data_18513 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18513 _Entry.PDB_ID 2LU9 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 18513 _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 PHE HA H 2 4.688 4.688 4.811 -0.123 18513 2 1 1 . 1 1 2 2 PHE H H 2 8.466 8.466 8.186 0.280 18513 3 1 1 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.554 -0.166 18513 4 1 1 . 1 1 3 3 CYS H H 3 8.244 8.244 7.189 1.055 18513 5 1 1 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.884 -0.072 18513 6 1 1 . 1 1 4 4 ASN H H 4 8.692 8.692 9.023 -0.331 18513 7 1 1 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.056 -0.077 18513 8 1 1 . 1 1 5 5 LEU H H 5 8.793 8.793 7.980 0.813 18513 9 1 1 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.045 0.032 18513 10 1 1 . 1 1 6 6 ARG H H 6 8.302 8.302 8.317 -0.015 18513 11 1 1 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.060 -0.038 18513 12 1 1 . 1 1 7 7 ARG H H 7 7.997 7.997 8.234 -0.237 18513 13 1 1 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.433 0.195 18513 14 1 1 . 1 1 8 8 CYS H H 8 8.695 8.695 7.575 1.120 18513 15 1 1 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.065 -0.263 18513 16 1 1 . 1 1 9 9 GLU H H 9 9.049 9.049 8.363 0.686 18513 17 1 1 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.316 -0.223 18513 18 1 1 . 1 1 10 10 LEU H H 10 8.094 8.094 8.109 -0.015 18513 19 1 1 . 1 1 11 11 SER HA H 11 4.297 4.297 4.580 -0.283 18513 20 1 1 . 1 1 11 11 SER H H 11 8.451 8.451 7.664 0.787 18513 21 1 1 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.531 -0.044 18513 22 1 1 . 1 1 12 12 CYS H H 12 8.280 8.280 8.139 0.141 18513 23 1 1 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.362 0.120 18513 24 1 1 . 1 1 13 13 ARG H H 13 8.321 8.321 8.300 0.021 18513 25 1 1 . 1 1 14 14 SER HA H 14 4.384 4.384 4.262 0.122 18513 26 1 1 . 1 1 14 14 SER H H 14 7.714 7.714 8.445 -0.731 18513 27 1 1 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.416 0.136 18513 28 1 1 . 1 1 15 15 LEU H H 15 7.395 7.395 7.551 -0.156 18513 29 1 1 . 1 1 16 16 GLY H H 16 8.161 8.161 7.894 0.267 18513 30 1 1 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.987 -0.332 18513 31 1 1 . 1 1 17 17 LEU H H 17 7.435 7.435 7.317 0.118 18513 32 1 1 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.642 -0.319 18513 33 1 1 . 1 1 18 18 LEU H H 18 8.630 8.630 8.255 0.375 18513 34 1 1 . 1 1 19 19 GLY H H 19 8.039 8.039 8.521 -0.482 18513 35 1 1 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.541 -0.156 18513 36 1 1 . 1 1 20 20 LYS H H 20 8.847 8.847 8.808 0.039 18513 37 1 1 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.372 0.916 18513 38 1 1 . 1 1 21 21 CYS H H 21 8.242 8.242 8.928 -0.686 18513 39 1 1 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.241 0.025 18513 40 1 1 . 1 1 22 22 ILE H H 22 9.030 9.030 8.913 0.117 18513 41 1 1 . 1 1 23 23 GLY H H 23 9.026 9.026 7.860 1.166 18513 42 1 1 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.689 -0.542 18513 43 1 1 . 1 1 24 24 GLU H H 24 8.856 8.856 8.066 0.790 18513 44 1 1 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.551 -0.024 18513 45 1 1 . 1 1 25 25 GLU H H 25 7.716 7.716 7.580 0.136 18513 46 1 1 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.120 -0.090 18513 47 1 1 . 1 1 26 26 CYS H H 26 8.670 8.670 8.663 0.007 18513 48 1 1 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.726 -0.062 18513 49 1 1 . 1 1 27 27 LYS H H 27 9.497 9.497 8.554 0.943 18513 50 1 1 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.575 0.122 18513 51 1 1 . 1 1 28 28 CYS H H 28 8.533 8.533 8.428 0.105 18513 52 1 1 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.757 0.178 18513 53 1 1 . 1 1 29 29 VAL H H 29 9.508 9.508 8.965 0.543 18513 54 1 2 . 1 1 2 2 PHE HA H 2 4.688 4.688 5.037 -0.349 18513 55 1 2 . 1 1 2 2 PHE H H 2 8.466 8.466 7.233 1.233 18513 56 1 2 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.559 -0.171 18513 57 1 2 . 1 1 3 3 CYS H H 3 8.244 8.244 8.396 -0.152 18513 58 1 2 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.796 0.016 18513 59 1 2 . 1 1 4 4 ASN H H 4 8.692 8.692 8.963 -0.271 18513 60 1 2 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.161 -0.182 18513 61 1 2 . 1 1 5 5 LEU H H 5 8.793 8.793 8.196 0.597 18513 62 1 2 . 1 1 6 6 ARG HA H 6 4.077 4.077 3.970 0.107 18513 63 1 2 . 1 1 6 6 ARG H H 6 8.302 8.302 8.560 -0.258 18513 64 1 2 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.237 -0.215 18513 65 1 2 . 1 1 7 7 ARG H H 7 7.997 7.997 7.673 0.324 18513 66 1 2 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.075 0.553 18513 67 1 2 . 1 1 8 8 CYS H H 8 8.695 8.695 8.258 0.437 18513 68 1 2 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.098 -0.296 18513 69 1 2 . 1 1 9 9 GLU H H 9 9.049 9.049 8.631 0.418 18513 70 1 2 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.185 -0.092 18513 71 1 2 . 1 1 10 10 LEU H H 10 8.094 8.094 7.642 0.452 18513 72 1 2 . 1 1 11 11 SER HA H 11 4.297 4.297 4.459 -0.162 18513 73 1 2 . 1 1 11 11 SER H H 11 8.451 8.451 7.637 0.814 18513 74 1 2 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.243 0.244 18513 75 1 2 . 1 1 12 12 CYS H H 12 8.280 8.280 8.767 -0.487 18513 76 1 2 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.305 0.177 18513 77 1 2 . 1 1 13 13 ARG H H 13 8.321 8.321 8.054 0.267 18513 78 1 2 . 1 1 14 14 SER HA H 14 4.384 4.384 4.238 0.146 18513 79 1 2 . 1 1 14 14 SER H H 14 7.714 7.714 7.803 -0.089 18513 80 1 2 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.583 -0.031 18513 81 1 2 . 1 1 15 15 LEU H H 15 7.395 7.395 7.528 -0.133 18513 82 1 2 . 1 1 16 16 GLY H H 16 8.161 8.161 7.676 0.485 18513 83 1 2 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.820 -0.165 18513 84 1 2 . 1 1 17 17 LEU H H 17 7.435 7.435 7.821 -0.386 18513 85 1 2 . 1 1 18 18 LEU HA H 18 4.323 4.323 5.072 -0.749 18513 86 1 2 . 1 1 18 18 LEU H H 18 8.630 8.630 9.033 -0.403 18513 87 1 2 . 1 1 19 19 GLY H H 19 8.039 8.039 9.433 -1.394 18513 88 1 2 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.704 -0.319 18513 89 1 2 . 1 1 20 20 LYS H H 20 8.847 8.847 8.934 -0.087 18513 90 1 2 . 1 1 21 21 CYS HA H 21 5.288 5.288 5.096 0.192 18513 91 1 2 . 1 1 21 21 CYS H H 21 8.242 8.242 8.987 -0.745 18513 92 1 2 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.630 -0.364 18513 93 1 2 . 1 1 22 22 ILE H H 22 9.030 9.030 9.055 -0.025 18513 94 1 2 . 1 1 23 23 GLY H H 23 9.026 9.026 7.672 1.354 18513 95 1 2 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.461 -0.314 18513 96 1 2 . 1 1 24 24 GLU H H 24 8.856 8.856 8.400 0.456 18513 97 1 2 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.598 -0.071 18513 98 1 2 . 1 1 25 25 GLU H H 25 7.716 7.716 8.084 -0.368 18513 99 1 2 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.299 -0.269 18513 100 1 2 . 1 1 26 26 CYS H H 26 8.670 8.670 8.638 0.032 18513 101 1 2 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.724 -0.060 18513 102 1 2 . 1 1 27 27 LYS H H 27 9.497 9.497 9.164 0.334 18513 103 1 2 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.737 -0.040 18513 104 1 2 . 1 1 28 28 CYS H H 28 8.533 8.533 8.547 -0.014 18513 105 1 2 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.750 0.185 18513 106 1 2 . 1 1 29 29 VAL H H 29 9.508 9.508 9.001 0.507 18513 107 1 3 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.851 -0.163 18513 108 1 3 . 1 1 2 2 PHE H H 2 8.466 8.466 7.593 0.873 18513 109 1 3 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.766 -0.378 18513 110 1 3 . 