data_25457 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25457 _Entry.PDB_ID 2MYM 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 25457 _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 SER HA H 2 4.330 4.330 4.485 -0.155 25457 2 1 1 . 1 1 2 2 SER H H 2 8.140 8.140 8.953 -0.813 25457 3 1 1 . 1 1 3 3 GLY H H 3 8.340 8.340 7.849 0.491 25457 4 1 1 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.522 -0.282 25457 5 1 1 . 1 1 4 4 LEU H H 4 7.880 7.880 8.354 -0.474 25457 6 1 1 . 1 1 5 5 SER HA H 5 4.280 4.280 4.305 -0.025 25457 7 1 1 . 1 1 5 5 SER H H 5 8.300 8.300 8.475 -0.175 25457 8 1 1 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457 9 1 1 . 1 1 6 6 PHE H H 6 8.250 8.250 8.126 0.124 25457 10 1 1 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.305 -0.025 25457 11 1 1 . 1 1 7 7 GLU H H 7 8.060 8.060 7.808 0.252 25457 12 1 1 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.349 -0.379 25457 13 1 1 . 1 1 11 11 ARG H H 11 7.880 7.880 7.774 0.106 25457 14 1 1 . 1 1 15 15 THR HA H 15 4.070 4.070 4.161 -0.091 25457 15 1 1 . 1 1 15 15 THR H H 15 7.870 7.870 8.407 -0.537 25457 16 1 1 . 1 1 16 16 MET HA H 16 4.220 4.220 4.384 -0.164 25457 17 1 1 . 1 1 16 16 MET H H 16 7.930 7.930 8.097 -0.167 25457 18 1 1 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457 19 1 1 . 1 1 17 17 VAL H H 17 7.700 7.700 7.946 -0.246 25457 20 1 1 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.164 -0.364 25457 21 1 1 . 1 1 18 18 LEU H H 18 7.810 7.810 7.618 0.192 25457 22 1 1 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.393 0.137 25457 23 1 1 . 1 1 19 19 HIS H H 19 8.000 8.000 7.796 0.204 25457 24 1 2 . 1 1 2 2 SER HA H 2 4.330 4.330 4.493 -0.163 25457 25 1 2 . 1 1 2 2 SER H H 2 8.140 8.140 9.134 -0.994 25457 26 1 2 . 1 1 3 3 GLY H H 3 8.340 8.340 8.677 -0.337 25457 27 1 2 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.061 0.179 25457 28 1 2 . 1 1 4 4 LEU H H 4 7.880 7.880 7.811 0.069 25457 29 1 2 . 1 1 5 5 SER HA H 5 4.280 4.280 4.159 0.121 25457 30 1 2 . 1 1 5 5 SER H H 5 8.300 8.300 8.476 -0.176 25457 31 1 2 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.582 0.008 25457 32 1 2 . 1 1 6 6 PHE H H 6 8.250 8.250 7.855 0.395 25457 33 1 2 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.040 0.240 25457 34 1 2 . 1 1 7 7 GLU H H 7 8.060 8.060 6.679 1.381 25457 35 1 2 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.436 -0.466 25457 36 1 2 . 1 1 11 11 ARG H H 11 7.880 7.880 7.733 0.147 25457 37 1 2 . 1 1 15 15 THR HA H 15 4.070 4.070 4.167 -0.097 25457 38 1 2 . 1 1 15 15 THR H H 15 7.870 7.870 8.442 -0.572 25457 39 1 2 . 1 1 16 16 MET HA H 16 4.220 4.220 4.422 -0.202 25457 40 1 2 . 1 1 16 16 MET H H 16 7.930 7.930 8.174 -0.244 25457 41 1 2 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.810 0.010 25457 42 1 2 . 1 1 17 17 VAL H H 17 7.700 7.700 7.979 -0.279 25457 43 1 2 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.158 -0.358 25457 44 1 2 . 1 1 18 18 LEU H H 18 7.810 7.810 7.629 0.181 25457 45 1 2 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.383 0.147 25457 46 1 2 . 1 1 19 19 HIS H H 19 8.000 8.000 7.795 0.205 25457 47 1 3 . 1 1 2 2 SER HA H 2 4.330 4.330 4.527 -0.197 25457 48 1 3 . 1 1 2 2 SER H H 2 8.140 8.140 8.622 -0.482 25457 49 1 3 . 1 1 3 3 GLY H H 3 8.340 8.340 8.470 -0.130 25457 50 1 3 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.497 -0.257 25457 51 1 3 . 1 1 4 4 LEU H H 4 7.880 7.880 7.745 0.135 25457 52 1 3 . 1 1 5 5 SER HA H 5 4.280 4.280 4.430 -0.150 25457 53 1 3 . 1 1 5 5 SER H H 5 8.300 8.300 8.617 -0.317 25457 54 1 3 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.471 0.119 25457 55 1 3 . 1 1 6 6 PHE H H 6 8.250 8.250 8.112 0.138 25457 56 1 3 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.353 -0.072 25457 57 1 3 . 1 1 7 7 GLU H H 7 8.060 8.060 8.598 -0.538 25457 58 1 3 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.384 -0.414 25457 59 1 3 . 1 1 11 11 ARG H H 11 7.880 7.880 7.659 0.221 25457 60 1 3 . 1 1 15 15 THR HA H 15 4.070 4.070 4.195 -0.125 25457 61 1 3 . 1 1 15 15 THR H H 15 7.870 7.870 8.457 -0.587 25457 62 1 3 . 1 1 16 16 MET HA H 16 4.220 4.220 4.399 -0.179 25457 63 1 3 . 1 1 16 16 MET H H 16 7.930 7.930 8.166 -0.236 25457 64 1 3 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.789 0.031 25457 65 1 3 . 1 1 17 17 VAL H H 17 7.700 7.700 8.002 -0.302 25457 66 1 3 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.149 -0.349 25457 67 1 3 . 1 1 18 18 LEU H H 18 7.810 7.810 7.651 0.160 25457 68 1 3 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.382 0.148 25457 69 1 3 . 1 1 19 19 HIS H H 19 8.000 8.000 7.788 0.212 25457 70 1 4 . 1 1 2 2 SER HA H 2 4.330 4.330 4.913 -0.583 25457 71 1 4 . 1 1 2 2 SER H H 2 8.140 8.140 8.640 -0.500 25457 72 1 4 . 1 1 3 3 GLY H H 3 8.340 8.340 8.291 0.049 25457 73 1 4 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.492 -0.252 25457 74 1 4 . 