data_18420 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18420 _Entry.PDB_ID 2LSA 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 18420 _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 4.269 4.269 4.447 -0.178 18420 2 1 1 . 1 1 2 2 ILE H H 2 8.590 8.590 8.636 -0.046 18420 3 1 1 . 1 1 3 3 GLY H H 3 8.591 8.591 8.160 0.431 18420 4 1 1 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.614 -0.476 18420 5 1 1 . 1 1 4 4 LYS H H 4 7.854 7.854 7.979 -0.125 18420 6 1 1 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.388 0.113 18420 7 1 1 . 1 1 5 5 PHE H H 5 7.897 7.897 8.319 -0.422 18420 8 1 1 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.322 -0.303 18420 9 1 1 . 1 1 6 6 LEU H H 6 8.056 8.056 8.197 -0.141 18420 10 1 1 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.327 0.070 18420 11 1 1 . 1 1 7 7 HIS H H 7 8.196 8.196 7.872 0.324 18420 12 1 1 . 1 1 8 8 SER HA H 8 4.343 4.343 4.556 -0.213 18420 13 1 1 . 1 1 8 8 SER H H 8 8.022 8.022 7.826 0.196 18420 14 1 1 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.237 -0.154 18420 15 1 1 . 1 1 9 9 ALA H H 9 8.367 8.367 7.884 0.483 18420 16 1 1 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.612 -0.648 18420 17 1 1 . 1 1 10 10 LYS H H 10 8.089 8.089 7.571 0.518 18420 18 1 1 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.407 -0.383 18420 19 1 1 . 1 1 11 11 LYS H H 11 7.659 7.659 7.848 -0.189 18420 20 1 1 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.751 -0.292 18420 21 1 1 . 1 1 12 12 PHE H H 12 8.196 8.196 8.349 -0.153 18420 22 1 1 . 1 1 13 13 GLY H H 13 8.713 8.713 8.530 0.183 18420 23 1 1 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.007 -0.005 18420 24 1 1 . 1 1 14 14 LYS H H 14 8.352 8.352 8.287 0.065 18420 25 1 1 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.182 0.006 18420 26 1 1 . 1 1 15 15 ALA H H 15 7.747 7.747 7.451 0.296 18420 27 1 1 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.563 -0.265 18420 28 1 1 . 1 1 16 16 PHE H H 16 8.280 8.280 7.641 0.639 18420 29 1 1 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.893 -0.305 18420 30 1 1 . 1 1 17 17 VAL H H 17 8.249 8.249 8.737 -0.488 18420 31 1 1 . 1 1 18 18 GLY H H 18 8.122 8.122 7.894 0.228 18420 32 1 1 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.458 -0.234 18420 33 1 1 . 1 1 19 19 GLU H H 19 7.731 7.731 7.702 0.029 18420 34 1 1 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.997 -0.145 18420 35 1 1 . 1 1 20 20 ILE H H 20 7.696 7.696 8.096 -0.400 18420 36 1 1 . 1 1 21 21 MET HA H 21 4.315 4.315 4.197 0.118 18420 37 1 1 . 1 1 21 21 MET H H 21 8.168 8.168 7.936 0.232 18420 38 1 1 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.684 0.060 18420 39 1 1 . 1 1 22 22 ASN H H 22 7.905 7.905 8.023 -0.118 18420 40 1 2 . 1 1 2 2 ILE HA H 2 4.269 4.269 3.866 0.403 18420 41 1 2 . 1 1 2 2 ILE H H 2 8.590 8.590 8.347 0.243 18420 42 1 2 . 1 1 3 3 GLY H H 3 8.591 8.591 8.782 -0.191 18420 43 1 2 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.523 -0.385 18420 44 1 2 . 1 1 4 4 LYS H H 4 7.854 7.854 8.266 -0.412 18420 45 1 2 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.314 0.187 18420 46 1 2 . 1 1 5 5 PHE H H 5 7.897 7.897 7.683 0.214 18420 47 1 2 . 1 1 6 6 LEU HA H 6 4.019 4.019 3.982 0.037 18420 48 1 2 . 1 1 6 6 LEU H H 6 8.056 8.056 7.430 0.626 18420 49 1 2 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.244 0.153 18420 50 1 2 . 1 1 7 7 HIS H H 7 8.196 8.196 7.623 0.573 18420 51 1 2 . 1 1 8 8 SER HA H 8 4.343 4.343 4.157 0.186 18420 52 1 2 . 1 1 8 8 SER H H 8 8.022 8.022 7.973 0.049 18420 53 1 2 . 1 1 9 9 ALA HA H 9 4.083 4.083 3.980 0.103 18420 54 1 2 . 1 1 9 9 ALA H H 9 8.367 8.367 7.843 0.524 18420 55 1 2 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.179 -0.215 18420 56 1 2 . 1 1 10 10 LYS H H 10 8.089 8.089 7.514 0.575 18420 57 1 2 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.117 -0.093 18420 58 1 2 . 1 1 11 11 LYS H H 11 7.659 7.659 7.455 0.204 18420 59 1 2 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.898 -0.439 18420 60 1 2 . 