data_25911 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25911 _Entry.PDB_ID 2N9M 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 25911 _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 ALA HA H 2 4.834 4.834 4.846 -0.012 25911 2 1 1 . 1 1 2 2 ALA H H 2 8.667 8.667 8.658 0.009 25911 3 1 1 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.123 0.022 25911 4 1 1 . 1 1 3 3 ARG H H 3 8.096 8.096 8.328 -0.232 25911 5 1 1 . 1 1 4 4 GLY H H 4 8.285 8.285 8.310 -0.025 25911 6 1 1 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.491 0.102 25911 7 1 1 . 1 1 5 5 TRP H H 5 7.989 7.989 7.876 0.113 25911 8 1 1 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.502 -0.372 25911 9 1 1 . 1 1 6 6 LYS H H 6 8.021 8.021 7.576 0.445 25911 10 1 1 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.175 0.179 25911 11 1 1 . 1 1 7 7 ARG H H 7 8.257 8.257 8.338 -0.081 25911 12 1 1 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.452 -0.196 25911 13 1 1 . 1 1 8 8 LYS H H 8 8.207 8.207 7.681 0.526 25911 14 1 1 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.914 -0.127 25911 15 1 1 . 1 1 9 9 CYS H H 9 8.366 8.366 7.988 0.378 25911 16 1 1 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.001 0.259 25911 17 1 1 . 1 1 11 11 LEU H H 11 8.206 8.206 7.924 0.282 25911 18 1 1 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.692 -0.070 25911 19 1 1 . 1 1 12 12 PHE H H 12 8.184 8.184 7.274 0.910 25911 20 1 1 . 1 1 13 13 GLY H H 13 8.330 8.330 7.269 1.061 25911 21 1 1 . 1 1 14 14 LYS HA H 14 4.292 4.292 3.990 0.302 25911 22 1 1 . 1 1 14 14 LYS H H 14 8.542 8.542 8.040 0.502 25911 23 1 1 . 1 1 15 15 GLY H H 15 8.515 8.515 7.865 0.650 25911 24 1 2 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.523 0.311 25911 25 1 2 . 1 1 2 2 ALA H H 2 8.667 8.667 8.393 0.274 25911 26 1 2 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.150 -0.005 25911 27 1 2 . 1 1 3 3 ARG H H 3 8.096 8.096 7.664 0.432 25911 28 1 2 . 1 1 4 4 GLY H H 4 8.285 8.285 8.205 0.080 25911 29 1 2 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.387 0.206 25911 30 1 2 . 1 1 5 5 TRP H H 5 7.989 7.989 7.889 0.100 25911 31 1 2 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.615 -0.485 25911 32 1 2 . 1 1 6 6 LYS H H 6 8.021 8.021 7.877 0.144 25911 33 1 2 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.194 0.160 25911 34 1 2 . 1 1 7 7 ARG H H 7 8.257 8.257 8.382 -0.125 25911 35 1 2 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.518 -0.262 25911 36 1 2 . 1 1 8 8 LYS H H 8 8.207 8.207 7.736 0.471 25911 37 1 2 . 1 1 9 9 CYS HA H 9 4.787 4.787 5.007 -0.220 25911 38 1 2 . 1 1 9 9 CYS H H 9 8.366 8.366 7.793 0.573 25911 39 1 2 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.309 -0.049 25911 40 1 2 . 1 1 11 11 LEU H H 11 8.206 8.206 7.993 0.213 25911 41 1 2 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.651 -0.029 25911 42 1 2 . 1 1 12 12 PHE H H 12 8.184 8.184 7.400 0.784 25911 43 1 2 . 1 1 13 13 GLY H H 13 8.330 8.330 7.492 0.838 25911 44 1 2 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.329 -0.037 25911 45 1 2 . 1 1 14 14 LYS H H 14 8.542 8.542 7.502 1.040 25911 46 1 2 . 1 1 15 15 GLY H H 15 8.515 8.515 8.081 0.434 25911 47 1 3 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.674 0.160 25911 48 1 3 . 1 1 2 2 ALA H H 2 8.667 8.667 8.297 0.370 25911 49 1 3 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.344 -0.199 25911 50 1 3 . 1 1 3 3 ARG H H 3 8.096 8.096 8.067 0.029 25911 51 1 3 . 1 1 4 4 GLY H H 4 8.285 8.285 8.493 -0.208 25911 52 1 3 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.621 -0.028 25911 53 1 3 . 1 1 5 5 TRP H H 5 7.989 7.989 7.846 0.143 25911 54 1 3 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.383 -0.253 25911 55 1 3 . 1 1 6 6 LYS H H 6 8.021 8.021 8.181 -0.160 25911 56 1 3 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.132 0.222 25911 57 1 3 . 1 1 7 7 ARG H H 7 8.257 8.257 8.483 -0.226 25911 58 1 3 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.398 -0.142 25911 59 1 3 . 1 1 8 8 LYS H H 8 8.207 8.207 7.683 0.524 25911 60 1 3 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.881 -0.094 25911 61 1 3 . 1 1 9 9 CYS H H 9 8.366 8.366 7.929 0.437 25911 62 1 3 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.187 0.073 25911 63 1 3 . 1 1 11 11 LEU H H 11 8.206 8.206 8.012 0.194 25911 64 1 3 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.798 -0.176 25911 65 1 3 . 1 1 12 12 PHE H H 12 8.184 8.184 7.501 0.683 25911 66 1 3 . 1 1 13 13 GLY H H 13 8.330 8.330 7.951 0.379 25911 67 1 3 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.587 -0.295 25911 68 1 3 . 1 1 14 14 LYS H H 14 8.542 8.542 7.794 0.748 25911 69 1 3 . 1 1 15 15 GLY H H 15 8.515 8.515 8.346 0.169 25911 70 1 4 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.609 0.225 25911 71 1 4 . 1 1 2 2 ALA H H 2 8.667 8.667 8.167 0.500 25911 72 1 4 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.222 -0.077 25911 73 1 4 . 