data_19524 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19524 _Entry.PDB_ID 2MEL 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 19524 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 ALA HA H 2 4.398 4.398 3.948 0.450 19524 2 1 1 . 1 1 2 2 ALA H H 2 8.375 8.375 8.433 -0.058 19524 3 1 1 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.276 0.412 19524 4 1 1 . 1 1 3 3 PHE H H 3 8.033 8.033 7.451 0.582 19524 5 1 1 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.661 -0.246 19524 6 1 1 . 1 1 4 4 CYS H H 4 8.130 8.130 7.848 0.282 19524 7 1 1 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.787 0.038 19524 8 1 1 . 1 1 5 5 ASN H H 5 8.745 8.745 9.477 -0.732 19524 9 1 1 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.449 -0.457 19524 10 1 1 . 1 1 6 6 LEU H H 6 8.757 8.757 8.219 0.538 19524 11 1 1 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.545 -0.488 19524 12 1 1 . 1 1 7 7 ARG H H 7 8.315 8.315 8.779 -0.464 19524 13 1 1 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.906 0.217 19524 14 1 1 . 1 1 8 8 ALA H H 8 7.903 7.903 8.151 -0.248 19524 15 1 1 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.220 0.425 19524 16 1 1 . 1 1 9 9 CYS H H 9 8.687 8.687 8.630 0.057 19524 17 1 1 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.058 -0.233 19524 18 1 1 . 1 1 10 10 GLU H H 10 9.036 9.036 8.070 0.966 19524 19 1 1 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.910 0.207 19524 20 1 1 . 1 1 11 11 LEU H H 11 8.153 8.153 8.399 -0.246 19524 21 1 1 . 1 1 12 12 SER HA H 12 4.306 4.306 4.271 0.035 19524 22 1 1 . 1 1 12 12 SER H H 12 8.396 8.396 7.938 0.458 19524 23 1 1 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.342 0.158 19524 24 1 1 . 1 1 13 13 CYS H H 13 8.318 8.318 7.377 0.941 19524 25 1 1 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.264 0.221 19524 26 1 1 . 1 1 14 14 ARG H H 14 8.329 8.329 8.642 -0.313 19524 27 1 1 . 1 1 15 15 SER HA H 15 4.397 4.397 4.197 0.200 19524 28 1 1 . 1 1 15 15 SER H H 15 7.731 7.731 8.192 -0.461 19524 29 1 1 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.165 0.411 19524 30 1 1 . 1 1 16 16 LEU H H 16 7.407 7.407 7.622 -0.215 19524 31 1 1 . 1 1 17 17 GLY H H 17 8.175 8.175 7.770 0.405 19524 32 1 1 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.918 0.748 19524 33 1 1 . 1 1 18 18 LEU H H 18 7.463 7.463 7.656 -0.193 19524 34 1 1 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.737 -0.419 19524 35 1 1 . 1 1 19 19 LEU H H 19 8.641 8.641 7.961 0.680 19524 36 1 1 . 1 1 20 20 GLY H H 20 8.023 8.023 8.627 -0.604 19524 37 1 1 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.949 -0.558 19524 38 1 1 . 1 1 21 21 LYS H H 21 8.872 8.872 9.184 -0.312 19524 39 1 1 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.772 0.525 19524 40 1 1 . 1 1 22 22 CYS H H 22 8.234 8.234 8.859 -0.625 19524 41 1 1 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.741 -0.468 19524 42 1 1 . 1 1 23 23 ILE H H 23 9.047 9.047 8.473 0.574 19524 43 1 1 . 1 1 24 24 GLY H H 24 9.017 9.017 9.093 -0.076 19524 44 1 1 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.977 0.191 19524 45 1 1 . 1 1 25 25 GLU H H 25 8.825 8.825 8.904 -0.079 19524 46 1 1 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.867 0.678 19524 47 1 1 . 1 1 26 26 GLU H H 26 7.717 7.717 8.754 -1.037 19524 48 1 1 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.741 0.296 19524 49 1 1 . 1 1 27 27 CYS H H 27 8.707 8.707 7.772 0.935 19524 50 1 1 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.731 -0.048 19524 51 1 1 . 1 1 28 28 LYS H H 28 9.491 9.491 8.789 0.702 19524 52 1 1 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.879 0.823 19524 53 1 1 . 1 1 29 29 CYS H H 29 8.538 8.538 9.031 -0.493 19524 54 1 1 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.199 -0.250 19524 55 1 1 . 1 1 30 30 VAL H H 30 9.518 9.518 8.727 0.791 19524 56 1 1 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.146 -0.589 19524 57 1 1 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.799 -0.534 19524 58 1 2 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.236 0.162 19524 59 1 2 . 1 1 2 2 ALA H H 2 8.375 8.375 8.206 0.169 19524 60 1 2 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.602 0.086 19524 61 1 2 . 1 1 3 3 PHE H H 3 8.033 8.033 8.027 0.006 19524 62 1 2 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.267 0.148 19524 63 1 2 . 1 1 4 4 CYS H H 4 8.130 8.130 7.759 0.371 19524 64 1 2 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.784 0.041 19524 65 1 2 . 1 1 5 5 ASN H H 5 8.745 8.745 7.621 1.124 19524 66 1 2 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.250 -0.258 19524 67 1 2 . 1 1 6 6 LEU H H 6 8.757 8.757 8.288 0.469 19524 68 1 2 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.534 -0.477 19524 69 1 2 . 1 1 7 7 ARG H H 7 8.315 8.315 8.509 -0.194 19524 70 1 2 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.933 0.190 19524 71 1 2 . 1 1 8 8 ALA H H 8 7.903 7.903 8.528 -0.625 19524 72 1 2 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.102 0.543 19524 73 1 2 . 1 1 9 9 CYS H H 9 8.687 8.687 8.700 -0.013 19524 74 1 2 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.143 -0.318 19524 75 1 2 . 1 1 10 10 GLU H H 10 9.036 9.036 8.318 0.718 19524 76 1 2 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.935 0.182 19524 77 1 2 . 1 1 11 11 LEU H H 11 8.153 8.153 8.417 -0.264 19524 78 1 2 . 1 1 12 12 SER HA H 12 4.306 4.306 4.448 -0.142 19524 79 1 2 . 1 1 12 12 SER H H 12 8.396 8.396 8.255 0.141 19524 80 1 2 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.551 -0.051 19524 81 1 2 . 1 1 13 13 CYS H H 13 8.318 8.318 7.496 0.822 19524 82 1 2 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.277 0.208 19524 83 1 2 . 1 1 14 14 ARG H H 14 8.329 8.329 8.675 -0.346 19524 84 1 2 . 1 1 15 15 SER HA H 15 4.397 4.397 4.185 0.212 19524 85 1 2 . 1 1 15 15 SER H H 15 7.731 7.731 8.527 -0.796 19524 86 1 2 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.089 0.487 19524 87 1 2 . 1 1 16 16 LEU H H 16 7.407 7.407 7.802 -0.395 19524 88 1 2 . 1 1 17 17 GLY H H 17 8.175 8.175 7.658 0.517 19524 89 1 2 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.919 0.747 19524 90 1 2 . 1 1 18 18 LEU H H 18 7.463 7.463 7.657 -0.194 19524 91 1 2 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.531 -0.214 19524 92 1 2 . 1 1 19 19 LEU H H 19 8.641 8.641 8.052 0.589 19524 93 1 2 . 1 1 20 20 GLY H H 20 8.023 8.023 8.470 -0.447 19524 94 1 2 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.986 -0.595 19524 95 1 2 . 1 1 21 21 LYS H H 21 8.872 8.872 8.996 -0.124 19524 96 1 2 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.863 0.434 19524 97 1 2 . 1 1 22 22 CYS H H 22 8.234 8.234 8.888 -0.654 19524 98 1 2 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.632 -0.359 19524 99 1 2 . 1 1 23 23 ILE H H 23 9.047 9.047 8.617 0.430 19524 100 1 2 . 1 1 24 24 GLY H H 24 9.017 9.017 9.179 -0.162 19524 101 1 2 . 1 1 25 25 GLU HA H 25 4.168 4.168 4.026 0.142 19524 102 1 2 . 1 1 25 25 GLU H H 25 8.825 8.825 8.998 -0.173 19524 103 1 2 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.595 0.950 19524 104 1 2 . 1 1 26 26 GLU H H 26 7.717 7.717 8.696 -0.979 19524 105 1 2 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.641 0.396 19524 106 1 2 . 1 1 27 27 CYS H H 27 8.707 8.707 7.537 1.170 19524 107 1 2 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.537 0.146 19524 108 1 2 . 1 1 28 28 LYS H H 28 9.491 9.491 8.702 0.789 19524 109 1 2 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.840 0.862 19524 110 1 2 . 1 1 29 29 CYS H H 29 8.538 8.538 8.844 -0.306 19524 111 1 2 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.210 -0.261 19524 112 1 2 . 1 1 30 30 VAL H H 30 9.518 9.518 8.524 0.994 19524 113 1 2 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.149 -0.592 19524 114 1 2 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.829 -0.564 19524 115 1 3 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.434 -0.036 19524 116 1 3 . 1 1 2 2 ALA H H 2 8.375 8.375 9.013 -0.638 19524 117 1 3 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.763 -0.075 19524 118 1 3 . 1 1 3 3 PHE H H 3 8.033 8.033 7.831 0.202 19524 119 1 3 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.772 -0.357 19524 120 1 3 . 1 1 4 4 CYS H H 4 8.130 8.130 8.269 -0.139 19524 121 1 3 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.062 -0.237 19524 122 1 3 . 1 1 5 5 ASN H H 5 8.745 8.745 7.944 0.801 19524 123 1 3 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.571 -0.579 19524 124 1 3 . 1 1 6 6 LEU H H 6 8.757 8.757 8.348 0.409 19524 125 1 3 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.634 -0.577 19524 126 1 3 . 1 1 7 7 ARG H H 7 8.315 8.315 8.325 -0.010 19524 127 1 3 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.915 0.208 19524 128 1 3 . 1 1 8 8 ALA H H 8 7.903 7.903 8.056 -0.153 19524 129 1 3 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.183 0.462 19524 130 1 3 . 1 1 9 9 CYS H H 9 8.687 8.687 9.186 -0.499 19524 131 1 3 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.128 -0.303 19524 132 1 3 . 1 1 10 10 GLU H H 10 9.036 9.036 8.503 0.533 19524 133 1 3 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.987 0.130 19524 134 1 3 . 1 1 11 11 LEU H H 11 8.153 8.153 8.407 -0.254 19524 135 1 3 . 1 1 12 12 SER HA H 12 4.306 4.306 4.149 0.157 19524 136 1 3 . 1 1 12 12 SER H H 12 8.396 8.396 8.683 -0.287 19524 137 1 3 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.415 0.085 19524 138 1 3 . 1 1 13 13 CYS H H 13 8.318 8.318 7.680 0.638 19524 139 1 3 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.342 0.143 19524 140 1 3 . 1 1 14 14 ARG H H 14 8.329 8.329 8.382 -0.053 19524 141 1 3 . 1 1 15 15 SER HA H 15 4.397 4.397 4.071 0.326 19524 142 1 3 . 1 1 15 15 SER H H 15 7.731 7.731 8.594 -0.863 19524 143 1 3 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.081 0.495 19524 144 1 3 . 1 1 16 16 LEU H H 16 7.407 7.407 8.030 -0.623 19524 145 1 3 . 1 1 17 17 GLY H H 17 8.175 8.175 7.575 0.600 19524 146 1 3 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.764 0.902 19524 147 1 3 . 1 1 18 18 LEU H H 18 7.463 7.463 7.494 -0.031 19524 148 1 3 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.247 0.070 19524 149 1 3 . 1 1 19 19 LEU H H 19 8.641 8.641 7.719 0.922 19524 150 1 3 . 1 1 20 20 GLY H H 20 8.023 8.023 8.701 -0.678 19524 151 1 3 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.935 -0.544 19524 152 1 3 . 1 1 21 21 LYS H H 21 8.872 8.872 9.132 -0.260 19524 153 1 3 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.750 0.547 19524 154 1 3 . 1 1 22 22 CYS H H 22 8.234 8.234 8.782 -0.548 19524 155 1 3 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.027 -0.754 19524 156 1 3 . 1 1 23 23 ILE H H 23 9.047 9.047 8.509 0.538 19524 157 1 3 . 1 1 24 24 GLY H H 24 9.017 9.017 9.091 -0.074 19524 158 1 3 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.970 0.198 19524 159 1 3 . 1 1 25 25 GLU H H 25 8.825 8.825 9.006 -0.181 19524 160 1 3 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.711 0.834 19524 161 1 3 . 1 1 26 26 GLU H H 26 7.717 7.717 8.696 -0.979 19524 162 1 3 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.825 0.212 19524 163 1 3 . 