1 1 12 12 PHE H H 12 8.196 8.196 8.364 -0.168 18420 61 1 2 . 1 1 13 13 GLY H H 13 8.713 8.713 8.878 -0.165 18420 62 1 2 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.154 -0.152 18420 63 1 2 . 1 1 14 14 LYS H H 14 8.352 8.352 7.544 0.808 18420 64 1 2 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.150 0.038 18420 65 1 2 . 1 1 15 15 ALA H H 15 7.747 7.747 7.324 0.423 18420 66 1 2 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.036 0.262 18420 67 1 2 . 1 1 16 16 PHE H H 16 8.280 8.280 7.868 0.412 18420 68 1 2 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.728 -0.140 18420 69 1 2 . 1 1 17 17 VAL H H 17 8.249 8.249 8.065 0.184 18420 70 1 2 . 1 1 18 18 GLY H H 18 8.122 8.122 8.320 -0.198 18420 71 1 2 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.308 -0.084 18420 72 1 2 . 1 1 19 19 GLU H H 19 7.731 7.731 7.471 0.260 18420 73 1 2 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.903 -0.051 18420 74 1 2 . 1 1 20 20 ILE H H 20 7.696 7.696 7.615 0.081 18420 75 1 2 . 1 1 21 21 MET HA H 21 4.315 4.315 4.613 -0.298 18420 76 1 2 . 1 1 21 21 MET H H 21 8.168 8.168 8.100 0.068 18420 77 1 2 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.836 -0.092 18420 78 1 2 . 1 1 22 22 ASN H H 22 7.905 7.905 8.566 -0.661 18420 79 1 3 . 1 1 2 2 ILE HA H 2 4.269 4.269 3.932 0.337 18420 80 1 3 . 1 1 2 2 ILE H H 2 8.590 8.590 8.669 -0.079 18420 81 1 3 . 1 1 3 3 GLY H H 3 8.591 8.591 8.708 -0.117 18420 82 1 3 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.501 -0.363 18420 83 1 3 . 1 1 4 4 LYS H H 4 7.854 7.854 7.978 -0.124 18420 84 1 3 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.484 0.017 18420 85 1 3 . 1 1 5 5 PHE H H 5 7.897 7.897 7.742 0.155 18420 86 1 3 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.074 -0.055 18420 87 1 3 . 1 1 6 6 LEU H H 6 8.056 8.056 8.074 -0.018 18420 88 1 3 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.289 0.108 18420 89 1 3 . 1 1 7 7 HIS H H 7 8.196 8.196 7.642 0.554 18420 90 1 3 . 1 1 8 8 SER HA H 8 4.343 4.343 4.204 0.139 18420 91 1 3 . 1 1 8 8 SER H H 8 8.022 8.022 7.495 0.527 18420 92 1 3 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.042 0.041 18420 93 1 3 . 1 1 9 9 ALA H H 9 8.367 8.367 7.530 0.837 18420 94 1 3 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.339 -0.375 18420 95 1 3 . 1 1 10 10 LYS H H 10 8.089 8.089 7.403 0.686 18420 96 1 3 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.022 0.002 18420 97 1 3 . 1 1 11 11 LYS H H 11 7.659 7.659 7.721 -0.062 18420 98 1 3 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.676 -0.217 18420 99 1 3 . 1 1 12 12 PHE H H 12 8.196 8.196 7.594 0.602 18420 100 1 3 . 1 1 13 13 GLY H H 13 8.713 8.713 8.133 0.580 18420 101 1 3 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.085 -0.083 18420 102 1 3 . 1 1 14 14 LYS H H 14 8.352 8.352 8.042 0.310 18420 103 1 3 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.226 -0.038 18420 104 1 3 . 1 1 15 15 ALA H H 15 7.747 7.747 7.286 0.461 18420 105 1 3 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.377 -0.079 18420 106 1 3 . 1 1 16 16 PHE H H 16 8.280 8.280 7.551 0.729 18420 107 1 3 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.657 -0.069 18420 108 1 3 . 1 1 17 17 VAL H H 17 8.249 8.249 8.389 -0.140 18420 109 1 3 . 1 1 18 18 GLY H H 18 8.122 8.122 7.875 0.247 18420 110 1 3 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.259 -0.035 18420 111 1 3 . 1 1 19 19 GLU H H 19 7.731 7.731 7.244 0.487 18420 112 1 3 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.707 0.145 18420 113 1 3 . 1 1 20 20 ILE H H 20 7.696 7.696 8.042 -0.346 18420 114 1 3 . 1 1 21 21 MET HA H 21 4.315 4.315 4.388 -0.073 18420 115 1 3 . 1 1 21 21 MET H H 21 8.168 8.168 7.660 0.508 18420 116 1 3 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.818 -0.074 18420 117 1 3 . 1 1 22 22 ASN H H 22 7.905 7.905 7.892 0.013 18420 118 1 4 . 1 1 2 2 ILE HA H 2 4.269 4.269 4.468 -0.199 18420 119 1 4 . 1 1 2 2 ILE H H 2 8.590 8.590 8.130 0.460 18420 120 1 4 . 