data_25844 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25844 _Entry.PDB_ID 2N8B 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 25844 _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 CYS HA H 2 4.561 4.561 5.143 -0.582 25844 2 1 1 . 1 1 2 2 CYS H H 2 7.688 7.688 7.820 -0.132 25844 3 1 1 . 1 1 3 3 ILE HA H 3 4.180 4.180 4.196 -0.016 25844 4 1 1 . 1 1 3 3 ILE H H 3 8.043 8.043 8.187 -0.144 25844 5 1 1 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.388 0.014 25844 6 1 1 . 1 1 4 4 LEU H H 4 7.885 7.885 8.378 -0.493 25844 7 1 1 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.504 0.276 25844 8 1 1 . 1 1 5 5 ASN H H 5 8.769 8.769 8.314 0.455 25844 9 1 1 . 1 1 6 6 GLY H H 6 8.723 8.723 7.923 0.800 25844 10 1 1 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.509 -0.409 25844 11 1 1 . 1 1 7 7 ARG H H 7 7.495 7.495 8.581 -1.086 25844 12 1 1 . 1 1 8 8 THR HA H 8 4.232 4.232 4.105 0.127 25844 13 1 1 . 1 1 8 8 THR H H 8 8.352 8.352 7.650 0.702 25844 14 1 1 . 1 1 9 9 ASP H H 9 8.660 8.660 8.598 0.062 25844 15 1 1 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.713 -0.540 25844 16 1 1 . 1 1 10 10 LEU H H 10 7.838 7.838 7.944 -0.106 25844 17 1 1 . 1 1 11 11 GLY H H 11 8.206 8.206 8.631 -0.425 25844 18 1 1 . 1 1 12 12 THR HA H 12 4.293 4.293 4.124 0.169 25844 19 1 1 . 1 1 12 12 THR H H 12 8.453 8.453 7.941 0.512 25844 20 1 1 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.303 -0.164 25844 21 1 1 . 1 1 13 13 LEU H H 13 7.907 7.907 8.079 -0.172 25844 22 1 1 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.919 0.332 25844 23 1 1 . 1 1 14 14 LEU H H 14 7.702 7.702 7.421 0.281 25844 24 1 1 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.028 -0.134 25844 25 1 1 . 1 1 15 15 PHE H H 15 7.917 7.917 7.637 0.280 25844 26 1 1 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.925 0.509 25844 27 1 1 . 1 1 16 16 ARG H H 16 8.345 8.345 9.011 -0.666 25844 28 1 1 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.215 0.595 25844 29 1 1 . 1 1 17 17 CYS H H 17 8.325 8.325 8.200 0.125 25844 30 1 1 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.049 0.294 25844 31 1 1 . 1 1 18 18 ARG H H 18 9.352 9.352 8.572 0.780 25844 32 1 1 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.353 0.293 25844 33 1 1 . 1 1 19 19 ARG H H 19 8.007 8.007 7.982 0.025 25844 34 1 1 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.347 -0.289 25844 35 1 1 . 1 1 20 20 ASP H H 20 9.164 9.164 8.906 0.258 25844 36 1 1 . 1 1 21 21 SER HA H 21 4.206 4.206 4.198 0.008 25844 37 1 1 . 1 1 21 21 SER H H 21 8.133 8.133 8.120 0.013 25844 38 1 1 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.638 -0.091 25844 39 1 1 . 1 1 22 22 ASP H H 22 7.653 7.653 8.178 -0.525 25844 40 1 1 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.977 -0.453 25844 41 1 1 . 1 1 23 23 CYS H H 23 7.828 7.828 7.955 -0.127 25844 42 1 1 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.290 0.112 25844 43 1 1 . 1 1 25 25 GLY H H 25 8.385 8.385 7.705 0.680 25844 44 1 1 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.108 0.177 25844 45 1 1 . 1 1 26 26 ALA H H 26 8.256 8.256 8.354 -0.098 25844 46 1 1 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.450 0.032 25844 47 1 1 . 1 1 27 27 CYS H H 27 8.083 8.083 7.896 0.187 25844 48 1 1 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.660 -0.392 25844 49 1 1 . 1 1 28 28 ILE H H 28 8.357 8.357 8.392 -0.035 25844 50 1 1 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.493 0.287 25844 51 1 1 . 1 1 29 29 CYS H H 29 8.964 8.964 8.991 -0.027 25844 52 1 1 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.642 -0.357 25844 53 1 1 . 1 1 30 30 ARG H H 30 8.054 8.054 8.022 0.032 25844 54 1 1 . 1 1 31 31 GLY H H 31 8.782 8.782 8.800 -0.018 25844 55 1 1 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.549 0.011 25844 56 1 1 . 1 1 32 32 ASN H H 32 7.652 7.652 8.047 -0.395 25844 57 1 1 . 1 1 33 33 GLY H H 33 8.227 8.227 8.204 0.023 25844 58 1 1 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.772 0.525 25844 59 1 1 . 1 1 34 34 TYR H H 34 7.271 7.271 7.639 -0.368 25844 60 1 1 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.409 0.866 25844 61 1 1 . 1 1 35 35 CYS H H 35 8.829 8.829 7.922 0.907 25844 62 1 2 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.809 -0.248 25844 63 1 2 . 1 1 2 2 CYS H H 2 7.688 7.688 8.732 -1.044 25844 64 1 2 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.732 0.448 25844 65 1 2 . 1 1 3 3 ILE H H 3 8.043 8.043 8.106 -0.063 25844 66 1 2 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.982 0.420 25844 67 1 2 . 1 1 4 4 LEU H H 4 7.885 7.885 8.472 -0.587 25844 68 1 2 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.756 0.024 25844 69 1 2 . 1 1 5 5 ASN H H 5 8.769 8.769 7.966 0.803 25844 70 1 2 . 1 1 6 6 GLY H H 6 8.723 8.723 8.666 0.057 25844 71 1 2 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.368 -0.268 25844 72 1 2 . 1 1 7 7 ARG H H 7 7.495 7.495 8.205 -0.710 25844 73 1 2 . 1 1 8 8 THR HA H 8 4.232 4.232 4.036 0.196 25844 74 1 2 . 1 1 8 8 THR H H 8 8.352 8.352 7.562 0.790 25844 75 1 2 . 1 1 9 9 ASP H H 9 8.660 8.660 8.691 -0.031 25844 76 1 2 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.591 -0.418 25844 77 1 2 . 1 1 10 10 LEU H H 10 7.838 7.838 7.820 0.018 25844 78 1 2 . 1 1 11 11 GLY H H 11 8.206 8.206 8.633 -0.427 25844 79 1 2 . 1 1 12 12 THR HA H 12 4.293 4.293 4.143 0.150 25844 80 1 2 . 1 1 12 12 THR H H 12 8.453 8.453 8.116 0.337 25844 81 1 2 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.255 -0.116 25844 82 1 2 . 1 1 13 13 LEU H H 13 7.907 7.907 7.945 -0.038 25844 83 1 2 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.792 0.459 25844 84 1 2 . 1 1 14 14 LEU H H 14 7.702 7.702 7.388 0.314 25844 85 1 2 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.104 -0.210 25844 86 1 2 . 1 1 15 15 PHE H H 15 7.917 7.917 7.584 0.333 25844 87 1 2 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.901 0.533 25844 88 1 2 . 1 1 16 16 ARG H H 16 8.345 8.345 8.928 -0.583 25844 89 1 2 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.325 0.485 25844 90 1 2 . 1 1 17 17 CYS H H 17 8.325 8.325 8.306 0.019 25844 91 1 2 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.077 0.266 25844 92 1 2 . 1 1 18 18 ARG H H 18 9.352 9.352 8.685 0.667 25844 93 1 2 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.426 0.220 25844 94 1 2 . 1 1 19 19 ARG H H 19 8.007 8.007 8.413 -0.406 25844 95 1 2 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.310 -0.252 25844 96 1 2 . 1 1 20 20 ASP H H 20 9.164 9.164 8.856 0.308 25844 97 1 2 . 1 1 21 21 SER HA H 21 4.206 4.206 4.137 0.069 25844 98 1 2 . 1 1 21 21 SER H H 21 8.133 8.133 8.089 0.044 25844 99 1 2 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.396 0.151 25844 100 1 2 . 1 1 22 22 ASP H H 22 7.653 7.653 8.141 -0.488 25844 101 1 2 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.846 -0.322 25844 102 1 2 . 1 1 23 23 CYS H H 23 7.828 7.828 7.761 0.067 25844 103 1 2 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.300 0.102 25844 104 1 2 . 1 1 25 25 GLY H H 25 8.385 8.385 7.532 0.853 25844 105 1 2 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.092 0.193 25844 106 1 2 . 1 1 26 26 ALA H H 26 8.256 8.256 8.254 0.002 25844 107 1 2 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.335 0.147 25844 108 1 2 . 1 1 27 27 CYS H H 27 8.083 8.083 7.947 0.136 25844 109 1 2 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.407 -0.139 25844 110 1 2 . 1 1 28 28 ILE H H 28 8.357 8.357 8.459 -0.102 25844 111 1 2 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.557 0.223 25844 112 1 2 . 1 1 29 29 CYS H H 29 8.964 8.964 8.583 0.381 25844 113 1 2 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.633 -0.348 25844 114 1 2 . 1 1 30 30 ARG H H 30 8.054 8.054 8.190 -0.136 25844 115 1 2 . 1 1 31 31 GLY H H 31 8.782 8.782 8.805 -0.023 25844 116 1 2 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.562 -0.002 25844 117 1 2 . 1 1 32 32 ASN H H 32 7.652 7.652 8.026 -0.374 25844 118 1 2 . 1 1 33 33 GLY H H 33 8.227 8.227 8.194 0.033 25844 119 1 2 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.762 0.535 25844 120 1 2 . 1 1 34 34 TYR H H 34 7.271 7.271 7.639 -0.368 25844 121 1 2 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.496 0.779 25844 122 1 2 . 1 1 35 35 CYS H H 35 8.829 8.829 8.070 0.759 25844 123 1 3 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.916 -0.355 25844 124 1 3 . 1 1 2 2 CYS H H 2 7.688 7.688 8.208 -0.520 25844 125 1 3 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.725 0.455 25844 126 1 3 . 1 1 3 3 ILE H H 3 8.043 8.043 8.476 -0.433 25844 127 1 3 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.300 0.102 25844 128 1 3 . 1 1 4 4 LEU H H 4 7.885 7.885 7.571 0.314 25844 129 1 3 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.488 0.292 25844 130 1 3 . 1 1 5 5 ASN H H 5 8.769 8.769 8.072 0.697 25844 131 1 3 . 1 1 6 6 GLY H H 6 8.723 8.723 8.586 0.137 25844 132 1 3 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.348 -0.248 25844 133 1 3 . 1 1 7 7 ARG H H 7 7.495 7.495 8.125 -0.630 25844 134 1 3 . 1 1 8 8 THR HA H 8 4.232 4.232 4.032 0.200 25844 135 1 3 . 1 1 8 8 THR H H 8 8.352 8.352 7.745 0.607 25844 136 1 3 . 1 1 9 9 ASP H H 9 8.660 8.660 8.629 0.031 25844 137 1 3 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.508 -0.335 25844 138 1 3 . 1 1 10 10 LEU H H 10 7.838 7.838 7.575 0.263 25844 139 1 3 . 1 1 11 11 GLY H H 11 8.206 8.206 8.643 -0.437 25844 140 1 3 . 1 1 12 12 THR HA H 12 4.293 4.293 4.188 0.105 25844 141 1 3 . 1 1 12 12 THR H H 12 8.453 8.453 8.039 0.414 25844 142 1 3 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.317 -0.178 25844 143 1 3 . 1 1 13 13 LEU H H 13 7.907 7.907 8.060 -0.153 25844 144 1 3 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.075 0.176 25844 145 1 3 . 1 1 14 14 LEU H H 14 7.702 7.702 7.574 0.128 25844 146 1 3 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.971 -0.077 25844 147 1 3 . 1 1 15 15 PHE H H 15 7.917 7.917 7.632 0.285 25844 148 1 3 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.907 0.527 25844 149 1 3 . 1 1 16 16 ARG H H 16 8.345 8.345 9.087 -0.742 25844 150 1 3 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.275 0.535 25844 151 1 3 . 1 1 17 17 CYS H H 17 8.325 8.325 8.258 0.067 25844 152 1 3 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.049 0.294 25844 153 1 3 . 1 1 18 18 ARG H H 18 9.352 9.352 8.524 0.828 25844 154 1 3 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.347 0.299 25844 155 1 3 . 1 1 19 19 ARG H H 19 8.007 8.007 7.944 0.063 25844 156 1 3 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.268 -0.210 25844 157 1 3 . 1 1 20 20 ASP H H 20 9.164 9.164 8.880 0.284 25844 158 1 3 . 1 1 21 21 SER HA H 21 4.206 4.206 4.123 0.083 25844 159 1 3 . 1 1 21 21 SER H H 21 8.133 8.133 8.221 -0.088 25844 160 1 3 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.571 -0.024 25844 161 1 3 . 1 1 22 22 ASP H H 22 7.653 7.653 8.197 -0.544 25844 162 1 3 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.727 -0.203 25844 163 1 3 . 1 1 23 23 CYS H H 23 7.828 7.828 7.836 -0.008 25844 164 1 3 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.414 -0.012 25844 165 1 3 . 1 1 25 25 GLY H H 25 8.385 8.385 7.832 0.553 25844 166 1 3 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.007 0.278 25844 167 1 3 . 1 1 26 26 ALA H H 26 8.256 8.256 8.335 -0.079 25844 168 1 3 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.366 0.116 25844 169 1 3 . 1 1 27 27 CYS H H 27 8.083 8.083 7.998 0.085 25844 170 1 3 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.376 -0.108 25844 171 1 3 . 1 1 28 28 ILE H H 28 8.357 8.357 8.569 -0.212 25844 172 1 3 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.516 0.264 25844 173 1 3 . 