1 1 4 4 LEU H H 4 7.880 7.880 7.854 0.026 25457 75 1 4 . 1 1 5 5 SER HA H 5 4.280 4.280 4.280 -0.000 25457 76 1 4 . 1 1 5 5 SER H H 5 8.300 8.300 8.293 0.007 25457 77 1 4 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.420 0.170 25457 78 1 4 . 1 1 6 6 PHE H H 6 8.250 8.250 8.255 -0.005 25457 79 1 4 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.303 -0.023 25457 80 1 4 . 1 1 7 7 GLU H H 7 8.060 8.060 7.909 0.151 25457 81 1 4 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.383 -0.413 25457 82 1 4 . 1 1 11 11 ARG H H 11 7.880 7.880 7.687 0.193 25457 83 1 4 . 1 1 15 15 THR HA H 15 4.070 4.070 4.291 -0.221 25457 84 1 4 . 1 1 15 15 THR H H 15 7.870 7.870 8.351 -0.481 25457 85 1 4 . 1 1 16 16 MET HA H 16 4.220 4.220 4.423 -0.203 25457 86 1 4 . 1 1 16 16 MET H H 16 7.930 7.930 8.282 -0.352 25457 87 1 4 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.740 0.080 25457 88 1 4 . 1 1 17 17 VAL H H 17 7.700 7.700 8.141 -0.441 25457 89 1 4 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.122 -0.322 25457 90 1 4 . 1 1 18 18 LEU H H 18 7.810 7.810 7.578 0.232 25457 91 1 4 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.379 0.151 25457 92 1 4 . 1 1 19 19 HIS H H 19 8.000 8.000 7.784 0.216 25457 93 1 5 . 1 1 2 2 SER HA H 2 4.330 4.330 4.472 -0.142 25457 94 1 5 . 1 1 2 2 SER H H 2 8.140 8.140 8.495 -0.355 25457 95 1 5 . 1 1 3 3 GLY H H 3 8.340 8.340 7.700 0.640 25457 96 1 5 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.018 0.222 25457 97 1 5 . 1 1 4 4 LEU H H 4 7.880 7.880 8.394 -0.514 25457 98 1 5 . 1 1 5 5 SER HA H 5 4.280 4.280 4.221 0.059 25457 99 1 5 . 1 1 5 5 SER H H 5 8.300 8.300 8.370 -0.070 25457 100 1 5 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457 101 1 5 . 1 1 6 6 PHE H H 6 8.250 8.250 7.706 0.544 25457 102 1 5 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.273 0.007 25457 103 1 5 . 1 1 7 7 GLU H H 7 8.060 8.060 7.818 0.242 25457 104 1 5 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.394 -0.424 25457 105 1 5 . 1 1 11 11 ARG H H 11 7.880 7.880 7.703 0.177 25457 106 1 5 . 1 1 15 15 THR HA H 15 4.070 4.070 4.264 -0.194 25457 107 1 5 . 1 1 15 15 THR H H 15 7.870 7.870 8.226 -0.356 25457 108 1 5 . 1 1 16 16 MET HA H 16 4.220 4.220 4.375 -0.155 25457 109 1 5 . 1 1 16 16 MET H H 16 7.930 7.930 8.142 -0.212 25457 110 1 5 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457 111 1 5 . 1 1 17 17 VAL H H 17 7.700 7.700 8.190 -0.490 25457 112 1 5 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.129 -0.329 25457 113 1 5 . 1 1 18 18 LEU H H 18 7.810 7.810 7.541 0.269 25457 114 1 5 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.371 0.159 25457 115 1 5 . 1 1 19 19 HIS H H 19 8.000 8.000 7.774 0.226 25457 116 1 6 . 1 1 2 2 SER HA H 2 4.330 4.330 4.597 -0.267 25457 117 1 6 . 1 1 2 2 SER H H 2 8.140 8.140 8.181 -0.041 25457 118 1 6 . 1 1 3 3 GLY H H 3 8.340 8.340 7.762 0.578 25457 119 1 6 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.929 0.311 25457 120 1 6 . 1 1 4 4 LEU H H 4 7.880 7.880 8.681 -0.801 25457 121 1 6 . 1 1 5 5 SER HA H 5 4.280 4.280 4.161 0.119 25457 122 1 6 . 1 1 5 5 SER H H 5 8.300 8.300 8.345 -0.045 25457 123 1 6 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.403 0.187 25457 124 1 6 . 1 1 6 6 PHE H H 6 8.250 8.250 7.454 0.796 25457 125 1 6 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.307 -0.027 25457 126 1 6 . 1 1 7 7 GLU H H 7 8.060 8.060 7.929 0.131 25457 127 1 6 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.472 -0.502 25457 128 1 6 . 1 1 11 11 ARG H H 11 7.880 7.880 7.757 0.123 25457 129 1 6 . 1 1 15 15 THR HA H 15 4.070 4.070 4.293 -0.223 25457 130 1 6 . 1 1 15 15 THR H H 15 7.870 7.870 8.356 -0.486 25457 131 1 6 . 1 1 16 16 MET HA H 16 4.220 4.220 4.402 -0.182 25457 132 1 6 . 1 1 16 16 MET H H 16 7.930 7.930 8.228 -0.298 25457 133 1 6 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.807 0.013 25457 134 1 6 . 1 1 17 17 VAL H H 17 7.700 7.700 8.194 -0.494 25457 135 1 6 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.135 -0.335 25457 136 1 6 . 1 1 18 18 LEU H H 18 7.810 7.810 7.554 0.256 25457 137 1 6 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457 138 1 6 . 1 1 19 19 HIS H H 19 8.000 8.000 7.783 0.217 25457 139 1 7 . 1 1 2 2 SER HA H 2 4.330 4.330 4.546 -0.216 25457 140 1 7 . 1 1 2 2 SER H H 2 8.140 8.140 8.575 -0.435 25457 141 1 7 . 1 1 3 3 GLY H H 3 8.340 8.340 7.956 0.384 25457 142 1 7 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.525 0.715 25457 143 1 7 . 1 1 4 4 LEU H H 4 7.880 7.880 8.414 -0.534 25457 144 1 7 . 1 1 5 5 SER HA H 5 4.280 4.280 4.255 0.025 25457 145 1 7 . 1 1 5 5 SER H H 5 8.300 8.300 8.332 -0.032 25457 146 1 7 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.645 -0.055 25457 147 1 7 . 1 1 6 6 PHE H H 6 8.250 8.250 7.635 0.615 25457 148 1 7 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.300 -0.020 25457 149 1 7 . 