1 1 27 27 CYS H H 27 8.707 8.707 7.360 1.347 19524 164 1 3 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.851 -0.168 19524 165 1 3 . 1 1 28 28 LYS H H 28 9.491 9.491 8.721 0.770 19524 166 1 3 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.874 0.828 19524 167 1 3 . 1 1 29 29 CYS H H 29 8.538 8.538 9.104 -0.566 19524 168 1 3 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.123 -0.174 19524 169 1 3 . 1 1 30 30 VAL H H 30 9.518 9.518 8.570 0.948 19524 170 1 3 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.075 -0.518 19524 171 1 3 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.671 -0.406 19524 172 1 4 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.179 0.219 19524 173 1 4 . 1 1 2 2 ALA H H 2 8.375 8.375 8.300 0.075 19524 174 1 4 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.453 0.235 19524 175 1 4 . 1 1 3 3 PHE H H 3 8.033 8.033 7.516 0.517 19524 176 1 4 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.682 -0.267 19524 177 1 4 . 1 1 4 4 CYS H H 4 8.130 8.130 8.031 0.099 19524 178 1 4 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.042 -0.217 19524 179 1 4 . 1 1 5 5 ASN H H 5 8.745 8.745 9.021 -0.276 19524 180 1 4 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.519 -0.527 19524 181 1 4 . 1 1 6 6 LEU H H 6 8.757 8.757 8.355 0.402 19524 182 1 4 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.512 -0.455 19524 183 1 4 . 1 1 7 7 ARG H H 7 8.315 8.315 8.797 -0.482 19524 184 1 4 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.872 0.251 19524 185 1 4 . 1 1 8 8 ALA H H 8 7.903 7.903 7.966 -0.063 19524 186 1 4 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.156 0.489 19524 187 1 4 . 1 1 9 9 CYS H H 9 8.687 8.687 8.604 0.083 19524 188 1 4 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.094 -0.269 19524 189 1 4 . 1 1 10 10 GLU H H 10 9.036 9.036 7.947 1.089 19524 190 1 4 . 1 1 11 11 LEU HA H 11 4.117 4.117 4.006 0.111 19524 191 1 4 . 1 1 11 11 LEU H H 11 8.153 8.153 8.427 -0.274 19524 192 1 4 . 1 1 12 12 SER HA H 12 4.306 4.306 4.446 -0.140 19524 193 1 4 . 1 1 12 12 SER H H 12 8.396 8.396 8.311 0.085 19524 194 1 4 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.469 0.031 19524 195 1 4 . 1 1 13 13 CYS H H 13 8.318 8.318 7.296 1.022 19524 196 1 4 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.230 0.255 19524 197 1 4 . 1 1 14 14 ARG H H 14 8.329 8.329 8.840 -0.511 19524 198 1 4 . 1 1 15 15 SER HA H 15 4.397 4.397 4.191 0.206 19524 199 1 4 . 1 1 15 15 SER H H 15 7.731 7.731 8.207 -0.476 19524 200 1 4 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.115 0.461 19524 201 1 4 . 1 1 16 16 LEU H H 16 7.407 7.407 7.686 -0.279 19524 202 1 4 . 1 1 17 17 GLY H H 17 8.175 8.175 7.894 0.281 19524 203 1 4 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.930 0.736 19524 204 1 4 . 1 1 18 18 LEU H H 18 7.463 7.463 7.614 -0.151 19524 205 1 4 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.510 -0.193 19524 206 1 4 . 1 1 19 19 LEU H H 19 8.641 8.641 7.783 0.858 19524 207 1 4 . 1 1 20 20 GLY H H 20 8.023 8.023 8.631 -0.608 19524 208 1 4 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.921 -0.530 19524 209 1 4 . 1 1 21 21 LYS H H 21 8.872 8.872 9.132 -0.260 19524 210 1 4 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.718 0.579 19524 211 1 4 . 1 1 22 22 CYS H H 22 8.234 8.234 8.703 -0.469 19524 212 1 4 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.095 -0.822 19524 213 1 4 . 1 1 23 23 ILE H H 23 9.047 9.047 8.782 0.265 19524 214 1 4 . 1 1 24 24 GLY H H 24 9.017 9.017 9.061 -0.044 19524 215 1 4 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.852 0.316 19524 216 1 4 . 1 1 25 25 GLU H H 25 8.825 8.825 8.790 0.035 19524 217 1 4 . 1 1 26 26 GLU HA H 26 4.545 4.545 4.567 -0.022 19524 218 1 4 . 1 1 26 26 GLU H H 26 7.717 7.717 8.287 -0.570 19524 219 1 4 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.688 0.349 19524 220 1 4 . 1 1 27 27 CYS H H 27 8.707 8.707 7.753 0.954 19524 221 1 4 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.315 -0.632 19524 222 1 4 . 1 1 28 28 LYS H H 28 9.491 9.491 8.791 0.700 19524 223 1 4 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.870 0.832 19524 224 1 4 . 1 1 29 29 CYS H H 29 8.538 8.538 9.218 -0.680 19524 225 1 4 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.255 -0.306 19524 226 1 4 . 1 1 30 30 VAL H H 30 9.518 9.518 8.595 0.923 19524 227 1 4 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.158 -0.601 19524 228 1 4 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.839 -0.574 19524 229 1 5 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.172 0.226 19524 230 1 5 . 1 1 2 2 ALA H H 2 8.375 8.375 8.737 -0.362 19524 231 1 5 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.823 -0.135 19524 232 1 5 . 1 1 3 3 PHE H H 3 8.033 8.033 7.631 0.402 19524 233 1 5 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.415 0.000 19524 234 1 5 . 1 1 4 4 CYS H H 4 8.130 8.130 8.106 0.024 19524 235 1 5 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.756 0.069 19524 236 1 5 . 1 1 5 5 ASN H H 5 8.745 8.745 8.068 0.677 19524 237 1 5 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.485 -0.493 19524 238 1 5 . 1 1 6 6 LEU H H 6 8.757 8.757 8.622 0.135 19524 239 1 5 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.597 -0.540 19524 240 1 5 . 1 1 7 7 ARG H H 7 8.315 8.315 8.654 -0.339 19524 241 1 5 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.002 0.121 19524 242 1 5 . 1 1 8 8 ALA H H 8 7.903 7.903 8.579 -0.676 19524 243 1 5 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.228 0.417 19524 244 1 5 . 1 1 9 9 CYS H H 9 8.687 8.687 8.594 0.093 19524 245 1 5 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.108 -0.283 19524 246 1 5 . 1 1 10 10 GLU H H 10 9.036 9.036 8.227 0.809 19524 247 1 5 . 1 1 11 11 LEU HA H 11 4.117 4.117 4.005 0.112 19524 248 1 5 . 1 1 11 11 LEU H H 11 8.153 8.153 8.427 -0.274 19524 249 1 5 . 1 1 12 12 SER HA H 12 4.306 4.306 4.554 -0.248 19524 250 1 5 . 1 1 12 12 SER H H 12 8.396 8.396 8.239 0.157 19524 251 1 5 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.552 -0.052 19524 252 1 5 . 1 1 13 13 CYS H H 13 8.318 8.318 7.574 0.744 19524 253 1 5 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.366 0.119 19524 254 1 5 . 1 1 14 14 ARG H H 14 8.329 8.329 8.873 -0.544 19524 255 1 5 . 1 1 15 15 SER HA H 15 4.397 4.397 4.055 0.342 19524 256 1 5 . 1 1 15 15 SER H H 15 7.731 7.731 8.354 -0.623 19524 257 1 5 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.045 0.531 19524 258 1 5 . 1 1 16 16 LEU H H 16 7.407 7.407 7.678 -0.271 19524 259 1 5 . 1 1 17 17 GLY H H 17 8.175 8.175 7.721 0.454 19524 260 1 5 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.696 0.970 19524 261 1 5 . 1 1 18 18 LEU H H 18 7.463 7.463 7.449 0.014 19524 262 1 5 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.466 -0.149 19524 263 1 5 . 1 1 19 19 LEU H H 19 8.641 8.641 7.961 0.680 19524 264 1 5 . 1 1 20 20 GLY H H 20 8.023 8.023 8.715 -0.692 19524 265 1 5 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.952 -0.561 19524 266 1 5 . 1 1 21 21 LYS H H 21 8.872 8.872 9.407 -0.535 19524 267 1 5 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.832 0.465 19524 268 1 5 . 1 1 22 22 CYS H H 22 8.234 8.234 8.690 -0.456 19524 269 1 5 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.837 -0.564 19524 270 1 5 . 1 1 23 23 ILE H H 23 9.047 9.047 8.827 0.220 19524 271 1 5 . 1 1 24 24 GLY H H 24 9.017 9.017 8.055 0.962 19524 272 1 5 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.923 0.245 19524 273 1 5 . 1 1 25 25 GLU H H 25 8.825 8.825 9.011 -0.186 19524 274 1 5 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.848 0.697 19524 275 1 5 . 1 1 26 26 GLU H H 26 7.717 7.717 8.632 -0.915 19524 276 1 5 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.768 0.269 19524 277 1 5 . 1 1 27 27 CYS H H 27 8.707 8.707 7.515 1.192 19524 278 1 5 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.743 -0.060 19524 279 1 5 . 1 1 28 28 LYS H H 28 9.491 9.491 8.718 0.773 19524 280 1 5 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.871 0.831 19524 281 1 5 . 1 1 29 29 CYS H H 29 8.538 8.538 8.963 -0.425 19524 282 1 5 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.187 -0.238 19524 283 1 5 . 1 1 30 30 VAL H H 30 9.518 9.518 8.554 0.964 19524 284 1 5 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.085 -0.528 19524 285 1 5 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.750 -0.485 19524 286 1 6 . 1 1 2 2 ALA HA H 2 4.398 4.398 3.932 0.466 19524 287 1 6 . 1 1 2 2 ALA H H 2 8.375 8.375 8.551 -0.176 19524 288 1 6 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.785 -0.097 19524 289 1 6 . 1 1 3 3 PHE H H 3 8.033 8.033 8.440 -0.407 19524 290 1 6 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.089 0.326 19524 291 1 6 . 1 1 4 4 CYS H H 4 8.130 8.130 7.677 0.453 19524 292 1 6 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.958 -0.133 19524 293 1 6 . 1 1 5 5 ASN H H 5 8.745 8.745 8.334 0.411 19524 294 1 6 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.466 -0.474 19524 295 1 6 . 1 1 6 6 LEU H H 6 8.757 8.757 8.390 0.367 19524 296 1 6 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.671 -0.614 19524 297 1 6 . 1 1 7 7 ARG H H 7 8.315 8.315 8.566 -0.251 19524 298 1 6 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.001 0.122 19524 299 1 6 . 1 1 8 8 ALA H H 8 7.903 7.903 8.550 -0.647 19524 300 1 6 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.126 0.519 19524 301 1 6 . 1 1 9 9 CYS H H 9 8.687 8.687 8.934 -0.247 19524 302 1 6 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.017 -0.192 19524 303 1 6 . 1 1 10 10 GLU H H 10 9.036 9.036 8.427 0.609 19524 304 1 6 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.935 0.182 19524 305 1 6 . 1 1 11 11 LEU H H 11 8.153 8.153 8.348 -0.195 19524 306 1 6 . 1 1 12 12 SER HA H 12 4.306 4.306 4.430 -0.124 19524 307 1 6 . 1 1 12 12 SER H H 12 8.396 8.396 8.224 0.172 19524 308 1 6 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.484 0.016 19524 309 1 6 . 1 1 13 13 CYS H H 13 8.318 8.318 7.578 0.740 19524 310 1 6 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.429 0.056 19524 311 1 6 . 1 1 14 14 ARG H H 14 8.329 8.329 8.159 0.170 19524 312 1 6 . 1 1 15 15 SER HA H 15 4.397 4.397 4.158 0.239 19524 313 1 6 . 1 1 15 15 SER H H 15 7.731 7.731 8.690 -0.959 19524 314 1 6 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.129 0.447 19524 315 1 6 . 1 1 16 16 LEU H H 16 7.407 7.407 8.378 -0.971 19524 316 1 6 . 1 1 17 17 GLY H H 17 8.175 8.175 7.859 0.316 19524 317 1 6 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.931 0.735 19524 318 1 6 . 1 1 18 18 LEU H H 18 7.463 7.463 7.534 -0.071 19524 319 1 6 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.701 -0.384 19524 320 1 6 . 1 1 19 19 LEU H H 19 8.641 8.641 7.999 0.642 19524 321 1 6 . 1 1 20 20 GLY H H 20 8.023 8.023 8.659 -0.636 19524 322 1 6 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.809 -0.418 19524 323 1 6 . 1 1 21 21 LYS H H 21 8.872 8.872 9.272 -0.400 19524 324 1 6 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.797 0.500 19524 325 1 6 . 1 1 22 22 CYS H H 22 8.234 8.234 8.518 -0.284 19524 326 1 6 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.824 -0.551 19524 327 1 6 . 