1 1 3 3 CYS H H 3 8.244 8.244 8.954 -0.710 18513 111 1 3 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.778 0.034 18513 112 1 3 . 1 1 4 4 ASN H H 4 8.692 8.692 9.080 -0.388 18513 113 1 3 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.093 -0.114 18513 114 1 3 . 1 1 5 5 LEU H H 5 8.793 8.793 8.034 0.759 18513 115 1 3 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.085 -0.008 18513 116 1 3 . 1 1 6 6 ARG H H 6 8.302 8.302 8.426 -0.124 18513 117 1 3 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.266 -0.244 18513 118 1 3 . 1 1 7 7 ARG H H 7 7.997 7.997 7.720 0.277 18513 119 1 3 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.202 0.426 18513 120 1 3 . 1 1 8 8 CYS H H 8 8.695 8.695 8.506 0.189 18513 121 1 3 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.985 -0.183 18513 122 1 3 . 1 1 9 9 GLU H H 9 9.049 9.049 8.226 0.823 18513 123 1 3 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.127 -0.034 18513 124 1 3 . 1 1 10 10 LEU H H 10 8.094 8.094 7.548 0.546 18513 125 1 3 . 1 1 11 11 SER HA H 11 4.297 4.297 4.136 0.161 18513 126 1 3 . 1 1 11 11 SER H H 11 8.451 8.451 8.057 0.394 18513 127 1 3 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.184 0.303 18513 128 1 3 . 1 1 12 12 CYS H H 12 8.280 8.280 8.369 -0.089 18513 129 1 3 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.031 0.451 18513 130 1 3 . 1 1 13 13 ARG H H 13 8.321 8.321 8.527 -0.206 18513 131 1 3 . 1 1 14 14 SER HA H 14 4.384 4.384 4.309 0.075 18513 132 1 3 . 1 1 14 14 SER H H 14 7.714 7.714 7.776 -0.062 18513 133 1 3 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.570 -0.018 18513 134 1 3 . 1 1 15 15 LEU H H 15 7.395 7.395 7.455 -0.060 18513 135 1 3 . 1 1 16 16 GLY H H 16 8.161 8.161 7.800 0.361 18513 136 1 3 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.756 -0.101 18513 137 1 3 . 1 1 17 17 LEU H H 17 7.435 7.435 7.900 -0.465 18513 138 1 3 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.420 -0.097 18513 139 1 3 . 1 1 18 18 LEU H H 18 8.630 8.630 8.576 0.054 18513 140 1 3 . 1 1 19 19 GLY H H 19 8.039 8.039 8.259 -0.220 18513 141 1 3 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.756 -0.371 18513 142 1 3 . 1 1 20 20 LYS H H 20 8.847 8.847 9.011 -0.164 18513 143 1 3 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.554 0.734 18513 144 1 3 . 1 1 21 21 CYS H H 21 8.242 8.242 9.065 -0.823 18513 145 1 3 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.461 -0.195 18513 146 1 3 . 1 1 22 22 ILE H H 22 9.030 9.030 8.753 0.277 18513 147 1 3 . 1 1 23 23 GLY H H 23 9.026 9.026 7.728 1.298 18513 148 1 3 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.699 -0.552 18513 149 1 3 . 1 1 24 24 GLU H H 24 8.856 8.856 8.316 0.540 18513 150 1 3 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.644 -0.117 18513 151 1 3 . 1 1 25 25 GLU H H 25 7.716 7.716 7.966 -0.250 18513 152 1 3 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.641 -0.611 18513 153 1 3 . 1 1 26 26 CYS H H 26 8.670 8.670 8.595 0.075 18513 154 1 3 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.753 -0.089 18513 155 1 3 . 1 1 27 27 LYS H H 27 9.497 9.497 8.940 0.557 18513 156 1 3 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.576 0.121 18513 157 1 3 . 1 1 28 28 CYS H H 28 8.533 8.533 8.528 0.005 18513 158 1 3 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.711 0.224 18513 159 1 3 . 1 1 29 29 VAL H H 29 9.508 9.508 8.792 0.716 18513 160 1 4 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.759 -0.071 18513 161 1 4 . 1 1 2 2 PHE H H 2 8.466 8.466 8.334 0.132 18513 162 1 4 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.408 -0.020 18513 163 1 4 . 1 1 3 3 CYS H H 3 8.244 8.244 8.059 0.185 18513 164 1 4 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.464 0.348 18513 165 1 4 . 1 1 4 4 ASN H H 4 8.692 8.692 8.760 -0.068 18513 166 1 4 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.051 -0.072 18513 167 1 4 . 1 1 5 5 LEU H H 5 8.793 8.793 7.736 1.057 18513 168 1 4 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.128 -0.051 18513 169 1 4 . 1 1 6 6 ARG H H 6 8.302 8.302 8.292 0.010 18513 170 1 4 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.076 -0.054 18513 171 1 4 . 1 1 7 7 ARG H H 7 7.997 7.997 8.121 -0.124 18513 172 1 4 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.238 0.390 18513 173 1 4 . 1 1 8 8 CYS H H 8 8.695 8.695 8.242 0.453 18513 174 1 4 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.051 -0.249 18513 175 1 4 . 1 1 9 9 GLU H H 9 9.049 9.049 8.016 1.033 18513 176 1 4 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.226 -0.133 18513 177 1 4 . 1 1 10 10 LEU H H 10 8.094 8.094 7.839 0.255 18513 178 1 4 . 1 1 11 11 SER HA H 11 4.297 4.297 4.505 -0.208 18513 179 1 4 . 1 1 11 11 SER H H 11 8.451 8.451 7.575 0.876 18513 180 1 4 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.265 0.222 18513 181 1 4 . 1 1 12 12 CYS H H 12 8.280 8.280 8.250 0.030 18513 182 1 4 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.078 0.404 18513 183 1 4 . 1 1 13 13 ARG H H 13 8.321 8.321 8.358 -0.037 18513 184 1 4 . 1 1 14 14 SER HA H 14 4.384 4.384 4.290 0.094 18513 185 1 4 . 1 1 14 14 SER H H 14 7.714 7.714 7.857 -0.143 18513 186 1 4 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.549 0.003 18513 187 1 4 . 1 1 15 15 LEU H H 15 7.395 7.395 7.511 -0.116 18513 188 1 4 . 1 1 16 16 GLY H H 16 8.161 8.161 7.899 0.262 18513 189 1 4 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.606 0.049 18513 190 1 4 . 1 1 17 17 LEU H H 17 7.435 7.435 7.703 -0.268 18513 191 1 4 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.544 -0.221 18513 192 1 4 . 1 1 18 18 LEU H H 18 8.630 8.630 8.597 0.033 18513 193 1 4 . 1 1 19 19 GLY H H 19 8.039 8.039 8.296 -0.257 18513 194 1 4 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.721 -0.336 18513 195 1 4 . 1 1 20 20 LYS H H 20 8.847 8.847 8.964 -0.117 18513 196 1 4 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.650 0.638 18513 197 1 4 . 1 1 21 21 CYS H H 21 8.242 8.242 8.924 -0.682 18513 198 1 4 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.115 0.151 18513 199 1 4 . 1 1 22 22 ILE H H 22 9.030 9.030 8.442 0.588 18513 200 1 4 . 1 1 23 23 GLY H H 23 9.026 9.026 8.123 0.903 18513 201 1 4 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.510 -0.363 18513 202 1 4 . 1 1 24 24 GLU H H 24 8.856 8.856 8.489 0.367 18513 203 1 4 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.523 0.004 18513 204 1 4 . 1 1 25 25 GLU H H 25 7.716 7.716 7.652 0.064 18513 205 1 4 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.874 0.156 18513 206 1 4 . 1 1 26 26 CYS H H 26 8.670 8.670 8.959 -0.289 18513 207 1 4 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.699 -0.035 18513 208 1 4 . 1 1 27 27 LYS H H 27 9.497 9.497 8.880 0.617 18513 209 1 4 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.649 0.048 18513 210 1 4 . 1 1 28 28 CYS H H 28 8.533 8.533 8.461 0.072 18513 211 1 4 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.704 0.231 18513 212 1 4 . 1 1 29 29 VAL H H 29 9.508 9.508 8.864 0.644 18513 213 1 5 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.872 -0.184 18513 214 1 5 . 1 1 2 2 PHE H H 2 8.466 8.466 8.764 -0.298 18513 215 1 5 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.785 -0.397 18513 216 1 5 . 1 1 3 3 CYS H H 3 8.244 8.244 9.026 -0.782 18513 217 1 5 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.810 0.002 18513 218 1 5 . 1 1 4 4 ASN H H 4 8.692 8.692 8.927 -0.235 18513 219 1 5 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.117 -0.138 18513 220 1 5 . 