1 1 3 3 ARG H H 3 8.096 8.096 8.103 -0.007 25911 74 1 4 . 1 1 4 4 GLY H H 4 8.285 8.285 8.408 -0.123 25911 75 1 4 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.823 -0.230 25911 76 1 4 . 1 1 5 5 TRP H H 5 7.989 7.989 7.617 0.372 25911 77 1 4 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.403 -0.273 25911 78 1 4 . 1 1 6 6 LYS H H 6 8.021 8.021 7.756 0.265 25911 79 1 4 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.162 0.192 25911 80 1 4 . 1 1 7 7 ARG H H 7 8.257 8.257 8.488 -0.231 25911 81 1 4 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.319 -0.063 25911 82 1 4 . 1 1 8 8 LYS H H 8 8.207 8.207 7.613 0.594 25911 83 1 4 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.861 -0.074 25911 84 1 4 . 1 1 9 9 CYS H H 9 8.366 8.366 7.909 0.457 25911 85 1 4 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.183 0.077 25911 86 1 4 . 1 1 11 11 LEU H H 11 8.206 8.206 7.951 0.255 25911 87 1 4 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.722 -0.100 25911 88 1 4 . 1 1 12 12 PHE H H 12 8.184 8.184 7.401 0.783 25911 89 1 4 . 1 1 13 13 GLY H H 13 8.330 8.330 7.531 0.799 25911 90 1 4 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.618 -0.326 25911 91 1 4 . 1 1 14 14 LYS H H 14 8.542 8.542 8.063 0.479 25911 92 1 4 . 1 1 15 15 GLY H H 15 8.515 8.515 7.984 0.531 25911 93 1 5 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.737 0.097 25911 94 1 5 . 1 1 2 2 ALA H H 2 8.667 8.667 8.209 0.458 25911 95 1 5 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.366 -0.221 25911 96 1 5 . 1 1 3 3 ARG H H 3 8.096 8.096 7.987 0.109 25911 97 1 5 . 1 1 4 4 GLY H H 4 8.285 8.285 8.277 0.008 25911 98 1 5 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.867 -0.274 25911 99 1 5 . 1 1 5 5 TRP H H 5 7.989 7.989 7.260 0.729 25911 100 1 5 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.305 -0.175 25911 101 1 5 . 1 1 6 6 LYS H H 6 8.021 8.021 7.494 0.527 25911 102 1 5 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.466 -0.112 25911 103 1 5 . 1 1 7 7 ARG H H 7 8.257 8.257 8.182 0.075 25911 104 1 5 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.274 -0.018 25911 105 1 5 . 1 1 8 8 LYS H H 8 8.207 8.207 8.538 -0.331 25911 106 1 5 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.952 -0.165 25911 107 1 5 . 1 1 9 9 CYS H H 9 8.366 8.366 8.468 -0.102 25911 108 1 5 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.107 0.153 25911 109 1 5 . 1 1 11 11 LEU H H 11 8.206 8.206 7.764 0.442 25911 110 1 5 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.759 -0.137 25911 111 1 5 . 1 1 12 12 PHE H H 12 8.184 8.184 7.622 0.562 25911 112 1 5 . 1 1 13 13 GLY H H 13 8.330 8.330 8.264 0.066 25911 113 1 5 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.078 0.214 25911 114 1 5 . 1 1 14 14 LYS H H 14 8.542 8.542 7.666 0.876 25911 115 1 5 . 1 1 15 15 GLY H H 15 8.515 8.515 8.428 0.087 25911 116 1 6 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.579 0.255 25911 117 1 6 . 1 1 2 2 ALA H H 2 8.667 8.667 8.485 0.182 25911 118 1 6 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.085 0.060 25911 119 1 6 . 1 1 3 3 ARG H H 3 8.096 8.096 7.605 0.491 25911 120 1 6 . 1 1 4 4 GLY H H 4 8.285 8.285 8.052 0.233 25911 121 1 6 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.543 0.050 25911 122 1 6 . 1 1 5 5 TRP H H 5 7.989 7.989 7.651 0.338 25911 123 1 6 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.627 -0.497 25911 124 1 6 . 1 1 6 6 LYS H H 6 8.021 8.021 8.028 -0.007 25911 125 1 6 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.176 0.178 25911 126 1 6 . 1 1 7 7 ARG H H 7 8.257 8.257 8.590 -0.333 25911 127 1 6 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.428 -0.172 25911 128 1 6 . 1 1 8 8 LYS H H 8 8.207 8.207 8.158 0.049 25911 129 1 6 . 1 1 9 9 CYS HA H 9 4.787 4.787 5.079 -0.292 25911 130 1 6 . 1 1 9 9 CYS H H 9 8.366 8.366 8.102 0.264 25911 131 1 6 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.122 0.138 25911 132 1 6 . 1 1 11 11 LEU H H 11 8.206 8.206 7.801 0.405 25911 133 1 6 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.678 -0.056 25911 134 1 6 . 1 1 12 12 PHE H H 12 8.184 8.184 7.732 0.452 25911 135 1 6 . 1 1 13 13 GLY H H 13 8.330 8.330 7.836 0.494 25911 136 1 6 . 1 1 14 14 LYS HA H 14 4.292 4.292 3.951 0.341 25911 137 1 6 . 1 1 14 14 LYS H H 14 8.542 8.542 7.779 0.763 25911 138 1 6 . 1 1 15 15 GLY H H 15 8.515 8.515 7.685 0.830 25911 139 1 7 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.829 0.005 25911 140 1 7 . 1 1 2 2 ALA H H 2 8.667 8.667 8.172 0.495 25911 141 1 7 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.256 -0.111 25911 142 1 7 . 1 1 3 3 ARG H H 3 8.096 8.096 8.194 -0.098 25911 143 1 7 . 1 1 4 4 GLY H H 4 8.285 8.285 8.283 0.002 25911 144 1 7 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.725 -0.132 25911 145 1 7 . 1 1 5 5 TRP H H 5 7.989 7.989 7.640 0.349 25911 146 1 7 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.341 -0.211 25911 147 1 7 . 