1 1 23 23 ILE H H 23 9.047 9.047 8.813 0.234 19524 328 1 6 . 1 1 24 24 GLY H H 24 9.017 9.017 9.080 -0.063 19524 329 1 6 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.946 0.222 19524 330 1 6 . 1 1 25 25 GLU H H 25 8.825 8.825 8.776 0.049 19524 331 1 6 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.710 0.835 19524 332 1 6 . 1 1 26 26 GLU H H 26 7.717 7.717 8.734 -1.017 19524 333 1 6 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.667 0.370 19524 334 1 6 . 1 1 27 27 CYS H H 27 8.707 8.707 7.367 1.340 19524 335 1 6 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.934 -0.251 19524 336 1 6 . 1 1 28 28 LYS H H 28 9.491 9.491 8.810 0.681 19524 337 1 6 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.879 0.823 19524 338 1 6 . 1 1 29 29 CYS H H 29 8.538 8.538 8.785 -0.247 19524 339 1 6 . 1 1 30 30 VAL HA H 30 4.949 4.949 4.962 -0.013 19524 340 1 6 . 1 1 30 30 VAL H H 30 9.518 9.518 8.440 1.078 19524 341 1 6 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.073 -0.516 19524 342 1 6 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.770 -0.505 19524 343 1 7 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.111 0.287 19524 344 1 7 . 1 1 2 2 ALA H H 2 8.375 8.375 9.191 -0.816 19524 345 1 7 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.368 0.320 19524 346 1 7 . 1 1 3 3 PHE H H 3 8.033 8.033 7.532 0.501 19524 347 1 7 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.505 -0.090 19524 348 1 7 . 1 1 4 4 CYS H H 4 8.130 8.130 7.858 0.272 19524 349 1 7 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.830 -0.005 19524 350 1 7 . 1 1 5 5 ASN H H 5 8.745 8.745 9.079 -0.334 19524 351 1 7 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.331 -0.339 19524 352 1 7 . 1 1 6 6 LEU H H 6 8.757 8.757 7.839 0.918 19524 353 1 7 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.458 -0.401 19524 354 1 7 . 1 1 7 7 ARG H H 7 8.315 8.315 8.554 -0.239 19524 355 1 7 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.221 -0.098 19524 356 1 7 . 1 1 8 8 ALA H H 8 7.903 7.903 8.439 -0.536 19524 357 1 7 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.646 -0.002 19524 358 1 7 . 1 1 9 9 CYS H H 9 8.687 8.687 7.685 1.002 19524 359 1 7 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.104 -0.279 19524 360 1 7 . 1 1 10 10 GLU H H 10 9.036 9.036 8.106 0.930 19524 361 1 7 . 1 1 11 11 LEU HA H 11 4.117 4.117 4.025 0.092 19524 362 1 7 . 1 1 11 11 LEU H H 11 8.153 8.153 8.568 -0.415 19524 363 1 7 . 1 1 12 12 SER HA H 12 4.306 4.306 4.215 0.091 19524 364 1 7 . 1 1 12 12 SER H H 12 8.396 8.396 7.351 1.045 19524 365 1 7 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.139 0.361 19524 366 1 7 . 1 1 13 13 CYS H H 13 8.318 8.318 8.163 0.155 19524 367 1 7 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.204 0.281 19524 368 1 7 . 1 1 14 14 ARG H H 14 8.329 8.329 8.772 -0.443 19524 369 1 7 . 1 1 15 15 SER HA H 15 4.397 4.397 4.153 0.244 19524 370 1 7 . 1 1 15 15 SER H H 15 7.731 7.731 7.863 -0.132 19524 371 1 7 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.075 0.501 19524 372 1 7 . 1 1 16 16 LEU H H 16 7.407 7.407 7.579 -0.172 19524 373 1 7 . 1 1 17 17 GLY H H 17 8.175 8.175 7.542 0.633 19524 374 1 7 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.741 0.925 19524 375 1 7 . 1 1 18 18 LEU H H 18 7.463 7.463 7.391 0.072 19524 376 1 7 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.404 -0.087 19524 377 1 7 . 1 1 19 19 LEU H H 19 8.641 8.641 7.863 0.778 19524 378 1 7 . 1 1 20 20 GLY H H 20 8.023 8.023 8.669 -0.646 19524 379 1 7 . 1 1 21 21 LYS HA H 21 4.391 4.391 5.080 -0.689 19524 380 1 7 . 1 1 21 21 LYS H H 21 8.872 8.872 9.227 -0.355 19524 381 1 7 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.758 0.539 19524 382 1 7 . 1 1 22 22 CYS H H 22 8.234 8.234 8.709 -0.475 19524 383 1 7 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.858 -0.585 19524 384 1 7 . 1 1 23 23 ILE H H 23 9.047 9.047 8.583 0.464 19524 385 1 7 . 1 1 24 24 GLY H H 24 9.017 9.017 9.125 -0.108 19524 386 1 7 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.971 0.197 19524 387 1 7 . 1 1 25 25 GLU H H 25 8.825 8.825 9.097 -0.272 19524 388 1 7 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.950 0.595 19524 389 1 7 . 1 1 26 26 GLU H H 26 7.717 7.717 8.562 -0.845 19524 390 1 7 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.808 0.229 19524 391 1 7 . 1 1 27 27 CYS H H 27 8.707 8.707 7.712 0.995 19524 392 1 7 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.795 -0.112 19524 393 1 7 . 1 1 28 28 LYS H H 28 9.491 9.491 8.863 0.628 19524 394 1 7 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.849 0.853 19524 395 1 7 . 1 1 29 29 CYS H H 29 8.538 8.538 9.197 -0.659 19524 396 1 7 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.273 -0.324 19524 397 1 7 . 1 1 30 30 VAL H H 30 9.518 9.518 8.650 0.868 19524 398 1 7 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.145 -0.588 19524 399 1 7 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.758 -0.493 19524 400 1 8 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.231 0.167 19524 401 1 8 . 1 1 2 2 ALA H H 2 8.375 8.375 8.428 -0.053 19524 402 1 8 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.733 -0.045 19524 403 1 8 . 1 1 3 3 PHE H H 3 8.033 8.033 8.121 -0.088 19524 404 1 8 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.004 0.411 19524 405 1 8 . 1 1 4 4 CYS H H 4 8.130 8.130 7.409 0.721 19524 406 1 8 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.674 0.151 19524 407 1 8 . 1 1 5 5 ASN H H 5 8.745 8.745 8.274 0.471 19524 408 1 8 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.426 -0.434 19524 409 1 8 . 1 1 6 6 LEU H H 6 8.757 8.757 8.175 0.582 19524 410 1 8 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.666 -0.609 19524 411 1 8 . 1 1 7 7 ARG H H 7 8.315 8.315 8.598 -0.283 19524 412 1 8 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.894 0.229 19524 413 1 8 . 1 1 8 8 ALA H H 8 7.903 7.903 8.427 -0.524 19524 414 1 8 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.111 0.534 19524 415 1 8 . 1 1 9 9 CYS H H 9 8.687 8.687 8.825 -0.138 19524 416 1 8 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.027 -0.202 19524 417 1 8 . 1 1 10 10 GLU H H 10 9.036 9.036 8.416 0.620 19524 418 1 8 . 1 1 11 11 LEU HA H 11 4.117 4.117 4.057 0.060 19524 419 1 8 . 1 1 11 11 LEU H H 11 8.153 8.153 8.552 -0.399 19524 420 1 8 . 1 1 12 12 SER HA H 12 4.306 4.306 4.579 -0.273 19524 421 1 8 . 1 1 12 12 SER H H 12 8.396 8.396 7.759 0.637 19524 422 1 8 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.387 0.113 19524 423 1 8 . 1 1 13 13 CYS H H 13 8.318 8.318 7.190 1.128 19524 424 1 8 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.195 0.290 19524 425 1 8 . 1 1 14 14 ARG H H 14 8.329 8.329 8.659 -0.330 19524 426 1 8 . 1 1 15 15 SER HA H 15 4.397 4.397 4.345 0.052 19524 427 1 8 . 1 1 15 15 SER H H 15 7.731 7.731 8.405 -0.674 19524 428 1 8 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.172 0.404 19524 429 1 8 . 1 1 16 16 LEU H H 16 7.407 7.407 7.880 -0.473 19524 430 1 8 . 1 1 17 17 GLY H H 17 8.175 8.175 7.830 0.345 19524 431 1 8 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.992 0.674 19524 432 1 8 . 1 1 18 18 LEU H H 18 7.463 7.463 7.824 -0.361 19524 433 1 8 . 1 1 19 19 LEU HA H 19 4.317 4.317 5.032 -0.715 19524 434 1 8 . 1 1 19 19 LEU H H 19 8.641 8.641 8.104 0.537 19524 435 1 8 . 1 1 20 20 GLY H H 20 8.023 8.023 8.740 -0.717 19524 436 1 8 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.799 -0.408 19524 437 1 8 . 1 1 21 21 LYS H H 21 8.872 8.872 8.287 0.585 19524 438 1 8 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.820 0.477 19524 439 1 8 . 1 1 22 22 CYS H H 22 8.234 8.234 8.838 -0.604 19524 440 1 8 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.062 -0.789 19524 441 1 8 . 1 1 23 23 ILE H H 23 9.047 9.047 8.778 0.269 19524 442 1 8 . 1 1 24 24 GLY H H 24 9.017 9.017 8.861 0.156 19524 443 1 8 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.943 0.225 19524 444 1 8 . 1 1 25 25 GLU H H 25 8.825 8.825 8.838 -0.013 19524 445 1 8 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.761 0.784 19524 446 1 8 . 1 1 26 26 GLU H H 26 7.717 7.717 8.632 -0.915 19524 447 1 8 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.823 0.214 19524 448 1 8 . 1 1 27 27 CYS H H 27 8.707 8.707 7.501 1.206 19524 449 1 8 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.163 -0.480 19524 450 1 8 . 1 1 28 28 LYS H H 28 9.491 9.491 8.716 0.775 19524 451 1 8 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.954 0.748 19524 452 1 8 . 1 1 29 29 CYS H H 29 8.538 8.538 9.041 -0.503 19524 453 1 8 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.130 -0.181 19524 454 1 8 . 1 1 30 30 VAL H H 30 9.518 9.518 8.570 0.948 19524 455 1 8 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.146 -0.589 19524 456 1 8 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.804 -0.539 19524 457 1 9 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.030 0.368 19524 458 1 9 . 1 1 2 2 ALA H H 2 8.375 8.375 8.759 -0.384 19524 459 1 9 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.759 -0.071 19524 460 1 9 . 1 1 3 3 PHE H H 3 8.033 8.033 7.723 0.310 19524 461 1 9 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.729 -0.314 19524 462 1 9 . 1 1 4 4 CYS H H 4 8.130 8.130 8.256 -0.126 19524 463 1 9 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.605 0.220 19524 464 1 9 . 1 1 5 5 ASN H H 5 8.745 8.745 7.327 1.418 19524 465 1 9 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.344 -0.352 19524 466 1 9 . 1 1 6 6 LEU H H 6 8.757 8.757 7.970 0.787 19524 467 1 9 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.511 -0.454 19524 468 1 9 . 1 1 7 7 ARG H H 7 8.315 8.315 8.673 -0.358 19524 469 1 9 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.294 -0.171 19524 470 1 9 . 1 1 8 8 ALA H H 8 7.903 7.903 8.461 -0.558 19524 471 1 9 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.637 0.008 19524 472 1 9 . 1 1 9 9 CYS H H 9 8.687 8.687 8.178 0.509 19524 473 1 9 . 1 1 10 10 GLU HA H 10 3.825 3.825 3.929 -0.104 19524 474 1 9 . 1 1 10 10 GLU H H 10 9.036 9.036 8.051 0.985 19524 475 1 9 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.966 0.151 19524 476 1 9 . 1 1 11 11 LEU H H 11 8.153 8.153 8.595 -0.442 19524 477 1 9 . 1 1 12 12 SER HA H 12 4.306 4.306 4.127 0.179 19524 478 1 9 . 1 1 12 12 SER H H 12 8.396 8.396 7.383 1.013 19524 479 1 9 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.264 0.236 19524 480 1 9 . 1 1 13 13 CYS H H 13 8.318 8.318 7.848 0.470 19524 481 1 9 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.391 0.094 19524 482 1 9 . 1 1 14 14 ARG H H 14 8.329 8.329 8.462 -0.133 19524 483 1 9 . 1 1 15 15 SER HA H 15 4.397 4.397 4.221 0.176 19524 484 1 9 . 1 1 15 15 SER H H 15 7.731 7.731 8.126 -0.395 19524 485 1 9 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.142 0.434 19524 486 1 9 . 1 1 16 16 LEU H H 16 7.407 7.407 7.879 -0.472 19524 487 1 9 . 1 1 17 17 GLY H H 17 8.175 8.175 7.686 0.489 19524 488 1 9 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.972 0.694 19524 489 1 9 . 