data_18014 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18014 _Entry.PDB_ID 2LKW 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 18014 _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 GLN HA H 2 4.248 4.248 4.546 -0.298 18014 2 1 1 . 1 1 2 2 GLN H H 2 8.473 8.473 8.206 0.267 18014 3 1 1 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.921 0.299 18014 4 1 1 . 1 1 3 3 ARG H H 3 8.504 8.504 8.083 0.421 18014 5 1 1 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.881 -0.181 18014 6 1 1 . 1 1 4 4 HIS H H 4 8.674 8.674 8.174 0.500 18014 7 1 1 . 1 1 5 5 SER HA H 5 4.411 4.411 4.400 0.011 18014 8 1 1 . 1 1 5 5 SER H H 5 8.495 8.495 8.440 0.055 18014 9 1 1 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.994 0.171 18014 10 1 1 . 1 1 6 6 ILE H H 6 8.424 8.424 8.199 0.225 18014 11 1 1 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.212 -0.197 18014 12 1 1 . 1 1 7 7 VAL H H 7 8.366 8.366 8.371 -0.005 18014 13 1 1 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.678 -0.133 18014 14 1 1 . 1 1 8 8 GLN H H 8 8.653 8.653 8.628 0.025 18014 15 1 1 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.654 0.003 18014 16 1 1 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.562 -0.208 18014 17 1 1 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.616 -0.095 18014 18 1 1 . 1 1 11 11 ALA H H 11 8.466 8.466 8.399 0.067 18014 19 1 1 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.790 -0.123 18014 20 1 1 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.522 0.135 18014 21 1 1 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.525 -0.186 18014 22 1 1 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.652 -0.114 18014 23 1 1 . 1 1 15 15 ASN H H 15 8.482 8.482 8.525 -0.043 18014 24 1 1 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.128 0.053 18014 25 1 1 . 1 1 16 16 ALA H H 16 8.281 8.281 8.046 0.235 18014 26 1 1 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.337 0.190 18014 27 1 1 . 1 1 17 17 PHE H H 17 8.266 8.266 6.769 1.497 18014 28 1 1 . 1 1 18 18 VAL HA H 18 3.950 3.950 3.761 0.189 18014 29 1 1 . 1 1 18 18 VAL H H 18 7.923 7.923 8.399 -0.476 18014 30 1 1 . 1 1 19 19 GLU HA H 19 4.280 4.280 3.927 0.353 18014 31 1 1 . 1 1 19 19 GLU H H 19 8.433 8.433 8.848 -0.415 18014 32 1 2 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.391 -0.143 18014 33 1 2 . 1 1 2 2 GLN H H 2 8.473 8.473 8.301 0.172 18014 34 1 2 . 1 1 3 3 ARG HA H 3 4.220 4.220 4.453 -0.233 18014 35 1 2 . 1 1 3 3 ARG H H 3 8.504 8.504 7.988 0.516 18014 36 1 2 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.763 -0.063 18014 37 1 2 . 1 1 4 4 HIS H H 4 8.674 8.674 8.638 0.036 18014 38 1 2 . 1 1 5 5 SER HA H 5 4.411 4.411 4.442 -0.031 18014 39 1 2 . 1 1 5 5 SER H H 5 8.495 8.495 8.174 0.321 18014 40 1 2 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.724 0.441 18014 41 1 2 . 1 1 6 6 ILE H H 6 8.424 8.424 8.091 0.333 18014 42 1 2 . 1 1 7 7 VAL HA H 7 4.015 4.015 3.789 0.226 18014 43 1 2 . 1 1 7 7 VAL H H 7 8.366 8.366 7.801 0.565 18014 44 1 2 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.800 -0.255 18014 45 1 2 . 1 1 8 8 GLN H H 8 8.653 8.653 8.387 0.266 18014 46 1 2 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.668 -0.011 18014 47 1 2 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.569 -0.215 18014 48 1 2 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.621 -0.100 18014 49 1 2 . 1 1 11 11 ALA H H 11 8.466 8.466 8.405 0.061 18014 50 1 2 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.797 -0.130 18014 51 1 2 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.520 0.137 18014 52 1 2 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.512 -0.173 18014 53 1 2 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.394 0.144 18014 54 1 2 . 1 1 15 15 ASN H H 15 8.482 8.482 8.519 -0.037 18014 55 1 2 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.337 -0.156 18014 56 1 2 . 