1 1 29 29 CYS H H 29 8.964 8.964 8.649 0.315 25844 174 1 3 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.606 -0.321 25844 175 1 3 . 1 1 30 30 ARG H H 30 8.054 8.054 8.263 -0.209 25844 176 1 3 . 1 1 31 31 GLY H H 31 8.782 8.782 8.804 -0.022 25844 177 1 3 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.563 -0.003 25844 178 1 3 . 1 1 32 32 ASN H H 32 7.652 7.652 8.051 -0.399 25844 179 1 3 . 1 1 33 33 GLY H H 33 8.227 8.227 8.219 0.008 25844 180 1 3 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.733 0.564 25844 181 1 3 . 1 1 34 34 TYR H H 34 7.271 7.271 7.632 -0.361 25844 182 1 3 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.405 0.870 25844 183 1 3 . 1 1 35 35 CYS H H 35 8.829 8.829 7.833 0.996 25844 184 1 4 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.918 -0.357 25844 185 1 4 . 1 1 2 2 CYS H H 2 7.688 7.688 8.122 -0.434 25844 186 1 4 . 1 1 3 3 ILE HA H 3 4.180 4.180 4.125 0.055 25844 187 1 4 . 1 1 3 3 ILE H H 3 8.043 8.043 8.483 -0.440 25844 188 1 4 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.392 0.010 25844 189 1 4 . 1 1 4 4 LEU H H 4 7.885 7.885 8.353 -0.468 25844 190 1 4 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.478 0.302 25844 191 1 4 . 1 1 5 5 ASN H H 5 8.769 8.769 8.404 0.365 25844 192 1 4 . 1 1 6 6 GLY H H 6 8.723 8.723 8.149 0.574 25844 193 1 4 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.152 -0.052 25844 194 1 4 . 1 1 7 7 ARG H H 7 7.495 7.495 8.131 -0.636 25844 195 1 4 . 1 1 8 8 THR HA H 8 4.232 4.232 4.248 -0.016 25844 196 1 4 . 1 1 8 8 THR H H 8 8.352 8.352 7.949 0.403 25844 197 1 4 . 1 1 9 9 ASP H H 9 8.660 8.660 8.704 -0.044 25844 198 1 4 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.605 -0.432 25844 199 1 4 . 1 1 10 10 LEU H H 10 7.838 7.838 7.858 -0.020 25844 200 1 4 . 1 1 11 11 GLY H H 11 8.206 8.206 8.652 -0.446 25844 201 1 4 . 1 1 12 12 THR HA H 12 4.293 4.293 4.112 0.181 25844 202 1 4 . 1 1 12 12 THR H H 12 8.453 8.453 8.136 0.317 25844 203 1 4 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.237 -0.098 25844 204 1 4 . 1 1 13 13 LEU H H 13 7.907 7.907 8.062 -0.155 25844 205 1 4 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.784 0.467 25844 206 1 4 . 1 1 14 14 LEU H H 14 7.702 7.702 7.457 0.245 25844 207 1 4 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.073 -0.179 25844 208 1 4 . 1 1 15 15 PHE H H 15 7.917 7.917 7.579 0.338 25844 209 1 4 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.888 0.546 25844 210 1 4 . 1 1 16 16 ARG H H 16 8.345 8.345 8.964 -0.619 25844 211 1 4 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.450 0.360 25844 212 1 4 . 1 1 17 17 CYS H H 17 8.325 8.325 8.319 0.006 25844 213 1 4 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.067 0.276 25844 214 1 4 . 1 1 18 18 ARG H H 18 9.352 9.352 8.925 0.427 25844 215 1 4 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.421 0.225 25844 216 1 4 . 1 1 19 19 ARG H H 19 8.007 8.007 7.719 0.288 25844 217 1 4 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.370 -0.312 25844 218 1 4 . 1 1 20 20 ASP H H 20 9.164 9.164 8.870 0.294 25844 219 1 4 . 1 1 21 21 SER HA H 21 4.206 4.206 4.087 0.119 25844 220 1 4 . 1 1 21 21 SER H H 21 8.133 8.133 8.152 -0.019 25844 221 1 4 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.367 0.180 25844 222 1 4 . 1 1 22 22 ASP H H 22 7.653 7.653 8.021 -0.368 25844 223 1 4 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.773 -0.249 25844 224 1 4 . 1 1 23 23 CYS H H 23 7.828 7.828 7.760 0.068 25844 225 1 4 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.308 0.094 25844 226 1 4 . 1 1 25 25 GLY H H 25 8.385 8.385 7.849 0.536 25844 227 1 4 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.112 0.173 25844 228 1 4 . 1 1 26 26 ALA H H 26 8.256 8.256 8.302 -0.046 25844 229 1 4 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.165 0.317 25844 230 1 4 . 1 1 27 27 CYS H H 27 8.083 8.083 8.311 -0.228 25844 231 1 4 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.415 -0.147 25844 232 1 4 . 1 1 28 28 ILE H H 28 8.357 8.357 7.883 0.474 25844 233 1 4 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.515 0.265 25844 234 1 4 . 1 1 29 29 CYS H H 29 8.964 8.964 8.536 0.428 25844 235 1 4 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.603 -0.318 25844 236 1 4 . 1 1 30 30 ARG H H 30 8.054 8.054 8.150 -0.096 25844 237 1 4 . 1 1 31 31 GLY H H 31 8.782 8.782 8.768 0.014 25844 238 1 4 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.582 -0.022 25844 239 1 4 . 1 1 32 32 ASN H H 32 7.652 7.652 7.993 -0.341 25844 240 1 4 . 1 1 33 33 GLY H H 33 8.227 8.227 8.193 0.034 25844 241 1 4 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.764 0.533 25844 242 1 4 . 1 1 34 34 TYR H H 34 7.271 7.271 7.640 -0.369 25844 243 1 4 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.599 0.676 25844 244 1 4 . 1 1 35 35 CYS H H 35 8.829 8.829 7.996 0.833 25844 245 1 5 . 1 1 2 2 CYS HA H 2 4.561 4.561 5.171 -0.610 25844 246 1 5 . 1 1 2 2 CYS H H 2 7.688 7.688 8.085 -0.397 25844 247 1 5 . 1 1 3 3 ILE HA H 3 4.180 4.180 4.239 -0.059 25844 248 1 5 . 1 1 3 3 ILE H H 3 8.043 8.043 8.488 -0.445 25844 249 1 5 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.493 -0.091 25844 250 1 5 . 1 1 4 4 LEU H H 4 7.885 7.885 8.313 -0.428 25844 251 1 5 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.746 0.034 25844 252 1 5 . 1 1 5 5 ASN H H 5 8.769 8.769 7.857 0.912 25844 253 1 5 . 1 1 6 6 GLY H H 6 8.723 8.723 8.443 0.280 25844 254 1 5 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.369 -0.269 25844 255 1 5 . 1 1 7 7 ARG H H 7 7.495 7.495 7.934 -0.439 25844 256 1 5 . 1 1 8 8 THR HA H 8 4.232 4.232 4.081 0.151 25844 257 1 5 . 1 1 8 8 THR H H 8 8.352 8.352 7.568 0.784 25844 258 1 5 . 1 1 9 9 ASP H H 9 8.660 8.660 8.618 0.042 25844 259 1 5 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.595 -0.422 25844 260 1 5 . 1 1 10 10 LEU H H 10 7.838 7.838 7.778 0.060 25844 261 1 5 . 1 1 11 11 GLY H H 11 8.206 8.206 8.547 -0.341 25844 262 1 5 . 1 1 12 12 THR HA H 12 4.293 4.293 4.221 0.072 25844 263 1 5 . 1 1 12 12 THR H H 12 8.453 8.453 7.985 0.468 25844 264 1 5 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.182 -0.043 25844 265 1 5 . 1 1 13 13 LEU H H 13 7.907 7.907 7.880 0.027 25844 266 1 5 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.779 0.472 25844 267 1 5 . 1 1 14 14 LEU H H 14 7.702 7.702 7.431 0.271 25844 268 1 5 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.102 -0.208 25844 269 1 5 . 1 1 15 15 PHE H H 15 7.917 7.917 7.567 0.350 25844 270 1 5 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.902 0.532 25844 271 1 5 . 1 1 16 16 ARG H H 16 8.345 8.345 8.864 -0.519 25844 272 1 5 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.474 0.336 25844 273 1 5 . 1 1 17 17 CYS H H 17 8.325 8.325 8.191 0.134 25844 274 1 5 . 1 1 18 18 ARG HA H 18 4.343 4.343 3.996 0.347 25844 275 1 5 . 1 1 18 18 ARG H H 18 9.352 9.352 8.692 0.660 25844 276 1 5 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.339 0.307 25844 277 1 5 . 1 1 19 19 ARG H H 19 8.007 8.007 7.437 0.570 25844 278 1 5 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.396 -0.338 25844 279 1 5 . 1 1 20 20 ASP H H 20 9.164 9.164 8.832 0.332 25844 280 1 5 . 1 1 21 21 SER HA H 21 4.206 4.206 4.120 0.086 25844 281 1 5 . 1 1 21 21 SER H H 21 8.133 8.133 8.133 -0.000 25844 282 1 5 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.404 0.143 25844 283 1 5 . 1 1 22 22 ASP H H 22 7.653 7.653 7.949 -0.296 25844 284 1 5 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.759 -0.235 25844 285 1 5 . 1 1 23 23 CYS H H 23 7.828 7.828 7.761 0.067 25844 286 1 5 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.320 0.082 25844 287 1 5 . 1 1 25 25 GLY H H 25 8.385 8.385 7.804 0.581 25844 288 1 5 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.105 0.180 25844 289 1 5 . 1 1 26 26 ALA H H 26 8.256 8.256 8.092 0.164 25844 290 1 5 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.336 0.146 25844 291 1 5 . 1 1 27 27 CYS H H 27 8.083 8.083 7.920 0.163 25844 292 1 5 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.530 -0.262 25844 293 1 5 . 1 1 28 28 ILE H H 28 8.357 8.357 8.228 0.129 25844 294 1 5 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.538 0.242 25844 295 1 5 . 1 1 29 29 CYS H H 29 8.964 8.964 8.630 0.334 25844 296 1 5 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.629 -0.344 25844 297 1 5 . 1 1 30 30 ARG H H 30 8.054 8.054 8.219 -0.165 25844 298 1 5 . 1 1 31 31 GLY H H 31 8.782 8.782 8.805 -0.023 25844 299 1 5 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.567 -0.007 25844 300 1 5 . 1 1 32 32 ASN H H 32 7.652 7.652 8.024 -0.372 25844 301 1 5 . 1 1 33 33 GLY H H 33 8.227 8.227 8.194 0.033 25844 302 1 5 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.774 0.523 25844 303 1 5 . 1 1 34 34 TYR H H 34 7.271 7.271 7.643 -0.372 25844 304 1 5 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.601 0.674 25844 305 1 5 . 1 1 35 35 CYS H H 35 8.829 8.829 7.991 0.838 25844 306 1 6 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.724 -0.163 25844 307 1 6 . 1 1 2 2 CYS H H 2 7.688 7.688 8.279 -0.591 25844 308 1 6 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.723 0.457 25844 309 1 6 . 1 1 3 3 ILE H H 3 8.043 8.043 8.973 -0.930 25844 310 1 6 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.982 0.420 25844 311 1 6 . 1 1 4 4 LEU H H 4 7.885 7.885 8.580 -0.695 25844 312 1 6 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.781 -0.001 25844 313 1 6 . 1 1 5 5 ASN H H 5 8.769 8.769 7.974 0.795 25844 314 1 6 . 1 1 6 6 GLY H H 6 8.723 8.723 8.698 0.025 25844 315 1 6 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.236 -0.136 25844 316 1 6 . 1 1 7 7 ARG H H 7 7.495 7.495 8.424 -0.929 25844 317 1 6 . 1 1 8 8 THR HA H 8 4.232 4.232 4.139 0.093 25844 318 1 6 . 1 1 8 8 THR H H 8 8.352 8.352 7.578 0.774 25844 319 1 6 . 1 1 9 9 ASP H H 9 8.660 8.660 8.336 0.324 25844 320 1 6 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.551 -0.378 25844 321 1 6 . 1 1 10 10 LEU H H 10 7.838 7.838 7.738 0.100 25844 322 1 6 . 1 1 11 11 GLY H H 11 8.206 8.206 8.649 -0.443 25844 323 1 6 . 1 1 12 12 THR HA H 12 4.293 4.293 4.150 0.143 25844 324 1 6 . 1 1 12 12 THR H H 12 8.453 8.453 8.143 0.310 25844 325 1 6 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.275 -0.136 25844 326 1 6 . 1 1 13 13 LEU H H 13 7.907 7.907 7.940 -0.033 25844 327 1 6 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.852 0.399 25844 328 1 6 . 1 1 14 14 LEU H H 14 7.702 7.702 7.519 0.183 25844 329 1 6 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.033 -0.139 25844 330 1 6 . 1 1 15 15 PHE H H 15 7.917 7.917 7.692 0.225 25844 331 1 6 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.903 0.531 25844 332 1 6 . 1 1 16 16 ARG H H 16 8.345 8.345 9.006 -0.661 25844 333 1 6 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.447 0.363 25844 334 1 6 . 1 1 17 17 CYS H H 17 8.325 8.325 8.300 0.025 25844 335 1 6 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.034 0.309 25844 336 1 6 . 1 1 18 18 ARG H H 18 9.352 9.352 9.054 0.298 25844 337 1 6 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.374 0.272 25844 338 1 6 . 1 1 19 19 ARG H H 19 8.007 8.007 7.532 0.475 25844 339 1 6 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.377 -0.319 25844 340 1 6 . 1 1 20 20 ASP H H 20 9.164 9.164 8.780 0.384 25844 341 1 6 . 1 1 21 21 SER HA H 21 4.206 4.206 4.160 0.046 25844 342 1 6 . 1 1 21 21 SER H H 21 8.133 8.133 8.170 -0.037 25844 343 1 6 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.429 0.118 25844 344 1 6 . 1 1 22 22 ASP H H 22 7.653 7.653 8.075 -0.422 25844 345 1 6 . 1 1 23 23 CYS HA H 23 4.524 4.524 5.084 -0.560 25844 346 1 6 . 1 1 23 23 CYS H H 23 7.828 7.828 7.761 0.067 25844 347 1 6 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.320 0.082 25844 348 1 6 . 