1 1 7 7 GLU H H 7 8.060 8.060 7.905 0.155 25457 150 1 7 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.402 -0.432 25457 151 1 7 . 1 1 11 11 ARG H H 11 7.880 7.880 7.810 0.070 25457 152 1 7 . 1 1 15 15 THR HA H 15 4.070 4.070 4.324 -0.254 25457 153 1 7 . 1 1 15 15 THR H H 15 7.870 7.870 8.296 -0.426 25457 154 1 7 . 1 1 16 16 MET HA H 16 4.220 4.220 4.432 -0.212 25457 155 1 7 . 1 1 16 16 MET H H 16 7.930 7.930 8.207 -0.277 25457 156 1 7 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.768 0.052 25457 157 1 7 . 1 1 17 17 VAL H H 17 7.700 7.700 8.144 -0.444 25457 158 1 7 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.118 -0.318 25457 159 1 7 . 1 1 18 18 LEU H H 18 7.810 7.810 7.559 0.251 25457 160 1 7 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.380 0.150 25457 161 1 7 . 1 1 19 19 HIS H H 19 8.000 8.000 7.783 0.217 25457 162 1 8 . 1 1 2 2 SER HA H 2 4.330 4.330 4.791 -0.461 25457 163 1 8 . 1 1 2 2 SER H H 2 8.140 8.140 8.878 -0.738 25457 164 1 8 . 1 1 3 3 GLY H H 3 8.340 8.340 7.888 0.452 25457 165 1 8 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.452 0.788 25457 166 1 8 . 1 1 4 4 LEU H H 4 7.880 7.880 7.885 -0.005 25457 167 1 8 . 1 1 5 5 SER HA H 5 4.280 4.280 4.316 -0.036 25457 168 1 8 . 1 1 5 5 SER H H 5 8.300 8.300 7.875 0.425 25457 169 1 8 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.578 0.012 25457 170 1 8 . 1 1 6 6 PHE H H 6 8.250 8.250 7.523 0.727 25457 171 1 8 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.302 -0.022 25457 172 1 8 . 1 1 7 7 GLU H H 7 8.060 8.060 7.911 0.149 25457 173 1 8 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.382 -0.412 25457 174 1 8 . 1 1 11 11 ARG H H 11 7.880 7.880 7.781 0.099 25457 175 1 8 . 1 1 15 15 THR HA H 15 4.070 4.070 4.289 -0.219 25457 176 1 8 . 1 1 15 15 THR H H 15 7.870 7.870 8.345 -0.475 25457 177 1 8 . 1 1 16 16 MET HA H 16 4.220 4.220 4.419 -0.199 25457 178 1 8 . 1 1 16 16 MET H H 16 7.930 7.930 8.285 -0.355 25457 179 1 8 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.786 0.034 25457 180 1 8 . 1 1 17 17 VAL H H 17 7.700 7.700 8.017 -0.317 25457 181 1 8 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.118 -0.318 25457 182 1 8 . 1 1 18 18 LEU H H 18 7.810 7.810 7.355 0.455 25457 183 1 8 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.382 0.148 25457 184 1 8 . 1 1 19 19 HIS H H 19 8.000 8.000 7.786 0.214 25457 185 1 9 . 1 1 2 2 SER HA H 2 4.330 4.330 4.592 -0.262 25457 186 1 9 . 1 1 2 2 SER H H 2 8.140 8.140 8.320 -0.180 25457 187 1 9 . 1 1 3 3 GLY H H 3 8.340 8.340 7.697 0.643 25457 188 1 9 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.373 0.867 25457 189 1 9 . 1 1 4 4 LEU H H 4 7.880 7.880 8.350 -0.470 25457 190 1 9 . 1 1 5 5 SER HA H 5 4.280 4.280 4.347 -0.067 25457 191 1 9 . 1 1 5 5 SER H H 5 8.300 8.300 8.058 0.242 25457 192 1 9 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.684 -0.094 25457 193 1 9 . 1 1 6 6 PHE H H 6 8.250 8.250 7.638 0.612 25457 194 1 9 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.260 0.020 25457 195 1 9 . 1 1 7 7 GLU H H 7 8.060 8.060 7.695 0.365 25457 196 1 9 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.488 -0.518 25457 197 1 9 . 1 1 11 11 ARG H H 11 7.880 7.880 7.725 0.155 25457 198 1 9 . 1 1 15 15 THR HA H 15 4.070 4.070 4.300 -0.230 25457 199 1 9 . 1 1 15 15 THR H H 15 7.870 7.870 8.362 -0.492 25457 200 1 9 . 1 1 16 16 MET HA H 16 4.220 4.220 4.390 -0.170 25457 201 1 9 . 1 1 16 16 MET H H 16 7.930 7.930 8.237 -0.307 25457 202 1 9 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.787 0.033 25457 203 1 9 . 1 1 17 17 VAL H H 17 7.700 7.700 8.223 -0.523 25457 204 1 9 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.143 -0.343 25457 205 1 9 . 1 1 18 18 LEU H H 18 7.810 7.810 7.676 0.134 25457 206 1 9 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.383 0.147 25457 207 1 9 . 1 1 19 19 HIS H H 19 8.000 8.000 7.797 0.203 25457 208 1 10 . 1 1 2 2 SER HA H 2 4.330 4.330 4.284 0.046 25457 209 1 10 . 1 1 2 2 SER H H 2 8.140 8.140 8.269 -0.129 25457 210 1 10 . 1 1 3 3 GLY H H 3 8.340 8.340 8.133 0.207 25457 211 1 10 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.496 -0.256 25457 212 1 10 . 1 1 4 4 LEU H H 4 7.880 7.880 7.906 -0.026 25457 213 1 10 . 1 1 5 5 SER HA H 5 4.280 4.280 4.301 -0.021 25457 214 1 10 . 1 1 5 5 SER H H 5 8.300 8.300 8.319 -0.019 25457 215 1 10 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.415 0.175 25457 216 1 10 . 1 1 6 6 PHE H H 6 8.250 8.250 8.226 0.024 25457 217 1 10 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.275 0.005 25457 218 1 10 . 1 1 7 7 GLU H H 7 8.060 8.060 7.787 0.273 25457 219 1 10 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.445 -0.475 25457 220 1 10 . 1 1 11 11 ARG H H 11 7.880 7.880 7.744 0.136 25457 221 1 10 . 1 1 15 15 THR HA H 15 4.070 4.070 4.304 -0.234 25457 222 1 10 . 1 1 15 15 THR H H 15 7.870 7.870 8.345 -0.475 25457 223 1 10 . 