1 1 16 16 ALA H H 16 8.281 8.281 8.319 -0.038 18014 57 1 2 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.426 0.101 18014 58 1 2 . 1 1 17 17 PHE H H 17 8.266 8.266 6.761 1.505 18014 59 1 2 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.332 -0.382 18014 60 1 2 . 1 1 18 18 VAL H H 18 7.923 7.923 8.273 -0.350 18014 61 1 2 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.801 -0.521 18014 62 1 2 . 1 1 19 19 GLU H H 19 8.433 8.433 8.442 -0.009 18014 63 1 3 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.477 -0.229 18014 64 1 3 . 1 1 2 2 GLN H H 2 8.473 8.473 8.522 -0.049 18014 65 1 3 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.863 0.357 18014 66 1 3 . 1 1 3 3 ARG H H 3 8.504 8.504 8.022 0.482 18014 67 1 3 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.710 -0.010 18014 68 1 3 . 1 1 4 4 HIS H H 4 8.674 8.674 8.128 0.546 18014 69 1 3 . 1 1 5 5 SER HA H 5 4.411 4.411 4.435 -0.024 18014 70 1 3 . 1 1 5 5 SER H H 5 8.495 8.495 8.477 0.018 18014 71 1 3 . 1 1 6 6 ILE HA H 6 4.165 4.165 4.021 0.144 18014 72 1 3 . 1 1 6 6 ILE H H 6 8.424 8.424 8.305 0.119 18014 73 1 3 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.179 -0.164 18014 74 1 3 . 1 1 7 7 VAL H H 7 8.366 8.366 8.579 -0.213 18014 75 1 3 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.680 -0.135 18014 76 1 3 . 1 1 8 8 GLN H H 8 8.653 8.653 8.105 0.548 18014 77 1 3 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.660 -0.003 18014 78 1 3 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.569 -0.215 18014 79 1 3 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.621 -0.100 18014 80 1 3 . 1 1 11 11 ALA H H 11 8.466 8.466 8.406 0.060 18014 81 1 3 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.811 -0.144 18014 82 1 3 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.551 0.106 18014 83 1 3 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.559 -0.220 18014 84 1 3 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.644 -0.106 18014 85 1 3 . 1 1 15 15 ASN H H 15 8.482 8.482 8.569 -0.087 18014 86 1 3 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.309 -0.128 18014 87 1 3 . 1 1 16 16 ALA H H 16 8.281 8.281 8.670 -0.389 18014 88 1 3 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.744 -0.217 18014 89 1 3 . 1 1 17 17 PHE H H 17 8.266 8.266 7.891 0.375 18014 90 1 3 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.436 -0.486 18014 91 1 3 . 1 1 18 18 VAL H H 18 7.923 7.923 8.474 -0.551 18014 92 1 3 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.153 0.127 18014 93 1 3 . 1 1 19 19 GLU H H 19 8.433 8.433 8.683 -0.250 18014 94 1 4 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.433 -0.185 18014 95 1 4 . 1 1 2 2 GLN H H 2 8.473 8.473 8.054 0.419 18014 96 1 4 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.906 0.314 18014 97 1 4 . 1 1 3 3 ARG H H 3 8.504 8.504 8.377 0.127 18014 98 1 4 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.182 0.518 18014 99 1 4 . 1 1 4 4 HIS H H 4 8.674 8.674 7.583 1.091 18014 100 1 4 . 1 1 5 5 SER HA H 5 4.411 4.411 4.522 -0.111 18014 101 1 4 . 1 1 5 5 SER H H 5 8.495 8.495 8.497 -0.002 18014 102 1 4 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.767 0.398 18014 103 1 4 . 1 1 6 6 ILE H H 6 8.424 8.424 7.953 0.471 18014 104 1 4 . 1 1 7 7 VAL HA H 7 4.015 4.015 3.850 0.165 18014 105 1 4 . 1 1 7 7 VAL H H 7 8.366 8.366 7.820 0.546 18014 106 1 4 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.813 -0.268 18014 107 1 4 . 1 1 8 8 GLN H H 8 8.653 8.653 8.424 0.229 18014 108 1 4 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.683 -0.026 18014 109 1 4 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.576 -0.222 18014 110 1 4 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.628 -0.107 18014 111 1 4 . 