1 1 6 6 LYS H H 6 8.021 8.021 8.223 -0.202 25911 148 1 7 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.129 0.225 25911 149 1 7 . 1 1 7 7 ARG H H 7 8.257 8.257 8.541 -0.284 25911 150 1 7 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.305 -0.049 25911 151 1 7 . 1 1 8 8 LYS H H 8 8.207 8.207 7.825 0.382 25911 152 1 7 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.868 -0.081 25911 153 1 7 . 1 1 9 9 CYS H H 9 8.366 8.366 7.712 0.654 25911 154 1 7 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.059 0.201 25911 155 1 7 . 1 1 11 11 LEU H H 11 8.206 8.206 7.869 0.337 25911 156 1 7 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.826 -0.204 25911 157 1 7 . 1 1 12 12 PHE H H 12 8.184 8.184 7.444 0.740 25911 158 1 7 . 1 1 13 13 GLY H H 13 8.330 8.330 7.562 0.768 25911 159 1 7 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.051 0.241 25911 160 1 7 . 1 1 14 14 LYS H H 14 8.542 8.542 8.195 0.347 25911 161 1 7 . 1 1 15 15 GLY H H 15 8.515 8.515 8.008 0.507 25911 162 1 8 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.677 0.157 25911 163 1 8 . 1 1 2 2 ALA H H 2 8.667 8.667 8.240 0.427 25911 164 1 8 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.072 0.073 25911 165 1 8 . 1 1 3 3 ARG H H 3 8.096 8.096 7.778 0.318 25911 166 1 8 . 1 1 4 4 GLY H H 4 8.285 8.285 8.178 0.107 25911 167 1 8 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.563 0.030 25911 168 1 8 . 1 1 5 5 TRP H H 5 7.989 7.989 7.668 0.321 25911 169 1 8 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.495 -0.365 25911 170 1 8 . 1 1 6 6 LYS H H 6 8.021 8.021 8.231 -0.210 25911 171 1 8 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.198 0.156 25911 172 1 8 . 1 1 7 7 ARG H H 7 8.257 8.257 8.535 -0.278 25911 173 1 8 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.405 -0.149 25911 174 1 8 . 1 1 8 8 LYS H H 8 8.207 8.207 8.295 -0.088 25911 175 1 8 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.918 -0.131 25911 176 1 8 . 1 1 9 9 CYS H H 9 8.366 8.366 8.131 0.235 25911 177 1 8 . 1 1 11 11 LEU HA H 11 4.260 4.260 3.903 0.357 25911 178 1 8 . 1 1 11 11 LEU H H 11 8.206 8.206 7.853 0.353 25911 179 1 8 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.536 0.086 25911 180 1 8 . 1 1 12 12 PHE H H 12 8.184 8.184 7.024 1.160 25911 181 1 8 . 1 1 13 13 GLY H H 13 8.330 8.330 7.631 0.699 25911 182 1 8 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.317 -0.025 25911 183 1 8 . 1 1 14 14 LYS H H 14 8.542 8.542 7.471 1.071 25911 184 1 8 . 1 1 15 15 GLY H H 15 8.515 8.515 8.396 0.119 25911 185 1 9 . 1 1 2 2 ALA HA H 2 4.834 4.834 3.867 0.967 25911 186 1 9 . 1 1 2 2 ALA H H 2 8.667 8.667 7.994 0.673 25911 187 1 9 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.152 -0.007 25911 188 1 9 . 1 1 3 3 ARG H H 3 8.096 8.096 8.436 -0.340 25911 189 1 9 . 1 1 4 4 GLY H H 4 8.285 8.285 8.227 0.058 25911 190 1 9 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.375 0.218 25911 191 1 9 . 1 1 5 5 TRP H H 5 7.989 7.989 7.603 0.386 25911 192 1 9 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.256 -0.126 25911 193 1 9 . 1 1 6 6 LYS H H 6 8.021 8.021 8.230 -0.209 25911 194 1 9 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.110 0.244 25911 195 1 9 . 1 1 7 7 ARG H H 7 8.257 8.257 7.658 0.599 25911 196 1 9 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.414 -0.158 25911 197 1 9 . 1 1 8 8 LYS H H 8 8.207 8.207 8.441 -0.234 25911 198 1 9 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.972 -0.185 25911 199 1 9 . 1 1 9 9 CYS H H 9 8.366 8.366 8.336 0.030 25911 200 1 9 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.157 0.103 25911 201 1 9 . 1 1 11 11 LEU H H 11 8.206 8.206 7.793 0.413 25911 202 1 9 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.580 0.042 25911 203 1 9 . 1 1 12 12 PHE H H 12 8.184 8.184 7.448 0.736 25911 204 1 9 . 1 1 13 13 GLY H H 13 8.330 8.330 7.542 0.788 25911 205 1 9 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.148 0.144 25911 206 1 9 . 1 1 14 14 LYS H H 14 8.542 8.542 7.786 0.756 25911 207 1 9 . 1 1 15 15 GLY H H 15 8.515 8.515 8.573 -0.058 25911 208 1 10 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.263 0.571 25911 209 1 10 . 1 1 2 2 ALA H H 2 8.667 8.667 8.048 0.619 25911 210 1 10 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.212 -0.067 25911 211 1 10 . 1 1 3 3 ARG H H 3 8.096 8.096 8.219 -0.123 25911 212 1 10 . 1 1 4 4 GLY H H 4 8.285 8.285 8.593 -0.308 25911 213 1 10 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.771 -0.178 25911 214 1 10 . 1 1 5 5 TRP H H 5 7.989 7.989 7.787 0.202 25911 215 1 10 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.317 -0.187 25911 216 1 10 . 1 1 6 6 LYS H H 6 8.021 8.021 8.197 -0.176 25911 217 1 10 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.234 0.120 25911 218 1 10 . 1 1 7 7 ARG H H 7 8.257 8.257 8.536 -0.279 25911 219 1 10 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.374 -0.118 25911 220 1 10 . 1 1 8 8 LYS H H 8 8.207 8.207 8.115 0.092 25911 221 1 10 . 