1 1 16 16 MET HA H 16 4.220 4.220 4.384 -0.164 25457 224 1 10 . 1 1 16 16 MET H H 16 7.930 7.930 8.216 -0.286 25457 225 1 10 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.826 -0.006 25457 226 1 10 . 1 1 17 17 VAL H H 17 7.700 7.700 7.954 -0.254 25457 227 1 10 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.162 -0.362 25457 228 1 10 . 1 1 18 18 LEU H H 18 7.810 7.810 7.473 0.337 25457 229 1 10 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457 230 1 10 . 1 1 19 19 HIS H H 19 8.000 8.000 7.782 0.218 25457 231 1 11 . 1 1 2 2 SER HA H 2 4.330 4.330 4.889 -0.559 25457 232 1 11 . 1 1 2 2 SER H H 2 8.140 8.140 8.494 -0.354 25457 233 1 11 . 1 1 3 3 GLY H H 3 8.340 8.340 8.250 0.090 25457 234 1 11 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.633 -0.393 25457 235 1 11 . 1 1 4 4 LEU H H 4 7.880 7.880 8.225 -0.345 25457 236 1 11 . 1 1 5 5 SER HA H 5 4.280 4.280 4.536 -0.256 25457 237 1 11 . 1 1 5 5 SER H H 5 8.300 8.300 8.383 -0.083 25457 238 1 11 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.498 0.092 25457 239 1 11 . 1 1 6 6 PHE H H 6 8.250 8.250 8.170 0.080 25457 240 1 11 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.332 -0.052 25457 241 1 11 . 1 1 7 7 GLU H H 7 8.060 8.060 8.648 -0.588 25457 242 1 11 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.516 -0.546 25457 243 1 11 . 1 1 11 11 ARG H H 11 7.880 7.880 7.827 0.053 25457 244 1 11 . 1 1 15 15 THR HA H 15 4.070 4.070 4.282 -0.212 25457 245 1 11 . 1 1 15 15 THR H H 15 7.870 7.870 8.328 -0.458 25457 246 1 11 . 1 1 16 16 MET HA H 16 4.220 4.220 4.399 -0.179 25457 247 1 11 . 1 1 16 16 MET H H 16 7.930 7.930 8.229 -0.299 25457 248 1 11 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.740 0.080 25457 249 1 11 . 1 1 17 17 VAL H H 17 7.700 7.700 8.126 -0.426 25457 250 1 11 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.109 -0.309 25457 251 1 11 . 1 1 18 18 LEU H H 18 7.810 7.810 7.553 0.257 25457 252 1 11 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.376 0.154 25457 253 1 11 . 1 1 19 19 HIS H H 19 8.000 8.000 7.775 0.225 25457 254 1 12 . 1 1 2 2 SER HA H 2 4.330 4.330 4.966 -0.636 25457 255 1 12 . 1 1 2 2 SER H H 2 8.140 8.140 8.891 -0.751 25457 256 1 12 . 1 1 3 3 GLY H H 3 8.340 8.340 7.837 0.503 25457 257 1 12 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.039 0.201 25457 258 1 12 . 1 1 4 4 LEU H H 4 7.880 7.880 8.264 -0.384 25457 259 1 12 . 1 1 5 5 SER HA H 5 4.280 4.280 4.580 -0.300 25457 260 1 12 . 1 1 5 5 SER H H 5 8.300 8.300 8.271 0.029 25457 261 1 12 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.568 0.022 25457 262 1 12 . 1 1 6 6 PHE H H 6 8.250 8.250 8.145 0.105 25457 263 1 12 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.355 -0.075 25457 264 1 12 . 1 1 7 7 GLU H H 7 8.060 8.060 8.748 -0.688 25457 265 1 12 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.353 -0.383 25457 266 1 12 . 1 1 11 11 ARG H H 11 7.880 7.880 7.604 0.276 25457 267 1 12 . 1 1 15 15 THR HA H 15 4.070 4.070 4.300 -0.230 25457 268 1 12 . 1 1 15 15 THR H H 15 7.870 7.870 8.266 -0.396 25457 269 1 12 . 1 1 16 16 MET HA H 16 4.220 4.220 4.437 -0.217 25457 270 1 12 . 1 1 16 16 MET H H 16 7.930 7.930 8.279 -0.349 25457 271 1 12 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.777 0.043 25457 272 1 12 . 1 1 17 17 VAL H H 17 7.700 7.700 8.017 -0.317 25457 273 1 12 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.145 -0.345 25457 274 1 12 . 1 1 18 18 LEU H H 18 7.810 7.810 7.464 0.346 25457 275 1 12 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.381 0.149 25457 276 1 12 . 1 1 19 19 HIS H H 19 8.000 8.000 7.794 0.206 25457 277 1 13 . 1 1 2 2 SER HA H 2 4.330 4.330 4.478 -0.148 25457 278 1 13 . 1 1 2 2 SER H H 2 8.140 8.140 8.498 -0.358 25457 279 1 13 . 1 1 3 3 GLY H H 3 8.340 8.340 7.794 0.546 25457 280 1 13 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.289 0.951 25457 281 1 13 . 1 1 4 4 LEU H H 4 7.880 7.880 8.273 -0.393 25457 282 1 13 . 1 1 5 5 SER HA H 5 4.280 4.280 4.232 0.048 25457 283 1 13 . 1 1 5 5 SER H H 5 8.300 8.300 7.802 0.498 25457 284 1 13 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.734 -0.144 25457 285 1 13 . 1 1 6 6 PHE H H 6 8.250 8.250 7.323 0.927 25457 286 1 13 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.257 0.023 25457 287 1 13 . 1 1 7 7 GLU H H 7 8.060 8.060 7.883 0.177 25457 288 1 13 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.447 -0.477 25457 289 1 13 . 1 1 11 11 ARG H H 11 7.880 7.880 7.740 0.140 25457 290 1 13 . 1 1 15 15 THR HA H 15 4.070 4.070 4.309 -0.239 25457 291 1 13 . 1 1 15 15 THR H H 15 7.870 7.870 8.283 -0.413 25457 292 1 13 . 1 1 16 16 MET HA H 16 4.220 4.220 4.469 -0.249 25457 293 1 13 . 1 1 16 16 MET H H 16 7.930 7.930 8.287 -0.357 25457 294 1 13 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.811 0.009 25457 295 1 13 . 