1 1 5 5 LEU H H 5 8.793 8.793 7.891 0.902 18513 221 1 5 . 1 1 6 6 ARG HA H 6 4.077 4.077 3.986 0.091 18513 222 1 5 . 1 1 6 6 ARG H H 6 8.302 8.302 8.262 0.040 18513 223 1 5 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.213 -0.191 18513 224 1 5 . 1 1 7 7 ARG H H 7 7.997 7.997 7.923 0.074 18513 225 1 5 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.549 0.079 18513 226 1 5 . 1 1 8 8 CYS H H 8 8.695 8.695 7.383 1.312 18513 227 1 5 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.009 -0.207 18513 228 1 5 . 1 1 9 9 GLU H H 9 9.049 9.049 8.239 0.810 18513 229 1 5 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.203 -0.110 18513 230 1 5 . 1 1 10 10 LEU H H 10 8.094 8.094 7.683 0.411 18513 231 1 5 . 1 1 11 11 SER HA H 11 4.297 4.297 4.599 -0.302 18513 232 1 5 . 1 1 11 11 SER H H 11 8.451 8.451 7.532 0.919 18513 233 1 5 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.614 -0.127 18513 234 1 5 . 1 1 12 12 CYS H H 12 8.280 8.280 8.152 0.129 18513 235 1 5 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.249 0.233 18513 236 1 5 . 1 1 13 13 ARG H H 13 8.321 8.321 8.692 -0.371 18513 237 1 5 . 1 1 14 14 SER HA H 14 4.384 4.384 4.295 0.089 18513 238 1 5 . 1 1 14 14 SER H H 14 7.714 7.714 8.497 -0.783 18513 239 1 5 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.656 -0.104 18513 240 1 5 . 1 1 15 15 LEU H H 15 7.395 7.395 7.926 -0.531 18513 241 1 5 . 1 1 16 16 GLY H H 16 8.161 8.161 8.064 0.097 18513 242 1 5 . 1 1 17 17 LEU HA H 17 4.655 4.655 5.029 -0.374 18513 243 1 5 . 1 1 17 17 LEU H H 17 7.435 7.435 7.560 -0.125 18513 244 1 5 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.534 -0.211 18513 245 1 5 . 1 1 18 18 LEU H H 18 8.630 8.630 7.977 0.653 18513 246 1 5 . 1 1 19 19 GLY H H 19 8.039 8.039 9.119 -1.080 18513 247 1 5 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.591 -0.206 18513 248 1 5 . 1 1 20 20 LYS H H 20 8.847 8.847 8.449 0.398 18513 249 1 5 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.609 0.679 18513 250 1 5 . 1 1 21 21 CYS H H 21 8.242 8.242 8.762 -0.520 18513 251 1 5 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.403 -0.137 18513 252 1 5 . 1 1 22 22 ILE H H 22 9.030 9.030 8.611 0.419 18513 253 1 5 . 1 1 23 23 GLY H H 23 9.026 9.026 8.294 0.732 18513 254 1 5 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.776 -0.629 18513 255 1 5 . 1 1 24 24 GLU H H 24 8.856 8.856 8.643 0.213 18513 256 1 5 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.530 -0.003 18513 257 1 5 . 1 1 25 25 GLU H H 25 7.716 7.716 7.957 -0.241 18513 258 1 5 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.674 0.356 18513 259 1 5 . 1 1 26 26 CYS H H 26 8.670 8.670 8.762 -0.092 18513 260 1 5 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.616 0.048 18513 261 1 5 . 1 1 27 27 LYS H H 27 9.497 9.497 8.407 1.090 18513 262 1 5 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.545 0.152 18513 263 1 5 . 1 1 28 28 CYS H H 28 8.533 8.533 8.514 0.019 18513 264 1 5 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.701 0.234 18513 265 1 5 . 1 1 29 29 VAL H H 29 9.508 9.508 8.584 0.924 18513 266 1 6 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.659 0.029 18513 267 1 6 . 1 1 2 2 PHE H H 2 8.466 8.466 7.993 0.473 18513 268 1 6 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.350 0.038 18513 269 1 6 . 1 1 3 3 CYS H H 3 8.244 8.244 7.100 1.144 18513 270 1 6 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.673 0.139 18513 271 1 6 . 1 1 4 4 ASN H H 4 8.692 8.692 8.682 0.010 18513 272 1 6 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.955 0.024 18513 273 1 6 . 1 1 5 5 LEU H H 5 8.793 8.793 7.472 1.321 18513 274 1 6 . 1 1 6 6 ARG HA H 6 4.077 4.077 3.791 0.286 18513 275 1 6 . 1 1 6 6 ARG H H 6 8.302 8.302 8.511 -0.209 18513 276 1 6 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.167 -0.145 18513 277 1 6 . 1 1 7 7 ARG H H 7 7.997 7.997 7.969 0.028 18513 278 1 6 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.501 0.127 18513 279 1 6 . 1 1 8 8 CYS H H 8 8.695 8.695 8.252 0.443 18513 280 1 6 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.978 -0.176 18513 281 1 6 . 1 1 9 9 GLU H H 9 9.049 9.049 8.236 0.813 18513 282 1 6 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.337 -0.244 18513 283 1 6 . 1 1 10 10 LEU H H 10 8.094 8.094 8.019 0.075 18513 284 1 6 . 1 1 11 11 SER HA H 11 4.297 4.297 4.636 -0.339 18513 285 1 6 . 1 1 11 11 SER H H 11 8.451 8.451 7.589 0.862 18513 286 1 6 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.737 -0.250 18513 287 1 6 . 1 1 12 12 CYS H H 12 8.280 8.280 8.012 0.268 18513 288 1 6 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.363 0.119 18513 289 1 6 . 1 1 13 13 ARG H H 13 8.321 8.321 8.184 0.137 18513 290 1 6 . 1 1 14 14 SER HA H 14 4.384 4.384 4.267 0.117 18513 291 1 6 . 1 1 14 14 SER H H 14 7.714 7.714 8.270 -0.556 18513 292 1 6 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.348 0.204 18513 293 1 6 . 1 1 15 15 LEU H H 15 7.395 7.395 7.719 -0.324 18513 294 1 6 . 1 1 16 16 GLY H H 16 8.161 8.161 7.655 0.506 18513 295 1 6 . 1 1 17 17 LEU HA H 17 4.655 4.655 5.183 -0.528 18513 296 1 6 . 1 1 17 17 LEU H H 17 7.435 7.435 7.912 -0.477 18513 297 1 6 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.853 -0.530 18513 298 1 6 . 1 1 18 18 LEU H H 18 8.630 8.630 8.813 -0.183 18513 299 1 6 . 1 1 19 19 GLY H H 19 8.039 8.039 9.140 -1.101 18513 300 1 6 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.797 -0.412 18513 301 1 6 . 1 1 20 20 LYS H H 20 8.847 8.847 8.933 -0.086 18513 302 1 6 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.858 0.430 18513 303 1 6 . 1 1 21 21 CYS H H 21 8.242 8.242 8.809 -0.567 18513 304 1 6 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.192 0.074 18513 305 1 6 . 1 1 22 22 ILE H H 22 9.030 9.030 9.050 -0.020 18513 306 1 6 . 1 1 23 23 GLY H H 23 9.026 9.026 8.545 0.481 18513 307 1 6 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.567 -0.420 18513 308 1 6 . 1 1 24 24 GLU H H 24 8.856 8.856 8.152 0.704 18513 309 1 6 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.289 0.238 18513 310 1 6 . 1 1 25 25 GLU H H 25 7.716 7.716 8.440 -0.724 18513 311 1 6 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.224 0.806 18513 312 1 6 . 1 1 26 26 CYS H H 26 8.670 8.670 7.406 1.264 18513 313 1 6 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.669 -0.005 18513 314 1 6 . 1 1 27 27 LYS H H 27 9.497 9.497 8.616 0.881 18513 315 1 6 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.678 0.019 18513 316 1 6 . 1 1 28 28 CYS H H 28 8.533 8.533 8.522 0.011 18513 317 1 6 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.753 0.182 18513 318 1 6 . 1 1 29 29 VAL H H 29 9.508 9.508 9.076 0.432 18513 319 1 7 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.662 0.026 18513 320 1 7 . 1 1 2 2 PHE H H 2 8.466 8.466 8.224 0.242 18513 321 1 7 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.529 -0.141 18513 322 1 7 . 1 1 3 3 CYS H H 3 8.244 8.244 6.884 1.360 18513 323 1 7 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.570 0.242 18513 324 1 7 . 1 1 4 4 ASN H H 4 8.692 8.692 8.768 -0.076 18513 325 1 7 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.873 0.106 18513 326 1 7 . 1 1 5 5 LEU H H 5 8.793 8.793 7.753 1.040 18513 327 1 7 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.160 -0.083 18513 328 1 7 . 1 1 6 6 ARG H H 6 8.302 8.302 8.311 -0.009 18513 329 1 7 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.561 -0.539 18513 330 1 7 . 