1 1 3 3 GLY H H 3 8.591 8.591 8.399 0.192 18420 121 1 4 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.520 -0.382 18420 122 1 4 . 1 1 4 4 LYS H H 4 7.854 7.854 7.763 0.091 18420 123 1 4 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.453 0.048 18420 124 1 4 . 1 1 5 5 PHE H H 5 7.897 7.897 8.099 -0.202 18420 125 1 4 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.321 -0.302 18420 126 1 4 . 1 1 6 6 LEU H H 6 8.056 8.056 8.103 -0.047 18420 127 1 4 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.536 -0.139 18420 128 1 4 . 1 1 7 7 HIS H H 7 8.196 8.196 7.647 0.549 18420 129 1 4 . 1 1 8 8 SER HA H 8 4.343 4.343 4.442 -0.100 18420 130 1 4 . 1 1 8 8 SER H H 8 8.022 8.022 7.839 0.183 18420 131 1 4 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.003 0.080 18420 132 1 4 . 1 1 9 9 ALA H H 9 8.367 8.367 7.915 0.452 18420 133 1 4 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.280 -0.316 18420 134 1 4 . 1 1 10 10 LYS H H 10 8.089 8.089 7.613 0.476 18420 135 1 4 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.287 -0.263 18420 136 1 4 . 1 1 11 11 LYS H H 11 7.659 7.659 7.730 -0.071 18420 137 1 4 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.701 -0.242 18420 138 1 4 . 1 1 12 12 PHE H H 12 8.196 8.196 8.324 -0.128 18420 139 1 4 . 1 1 13 13 GLY H H 13 8.713 8.713 7.923 0.790 18420 140 1 4 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.117 -0.115 18420 141 1 4 . 1 1 14 14 LYS H H 14 8.352 8.352 8.053 0.299 18420 142 1 4 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.191 -0.003 18420 143 1 4 . 1 1 15 15 ALA H H 15 7.747 7.747 7.882 -0.135 18420 144 1 4 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.237 0.061 18420 145 1 4 . 1 1 16 16 PHE H H 16 8.280 8.280 7.643 0.637 18420 146 1 4 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.571 0.017 18420 147 1 4 . 1 1 17 17 VAL H H 17 8.249 8.249 8.102 0.147 18420 148 1 4 . 1 1 18 18 GLY H H 18 8.122 8.122 8.190 -0.068 18420 149 1 4 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.336 -0.112 18420 150 1 4 . 1 1 19 19 GLU H H 19 7.731 7.731 7.410 0.321 18420 151 1 4 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.766 0.086 18420 152 1 4 . 1 1 20 20 ILE H H 20 7.696 7.696 7.213 0.483 18420 153 1 4 . 1 1 21 21 MET HA H 21 4.315 4.315 4.424 -0.109 18420 154 1 4 . 1 1 21 21 MET H H 21 8.168 8.168 7.829 0.339 18420 155 1 4 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.798 -0.054 18420 156 1 4 . 1 1 22 22 ASN H H 22 7.905 7.905 7.873 0.032 18420 157 1 5 . 1 1 2 2 ILE HA H 2 4.269 4.269 3.817 0.452 18420 158 1 5 . 1 1 2 2 ILE H H 2 8.590 8.590 8.393 0.197 18420 159 1 5 . 1 1 3 3 GLY H H 3 8.591 8.591 8.773 -0.182 18420 160 1 5 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.462 -0.324 18420 161 1 5 . 1 1 4 4 LYS H H 4 7.854 7.854 8.196 -0.342 18420 162 1 5 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.361 0.140 18420 163 1 5 . 1 1 5 5 PHE H H 5 7.897 7.897 7.819 0.078 18420 164 1 5 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.276 -0.257 18420 165 1 5 . 1 1 6 6 LEU H H 6 8.056 8.056 7.624 0.432 18420 166 1 5 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.225 0.172 18420 167 1 5 . 1 1 7 7 HIS H H 7 8.196 8.196 7.683 0.513 18420 168 1 5 . 1 1 8 8 SER HA H 8 4.343 4.343 4.616 -0.273 18420 169 1 5 . 1 1 8 8 SER H H 8 8.022 8.022 8.637 -0.615 18420 170 1 5 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.206 -0.123 18420 171 1 5 . 1 1 9 9 ALA H H 9 8.367 8.367 7.838 0.529 18420 172 1 5 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.224 -0.260 18420 173 1 5 . 1 1 10 10 LYS H H 10 8.089 8.089 7.619 0.470 18420 174 1 5 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.410 -0.386 18420 175 1 5 . 1 1 11 11 LYS H H 11 7.659 7.659 8.035 -0.376 18420 176 1 5 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.674 -0.215 18420 177 1 5 . 1 1 12 12 PHE H H 12 8.196 8.196 7.878 0.318 18420 178 1 5 . 1 1 13 13 GLY H H 13 8.713 8.713 8.413 0.300 18420 179 1 5 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.019 -0.017 18420 180 1 5 . 