1 1 25 25 GLY H H 25 8.385 8.385 8.023 0.362 25844 349 1 6 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.159 0.126 25844 350 1 6 . 1 1 26 26 ALA H H 26 8.256 8.256 8.378 -0.122 25844 351 1 6 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.300 0.182 25844 352 1 6 . 1 1 27 27 CYS H H 27 8.083 8.083 8.309 -0.226 25844 353 1 6 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.405 -0.137 25844 354 1 6 . 1 1 28 28 ILE H H 28 8.357 8.357 8.153 0.204 25844 355 1 6 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.485 0.295 25844 356 1 6 . 1 1 29 29 CYS H H 29 8.964 8.964 8.476 0.488 25844 357 1 6 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.645 -0.360 25844 358 1 6 . 1 1 30 30 ARG H H 30 8.054 8.054 8.092 -0.038 25844 359 1 6 . 1 1 31 31 GLY H H 31 8.782 8.782 8.775 0.007 25844 360 1 6 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.567 -0.007 25844 361 1 6 . 1 1 32 32 ASN H H 32 7.652 7.652 8.039 -0.387 25844 362 1 6 . 1 1 33 33 GLY H H 33 8.227 8.227 8.272 -0.045 25844 363 1 6 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.748 0.549 25844 364 1 6 . 1 1 34 34 TYR H H 34 7.271 7.271 7.640 -0.369 25844 365 1 6 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.339 0.936 25844 366 1 6 . 1 1 35 35 CYS H H 35 8.829 8.829 7.867 0.962 25844 367 1 7 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.816 -0.255 25844 368 1 7 . 1 1 2 2 CYS H H 2 7.688 7.688 8.422 -0.734 25844 369 1 7 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.737 0.443 25844 370 1 7 . 1 1 3 3 ILE H H 3 8.043 8.043 8.180 -0.137 25844 371 1 7 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.587 -0.185 25844 372 1 7 . 1 1 4 4 LEU H H 4 7.885 7.885 8.171 -0.286 25844 373 1 7 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.787 -0.007 25844 374 1 7 . 1 1 5 5 ASN H H 5 8.769 8.769 8.643 0.126 25844 375 1 7 . 1 1 6 6 GLY H H 6 8.723 8.723 7.834 0.889 25844 376 1 7 . 1 1 7 7 ARG HA H 7 4.100 4.100 3.905 0.195 25844 377 1 7 . 1 1 7 7 ARG H H 7 7.495 7.495 8.702 -1.207 25844 378 1 7 . 1 1 8 8 THR HA H 8 4.232 4.232 4.001 0.231 25844 379 1 7 . 1 1 8 8 THR H H 8 8.352 8.352 8.188 0.164 25844 380 1 7 . 1 1 9 9 ASP H H 9 8.660 8.660 8.494 0.166 25844 381 1 7 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.679 -0.506 25844 382 1 7 . 1 1 10 10 LEU H H 10 7.838 7.838 7.750 0.088 25844 383 1 7 . 1 1 11 11 GLY H H 11 8.206 8.206 8.688 -0.482 25844 384 1 7 . 1 1 12 12 THR HA H 12 4.293 4.293 4.137 0.156 25844 385 1 7 . 1 1 12 12 THR H H 12 8.453 8.453 8.151 0.302 25844 386 1 7 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.193 -0.054 25844 387 1 7 . 1 1 13 13 LEU H H 13 7.907 7.907 7.990 -0.083 25844 388 1 7 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.909 0.342 25844 389 1 7 . 1 1 14 14 LEU H H 14 7.702 7.702 7.716 -0.014 25844 390 1 7 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.019 -0.125 25844 391 1 7 . 1 1 15 15 PHE H H 15 7.917 7.917 7.663 0.254 25844 392 1 7 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.914 0.520 25844 393 1 7 . 1 1 16 16 ARG H H 16 8.345 8.345 8.968 -0.623 25844 394 1 7 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.250 0.560 25844 395 1 7 . 1 1 17 17 CYS H H 17 8.325 8.325 8.254 0.071 25844 396 1 7 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.013 0.330 25844 397 1 7 . 1 1 18 18 ARG H H 18 9.352 9.352 8.584 0.768 25844 398 1 7 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.407 0.239 25844 399 1 7 . 1 1 19 19 ARG H H 19 8.007 8.007 8.039 -0.032 25844 400 1 7 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.308 -0.250 25844 401 1 7 . 1 1 20 20 ASP H H 20 9.164 9.164 8.916 0.248 25844 402 1 7 . 1 1 21 21 SER HA H 21 4.206 4.206 4.148 0.058 25844 403 1 7 . 1 1 21 21 SER H H 21 8.133 8.133 8.023 0.110 25844 404 1 7 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.555 -0.008 25844 405 1 7 . 1 1 22 22 ASP H H 22 7.653 7.653 8.189 -0.536 25844 406 1 7 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.776 -0.252 25844 407 1 7 . 1 1 23 23 CYS H H 23 7.828 7.828 7.806 0.022 25844 408 1 7 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.323 0.079 25844 409 1 7 . 1 1 25 25 GLY H H 25 8.385 8.385 7.931 0.454 25844 410 1 7 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.185 0.100 25844 411 1 7 . 1 1 26 26 ALA H H 26 8.256 8.256 8.375 -0.119 25844 412 1 7 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.445 0.037 25844 413 1 7 . 1 1 27 27 CYS H H 27 8.083 8.083 7.875 0.208 25844 414 1 7 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.391 -0.123 25844 415 1 7 . 1 1 28 28 ILE H H 28 8.357 8.357 8.514 -0.157 25844 416 1 7 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.595 0.185 25844 417 1 7 . 1 1 29 29 CYS H H 29 8.964 8.964 8.422 0.542 25844 418 1 7 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.659 -0.374 25844 419 1 7 . 1 1 30 30 ARG H H 30 8.054 8.054 8.104 -0.050 25844 420 1 7 . 1 1 31 31 GLY H H 31 8.782 8.782 8.808 -0.026 25844 421 1 7 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.562 -0.002 25844 422 1 7 . 1 1 32 32 ASN H H 32 7.652 7.652 8.049 -0.397 25844 423 1 7 . 1 1 33 33 GLY H H 33 8.227 8.227 8.285 -0.058 25844 424 1 7 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.727 0.570 25844 425 1 7 . 1 1 34 34 TYR H H 34 7.271 7.271 7.636 -0.365 25844 426 1 7 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.405 0.870 25844 427 1 7 . 1 1 35 35 CYS H H 35 8.829 8.829 7.762 1.067 25844 428 1 8 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.988 -0.427 25844 429 1 8 . 1 1 2 2 CYS H H 2 7.688 7.688 8.556 -0.868 25844 430 1 8 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.788 0.392 25844 431 1 8 . 1 1 3 3 ILE H H 3 8.043 8.043 8.294 -0.251 25844 432 1 8 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.864 -0.462 25844 433 1 8 . 1 1 4 4 LEU H H 4 7.885 7.885 8.255 -0.370 25844 434 1 8 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.785 -0.005 25844 435 1 8 . 1 1 5 5 ASN H H 5 8.769 8.769 8.827 -0.058 25844 436 1 8 . 1 1 6 6 GLY H H 6 8.723 8.723 8.196 0.527 25844 437 1 8 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.091 0.009 25844 438 1 8 . 1 1 7 7 ARG H H 7 7.495 7.495 8.191 -0.696 25844 439 1 8 . 1 1 8 8 THR HA H 8 4.232 4.232 4.800 -0.568 25844 440 1 8 . 1 1 8 8 THR H H 8 8.352 8.352 7.936 0.416 25844 441 1 8 . 1 1 9 9 ASP H H 9 8.660 8.660 8.727 -0.067 25844 442 1 8 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.599 -0.426 25844 443 1 8 . 1 1 10 10 LEU H H 10 7.838 7.838 7.895 -0.057 25844 444 1 8 . 1 1 11 11 GLY H H 11 8.206 8.206 8.604 -0.398 25844 445 1 8 . 1 1 12 12 THR HA H 12 4.293 4.293 4.180 0.113 25844 446 1 8 . 1 1 12 12 THR H H 12 8.453 8.453 7.991 0.462 25844 447 1 8 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.461 -0.322 25844 448 1 8 . 1 1 13 13 LEU H H 13 7.907 7.907 8.162 -0.255 25844 449 1 8 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.220 0.031 25844 450 1 8 . 1 1 14 14 LEU H H 14 7.702 7.702 7.482 0.220 25844 451 1 8 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.854 0.040 25844 452 1 8 . 1 1 15 15 PHE H H 15 7.917 7.917 7.524 0.393 25844 453 1 8 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.710 0.724 25844 454 1 8 . 1 1 16 16 ARG H H 16 8.345 8.345 8.445 -0.100 25844 455 1 8 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.170 0.640 25844 456 1 8 . 1 1 17 17 CYS H H 17 8.325 8.325 8.129 0.196 25844 457 1 8 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.095 0.248 25844 458 1 8 . 1 1 18 18 ARG H H 18 9.352 9.352 8.513 0.839 25844 459 1 8 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.358 0.288 25844 460 1 8 . 1 1 19 19 ARG H H 19 8.007 8.007 7.993 0.014 25844 461 1 8 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.314 -0.256 25844 462 1 8 . 1 1 20 20 ASP H H 20 9.164 9.164 8.840 0.324 25844 463 1 8 . 1 1 21 21 SER HA H 21 4.206 4.206 4.155 0.051 25844 464 1 8 . 1 1 21 21 SER H H 21 8.133 8.133 8.012 0.121 25844 465 1 8 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.651 -0.104 25844 466 1 8 . 1 1 22 22 ASP H H 22 7.653 7.653 8.107 -0.454 25844 467 1 8 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.944 -0.420 25844 468 1 8 . 1 1 23 23 CYS H H 23 7.828 7.828 8.004 -0.176 25844 469 1 8 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.294 0.108 25844 470 1 8 . 1 1 25 25 GLY H H 25 8.385 8.385 7.734 0.651 25844 471 1 8 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.106 0.179 25844 472 1 8 . 1 1 26 26 ALA H H 26 8.256 8.256 8.256 0.000 25844 473 1 8 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.332 0.150 25844 474 1 8 . 1 1 27 27 CYS H H 27 8.083 8.083 8.206 -0.123 25844 475 1 8 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.386 -0.118 25844 476 1 8 . 1 1 28 28 ILE H H 28 8.357 8.357 8.077 0.280 25844 477 1 8 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.491 0.289 25844 478 1 8 . 1 1 29 29 CYS H H 29 8.964 8.964 8.666 0.298 25844 479 1 8 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.543 -0.258 25844 480 1 8 . 1 1 30 30 ARG H H 30 8.054 8.054 7.944 0.111 25844 481 1 8 . 1 1 31 31 GLY H H 31 8.782 8.782 8.730 0.052 25844 482 1 8 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.498 0.062 25844 483 1 8 . 1 1 32 32 ASN H H 32 7.652 7.652 7.954 -0.302 25844 484 1 8 . 1 1 33 33 GLY H H 33 8.227 8.227 8.099 0.128 25844 485 1 8 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.495 0.802 25844 486 1 8 . 1 1 34 34 TYR H H 34 7.271 7.271 7.357 -0.086 25844 487 1 8 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.238 1.037 25844 488 1 8 . 1 1 35 35 CYS H H 35 8.829 8.829 7.858 0.971 25844 489 1 9 . 1 1 2 2 CYS HA H 2 4.561 4.561 5.021 -0.460 25844 490 1 9 . 1 1 2 2 CYS H H 2 7.688 7.688 8.314 -0.626 25844 491 1 9 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.681 0.499 25844 492 1 9 . 1 1 3 3 ILE H H 3 8.043 8.043 8.197 -0.154 25844 493 1 9 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.970 0.432 25844 494 1 9 . 1 1 4 4 LEU H H 4 7.885 7.885 8.386 -0.501 25844 495 1 9 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.743 0.037 25844 496 1 9 . 1 1 5 5 ASN H H 5 8.769 8.769 8.027 0.742 25844 497 1 9 . 1 1 6 6 GLY H H 6 8.723 8.723 8.657 0.066 25844 498 1 9 . 1 1 7 7 ARG HA H 7 4.100 4.100 3.950 0.150 25844 499 1 9 . 1 1 7 7 ARG H H 7 7.495 7.495 7.803 -0.308 25844 500 1 9 . 1 1 8 8 THR HA H 8 4.232 4.232 4.063 0.169 25844 501 1 9 . 1 1 8 8 THR H H 8 8.352 8.352 8.119 0.233 25844 502 1 9 . 1 1 9 9 ASP H H 9 8.660 8.660 8.431 0.229 25844 503 1 9 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.477 -0.304 25844 504 1 9 . 1 1 10 10 LEU H H 10 7.838 7.838 7.507 0.331 25844 505 1 9 . 1 1 11 11 GLY H H 11 8.206 8.206 8.810 -0.604 25844 506 1 9 . 1 1 12 12 THR HA H 12 4.293 4.293 4.049 0.244 25844 507 1 9 . 1 1 12 12 THR H H 12 8.453 8.453 8.013 0.440 25844 508 1 9 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.208 -0.069 25844 509 1 9 . 1 1 13 13 LEU H H 13 7.907 7.907 8.107 -0.200 25844 510 1 9 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.823 0.428 25844 511 1 9 . 1 1 14 14 LEU H H 14 7.702 7.702 7.988 -0.286 25844 512 1 9 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.859 0.035 25844 513 1 9 . 1 1 15 15 PHE H H 15 7.917 7.917 7.632 0.285 25844 514 1 9 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.919 0.515 25844 515 1 9 . 1 1 16 16 ARG H H 16 8.345 8.345 9.057 -0.712 25844 516 1 9 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.280 0.530 25844 517 1 9 . 1 1 17 17 CYS H H 17 8.325 8.325 8.273 0.052 25844 518 1 9 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.029 0.314 25844 519 1 9 . 1 1 18 18 ARG H H 18 9.352 9.352 8.537 0.815 25844 520 1 9 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.493 0.153 25844 521 1 9 . 1 1 19 19 ARG H H 19 8.007 8.007 8.046 -0.039 25844 522 1 9 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.258 -0.200 25844 523 1 9 . 