1 1 18 18 LEU H H 18 7.463 7.463 8.079 -0.616 19524 490 1 9 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.897 -0.580 19524 491 1 9 . 1 1 19 19 LEU H H 19 8.641 8.641 8.038 0.603 19524 492 1 9 . 1 1 20 20 GLY H H 20 8.023 8.023 8.853 -0.830 19524 493 1 9 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.730 -0.339 19524 494 1 9 . 1 1 21 21 LYS H H 21 8.872 8.872 8.310 0.562 19524 495 1 9 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.919 0.378 19524 496 1 9 . 1 1 22 22 CYS H H 22 8.234 8.234 8.680 -0.446 19524 497 1 9 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.538 -0.265 19524 498 1 9 . 1 1 23 23 ILE H H 23 9.047 9.047 8.770 0.277 19524 499 1 9 . 1 1 24 24 GLY H H 24 9.017 9.017 8.904 0.113 19524 500 1 9 . 1 1 25 25 GLU HA H 25 4.168 4.168 4.066 0.102 19524 501 1 9 . 1 1 25 25 GLU H H 25 8.825 8.825 8.891 -0.066 19524 502 1 9 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.619 0.926 19524 503 1 9 . 1 1 26 26 GLU H H 26 7.717 7.717 8.753 -1.036 19524 504 1 9 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.637 0.400 19524 505 1 9 . 1 1 27 27 CYS H H 27 8.707 8.707 7.568 1.139 19524 506 1 9 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.831 -0.148 19524 507 1 9 . 1 1 28 28 LYS H H 28 9.491 9.491 8.796 0.695 19524 508 1 9 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.875 0.827 19524 509 1 9 . 1 1 29 29 CYS H H 29 8.538 8.538 8.943 -0.405 19524 510 1 9 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.161 -0.212 19524 511 1 9 . 1 1 30 30 VAL H H 30 9.518 9.518 8.427 1.091 19524 512 1 9 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.096 -0.539 19524 513 1 9 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.686 -0.420 19524 514 1 10 . 1 1 2 2 ALA HA H 2 4.398 4.398 3.937 0.461 19524 515 1 10 . 1 1 2 2 ALA H H 2 8.375 8.375 8.535 -0.160 19524 516 1 10 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.628 0.060 19524 517 1 10 . 1 1 3 3 PHE H H 3 8.033 8.033 8.368 -0.335 19524 518 1 10 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.651 -0.236 19524 519 1 10 . 1 1 4 4 CYS H H 4 8.130 8.130 8.256 -0.126 19524 520 1 10 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.639 0.186 19524 521 1 10 . 1 1 5 5 ASN H H 5 8.745 8.745 7.829 0.916 19524 522 1 10 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.620 -0.628 19524 523 1 10 . 1 1 6 6 LEU H H 6 8.757 8.757 8.160 0.597 19524 524 1 10 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.646 -0.589 19524 525 1 10 . 1 1 7 7 ARG H H 7 8.315 8.315 8.364 -0.049 19524 526 1 10 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.950 0.173 19524 527 1 10 . 1 1 8 8 ALA H H 8 7.903 7.903 8.261 -0.358 19524 528 1 10 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.215 0.430 19524 529 1 10 . 1 1 9 9 CYS H H 9 8.687 8.687 8.969 -0.282 19524 530 1 10 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.113 -0.288 19524 531 1 10 . 1 1 10 10 GLU H H 10 9.036 9.036 8.467 0.569 19524 532 1 10 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.990 0.127 19524 533 1 10 . 1 1 11 11 LEU H H 11 8.153 8.153 8.434 -0.281 19524 534 1 10 . 1 1 12 12 SER HA H 12 4.306 4.306 4.439 -0.133 19524 535 1 10 . 1 1 12 12 SER H H 12 8.396 8.396 7.882 0.514 19524 536 1 10 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.500 -0.000 19524 537 1 10 . 1 1 13 13 CYS H H 13 8.318 8.318 7.609 0.709 19524 538 1 10 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.380 0.105 19524 539 1 10 . 1 1 14 14 ARG H H 14 8.329 8.329 8.308 0.021 19524 540 1 10 . 1 1 15 15 SER HA H 15 4.397 4.397 4.166 0.231 19524 541 1 10 . 1 1 15 15 SER H H 15 7.731 7.731 8.626 -0.895 19524 542 1 10 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.111 0.465 19524 543 1 10 . 1 1 16 16 LEU H H 16 7.407 7.407 8.289 -0.882 19524 544 1 10 . 1 1 17 17 GLY H H 17 8.175 8.175 7.828 0.347 19524 545 1 10 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.934 0.732 19524 546 1 10 . 1 1 18 18 LEU H H 18 7.463 7.463 7.693 -0.230 19524 547 1 10 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.949 -0.632 19524 548 1 10 . 1 1 19 19 LEU H H 19 8.641 8.641 8.248 0.393 19524 549 1 10 . 1 1 20 20 GLY H H 20 8.023 8.023 8.729 -0.706 19524 550 1 10 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.947 -0.556 19524 551 1 10 . 1 1 21 21 LYS H H 21 8.872 8.872 9.068 -0.196 19524 552 1 10 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.743 0.554 19524 553 1 10 . 1 1 22 22 CYS H H 22 8.234 8.234 8.670 -0.436 19524 554 1 10 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.800 -0.527 19524 555 1 10 . 1 1 23 23 ILE H H 23 9.047 9.047 8.471 0.576 19524 556 1 10 . 1 1 24 24 GLY H H 24 9.017 9.017 8.976 0.041 19524 557 1 10 . 1 1 25 25 GLU HA H 25 4.168 4.168 4.037 0.131 19524 558 1 10 . 1 1 25 25 GLU H H 25 8.825 8.825 8.799 0.026 19524 559 1 10 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.524 1.021 19524 560 1 10 . 1 1 26 26 GLU H H 26 7.717 7.717 8.579 -0.862 19524 561 1 10 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.604 0.433 19524 562 1 10 . 1 1 27 27 CYS H H 27 8.707 8.707 7.546 1.161 19524 563 1 10 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.583 0.100 19524 564 1 10 . 1 1 28 28 LYS H H 28 9.491 9.491 8.747 0.744 19524 565 1 10 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.860 0.842 19524 566 1 10 . 1 1 29 29 CYS H H 29 8.538 8.538 9.063 -0.525 19524 567 1 10 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.177 -0.228 19524 568 1 10 . 1 1 30 30 VAL H H 30 9.518 9.518 8.576 0.942 19524 569 1 10 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.108 -0.551 19524 570 1 10 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.757 -0.492 19524 571 1 11 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.147 0.251 19524 572 1 11 . 1 1 2 2 ALA H H 2 8.375 8.375 8.068 0.307 19524 573 1 11 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.222 0.466 19524 574 1 11 . 1 1 3 3 PHE H H 3 8.033 8.033 8.936 -0.903 19524 575 1 11 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.648 -0.233 19524 576 1 11 . 1 1 4 4 CYS H H 4 8.130 8.130 7.874 0.256 19524 577 1 11 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.885 -0.060 19524 578 1 11 . 1 1 5 5 ASN H H 5 8.745 8.745 7.534 1.211 19524 579 1 11 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.281 -0.289 19524 580 1 11 . 1 1 6 6 LEU H H 6 8.757 8.757 8.371 0.386 19524 581 1 11 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.404 -0.347 19524 582 1 11 . 1 1 7 7 ARG H H 7 8.315 8.315 8.476 -0.161 19524 583 1 11 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.149 -0.026 19524 584 1 11 . 1 1 8 8 ALA H H 8 7.903 7.903 8.149 -0.246 19524 585 1 11 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.637 0.008 19524 586 1 11 . 1 1 9 9 CYS H H 9 8.687 8.687 7.997 0.690 19524 587 1 11 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.174 -0.349 19524 588 1 11 . 1 1 10 10 GLU H H 10 9.036 9.036 8.013 1.023 19524 589 1 11 . 1 1 11 11 LEU HA H 11 4.117 4.117 4.008 0.109 19524 590 1 11 . 1 1 11 11 LEU H H 11 8.153 8.153 8.444 -0.291 19524 591 1 11 . 1 1 12 12 SER HA H 12 4.306 4.306 4.258 0.048 19524 592 1 11 . 1 1 12 12 SER H H 12 8.396 8.396 7.958 0.438 19524 593 1 11 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.208 0.292 19524 594 1 11 . 1 1 13 13 CYS H H 13 8.318 8.318 7.781 0.537 19524 595 1 11 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.264 0.221 19524 596 1 11 . 1 1 14 14 ARG H H 14 8.329 8.329 8.639 -0.310 19524 597 1 11 . 1 1 15 15 SER HA H 15 4.397 4.397 4.381 0.016 19524 598 1 11 . 1 1 15 15 SER H H 15 7.731 7.731 7.922 -0.191 19524 599 1 11 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.087 0.489 19524 600 1 11 . 1 1 16 16 LEU H H 16 7.407 7.407 7.669 -0.262 19524 601 1 11 . 1 1 17 17 GLY H H 17 8.175 8.175 7.668 0.507 19524 602 1 11 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.938 0.728 19524 603 1 11 . 1 1 18 18 LEU H H 18 7.463 7.463 7.613 -0.150 19524 604 1 11 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.970 -0.653 19524 605 1 11 . 1 1 19 19 LEU H H 19 8.641 8.641 8.131 0.510 19524 606 1 11 . 1 1 20 20 GLY H H 20 8.023 8.023 8.984 -0.961 19524 607 1 11 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.939 -0.548 19524 608 1 11 . 1 1 21 21 LYS H H 21 8.872 8.872 8.242 0.630 19524 609 1 11 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.940 0.357 19524 610 1 11 . 1 1 22 22 CYS H H 22 8.234 8.234 9.098 -0.864 19524 611 1 11 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.012 -0.739 19524 612 1 11 . 1 1 23 23 ILE H H 23 9.047 9.047 8.905 0.142 19524 613 1 11 . 1 1 24 24 GLY H H 24 9.017 9.017 9.138 -0.121 19524 614 1 11 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.980 0.188 19524 615 1 11 . 1 1 25 25 GLU H H 25 8.825 8.825 8.761 0.064 19524 616 1 11 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.786 0.759 19524 617 1 11 . 1 1 26 26 GLU H H 26 7.717 7.717 8.171 -0.454 19524 618 1 11 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.728 0.309 19524 619 1 11 . 1 1 27 27 CYS H H 27 8.707 8.707 7.820 0.887 19524 620 1 11 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.774 -0.091 19524 621 1 11 . 1 1 28 28 LYS H H 28 9.491 9.491 8.682 0.809 19524 622 1 11 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.919 0.783 19524 623 1 11 . 1 1 29 29 CYS H H 29 8.538 8.538 9.144 -0.606 19524 624 1 11 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.364 -0.415 19524 625 1 11 . 1 1 30 30 VAL H H 30 9.518 9.518 8.668 0.850 19524 626 1 11 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.161 -0.604 19524 627 1 11 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.773 -0.508 19524 628 1 12 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.459 -0.061 19524 629 1 12 . 1 1 2 2 ALA H H 2 8.375 8.375 8.649 -0.274 19524 630 1 12 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.627 0.061 19524 631 1 12 . 1 1 3 3 PHE H H 3 8.033 8.033 8.017 0.016 19524 632 1 12 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.678 -0.263 19524 633 1 12 . 1 1 4 4 CYS H H 4 8.130 8.130 8.233 -0.103 19524 634 1 12 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.007 -0.182 19524 635 1 12 . 1 1 5 5 ASN H H 5 8.745 8.745 8.821 -0.076 19524 636 1 12 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.627 -0.635 19524 637 1 12 . 1 1 6 6 LEU H H 6 8.757 8.757 8.385 0.372 19524 638 1 12 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.491 -0.434 19524 639 1 12 . 1 1 7 7 ARG H H 7 8.315 8.315 8.730 -0.415 19524 640 1 12 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.210 -0.087 19524 641 1 12 . 1 1 8 8 ALA H H 8 7.903 7.903 8.401 -0.498 19524 642 1 12 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.631 0.014 19524 643 1 12 . 1 1 9 9 CYS H H 9 8.687 8.687 7.695 0.992 19524 644 1 12 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.112 -0.287 19524 645 1 12 . 1 1 10 10 GLU H H 10 9.036 9.036 8.033 1.003 19524 646 1 12 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.970 0.147 19524 647 1 12 . 1 1 11 11 LEU H H 11 8.153 8.153 8.449 -0.296 19524 648 1 12 . 1 1 12 12 SER HA H 12 4.306 4.306 4.252 0.054 19524 649 1 12 . 1 1 12 12 SER H H 12 8.396 8.396 8.240 0.156 19524 650 1 12 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.242 0.258 19524 651 1 12 . 