1 1 9 9 CYS HA H 9 4.787 4.787 5.068 -0.281 25911 222 1 10 . 1 1 9 9 CYS H H 9 8.366 8.366 8.006 0.360 25911 223 1 10 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.111 0.149 25911 224 1 10 . 1 1 11 11 LEU H H 11 8.206 8.206 7.927 0.279 25911 225 1 10 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.715 -0.093 25911 226 1 10 . 1 1 12 12 PHE H H 12 8.184 8.184 7.777 0.407 25911 227 1 10 . 1 1 13 13 GLY H H 13 8.330 8.330 8.092 0.238 25911 228 1 10 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.077 0.215 25911 229 1 10 . 1 1 14 14 LYS H H 14 8.542 8.542 7.742 0.800 25911 230 1 10 . 1 1 15 15 GLY H H 15 8.515 8.515 7.678 0.837 25911 231 1 11 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.786 0.048 25911 232 1 11 . 1 1 2 2 ALA H H 2 8.667 8.667 8.142 0.525 25911 233 1 11 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.192 -0.047 25911 234 1 11 . 1 1 3 3 ARG H H 3 8.096 8.096 8.128 -0.032 25911 235 1 11 . 1 1 4 4 GLY H H 4 8.285 8.285 8.316 -0.031 25911 236 1 11 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.935 -0.342 25911 237 1 11 . 1 1 5 5 TRP H H 5 7.989 7.989 7.764 0.225 25911 238 1 11 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.738 -0.608 25911 239 1 11 . 1 1 6 6 LYS H H 6 8.021 8.021 7.973 0.048 25911 240 1 11 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.107 0.247 25911 241 1 11 . 1 1 7 7 ARG H H 7 8.257 8.257 8.269 -0.012 25911 242 1 11 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.090 0.166 25911 243 1 11 . 1 1 8 8 LYS H H 8 8.207 8.207 8.407 -0.200 25911 244 1 11 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.808 -0.021 25911 245 1 11 . 1 1 9 9 CYS H H 9 8.366 8.366 7.796 0.570 25911 246 1 11 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.028 0.232 25911 247 1 11 . 1 1 11 11 LEU H H 11 8.206 8.206 8.105 0.101 25911 248 1 11 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.801 -0.179 25911 249 1 11 . 1 1 12 12 PHE H H 12 8.184 8.184 7.505 0.679 25911 250 1 11 . 1 1 13 13 GLY H H 13 8.330 8.330 7.847 0.483 25911 251 1 11 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.074 0.218 25911 252 1 11 . 1 1 14 14 LYS H H 14 8.542 8.542 8.159 0.383 25911 253 1 11 . 1 1 15 15 GLY H H 15 8.515 8.515 8.245 0.270 25911 254 1 12 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.826 0.008 25911 255 1 12 . 1 1 2 2 ALA H H 2 8.667 8.667 8.276 0.391 25911 256 1 12 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.435 -0.290 25911 257 1 12 . 1 1 3 3 ARG H H 3 8.096 8.096 7.886 0.210 25911 258 1 12 . 1 1 4 4 GLY H H 4 8.285 8.285 8.477 -0.192 25911 259 1 12 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.868 -0.275 25911 260 1 12 . 1 1 5 5 TRP H H 5 7.989 7.989 7.099 0.890 25911 261 1 12 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.087 0.043 25911 262 1 12 . 1 1 6 6 LYS H H 6 8.021 8.021 8.073 -0.052 25911 263 1 12 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.356 -0.002 25911 264 1 12 . 1 1 7 7 ARG H H 7 8.257 8.257 8.247 0.010 25911 265 1 12 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.339 -0.083 25911 266 1 12 . 1 1 8 8 LYS H H 8 8.207 8.207 8.323 -0.116 25911 267 1 12 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.898 -0.111 25911 268 1 12 . 1 1 9 9 CYS H H 9 8.366 8.366 8.437 -0.071 25911 269 1 12 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.147 0.113 25911 270 1 12 . 1 1 11 11 LEU H H 11 8.206 8.206 7.901 0.305 25911 271 1 12 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.693 -0.071 25911 272 1 12 . 1 1 12 12 PHE H H 12 8.184 8.184 7.538 0.646 25911 273 1 12 . 1 1 13 13 GLY H H 13 8.330 8.330 7.587 0.743 25911 274 1 12 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.514 -0.222 25911 275 1 12 . 1 1 14 14 LYS H H 14 8.542 8.542 7.783 0.759 25911 276 1 12 . 1 1 15 15 GLY H H 15 8.515 8.515 8.420 0.095 25911 277 1 13 . 1 1 2 2 ALA HA H 2 4.834 4.834 3.679 1.155 25911 278 1 13 . 1 1 2 2 ALA H H 2 8.667 8.667 8.183 0.484 25911 279 1 13 . 1 1 3 3 ARG HA H 3 4.145 4.145 3.839 0.306 25911 280 1 13 . 1 1 3 3 ARG H H 3 8.096 8.096 7.905 0.191 25911 281 1 13 . 1 1 4 4 GLY H H 4 8.285 8.285 7.941 0.344 25911 282 1 13 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.388 0.205 25911 283 1 13 . 1 1 5 5 TRP H H 5 7.989 7.989 7.716 0.273 25911 284 1 13 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.629 -0.499 25911 285 1 13 . 1 1 6 6 LYS H H 6 8.021 8.021 8.209 -0.188 25911 286 1 13 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.259 0.095 25911 287 1 13 . 1 1 7 7 ARG H H 7 8.257 8.257 8.295 -0.038 25911 288 1 13 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.151 0.105 25911 289 1 13 . 1 1 8 8 LYS H H 8 8.207 8.207 8.276 -0.069 25911 290 1 13 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.848 -0.061 25911 291 1 13 . 1 1 9 9 CYS H H 9 8.366 8.366 8.149 0.217 25911 292 1 13 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.185 0.075 25911 293 1 13 . 1 1 11 11 LEU H H 11 8.206 8.206 7.784 0.422 25911 294 1 13 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.754 -0.132 25911 295 1 13 . 