1 1 20 20 ASP H H 20 9.164 9.164 8.879 0.285 25844 524 1 9 . 1 1 21 21 SER HA H 21 4.206 4.206 4.206 -0.000 25844 525 1 9 . 1 1 21 21 SER H H 21 8.133 8.133 8.182 -0.049 25844 526 1 9 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.583 -0.036 25844 527 1 9 . 1 1 22 22 ASP H H 22 7.653 7.653 8.142 -0.489 25844 528 1 9 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.791 -0.267 25844 529 1 9 . 1 1 23 23 CYS H H 23 7.828 7.828 7.862 -0.034 25844 530 1 9 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.356 0.046 25844 531 1 9 . 1 1 25 25 GLY H H 25 8.385 8.385 7.562 0.823 25844 532 1 9 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.148 0.137 25844 533 1 9 . 1 1 26 26 ALA H H 26 8.256 8.256 8.137 0.119 25844 534 1 9 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.369 0.113 25844 535 1 9 . 1 1 27 27 CYS H H 27 8.083 8.083 8.160 -0.077 25844 536 1 9 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.407 -0.139 25844 537 1 9 . 1 1 28 28 ILE H H 28 8.357 8.357 8.457 -0.100 25844 538 1 9 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.493 0.287 25844 539 1 9 . 1 1 29 29 CYS H H 29 8.964 8.964 8.676 0.288 25844 540 1 9 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.596 -0.311 25844 541 1 9 . 1 1 30 30 ARG H H 30 8.054 8.054 8.065 -0.011 25844 542 1 9 . 1 1 31 31 GLY H H 31 8.782 8.782 8.774 0.008 25844 543 1 9 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.556 0.004 25844 544 1 9 . 1 1 32 32 ASN H H 32 7.652 7.652 8.033 -0.381 25844 545 1 9 . 1 1 33 33 GLY H H 33 8.227 8.227 8.271 -0.044 25844 546 1 9 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.729 0.568 25844 547 1 9 . 1 1 34 34 TYR H H 34 7.271 7.271 7.610 -0.339 25844 548 1 9 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.379 0.896 25844 549 1 9 . 1 1 35 35 CYS H H 35 8.829 8.829 7.818 1.011 25844 550 1 10 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.959 -0.398 25844 551 1 10 . 1 1 2 2 CYS H H 2 7.688 7.688 8.058 -0.370 25844 552 1 10 . 1 1 3 3 ILE HA H 3 4.180 4.180 4.268 -0.088 25844 553 1 10 . 1 1 3 3 ILE H H 3 8.043 8.043 8.780 -0.737 25844 554 1 10 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.968 0.434 25844 555 1 10 . 1 1 4 4 LEU H H 4 7.885 7.885 8.679 -0.794 25844 556 1 10 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.753 0.027 25844 557 1 10 . 1 1 5 5 ASN H H 5 8.769 8.769 7.894 0.875 25844 558 1 10 . 1 1 6 6 GLY H H 6 8.723 8.723 8.743 -0.020 25844 559 1 10 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.553 -0.453 25844 560 1 10 . 1 1 7 7 ARG H H 7 7.495 7.495 7.895 -0.400 25844 561 1 10 . 1 1 8 8 THR HA H 8 4.232 4.232 3.961 0.271 25844 562 1 10 . 1 1 8 8 THR H H 8 8.352 8.352 7.995 0.357 25844 563 1 10 . 1 1 9 9 ASP H H 9 8.660 8.660 8.646 0.014 25844 564 1 10 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.629 -0.456 25844 565 1 10 . 1 1 10 10 LEU H H 10 7.838 7.838 7.718 0.120 25844 566 1 10 . 1 1 11 11 GLY H H 11 8.206 8.206 8.445 -0.239 25844 567 1 10 . 1 1 12 12 THR HA H 12 4.293 4.293 4.224 0.069 25844 568 1 10 . 1 1 12 12 THR H H 12 8.453 8.453 7.936 0.517 25844 569 1 10 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.399 -0.260 25844 570 1 10 . 1 1 13 13 LEU H H 13 7.907 7.907 8.128 -0.221 25844 571 1 10 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.929 0.322 25844 572 1 10 . 1 1 14 14 LEU H H 14 7.702 7.702 7.400 0.302 25844 573 1 10 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.009 -0.115 25844 574 1 10 . 1 1 15 15 PHE H H 15 7.917 7.917 7.489 0.428 25844 575 1 10 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.898 0.536 25844 576 1 10 . 1 1 16 16 ARG H H 16 8.345 8.345 9.102 -0.757 25844 577 1 10 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.223 0.587 25844 578 1 10 . 1 1 17 17 CYS H H 17 8.325 8.325 8.309 0.016 25844 579 1 10 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.096 0.247 25844 580 1 10 . 1 1 18 18 ARG H H 18 9.352 9.352 8.506 0.846 25844 581 1 10 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.367 0.279 25844 582 1 10 . 1 1 19 19 ARG H H 19 8.007 8.007 8.092 -0.085 25844 583 1 10 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.290 -0.232 25844 584 1 10 . 1 1 20 20 ASP H H 20 9.164 9.164 8.920 0.244 25844 585 1 10 . 1 1 21 21 SER HA H 21 4.206 4.206 4.076 0.130 25844 586 1 10 . 1 1 21 21 SER H H 21 8.133 8.133 8.094 0.039 25844 587 1 10 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.485 0.062 25844 588 1 10 . 1 1 22 22 ASP H H 22 7.653 7.653 8.367 -0.714 25844 589 1 10 . 1 1 23 23 CYS HA H 23 4.524 4.524 5.093 -0.569 25844 590 1 10 . 1 1 23 23 CYS H H 23 7.828 7.828 8.074 -0.246 25844 591 1 10 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.320 0.082 25844 592 1 10 . 1 1 25 25 GLY H H 25 8.385 8.385 7.580 0.805 25844 593 1 10 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.046 0.239 25844 594 1 10 . 1 1 26 26 ALA H H 26 8.256 8.256 8.531 -0.275 25844 595 1 10 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.342 0.140 25844 596 1 10 . 1 1 27 27 CYS H H 27 8.083 8.083 7.797 0.286 25844 597 1 10 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.518 -0.250 25844 598 1 10 . 1 1 28 28 ILE H H 28 8.357 8.357 8.692 -0.335 25844 599 1 10 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.438 0.342 25844 600 1 10 . 1 1 29 29 CYS H H 29 8.964 8.964 8.871 0.093 25844 601 1 10 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.609 -0.324 25844 602 1 10 . 1 1 30 30 ARG H H 30 8.054 8.054 8.232 -0.178 25844 603 1 10 . 1 1 31 31 GLY H H 31 8.782 8.782 8.803 -0.021 25844 604 1 10 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.549 0.011 25844 605 1 10 . 1 1 32 32 ASN H H 32 7.652 7.652 8.048 -0.396 25844 606 1 10 . 1 1 33 33 GLY H H 33 8.227 8.227 8.232 -0.005 25844 607 1 10 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.749 0.548 25844 608 1 10 . 1 1 34 34 TYR H H 34 7.271 7.271 7.632 -0.361 25844 609 1 10 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.327 0.948 25844 610 1 10 . 1 1 35 35 CYS H H 35 8.829 8.829 7.876 0.953 25844 611 1 11 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.859 -0.298 25844 612 1 11 . 1 1 2 2 CYS H H 2 7.688 7.688 8.201 -0.513 25844 613 1 11 . 1 1 3 3 ILE HA H 3 4.180 4.180 4.332 -0.152 25844 614 1 11 . 1 1 3 3 ILE H H 3 8.043 8.043 8.119 -0.076 25844 615 1 11 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.646 -0.244 25844 616 1 11 . 1 1 4 4 LEU H H 4 7.885 7.885 8.139 -0.254 25844 617 1 11 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.756 0.024 25844 618 1 11 . 1 1 5 5 ASN H H 5 8.769 8.769 8.186 0.583 25844 619 1 11 . 1 1 6 6 GLY H H 6 8.723 8.723 7.594 1.129 25844 620 1 11 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.648 -0.548 25844 621 1 11 . 1 1 7 7 ARG H H 7 7.495 7.495 8.423 -0.928 25844 622 1 11 . 1 1 8 8 THR HA H 8 4.232 4.232 4.037 0.195 25844 623 1 11 . 1 1 8 8 THR H H 8 8.352 8.352 8.300 0.052 25844 624 1 11 . 1 1 9 9 ASP H H 9 8.660 8.660 8.484 0.176 25844 625 1 11 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.636 -0.463 25844 626 1 11 . 1 1 10 10 LEU H H 10 7.838 7.838 7.745 0.093 25844 627 1 11 . 1 1 11 11 GLY H H 11 8.206 8.206 8.623 -0.417 25844 628 1 11 . 1 1 12 12 THR HA H 12 4.293 4.293 4.145 0.148 25844 629 1 11 . 1 1 12 12 THR H H 12 8.453 8.453 7.985 0.468 25844 630 1 11 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.227 -0.088 25844 631 1 11 . 1 1 13 13 LEU H H 13 7.907 7.907 8.098 -0.191 25844 632 1 11 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.125 0.126 25844 633 1 11 . 1 1 14 14 LEU H H 14 7.702 7.702 7.581 0.121 25844 634 1 11 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.036 -0.142 25844 635 1 11 . 1 1 15 15 PHE H H 15 7.917 7.917 7.710 0.207 25844 636 1 11 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.893 0.541 25844 637 1 11 . 1 1 16 16 ARG H H 16 8.345 8.345 9.064 -0.719 25844 638 1 11 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.264 0.546 25844 639 1 11 . 1 1 17 17 CYS H H 17 8.325 8.325 8.232 0.093 25844 640 1 11 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.025 0.318 25844 641 1 11 . 1 1 18 18 ARG H H 18 9.352 9.352 8.510 0.842 25844 642 1 11 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.357 0.289 25844 643 1 11 . 1 1 19 19 ARG H H 19 8.007 8.007 8.097 -0.090 25844 644 1 11 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.323 -0.265 25844 645 1 11 . 1 1 20 20 ASP H H 20 9.164 9.164 8.825 0.339 25844 646 1 11 . 1 1 21 21 SER HA H 21 4.206 4.206 4.211 -0.005 25844 647 1 11 . 1 1 21 21 SER H H 21 8.133 8.133 8.190 -0.057 25844 648 1 11 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.492 0.055 25844 649 1 11 . 1 1 22 22 ASP H H 22 7.653 7.653 8.147 -0.494 25844 650 1 11 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.805 -0.281 25844 651 1 11 . 1 1 23 23 CYS H H 23 7.828 7.828 7.878 -0.050 25844 652 1 11 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.348 0.054 25844 653 1 11 . 1 1 25 25 GLY H H 25 8.385 8.385 7.818 0.567 25844 654 1 11 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.070 0.215 25844 655 1 11 . 1 1 26 26 ALA H H 26 8.256 8.256 8.267 -0.011 25844 656 1 11 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.385 0.097 25844 657 1 11 . 1 1 27 27 CYS H H 27 8.083 8.083 8.355 -0.272 25844 658 1 11 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.606 -0.338 25844 659 1 11 . 1 1 28 28 ILE H H 28 8.357 8.357 8.209 0.148 25844 660 1 11 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.481 0.299 25844 661 1 11 . 1 1 29 29 CYS H H 29 8.964 8.964 8.547 0.417 25844 662 1 11 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.595 -0.310 25844 663 1 11 . 1 1 30 30 ARG H H 30 8.054 8.054 8.042 0.012 25844 664 1 11 . 1 1 31 31 GLY H H 31 8.782 8.782 8.782 0.000 25844 665 1 11 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.560 0.000 25844 666 1 11 . 1 1 32 32 ASN H H 32 7.652 7.652 8.039 -0.387 25844 667 1 11 . 1 1 33 33 GLY H H 33 8.227 8.227 8.253 -0.026 25844 668 1 11 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.703 0.594 25844 669 1 11 . 1 1 34 34 TYR H H 34 7.271 7.271 7.625 -0.354 25844 670 1 11 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.329 0.946 25844 671 1 11 . 1 1 35 35 CYS H H 35 8.829 8.829 7.693 1.136 25844 672 1 12 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.688 -0.127 25844 673 1 12 . 1 1 2 2 CYS H H 2 7.688 7.688 7.969 -0.281 25844 674 1 12 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.711 0.469 25844 675 1 12 . 1 1 3 3 ILE H H 3 8.043 8.043 8.786 -0.743 25844 676 1 12 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.448 -0.046 25844 677 1 12 . 1 1 4 4 LEU H H 4 7.885 7.885 8.306 -0.421 25844 678 1 12 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.732 0.048 25844 679 1 12 . 1 1 5 5 ASN H H 5 8.769 8.769 8.331 0.438 25844 680 1 12 . 1 1 6 6 GLY H H 6 8.723 8.723 7.638 1.085 25844 681 1 12 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.530 -0.430 25844 682 1 12 . 1 1 7 7 ARG H H 7 7.495 7.495 8.689 -1.194 25844 683 1 12 . 1 1 8 8 THR HA H 8 4.232 4.232 3.941 0.291 25844 684 1 12 . 1 1 8 8 THR H H 8 8.352 8.352 8.322 0.030 25844 685 1 12 . 1 1 9 9 ASP H H 9 8.660 8.660 8.603 0.057 25844 686 1 12 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.853 -0.680 25844 687 1 12 . 1 1 10 10 LEU H H 10 7.838 7.838 7.658 0.180 25844 688 1 12 . 1 1 11 11 GLY H H 11 8.206 8.206 8.790 -0.584 25844 689 1 12 . 1 1 12 12 THR HA H 12 4.293 4.293 4.048 0.245 25844 690 1 12 . 1 1 12 12 THR H H 12 8.453 8.453 7.988 0.465 25844 691 1 12 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.134 0.005 25844 692 1 12 . 1 1 13 13 LEU H H 13 7.907 7.907 8.053 -0.146 25844 693 1 12 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.837 0.414 25844 694 1 12 . 