1 1 14 14 LYS H H 14 8.352 8.352 8.482 -0.131 18420 181 1 5 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.236 -0.048 18420 182 1 5 . 1 1 15 15 ALA H H 15 7.747 7.747 7.726 0.021 18420 183 1 5 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.274 0.024 18420 184 1 5 . 1 1 16 16 PHE H H 16 8.280 8.280 8.047 0.233 18420 185 1 5 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.916 -0.328 18420 186 1 5 . 1 1 17 17 VAL H H 17 8.249 8.249 8.386 -0.137 18420 187 1 5 . 1 1 18 18 GLY H H 18 8.122 8.122 7.669 0.453 18420 188 1 5 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.244 -0.020 18420 189 1 5 . 1 1 19 19 GLU H H 19 7.731 7.731 7.424 0.307 18420 190 1 5 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.933 -0.081 18420 191 1 5 . 1 1 20 20 ILE H H 20 7.696 7.696 7.899 -0.203 18420 192 1 5 . 1 1 21 21 MET HA H 21 4.315 4.315 4.190 0.125 18420 193 1 5 . 1 1 21 21 MET H H 21 8.168 8.168 8.001 0.167 18420 194 1 5 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.850 -0.106 18420 195 1 5 . 1 1 22 22 ASN H H 22 7.905 7.905 7.937 -0.032 18420 196 1 6 . 1 1 2 2 ILE HA H 2 4.269 4.269 4.435 -0.166 18420 197 1 6 . 1 1 2 2 ILE H H 2 8.590 8.590 8.918 -0.328 18420 198 1 6 . 1 1 3 3 GLY H H 3 8.591 8.591 8.043 0.548 18420 199 1 6 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.354 -0.216 18420 200 1 6 . 1 1 4 4 LYS H H 4 7.854 7.854 8.297 -0.443 18420 201 1 6 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.547 -0.046 18420 202 1 6 . 1 1 5 5 PHE H H 5 7.897 7.897 8.630 -0.733 18420 203 1 6 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.661 -0.642 18420 204 1 6 . 1 1 6 6 LEU H H 6 8.056 8.056 7.438 0.618 18420 205 1 6 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.455 -0.058 18420 206 1 6 . 1 1 7 7 HIS H H 7 8.196 8.196 7.803 0.393 18420 207 1 6 . 1 1 8 8 SER HA H 8 4.343 4.343 4.480 -0.137 18420 208 1 6 . 1 1 8 8 SER H H 8 8.022 8.022 8.266 -0.244 18420 209 1 6 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.248 -0.165 18420 210 1 6 . 1 1 9 9 ALA H H 9 8.367 8.367 8.748 -0.381 18420 211 1 6 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.502 -0.538 18420 212 1 6 . 1 1 10 10 LYS H H 10 8.089 8.089 7.595 0.494 18420 213 1 6 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.344 -0.320 18420 214 1 6 . 1 1 11 11 LYS H H 11 7.659 7.659 7.916 -0.257 18420 215 1 6 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.607 -0.148 18420 216 1 6 . 1 1 12 12 PHE H H 12 8.196 8.196 8.078 0.118 18420 217 1 6 . 1 1 13 13 GLY H H 13 8.713 8.713 8.033 0.680 18420 218 1 6 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.056 -0.054 18420 219 1 6 . 1 1 14 14 LYS H H 14 8.352 8.352 8.363 -0.011 18420 220 1 6 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.434 -0.246 18420 221 1 6 . 1 1 15 15 ALA H H 15 7.747 7.747 7.656 0.091 18420 222 1 6 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.678 -0.380 18420 223 1 6 . 1 1 16 16 PHE H H 16 8.280 8.280 7.883 0.397 18420 224 1 6 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.606 -0.018 18420 225 1 6 . 1 1 17 17 VAL H H 17 8.249 8.249 8.909 -0.660 18420 226 1 6 . 1 1 18 18 GLY H H 18 8.122 8.122 8.048 0.074 18420 227 1 6 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.425 -0.201 18420 228 1 6 . 1 1 19 19 GLU H H 19 7.731 7.731 7.476 0.255 18420 229 1 6 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.772 0.080 18420 230 1 6 . 1 1 20 20 ILE H H 20 7.696 7.696 8.050 -0.354 18420 231 1 6 . 1 1 21 21 MET HA H 21 4.315 4.315 4.421 -0.106 18420 232 1 6 . 1 1 21 21 MET H H 21 8.168 8.168 7.569 0.599 18420 233 1 6 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.889 -0.145 18420 234 1 6 . 1 1 22 22 ASN H H 22 7.905 7.905 7.807 0.098 18420 235 1 7 . 1 1 2 2 ILE HA H 2 4.269 4.269 4.566 -0.297 18420 236 1 7 . 1 1 2 2 ILE H H 2 8.590 8.590 8.282 0.308 18420 237 1 7 . 1 1 3 3 GLY H H 3 8.591 8.591 8.195 0.396 18420 238 1 7 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.681 -0.543 18420 239 1 7 . 