1 1 11 11 ALA H H 11 8.466 8.466 8.408 0.058 18014 112 1 4 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.796 -0.129 18014 113 1 4 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.545 0.112 18014 114 1 4 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.499 -0.160 18014 115 1 4 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.554 -0.016 18014 116 1 4 . 1 1 15 15 ASN H H 15 8.482 8.482 8.776 -0.294 18014 117 1 4 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.526 -0.345 18014 118 1 4 . 1 1 16 16 ALA H H 16 8.281 8.281 8.747 -0.466 18014 119 1 4 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.737 -0.210 18014 120 1 4 . 1 1 17 17 PHE H H 17 8.266 8.266 8.308 -0.042 18014 121 1 4 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.372 -0.422 18014 122 1 4 . 1 1 18 18 VAL H H 18 7.923 7.923 8.398 -0.475 18014 123 1 4 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.484 -0.204 18014 124 1 4 . 1 1 19 19 GLU H H 19 8.433 8.433 8.581 -0.148 18014 125 1 5 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.679 -0.431 18014 126 1 5 . 1 1 2 2 GLN H H 2 8.473 8.473 8.435 0.038 18014 127 1 5 . 1 1 3 3 ARG HA H 3 4.220 4.220 4.273 -0.053 18014 128 1 5 . 1 1 3 3 ARG H H 3 8.504 8.504 8.493 0.011 18014 129 1 5 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.300 0.400 18014 130 1 5 . 1 1 4 4 HIS H H 4 8.674 8.674 8.713 -0.039 18014 131 1 5 . 1 1 5 5 SER HA H 5 4.411 4.411 4.531 -0.120 18014 132 1 5 . 1 1 5 5 SER H H 5 8.495 8.495 8.272 0.223 18014 133 1 5 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.883 0.282 18014 134 1 5 . 1 1 6 6 ILE H H 6 8.424 8.424 8.162 0.262 18014 135 1 5 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.385 -0.370 18014 136 1 5 . 1 1 7 7 VAL H H 7 8.366 8.366 8.386 -0.020 18014 137 1 5 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.745 -0.200 18014 138 1 5 . 1 1 8 8 GLN H H 8 8.653 8.653 8.200 0.453 18014 139 1 5 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.700 -0.043 18014 140 1 5 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.567 -0.213 18014 141 1 5 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.622 -0.101 18014 142 1 5 . 1 1 11 11 ALA H H 11 8.466 8.466 8.403 0.063 18014 143 1 5 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.789 -0.122 18014 144 1 5 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.518 0.139 18014 145 1 5 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.431 -0.092 18014 146 1 5 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.431 0.107 18014 147 1 5 . 1 1 15 15 ASN H H 15 8.482 8.482 8.529 -0.047 18014 148 1 5 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.176 0.005 18014 149 1 5 . 1 1 16 16 ALA H H 16 8.281 8.281 8.299 -0.018 18014 150 1 5 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.096 0.431 18014 151 1 5 . 1 1 17 17 PHE H H 17 8.266 8.266 7.132 1.134 18014 152 1 5 . 1 1 18 18 VAL HA H 18 3.950 3.950 3.802 0.148 18014 153 1 5 . 1 1 18 18 VAL H H 18 7.923 7.923 8.373 -0.450 18014 154 1 5 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.365 -0.085 18014 155 1 5 . 1 1 19 19 GLU H H 19 8.433 8.433 8.583 -0.150 18014 156 1 6 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.628 -0.380 18014 157 1 6 . 1 1 2 2 GLN H H 2 8.473 8.473 7.858 0.615 18014 158 1 6 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.970 0.250 18014 159 1 6 . 1 1 3 3 ARG H H 3 8.504 8.504 8.493 0.011 18014 160 1 6 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.782 -0.082 18014 161 1 6 . 1 1 4 4 HIS H H 4 8.674 8.674 8.485 0.189 18014 162 1 6 . 1 1 5 5 SER HA H 5 4.411 4.411 4.647 -0.236 18014 163 1 6 . 1 1 5 5 SER H H 5 8.495 8.495 8.596 -0.101 18014 164 1 6 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.823 0.342 18014 165 1 6 . 1 1 6 6 ILE H H 6 8.424 8.424 8.809 -0.385 18014 166 1 6 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.201 -0.186 18014 167 1 6 . 