0.171 19823 24 1 . 1 1 14 14 GLN H H 14 8.919 8.919 8.436 0.483 19823 25 1 . 1 1 15 15 THR HA H 15 4.646 4.646 4.525 0.121 19823 26 1 . 1 1 15 15 THR H H 15 7.464 7.464 7.273 0.191 19823 27 1 . 1 1 16 16 TYR HA H 16 5.135 5.135 4.940 0.195 19823 28 1 . 1 1 16 16 TYR H H 16 8.053 8.053 7.924 0.129 19823 29 1 . 1 1 17 17 TRP HA H 17 5.487 5.487 5.034 0.453 19823 30 1 . 1 1 17 17 TRP H H 17 9.348 9.348 8.187 1.161 19823 stop_ save_