1 1 17 17 VAL H H 17 7.700 7.700 8.098 -0.398 25457 296 1 13 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.103 -0.303 25457 297 1 13 . 1 1 18 18 LEU H H 18 7.810 7.810 7.321 0.489 25457 298 1 13 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.353 0.177 25457 299 1 13 . 1 1 19 19 HIS H H 19 8.000 8.000 7.805 0.195 25457 300 1 14 . 1 1 2 2 SER HA H 2 4.330 4.330 4.860 -0.530 25457 301 1 14 . 1 1 2 2 SER H H 2 8.140 8.140 8.797 -0.657 25457 302 1 14 . 1 1 3 3 GLY H H 3 8.340 8.340 7.798 0.542 25457 303 1 14 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.080 0.160 25457 304 1 14 . 1 1 4 4 LEU H H 4 7.880 7.880 8.254 -0.374 25457 305 1 14 . 1 1 5 5 SER HA H 5 4.280 4.280 4.449 -0.169 25457 306 1 14 . 1 1 5 5 SER H H 5 8.300 8.300 8.151 0.149 25457 307 1 14 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.453 0.137 25457 308 1 14 . 1 1 6 6 PHE H H 6 8.250 8.250 8.148 0.102 25457 309 1 14 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.249 0.031 25457 310 1 14 . 1 1 7 7 GLU H H 7 8.060 8.060 8.586 -0.526 25457 311 1 14 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.313 -0.343 25457 312 1 14 . 1 1 11 11 ARG H H 11 7.880 7.880 7.871 0.009 25457 313 1 14 . 1 1 15 15 THR HA H 15 4.070 4.070 4.158 -0.088 25457 314 1 14 . 1 1 15 15 THR H H 15 7.870 7.870 8.506 -0.636 25457 315 1 14 . 1 1 16 16 MET HA H 16 4.220 4.220 4.331 -0.111 25457 316 1 14 . 1 1 16 16 MET H H 16 7.930 7.930 8.048 -0.118 25457 317 1 14 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.808 0.012 25457 318 1 14 . 1 1 17 17 VAL H H 17 7.700 7.700 8.003 -0.303 25457 319 1 14 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.201 -0.401 25457 320 1 14 . 1 1 18 18 LEU H H 18 7.810 7.810 7.700 0.110 25457 321 1 14 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.419 0.111 25457 322 1 14 . 1 1 19 19 HIS H H 19 8.000 8.000 7.826 0.174 25457 323 1 15 . 1 1 2 2 SER HA H 2 4.330 4.330 4.532 -0.202 25457 324 1 15 . 1 1 2 2 SER H H 2 8.140 8.140 8.459 -0.319 25457 325 1 15 . 1 1 3 3 GLY H H 3 8.340 8.340 7.987 0.353 25457 326 1 15 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.080 0.160 25457 327 1 15 . 1 1 4 4 LEU H H 4 7.880 7.880 8.171 -0.291 25457 328 1 15 . 1 1 5 5 SER HA H 5 4.280 4.280 4.418 -0.138 25457 329 1 15 . 1 1 5 5 SER H H 5 8.300 8.300 8.074 0.226 25457 330 1 15 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.466 0.124 25457 331 1 15 . 1 1 6 6 PHE H H 6 8.250 8.250 8.041 0.209 25457 332 1 15 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.266 0.014 25457 333 1 15 . 1 1 7 7 GLU H H 7 8.060 8.060 8.448 -0.388 25457 334 1 15 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.409 -0.439 25457 335 1 15 . 1 1 11 11 ARG H H 11 7.880 7.880 7.721 0.159 25457 336 1 15 . 1 1 15 15 THR HA H 15 4.070 4.070 4.169 -0.099 25457 337 1 15 . 1 1 15 15 THR H H 15 7.870 7.870 8.420 -0.550 25457 338 1 15 . 1 1 16 16 MET HA H 16 4.220 4.220 4.443 -0.223 25457 339 1 15 . 1 1 16 16 MET H H 16 7.930 7.930 8.268 -0.338 25457 340 1 15 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.789 0.031 25457 341 1 15 . 1 1 17 17 VAL H H 17 7.700 7.700 7.967 -0.267 25457 342 1 15 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.145 -0.345 25457 343 1 15 . 1 1 18 18 LEU H H 18 7.810 7.810 7.644 0.166 25457 344 1 15 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.384 0.146 25457 345 1 15 . 1 1 19 19 HIS H H 19 8.000 8.000 7.797 0.203 25457 346 1 16 . 1 1 2 2 SER HA H 2 4.330 4.330 4.610 -0.280 25457 347 1 16 . 1 1 2 2 SER H H 2 8.140 8.140 8.781 -0.641 25457 348 1 16 . 1 1 3 3 GLY H H 3 8.340 8.340 8.034 0.306 25457 349 1 16 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.992 0.248 25457 350 1 16 . 1 1 4 4 LEU H H 4 7.880 7.880 8.439 -0.559 25457 351 1 16 . 1 1 5 5 SER HA H 5 4.280 4.280 4.699 -0.419 25457 352 1 16 . 1 1 5 5 SER H H 5 8.300 8.300 8.490 -0.190 25457 353 1 16 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.557 0.033 25457 354 1 16 . 1 1 6 6 PHE H H 6 8.250 8.250 8.181 0.069 25457 355 1 16 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.326 -0.046 25457 356 1 16 . 1 1 7 7 GLU H H 7 8.060 8.060 8.546 -0.486 25457 357 1 16 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.391 -0.421 25457 358 1 16 . 1 1 11 11 ARG H H 11 7.880 7.880 7.904 -0.024 25457 359 1 16 . 1 1 15 15 THR HA H 15 4.070 4.070 4.090 -0.020 25457 360 1 16 . 1 1 15 15 THR H H 15 7.870 7.870 8.455 -0.585 25457 361 1 16 . 1 1 16 16 MET HA H 16 4.220 4.220 4.304 -0.084 25457 362 1 16 . 1 1 16 16 MET H H 16 7.930 7.930 8.014 -0.084 25457 363 1 16 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.806 0.014 25457 364 1 16 . 1 1 17 17 VAL H H 17 7.700 7.700 7.967 -0.267 25457 365 1 16 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.170 -0.370 25457 366 1 16 . 1 1 18 18 LEU H H 18 7.810 7.810 7.633 0.177 25457 367 1 16 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.404 0.126 25457 368 1 16 . 