1 1 13 13 CYS H H 13 8.318 8.318 7.487 0.831 19524 652 1 12 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.292 0.193 19524 653 1 12 . 1 1 14 14 ARG H H 14 8.329 8.329 8.797 -0.468 19524 654 1 12 . 1 1 15 15 SER HA H 15 4.397 4.397 4.161 0.236 19524 655 1 12 . 1 1 15 15 SER H H 15 7.731 7.731 8.422 -0.691 19524 656 1 12 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.147 0.429 19524 657 1 12 . 1 1 16 16 LEU H H 16 7.407 7.407 7.662 -0.255 19524 658 1 12 . 1 1 17 17 GLY H H 17 8.175 8.175 7.580 0.595 19524 659 1 12 . 1 1 18 18 LEU HA H 18 4.666 4.666 4.003 0.663 19524 660 1 12 . 1 1 18 18 LEU H H 18 7.463 7.463 7.811 -0.348 19524 661 1 12 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.755 -0.438 19524 662 1 12 . 1 1 19 19 LEU H H 19 8.641 8.641 7.909 0.732 19524 663 1 12 . 1 1 20 20 GLY H H 20 8.023 8.023 8.720 -0.697 19524 664 1 12 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.833 -0.442 19524 665 1 12 . 1 1 21 21 LYS H H 21 8.872 8.872 9.277 -0.405 19524 666 1 12 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.773 0.524 19524 667 1 12 . 1 1 22 22 CYS H H 22 8.234 8.234 8.868 -0.634 19524 668 1 12 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.064 -0.791 19524 669 1 12 . 1 1 23 23 ILE H H 23 9.047 9.047 8.587 0.460 19524 670 1 12 . 1 1 24 24 GLY H H 24 9.017 9.017 9.197 -0.180 19524 671 1 12 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.956 0.212 19524 672 1 12 . 1 1 25 25 GLU H H 25 8.825 8.825 8.986 -0.161 19524 673 1 12 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.766 0.779 19524 674 1 12 . 1 1 26 26 GLU H H 26 7.717 7.717 8.559 -0.842 19524 675 1 12 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.746 0.291 19524 676 1 12 . 1 1 27 27 CYS H H 27 8.707 8.707 7.562 1.145 19524 677 1 12 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.053 -0.370 19524 678 1 12 . 1 1 28 28 LYS H H 28 9.491 9.491 8.687 0.804 19524 679 1 12 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.876 0.826 19524 680 1 12 . 1 1 29 29 CYS H H 29 8.538 8.538 9.133 -0.595 19524 681 1 12 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.172 -0.223 19524 682 1 12 . 1 1 30 30 VAL H H 30 9.518 9.518 8.585 0.933 19524 683 1 12 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.141 -0.584 19524 684 1 12 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.820 -0.555 19524 685 1 13 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.484 -0.086 19524 686 1 13 . 1 1 2 2 ALA H H 2 8.375 8.375 9.088 -0.713 19524 687 1 13 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.831 -0.143 19524 688 1 13 . 1 1 3 3 PHE H H 3 8.033 8.033 8.143 -0.111 19524 689 1 13 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.799 -0.384 19524 690 1 13 . 1 1 4 4 CYS H H 4 8.130 8.130 8.303 -0.173 19524 691 1 13 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.116 -0.291 19524 692 1 13 . 1 1 5 5 ASN H H 5 8.745 8.745 8.656 0.089 19524 693 1 13 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.648 -0.656 19524 694 1 13 . 1 1 6 6 LEU H H 6 8.757 8.757 8.238 0.519 19524 695 1 13 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.666 -0.609 19524 696 1 13 . 1 1 7 7 ARG H H 7 8.315 8.315 8.329 -0.014 19524 697 1 13 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.019 0.104 19524 698 1 13 . 1 1 8 8 ALA H H 8 7.903 7.903 8.468 -0.565 19524 699 1 13 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.362 0.283 19524 700 1 13 . 1 1 9 9 CYS H H 9 8.687 8.687 8.844 -0.157 19524 701 1 13 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.391 -0.566 19524 702 1 13 . 1 1 10 10 GLU H H 10 9.036 9.036 7.506 1.530 19524 703 1 13 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.917 0.200 19524 704 1 13 . 1 1 11 11 LEU H H 11 8.153 8.153 8.482 -0.329 19524 705 1 13 . 1 1 12 12 SER HA H 12 4.306 4.306 4.478 -0.172 19524 706 1 13 . 1 1 12 12 SER H H 12 8.396 8.396 7.826 0.570 19524 707 1 13 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.342 0.158 19524 708 1 13 . 1 1 13 13 CYS H H 13 8.318 8.318 7.416 0.902 19524 709 1 13 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.407 0.078 19524 710 1 13 . 1 1 14 14 ARG H H 14 8.329 8.329 8.558 -0.229 19524 711 1 13 . 1 1 15 15 SER HA H 15 4.397 4.397 4.201 0.196 19524 712 1 13 . 1 1 15 15 SER H H 15 7.731 7.731 8.407 -0.676 19524 713 1 13 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.131 0.445 19524 714 1 13 . 1 1 16 16 LEU H H 16 7.407 7.407 8.029 -0.622 19524 715 1 13 . 1 1 17 17 GLY H H 17 8.175 8.175 7.926 0.249 19524 716 1 13 . 1 1 18 18 LEU HA H 18 4.666 4.666 4.033 0.633 19524 717 1 13 . 1 1 18 18 LEU H H 18 7.463 7.463 7.740 -0.277 19524 718 1 13 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.478 -0.161 19524 719 1 13 . 1 1 19 19 LEU H H 19 8.641 8.641 7.903 0.738 19524 720 1 13 . 1 1 20 20 GLY H H 20 8.023 8.023 8.293 -0.270 19524 721 1 13 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.889 -0.498 19524 722 1 13 . 1 1 21 21 LYS H H 21 8.872 8.872 9.251 -0.379 19524 723 1 13 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.842 0.455 19524 724 1 13 . 1 1 22 22 CYS H H 22 8.234 8.234 8.901 -0.667 19524 725 1 13 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.569 -0.296 19524 726 1 13 . 1 1 23 23 ILE H H 23 9.047 9.047 8.589 0.458 19524 727 1 13 . 1 1 24 24 GLY H H 24 9.017 9.017 9.097 -0.080 19524 728 1 13 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.965 0.203 19524 729 1 13 . 1 1 25 25 GLU H H 25 8.825 8.825 8.874 -0.049 19524 730 1 13 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.702 0.843 19524 731 1 13 . 1 1 26 26 GLU H H 26 7.717 7.717 8.645 -0.928 19524 732 1 13 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.623 0.414 19524 733 1 13 . 1 1 27 27 CYS H H 27 8.707 8.707 7.413 1.294 19524 734 1 13 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.709 -0.026 19524 735 1 13 . 1 1 28 28 LYS H H 28 9.491 9.491 8.802 0.689 19524 736 1 13 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.891 0.811 19524 737 1 13 . 1 1 29 29 CYS H H 29 8.538 8.538 9.047 -0.509 19524 738 1 13 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.081 -0.132 19524 739 1 13 . 1 1 30 30 VAL H H 30 9.518 9.518 8.512 1.006 19524 740 1 13 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.042 -0.485 19524 741 1 13 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.714 -0.449 19524 742 1 14 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.271 0.127 19524 743 1 14 . 1 1 2 2 ALA H H 2 8.375 8.375 8.868 -0.493 19524 744 1 14 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.601 0.087 19524 745 1 14 . 1 1 3 3 PHE H H 3 8.033 8.033 7.390 0.643 19524 746 1 14 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.619 -0.204 19524 747 1 14 . 1 1 4 4 CYS H H 4 8.130 8.130 8.053 0.077 19524 748 1 14 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.788 0.037 19524 749 1 14 . 1 1 5 5 ASN H H 5 8.745 8.745 9.130 -0.385 19524 750 1 14 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.460 -0.468 19524 751 1 14 . 1 1 6 6 LEU H H 6 8.757 8.757 7.923 0.834 19524 752 1 14 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.644 -0.587 19524 753 1 14 . 1 1 7 7 ARG H H 7 8.315 8.315 8.399 -0.084 19524 754 1 14 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.010 0.113 19524 755 1 14 . 1 1 8 8 ALA H H 8 7.903 7.903 8.287 -0.384 19524 756 1 14 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.358 0.287 19524 757 1 14 . 1 1 9 9 CYS H H 9 8.687 8.687 8.721 -0.034 19524 758 1 14 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.248 -0.423 19524 759 1 14 . 1 1 10 10 GLU H H 10 9.036 9.036 8.155 0.881 19524 760 1 14 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.914 0.203 19524 761 1 14 . 1 1 11 11 LEU H H 11 8.153 8.153 8.412 -0.259 19524 762 1 14 . 1 1 12 12 SER HA H 12 4.306 4.306 4.446 -0.140 19524 763 1 14 . 1 1 12 12 SER H H 12 8.396 8.396 8.014 0.382 19524 764 1 14 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.373 0.127 19524 765 1 14 . 1 1 13 13 CYS H H 13 8.318 8.318 7.535 0.783 19524 766 1 14 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.194 0.291 19524 767 1 14 . 1 1 14 14 ARG H H 14 8.329 8.329 8.860 -0.531 19524 768 1 14 . 1 1 15 15 SER HA H 15 4.397 4.397 4.161 0.236 19524 769 1 14 . 1 1 15 15 SER H H 15 7.731 7.731 8.296 -0.565 19524 770 1 14 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.105 0.471 19524 771 1 14 . 1 1 16 16 LEU H H 16 7.407 7.407 7.747 -0.340 19524 772 1 14 . 1 1 17 17 GLY H H 17 8.175 8.175 7.799 0.376 19524 773 1 14 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.942 0.724 19524 774 1 14 . 1 1 18 18 LEU H H 18 7.463 7.463 7.523 -0.060 19524 775 1 14 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.446 -0.129 19524 776 1 14 . 1 1 19 19 LEU H H 19 8.641 8.641 8.033 0.608 19524 777 1 14 . 1 1 20 20 GLY H H 20 8.023 8.023 8.602 -0.579 19524 778 1 14 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.900 -0.509 19524 779 1 14 . 1 1 21 21 LYS H H 21 8.872 8.872 9.278 -0.406 19524 780 1 14 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.833 0.464 19524 781 1 14 . 1 1 22 22 CYS H H 22 8.234 8.234 8.880 -0.646 19524 782 1 14 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.755 -0.482 19524 783 1 14 . 1 1 23 23 ILE H H 23 9.047 9.047 8.717 0.330 19524 784 1 14 . 1 1 24 24 GLY H H 24 9.017 9.017 8.998 0.019 19524 785 1 14 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.971 0.197 19524 786 1 14 . 1 1 25 25 GLU H H 25 8.825 8.825 9.098 -0.273 19524 787 1 14 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.873 0.672 19524 788 1 14 . 1 1 26 26 GLU H H 26 7.717 7.717 8.743 -1.026 19524 789 1 14 . 1 1 27 27 CYS HA H 27 5.037 5.037 5.129 -0.092 19524 790 1 14 . 1 1 27 27 CYS H H 27 8.707 8.707 7.554 1.153 19524 791 1 14 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.031 -0.348 19524 792 1 14 . 1 1 28 28 LYS H H 28 9.491 9.491 8.683 0.808 19524 793 1 14 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.893 0.809 19524 794 1 14 . 1 1 29 29 CYS H H 29 8.538 8.538 9.099 -0.561 19524 795 1 14 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.116 -0.167 19524 796 1 14 . 1 1 30 30 VAL H H 30 9.518 9.518 8.582 0.936 19524 797 1 14 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.095 -0.538 19524 798 1 14 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.836 -0.571 19524 799 1 15 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.263 0.135 19524 800 1 15 . 1 1 2 2 ALA H H 2 8.375 8.375 8.460 -0.085 19524 801 1 15 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.372 0.316 19524 802 1 15 . 1 1 3 3 PHE H H 3 8.033 8.033 8.224 -0.191 19524 803 1 15 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.053 0.362 19524 804 1 15 . 1 1 4 4 CYS H H 4 8.130 8.130 8.245 -0.115 19524 805 1 15 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.845 -0.020 19524 806 1 15 . 1 1 5 5 ASN H H 5 8.745 8.745 6.858 1.887 19524 807 1 15 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.605 -0.613 19524 808 1 15 . 1 1 6 6 LEU H H 6 8.757 8.757 8.189 0.568 19524 809 1 15 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.632 -0.575 19524 810 1 15 . 1 1 7 7 ARG H H 7 8.315 8.315 8.390 -0.075 19524 811 1 15 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.969 0.154 19524 812 1 15 . 