1 1 12 12 PHE H H 12 8.184 8.184 7.176 1.008 25911 296 1 13 . 1 1 13 13 GLY H H 13 8.330 8.330 8.322 0.008 25911 297 1 13 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.445 -0.153 25911 298 1 13 . 1 1 14 14 LYS H H 14 8.542 8.542 8.042 0.500 25911 299 1 13 . 1 1 15 15 GLY H H 15 8.515 8.515 8.253 0.262 25911 300 1 14 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.533 0.301 25911 301 1 14 . 1 1 2 2 ALA H H 2 8.667 8.667 8.319 0.348 25911 302 1 14 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.242 -0.097 25911 303 1 14 . 1 1 3 3 ARG H H 3 8.096 8.096 7.804 0.292 25911 304 1 14 . 1 1 4 4 GLY H H 4 8.285 8.285 8.625 -0.340 25911 305 1 14 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.789 -0.196 25911 306 1 14 . 1 1 5 5 TRP H H 5 7.989 7.989 7.706 0.283 25911 307 1 14 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.294 -0.164 25911 308 1 14 . 1 1 6 6 LYS H H 6 8.021 8.021 7.840 0.181 25911 309 1 14 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.087 0.267 25911 310 1 14 . 1 1 7 7 ARG H H 7 8.257 8.257 8.406 -0.149 25911 311 1 14 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.155 0.101 25911 312 1 14 . 1 1 8 8 LYS H H 8 8.207 8.207 8.188 0.019 25911 313 1 14 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.831 -0.044 25911 314 1 14 . 1 1 9 9 CYS H H 9 8.366 8.366 7.796 0.570 25911 315 1 14 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.213 0.047 25911 316 1 14 . 1 1 11 11 LEU H H 11 8.206 8.206 7.850 0.356 25911 317 1 14 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.735 -0.113 25911 318 1 14 . 1 1 12 12 PHE H H 12 8.184 8.184 7.509 0.675 25911 319 1 14 . 1 1 13 13 GLY H H 13 8.330 8.330 7.595 0.735 25911 320 1 14 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.267 0.025 25911 321 1 14 . 1 1 14 14 LYS H H 14 8.542 8.542 7.521 1.021 25911 322 1 14 . 1 1 15 15 GLY H H 15 8.515 8.515 8.008 0.507 25911 323 1 15 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.518 0.316 25911 324 1 15 . 1 1 2 2 ALA H H 2 8.667 8.667 8.150 0.517 25911 325 1 15 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.231 -0.086 25911 326 1 15 . 1 1 3 3 ARG H H 3 8.096 8.096 8.115 -0.019 25911 327 1 15 . 1 1 4 4 GLY H H 4 8.285 8.285 8.211 0.074 25911 328 1 15 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.460 0.133 25911 329 1 15 . 1 1 5 5 TRP H H 5 7.989 7.989 7.762 0.227 25911 330 1 15 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.405 -0.275 25911 331 1 15 . 1 1 6 6 LYS H H 6 8.021 8.021 8.539 -0.518 25911 332 1 15 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.259 0.095 25911 333 1 15 . 1 1 7 7 ARG H H 7 8.257 8.257 8.012 0.245 25911 334 1 15 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.470 -0.214 25911 335 1 15 . 1 1 8 8 LYS H H 8 8.207 8.207 8.565 -0.358 25911 336 1 15 . 1 1 9 9 CYS HA H 9 4.787 4.787 5.112 -0.325 25911 337 1 15 . 1 1 9 9 CYS H H 9 8.366 8.366 8.381 -0.015 25911 338 1 15 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.168 0.092 25911 339 1 15 . 1 1 11 11 LEU H H 11 8.206 8.206 7.979 0.227 25911 340 1 15 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.689 -0.067 25911 341 1 15 . 1 1 12 12 PHE H H 12 8.184 8.184 7.597 0.587 25911 342 1 15 . 1 1 13 13 GLY H H 13 8.330 8.330 7.673 0.657 25911 343 1 15 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.231 0.061 25911 344 1 15 . 1 1 14 14 LYS H H 14 8.542 8.542 7.472 1.070 25911 345 1 15 . 1 1 15 15 GLY H H 15 8.515 8.515 8.128 0.387 25911 346 1 16 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.342 0.492 25911 347 1 16 . 1 1 2 2 ALA H H 2 8.667 8.667 7.869 0.798 25911 348 1 16 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.129 0.016 25911 349 1 16 . 1 1 3 3 ARG H H 3 8.096 8.096 8.005 0.091 25911 350 1 16 . 1 1 4 4 GLY H H 4 8.285 8.285 8.601 -0.316 25911 351 1 16 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.767 -0.174 25911 352 1 16 . 1 1 5 5 TRP H H 5 7.989 7.989 7.687 0.302 25911 353 1 16 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.116 0.014 25911 354 1 16 . 1 1 6 6 LYS H H 6 8.021 8.021 8.213 -0.192 25911 355 1 16 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.332 0.022 25911 356 1 16 . 1 1 7 7 ARG H H 7 8.257 8.257 8.292 -0.035 25911 357 1 16 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.138 0.118 25911 358 1 16 . 1 1 8 8 LYS H H 8 8.207 8.207 7.874 0.333 25911 359 1 16 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.770 0.017 25911 360 1 16 . 1 1 9 9 CYS H H 9 8.366 8.366 7.797 0.569 25911 361 1 16 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.135 0.125 25911 362 1 16 . 1 1 11 11 LEU H H 11 8.206 8.206 7.970 0.236 25911 363 1 16 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.703 -0.081 25911 364 1 16 . 1 1 12 12 PHE H H 12 8.184 8.184 7.767 0.417 25911 365 1 16 . 1 1 13 13 GLY H H 13 8.330 8.330 8.440 -0.110 25911 366 1 16 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.098 0.194 25911 367 1 16 . 