1 1 7 7 VAL H H 7 8.366 8.366 7.747 0.619 18014 168 1 6 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.679 -0.134 18014 169 1 6 . 1 1 8 8 GLN H H 8 8.653 8.653 7.805 0.848 18014 170 1 6 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.627 0.030 18014 171 1 6 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.571 -0.217 18014 172 1 6 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.624 -0.103 18014 173 1 6 . 1 1 11 11 ALA H H 11 8.466 8.466 8.411 0.055 18014 174 1 6 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.800 -0.133 18014 175 1 6 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.558 0.099 18014 176 1 6 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.564 -0.225 18014 177 1 6 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.681 -0.143 18014 178 1 6 . 1 1 15 15 ASN H H 15 8.482 8.482 8.332 0.150 18014 179 1 6 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.523 -0.342 18014 180 1 6 . 1 1 16 16 ALA H H 16 8.281 8.281 8.652 -0.371 18014 181 1 6 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.572 -0.045 18014 182 1 6 . 1 1 17 17 PHE H H 17 8.266 8.266 8.267 -0.001 18014 183 1 6 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.334 -0.384 18014 184 1 6 . 1 1 18 18 VAL H H 18 7.923 7.923 7.766 0.157 18014 185 1 6 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.639 -0.359 18014 186 1 6 . 1 1 19 19 GLU H H 19 8.433 8.433 8.260 0.173 18014 187 1 7 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.561 -0.313 18014 188 1 7 . 1 1 2 2 GLN H H 2 8.473 8.473 8.043 0.430 18014 189 1 7 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.978 0.242 18014 190 1 7 . 1 1 3 3 ARG H H 3 8.504 8.504 8.380 0.124 18014 191 1 7 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.393 0.307 18014 192 1 7 . 1 1 4 4 HIS H H 4 8.674 8.674 8.427 0.247 18014 193 1 7 . 1 1 5 5 SER HA H 5 4.411 4.411 4.234 0.177 18014 194 1 7 . 1 1 5 5 SER H H 5 8.495 8.495 8.580 -0.085 18014 195 1 7 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.465 0.700 18014 196 1 7 . 1 1 6 6 ILE H H 6 8.424 8.424 7.563 0.861 18014 197 1 7 . 1 1 7 7 VAL HA H 7 4.015 4.015 3.908 0.107 18014 198 1 7 . 1 1 7 7 VAL H H 7 8.366 8.366 7.745 0.621 18014 199 1 7 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.619 -0.074 18014 200 1 7 . 1 1 8 8 GLN H H 8 8.653 8.653 8.607 0.046 18014 201 1 7 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.612 0.045 18014 202 1 7 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.574 -0.220 18014 203 1 7 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.625 -0.104 18014 204 1 7 . 1 1 11 11 ALA H H 11 8.466 8.466 8.407 0.059 18014 205 1 7 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.795 -0.128 18014 206 1 7 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.523 0.134 18014 207 1 7 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.471 -0.132 18014 208 1 7 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.414 0.124 18014 209 1 7 . 1 1 15 15 ASN H H 15 8.482 8.482 8.150 0.332 18014 210 1 7 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.452 -0.271 18014 211 1 7 . 1 1 16 16 ALA H H 16 8.281 8.281 8.320 -0.039 18014 212 1 7 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.110 0.417 18014 213 1 7 . 1 1 17 17 PHE H H 17 8.266 8.266 7.507 0.759 18014 214 1 7 . 1 1 18 18 VAL HA H 18 3.950 3.950 3.620 0.330 18014 215 1 7 . 1 1 18 18 VAL H H 18 7.923 7.923 8.635 -0.712 18014 216 1 7 . 1 1 19 19 GLU HA H 19 4.280 4.280 3.955 0.325 18014 217 1 7 . 1 1 19 19 GLU H H 19 8.433 8.433 8.705 -0.272 18014 218 1 8 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.507 -0.259 18014 219 1 8 . 1 1 2 2 GLN H H 2 8.473 8.473 8.789 -0.316 18014 220 1 8 . 1 1 3 3 ARG HA H 3 4.220 4.220 3.992 0.228 18014 221 1 8 . 1 1 3 3 ARG H H 3 8.504 8.504 8.208 0.296 18014 222 1 8 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.786 -0.086 18014 223 1 8 . 