1 1 8 8 ALA H H 8 7.903 7.903 8.145 -0.242 19524 813 1 15 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.306 0.339 19524 814 1 15 . 1 1 9 9 CYS H H 9 8.687 8.687 8.822 -0.135 19524 815 1 15 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.247 -0.422 19524 816 1 15 . 1 1 10 10 GLU H H 10 9.036 9.036 8.139 0.897 19524 817 1 15 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.945 0.172 19524 818 1 15 . 1 1 11 11 LEU H H 11 8.153 8.153 8.436 -0.283 19524 819 1 15 . 1 1 12 12 SER HA H 12 4.306 4.306 4.437 -0.131 19524 820 1 15 . 1 1 12 12 SER H H 12 8.396 8.396 7.954 0.442 19524 821 1 15 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.368 0.132 19524 822 1 15 . 1 1 13 13 CYS H H 13 8.318 8.318 7.487 0.831 19524 823 1 15 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.439 0.046 19524 824 1 15 . 1 1 14 14 ARG H H 14 8.329 8.329 8.403 -0.074 19524 825 1 15 . 1 1 15 15 SER HA H 15 4.397 4.397 3.972 0.425 19524 826 1 15 . 1 1 15 15 SER H H 15 7.731 7.731 8.397 -0.666 19524 827 1 15 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.105 0.471 19524 828 1 15 . 1 1 16 16 LEU H H 16 7.407 7.407 8.159 -0.752 19524 829 1 15 . 1 1 17 17 GLY H H 17 8.175 8.175 7.725 0.450 19524 830 1 15 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.619 1.047 19524 831 1 15 . 1 1 18 18 LEU H H 18 7.463 7.463 7.460 0.003 19524 832 1 15 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.814 -0.497 19524 833 1 15 . 1 1 19 19 LEU H H 19 8.641 8.641 7.948 0.693 19524 834 1 15 . 1 1 20 20 GLY H H 20 8.023 8.023 8.861 -0.838 19524 835 1 15 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.916 -0.525 19524 836 1 15 . 1 1 21 21 LYS H H 21 8.872 8.872 9.196 -0.324 19524 837 1 15 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.710 0.587 19524 838 1 15 . 1 1 22 22 CYS H H 22 8.234 8.234 8.719 -0.485 19524 839 1 15 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.994 -0.721 19524 840 1 15 . 1 1 23 23 ILE H H 23 9.047 9.047 8.457 0.590 19524 841 1 15 . 1 1 24 24 GLY H H 24 9.017 9.017 9.153 -0.136 19524 842 1 15 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.966 0.202 19524 843 1 15 . 1 1 25 25 GLU H H 25 8.825 8.825 9.012 -0.187 19524 844 1 15 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.758 0.787 19524 845 1 15 . 1 1 26 26 GLU H H 26 7.717 7.717 8.814 -1.097 19524 846 1 15 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.669 0.368 19524 847 1 15 . 1 1 27 27 CYS H H 27 8.707 8.707 7.482 1.225 19524 848 1 15 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.691 -0.008 19524 849 1 15 . 1 1 28 28 LYS H H 28 9.491 9.491 8.769 0.722 19524 850 1 15 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.891 0.811 19524 851 1 15 . 1 1 29 29 CYS H H 29 8.538 8.538 9.157 -0.619 19524 852 1 15 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.134 -0.185 19524 853 1 15 . 1 1 30 30 VAL H H 30 9.518 9.518 8.573 0.945 19524 854 1 15 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.130 -0.573 19524 855 1 15 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.771 -0.506 19524 856 1 16 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.450 -0.052 19524 857 1 16 . 1 1 2 2 ALA H H 2 8.375 8.375 8.505 -0.130 19524 858 1 16 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.672 0.016 19524 859 1 16 . 1 1 3 3 PHE H H 3 8.033 8.033 8.026 0.007 19524 860 1 16 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.792 -0.377 19524 861 1 16 . 1 1 4 4 CYS H H 4 8.130 8.130 8.299 -0.169 19524 862 1 16 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.045 -0.220 19524 863 1 16 . 1 1 5 5 ASN H H 5 8.745 8.745 8.790 -0.045 19524 864 1 16 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.356 -0.364 19524 865 1 16 . 1 1 6 6 LEU H H 6 8.757 8.757 8.377 0.380 19524 866 1 16 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.625 -0.568 19524 867 1 16 . 1 1 7 7 ARG H H 7 8.315 8.315 8.503 -0.188 19524 868 1 16 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.970 0.153 19524 869 1 16 . 1 1 8 8 ALA H H 8 7.903 7.903 8.068 -0.165 19524 870 1 16 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.221 0.424 19524 871 1 16 . 1 1 9 9 CYS H H 9 8.687 8.687 9.026 -0.339 19524 872 1 16 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.179 -0.354 19524 873 1 16 . 1 1 10 10 GLU H H 10 9.036 9.036 8.498 0.538 19524 874 1 16 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.958 0.159 19524 875 1 16 . 1 1 11 11 LEU H H 11 8.153 8.153 8.446 -0.293 19524 876 1 16 . 1 1 12 12 SER HA H 12 4.306 4.306 4.133 0.173 19524 877 1 16 . 1 1 12 12 SER H H 12 8.396 8.396 8.618 -0.222 19524 878 1 16 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.259 0.241 19524 879 1 16 . 1 1 13 13 CYS H H 13 8.318 8.318 7.882 0.436 19524 880 1 16 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.350 0.135 19524 881 1 16 . 1 1 14 14 ARG H H 14 8.329 8.329 8.482 -0.153 19524 882 1 16 . 1 1 15 15 SER HA H 15 4.397 4.397 4.059 0.338 19524 883 1 16 . 1 1 15 15 SER H H 15 7.731 7.731 8.542 -0.811 19524 884 1 16 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.090 0.486 19524 885 1 16 . 1 1 16 16 LEU H H 16 7.407 7.407 7.828 -0.421 19524 886 1 16 . 1 1 17 17 GLY H H 17 8.175 8.175 7.957 0.218 19524 887 1 16 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.704 0.962 19524 888 1 16 . 1 1 18 18 LEU H H 18 7.463 7.463 7.498 -0.035 19524 889 1 16 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.404 -0.087 19524 890 1 16 . 1 1 19 19 LEU H H 19 8.641 8.641 7.954 0.687 19524 891 1 16 . 1 1 20 20 GLY H H 20 8.023 8.023 8.697 -0.674 19524 892 1 16 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.994 -0.603 19524 893 1 16 . 1 1 21 21 LYS H H 21 8.872 8.872 9.310 -0.438 19524 894 1 16 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.907 0.390 19524 895 1 16 . 1 1 22 22 CYS H H 22 8.234 8.234 9.027 -0.793 19524 896 1 16 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.065 -0.792 19524 897 1 16 . 1 1 23 23 ILE H H 23 9.047 9.047 8.719 0.328 19524 898 1 16 . 1 1 24 24 GLY H H 24 9.017 9.017 8.851 0.166 19524 899 1 16 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.926 0.242 19524 900 1 16 . 1 1 25 25 GLU H H 25 8.825 8.825 9.043 -0.218 19524 901 1 16 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.769 0.776 19524 902 1 16 . 1 1 26 26 GLU H H 26 7.717 7.717 8.542 -0.825 19524 903 1 16 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.669 0.368 19524 904 1 16 . 1 1 27 27 CYS H H 27 8.707 8.707 7.446 1.261 19524 905 1 16 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.850 -0.167 19524 906 1 16 . 1 1 28 28 LYS H H 28 9.491 9.491 8.940 0.551 19524 907 1 16 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.936 0.766 19524 908 1 16 . 1 1 29 29 CYS H H 29 8.538 8.538 9.155 -0.617 19524 909 1 16 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.241 -0.292 19524 910 1 16 . 1 1 30 30 VAL H H 30 9.518 9.518 8.566 0.952 19524 911 1 16 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.136 -0.579 19524 912 1 16 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.767 -0.502 19524 913 1 17 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.303 0.095 19524 914 1 17 . 1 1 2 2 ALA H H 2 8.375 8.375 7.963 0.412 19524 915 1 17 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.774 -0.086 19524 916 1 17 . 1 1 3 3 PHE H H 3 8.033 8.033 8.011 0.022 19524 917 1 17 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.691 -0.276 19524 918 1 17 . 1 1 4 4 CYS H H 4 8.130 8.130 7.854 0.276 19524 919 1 17 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.890 -0.065 19524 920 1 17 . 1 1 5 5 ASN H H 5 8.745 8.745 9.077 -0.332 19524 921 1 17 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.287 -0.295 19524 922 1 17 . 1 1 6 6 LEU H H 6 8.757 8.757 8.083 0.674 19524 923 1 17 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.454 -0.397 19524 924 1 17 . 1 1 7 7 ARG H H 7 8.315 8.315 8.475 -0.160 19524 925 1 17 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.149 -0.026 19524 926 1 17 . 1 1 8 8 ALA H H 8 7.903 7.903 8.161 -0.258 19524 927 1 17 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.636 0.009 19524 928 1 17 . 1 1 9 9 CYS H H 9 8.687 8.687 7.955 0.732 19524 929 1 17 . 1 1 10 10 GLU HA H 10 3.825 3.825 3.957 -0.132 19524 930 1 17 . 1 1 10 10 GLU H H 10 9.036 9.036 7.953 1.083 19524 931 1 17 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.968 0.149 19524 932 1 17 . 1 1 11 11 LEU H H 11 8.153 8.153 8.515 -0.362 19524 933 1 17 . 1 1 12 12 SER HA H 12 4.306 4.306 4.230 0.076 19524 934 1 17 . 1 1 12 12 SER H H 12 8.396 8.396 7.520 0.876 19524 935 1 17 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.282 0.218 19524 936 1 17 . 1 1 13 13 CYS H H 13 8.318 8.318 7.264 1.054 19524 937 1 17 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.255 0.230 19524 938 1 17 . 1 1 14 14 ARG H H 14 8.329 8.329 8.897 -0.568 19524 939 1 17 . 1 1 15 15 SER HA H 15 4.397 4.397 4.372 0.025 19524 940 1 17 . 1 1 15 15 SER H H 15 7.731 7.731 7.897 -0.166 19524 941 1 17 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.046 0.530 19524 942 1 17 . 1 1 16 16 LEU H H 16 7.407 7.407 7.789 -0.382 19524 943 1 17 . 1 1 17 17 GLY H H 17 8.175 8.175 7.814 0.361 19524 944 1 17 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.932 0.734 19524 945 1 17 . 1 1 18 18 LEU H H 18 7.463 7.463 7.644 -0.180 19524 946 1 17 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.991 -0.674 19524 947 1 17 . 1 1 19 19 LEU H H 19 8.641 8.641 8.007 0.634 19524 948 1 17 . 1 1 20 20 GLY H H 20 8.023 8.023 8.856 -0.833 19524 949 1 17 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.686 -0.295 19524 950 1 17 . 1 1 21 21 LYS H H 21 8.872 8.872 8.262 0.610 19524 951 1 17 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.888 0.409 19524 952 1 17 . 1 1 22 22 CYS H H 22 8.234 8.234 8.952 -0.718 19524 953 1 17 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.742 -0.469 19524 954 1 17 . 1 1 23 23 ILE H H 23 9.047 9.047 8.830 0.217 19524 955 1 17 . 1 1 24 24 GLY H H 24 9.017 9.017 9.165 -0.148 19524 956 1 17 . 1 1 25 25 GLU HA H 25 4.168 4.168 4.029 0.139 19524 957 1 17 . 1 1 25 25 GLU H H 25 8.825 8.825 8.789 0.036 19524 958 1 17 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.860 0.685 19524 959 1 17 . 1 1 26 26 GLU H H 26 7.717 7.717 8.815 -1.098 19524 960 1 17 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.714 0.323 19524 961 1 17 . 1 1 27 27 CYS H H 27 8.707 8.707 7.423 1.284 19524 962 1 17 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.235 -0.552 19524 963 1 17 . 1 1 28 28 LYS H H 28 9.491 9.491 8.734 0.757 19524 964 1 17 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.935 0.767 19524 965 1 17 . 1 1 29 29 CYS H H 29 8.538 8.538 8.907 -0.369 19524 966 1 17 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.201 -0.252 19524 967 1 17 . 1 1 30 30 VAL H H 30 9.518 9.518 8.400 1.118 19524 968 1 17 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.112 -0.555 19524 969 1 17 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.736 -0.471 19524 970 1 18 . 1 1 2 2 ALA HA H 2 4.398 4.398 3.938 0.460 19524 971 1 18 . 