1 1 14 14 LEU H H 14 7.702 7.702 7.657 0.045 25844 695 1 12 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.093 -0.199 25844 696 1 12 . 1 1 15 15 PHE H H 15 7.917 7.917 7.875 0.042 25844 697 1 12 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.903 0.531 25844 698 1 12 . 1 1 16 16 ARG H H 16 8.345 8.345 8.903 -0.558 25844 699 1 12 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.441 0.369 25844 700 1 12 . 1 1 17 17 CYS H H 17 8.325 8.325 8.209 0.116 25844 701 1 12 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.026 0.317 25844 702 1 12 . 1 1 18 18 ARG H H 18 9.352 9.352 8.642 0.710 25844 703 1 12 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.374 0.272 25844 704 1 12 . 1 1 19 19 ARG H H 19 8.007 8.007 7.664 0.343 25844 705 1 12 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.345 -0.287 25844 706 1 12 . 1 1 20 20 ASP H H 20 9.164 9.164 8.872 0.292 25844 707 1 12 . 1 1 21 21 SER HA H 21 4.206 4.206 4.139 0.067 25844 708 1 12 . 1 1 21 21 SER H H 21 8.133 8.133 8.275 -0.142 25844 709 1 12 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.409 0.138 25844 710 1 12 . 1 1 22 22 ASP H H 22 7.653 7.653 8.060 -0.407 25844 711 1 12 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.751 -0.227 25844 712 1 12 . 1 1 23 23 CYS H H 23 7.828 7.828 7.737 0.091 25844 713 1 12 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.309 0.093 25844 714 1 12 . 1 1 25 25 GLY H H 25 8.385 8.385 7.756 0.629 25844 715 1 12 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.200 0.085 25844 716 1 12 . 1 1 26 26 ALA H H 26 8.256 8.256 7.905 0.351 25844 717 1 12 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.276 0.206 25844 718 1 12 . 1 1 27 27 CYS H H 27 8.083 8.083 7.782 0.301 25844 719 1 12 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.435 -0.167 25844 720 1 12 . 1 1 28 28 ILE H H 28 8.357 8.357 8.465 -0.108 25844 721 1 12 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.569 0.211 25844 722 1 12 . 1 1 29 29 CYS H H 29 8.964 8.964 8.568 0.396 25844 723 1 12 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.576 -0.291 25844 724 1 12 . 1 1 30 30 ARG H H 30 8.054 8.054 8.293 -0.239 25844 725 1 12 . 1 1 31 31 GLY H H 31 8.782 8.782 8.804 -0.022 25844 726 1 12 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.567 -0.007 25844 727 1 12 . 1 1 32 32 ASN H H 32 7.652 7.652 8.026 -0.374 25844 728 1 12 . 1 1 33 33 GLY H H 33 8.227 8.227 8.190 0.037 25844 729 1 12 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.764 0.533 25844 730 1 12 . 1 1 34 34 TYR H H 34 7.271 7.271 7.636 -0.365 25844 731 1 12 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.506 0.769 25844 732 1 12 . 1 1 35 35 CYS H H 35 8.829 8.829 8.082 0.747 25844 733 1 13 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.758 -0.197 25844 734 1 13 . 1 1 2 2 CYS H H 2 7.688 7.688 8.020 -0.332 25844 735 1 13 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.716 0.464 25844 736 1 13 . 1 1 3 3 ILE H H 3 8.043 8.043 8.394 -0.351 25844 737 1 13 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.974 0.428 25844 738 1 13 . 1 1 4 4 LEU H H 4 7.885 7.885 7.774 0.111 25844 739 1 13 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.767 0.013 25844 740 1 13 . 1 1 5 5 ASN H H 5 8.769 8.769 8.534 0.235 25844 741 1 13 . 1 1 6 6 GLY H H 6 8.723 8.723 7.830 0.893 25844 742 1 13 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.062 0.038 25844 743 1 13 . 1 1 7 7 ARG H H 7 7.495 7.495 8.253 -0.758 25844 744 1 13 . 1 1 8 8 THR HA H 8 4.232 4.232 4.372 -0.140 25844 745 1 13 . 1 1 8 8 THR H H 8 8.352 8.352 8.005 0.347 25844 746 1 13 . 1 1 9 9 ASP H H 9 8.660 8.660 8.617 0.043 25844 747 1 13 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.556 -0.383 25844 748 1 13 . 1 1 10 10 LEU H H 10 7.838 7.838 7.729 0.109 25844 749 1 13 . 1 1 11 11 GLY H H 11 8.206 8.206 8.756 -0.550 25844 750 1 13 . 1 1 12 12 THR HA H 12 4.293 4.293 4.117 0.176 25844 751 1 13 . 1 1 12 12 THR H H 12 8.453 8.453 7.995 0.458 25844 752 1 13 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.305 -0.166 25844 753 1 13 . 1 1 13 13 LEU H H 13 7.907 7.907 8.336 -0.429 25844 754 1 13 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.172 0.079 25844 755 1 13 . 1 1 14 14 LEU H H 14 7.702 7.702 7.795 -0.093 25844 756 1 13 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.012 -0.118 25844 757 1 13 . 1 1 15 15 PHE H H 15 7.917 7.917 7.531 0.386 25844 758 1 13 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.922 0.512 25844 759 1 13 . 1 1 16 16 ARG H H 16 8.345 8.345 9.142 -0.797 25844 760 1 13 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.241 0.569 25844 761 1 13 . 1 1 17 17 CYS H H 17 8.325 8.325 8.298 0.027 25844 762 1 13 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.108 0.235 25844 763 1 13 . 1 1 18 18 ARG H H 18 9.352 9.352 8.595 0.757 25844 764 1 13 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.468 0.178 25844 765 1 13 . 1 1 19 19 ARG H H 19 8.007 8.007 7.787 0.220 25844 766 1 13 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.269 -0.211 25844 767 1 13 . 1 1 20 20 ASP H H 20 9.164 9.164 8.943 0.221 25844 768 1 13 . 1 1 21 21 SER HA H 21 4.206 4.206 4.204 0.002 25844 769 1 13 . 1 1 21 21 SER H H 21 8.133 8.133 8.023 0.110 25844 770 1 13 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.658 -0.111 25844 771 1 13 . 1 1 22 22 ASP H H 22 7.653 7.653 8.092 -0.439 25844 772 1 13 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.905 -0.381 25844 773 1 13 . 1 1 23 23 CYS H H 23 7.828 7.828 7.823 0.005 25844 774 1 13 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.293 0.109 25844 775 1 13 . 1 1 25 25 GLY H H 25 8.385 8.385 7.483 0.902 25844 776 1 13 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.059 0.226 25844 777 1 13 . 1 1 26 26 ALA H H 26 8.256 8.256 8.441 -0.185 25844 778 1 13 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.235 0.247 25844 779 1 13 . 1 1 27 27 CYS H H 27 8.083 8.083 7.648 0.435 25844 780 1 13 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.431 -0.163 25844 781 1 13 . 1 1 28 28 ILE H H 28 8.357 8.357 8.618 -0.261 25844 782 1 13 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.391 0.389 25844 783 1 13 . 1 1 29 29 CYS H H 29 8.964 8.964 8.807 0.157 25844 784 1 13 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.614 -0.329 25844 785 1 13 . 1 1 30 30 ARG H H 30 8.054 8.054 8.217 -0.163 25844 786 1 13 . 1 1 31 31 GLY H H 31 8.782 8.782 8.799 -0.017 25844 787 1 13 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.547 0.013 25844 788 1 13 . 1 1 32 32 ASN H H 32 7.652 7.652 8.049 -0.397 25844 789 1 13 . 1 1 33 33 GLY H H 33 8.227 8.227 8.301 -0.074 25844 790 1 13 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.769 0.528 25844 791 1 13 . 1 1 34 34 TYR H H 34 7.271 7.271 7.633 -0.362 25844 792 1 13 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.300 0.975 25844 793 1 13 . 1 1 35 35 CYS H H 35 8.829 8.829 7.906 0.923 25844 794 1 14 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.969 -0.408 25844 795 1 14 . 1 1 2 2 CYS H H 2 7.688 7.688 8.387 -0.699 25844 796 1 14 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.727 0.453 25844 797 1 14 . 1 1 3 3 ILE H H 3 8.043 8.043 8.229 -0.186 25844 798 1 14 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.001 0.401 25844 799 1 14 . 1 1 4 4 LEU H H 4 7.885 7.885 8.379 -0.494 25844 800 1 14 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.762 0.018 25844 801 1 14 . 1 1 5 5 ASN H H 5 8.769 8.769 7.859 0.910 25844 802 1 14 . 1 1 6 6 GLY H H 6 8.723 8.723 8.582 0.141 25844 803 1 14 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.385 -0.285 25844 804 1 14 . 1 1 7 7 ARG H H 7 7.495 7.495 8.417 -0.922 25844 805 1 14 . 1 1 8 8 THR HA H 8 4.232 4.232 4.067 0.165 25844 806 1 14 . 1 1 8 8 THR H H 8 8.352 8.352 7.970 0.382 25844 807 1 14 . 1 1 9 9 ASP H H 9 8.660 8.660 8.600 0.060 25844 808 1 14 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.568 -0.395 25844 809 1 14 . 1 1 10 10 LEU H H 10 7.838 7.838 7.967 -0.129 25844 810 1 14 . 1 1 11 11 GLY H H 11 8.206 8.206 8.820 -0.614 25844 811 1 14 . 1 1 12 12 THR HA H 12 4.293 4.293 4.101 0.192 25844 812 1 14 . 1 1 12 12 THR H H 12 8.453 8.453 8.013 0.440 25844 813 1 14 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.258 -0.119 25844 814 1 14 . 1 1 13 13 LEU H H 13 7.907 7.907 8.308 -0.401 25844 815 1 14 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.155 0.096 25844 816 1 14 . 1 1 14 14 LEU H H 14 7.702 7.702 7.804 -0.102 25844 817 1 14 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.928 -0.034 25844 818 1 14 . 1 1 15 15 PHE H H 15 7.917 7.917 7.564 0.353 25844 819 1 14 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.926 0.508 25844 820 1 14 . 1 1 16 16 ARG H H 16 8.345 8.345 9.089 -0.744 25844 821 1 14 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.249 0.561 25844 822 1 14 . 1 1 17 17 CYS H H 17 8.325 8.325 8.298 0.027 25844 823 1 14 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.128 0.215 25844 824 1 14 . 1 1 18 18 ARG H H 18 9.352 9.352 8.483 0.869 25844 825 1 14 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.364 0.282 25844 826 1 14 . 1 1 19 19 ARG H H 19 8.007 8.007 7.974 0.033 25844 827 1 14 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.333 -0.275 25844 828 1 14 . 1 1 20 20 ASP H H 20 9.164 9.164 8.844 0.320 25844 829 1 14 . 1 1 21 21 SER HA H 21 4.206 4.206 4.223 -0.017 25844 830 1 14 . 1 1 21 21 SER H H 21 8.133 8.133 8.171 -0.038 25844 831 1 14 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.668 -0.121 25844 832 1 14 . 1 1 22 22 ASP H H 22 7.653 7.653 8.190 -0.537 25844 833 1 14 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.909 -0.385 25844 834 1 14 . 1 1 23 23 CYS H H 23 7.828 7.828 7.899 -0.071 25844 835 1 14 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.348 0.054 25844 836 1 14 . 1 1 25 25 GLY H H 25 8.385 8.385 7.403 0.982 25844 837 1 14 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.132 0.153 25844 838 1 14 . 1 1 26 26 ALA H H 26 8.256 8.256 8.002 0.254 25844 839 1 14 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.442 0.039 25844 840 1 14 . 1 1 27 27 CYS H H 27 8.083 8.083 7.918 0.165 25844 841 1 14 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.479 -0.211 25844 842 1 14 . 1 1 28 28 ILE H H 28 8.357 8.357 7.971 0.386 25844 843 1 14 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.512 0.268 25844 844 1 14 . 1 1 29 29 CYS H H 29 8.964 8.964 8.719 0.245 25844 845 1 14 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.588 -0.303 25844 846 1 14 . 1 1 30 30 ARG H H 30 8.054 8.054 8.042 0.012 25844 847 1 14 . 1 1 31 31 GLY H H 31 8.782 8.782 8.770 0.012 25844 848 1 14 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.553 0.007 25844 849 1 14 . 1 1 32 32 ASN H H 32 7.652 7.652 8.038 -0.386 25844 850 1 14 . 1 1 33 33 GLY H H 33 8.227 8.227 8.279 -0.052 25844 851 1 14 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.749 0.548 25844 852 1 14 . 1 1 34 34 TYR H H 34 7.271 7.271 7.626 -0.355 25844 853 1 14 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.295 0.980 25844 854 1 14 . 1 1 35 35 CYS H H 35 8.829 8.829 7.865 0.964 25844 855 1 15 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.886 -0.325 25844 856 1 15 . 1 1 2 2 CYS H H 2 7.688 7.688 8.176 -0.488 25844 857 1 15 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.792 0.388 25844 858 1 15 . 1 1 3 3 ILE H H 3 8.043 8.043 8.626 -0.583 25844 859 1 15 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.302 0.100 25844 860 1 15 . 1 1 4 4 LEU H H 4 7.885 7.885 7.615 0.270 25844 861 1 15 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.402 0.378 25844 862 1 15 . 1 1 5 5 ASN H H 5 8.769 8.769 8.069 0.700 25844 863 1 15 . 1 1 6 6 GLY H H 6 8.723 8.723 8.663 0.060 25844 864 1 15 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.067 0.033 25844 865 1 15 . 