1 1 4 4 HIS H H 4 8.674 8.674 7.801 0.873 18014 224 1 8 . 1 1 5 5 SER HA H 5 4.411 4.411 4.632 -0.221 18014 225 1 8 . 1 1 5 5 SER H H 5 8.495 8.495 8.222 0.273 18014 226 1 8 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.786 0.379 18014 227 1 8 . 1 1 6 6 ILE H H 6 8.424 8.424 8.324 0.100 18014 228 1 8 . 1 1 7 7 VAL HA H 7 4.015 4.015 3.903 0.112 18014 229 1 8 . 1 1 7 7 VAL H H 7 8.366 8.366 7.909 0.457 18014 230 1 8 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.700 -0.155 18014 231 1 8 . 1 1 8 8 GLN H H 8 8.653 8.653 8.462 0.191 18014 232 1 8 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.654 0.003 18014 233 1 8 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.571 -0.217 18014 234 1 8 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.629 -0.108 18014 235 1 8 . 1 1 11 11 ALA H H 11 8.466 8.466 8.407 0.059 18014 236 1 8 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.795 -0.128 18014 237 1 8 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.543 0.114 18014 238 1 8 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.498 -0.159 18014 239 1 8 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.618 -0.080 18014 240 1 8 . 1 1 15 15 ASN H H 15 8.482 8.482 8.594 -0.112 18014 241 1 8 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.466 -0.285 18014 242 1 8 . 1 1 16 16 ALA H H 16 8.281 8.281 8.619 -0.338 18014 243 1 8 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.549 -0.022 18014 244 1 8 . 1 1 17 17 PHE H H 17 8.266 8.266 8.025 0.241 18014 245 1 8 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.433 -0.483 18014 246 1 8 . 1 1 18 18 VAL H H 18 7.923 7.923 7.799 0.124 18014 247 1 8 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.310 -0.030 18014 248 1 8 . 1 1 19 19 GLU H H 19 8.433 8.433 8.980 -0.547 18014 249 1 9 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.533 -0.285 18014 250 1 9 . 1 1 2 2 GLN H H 2 8.473 8.473 8.040 0.433 18014 251 1 9 . 1 1 3 3 ARG HA H 3 4.220 4.220 4.105 0.115 18014 252 1 9 . 1 1 3 3 ARG H H 3 8.504 8.504 8.840 -0.336 18014 253 1 9 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.733 -0.033 18014 254 1 9 . 1 1 4 4 HIS H H 4 8.674 8.674 8.073 0.601 18014 255 1 9 . 1 1 5 5 SER HA H 5 4.411 4.411 4.545 -0.134 18014 256 1 9 . 1 1 5 5 SER H H 5 8.495 8.495 7.993 0.502 18014 257 1 9 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.856 0.309 18014 258 1 9 . 1 1 6 6 ILE H H 6 8.424 8.424 8.319 0.105 18014 259 1 9 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.294 -0.279 18014 260 1 9 . 1 1 7 7 VAL H H 7 8.366 8.366 8.487 -0.121 18014 261 1 9 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.643 -0.098 18014 262 1 9 . 1 1 8 8 GLN H H 8 8.653 8.653 7.759 0.894 18014 263 1 9 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.641 0.016 18014 264 1 9 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.534 -0.180 18014 265 1 9 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.623 -0.102 18014 266 1 9 . 1 1 11 11 ALA H H 11 8.466 8.466 8.403 0.063 18014 267 1 9 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.797 -0.130 18014 268 1 9 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.531 0.126 18014 269 1 9 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.523 -0.184 18014 270 1 9 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.450 0.088 18014 271 1 9 . 1 1 15 15 ASN H H 15 8.482 8.482 8.478 0.004 18014 272 1 9 . 1 1 16 16 ALA HA H 16 4.181 4.181 3.830 0.351 18014 273 1 9 . 1 1 16 16 ALA H H 16 8.281 8.281 8.418 -0.137 18014 274 1 9 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.104 0.423 18014 275 1 9 . 1 1 17 17 PHE H H 17 8.266 8.266 7.313 0.953 18014 276 1 9 . 1 1 18 18 VAL HA H 18 3.950 3.950 3.785 0.165 18014 277 1 9 . 1 1 18 18 VAL H H 18 7.923 7.923 8.366 -0.443 18014 278 1 9 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.168 0.112 18014 279 1 9 . 