1 1 4 4 LYS H H 4 7.854 7.854 8.011 -0.157 18420 240 1 7 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.509 -0.008 18420 241 1 7 . 1 1 5 5 PHE H H 5 7.897 7.897 8.412 -0.515 18420 242 1 7 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.096 -0.077 18420 243 1 7 . 1 1 6 6 LEU H H 6 8.056 8.056 8.197 -0.141 18420 244 1 7 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.382 0.015 18420 245 1 7 . 1 1 7 7 HIS H H 7 8.196 8.196 7.835 0.361 18420 246 1 7 . 1 1 8 8 SER HA H 8 4.343 4.343 4.475 -0.132 18420 247 1 7 . 1 1 8 8 SER H H 8 8.022 8.022 7.570 0.452 18420 248 1 7 . 1 1 9 9 ALA HA H 9 4.083 4.083 3.976 0.107 18420 249 1 7 . 1 1 9 9 ALA H H 9 8.367 8.367 8.132 0.235 18420 250 1 7 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.487 -0.523 18420 251 1 7 . 1 1 10 10 LYS H H 10 8.089 8.089 7.407 0.682 18420 252 1 7 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.289 -0.265 18420 253 1 7 . 1 1 11 11 LYS H H 11 7.659 7.659 8.032 -0.373 18420 254 1 7 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.709 -0.250 18420 255 1 7 . 1 1 12 12 PHE H H 12 8.196 8.196 8.268 -0.072 18420 256 1 7 . 1 1 13 13 GLY H H 13 8.713 8.713 8.260 0.453 18420 257 1 7 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.026 -0.024 18420 258 1 7 . 1 1 14 14 LYS H H 14 8.352 8.352 8.417 -0.065 18420 259 1 7 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.206 -0.018 18420 260 1 7 . 1 1 15 15 ALA H H 15 7.747 7.747 7.822 -0.075 18420 261 1 7 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.745 -0.447 18420 262 1 7 . 1 1 16 16 PHE H H 16 8.280 8.280 7.906 0.374 18420 263 1 7 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.994 -0.406 18420 264 1 7 . 1 1 17 17 VAL H H 17 8.249 8.249 8.789 -0.540 18420 265 1 7 . 1 1 18 18 GLY H H 18 8.122 8.122 7.804 0.318 18420 266 1 7 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.415 -0.191 18420 267 1 7 . 1 1 19 19 GLU H H 19 7.731 7.731 7.496 0.235 18420 268 1 7 . 1 1 20 20 ILE HA H 20 3.852 3.852 4.118 -0.266 18420 269 1 7 . 1 1 20 20 ILE H H 20 7.696 7.696 8.312 -0.616 18420 270 1 7 . 1 1 21 21 MET HA H 21 4.315 4.315 4.383 -0.068 18420 271 1 7 . 1 1 21 21 MET H H 21 8.168 8.168 7.497 0.671 18420 272 1 7 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.939 -0.195 18420 273 1 7 . 1 1 22 22 ASN H H 22 7.905 7.905 8.262 -0.357 18420 274 1 8 . 1 1 2 2 ILE HA H 2 4.269 4.269 4.617 -0.348 18420 275 1 8 . 1 1 2 2 ILE H H 2 8.590 8.590 8.199 0.391 18420 276 1 8 . 1 1 3 3 GLY H H 3 8.591 8.591 8.411 0.180 18420 277 1 8 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.014 0.124 18420 278 1 8 . 1 1 4 4 LYS H H 4 7.854 7.854 7.670 0.184 18420 279 1 8 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.410 0.091 18420 280 1 8 . 1 1 5 5 PHE H H 5 7.897 7.897 8.054 -0.157 18420 281 1 8 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.062 -0.043 18420 282 1 8 . 1 1 6 6 LEU H H 6 8.056 8.056 7.957 0.099 18420 283 1 8 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.303 0.094 18420 284 1 8 . 1 1 7 7 HIS H H 7 8.196 8.196 7.353 0.843 18420 285 1 8 . 1 1 8 8 SER HA H 8 4.343 4.343 4.450 -0.107 18420 286 1 8 . 1 1 8 8 SER H H 8 8.022 8.022 8.150 -0.128 18420 287 1 8 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.028 0.055 18420 288 1 8 . 1 1 9 9 ALA H H 9 8.367 8.367 7.455 0.912 18420 289 1 8 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.311 -0.347 18420 290 1 8 . 1 1 10 10 LYS H H 10 8.089 8.089 7.382 0.707 18420 291 1 8 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.248 -0.224 18420 292 1 8 . 1 1 11 11 LYS H H 11 7.659 7.659 7.601 0.058 18420 293 1 8 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.662 -0.203 18420 294 1 8 . 1 1 12 12 PHE H H 12 8.196 8.196 7.977 0.219 18420 295 1 8 . 1 1 13 13 GLY H H 13 8.713 8.713 8.751 -0.038 18420 296 1 8 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.027 -0.025 18420 297 1 8 . 1 1 14 14 LYS H H 14 8.352 8.352 8.092 0.260 18420 298 1 8 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.040 0.148 18420 299 1 8 . 