1 1 7 7 ARG H H 7 7.495 7.495 8.272 -0.777 25844 866 1 15 . 1 1 8 8 THR HA H 8 4.232 4.232 3.923 0.309 25844 867 1 15 . 1 1 8 8 THR H H 8 8.352 8.352 8.015 0.337 25844 868 1 15 . 1 1 9 9 ASP H H 9 8.660 8.660 8.425 0.235 25844 869 1 15 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.585 -0.412 25844 870 1 15 . 1 1 10 10 LEU H H 10 7.838 7.838 7.765 0.073 25844 871 1 15 . 1 1 11 11 GLY H H 11 8.206 8.206 8.633 -0.427 25844 872 1 15 . 1 1 12 12 THR HA H 12 4.293 4.293 4.197 0.096 25844 873 1 15 . 1 1 12 12 THR H H 12 8.453 8.453 8.051 0.402 25844 874 1 15 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.260 -0.121 25844 875 1 15 . 1 1 13 13 LEU H H 13 7.907 7.907 8.180 -0.273 25844 876 1 15 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.068 0.183 25844 877 1 15 . 1 1 14 14 LEU H H 14 7.702 7.702 7.460 0.242 25844 878 1 15 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.981 -0.087 25844 879 1 15 . 1 1 15 15 PHE H H 15 7.917 7.917 7.731 0.186 25844 880 1 15 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.910 0.524 25844 881 1 15 . 1 1 16 16 ARG H H 16 8.345 8.345 9.065 -0.720 25844 882 1 15 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.213 0.597 25844 883 1 15 . 1 1 17 17 CYS H H 17 8.325 8.325 8.184 0.141 25844 884 1 15 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.198 0.145 25844 885 1 15 . 1 1 18 18 ARG H H 18 9.352 9.352 8.495 0.857 25844 886 1 15 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.374 0.272 25844 887 1 15 . 1 1 19 19 ARG H H 19 8.007 8.007 7.943 0.064 25844 888 1 15 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.362 -0.304 25844 889 1 15 . 1 1 20 20 ASP H H 20 9.164 9.164 8.841 0.323 25844 890 1 15 . 1 1 21 21 SER HA H 21 4.206 4.206 4.204 0.002 25844 891 1 15 . 1 1 21 21 SER H H 21 8.133 8.133 8.117 0.016 25844 892 1 15 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.677 -0.130 25844 893 1 15 . 1 1 22 22 ASP H H 22 7.653 7.653 8.227 -0.574 25844 894 1 15 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.831 -0.307 25844 895 1 15 . 1 1 23 23 CYS H H 23 7.828 7.828 7.825 0.003 25844 896 1 15 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.393 0.009 25844 897 1 15 . 1 1 25 25 GLY H H 25 8.385 8.385 7.899 0.486 25844 898 1 15 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.029 0.256 25844 899 1 15 . 1 1 26 26 ALA H H 26 8.256 8.256 7.628 0.628 25844 900 1 15 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.413 0.069 25844 901 1 15 . 1 1 27 27 CYS H H 27 8.083 8.083 8.380 -0.297 25844 902 1 15 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.644 -0.376 25844 903 1 15 . 1 1 28 28 ILE H H 28 8.357 8.357 8.258 0.099 25844 904 1 15 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.494 0.286 25844 905 1 15 . 1 1 29 29 CYS H H 29 8.964 8.964 8.691 0.273 25844 906 1 15 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.579 -0.294 25844 907 1 15 . 1 1 30 30 ARG H H 30 8.054 8.054 8.004 0.050 25844 908 1 15 . 1 1 31 31 GLY H H 31 8.782 8.782 8.771 0.011 25844 909 1 15 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.562 -0.002 25844 910 1 15 . 1 1 32 32 ASN H H 32 7.652 7.652 8.043 -0.391 25844 911 1 15 . 1 1 33 33 GLY H H 33 8.227 8.227 8.280 -0.053 25844 912 1 15 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.744 0.553 25844 913 1 15 . 1 1 34 34 TYR H H 34 7.271 7.271 7.641 -0.370 25844 914 1 15 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.393 0.882 25844 915 1 15 . 1 1 35 35 CYS H H 35 8.829 8.829 7.873 0.956 25844 916 1 16 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.712 -0.151 25844 917 1 16 . 1 1 2 2 CYS H H 2 7.688 7.688 8.753 -1.065 25844 918 1 16 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.694 0.486 25844 919 1 16 . 1 1 3 3 ILE H H 3 8.043 8.043 8.087 -0.044 25844 920 1 16 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.968 0.434 25844 921 1 16 . 1 1 4 4 LEU H H 4 7.885 7.885 8.328 -0.443 25844 922 1 16 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.806 -0.026 25844 923 1 16 . 1 1 5 5 ASN H H 5 8.769 8.769 7.744 1.025 25844 924 1 16 . 1 1 6 6 GLY H H 6 8.723 8.723 8.697 0.026 25844 925 1 16 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.384 -0.284 25844 926 1 16 . 1 1 7 7 ARG H H 7 7.495 7.495 7.960 -0.465 25844 927 1 16 . 1 1 8 8 THR HA H 8 4.232 4.232 4.051 0.181 25844 928 1 16 . 1 1 8 8 THR H H 8 8.352 8.352 8.022 0.330 25844 929 1 16 . 1 1 9 9 ASP H H 9 8.660 8.660 8.483 0.177 25844 930 1 16 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.686 -0.513 25844 931 1 16 . 1 1 10 10 LEU H H 10 7.838 7.838 7.752 0.086 25844 932 1 16 . 1 1 11 11 GLY H H 11 8.206 8.206 8.629 -0.423 25844 933 1 16 . 1 1 12 12 THR HA H 12 4.293 4.293 4.114 0.179 25844 934 1 16 . 1 1 12 12 THR H H 12 8.453 8.453 8.023 0.430 25844 935 1 16 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.158 -0.019 25844 936 1 16 . 1 1 13 13 LEU H H 13 7.907 7.907 8.088 -0.181 25844 937 1 16 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.999 0.252 25844 938 1 16 . 1 1 14 14 LEU H H 14 7.702 7.702 7.644 0.058 25844 939 1 16 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.878 0.016 25844 940 1 16 . 1 1 15 15 PHE H H 15 7.917 7.917 7.780 0.137 25844 941 1 16 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.958 0.476 25844 942 1 16 . 1 1 16 16 ARG H H 16 8.345 8.345 9.232 -0.887 25844 943 1 16 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.242 0.569 25844 944 1 16 . 1 1 17 17 CYS H H 17 8.325 8.325 8.251 0.074 25844 945 1 16 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.048 0.295 25844 946 1 16 . 1 1 18 18 ARG H H 18 9.352 9.352 8.772 0.580 25844 947 1 16 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.345 0.301 25844 948 1 16 . 1 1 19 19 ARG H H 19 8.007 8.007 7.969 0.038 25844 949 1 16 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.360 -0.302 25844 950 1 16 . 1 1 20 20 ASP H H 20 9.164 9.164 8.824 0.340 25844 951 1 16 . 1 1 21 21 SER HA H 21 4.206 4.206 4.178 0.028 25844 952 1 16 . 1 1 21 21 SER H H 21 8.133 8.133 8.218 -0.085 25844 953 1 16 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.447 0.100 25844 954 1 16 . 1 1 22 22 ASP H H 22 7.653 7.653 8.299 -0.646 25844 955 1 16 . 1 1 23 23 CYS HA H 23 4.524 4.524 5.172 -0.648 25844 956 1 16 . 1 1 23 23 CYS H H 23 7.828 7.828 7.693 0.135 25844 957 1 16 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.329 0.073 25844 958 1 16 . 1 1 25 25 GLY H H 25 8.385 8.385 7.780 0.605 25844 959 1 16 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.246 0.039 25844 960 1 16 . 1 1 26 26 ALA H H 26 8.256 8.256 8.146 0.110 25844 961 1 16 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.537 -0.055 25844 962 1 16 . 1 1 27 27 CYS H H 27 8.083 8.083 7.893 0.190 25844 963 1 16 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.403 -0.135 25844 964 1 16 . 1 1 28 28 ILE H H 28 8.357 8.357 8.372 -0.015 25844 965 1 16 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.574 0.206 25844 966 1 16 . 1 1 29 29 CYS H H 29 8.964 8.964 8.657 0.307 25844 967 1 16 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.621 -0.336 25844 968 1 16 . 1 1 30 30 ARG H H 30 8.054 8.054 8.006 0.048 25844 969 1 16 . 1 1 31 31 GLY H H 31 8.782 8.782 8.745 0.037 25844 970 1 16 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.561 -0.001 25844 971 1 16 . 1 1 32 32 ASN H H 32 7.652 7.652 7.998 -0.346 25844 972 1 16 . 1 1 33 33 GLY H H 33 8.227 8.227 8.059 0.168 25844 973 1 16 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.815 0.482 25844 974 1 16 . 1 1 34 34 TYR H H 34 7.271 7.271 7.606 -0.335 25844 975 1 16 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.422 0.853 25844 976 1 16 . 1 1 35 35 CYS H H 35 8.829 8.829 7.954 0.875 25844 977 1 17 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.930 -0.369 25844 978 1 17 . 1 1 2 2 CYS H H 2 7.688 7.688 8.250 -0.562 25844 979 1 17 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.682 0.498 25844 980 1 17 . 1 1 3 3 ILE H H 3 8.043 8.043 8.161 -0.118 25844 981 1 17 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.441 -0.039 25844 982 1 17 . 1 1 4 4 LEU H H 4 7.885 7.885 7.619 0.266 25844 983 1 17 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.551 0.229 25844 984 1 17 . 1 1 5 5 ASN H H 5 8.769 8.769 8.180 0.589 25844 985 1 17 . 1 1 6 6 GLY H H 6 8.723 8.723 8.740 -0.017 25844 986 1 17 . 1 1 7 7 ARG HA H 7 4.100 4.100 3.849 0.251 25844 987 1 17 . 1 1 7 7 ARG H H 7 7.495 7.495 8.157 -0.662 25844 988 1 17 . 1 1 8 8 THR HA H 8 4.232 4.232 4.201 0.031 25844 989 1 17 . 1 1 8 8 THR H H 8 8.352 8.352 8.256 0.096 25844 990 1 17 . 1 1 9 9 ASP H H 9 8.660 8.660 8.617 0.043 25844 991 1 17 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.538 -0.365 25844 992 1 17 . 1 1 10 10 LEU H H 10 7.838 7.838 7.851 -0.013 25844 993 1 17 . 1 1 11 11 GLY H H 11 8.206 8.206 8.839 -0.633 25844 994 1 17 . 1 1 12 12 THR HA H 12 4.293 4.293 4.054 0.239 25844 995 1 17 . 1 1 12 12 THR H H 12 8.453 8.453 8.049 0.404 25844 996 1 17 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.242 -0.103 25844 997 1 17 . 1 1 13 13 LEU H H 13 7.907 7.907 8.106 -0.199 25844 998 1 17 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.085 0.166 25844 999 1 17 . 1 1 14 14 LEU H H 14 7.702 7.702 7.935 -0.233 25844 1000 1 17 . 1 1 15 15 PHE HA H 15 4.894 4.894 4.926 -0.032 25844 1001 1 17 . 1 1 15 15 PHE H H 15 7.917 7.917 7.708 0.209 25844 1002 1 17 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.921 0.513 25844 1003 1 17 . 1 1 16 16 ARG H H 16 8.345 8.345 9.049 -0.704 25844 1004 1 17 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.345 0.465 25844 1005 1 17 . 1 1 17 17 CYS H H 17 8.325 8.325 8.228 0.097 25844 1006 1 17 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.058 0.285 25844 1007 1 17 . 1 1 18 18 ARG H H 18 9.352 9.352 8.580 0.772 25844 1008 1 17 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.363 0.283 25844 1009 1 17 . 1 1 19 19 ARG H H 19 8.007 8.007 7.871 0.136 25844 1010 1 17 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.242 -0.184 25844 1011 1 17 . 1 1 20 20 ASP H H 20 9.164 9.164 8.865 0.299 25844 1012 1 17 . 1 1 21 21 SER HA H 21 4.206 4.206 4.095 0.111 25844 1013 1 17 . 1 1 21 21 SER H H 21 8.133 8.133 7.937 0.196 25844 1014 1 17 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.501 0.046 25844 1015 1 17 . 1 1 22 22 ASP H H 22 7.653 7.653 8.256 -0.603 25844 1016 1 17 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.774 -0.250 25844 1017 1 17 . 1 1 23 23 CYS H H 23 7.828 7.828 7.852 -0.024 25844 1018 1 17 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.396 0.006 25844 1019 1 17 . 1 1 25 25 GLY H H 25 8.385 8.385 8.090 0.295 25844 1020 1 17 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.096 0.189 25844 1021 1 17 . 1 1 26 26 ALA H H 26 8.256 8.256 8.253 0.003 25844 1022 1 17 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.379 0.103 25844 1023 1 17 . 1 1 27 27 CYS H H 27 8.083 8.083 7.826 0.257 25844 1024 1 17 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.426 -0.158 25844 1025 1 17 . 1 1 28 28 ILE H H 28 8.357 8.357 8.536 -0.179 25844 1026 1 17 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.504 0.276 25844 1027 1 17 . 1 1 29 29 CYS H H 29 8.964 8.964 8.629 0.335 25844 1028 1 17 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.605 -0.320 25844 1029 1 17 . 1 1 30 30 ARG H H 30 8.054 8.054 8.191 -0.137 25844 1030 1 17 . 1 1 31 31 GLY H H 31 8.782 8.782 8.800 -0.018 25844 1031 1 17 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.549 0.011 25844 1032 1 17 . 1 1 32 32 ASN H H 32 7.652 7.652 8.046 -0.394 25844 1033 1 17 . 1 1 33 33 GLY H H 33 8.227 8.227 8.237 -0.010 25844 1034 1 17 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.722 0.575 25844 1035 1 17 . 1 1 34 34 TYR H H 34 7.271 7.271 7.608 -0.337 25844 1036 1 17 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.376 0.899 25844 1037 1 17 . 