1 1 7 7 ARG H H 7 7.997 7.997 8.009 -0.012 18513 331 1 7 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.229 0.399 18513 332 1 7 . 1 1 8 8 CYS H H 8 8.695 8.695 8.600 0.095 18513 333 1 7 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.974 -0.172 18513 334 1 7 . 1 1 9 9 GLU H H 9 9.049 9.049 8.070 0.979 18513 335 1 7 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.169 -0.076 18513 336 1 7 . 1 1 10 10 LEU H H 10 8.094 8.094 8.036 0.058 18513 337 1 7 . 1 1 11 11 SER HA H 11 4.297 4.297 4.457 -0.160 18513 338 1 7 . 1 1 11 11 SER H H 11 8.451 8.451 7.782 0.669 18513 339 1 7 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.625 -0.138 18513 340 1 7 . 1 1 12 12 CYS H H 12 8.280 8.280 7.604 0.676 18513 341 1 7 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.177 0.305 18513 342 1 7 . 1 1 13 13 ARG H H 13 8.321 8.321 8.612 -0.291 18513 343 1 7 . 1 1 14 14 SER HA H 14 4.384 4.384 4.258 0.126 18513 344 1 7 . 1 1 14 14 SER H H 14 7.714 7.714 8.496 -0.782 18513 345 1 7 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.653 -0.101 18513 346 1 7 . 1 1 15 15 LEU H H 15 7.395 7.395 7.656 -0.261 18513 347 1 7 . 1 1 16 16 GLY H H 16 8.161 8.161 7.783 0.378 18513 348 1 7 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.467 0.188 18513 349 1 7 . 1 1 17 17 LEU H H 17 7.435 7.435 7.460 -0.025 18513 350 1 7 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.552 -0.229 18513 351 1 7 . 1 1 18 18 LEU H H 18 8.630 8.630 8.310 0.320 18513 352 1 7 . 1 1 19 19 GLY H H 19 8.039 8.039 8.584 -0.545 18513 353 1 7 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.540 -0.155 18513 354 1 7 . 1 1 20 20 LYS H H 20 8.847 8.847 8.267 0.580 18513 355 1 7 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.527 0.761 18513 356 1 7 . 1 1 21 21 CYS H H 21 8.242 8.242 8.879 -0.637 18513 357 1 7 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.439 -0.173 18513 358 1 7 . 1 1 22 22 ILE H H 22 9.030 9.030 8.700 0.330 18513 359 1 7 . 1 1 23 23 GLY H H 23 9.026 9.026 8.927 0.099 18513 360 1 7 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.458 -0.311 18513 361 1 7 . 1 1 24 24 GLU H H 24 8.856 8.856 8.019 0.837 18513 362 1 7 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.413 0.114 18513 363 1 7 . 1 1 25 25 GLU H H 25 7.716 7.716 7.962 -0.246 18513 364 1 7 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.385 0.645 18513 365 1 7 . 1 1 26 26 CYS H H 26 8.670 8.670 8.678 -0.008 18513 366 1 7 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.588 0.076 18513 367 1 7 . 1 1 27 27 LYS H H 27 9.497 9.497 8.468 1.029 18513 368 1 7 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.522 0.175 18513 369 1 7 . 1 1 28 28 CYS H H 28 8.533 8.533 8.381 0.152 18513 370 1 7 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.666 0.269 18513 371 1 7 . 1 1 29 29 VAL H H 29 9.508 9.508 8.649 0.859 18513 372 1 8 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.087 0.601 18513 373 1 8 . 1 1 2 2 PHE H H 2 8.466 8.466 8.407 0.059 18513 374 1 8 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.429 -0.041 18513 375 1 8 . 1 1 3 3 CYS H H 3 8.244 8.244 6.847 1.397 18513 376 1 8 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.663 0.149 18513 377 1 8 . 1 1 4 4 ASN H H 4 8.692 8.692 8.733 -0.041 18513 378 1 8 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.046 -0.067 18513 379 1 8 . 1 1 5 5 LEU H H 5 8.793 8.793 7.812 0.981 18513 380 1 8 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.220 -0.143 18513 381 1 8 . 1 1 6 6 ARG H H 6 8.302 8.302 8.286 0.016 18513 382 1 8 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.524 -0.502 18513 383 1 8 . 1 1 7 7 ARG H H 7 7.997 7.997 8.093 -0.096 18513 384 1 8 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.122 0.506 18513 385 1 8 . 1 1 8 8 CYS H H 8 8.695 8.695 8.478 0.217 18513 386 1 8 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.930 -0.128 18513 387 1 8 . 1 1 9 9 GLU H H 9 9.049 9.049 7.811 1.238 18513 388 1 8 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.114 -0.021 18513 389 1 8 . 1 1 10 10 LEU H H 10 8.094 8.094 7.597 0.497 18513 390 1 8 . 1 1 11 11 SER HA H 11 4.297 4.297 4.329 -0.032 18513 391 1 8 . 1 1 11 11 SER H H 11 8.451 8.451 8.047 0.404 18513 392 1 8 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.591 -0.104 18513 393 1 8 . 1 1 12 12 CYS H H 12 8.280 8.280 7.615 0.665 18513 394 1 8 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.329 0.153 18513 395 1 8 . 1 1 13 13 ARG H H 13 8.321 8.321 8.716 -0.395 18513 396 1 8 . 1 1 14 14 SER HA H 14 4.384 4.384 4.258 0.126 18513 397 1 8 . 1 1 14 14 SER H H 14 7.714 7.714 8.368 -0.654 18513 398 1 8 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.604 -0.052 18513 399 1 8 . 1 1 15 15 LEU H H 15 7.395 7.395 7.886 -0.491 18513 400 1 8 . 1 1 16 16 GLY H H 16 8.161 8.161 7.843 0.318 18513 401 1 8 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.413 0.242 18513 402 1 8 . 1 1 17 17 LEU H H 17 7.435 7.435 7.302 0.133 18513 403 1 8 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.658 -0.335 18513 404 1 8 . 1 1 18 18 LEU H H 18 8.630 8.630 8.477 0.153 18513 405 1 8 . 1 1 19 19 GLY H H 19 8.039 8.039 8.534 -0.495 18513 406 1 8 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.701 -0.316 18513 407 1 8 . 1 1 20 20 LYS H H 20 8.847 8.847 8.780 0.068 18513 408 1 8 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.705 0.583 18513 409 1 8 . 1 1 21 21 CYS H H 21 8.242 8.242 8.824 -0.582 18513 410 1 8 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.015 0.251 18513 411 1 8 . 1 1 22 22 ILE H H 22 9.030 9.030 8.550 0.480 18513 412 1 8 . 1 1 23 23 GLY H H 23 9.026 9.026 8.259 0.767 18513 413 1 8 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.534 -0.387 18513 414 1 8 . 1 1 24 24 GLU H H 24 8.856 8.856 8.222 0.634 18513 415 1 8 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.378 0.149 18513 416 1 8 . 1 1 25 25 GLU H H 25 7.716 7.716 7.834 -0.118 18513 417 1 8 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.496 0.534 18513 418 1 8 . 1 1 26 26 CYS H H 26 8.670 8.670 8.767 -0.097 18513 419 1 8 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.670 -0.006 18513 420 1 8 . 1 1 27 27 LYS H H 27 9.497 9.497 8.989 0.508 18513 421 1 8 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.580 0.117 18513 422 1 8 . 1 1 28 28 CYS H H 28 8.533 8.533 8.587 -0.054 18513 423 1 8 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.671 0.264 18513 424 1 8 . 1 1 29 29 VAL H H 29 9.508 9.508 8.814 0.694 18513 425 1 9 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.431 0.257 18513 426 1 9 . 1 1 2 2 PHE H H 2 8.466 8.466 8.074 0.392 18513 427 1 9 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.488 -0.100 18513 428 1 9 . 1 1 3 3 CYS H H 3 8.244 8.244 7.290 0.954 18513 429 1 9 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.664 0.148 18513 430 1 9 . 1 1 4 4 ASN H H 4 8.692 8.692 8.711 -0.019 18513 431 1 9 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.964 0.015 18513 432 1 9 . 1 1 5 5 LEU H H 5 8.793 8.793 7.501 1.292 18513 433 1 9 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.155 -0.078 18513 434 1 9 . 1 1 6 6 ARG H H 6 8.302 8.302 8.478 -0.176 18513 435 1 9 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.530 -0.508 18513 436 1 9 . 1 1 7 7 ARG H H 7 7.997 7.997 7.795 0.202 18513 437 1 9 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.078 0.550 18513 438 1 9 . 1 1 8 8 CYS H H 8 8.695 8.695 8.382 0.313 18513 439 1 9 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.114 -0.312 18513 440 1 9 . 