1 1 15 15 ALA H H 15 7.747 7.747 7.413 0.334 18420 300 1 8 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.447 -0.149 18420 301 1 8 . 1 1 16 16 PHE H H 16 8.280 8.280 7.402 0.878 18420 302 1 8 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.949 -0.361 18420 303 1 8 . 1 1 17 17 VAL H H 17 8.249 8.249 8.818 -0.569 18420 304 1 8 . 1 1 18 18 GLY H H 18 8.122 8.122 7.927 0.195 18420 305 1 8 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.332 -0.108 18420 306 1 8 . 1 1 19 19 GLU H H 19 7.731 7.731 7.692 0.039 18420 307 1 8 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.773 0.079 18420 308 1 8 . 1 1 20 20 ILE H H 20 7.696 7.696 7.994 -0.298 18420 309 1 8 . 1 1 21 21 MET HA H 21 4.315 4.315 4.510 -0.195 18420 310 1 8 . 1 1 21 21 MET H H 21 8.168 8.168 8.211 -0.043 18420 311 1 8 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.817 -0.073 18420 312 1 8 . 1 1 22 22 ASN H H 22 7.905 7.905 7.895 0.010 18420 313 1 9 . 1 1 2 2 ILE HA H 2 4.269 4.269 4.671 -0.402 18420 314 1 9 . 1 1 2 2 ILE H H 2 8.590 8.590 8.522 0.068 18420 315 1 9 . 1 1 3 3 GLY H H 3 8.591 8.591 7.929 0.662 18420 316 1 9 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.624 -0.486 18420 317 1 9 . 1 1 4 4 LYS H H 4 7.854 7.854 8.271 -0.417 18420 318 1 9 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.666 -0.165 18420 319 1 9 . 1 1 5 5 PHE H H 5 7.897 7.897 7.920 -0.023 18420 320 1 9 . 1 1 6 6 LEU HA H 6 4.019 4.019 3.818 0.201 18420 321 1 9 . 1 1 6 6 LEU H H 6 8.056 8.056 7.840 0.216 18420 322 1 9 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.254 0.143 18420 323 1 9 . 1 1 7 7 HIS H H 7 8.196 8.196 8.047 0.149 18420 324 1 9 . 1 1 8 8 SER HA H 8 4.343 4.343 4.557 -0.214 18420 325 1 9 . 1 1 8 8 SER H H 8 8.022 8.022 8.037 -0.015 18420 326 1 9 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.323 -0.240 18420 327 1 9 . 1 1 9 9 ALA H H 9 8.367 8.367 8.052 0.315 18420 328 1 9 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.295 -0.331 18420 329 1 9 . 1 1 10 10 LYS H H 10 8.089 8.089 7.604 0.485 18420 330 1 9 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.147 -0.123 18420 331 1 9 . 1 1 11 11 LYS H H 11 7.659 7.659 7.630 0.029 18420 332 1 9 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.835 -0.376 18420 333 1 9 . 1 1 12 12 PHE H H 12 8.196 8.196 8.443 -0.247 18420 334 1 9 . 1 1 13 13 GLY H H 13 8.713 8.713 8.932 -0.219 18420 335 1 9 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.056 -0.054 18420 336 1 9 . 1 1 14 14 LYS H H 14 8.352 8.352 8.418 -0.066 18420 337 1 9 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.103 0.085 18420 338 1 9 . 1 1 15 15 ALA H H 15 7.747 7.747 7.634 0.113 18420 339 1 9 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.715 -0.417 18420 340 1 9 . 1 1 16 16 PHE H H 16 8.280 8.280 7.811 0.469 18420 341 1 9 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.953 -0.365 18420 342 1 9 . 1 1 17 17 VAL H H 17 8.249 8.249 8.832 -0.583 18420 343 1 9 . 1 1 18 18 GLY H H 18 8.122 8.122 7.934 0.188 18420 344 1 9 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.470 -0.246 18420 345 1 9 . 1 1 19 19 GLU H H 19 7.731 7.731 7.676 0.055 18420 346 1 9 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.763 0.089 18420 347 1 9 . 1 1 20 20 ILE H H 20 7.696 7.696 8.776 -1.080 18420 348 1 9 . 1 1 21 21 MET HA H 21 4.315 4.315 4.290 0.025 18420 349 1 9 . 1 1 21 21 MET H H 21 8.168 8.168 7.856 0.312 18420 350 1 9 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.787 -0.043 18420 351 1 9 . 1 1 22 22 ASN H H 22 7.905 7.905 7.753 0.152 18420 352 1 10 . 1 1 2 2 ILE HA H 2 4.269 4.269 3.817 0.452 18420 353 1 10 . 1 1 2 2 ILE H H 2 8.590 8.590 8.708 -0.118 18420 354 1 10 . 1 1 3 3 GLY H H 3 8.591 8.591 8.713 -0.122 18420 355 1 10 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.590 -0.452 18420 356 1 10 . 1 1 4 4 LYS H H 4 7.854 7.854 8.082 -0.228 18420 357 1 10 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.423 0.078 18420 358 1 10 . 