1 1 35 35 CYS H H 35 8.829 8.829 7.738 1.091 25844 1038 1 18 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.679 -0.118 25844 1039 1 18 . 1 1 2 2 CYS H H 2 7.688 7.688 8.157 -0.469 25844 1040 1 18 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.802 0.378 25844 1041 1 18 . 1 1 3 3 ILE H H 3 8.043 8.043 8.255 -0.212 25844 1042 1 18 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.485 -0.083 25844 1043 1 18 . 1 1 4 4 LEU H H 4 7.885 7.885 8.726 -0.841 25844 1044 1 18 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.730 0.050 25844 1045 1 18 . 1 1 5 5 ASN H H 5 8.769 8.769 8.072 0.697 25844 1046 1 18 . 1 1 6 6 GLY H H 6 8.723 8.723 7.758 0.965 25844 1047 1 18 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.619 -0.519 25844 1048 1 18 . 1 1 7 7 ARG H H 7 7.495 7.495 8.637 -1.142 25844 1049 1 18 . 1 1 8 8 THR HA H 8 4.232 4.232 4.266 -0.034 25844 1050 1 18 . 1 1 8 8 THR H H 8 8.352 8.352 8.108 0.244 25844 1051 1 18 . 1 1 9 9 ASP H H 9 8.660 8.660 8.542 0.118 25844 1052 1 18 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.685 -0.512 25844 1053 1 18 . 1 1 10 10 LEU H H 10 7.838 7.838 7.662 0.176 25844 1054 1 18 . 1 1 11 11 GLY H H 11 8.206 8.206 8.648 -0.442 25844 1055 1 18 . 1 1 12 12 THR HA H 12 4.293 4.293 4.107 0.186 25844 1056 1 18 . 1 1 12 12 THR H H 12 8.453 8.453 8.126 0.327 25844 1057 1 18 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.229 -0.090 25844 1058 1 18 . 1 1 13 13 LEU H H 13 7.907 7.907 8.097 -0.190 25844 1059 1 18 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.848 0.403 25844 1060 1 18 . 1 1 14 14 LEU H H 14 7.702 7.702 7.374 0.328 25844 1061 1 18 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.088 -0.194 25844 1062 1 18 . 1 1 15 15 PHE H H 15 7.917 7.917 7.620 0.297 25844 1063 1 18 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.891 0.543 25844 1064 1 18 . 1 1 16 16 ARG H H 16 8.345 8.345 8.979 -0.634 25844 1065 1 18 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.314 0.496 25844 1066 1 18 . 1 1 17 17 CYS H H 17 8.325 8.325 8.281 0.044 25844 1067 1 18 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.080 0.263 25844 1068 1 18 . 1 1 18 18 ARG H H 18 9.352 9.352 8.415 0.937 25844 1069 1 18 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.413 0.233 25844 1070 1 18 . 1 1 19 19 ARG H H 19 8.007 8.007 8.183 -0.176 25844 1071 1 18 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.369 -0.311 25844 1072 1 18 . 1 1 20 20 ASP H H 20 9.164 9.164 8.863 0.301 25844 1073 1 18 . 1 1 21 21 SER HA H 21 4.206 4.206 4.110 0.096 25844 1074 1 18 . 1 1 21 21 SER H H 21 8.133 8.133 8.140 -0.007 25844 1075 1 18 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.427 0.120 25844 1076 1 18 . 1 1 22 22 ASP H H 22 7.653 7.653 8.165 -0.512 25844 1077 1 18 . 1 1 23 23 CYS HA H 23 4.524 4.524 5.195 -0.671 25844 1078 1 18 . 1 1 23 23 CYS H H 23 7.828 7.828 7.806 0.022 25844 1079 1 18 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.299 0.103 25844 1080 1 18 . 1 1 25 25 GLY H H 25 8.385 8.385 7.900 0.485 25844 1081 1 18 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.114 0.171 25844 1082 1 18 . 1 1 26 26 ALA H H 26 8.256 8.256 8.256 0.000 25844 1083 1 18 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.301 0.181 25844 1084 1 18 . 1 1 27 27 CYS H H 27 8.083 8.083 8.268 -0.185 25844 1085 1 18 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.429 -0.161 25844 1086 1 18 . 1 1 28 28 ILE H H 28 8.357 8.357 8.296 0.062 25844 1087 1 18 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.488 0.292 25844 1088 1 18 . 1 1 29 29 CYS H H 29 8.964 8.964 8.561 0.403 25844 1089 1 18 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.645 -0.360 25844 1090 1 18 . 1 1 30 30 ARG H H 30 8.054 8.054 8.071 -0.017 25844 1091 1 18 . 1 1 31 31 GLY H H 31 8.782 8.782 8.774 0.008 25844 1092 1 18 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.560 -0.000 25844 1093 1 18 . 1 1 32 32 ASN H H 32 7.652 7.652 8.038 -0.386 25844 1094 1 18 . 1 1 33 33 GLY H H 33 8.227 8.227 8.247 -0.020 25844 1095 1 18 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.744 0.553 25844 1096 1 18 . 1 1 34 34 TYR H H 34 7.271 7.271 7.638 -0.367 25844 1097 1 18 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.409 0.866 25844 1098 1 18 . 1 1 35 35 CYS H H 35 8.829 8.829 7.927 0.902 25844 1099 1 19 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.986 -0.425 25844 1100 1 19 . 1 1 2 2 CYS H H 2 7.688 7.688 8.616 -0.928 25844 1101 1 19 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.748 0.432 25844 1102 1 19 . 1 1 3 3 ILE H H 3 8.043 8.043 8.505 -0.462 25844 1103 1 19 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.316 0.086 25844 1104 1 19 . 1 1 4 4 LEU H H 4 7.885 7.885 7.540 0.345 25844 1105 1 19 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.406 0.374 25844 1106 1 19 . 1 1 5 5 ASN H H 5 8.769 8.769 8.494 0.275 25844 1107 1 19 . 1 1 6 6 GLY H H 6 8.723 8.723 8.739 -0.016 25844 1108 1 19 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.364 -0.264 25844 1109 1 19 . 1 1 7 7 ARG H H 7 7.495 7.495 7.899 -0.404 25844 1110 1 19 . 1 1 8 8 THR HA H 8 4.232 4.232 4.117 0.115 25844 1111 1 19 . 1 1 8 8 THR H H 8 8.352 8.352 8.327 0.025 25844 1112 1 19 . 1 1 9 9 ASP H H 9 8.660 8.660 8.465 0.195 25844 1113 1 19 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.805 -0.632 25844 1114 1 19 . 1 1 10 10 LEU H H 10 7.838 7.838 7.757 0.081 25844 1115 1 19 . 1 1 11 11 GLY H H 11 8.206 8.206 8.765 -0.559 25844 1116 1 19 . 1 1 12 12 THR HA H 12 4.293 4.293 4.121 0.172 25844 1117 1 19 . 1 1 12 12 THR H H 12 8.453 8.453 7.938 0.515 25844 1118 1 19 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.146 -0.007 25844 1119 1 19 . 1 1 13 13 LEU H H 13 7.907 7.907 8.076 -0.169 25844 1120 1 19 . 1 1 14 14 LEU HA H 14 4.251 4.251 4.140 0.111 25844 1121 1 19 . 1 1 14 14 LEU H H 14 7.702 7.702 7.622 0.080 25844 1122 1 19 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.016 -0.122 25844 1123 1 19 . 1 1 15 15 PHE H H 15 7.917 7.917 7.701 0.216 25844 1124 1 19 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.892 0.542 25844 1125 1 19 . 1 1 16 16 ARG H H 16 8.345 8.345 9.077 -0.732 25844 1126 1 19 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.222 0.588 25844 1127 1 19 . 1 1 17 17 CYS H H 17 8.325 8.325 8.340 -0.015 25844 1128 1 19 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.148 0.195 25844 1129 1 19 . 1 1 18 18 ARG H H 18 9.352 9.352 8.513 0.839 25844 1130 1 19 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.349 0.297 25844 1131 1 19 . 1 1 19 19 ARG H H 19 8.007 8.007 7.842 0.165 25844 1132 1 19 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.295 -0.237 25844 1133 1 19 . 1 1 20 20 ASP H H 20 9.164 9.164 8.871 0.293 25844 1134 1 19 . 1 1 21 21 SER HA H 21 4.206 4.206 4.148 0.058 25844 1135 1 19 . 1 1 21 21 SER H H 21 8.133 8.133 8.000 0.133 25844 1136 1 19 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.586 -0.039 25844 1137 1 19 . 1 1 22 22 ASP H H 22 7.653 7.653 8.130 -0.477 25844 1138 1 19 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.585 -0.061 25844 1139 1 19 . 1 1 23 23 CYS H H 23 7.828 7.828 7.794 0.034 25844 1140 1 19 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.225 0.177 25844 1141 1 19 . 1 1 25 25 GLY H H 25 8.385 8.385 7.429 0.956 25844 1142 1 19 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.043 0.241 25844 1143 1 19 . 1 1 26 26 ALA H H 26 8.256 8.256 8.037 0.219 25844 1144 1 19 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.239 0.243 25844 1145 1 19 . 1 1 27 27 CYS H H 27 8.083 8.083 8.338 -0.255 25844 1146 1 19 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.794 -0.526 25844 1147 1 19 . 1 1 28 28 ILE H H 28 8.357 8.357 8.198 0.159 25844 1148 1 19 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.498 0.282 25844 1149 1 19 . 1 1 29 29 CYS H H 29 8.964 8.964 8.696 0.268 25844 1150 1 19 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.584 -0.299 25844 1151 1 19 . 1 1 30 30 ARG H H 30 8.054 8.054 8.050 0.004 25844 1152 1 19 . 1 1 31 31 GLY H H 31 8.782 8.782 8.769 0.013 25844 1153 1 19 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.551 0.009 25844 1154 1 19 . 1 1 32 32 ASN H H 32 7.652 7.652 8.037 -0.385 25844 1155 1 19 . 1 1 33 33 GLY H H 33 8.227 8.227 8.252 -0.025 25844 1156 1 19 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.743 0.554 25844 1157 1 19 . 1 1 34 34 TYR H H 34 7.271 7.271 7.621 -0.350 25844 1158 1 19 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.317 0.958 25844 1159 1 19 . 1 1 35 35 CYS H H 35 8.829 8.829 7.882 0.947 25844 1160 1 20 . 1 1 2 2 CYS HA H 2 4.561 4.561 4.790 -0.229 25844 1161 1 20 . 1 1 2 2 CYS H H 2 7.688 7.688 8.910 -1.222 25844 1162 1 20 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.717 0.463 25844 1163 1 20 . 1 1 3 3 ILE H H 3 8.043 8.043 8.132 -0.089 25844 1164 1 20 . 1 1 4 4 LEU HA H 4 4.402 4.402 3.988 0.414 25844 1165 1 20 . 1 1 4 4 LEU H H 4 7.885 7.885 8.353 -0.468 25844 1166 1 20 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.465 0.315 25844 1167 1 20 . 1 1 5 5 ASN H H 5 8.769 8.769 8.675 0.094 25844 1168 1 20 . 1 1 6 6 GLY H H 6 8.723 8.723 8.630 0.093 25844 1169 1 20 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.358 -0.258 25844 1170 1 20 . 1 1 7 7 ARG H H 7 7.495 7.495 7.500 -0.005 25844 1171 1 20 . 1 1 8 8 THR HA H 8 4.232 4.232 4.136 0.096 25844 1172 1 20 . 1 1 8 8 THR H H 8 8.352 8.352 7.615 0.737 25844 1173 1 20 . 1 1 9 9 ASP H H 9 8.660 8.660 8.491 0.169 25844 1174 1 20 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.586 -0.413 25844 1175 1 20 . 1 1 10 10 LEU H H 10 7.838 7.838 7.750 0.088 25844 1176 1 20 . 1 1 11 11 GLY H H 11 8.206 8.206 8.637 -0.431 25844 1177 1 20 . 1 1 12 12 THR HA H 12 4.293 4.293 4.152 0.141 25844 1178 1 20 . 1 1 12 12 THR H H 12 8.453 8.453 8.162 0.291 25844 1179 1 20 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.192 -0.053 25844 1180 1 20 . 1 1 13 13 LEU H H 13 7.907 7.907 8.042 -0.135 25844 1181 1 20 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.898 0.353 25844 1182 1 20 . 1 1 14 14 LEU H H 14 7.702 7.702 7.535 0.167 25844 1183 1 20 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.043 -0.149 25844 1184 1 20 . 1 1 15 15 PHE H H 15 7.917 7.917 7.712 0.205 25844 1185 1 20 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.906 0.528 25844 1186 1 20 . 1 1 16 16 ARG H H 16 8.345 8.345 8.948 -0.603 25844 1187 1 20 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.273 0.537 25844 1188 1 20 . 1 1 17 17 CYS H H 17 8.325 8.325 8.237 0.088 25844 1189 1 20 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.016 0.327 25844 1190 1 20 . 1 1 18 18 ARG H H 18 9.352 9.352 8.427 0.925 25844 1191 1 20 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.334 0.312 25844 1192 1 20 . 1 1 19 19 ARG H H 19 8.007 8.007 8.065 -0.058 25844 1193 1 20 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.306 -0.248 25844 1194 1 20 . 1 1 20 20 ASP H H 20 9.164 9.164 8.841 0.323 25844 1195 1 20 . 1 1 21 21 SER HA H 21 4.206 4.206 4.192 0.014 25844 1196 1 20 . 1 1 21 21 SER H H 21 8.133 8.133 8.294 -0.161 25844 1197 1 20 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.581 -0.034 25844 1198 1 20 . 1 1 22 22 ASP H H 22 7.653 7.653 8.132 -0.479 25844 1199 1 20 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.770 -0.246 25844 1200 1 20 . 1 1 23 23 CYS H H 23 7.828 7.828 7.838 -0.010 25844 1201 1 20 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.316 0.086 25844 1202 1 20 . 1 1 25 25 GLY H H 25 8.385 8.385 7.512 0.873 25844 1203 1 20 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.089 0.196 25844 1204 1 20 . 1 1 26 26 ALA H H 26 8.256 8.256 8.231 0.025 25844 1205 1 20 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.196 0.286 25844 1206 1 20 . 