1 1 19 19 GLU H H 19 8.433 8.433 8.326 0.107 18014 280 1 10 . 1 1 2 2 GLN HA H 2 4.248 4.248 4.401 -0.153 18014 281 1 10 . 1 1 2 2 GLN H H 2 8.473 8.473 8.492 -0.019 18014 282 1 10 . 1 1 3 3 ARG HA H 3 4.220 4.220 4.127 0.093 18014 283 1 10 . 1 1 3 3 ARG H H 3 8.504 8.504 8.070 0.434 18014 284 1 10 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.343 0.357 18014 285 1 10 . 1 1 4 4 HIS H H 4 8.674 8.674 8.481 0.193 18014 286 1 10 . 1 1 5 5 SER HA H 5 4.411 4.411 4.324 0.087 18014 287 1 10 . 1 1 5 5 SER H H 5 8.495 8.495 8.250 0.245 18014 288 1 10 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.639 0.526 18014 289 1 10 . 1 1 6 6 ILE H H 6 8.424 8.424 7.174 1.250 18014 290 1 10 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.123 -0.108 18014 291 1 10 . 1 1 7 7 VAL H H 7 8.366 8.366 8.549 -0.183 18014 292 1 10 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.664 -0.119 18014 293 1 10 . 1 1 8 8 GLN H H 8 8.653 8.653 8.165 0.488 18014 294 1 10 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.662 -0.005 18014 295 1 10 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.539 -0.185 18014 296 1 10 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.626 -0.105 18014 297 1 10 . 1 1 11 11 ALA H H 11 8.466 8.466 8.405 0.061 18014 298 1 10 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.792 -0.125 18014 299 1 10 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.528 0.129 18014 300 1 10 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.474 -0.135 18014 301 1 10 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.474 0.064 18014 302 1 10 . 1 1 15 15 ASN H H 15 8.482 8.482 8.194 0.288 18014 303 1 10 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.429 -0.248 18014 304 1 10 . 1 1 16 16 ALA H H 16 8.281 8.281 8.468 -0.187 18014 305 1 10 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.113 0.414 18014 306 1 10 . 1 1 17 17 PHE H H 17 8.266 8.266 7.455 0.811 18014 307 1 10 . 1 1 18 18 VAL HA H 18 3.950 3.950 3.745 0.205 18014 308 1 10 . 1 1 18 18 VAL H H 18 7.923 7.923 8.306 -0.383 18014 309 1 10 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.158 0.122 18014 310 1 10 . 1 1 19 19 GLU H H 19 8.433 8.433 8.163 0.270 18014 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 18014 2 1 1 "Average Difference" HA 18 0.187 0.007 0.192 18014 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18014 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18014 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18014 6 1 1 "Average Difference" HN 13 0.500 -0.181 0.485 18014 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18014 8 1 2 "Average Difference" HA 18 0.234 0.076 0.228 18014 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18014 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18014 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18014 12 1 2 "Average Difference" HN 13 0.503 -0.257 0.451 18014 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18014 14 1 3 "Average Difference" HA 18 0.199 0.080 0.187 18014 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18014 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18014 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18014 18 1 3 "Average Difference" HN 13 0.347 -0.047 0.357 18014 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18014 20 1 4 "Average Difference" HA 18 0.255 0.050 0.257 18014 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18014 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18014 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18014 24 1 4 "Average Difference" HN 13 0.440 -0.117 0.441 18014 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18014 26 1 5 "Average Difference" HA 18 0.229 0.018 0.235 18014 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18014 