1 1 9 9 GLU H H 9 9.049 9.049 8.088 0.961 18513 441 1 9 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.146 -0.053 18513 442 1 9 . 1 1 10 10 LEU H H 10 8.094 8.094 7.927 0.167 18513 443 1 9 . 1 1 11 11 SER HA H 11 4.297 4.297 4.143 0.154 18513 444 1 9 . 1 1 11 11 SER H H 11 8.451 8.451 7.744 0.707 18513 445 1 9 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.414 0.073 18513 446 1 9 . 1 1 12 12 CYS H H 12 8.280 8.280 7.959 0.321 18513 447 1 9 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.255 0.227 18513 448 1 9 . 1 1 13 13 ARG H H 13 8.321 8.321 8.567 -0.246 18513 449 1 9 . 1 1 14 14 SER HA H 14 4.384 4.384 4.242 0.142 18513 450 1 9 . 1 1 14 14 SER H H 14 7.714 7.714 7.822 -0.108 18513 451 1 9 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.638 -0.086 18513 452 1 9 . 1 1 15 15 LEU H H 15 7.395 7.395 7.954 -0.559 18513 453 1 9 . 1 1 16 16 GLY H H 16 8.161 8.161 7.976 0.185 18513 454 1 9 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.393 0.262 18513 455 1 9 . 1 1 17 17 LEU H H 17 7.435 7.435 7.309 0.126 18513 456 1 9 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.782 -0.459 18513 457 1 9 . 1 1 18 18 LEU H H 18 8.630 8.630 8.291 0.339 18513 458 1 9 . 1 1 19 19 GLY H H 19 8.039 8.039 8.351 -0.312 18513 459 1 9 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.740 -0.355 18513 460 1 9 . 1 1 20 20 LYS H H 20 8.847 8.847 8.831 0.016 18513 461 1 9 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.933 0.355 18513 462 1 9 . 1 1 21 21 CYS H H 21 8.242 8.242 8.660 -0.418 18513 463 1 9 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.089 0.177 18513 464 1 9 . 1 1 22 22 ILE H H 22 9.030 9.030 9.636 -0.606 18513 465 1 9 . 1 1 23 23 GLY H H 23 9.026 9.026 8.509 0.517 18513 466 1 9 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.576 -0.429 18513 467 1 9 . 1 1 24 24 GLU H H 24 8.856 8.856 8.392 0.464 18513 468 1 9 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.412 0.115 18513 469 1 9 . 1 1 25 25 GLU H H 25 7.716 7.716 8.488 -0.772 18513 470 1 9 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.254 0.776 18513 471 1 9 . 1 1 26 26 CYS H H 26 8.670 8.670 7.892 0.778 18513 472 1 9 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.693 -0.029 18513 473 1 9 . 1 1 27 27 LYS H H 27 9.497 9.497 8.985 0.512 18513 474 1 9 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.633 0.064 18513 475 1 9 . 1 1 28 28 CYS H H 28 8.533 8.533 8.591 -0.058 18513 476 1 9 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.730 0.205 18513 477 1 9 . 1 1 29 29 VAL H H 29 9.508 9.508 9.068 0.440 18513 478 1 10 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.496 0.192 18513 479 1 10 . 1 1 2 2 PHE H H 2 8.466 8.466 7.949 0.517 18513 480 1 10 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.461 -0.073 18513 481 1 10 . 1 1 3 3 CYS H H 3 8.244 8.244 8.352 -0.108 18513 482 1 10 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.793 0.019 18513 483 1 10 . 1 1 4 4 ASN H H 4 8.692 8.692 8.824 -0.132 18513 484 1 10 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.363 -0.384 18513 485 1 10 . 1 1 5 5 LEU H H 5 8.793 8.793 8.039 0.754 18513 486 1 10 . 1 1 6 6 ARG HA H 6 4.077 4.077 3.956 0.121 18513 487 1 10 . 1 1 6 6 ARG H H 6 8.302 8.302 8.508 -0.206 18513 488 1 10 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.195 -0.173 18513 489 1 10 . 1 1 7 7 ARG H H 7 7.997 7.997 8.495 -0.498 18513 490 1 10 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.954 -0.326 18513 491 1 10 . 1 1 8 8 CYS H H 8 8.695 8.695 8.071 0.624 18513 492 1 10 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.225 -0.423 18513 493 1 10 . 1 1 9 9 GLU H H 9 9.049 9.049 8.531 0.518 18513 494 1 10 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.122 -0.029 18513 495 1 10 . 1 1 10 10 LEU H H 10 8.094 8.094 7.594 0.500 18513 496 1 10 . 1 1 11 11 SER HA H 11 4.297 4.297 4.228 0.069 18513 497 1 10 . 1 1 11 11 SER H H 11 8.451 8.451 8.103 0.348 18513 498 1 10 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.278 0.209 18513 499 1 10 . 1 1 12 12 CYS H H 12 8.280 8.280 8.684 -0.404 18513 500 1 10 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.269 0.213 18513 501 1 10 . 1 1 13 13 ARG H H 13 8.321 8.321 7.940 0.381 18513 502 1 10 . 1 1 14 14 SER HA H 14 4.384 4.384 4.331 0.053 18513 503 1 10 . 1 1 14 14 SER H H 14 7.714 7.714 7.879 -0.165 18513 504 1 10 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.452 0.100 18513 505 1 10 . 1 1 15 15 LEU H H 15 7.395 7.395 7.496 -0.101 18513 506 1 10 . 1 1 16 16 GLY H H 16 8.161 8.161 7.576 0.585 18513 507 1 10 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.602 0.053 18513 508 1 10 . 1 1 17 17 LEU H H 17 7.435 7.435 7.932 -0.497 18513 509 1 10 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.650 -0.327 18513 510 1 10 . 1 1 18 18 LEU H H 18 8.630 8.630 8.527 0.102 18513 511 1 10 . 1 1 19 19 GLY H H 19 8.039 8.039 8.932 -0.893 18513 512 1 10 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.786 -0.401 18513 513 1 10 . 1 1 20 20 LYS H H 20 8.847 8.847 8.916 -0.069 18513 514 1 10 . 1 1 21 21 CYS HA H 21 5.288 5.288 5.404 -0.116 18513 515 1 10 . 1 1 21 21 CYS H H 21 8.242 8.242 8.888 -0.646 18513 516 1 10 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.266 -0.000 18513 517 1 10 . 1 1 22 22 ILE H H 22 9.030 9.030 8.970 0.060 18513 518 1 10 . 1 1 23 23 GLY H H 23 9.026 9.026 8.091 0.935 18513 519 1 10 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.512 -0.365 18513 520 1 10 . 1 1 24 24 GLU H H 24 8.856 8.856 8.288 0.568 18513 521 1 10 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.456 0.071 18513 522 1 10 . 1 1 25 25 GLU H H 25 7.716 7.716 8.211 -0.495 18513 523 1 10 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.056 -0.026 18513 524 1 10 . 1 1 26 26 CYS H H 26 8.670 8.670 8.697 -0.027 18513 525 1 10 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.800 -0.136 18513 526 1 10 . 1 1 27 27 LYS H H 27 9.497 9.497 8.917 0.580 18513 527 1 10 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.576 0.121 18513 528 1 10 . 1 1 28 28 CYS H H 28 8.533 8.533 8.421 0.112 18513 529 1 10 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.678 0.257 18513 530 1 10 . 1 1 29 29 VAL H H 29 9.508 9.508 9.082 0.426 18513 531 1 11 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.103 0.585 18513 532 1 11 . 1 1 2 2 PHE H H 2 8.466 8.466 8.513 -0.047 18513 533 1 11 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.630 -0.242 18513 534 1 11 . 1 1 3 3 CYS H H 3 8.244 8.244 7.724 0.520 18513 535 1 11 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.684 0.128 18513 536 1 11 . 1 1 4 4 ASN H H 4 8.692 8.692 8.693 -0.001 18513 537 1 11 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.094 -0.115 18513 538 1 11 . 1 1 5 5 LEU H H 5 8.793 8.793 8.083 0.710 18513 539 1 11 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.029 0.048 18513 540 1 11 . 1 1 6 6 ARG H H 6 8.302 8.302 8.556 -0.254 18513 541 1 11 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.151 -0.129 18513 542 1 11 . 1 1 7 7 ARG H H 7 7.997 7.997 8.300 -0.303 18513 543 1 11 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.193 0.435 18513 544 1 11 . 1 1 8 8 CYS H H 8 8.695 8.695 8.607 0.088 18513 545 1 11 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.074 -0.272 18513 546 1 11 . 1 1 9 9 GLU H H 9 9.049 9.049 8.166 0.883 18513 547 1 11 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.230 -0.137 18513 548 1 11 . 