1 1 27 27 CYS H H 27 8.083 8.083 7.793 0.290 25844 1207 1 20 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.434 -0.166 25844 1208 1 20 . 1 1 28 28 ILE H H 28 8.357 8.357 8.306 0.051 25844 1209 1 20 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.488 0.292 25844 1210 1 20 . 1 1 29 29 CYS H H 29 8.964 8.964 8.423 0.541 25844 1211 1 20 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.630 -0.345 25844 1212 1 20 . 1 1 30 30 ARG H H 30 8.054 8.054 8.032 0.022 25844 1213 1 20 . 1 1 31 31 GLY H H 31 8.782 8.782 8.781 0.001 25844 1214 1 20 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.555 0.005 25844 1215 1 20 . 1 1 32 32 ASN H H 32 7.652 7.652 8.035 -0.383 25844 1216 1 20 . 1 1 33 33 GLY H H 33 8.227 8.227 8.253 -0.026 25844 1217 1 20 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.717 0.580 25844 1218 1 20 . 1 1 34 34 TYR H H 34 7.271 7.271 7.615 -0.344 25844 1219 1 20 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.355 0.920 25844 1220 1 20 . 1 1 35 35 CYS H H 35 8.829 8.829 7.739 1.090 25844 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 25844 2 1 1 "Average Difference" HA 28 0.358 -0.043 0.362 25844 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25844 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25844 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25844 6 1 1 "Average Difference" HN 33 0.444 -0.040 0.449 25844 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25844 8 1 2 "Average Difference" HA 28 0.327 -0.110 0.314 25844 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25844 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25844 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25844 12 1 2 "Average Difference" HN 33 0.453 -0.016 0.460 25844 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25844 14 1 3 "Average Difference" HA 28 0.322 -0.110 0.308 25844 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25844 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25844 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25844 18 1 3 "Average Difference" HN 33 0.419 -0.038 0.424 25844 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25844 20 1 4 "Average Difference" HA 28 0.301 -0.093 0.292 25844 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25844 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25844 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25844 24 1 4 "Average Difference" HN 33 0.378 -0.028 0.383 25844 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25844 26 1 5 "Average Difference" HA 28 0.315 -0.052 0.316 25844 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25844 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25844 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25844 30 1 5 "Average Difference" HN 33 0.411 -0.103 0.404 25844 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25844 32 1 6 "Average Difference" HA 28 0.342 -0.107 0.331 25844 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25844 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25844 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25844 36 1 6 "Average Difference" HN 33 0.463 -0.002 0.470 25844 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25844 38 1 7 "Average Difference" HA 28 0.326 -0.099 0.316 25844 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25844 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25844 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25844 42 1 7 "Average Difference" HN 33 0.451 -0.005 0.458 25844 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25844 44 1 8 "Average Difference" HA 28 0.399 -0.064 0.401 25844 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25844 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25844 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25844 48 1 8 "Average Difference" HN 33 0.402 -0.053 0.404 25844 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25844 50 1 9 "Average Difference" HA 28 0.337 -0.135 0.315 25844 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25844 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25844 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25844 54 1 9 "Average Difference" HN 33 0.422 -0.023 0.428 25844 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25844 56 1 10 "Average Difference" HA 28 0.367 -0.076 0.365 25844 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25844 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25844 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25844 60 1 10 "Average Difference" HN 33 0.464 0.008 0.471 25844 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25844 62 1 11 "Average Difference" HA 28 0.345 -0.047 0.348 25844 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25844 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25844 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25844 66 1 11 "Average Difference" HN 33 0.464 -0.047 0.469 25844 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25844 68 1 12 "Average Difference" HA 28 0.332 -0.093 0.324 25844 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25844 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25844 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25844 72 1 12 "Average Difference" HN 33 0.464 -0.023 0.471 25844 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25844 74 1 13 "Average Difference" HA 28 0.338 -0.106 0.327 25844 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25844 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25844 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25844 78 1 13 "Average Difference" HN 33 0.443 -0.034 0.449 25844 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25844 80 1 14 "Average Difference" HA 28 0.343 -0.085 0.338 25844 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25844 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25844 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25844 84 1 14 "Average Difference" HN 33 0.482 -0.025 0.489 25844 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25844 86 1 15 "Average Difference" HA 28 0.335 -0.097 0.326 25844 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25844 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25844 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25844 90 1 15 "Average Difference" HN 33 0.432 -0.044 0.436 25844 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25844 92 1 16 "Average Difference" HA 28 0.344 -0.089 0.338 25844 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25844 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25844 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25844 96 1 16 "Average Difference" HN 33 0.440 -0.025 0.446 25844 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25844 98 1 17 "Average Difference" HA 28 0.320 -0.120 0.302 25844 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25844 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25844 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25844 102 1 17 "Average Difference" HN 33 0.400 -0.007 0.406 25844 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25844 104 1 18 "Average Difference" HA 28 0.356 -0.067 0.356 25844 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25844 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25844 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25844 108 1 18 "Average Difference" HN 33 0.478 -0.022 0.485 25844 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25844 110 1 19 "Average Difference" HA 28 0.364 -0.101 0.356 25844 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25844 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25844 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25844 114 1 19 "Average Difference" HN 33 0.427 -0.030 0.433 25844 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25844 116 1 20 "Average Difference" HA 28 0.348 -0.133 0.328 25844 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25844 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25844 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25844 120 1 20 "Average Difference" HN 33 0.456 -0.050 0.460 25844 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 25844 _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 CYS HA H 2 4.561 4.561 4.886 -0.325 25844 2 1 . 1 1 2 2 CYS H H 2 7.688 7.688 8.302 -0.614 25844 3 1 . 1 1 3 3 ILE HA H 3 4.180 4.180 3.857 0.323 25844 4 1 . 1 1 3 3 ILE H H 3 8.043 8.043 8.373 -0.330 25844 5 1 . 1 1 4 4 LEU HA H 4 4.402 4.402 4.275 0.127 25844 6 1 . 1 1 4 4 LEU H H 4 7.885 7.885 8.197 -0.312 25844 7 1 . 1 1 5 5 ASN HA H 5 4.780 4.780 4.660 0.120 25844 8 1 . 1 1 5 5 ASN H H 5 8.769 8.769 8.206 0.563 25844 9 1 . 1 1 6 6 GLY H H 6 8.723 8.723 8.338 0.385 25844 10 1 . 1 1 7 7 ARG HA H 7 4.100 4.100 4.287 -0.187 25844 11 1 . 1 1 7 7 ARG H H 7 7.495 7.495 8.210 -0.715 25844 12 1 . 1 1 8 8 THR HA H 8 4.232 4.232 4.129 0.103 25844 13 1 . 1 1 8 8 THR H H 8 8.352 8.352 7.962 0.391 25844 14 1 . 1 1 9 9 ASP H H 9 8.660 8.660 8.560 0.100 25844 15 1 . 1 1 10 10 LEU HA H 10 4.173 4.173 4.622 -0.449 25844 16 1 . 1 1 10 10 LEU H H 10 7.838 7.838 7.761 0.077 25844 17 1 . 1 1 11 11 GLY H H 11 8.206 8.206 8.672 -0.466 25844 18 1 . 1 1 12 12 THR HA H 12 4.293 4.293 4.134 0.159 25844 19 1 . 1 1 12 12 THR H H 12 8.453 8.453 8.039 0.414 25844 20 1 . 1 1 13 13 LEU HA H 13 4.139 4.139 4.249 -0.110 25844 21 1 . 1 1 13 13 LEU H H 13 7.907 7.907 8.087 -0.180 25844 22 1 . 1 1 14 14 LEU HA H 14 4.251 4.251 3.970 0.281 25844 23 1 . 1 1 14 14 LEU H H 14 7.702 7.702 7.589 0.113 25844 24 1 . 1 1 15 15 PHE HA H 15 4.894 4.894 5.003 -0.109 25844 25 1 . 1 1 15 15 PHE H H 15 7.917 7.917 7.647 0.270 25844 26 1 . 1 1 16 16 ARG HA H 16 4.434 4.434 3.899 0.535 25844 27 1 . 1 1 16 16 ARG H H 16 8.345 8.345 8.999 -0.654 25844 28 1 . 1 1 17 17 CYS HA H 17 4.810 4.810 4.296 0.514 25844 29 1 . 1 1 17 17 CYS H H 17 8.325 8.325 8.255 0.070 25844 30 1 . 1 1 18 18 ARG HA H 18 4.343 4.343 4.067 0.276 25844 31 1 . 1 1 18 18 ARG H H 18 9.352 9.352 8.601 0.751 25844 32 1 . 1 1 19 19 ARG HA H 19 4.646 4.646 4.381 0.265 25844 33 1 . 1 1 19 19 ARG H H 19 8.007 8.007 7.930 0.077 25844 34 1 . 1 1 20 20 ASP HA H 20 4.058 4.058 4.322 -0.264 25844 35 1 . 1 1 20 20 ASP H H 20 9.164 9.164 8.863 0.301 25844 36 1 . 1 1 21 21 SER HA H 21 4.206 4.206 4.156 0.050 25844 37 1 . 1 1 21 21 SER H H 21 8.133 8.133 8.128 0.005 25844 38 1 . 1 1 22 22 ASP HA H 22 4.547 4.547 4.526 0.021 25844 39 1 . 1 1 22 22 ASP H H 22 7.653 7.653 8.153 -0.500 25844 40 1 . 1 1 23 23 CYS HA H 23 4.524 4.524 4.873 -0.349 25844 41 1 . 1 1 23 23 CYS H H 23 7.828 7.828 7.836 -0.008 25844 42 1 . 1 1 24 24 PRO HA H 24 4.402 4.402 4.325 0.077 25844 43 1 . 1 1 25 25 GLY H H 25 8.385 8.385 7.731 0.654 25844 44 1 . 1 1 26 26 ALA HA H 26 4.285 4.285 4.107 0.178 25844 45 1 . 1 1 26 26 ALA H H 26 8.256 8.256 8.209 0.047 25844 46 1 . 1 1 27 27 CYS HA H 27 4.482 4.482 4.342 0.140 25844 47 1 . 1 1 27 27 CYS H H 27 8.083 8.083 8.031 0.052 25844 48 1 . 1 1 28 28 ILE HA H 28 4.268 4.268 4.479 -0.211 25844 49 1 . 1 1 28 28 ILE H H 28 8.357 8.357 8.333 0.024 25844 50 1 . 1 1 29 29 CYS HA H 29 4.780 4.780 4.506 0.274 25844 51 1 . 1 1 29 29 CYS H H 29 8.964 8.964 8.640 0.324 25844 52 1 . 1 1 30 30 ARG HA H 30 4.285 4.285 4.610 -0.325 25844 53 1 . 1 1 30 30 ARG H H 30 8.054 8.054 8.111 -0.057 25844 54 1 . 1 1 31 31 GLY H H 31 8.782 8.782 8.783 -0.001 25844 55 1 . 1 1 32 32 ASN HA H 32 4.560 4.560 4.556 0.004 25844 56 1 . 1 1 32 32 ASN H H 32 7.652 7.652 8.031 -0.379 25844 57 1 . 1 1 33 33 GLY H H 33 8.227 8.227 8.226 0.001 25844 58 1 . 1 1 34 34 TYR HA H 34 5.297 5.297 4.736 0.561 25844 59 1 . 1 1 34 34 TYR H H 34 7.271 7.271 7.616 -0.345 25844 60 1 . 1 1 35 35 CYS HA H 35 5.275 5.275 4.395 0.880 25844 61 1 . 1 1 35 35 CYS H H 35 8.829 8.829 7.883 0.946 25844 stop_ save_