1 1 14 14 LYS H H 14 8.542 8.542 7.542 1.000 25911 368 1 16 . 1 1 15 15 GLY H H 15 8.515 8.515 7.703 0.812 25911 369 1 17 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.335 0.499 25911 370 1 17 . 1 1 2 2 ALA H H 2 8.667 8.667 8.849 -0.182 25911 371 1 17 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.188 -0.043 25911 372 1 17 . 1 1 3 3 ARG H H 3 8.096 8.096 8.140 -0.045 25911 373 1 17 . 1 1 4 4 GLY H H 4 8.285 8.285 7.081 1.204 25911 374 1 17 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.886 -0.293 25911 375 1 17 . 1 1 5 5 TRP H H 5 7.989 7.989 7.113 0.876 25911 376 1 17 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.287 -0.157 25911 377 1 17 . 1 1 6 6 LYS H H 6 8.021 8.021 8.251 -0.230 25911 378 1 17 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.145 0.209 25911 379 1 17 . 1 1 7 7 ARG H H 7 8.257 8.257 8.413 -0.156 25911 380 1 17 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.326 -0.070 25911 381 1 17 . 1 1 8 8 LYS H H 8 8.207 8.207 8.383 -0.176 25911 382 1 17 . 1 1 9 9 CYS HA H 9 4.787 4.787 5.010 -0.223 25911 383 1 17 . 1 1 9 9 CYS H H 9 8.366 8.366 8.251 0.115 25911 384 1 17 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.106 0.154 25911 385 1 17 . 1 1 11 11 LEU H H 11 8.206 8.206 8.062 0.144 25911 386 1 17 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.701 -0.079 25911 387 1 17 . 1 1 12 12 PHE H H 12 8.184 8.184 7.606 0.578 25911 388 1 17 . 1 1 13 13 GLY H H 13 8.330 8.330 7.991 0.339 25911 389 1 17 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.148 0.144 25911 390 1 17 . 1 1 14 14 LYS H H 14 8.542 8.542 8.331 0.211 25911 391 1 17 . 1 1 15 15 GLY H H 15 8.515 8.515 8.437 0.078 25911 392 1 18 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.371 0.463 25911 393 1 18 . 1 1 2 2 ALA H H 2 8.667 8.667 8.378 0.289 25911 394 1 18 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.154 -0.009 25911 395 1 18 . 1 1 3 3 ARG H H 3 8.096 8.096 8.077 0.019 25911 396 1 18 . 1 1 4 4 GLY H H 4 8.285 8.285 7.110 1.175 25911 397 1 18 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.813 -0.220 25911 398 1 18 . 1 1 5 5 TRP H H 5 7.989 7.989 7.049 0.940 25911 399 1 18 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.117 0.013 25911 400 1 18 . 1 1 6 6 LYS H H 6 8.021 8.021 8.190 -0.169 25911 401 1 18 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.399 -0.045 25911 402 1 18 . 1 1 7 7 ARG H H 7 8.257 8.257 8.387 -0.130 25911 403 1 18 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.372 -0.116 25911 404 1 18 . 1 1 8 8 LYS H H 8 8.207 8.207 8.127 0.080 25911 405 1 18 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.969 -0.182 25911 406 1 18 . 1 1 9 9 CYS H H 9 8.366 8.366 8.625 -0.259 25911 407 1 18 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.157 0.103 25911 408 1 18 . 1 1 11 11 LEU H H 11 8.206 8.206 8.029 0.177 25911 409 1 18 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.734 -0.112 25911 410 1 18 . 1 1 12 12 PHE H H 12 8.184 8.184 7.507 0.677 25911 411 1 18 . 1 1 13 13 GLY H H 13 8.330 8.330 7.913 0.417 25911 412 1 18 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.269 0.023 25911 413 1 18 . 1 1 14 14 LYS H H 14 8.542 8.542 7.913 0.629 25911 414 1 18 . 1 1 15 15 GLY H H 15 8.515 8.515 8.440 0.075 25911 415 1 19 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.211 0.623 25911 416 1 19 . 1 1 2 2 ALA H H 2 8.667 8.667 8.326 0.341 25911 417 1 19 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.097 0.048 25911 418 1 19 . 1 1 3 3 ARG H H 3 8.096 8.096 8.043 0.053 25911 419 1 19 . 1 1 4 4 GLY H H 4 8.285 8.285 8.166 0.119 25911 420 1 19 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.958 -0.365 25911 421 1 19 . 1 1 5 5 TRP H H 5 7.989 7.989 7.770 0.219 25911 422 1 19 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.721 -0.591 25911 423 1 19 . 1 1 6 6 LYS H H 6 8.021 8.021 8.283 -0.262 25911 424 1 19 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.204 0.150 25911 425 1 19 . 1 1 7 7 ARG H H 7 8.257 8.257 8.369 -0.112 25911 426 1 19 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.465 -0.209 25911 427 1 19 . 1 1 8 8 LYS H H 8 8.207 8.207 8.185 0.022 25911 428 1 19 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.952 -0.165 25911 429 1 19 . 1 1 9 9 CYS H H 9 8.366 8.366 8.030 0.336 25911 430 1 19 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.446 -0.186 25911 431 1 19 . 1 1 11 11 LEU H H 11 8.206 8.206 7.759 0.447 25911 432 1 19 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.710 -0.088 25911 433 1 19 . 1 1 12 12 PHE H H 12 8.184 8.184 7.307 0.877 25911 434 1 19 . 1 1 13 13 GLY H H 13 8.330 8.330 8.264 0.066 25911 435 1 19 . 1 1 14 14 LYS HA H 14 4.292 4.292 3.952 0.340 25911 436 1 19 . 1 1 14 14 LYS H H 14 8.542 8.542 8.015 0.527 25911 437 1 19 . 1 1 15 15 GLY H H 15 8.515 8.515 7.997 0.518 25911 438 1 20 . 1 1 2 2 ALA HA H 2 4.834 4.834 4.814 0.020 25911 439 1 20 . 