1 1 2 2 ALA H H 2 8.375 8.375 8.184 0.191 19524 972 1 18 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.189 0.499 19524 973 1 18 . 1 1 3 3 PHE H H 3 8.033 8.033 8.731 -0.698 19524 974 1 18 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.773 -0.358 19524 975 1 18 . 1 1 4 4 CYS H H 4 8.130 8.130 7.455 0.675 19524 976 1 18 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.480 0.345 19524 977 1 18 . 1 1 5 5 ASN H H 5 8.745 8.745 8.274 0.471 19524 978 1 18 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.587 -0.595 19524 979 1 18 . 1 1 6 6 LEU H H 6 8.757 8.757 8.398 0.359 19524 980 1 18 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.628 -0.571 19524 981 1 18 . 1 1 7 7 ARG H H 7 8.315 8.315 8.343 -0.028 19524 982 1 18 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.956 0.167 19524 983 1 18 . 1 1 8 8 ALA H H 8 7.903 7.903 7.968 -0.065 19524 984 1 18 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.190 0.455 19524 985 1 18 . 1 1 9 9 CYS H H 9 8.687 8.687 9.019 -0.332 19524 986 1 18 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.190 -0.365 19524 987 1 18 . 1 1 10 10 GLU H H 10 9.036 9.036 8.415 0.621 19524 988 1 18 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.959 0.158 19524 989 1 18 . 1 1 11 11 LEU H H 11 8.153 8.153 8.392 -0.239 19524 990 1 18 . 1 1 12 12 SER HA H 12 4.306 4.306 4.464 -0.158 19524 991 1 18 . 1 1 12 12 SER H H 12 8.396 8.396 7.961 0.435 19524 992 1 18 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.499 0.001 19524 993 1 18 . 1 1 13 13 CYS H H 13 8.318 8.318 7.534 0.784 19524 994 1 18 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.419 0.066 19524 995 1 18 . 1 1 14 14 ARG H H 14 8.329 8.329 8.469 -0.140 19524 996 1 18 . 1 1 15 15 SER HA H 15 4.397 4.397 4.114 0.283 19524 997 1 18 . 1 1 15 15 SER H H 15 7.731 7.731 8.487 -0.756 19524 998 1 18 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.130 0.446 19524 999 1 18 . 1 1 16 16 LEU H H 16 7.407 7.407 8.419 -1.012 19524 1000 1 18 . 1 1 17 17 GLY H H 17 8.175 8.175 7.767 0.408 19524 1001 1 18 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.939 0.727 19524 1002 1 18 . 1 1 18 18 LEU H H 18 7.463 7.463 7.762 -0.299 19524 1003 1 18 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.957 -0.640 19524 1004 1 18 . 1 1 19 19 LEU H H 19 8.641 8.641 8.196 0.445 19524 1005 1 18 . 1 1 20 20 GLY H H 20 8.023 8.023 8.730 -0.707 19524 1006 1 18 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.561 -0.170 19524 1007 1 18 . 1 1 21 21 LYS H H 21 8.872 8.872 8.897 -0.025 19524 1008 1 18 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.828 0.469 19524 1009 1 18 . 1 1 22 22 CYS H H 22 8.234 8.234 8.624 -0.390 19524 1010 1 18 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.499 -0.226 19524 1011 1 18 . 1 1 23 23 ILE H H 23 9.047 9.047 8.736 0.311 19524 1012 1 18 . 1 1 24 24 GLY H H 24 9.017 9.017 9.116 -0.099 19524 1013 1 18 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.942 0.226 19524 1014 1 18 . 1 1 25 25 GLU H H 25 8.825 8.825 8.990 -0.165 19524 1015 1 18 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.888 0.657 19524 1016 1 18 . 1 1 26 26 GLU H H 26 7.717 7.717 8.680 -0.963 19524 1017 1 18 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.721 0.317 19524 1018 1 18 . 1 1 27 27 CYS H H 27 8.707 8.707 7.538 1.169 19524 1019 1 18 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.826 -0.143 19524 1020 1 18 . 1 1 28 28 LYS H H 28 9.491 9.491 8.571 0.920 19524 1021 1 18 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.832 0.870 19524 1022 1 18 . 1 1 29 29 CYS H H 29 8.538 8.538 9.060 -0.522 19524 1023 1 18 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.225 -0.276 19524 1024 1 18 . 1 1 30 30 VAL H H 30 9.518 9.518 8.547 0.971 19524 1025 1 18 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.123 -0.566 19524 1026 1 18 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.788 -0.523 19524 1027 1 19 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.338 0.060 19524 1028 1 19 . 1 1 2 2 ALA H H 2 8.375 8.375 8.797 -0.422 19524 1029 1 19 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.537 0.151 19524 1030 1 19 . 1 1 3 3 PHE H H 3 8.033 8.033 7.698 0.335 19524 1031 1 19 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.580 -0.165 19524 1032 1 19 . 1 1 4 4 CYS H H 4 8.130 8.130 8.352 -0.222 19524 1033 1 19 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.720 0.105 19524 1034 1 19 . 1 1 5 5 ASN H H 5 8.745 8.745 8.681 0.064 19524 1035 1 19 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.589 -0.597 19524 1036 1 19 . 1 1 6 6 LEU H H 6 8.757 8.757 8.272 0.485 19524 1037 1 19 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.612 -0.555 19524 1038 1 19 . 1 1 7 7 ARG H H 7 8.315 8.315 8.349 -0.034 19524 1039 1 19 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.984 0.139 19524 1040 1 19 . 1 1 8 8 ALA H H 8 7.903 7.903 8.561 -0.658 19524 1041 1 19 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.135 0.510 19524 1042 1 19 . 1 1 9 9 CYS H H 9 8.687 8.687 8.926 -0.239 19524 1043 1 19 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.243 -0.418 19524 1044 1 19 . 1 1 10 10 GLU H H 10 9.036 9.036 8.325 0.711 19524 1045 1 19 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.931 0.186 19524 1046 1 19 . 1 1 11 11 LEU H H 11 8.153 8.153 8.472 -0.319 19524 1047 1 19 . 1 1 12 12 SER HA H 12 4.306 4.306 4.448 -0.142 19524 1048 1 19 . 1 1 12 12 SER H H 12 8.396 8.396 8.187 0.209 19524 1049 1 19 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.410 0.090 19524 1050 1 19 . 1 1 13 13 CYS H H 13 8.318 8.318 7.501 0.817 19524 1051 1 19 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.254 0.231 19524 1052 1 19 . 1 1 14 14 ARG H H 14 8.329 8.329 8.804 -0.475 19524 1053 1 19 . 1 1 15 15 SER HA H 15 4.397 4.397 4.108 0.289 19524 1054 1 19 . 1 1 15 15 SER H H 15 7.731 7.731 8.274 -0.543 19524 1055 1 19 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.137 0.439 19524 1056 1 19 . 1 1 16 16 LEU H H 16 7.407 7.407 7.615 -0.208 19524 1057 1 19 . 1 1 17 17 GLY H H 17 8.175 8.175 7.857 0.318 19524 1058 1 19 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.959 0.707 19524 1059 1 19 . 1 1 18 18 LEU H H 18 7.463 7.463 7.294 0.169 19524 1060 1 19 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.460 -0.143 19524 1061 1 19 . 1 1 19 19 LEU H H 19 8.641 8.641 8.011 0.630 19524 1062 1 19 . 1 1 20 20 GLY H H 20 8.023 8.023 8.604 -0.581 19524 1063 1 19 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.880 -0.489 19524 1064 1 19 . 1 1 21 21 LYS H H 21 8.872 8.872 8.897 -0.025 19524 1065 1 19 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.690 0.607 19524 1066 1 19 . 1 1 22 22 CYS H H 22 8.234 8.234 8.751 -0.517 19524 1067 1 19 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.783 -0.510 19524 1068 1 19 . 1 1 23 23 ILE H H 23 9.047 9.047 8.617 0.430 19524 1069 1 19 . 1 1 24 24 GLY H H 24 9.017 9.017 9.142 -0.125 19524 1070 1 19 . 1 1 25 25 GLU HA H 25 4.168 4.168 4.038 0.130 19524 1071 1 19 . 1 1 25 25 GLU H H 25 8.825 8.825 8.854 -0.029 19524 1072 1 19 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.788 0.757 19524 1073 1 19 . 1 1 26 26 GLU H H 26 7.717 7.717 8.689 -0.972 19524 1074 1 19 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.702 0.335 19524 1075 1 19 . 1 1 27 27 CYS H H 27 8.707 8.707 7.555 1.152 19524 1076 1 19 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.838 -0.155 19524 1077 1 19 . 1 1 28 28 LYS H H 28 9.491 9.491 8.711 0.780 19524 1078 1 19 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.894 0.808 19524 1079 1 19 . 1 1 29 29 CYS H H 29 8.538 8.538 9.019 -0.481 19524 1080 1 19 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.219 -0.270 19524 1081 1 19 . 1 1 30 30 VAL H H 30 9.518 9.518 8.546 0.972 19524 1082 1 19 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.116 -0.559 19524 1083 1 19 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.799 -0.534 19524 1084 1 20 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.454 -0.056 19524 1085 1 20 . 1 1 2 2 ALA H H 2 8.375 8.375 8.359 0.016 19524 1086 1 20 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.456 0.232 19524 1087 1 20 . 1 1 3 3 PHE H H 3 8.033 8.033 7.602 0.431 19524 1088 1 20 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.789 -0.374 19524 1089 1 20 . 1 1 4 4 CYS H H 4 8.130 8.130 8.078 0.052 19524 1090 1 20 . 1 1 5 5 ASN HA H 5 4.825 4.825 5.067 -0.242 19524 1091 1 20 . 1 1 5 5 ASN H H 5 8.745 8.745 8.792 -0.047 19524 1092 1 20 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.540 -0.548 19524 1093 1 20 . 1 1 6 6 LEU H H 6 8.757 8.757 8.403 0.354 19524 1094 1 20 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.593 -0.536 19524 1095 1 20 . 1 1 7 7 ARG H H 7 8.315 8.315 8.675 -0.360 19524 1096 1 20 . 1 1 8 8 ALA HA H 8 4.123 4.123 3.948 0.175 19524 1097 1 20 . 1 1 8 8 ALA H H 8 7.903 7.903 8.177 -0.274 19524 1098 1 20 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.172 0.473 19524 1099 1 20 . 1 1 9 9 CYS H H 9 8.687 8.687 8.459 0.228 19524 1100 1 20 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.106 -0.281 19524 1101 1 20 . 1 1 10 10 GLU H H 10 9.036 9.036 7.953 1.083 19524 1102 1 20 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.939 0.178 19524 1103 1 20 . 1 1 11 11 LEU H H 11 8.153 8.153 8.379 -0.226 19524 1104 1 20 . 1 1 12 12 SER HA H 12 4.306 4.306 4.365 -0.059 19524 1105 1 20 . 1 1 12 12 SER H H 12 8.396 8.396 8.107 0.289 19524 1106 1 20 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.400 0.100 19524 1107 1 20 . 1 1 13 13 CYS H H 13 8.318 8.318 7.373 0.945 19524 1108 1 20 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.398 0.087 19524 1109 1 20 . 1 1 14 14 ARG H H 14 8.329 8.329 8.554 -0.225 19524 1110 1 20 . 1 1 15 15 SER HA H 15 4.397 4.397 4.197 0.200 19524 1111 1 20 . 1 1 15 15 SER H H 15 7.731 7.731 8.602 -0.871 19524 1112 1 20 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.109 0.467 19524 1113 1 20 . 1 1 16 16 LEU H H 16 7.407 7.407 7.865 -0.458 19524 1114 1 20 . 1 1 17 17 GLY H H 17 8.175 8.175 7.820 0.355 19524 1115 1 20 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.926 0.740 19524 1116 1 20 . 1 1 18 18 LEU H H 18 7.463 7.463 7.730 -0.267 19524 1117 1 20 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.783 -0.466 19524 1118 1 20 . 1 1 19 19 LEU H H 19 8.641 8.641 7.939 0.702 19524 1119 1 20 . 1 1 20 20 GLY H H 20 8.023 8.023 8.698 -0.675 19524 1120 1 20 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.808 -0.417 19524 1121 1 20 . 1 1 21 21 LYS H H 21 8.872 8.872 9.341 -0.469 19524 1122 1 20 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.773 0.524 19524 1123 1 20 . 1 1 22 22 CYS H H 22 8.234 8.234 8.795 -0.561 19524 1124 1 20 . 1 1 23 23 ILE HA H 23 4.273 4.273 5.000 -0.727 19524 1125 1 20 . 1 1 23 23 ILE H H 23 9.047 9.047 8.546 0.501 19524 1126 1 20 . 1 1 24 24 GLY H H 24 9.017 9.017 9.237 -0.220 19524 1127 1 20 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.947 0.221 19524 1128 1 20 . 1 1 25 25 GLU H H 25 8.825 8.825 9.274 -0.449 19524 1129 1 20 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.893 0.652 19524 1130 1 20 . 1 1 26 26 GLU H H 26 7.717 7.717 8.832 -1.115 19524 1131 1 20 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.725 0.312 19524 1132 1 20 . 