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18014 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18014 30 1 5 "Average Difference" HN 13 0.377 -0.112 0.374 18014 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18014 32 1 6 "Average Difference" HA 18 0.235 0.125 0.205 18014 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18014 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18014 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18014 36 1 6 "Average Difference" HN 13 0.382 -0.151 0.365 18014 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18014 38 1 7 "Average Difference" HA 18 0.277 -0.092 0.269 18014 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18014 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18014 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18014 42 1 7 "Average Difference" HN 13 0.453 -0.182 0.432 18014 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18014 44 1 8 "Average Difference" HA 18 0.210 0.078 0.200 18014 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18014 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18014 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18014 48 1 8 "Average Difference" HN 13 0.370 -0.100 0.371 18014 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18014 50 1 9 "Average Difference" HA 18 0.205 -0.016 0.210 18014 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18014 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18014 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18014 54 1 9 "Average Difference" HN 13 0.470 -0.202 0.442 18014 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18014 56 1 10 "Average Difference" HA 18 0.218 -0.045 0.220 18014 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18014 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18014 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18014 60 1 10 "Average Difference" HN 13 0.490 -0.251 0.438 18014 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 18014 _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 GLN HA H 2 4.248 4.248 4.516 -0.268 18014 2 1 . 1 1 2 2 GLN H H 2 8.473 8.473 8.274 0.199 18014 3 1 . 1 1 3 3 ARG HA H 3 4.220 4.220 4.059 0.161 18014 4 1 . 1 1 3 3 ARG H H 3 8.504 8.504 8.295 0.209 18014 5 1 . 1 1 4 4 HIS HA H 4 4.700 4.700 4.587 0.113 18014 6 1 . 1 1 4 4 HIS H H 4 8.674 8.674 8.250 0.424 18014 7 1 . 1 1 5 5 SER HA H 5 4.411 4.411 4.471 -0.060 18014 8 1 . 1 1 5 5 SER H H 5 8.495 8.495 8.350 0.145 18014 9 1 . 1 1 6 6 ILE HA H 6 4.165 4.165 3.796 0.369 18014 10 1 . 1 1 6 6 ILE H H 6 8.424 8.424 8.090 0.334 18014 11 1 . 1 1 7 7 VAL HA H 7 4.015 4.015 4.084 -0.069 18014 12 1 . 1 1 7 7 VAL H H 7 8.366 8.366 8.139 0.227 18014 13 1 . 1 1 8 8 GLN HA H 8 4.545 4.545 4.702 -0.157 18014 14 1 . 1 1 8 8 GLN H H 8 8.653 8.653 8.254 0.399 18014 15 1 . 1 1 9 9 PRO HA H 9 4.657 4.657 4.656 0.001 18014 16 1 . 1 1 10 10 PRO HA H 10 4.354 4.354 4.563 -0.209 18014 17 1 . 1 1 11 11 ALA HA H 11 4.521 4.521 4.623 -0.102 18014 18 1 . 1 1 11 11 ALA H H 11 8.466 8.466 8.405 0.061 18014 19 1 . 1 1 12 12 PRO HA H 12 4.667 4.667 4.796 -0.129 18014 20 1 . 1 1 13 13 PRO HA H 13 4.657 4.657 4.534 0.123 18014 21 1 . 1 1 14 14 PRO HA H 14 4.339 4.339 4.506 -0.167 18014 22 1 . 1 1 15 15 ASN HA H 15 4.538 4.538 4.531 0.007 18014 23 1 . 1 1 15 15 ASN H H 15 8.482 8.482 8.467 0.015 18014 24 1 . 1 1 16 16 ALA HA H 16 4.181 4.181 4.318 -0.137 18014 25 1 . 1 1 16 16 ALA H H 16 8.281 8.281 8.456 -0.175 18014 26 1 . 1 1 17 17 PHE HA H 17 4.527 4.527 4.379 0.148 18014 27 1 . 1 1 17 17 PHE H H 17 8.266 8.266 7.543 0.723 18014 28 1 . 1 1 18 18 VAL HA H 18 3.950 3.950 4.062 -0.112 18014 29 1 . 1 1 18 18 VAL H H 18 7.923 7.923 8.279 -0.356 18014 30 1 . 1 1 19 19 GLU HA H 19 4.280 4.280 4.296 -0.016 18014 31 1 . 1 1 19 19 GLU H H 19 8.433 8.433 8.557 -0.124 18014 stop_ save_