1 1 19 19 HIS H H 19 8.000 8.000 7.807 0.193 25457 369 1 17 . 1 1 2 2 SER HA H 2 4.330 4.330 4.987 -0.657 25457 370 1 17 . 1 1 2 2 SER H H 2 8.140 8.140 8.907 -0.767 25457 371 1 17 . 1 1 3 3 GLY H H 3 8.340 8.340 7.820 0.520 25457 372 1 17 . 1 1 4 4 LEU HA H 4 4.240 4.240 5.101 -0.861 25457 373 1 17 . 1 1 4 4 LEU H H 4 7.880 7.880 8.243 -0.363 25457 374 1 17 . 1 1 5 5 SER HA H 5 4.280 4.280 4.246 0.034 25457 375 1 17 . 1 1 5 5 SER H H 5 8.300 8.300 8.542 -0.242 25457 376 1 17 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.696 -0.106 25457 377 1 17 . 1 1 6 6 PHE H H 6 8.250 8.250 7.880 0.370 25457 378 1 17 . 1 1 7 7 GLU HA H 7 4.280 4.280 3.747 0.533 25457 379 1 17 . 1 1 7 7 GLU H H 7 8.060 8.060 7.501 0.559 25457 380 1 17 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.257 -0.287 25457 381 1 17 . 1 1 11 11 ARG H H 11 7.880 7.880 7.662 0.218 25457 382 1 17 . 1 1 15 15 THR HA H 15 4.070 4.070 4.173 -0.103 25457 383 1 17 . 1 1 15 15 THR H H 15 7.870 7.870 8.475 -0.605 25457 384 1 17 . 1 1 16 16 MET HA H 16 4.220 4.220 4.423 -0.203 25457 385 1 17 . 1 1 16 16 MET H H 16 7.930 7.930 8.166 -0.236 25457 386 1 17 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.816 0.004 25457 387 1 17 . 1 1 17 17 VAL H H 17 7.700 7.700 7.937 -0.237 25457 388 1 17 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.164 -0.364 25457 389 1 17 . 1 1 18 18 LEU H H 18 7.810 7.810 7.644 0.166 25457 390 1 17 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.386 0.144 25457 391 1 17 . 1 1 19 19 HIS H H 19 8.000 8.000 7.793 0.207 25457 392 1 18 . 1 1 2 2 SER HA H 2 4.330 4.330 4.642 -0.312 25457 393 1 18 . 1 1 2 2 SER H H 2 8.140 8.140 8.204 -0.064 25457 394 1 18 . 1 1 3 3 GLY H H 3 8.340 8.340 8.295 0.045 25457 395 1 18 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.538 -0.298 25457 396 1 18 . 1 1 4 4 LEU H H 4 7.880 7.880 7.620 0.260 25457 397 1 18 . 1 1 5 5 SER HA H 5 4.280 4.280 4.261 0.019 25457 398 1 18 . 1 1 5 5 SER H H 5 8.300 8.300 8.364 -0.064 25457 399 1 18 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.450 0.140 25457 400 1 18 . 1 1 6 6 PHE H H 6 8.250 8.250 8.016 0.234 25457 401 1 18 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.219 0.061 25457 402 1 18 . 1 1 7 7 GLU H H 7 8.060 8.060 8.409 -0.349 25457 403 1 18 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.485 -0.515 25457 404 1 18 . 1 1 11 11 ARG H H 11 7.880 7.880 7.795 0.085 25457 405 1 18 . 1 1 15 15 THR HA H 15 4.070 4.070 4.166 -0.096 25457 406 1 18 . 1 1 15 15 THR H H 15 7.870 7.870 8.386 -0.516 25457 407 1 18 . 1 1 16 16 MET HA H 16 4.220 4.220 4.401 -0.181 25457 408 1 18 . 1 1 16 16 MET H H 16 7.930 7.930 8.100 -0.170 25457 409 1 18 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.804 0.016 25457 410 1 18 . 1 1 17 17 VAL H H 17 7.700 7.700 7.935 -0.235 25457 411 1 18 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.172 -0.372 25457 412 1 18 . 1 1 18 18 LEU H H 18 7.810 7.810 7.643 0.167 25457 413 1 18 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.393 0.137 25457 414 1 18 . 1 1 19 19 HIS H H 19 8.000 8.000 7.800 0.200 25457 415 1 19 . 1 1 2 2 SER HA H 2 4.330 4.330 4.527 -0.197 25457 416 1 19 . 1 1 2 2 SER H H 2 8.140 8.140 8.192 -0.052 25457 417 1 19 . 1 1 3 3 GLY H H 3 8.340 8.340 8.564 -0.224 25457 418 1 19 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.704 -0.464 25457 419 1 19 . 1 1 4 4 LEU H H 4 7.880 7.880 8.094 -0.214 25457 420 1 19 . 1 1 5 5 SER HA H 5 4.280 4.280 4.434 -0.154 25457 421 1 19 . 1 1 5 5 SER H H 5 8.300 8.300 8.175 0.125 25457 422 1 19 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.467 0.123 25457 423 1 19 . 1 1 6 6 PHE H H 6 8.250 8.250 8.206 0.045 25457 424 1 19 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.393 -0.113 25457 425 1 19 . 1 1 7 7 GLU H H 7 8.060 8.060 8.710 -0.650 25457 426 1 19 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.381 -0.411 25457 427 1 19 . 1 1 11 11 ARG H H 11 7.880 7.880 7.853 0.027 25457 428 1 19 . 1 1 15 15 THR HA H 15 4.070 4.070 4.181 -0.111 25457 429 1 19 . 1 1 15 15 THR H H 15 7.870 7.870 8.444 -0.574 25457 430 1 19 . 1 1 16 16 MET HA H 16 4.220 4.220 4.403 -0.183 25457 431 1 19 . 1 1 16 16 MET H H 16 7.930 7.930 8.209 -0.279 25457 432 1 19 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.742 0.078 25457 433 1 19 . 1 1 17 17 VAL H H 17 7.700 7.700 7.895 -0.195 25457 434 1 19 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.190 -0.390 25457 435 1 19 . 1 1 18 18 LEU H H 18 7.810 7.810 7.658 0.152 25457 436 1 19 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.404 0.126 25457 437 1 19 . 1 1 19 19 HIS H H 19 8.000 8.000 7.817 0.183 25457 438 1 20 . 1 1 2 2 SER HA H 2 4.330 4.330 4.790 -0.460 25457 439 1 20 . 1 1 2 2 SER H H 2 8.140 8.140 8.603 -0.463 25457 440 1 20 . 1 1 3 3 GLY H H 3 8.340 8.340 7.826 0.514 25457 441 1 20 . 1 1 4 4 LEU HA H 4 4.240 4.240 3.361 0.879 25457 442 1 20 . 