1 1 10 10 LEU H H 10 8.094 8.094 7.589 0.505 18513 549 1 11 . 1 1 11 11 SER HA H 11 4.297 4.297 4.306 -0.009 18513 550 1 11 . 1 1 11 11 SER H H 11 8.451 8.451 7.729 0.722 18513 551 1 11 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.624 -0.137 18513 552 1 11 . 1 1 12 12 CYS H H 12 8.280 8.280 7.663 0.617 18513 553 1 11 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.150 0.332 18513 554 1 11 . 1 1 13 13 ARG H H 13 8.321 8.321 7.591 0.730 18513 555 1 11 . 1 1 14 14 SER HA H 14 4.384 4.384 4.249 0.135 18513 556 1 11 . 1 1 14 14 SER H H 14 7.714 7.714 8.488 -0.774 18513 557 1 11 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.348 0.204 18513 558 1 11 . 1 1 15 15 LEU H H 15 7.395 7.395 7.821 -0.426 18513 559 1 11 . 1 1 16 16 GLY H H 16 8.161 8.161 7.602 0.559 18513 560 1 11 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.155 0.500 18513 561 1 11 . 1 1 17 17 LEU H H 17 7.435 7.435 7.806 -0.371 18513 562 1 11 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.658 -0.335 18513 563 1 11 . 1 1 18 18 LEU H H 18 8.630 8.630 7.953 0.677 18513 564 1 11 . 1 1 19 19 GLY H H 19 8.039 8.039 8.527 -0.488 18513 565 1 11 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.737 -0.352 18513 566 1 11 . 1 1 20 20 LYS H H 20 8.847 8.847 8.851 -0.004 18513 567 1 11 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.339 0.949 18513 568 1 11 . 1 1 21 21 CYS H H 21 8.242 8.242 8.943 -0.701 18513 569 1 11 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.522 -0.256 18513 570 1 11 . 1 1 22 22 ILE H H 22 9.030 9.030 9.161 -0.131 18513 571 1 11 . 1 1 23 23 GLY H H 23 9.026 9.026 7.770 1.256 18513 572 1 11 . 1 1 24 24 GLU HA H 24 4.147 4.147 3.883 0.264 18513 573 1 11 . 1 1 24 24 GLU H H 24 8.856 8.856 8.903 -0.047 18513 574 1 11 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.460 0.067 18513 575 1 11 . 1 1 25 25 GLU H H 25 7.716 7.716 7.851 -0.135 18513 576 1 11 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.355 -0.325 18513 577 1 11 . 1 1 26 26 CYS H H 26 8.670 8.670 8.455 0.215 18513 578 1 11 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.849 -0.185 18513 579 1 11 . 1 1 27 27 LYS H H 27 9.497 9.497 8.880 0.617 18513 580 1 11 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.612 0.085 18513 581 1 11 . 1 1 28 28 CYS H H 28 8.533 8.533 8.495 0.038 18513 582 1 11 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.674 0.261 18513 583 1 11 . 1 1 29 29 VAL H H 29 9.508 9.508 9.069 0.439 18513 584 1 12 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.728 -0.040 18513 585 1 12 . 1 1 2 2 PHE H H 2 8.466 8.466 8.472 -0.006 18513 586 1 12 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.403 -0.015 18513 587 1 12 . 1 1 3 3 CYS H H 3 8.244 8.244 7.971 0.273 18513 588 1 12 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.599 0.213 18513 589 1 12 . 1 1 4 4 ASN H H 4 8.692 8.692 8.680 0.012 18513 590 1 12 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.041 -0.062 18513 591 1 12 . 1 1 5 5 LEU H H 5 8.793 8.793 7.855 0.938 18513 592 1 12 . 1 1 6 6 ARG HA H 6 4.077 4.077 3.940 0.137 18513 593 1 12 . 1 1 6 6 ARG H H 6 8.302 8.302 8.594 -0.292 18513 594 1 12 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.370 -0.348 18513 595 1 12 . 1 1 7 7 ARG H H 7 7.997 7.997 7.585 0.412 18513 596 1 12 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.272 0.356 18513 597 1 12 . 1 1 8 8 CYS H H 8 8.695 8.695 8.259 0.436 18513 598 1 12 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.061 -0.259 18513 599 1 12 . 1 1 9 9 GLU H H 9 9.049 9.049 8.221 0.828 18513 600 1 12 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.221 -0.128 18513 601 1 12 . 1 1 10 10 LEU H H 10 8.094 8.094 7.436 0.658 18513 602 1 12 . 1 1 11 11 SER HA H 11 4.297 4.297 4.282 0.015 18513 603 1 12 . 1 1 11 11 SER H H 11 8.451 8.451 8.608 -0.157 18513 604 1 12 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.879 -0.392 18513 605 1 12 . 1 1 12 12 CYS H H 12 8.280 8.280 7.583 0.697 18513 606 1 12 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.130 0.352 18513 607 1 12 . 1 1 13 13 ARG H H 13 8.321 8.321 7.706 0.615 18513 608 1 12 . 1 1 14 14 SER HA H 14 4.384 4.384 4.284 0.100 18513 609 1 12 . 1 1 14 14 SER H H 14 7.714 7.714 8.570 -0.857 18513 610 1 12 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.486 0.066 18513 611 1 12 . 1 1 15 15 LEU H H 15 7.395 7.395 7.549 -0.154 18513 612 1 12 . 1 1 16 16 GLY H H 16 8.161 8.161 7.496 0.665 18513 613 1 12 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.040 0.615 18513 614 1 12 . 1 1 17 17 LEU H H 17 7.435 7.435 7.694 -0.259 18513 615 1 12 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.393 -0.070 18513 616 1 12 . 1 1 18 18 LEU H H 18 8.630 8.630 8.802 -0.172 18513 617 1 12 . 1 1 19 19 GLY H H 19 8.039 8.039 8.360 -0.321 18513 618 1 12 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.734 -0.349 18513 619 1 12 . 1 1 20 20 LYS H H 20 8.847 8.847 8.868 -0.021 18513 620 1 12 . 1 1 21 21 CYS HA H 21 5.288 5.288 5.389 -0.101 18513 621 1 12 . 1 1 21 21 CYS H H 21 8.242 8.242 8.795 -0.553 18513 622 1 12 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.593 -0.327 18513 623 1 12 . 1 1 22 22 ILE H H 22 9.030 9.030 8.555 0.475 18513 624 1 12 . 1 1 23 23 GLY H H 23 9.026 9.026 7.700 1.326 18513 625 1 12 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.425 -0.278 18513 626 1 12 . 1 1 24 24 GLU H H 24 8.856 8.856 8.442 0.414 18513 627 1 12 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.665 -0.138 18513 628 1 12 . 1 1 25 25 GLU H H 25 7.716 7.716 7.897 -0.181 18513 629 1 12 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.265 -0.235 18513 630 1 12 . 1 1 26 26 CYS H H 26 8.670 8.670 8.782 -0.112 18513 631 1 12 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.715 -0.050 18513 632 1 12 . 1 1 27 27 LYS H H 27 9.497 9.497 9.135 0.362 18513 633 1 12 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.630 0.067 18513 634 1 12 . 1 1 28 28 CYS H H 28 8.533 8.533 8.383 0.150 18513 635 1 12 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.730 0.205 18513 636 1 12 . 1 1 29 29 VAL H H 29 9.508 9.508 9.016 0.492 18513 637 1 13 . 1 1 2 2 PHE HA H 2 4.688 4.688 5.072 -0.384 18513 638 1 13 . 1 1 2 2 PHE H H 2 8.466 8.466 7.631 0.835 18513 639 1 13 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.551 -0.163 18513 640 1 13 . 1 1 3 3 CYS H H 3 8.244 8.244 8.285 -0.041 18513 641 1 13 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.871 -0.059 18513 642 1 13 . 1 1 4 4 ASN H H 4 8.692 8.692 9.080 -0.388 18513 643 1 13 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.102 -0.123 18513 644 1 13 . 1 1 5 5 LEU H H 5 8.793 8.793 8.098 0.695 18513 645 1 13 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.081 -0.004 18513 646 1 13 . 1 1 6 6 ARG H H 6 8.302 8.302 8.339 -0.037 18513 647 1 13 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.271 -0.249 18513 648 1 13 . 1 1 7 7 ARG H H 7 7.997 7.997 7.658 0.339 18513 649 1 13 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.135 0.493 18513 650 1 13 . 1 1 8 8 CYS H H 8 8.695 8.695 8.382 0.313 18513 651 1 13 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.009 -0.207 18513 652 1 13 . 1 1 9 9 GLU H H 9 9.049 9.049 8.467 0.582 18513 653 1 13 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.134 -0.041 18513 654 1 13 . 1 1 10 10 LEU H H 10 8.094 8.094 7.912 0.182 18513 655 1 13 . 1 1 11 11 SER HA H 11 4.297 4.297 4.247 0.050 18513 656 1 13 . 1 1 11 11 SER H H 11 8.451 8.451 8.118 0.333 18513 657 1 13 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.377 0.110 18513 658 1 13 . 