1 1 2 2 ALA H H 2 8.667 8.667 7.954 0.713 25911 440 1 20 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.393 -0.248 25911 441 1 20 . 1 1 3 3 ARG H H 3 8.096 8.096 8.241 -0.145 25911 442 1 20 . 1 1 4 4 GLY H H 4 8.285 8.285 8.540 -0.255 25911 443 1 20 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.245 0.348 25911 444 1 20 . 1 1 5 5 TRP H H 5 7.989 7.989 8.365 -0.376 25911 445 1 20 . 1 1 6 6 LYS HA H 6 4.130 4.130 3.463 0.667 25911 446 1 20 . 1 1 6 6 LYS H H 6 8.021 8.021 7.297 0.724 25911 447 1 20 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.040 0.314 25911 448 1 20 . 1 1 7 7 ARG H H 7 8.257 8.257 7.974 0.283 25911 449 1 20 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.385 -0.129 25911 450 1 20 . 1 1 8 8 LYS H H 8 8.207 8.207 7.818 0.389 25911 451 1 20 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.922 -0.135 25911 452 1 20 . 1 1 9 9 CYS H H 9 8.366 8.366 8.204 0.162 25911 453 1 20 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.248 0.012 25911 454 1 20 . 1 1 11 11 LEU H H 11 8.206 8.206 7.906 0.300 25911 455 1 20 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.874 -0.252 25911 456 1 20 . 1 1 12 12 PHE H H 12 8.184 8.184 7.563 0.621 25911 457 1 20 . 1 1 13 13 GLY H H 13 8.330 8.330 7.822 0.508 25911 458 1 20 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.399 -0.107 25911 459 1 20 . 1 1 14 14 LYS H H 14 8.542 8.542 7.927 0.615 25911 460 1 20 . 1 1 15 15 GLY H H 15 8.515 8.515 8.091 0.424 25911 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 25911 2 1 1 "Average Difference" HA 16 0.276 -0.016 0.285 25911 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25911 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25911 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25911 6 1 1 "Average Difference" HN 13 0.512 -0.349 0.389 25911 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25911 8 1 2 "Average Difference" HA 16 0.255 0.065 0.254 25911 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25911 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25911 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25911 12 1 2 "Average Difference" HN 13 0.519 -0.404 0.338 25911 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25911 14 1 3 "Average Difference" HA 16 0.221 0.110 0.198 25911 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25911 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25911 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25911 18 1 3 "Average Difference" HN 13 0.390 -0.237 0.323 25911 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25911 20 1 4 "Average Difference" HA 16 0.286 0.177 0.232 25911 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25911 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25911 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25911 24 1 4 "Average Difference" HN 13 0.474 -0.360 0.321 25911 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25911 26 1 5 "Average Difference" HA 16 0.196 0.016 0.201 25911 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25911 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25911 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25911 30 1 5 "Average Difference" HN 13 0.434 -0.270 0.354 25911 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25911 32 1 6 "Average Difference" HA 16 0.335 -0.075 0.337 25911 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25911 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25911 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25911 36 1 6 "Average Difference" HN 13 0.439 -0.320 0.313 25911 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25911 38 1 7 "Average Difference" HA 16 0.183 0.040 0.185 25911 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25911 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25911 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25911 42 1 7 "Average Difference" HN 13 0.456 -0.307 0.350 25911 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25911 44 1 8 "Average Difference" HA 16 0.291 -0.046 0.297 25911 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25911 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25911 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25911 48 1 8 "Average Difference" HN 13 0.534 -0.326 0.440 25911 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25911 50 1 9 "Average Difference" HA 16 0.285 -0.053 0.289 25911 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25911 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25911 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25911 54 1 9 "Average Difference" HN 13 0.487 -0.277 0.417 25911 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25911 56 1 10 "Average Difference" HA 16 0.265 -0.027 0.273 25911 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25911 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25911 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25911 60 1 10 "Average Difference" HN 13 0.432 -0.227 0.382 25911 