1 1 4 4 LEU H H 4 7.880 7.880 8.050 -0.170 25457 443 1 20 . 1 1 5 5 SER HA H 5 4.280 4.280 4.488 -0.208 25457 444 1 20 . 1 1 5 5 SER H H 5 8.300 8.300 7.869 0.431 25457 445 1 20 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.777 -0.187 25457 446 1 20 . 1 1 6 6 PHE H H 6 8.250 8.250 7.375 0.875 25457 447 1 20 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.330 -0.050 25457 448 1 20 . 1 1 7 7 GLU H H 7 8.060 8.060 7.933 0.127 25457 449 1 20 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.369 -0.399 25457 450 1 20 . 1 1 11 11 ARG H H 11 7.880 7.880 7.706 0.174 25457 451 1 20 . 1 1 15 15 THR HA H 15 4.070 4.070 4.286 -0.216 25457 452 1 20 . 1 1 15 15 THR H H 15 7.870 7.870 8.346 -0.476 25457 453 1 20 . 1 1 16 16 MET HA H 16 4.220 4.220 4.427 -0.207 25457 454 1 20 . 1 1 16 16 MET H H 16 7.930 7.930 8.285 -0.355 25457 455 1 20 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.745 0.075 25457 456 1 20 . 1 1 17 17 VAL H H 17 7.700 7.700 8.141 -0.441 25457 457 1 20 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.133 -0.333 25457 458 1 20 . 1 1 18 18 LEU H H 18 7.810 7.810 7.650 0.160 25457 459 1 20 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.381 0.149 25457 460 1 20 . 1 1 19 19 HIS H H 19 8.000 8.000 7.800 0.200 25457 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 25457 2 1 1 "Average Difference" HA 13 0.197 0.086 0.184 25457 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25457 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25457 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25457 6 1 1 "Average Difference" HN 12 0.377 0.087 0.383 25457 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25457 8 1 2 "Average Difference" HA 13 0.214 0.056 0.215 25457 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25457 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25457 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25457 12 1 2 "Average Difference" HN 12 0.560 0.019 0.584 25457 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25457 14 1 3 "Average Difference" HA 13 0.217 0.139 0.173 25457 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25457 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25457 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25457 18 1 3 "Average Difference" HN 12 0.327 0.144 0.307 25457 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25457 20 1 4 "Average Difference" HA 13 0.259 0.137 0.229 25457 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25457 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25457 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25457 24 1 4 "Average Difference" HN 12 0.283 0.075 0.285 25457 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25457 26 1 5 "Average Difference" HA 13 0.201 0.037 0.205 25457 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25457 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25457 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25457 30 1 5 "Average Difference" HN 12 0.379 -0.008 0.396 25457 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25457 32 1 6 "Average Difference" HA 13 0.272 0.112 0.258 25457 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25457 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25457 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25457 36 1 6 "Average Difference" HN 12 0.440 0.005 0.460 25457 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25457 38 1 7 "Average Difference" HA 13 0.288 0.070 0.291 25457 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25457 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25457 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25457 42 1 7 "Average Difference" HN 12 0.365 0.038 0.379 25457 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25457 44 1 8 "Average Difference" HA 13 0.321 0.020 0.333 25457 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25457 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25457 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25457 48 1 8 "Average Difference" HN 12 0.428 -0.053 0.443 25457 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25457 50 1 9 "Average Difference" HA 13 0.326 0.031 0.338 25457 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25457 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25457 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25457 54 1 9 "Average Difference" HN 12 0.401 -0.032 0.417 25457 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25457 56 1 10 "Average Difference" HA 13 0.216 0.098 0.200 25457 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25457 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25457 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25457 60 1 10 "Average Difference" HN 12 0.239 -0.000 0.250 25457 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25457 62 1 11 "Average Difference" HA 13 0.330 