1 1 5 5 PHE H H 5 7.897 7.897 7.739 0.158 18420 359 1 10 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.143 -0.124 18420 360 1 10 . 1 1 6 6 LEU H H 6 8.056 8.056 8.155 -0.099 18420 361 1 10 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.396 0.001 18420 362 1 10 . 1 1 7 7 HIS H H 7 8.196 8.196 7.510 0.686 18420 363 1 10 . 1 1 8 8 SER HA H 8 4.343 4.343 4.264 0.079 18420 364 1 10 . 1 1 8 8 SER H H 8 8.022 8.022 7.533 0.489 18420 365 1 10 . 1 1 9 9 ALA HA H 9 4.083 4.083 3.588 0.495 18420 366 1 10 . 1 1 9 9 ALA H H 9 8.367 8.367 7.709 0.658 18420 367 1 10 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.283 -0.319 18420 368 1 10 . 1 1 10 10 LYS H H 10 8.089 8.089 7.334 0.755 18420 369 1 10 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.156 -0.132 18420 370 1 10 . 1 1 11 11 LYS H H 11 7.659 7.659 7.589 0.070 18420 371 1 10 . 1 1 12 12 PHE HA H 12 4.459 4.459 5.009 -0.550 18420 372 1 10 . 1 1 12 12 PHE H H 12 8.196 8.196 7.583 0.613 18420 373 1 10 . 1 1 13 13 GLY H H 13 8.713 8.713 7.522 1.191 18420 374 1 10 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.197 -0.195 18420 375 1 10 . 1 1 14 14 LYS H H 14 8.352 8.352 8.160 0.192 18420 376 1 10 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.138 0.050 18420 377 1 10 . 1 1 15 15 ALA H H 15 7.747 7.747 8.206 -0.459 18420 378 1 10 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.461 -0.163 18420 379 1 10 . 1 1 16 16 PHE H H 16 8.280 8.280 7.507 0.773 18420 380 1 10 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.999 -0.411 18420 381 1 10 . 1 1 17 17 VAL H H 17 8.249 8.249 8.479 -0.230 18420 382 1 10 . 1 1 18 18 GLY H H 18 8.122 8.122 7.925 0.197 18420 383 1 10 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.500 -0.276 18420 384 1 10 . 1 1 19 19 GLU H H 19 7.731 7.731 7.549 0.182 18420 385 1 10 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.848 0.004 18420 386 1 10 . 1 1 20 20 ILE H H 20 7.696 7.696 8.424 -0.728 18420 387 1 10 . 1 1 21 21 MET HA H 21 4.315 4.315 4.680 -0.365 18420 388 1 10 . 1 1 21 21 MET H H 21 8.168 8.168 7.767 0.401 18420 389 1 10 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.851 -0.107 18420 390 1 10 . 1 1 22 22 ASN H H 22 7.905 7.905 7.848 0.057 18420 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 18420 2 1 1 "Average Difference" HA 24 0.245 0.144 0.203 18420 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18420 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18420 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18420 6 1 1 "Average Difference" HN 21 0.321 -0.074 0.320 18420 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18420 8 1 2 "Average Difference" HA 24 0.232 -0.029 0.235 18420 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18420 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18420 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18420 12 1 2 "Average Difference" HN 21 0.398 -0.164 0.372 18420 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18420 14 1 3 "Average Difference" HA 24 0.181 -0.009 0.184 18420 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18420 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18420 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18420 18 1 3 "Average Difference" HN 21 0.439 -0.277 0.350 18420 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18420 20 1 4 "Average Difference" HA 24 0.183 0.107 0.151 18420 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18420 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18420 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18420 24 1 4 "Average Difference" HN 21 0.359 -0.229 0.283 18420 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18420 26 1 5 "Average Difference" HA 24 0.232 0.013 0.237 18420 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18420 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18420 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18420 30 1 5 "Average Difference" HN 21 0.332 -0.095 0.326 18420 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18420 32 1 6 "Average Difference" HA 24 0.240 