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25911 62 1 11 "Average Difference" HA 16 0.261 0.065 0.261 25911 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25911 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25911 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25911 66 1 11 "Average Difference" HN 13 0.353 -0.231 0.277 25911 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25911 68 1 12 "Average Difference" HA 16 0.255 0.070 0.253 25911 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25911 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25911 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25911 72 1 12 "Average Difference" HN 13 0.455 -0.278 0.375 25911 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25911 74 1 13 "Average Difference" HA 16 0.358 0.004 0.370 25911 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25911 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25911 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25911 78 1 13 "Average Difference" HN 13 0.399 -0.263 0.312 25911 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25911 80 1 14 "Average Difference" HA 16 0.193 0.024 0.198 25911 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25911 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25911 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25911 84 1 14 "Average Difference" HN 13 0.497 -0.346 0.371 25911 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25911 86 1 15 "Average Difference" HA 16 0.230 0.018 0.237 25911 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25911 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25911 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25911 90 1 15 "Average Difference" HN 13 0.473 -0.237 0.426 25911 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25911 92 1 16 "Average Difference" HA 16 0.210 -0.047 0.211 25911 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25911 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25911 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25911 96 1 16 "Average Difference" HN 13 0.497 -0.300 0.412 25911 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25911 98 1 17 "Average Difference" HA 16 0.248 0.092 0.238 25911 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25911 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25911 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25911 102 1 17 "Average Difference" HN 13 0.472 -0.212 0.439 25911 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25911 104 1 18 "Average Difference" HA 16 0.240 0.116 0.217 25911 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25911 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25911 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25911 108 1 18 "Average Difference" HN 13 0.521 -0.301 0.442 25911 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25911 110 1 19 "Average Difference" HA 16 0.291 0.035 0.298 25911 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25911 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25911 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25911 114 1 19 "Average Difference" HN 13 0.382 -0.242 0.307 25911 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25911 116 1 20 "Average Difference" HA 16 0.251 -0.011 0.259 25911 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25911 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25911 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25911 120 1 20 "Average Difference" HN 13 0.465 -0.305 0.365 25911 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 25911 _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 ALA HA H 2 4.834 4.834 4.501 0.333 25911 2 1 . 1 1 2 2 ALA H H 2 8.667 8.667 8.255 0.412 25911 3 1 . 1 1 3 3 ARG HA H 3 4.145 4.145 4.194 -0.049 25911 4 1 . 1 1 3 3 ARG H H 3 8.096 8.096 8.036 0.060 25911 5 1 . 1 1 4 4 GLY H H 4 8.285 8.285 8.205 0.080 25911 6 1 . 1 1 5 5 TRP HA H 5 4.593 4.593 4.664 -0.071 25911 7 1 . 1 1 5 5 TRP H H 5 7.989 7.989 7.643 0.346 25911 8 1 . 1 1 6 6 LYS HA H 6 4.130 4.130 4.355 -0.225 25911 9 1 . 1 1 6 6 LYS H H 6 8.021 8.021 8.033 -0.012 25911 10 1 . 1 1 7 7 ARG HA H 7 4.354 4.354 4.208 0.146 25911 11 1 . 1 1 7 7 ARG H H 7 8.257 8.257 8.320 -0.063 25911 12 1 . 1 1 8 8 LYS HA H 8 4.256 4.256 4.339 -0.083 25911 13 1 . 1 1 8 8 LYS H H 8 8.207 8.207 8.112 0.095 25911 14 1 . 1 1 9 9 CYS HA H 9 4.787 4.787 4.932 -0.145 25911 15 1 . 1 1 9 9 CYS H H 9 8.366 8.366 8.092 0.274 25911 16 1 . 1 1 11 11 LEU HA H 11 4.260 4.260 4.149 0.111 25911 17 1 . 1 1 11 11 LEU H H 11 8.206 8.206 7.912 0.294 25911 18 1 . 1 1 12 12 PHE HA H 12 4.622 4.622 4.718 -0.096 25911 19 1 . 1 1 12 12 PHE H H 12 8.184 8.184 7.485 0.699 25911 20 1 . 1 1 13 13 GLY H H 13 8.330 8.330 7.831 0.499 25911 21 1 . 1 1 14 14 LYS HA H 14 4.292 4.292 4.227 0.065 25911 22 1 . 1 1 14 14 LYS H H 14 8.542 8.542 7.837 0.705 25911 23 1 . 1 1 15 15 GLY H H 15 8.515 8.515 8.138 0.377 25911 stop_ save_