1 1 12 12 CYS H H 12 8.280 8.280 8.311 -0.031 18513 659 1 13 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.376 0.106 18513 660 1 13 . 1 1 13 13 ARG H H 13 8.321 8.321 7.679 0.642 18513 661 1 13 . 1 1 14 14 SER HA H 14 4.384 4.384 4.217 0.167 18513 662 1 13 . 1 1 14 14 SER H H 14 7.714 7.714 8.025 -0.311 18513 663 1 13 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.460 0.092 18513 664 1 13 . 1 1 15 15 LEU H H 15 7.395 7.395 7.883 -0.488 18513 665 1 13 . 1 1 16 16 GLY H H 16 8.161 8.161 7.668 0.493 18513 666 1 13 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.473 0.182 18513 667 1 13 . 1 1 17 17 LEU H H 17 7.435 7.435 7.606 -0.171 18513 668 1 13 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.580 -0.257 18513 669 1 13 . 1 1 18 18 LEU H H 18 8.630 8.630 7.595 1.035 18513 670 1 13 . 1 1 19 19 GLY H H 19 8.039 8.039 8.331 -0.292 18513 671 1 13 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.848 -0.463 18513 672 1 13 . 1 1 20 20 LYS H H 20 8.847 8.847 8.707 0.140 18513 673 1 13 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.665 0.623 18513 674 1 13 . 1 1 21 21 CYS H H 21 8.242 8.242 8.864 -0.622 18513 675 1 13 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.365 -0.099 18513 676 1 13 . 1 1 22 22 ILE H H 22 9.030 9.030 8.369 0.661 18513 677 1 13 . 1 1 23 23 GLY H H 23 9.026 9.026 8.231 0.795 18513 678 1 13 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.375 -0.228 18513 679 1 13 . 1 1 24 24 GLU H H 24 8.856 8.856 7.869 0.987 18513 680 1 13 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.517 0.010 18513 681 1 13 . 1 1 25 25 GLU H H 25 7.716 7.716 7.919 -0.203 18513 682 1 13 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.716 0.314 18513 683 1 13 . 1 1 26 26 CYS H H 26 8.670 8.670 8.920 -0.250 18513 684 1 13 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.731 -0.067 18513 685 1 13 . 1 1 27 27 LYS H H 27 9.497 9.497 8.917 0.580 18513 686 1 13 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.363 0.334 18513 687 1 13 . 1 1 28 28 CYS H H 28 8.533 8.533 8.471 0.062 18513 688 1 13 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.644 0.291 18513 689 1 13 . 1 1 29 29 VAL H H 29 9.508 9.508 8.899 0.609 18513 690 1 14 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.571 0.117 18513 691 1 14 . 1 1 2 2 PHE H H 2 8.466 8.466 8.220 0.246 18513 692 1 14 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.488 -0.100 18513 693 1 14 . 1 1 3 3 CYS H H 3 8.244 8.244 8.134 0.110 18513 694 1 14 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.844 -0.032 18513 695 1 14 . 1 1 4 4 ASN H H 4 8.692 8.692 8.640 0.052 18513 696 1 14 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.035 -0.056 18513 697 1 14 . 1 1 5 5 LEU H H 5 8.793 8.793 8.109 0.684 18513 698 1 14 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.096 -0.019 18513 699 1 14 . 1 1 6 6 ARG H H 6 8.302 8.302 8.700 -0.398 18513 700 1 14 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.278 -0.256 18513 701 1 14 . 1 1 7 7 ARG H H 7 7.997 7.997 7.771 0.226 18513 702 1 14 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.596 0.032 18513 703 1 14 . 1 1 8 8 CYS H H 8 8.695 8.695 8.246 0.449 18513 704 1 14 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.944 -0.142 18513 705 1 14 . 1 1 9 9 GLU H H 9 9.049 9.049 8.397 0.652 18513 706 1 14 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.367 -0.274 18513 707 1 14 . 1 1 10 10 LEU H H 10 8.094 8.094 8.299 -0.205 18513 708 1 14 . 1 1 11 11 SER HA H 11 4.297 4.297 4.613 -0.316 18513 709 1 14 . 1 1 11 11 SER H H 11 8.451 8.451 7.898 0.553 18513 710 1 14 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.617 -0.130 18513 711 1 14 . 1 1 12 12 CYS H H 12 8.280 8.280 7.795 0.485 18513 712 1 14 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.293 0.189 18513 713 1 14 . 1 1 13 13 ARG H H 13 8.321 8.321 8.704 -0.383 18513 714 1 14 . 1 1 14 14 SER HA H 14 4.384 4.384 4.267 0.117 18513 715 1 14 . 1 1 14 14 SER H H 14 7.714 7.714 8.411 -0.697 18513 716 1 14 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.562 -0.010 18513 717 1 14 . 1 1 15 15 LEU H H 15 7.395 7.395 7.663 -0.268 18513 718 1 14 . 1 1 16 16 GLY H H 16 8.161 8.161 7.692 0.469 18513 719 1 14 . 1 1 17 17 LEU HA H 17 4.655 4.655 5.035 -0.380 18513 720 1 14 . 1 1 17 17 LEU H H 17 7.435 7.435 7.419 0.016 18513 721 1 14 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.564 -0.241 18513 722 1 14 . 1 1 18 18 LEU H H 18 8.630 8.630 8.197 0.433 18513 723 1 14 . 1 1 19 19 GLY H H 19 8.039 8.039 8.575 -0.536 18513 724 1 14 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.271 0.114 18513 725 1 14 . 1 1 20 20 LYS H H 20 8.847 8.847 7.966 0.881 18513 726 1 14 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.525 0.763 18513 727 1 14 . 1 1 21 21 CYS H H 21 8.242 8.242 8.070 0.172 18513 728 1 14 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.344 -0.078 18513 729 1 14 . 1 1 22 22 ILE H H 22 9.030 9.030 8.970 0.060 18513 730 1 14 . 1 1 23 23 GLY H H 23 9.026 9.026 8.228 0.798 18513 731 1 14 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.603 -0.456 18513 732 1 14 . 1 1 24 24 GLU H H 24 8.856 8.856 8.035 0.821 18513 733 1 14 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.613 -0.086 18513 734 1 14 . 1 1 25 25 GLU H H 25 7.716 7.716 7.501 0.215 18513 735 1 14 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.747 0.283 18513 736 1 14 . 1 1 26 26 CYS H H 26 8.670 8.670 8.659 0.011 18513 737 1 14 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.737 -0.073 18513 738 1 14 . 1 1 27 27 LYS H H 27 9.497 9.497 8.571 0.926 18513 739 1 14 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.451 0.246 18513 740 1 14 . 1 1 28 28 CYS H H 28 8.533 8.533 8.544 -0.011 18513 741 1 14 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.638 0.297 18513 742 1 14 . 1 1 29 29 VAL H H 29 9.508 9.508 8.575 0.933 18513 743 1 15 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.574 0.114 18513 744 1 15 . 1 1 2 2 PHE H H 2 8.466 8.466 7.876 0.590 18513 745 1 15 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.457 -0.069 18513 746 1 15 . 1 1 3 3 CYS H H 3 8.244 8.244 7.643 0.601 18513 747 1 15 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.513 0.299 18513 748 1 15 . 1 1 4 4 ASN H H 4 8.692 8.692 8.855 -0.163 18513 749 1 15 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.924 0.055 18513 750 1 15 . 1 1 5 5 LEU H H 5 8.793 8.793 7.948 0.845 18513 751 1 15 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.121 -0.044 18513 752 1 15 . 1 1 6 6 ARG H H 6 8.302 8.302 8.573 -0.271 18513 753 1 15 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.294 -0.272 18513 754 1 15 . 1 1 7 7 ARG H H 7 7.997 7.997 7.600 0.397 18513 755 1 15 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.294 0.334 18513 756 1 15 . 1 1 8 8 CYS H H 8 8.695 8.695 8.439 0.256 18513 757 1 15 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.009 -0.207 18513 758 1 15 . 1 1 9 9 GLU H H 9 9.049 9.049 8.375 0.674 18513 759 1 15 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.226 -0.133 18513 760 1 15 . 1 1 10 10 LEU H H 10 8.094 8.094 8.178 -0.084 18513 761 1 15 . 1 1 11 11 SER HA H 11 4.297 4.297 4.442 -0.145 18513 762 1 15 . 1 1 11 11 SER H H 11 8.451 8.451 7.848 0.603 18513 763 1 15 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.736 -0.249 18513 764 1 15 . 1 1 12 12 CYS H H 12 8.280 8.280 7.844 0.436 18513 765 1 15 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.275 0.207 18513 766 1 15 . 