1 1 27 27 CYS H H 27 8.707 8.707 7.613 1.094 19524 1133 1 20 . 1 1 28 28 LYS HA H 28 4.683 4.683 5.033 -0.350 19524 1134 1 20 . 1 1 28 28 LYS H H 28 9.491 9.491 8.582 0.909 19524 1135 1 20 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.888 0.814 19524 1136 1 20 . 1 1 29 29 CYS H H 29 8.538 8.538 9.001 -0.463 19524 1137 1 20 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.204 -0.255 19524 1138 1 20 . 1 1 30 30 VAL H H 30 9.518 9.518 8.539 0.979 19524 1139 1 20 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.164 -0.607 19524 1140 1 20 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.750 -0.485 19524 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 19524 2 1 1 "Average Difference" HA 34 0.480 -0.017 0.487 19524 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19524 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19524 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19524 6 1 1 "Average Difference" HN 29 0.561 -0.061 0.568 19524 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19524 8 1 2 "Average Difference" HA 34 0.480 -0.034 0.486 19524 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19524 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19524 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19524 12 1 2 "Average Difference" HN 29 0.582 -0.091 0.585 19524 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19524 14 1 3 "Average Difference" HA 34 0.514 0.040 0.520 19524 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19524 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19524 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19524 18 1 3 "Average Difference" HN 29 0.601 -0.030 0.611 19524 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19524 20 1 4 "Average Difference" HA 34 0.494 0.044 0.499 19524 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19524 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19524 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19524 24 1 4 "Average Difference" HN 29 0.533 -0.077 0.537 19524 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19524 26 1 5 "Average Difference" HA 34 0.506 0.022 0.514 19524 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19524 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19524 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19524 30 1 5 "Average Difference" HN 29 0.588 -0.069 0.594 19524 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19524 32 1 6 "Average Difference" HA 34 0.479 -0.023 0.486 19524 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19524 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19524 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19524 36 1 6 "Average Difference" HN 29 0.583 -0.024 0.593 19524 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19524 38 1 7 "Average Difference" HA 34 0.489 -0.003 0.497 19524 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19524 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19524 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19524 42 1 7 "Average Difference" HN 29 0.617 -0.097 0.621 19524 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19524 44 1 8 "Average Difference" HA 34 0.508 0.047 0.513 19524 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19524 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19524 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19524 48 1 8 "Average Difference" HN 29 0.598 -0.100 0.600 19524 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19524 50 1 9 "Average Difference" HA 34 0.470 0.020 0.476 19524 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19524 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19524 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19524 54 1 9 "Average Difference" HN 29 0.667 -0.145 0.662 19524 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19524 56 1 10 "Average Difference" HA 34 0.511 -0.004 0.519 19524 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19524 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19524 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19524 60 1 10 "Average Difference" HN 29 0.573 -0.043 0.581 19524 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19524 62 1 11 "Average Difference" HA 34 0.483 0.019 0.490 19524 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19524 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19524 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19524 66 1 11 "Average Difference" HN 29 0.597 -0.128 0.594 19524 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19524 68 1 12 "Average Difference" HA 34 0.487 0.067 0.490 19524 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19524 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19524 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19524 72 1 12 "Average Difference" HN 29 0.600 -0.038 0.609 19524 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19524 74 1 13 "Average Difference" HA 34 0.469 0.017 0.476 19524 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19524 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19524 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19524 78 1 13 "Average Difference" HN 29 0.630 -0.045 0.639 19524 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19524 80 1 14 "Average Difference" HA 34 0.465 0.023 0.472 19524 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19524 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19524 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19524 84 1 14 "Average Difference" HN 29 0.582 -0.042 0.591 19524 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19524 86 1 15 "Average Difference" HA 34 0.520 -0.015 0.528 19524 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19524 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19524 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19524 90 1 15 "Average Difference" HN 29 0.681 -0.102 0.685 19524 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19524 92 1 16 "Average Difference" HA 34 0.513 0.035 0.519 19524 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19524 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19524 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19524 96 1 16 "Average Difference" HN 29 0.515 0.035 0.523 19524 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19524 98 1 17 "Average Difference" HA 34 0.457 0.033 0.462 19524 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19524 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19524 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19524 102 1 17 "Average Difference" HN 29 0.647 -0.158 0.639 19524 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19524 104 1 18 "Average Difference" HA 34 0.495 0.002 0.502 19524 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19524 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19524 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19524 108 1 18 "Average Difference" HN 29 0.584 -0.045 0.593 19524 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19524 110 1 19 "Average Difference" HA 34 0.480 -0.008 0.488 19524 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19524 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19524 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19524 114 1 19 "Average Difference" HN 29 0.536 -0.042 0.544 19524 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19524 116 1 20 "Average Difference" HA 34 0.490 0.041 0.496 19524 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19524 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19524 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19524 120 1 20 "Average Difference" HN 29 0.599 -0.043 0.608 19524 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 19524 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 ALA HA H 2 4.398 4.398 4.216 0.182 19524 2 1 . 1 1 2 2 ALA H H 2 8.375 8.375 8.555 -0.180 19524 3 1 . 1 1 3 3 PHE HA H 3 4.688 4.688 4.574 0.114 19524 4 1 . 1 1 3 3 PHE H H 3 8.033 8.033 7.971 0.062 19524 5 1 . 1 1 4 4 CYS HA H 4 4.415 4.415 4.560 -0.145 19524 6 1 . 1 1 4 4 CYS H H 4 8.130 8.130 8.011 0.119 19524 7 1 . 1 1 5 5 ASN HA H 5 4.825 4.825 4.849 -0.024 19524 8 1 . 1 1 5 5 ASN H H 5 8.745 8.745 8.379 0.366 19524 9 1 . 1 1 6 6 LEU HA H 6 3.992 3.992 4.472 -0.480 19524 10 1 . 1 1 6 6 LEU H H 6 8.757 8.757 8.250 0.507 19524 11 1 . 1 1 7 7 ARG HA H 7 4.057 4.057 4.576 -0.519 19524 12 1 . 1 1 7 7 ARG H H 7 8.315 8.315 8.524 -0.209 19524 13 1 . 1 1 8 8 ALA HA H 8 4.123 4.123 4.018 0.105 19524 14 1 . 1 1 8 8 ALA H H 8 7.903 7.903 8.290 -0.387 19524 15 1 . 1 1 9 9 CYS HA H 9 4.645 4.645 4.314 0.331 19524 16 1 . 1 1 9 9 CYS H H 9 8.687 8.687 8.588 0.099 19524 17 1 . 1 1 10 10 GLU HA H 10 3.825 3.825 4.128 -0.303 19524 18 1 . 1 1 10 10 GLU H H 10 9.036 9.036 8.176 0.860 19524 19 1 . 1 1 11 11 LEU HA H 11 4.117 4.117 3.966 0.151 19524 20 1 . 1 1 11 11 LEU H H 11 8.153 8.153 8.450 -0.297 19524 21 1 . 1 1 12 12 SER HA H 12 4.306 4.306 4.358 -0.052 19524 22 1 . 1 1 12 12 SER H H 12 8.396 8.396 8.021 0.375 19524 23 1 . 1 1 13 13 CYS HA H 13 4.500 4.500 4.374 0.126 19524 24 1 . 1 1 13 13 CYS H H 13 8.318 8.318 7.554 0.764 19524 25 1 . 1 1 14 14 ARG HA H 14 4.485 4.485 4.317 0.167 19524 26 1 . 1 1 14 14 ARG H H 14 8.329 8.329 8.612 -0.283 19524 27 1 . 1 1 15 15 SER HA H 15 4.397 4.397 4.173 0.224 19524 28 1 . 1 1 15 15 SER H H 15 7.731 7.731 8.341 -0.610 19524 29 1 . 1 1 16 16 LEU HA H 16 4.576 4.576 4.111 0.465 19524 30 1 . 1 1 16 16 LEU H H 16 7.407 7.407 7.880 -0.473 19524 31 1 . 1 1 17 17 GLY H H 17 8.175 8.175 7.764 0.411 19524 32 1 . 1 1 18 18 LEU HA H 18 4.666 4.666 3.890 0.776 19524 33 1 . 1 1 18 18 LEU H H 18 7.463 7.463 7.623 -0.160 19524 34 1 . 1 1 19 19 LEU HA H 19 4.317 4.317 4.677 -0.360 19524 35 1 . 1 1 19 19 LEU H H 19 8.641 8.641 7.988 0.653 19524 36 1 . 1 1 20 20 GLY H H 20 8.023 8.023 8.692 -0.669 19524 37 1 . 1 1 21 21 LYS HA H 21 4.391 4.391 4.876 -0.485 19524 38 1 . 1 1 21 21 LYS H H 21 8.872 8.872 8.998 -0.126 19524 39 1 . 1 1 22 22 CYS HA H 22 5.297 5.297 4.808 0.489 19524 40 1 . 1 1 22 22 CYS H H 22 8.234 8.234 8.798 -0.564 19524 41 1 . 1 1 23 23 ILE HA H 23 4.273 4.273 4.845 -0.572 19524 42 1 . 1 1 23 23 ILE H H 23 9.047 9.047 8.666 0.381 19524 43 1 . 1 1 24 24 GLY H H 24 9.017 9.017 9.026 -0.009 19524 44 1 . 1 1 25 25 GLU HA H 25 4.168 4.168 3.972 0.196 19524 45 1 . 1 1 25 25 GLU H H 25 8.825 8.825 8.940 -0.115 19524 46 1 . 1 1 26 26 GLU HA H 26 4.545 4.545 3.812 0.733 19524 47 1 . 1 1 26 26 GLU H H 26 7.717 7.717 8.641 -0.924 19524 48 1 . 1 1 27 27 CYS HA H 27 5.037 5.037 4.731 0.306 19524 49 1 . 1 1 27 27 CYS H H 27 8.707 8.707 7.552 1.155 19524 50 1 . 1 1 28 28 LYS HA H 28 4.683 4.683 4.876 -0.193 19524 51 1 . 1 1 28 28 LYS H H 28 9.491 9.491 8.741 0.750 19524 52 1 . 1 1 29 29 CYS HA H 29 5.702 5.702 4.885 0.817 19524 53 1 . 1 1 29 29 CYS H H 29 8.538 8.538 9.046 -0.508 19524 54 1 . 1 1 30 30 VAL HA H 30 4.949 4.949 5.182 -0.233 19524 55 1 . 1 1 30 30 VAL H H 30 9.518 9.518 8.558 0.960 19524 56 1 . 1 1 31 31 PRO HA H 31 4.557 4.557 5.120 -0.563 19524 57 1 . 1 1 32 32 TYR HA H 32 4.265 4.265 4.771 -0.506 19524 stop_ save_