0.162 0.181 18420 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18420 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18420 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18420 36 1 6 "Average Difference" HN 21 0.427 -0.045 0.435 18420 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18420 38 1 7 "Average Difference" HA 24 0.247 0.160 0.193 18420 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18420 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18420 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18420 42 1 7 "Average Difference" HN 21 0.398 -0.075 0.400 18420 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18420 44 1 8 "Average Difference" HA 24 0.212 0.068 0.205 18420 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18420 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18420 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18420 48 1 8 "Average Difference" HN 21 0.424 -0.194 0.386 18420 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18420 50 1 9 "Average Difference" HA 24 0.256 0.169 0.197 18420 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18420 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18420 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18420 54 1 9 "Average Difference" HN 21 0.380 -0.027 0.388 18420 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18420 56 1 10 "Average Difference" HA 24 0.318 0.089 0.312 18420 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18420 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18420 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18420 60 1 10 "Average Difference" HN 21 0.502 -0.211 0.466 18420 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 18420 _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 4.269 4.269 4.264 0.005 18420 2 1 . 1 1 2 2 ILE H H 2 8.590 8.590 8.480 0.110 18420 3 1 . 1 1 3 3 GLY H H 3 8.591 8.591 8.411 0.180 18420 4 1 . 1 1 4 4 LYS HA H 4 4.138 4.138 4.488 -0.350 18420 5 1 . 1 1 4 4 LYS H H 4 7.854 7.854 8.051 -0.197 18420 6 1 . 1 1 5 5 PHE HA H 5 4.501 4.501 4.456 0.045 18420 7 1 . 1 1 5 5 PHE H H 5 7.897 7.897 8.042 -0.145 18420 8 1 . 1 1 6 6 LEU HA H 6 4.019 4.019 4.175 -0.157 18420 9 1 . 1 1 6 6 LEU H H 6 8.056 8.056 7.902 0.154 18420 10 1 . 1 1 7 7 HIS HA H 7 4.397 4.397 4.341 0.056 18420 11 1 . 1 1 7 7 HIS H H 7 8.196 8.196 7.702 0.494 18420 12 1 . 1 1 8 8 SER HA H 8 4.343 4.343 4.420 -0.077 18420 13 1 . 1 1 8 8 SER H H 8 8.022 8.022 7.933 0.089 18420 14 1 . 1 1 9 9 ALA HA H 9 4.083 4.083 4.063 0.020 18420 15 1 . 1 1 9 9 ALA H H 9 8.367 8.367 7.911 0.456 18420 16 1 . 1 1 10 10 LYS HA H 10 3.964 3.964 4.351 -0.387 18420 17 1 . 1 1 10 10 LYS H H 10 8.089 8.089 7.504 0.585 18420 18 1 . 1 1 11 11 LYS HA H 11 4.024 4.024 4.243 -0.219 18420 19 1 . 1 1 11 11 LYS H H 11 7.659 7.659 7.756 -0.097 18420 20 1 . 1 1 12 12 PHE HA H 12 4.459 4.459 4.752 -0.293 18420 21 1 . 1 1 12 12 PHE H H 12 8.196 8.196 8.086 0.110 18420 22 1 . 1 1 13 13 GLY H H 13 8.713 8.713 8.338 0.376 18420 23 1 . 1 1 14 14 LYS HA H 14 4.002 4.002 4.074 -0.072 18420 24 1 . 1 1 14 14 LYS H H 14 8.352 8.352 8.186 0.166 18420 25 1 . 1 1 15 15 ALA HA H 15 4.188 4.188 4.191 -0.003 18420 26 1 . 1 1 15 15 ALA H H 15 7.747 7.747 7.640 0.107 18420 27 1 . 1 1 16 16 PHE HA H 16 4.298 4.298 4.453 -0.155 18420 28 1 . 1 1 16 16 PHE H H 16 8.280 8.280 7.726 0.554 18420 29 1 . 1 1 17 17 VAL HA H 17 3.588 3.588 3.827 -0.239 18420 30 1 . 1 1 17 17 VAL H H 17 8.249 8.249 8.551 -0.302 18420 31 1 . 1 1 18 18 GLY H H 18 8.122 8.122 7.959 0.163 18420 32 1 . 1 1 19 19 GLU HA H 19 4.224 4.224 4.375 -0.151 18420 33 1 . 1 1 19 19 GLU H H 19 7.731 7.731 7.514 0.217 18420 34 1 . 1 1 20 20 ILE HA H 20 3.852 3.852 3.858 -0.006 18420 35 1 . 1 1 20 20 ILE H H 20 7.696 7.696 8.042 -0.346 18420 36 1 . 1 1 21 21 MET HA H 21 4.315 4.315 4.410 -0.095 18420 37 1 . 1 1 21 21 MET H H 21 8.168 8.168 7.843 0.325 18420 38 1 . 1 1 22 22 ASN HA H 22 4.744 4.744 4.827 -0.083 18420 39 1 . 1 1 22 22 ASN H H 22 7.905 7.905 7.986 -0.081 18420 stop_ save_