0.231 0.246 25457 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25457 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25457 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25457 66 1 11 "Average Difference" HN 12 0.318 0.154 0.290 25457 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25457 68 1 12 "Average Difference" HA 13 0.275 0.122 0.256 25457 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25457 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25457 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25457 72 1 12 "Average Difference" HN 12 0.415 0.118 0.415 25457 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25457 74 1 13 "Average Difference" HA 13 0.348 -0.011 0.362 25457 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25457 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25457 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25457 78 1 13 "Average Difference" HN 12 0.454 -0.088 0.465 25457 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25457 80 1 14 "Average Difference" HA 13 0.232 0.091 0.222 25457 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25457 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25457 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25457 84 1 14 "Average Difference" HN 12 0.379 0.127 0.373 25457 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25457 86 1 15 "Average Difference" HA 13 0.220 0.040 0.226 25457 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25457 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25457 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25457 90 1 15 "Average Difference" HN 12 0.308 0.070 0.313 25457 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25457 92 1 16 "Average Difference" HA 13 0.238 0.070 0.237 25457 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25457 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25457 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25457 96 1 16 "Average Difference" HN 12 0.363 0.174 0.333 25457 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25457 98 1 17 "Average Difference" HA 13 0.371 0.142 0.356 25457 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25457 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25457 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25457 102 1 17 "Average Difference" HN 12 0.418 0.034 0.435 25457 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25457 104 1 18 "Average Difference" HA 13 0.255 0.147 0.216 25457 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25457 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25457 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25457 108 1 18 "Average Difference" HN 12 0.238 0.034 0.246 25457 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25457 110 1 19 "Average Difference" HA 13 0.237 0.136 0.202 25457 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25457 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25457 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25457 114 1 19 "Average Difference" HN 12 0.295 0.138 0.272 25457 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25457 116 1 20 "Average Difference" HA 13 0.339 0.071 0.344 25457 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25457 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25457 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25457 120 1 20 "Average Difference" HN 12 0.420 -0.048 0.436 25457 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 25457 _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 SER HA H 2 4.330 4.330 4.649 -0.319 25457 2 1 . 1 1 2 2 SER H H 2 8.140 8.140 8.595 -0.455 25457 3 1 . 1 1 3 3 GLY H H 3 8.340 8.340 8.031 0.309 25457 4 1 . 1 1 4 4 LEU HA H 4 4.240 4.240 4.109 0.131 25457 5 1 . 1 1 4 4 LEU H H 4 7.880 7.880 8.151 -0.271 25457 6 1 . 1 1 5 5 SER HA H 5 4.280 4.280 4.356 -0.076 25457 7 1 . 1 1 5 5 SER H H 5 8.300 8.300 8.264 0.036 25457 8 1 . 1 1 6 6 PHE HA H 6 4.590 4.590 4.535 0.055 25457 9 1 . 1 1 6 6 PHE H H 6 8.250 8.250 7.901 0.349 25457 10 1 . 1 1 7 7 GLU HA H 7 4.280 4.280 4.260 0.020 25457 11 1 . 1 1 7 7 GLU H H 7 8.060 8.060 8.073 -0.013 25457 12 1 . 1 1 11 11 ARG HA H 11 3.970 3.970 4.403 -0.433 25457 13 1 . 1 1 11 11 ARG H H 11 7.880 7.880 7.753 0.127 25457 14 1 . 1 1 15 15 THR HA H 15 4.070 4.070 4.235 -0.165 25457 15 1 . 1 1 15 15 THR H H 15 7.870 7.870 8.375 -0.505 25457 16 1 . 1 1 16 16 MET HA H 16 4.220 4.220 4.403 -0.183 25457 17 1 . 1 1 16 16 MET H H 16 7.930 7.930 8.196 -0.266 25457 18 1 . 1 1 17 17 VAL HA H 17 3.820 3.820 3.788 0.032 25457 19 1 . 1 1 17 17 VAL H H 17 7.700 7.700 8.044 -0.344 25457 20 1 . 1 1 18 18 LEU HA H 18 3.800 3.800 4.146 -0.346 25457 21 1 . 1 1 18 18 LEU H H 18 7.810 7.810 7.577 0.233 25457 22 1 . 1 1 19 19 HIS HA H 19 4.530 4.530 4.384 0.146 25457 23 1 . 1 1 19 19 HIS H H 19 8.000 8.000 7.794 0.206 25457 stop_ save_