1 1 13 13 ARG H H 13 8.321 8.321 8.568 -0.247 18513 767 1 15 . 1 1 14 14 SER HA H 14 4.384 4.384 4.345 0.039 18513 768 1 15 . 1 1 14 14 SER H H 14 7.714 7.714 8.456 -0.742 18513 769 1 15 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.504 0.048 18513 770 1 15 . 1 1 15 15 LEU H H 15 7.395 7.395 7.576 -0.181 18513 771 1 15 . 1 1 16 16 GLY H H 16 8.161 8.161 7.754 0.407 18513 772 1 15 . 1 1 17 17 LEU HA H 17 4.655 4.655 5.015 -0.360 18513 773 1 15 . 1 1 17 17 LEU H H 17 7.435 7.435 7.604 -0.169 18513 774 1 15 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.522 -0.199 18513 775 1 15 . 1 1 18 18 LEU H H 18 8.630 8.630 8.603 0.027 18513 776 1 15 . 1 1 19 19 GLY H H 19 8.039 8.039 8.338 -0.299 18513 777 1 15 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.809 -0.424 18513 778 1 15 . 1 1 20 20 LYS H H 20 8.847 8.847 8.966 -0.119 18513 779 1 15 . 1 1 21 21 CYS HA H 21 5.288 5.288 5.193 0.095 18513 780 1 15 . 1 1 21 21 CYS H H 21 8.242 8.242 8.642 -0.400 18513 781 1 15 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.263 0.003 18513 782 1 15 . 1 1 22 22 ILE H H 22 9.030 9.030 9.099 -0.069 18513 783 1 15 . 1 1 23 23 GLY H H 23 9.026 9.026 7.441 1.585 18513 784 1 15 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.375 -0.228 18513 785 1 15 . 1 1 24 24 GLU H H 24 8.856 8.856 8.443 0.413 18513 786 1 15 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.498 0.029 18513 787 1 15 . 1 1 25 25 GLU H H 25 7.716 7.716 8.032 -0.316 18513 788 1 15 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.762 0.268 18513 789 1 15 . 1 1 26 26 CYS H H 26 8.670 8.670 8.837 -0.167 18513 790 1 15 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.693 -0.029 18513 791 1 15 . 1 1 27 27 LYS H H 27 9.497 9.497 8.814 0.683 18513 792 1 15 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.635 0.062 18513 793 1 15 . 1 1 28 28 CYS H H 28 8.533 8.533 8.494 0.039 18513 794 1 15 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.663 0.272 18513 795 1 15 . 1 1 29 29 VAL H H 29 9.508 9.508 8.683 0.825 18513 796 1 16 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.826 -0.138 18513 797 1 16 . 1 1 2 2 PHE H H 2 8.466 8.466 8.377 0.089 18513 798 1 16 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.684 -0.296 18513 799 1 16 . 1 1 3 3 CYS H H 3 8.244 8.244 7.767 0.477 18513 800 1 16 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.633 0.179 18513 801 1 16 . 1 1 4 4 ASN H H 4 8.692 8.692 8.730 -0.038 18513 802 1 16 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.975 0.004 18513 803 1 16 . 1 1 5 5 LEU H H 5 8.793 8.793 8.012 0.781 18513 804 1 16 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.119 -0.042 18513 805 1 16 . 1 1 6 6 ARG H H 6 8.302 8.302 8.477 -0.175 18513 806 1 16 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.311 -0.289 18513 807 1 16 . 1 1 7 7 ARG H H 7 7.997 7.997 7.782 0.215 18513 808 1 16 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.258 0.370 18513 809 1 16 . 1 1 8 8 CYS H H 8 8.695 8.695 8.485 0.210 18513 810 1 16 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.990 -0.188 18513 811 1 16 . 1 1 9 9 GLU H H 9 9.049 9.049 8.012 1.037 18513 812 1 16 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.182 -0.089 18513 813 1 16 . 1 1 10 10 LEU H H 10 8.094 8.094 8.143 -0.049 18513 814 1 16 . 1 1 11 11 SER HA H 11 4.297 4.297 4.307 -0.010 18513 815 1 16 . 1 1 11 11 SER H H 11 8.451 8.451 7.908 0.543 18513 816 1 16 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.645 -0.158 18513 817 1 16 . 1 1 12 12 CYS H H 12 8.280 8.280 7.640 0.640 18513 818 1 16 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.362 0.120 18513 819 1 16 . 1 1 13 13 ARG H H 13 8.321 8.321 8.735 -0.414 18513 820 1 16 . 1 1 14 14 SER HA H 14 4.384 4.384 4.271 0.113 18513 821 1 16 . 1 1 14 14 SER H H 14 7.714 7.714 8.290 -0.576 18513 822 1 16 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.655 -0.103 18513 823 1 16 . 1 1 15 15 LEU H H 15 7.395 7.395 7.638 -0.243 18513 824 1 16 . 1 1 16 16 GLY H H 16 8.161 8.161 7.655 0.506 18513 825 1 16 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.450 0.205 18513 826 1 16 . 1 1 17 17 LEU H H 17 7.435 7.435 7.949 -0.514 18513 827 1 16 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.642 -0.319 18513 828 1 16 . 1 1 18 18 LEU H H 18 8.630 8.630 8.832 -0.202 18513 829 1 16 . 1 1 19 19 GLY H H 19 8.039 8.039 8.902 -0.863 18513 830 1 16 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.738 -0.353 18513 831 1 16 . 1 1 20 20 LYS H H 20 8.847 8.847 8.883 -0.036 18513 832 1 16 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.676 0.612 18513 833 1 16 . 1 1 21 21 CYS H H 21 8.242 8.242 8.948 -0.706 18513 834 1 16 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.280 -0.014 18513 835 1 16 . 1 1 22 22 ILE H H 22 9.030 9.030 8.917 0.113 18513 836 1 16 . 1 1 23 23 GLY H H 23 9.026 9.026 8.139 0.887 18513 837 1 16 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.404 -0.258 18513 838 1 16 . 1 1 24 24 GLU H H 24 8.856 8.856 8.546 0.310 18513 839 1 16 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.547 -0.020 18513 840 1 16 . 1 1 25 25 GLU H H 25 7.716 7.716 7.983 -0.267 18513 841 1 16 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.102 -0.072 18513 842 1 16 . 1 1 26 26 CYS H H 26 8.670 8.670 8.585 0.085 18513 843 1 16 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.769 -0.105 18513 844 1 16 . 1 1 27 27 LYS H H 27 9.497 9.497 8.993 0.504 18513 845 1 16 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.626 0.071 18513 846 1 16 . 1 1 28 28 CYS H H 28 8.533 8.533 8.509 0.024 18513 847 1 16 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.755 0.180 18513 848 1 16 . 1 1 29 29 VAL H H 29 9.508 9.508 8.683 0.825 18513 849 1 17 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.855 -0.167 18513 850 1 17 . 1 1 2 2 PHE H H 2 8.466 8.466 7.704 0.762 18513 851 1 17 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.729 -0.341 18513 852 1 17 . 1 1 3 3 CYS H H 3 8.244 8.244 7.654 0.590 18513 853 1 17 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.652 0.160 18513 854 1 17 . 1 1 4 4 ASN H H 4 8.692 8.692 8.845 -0.153 18513 855 1 17 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.105 -0.126 18513 856 1 17 . 1 1 5 5 LEU H H 5 8.793 8.793 7.982 0.811 18513 857 1 17 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.175 -0.098 18513 858 1 17 . 1 1 6 6 ARG H H 6 8.302 8.302 8.297 0.005 18513 859 1 17 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.368 -0.346 18513 860 1 17 . 1 1 7 7 ARG H H 7 7.997 7.997 7.926 0.071 18513 861 1 17 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.105 0.523 18513 862 1 17 . 1 1 8 8 CYS H H 8 8.695 8.695 8.626 0.069 18513 863 1 17 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.031 -0.229 18513 864 1 17 . 1 1 9 9 GLU H H 9 9.049 9.049 8.302 0.747 18513 865 1 17 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.227 -0.134 18513 866 1 17 . 1 1 10 10 LEU H H 10 8.094 8.094 7.437 0.657 18513 867 1 17 . 1 1 11 11 SER HA H 11 4.297 4.297 4.494 -0.197 18513 868 1 17 . 1 1 11 11 SER H H 11 8.451 8.451 7.695 0.756 18513 869 1 17 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.285 0.202 18513 870 1 17 . 1 1 12 12 CYS H H 12 8.280 8.280 8.667 -0.387 18513 871 1 17 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.167 0.315 18513 872 1 17 . 1 1 13 13 ARG H H 13 8.321 8.321 7.866 0.455 18513 873 1 17 . 1 1 14 14 SER HA H 14 4.384 4.384 4.232 0.152 18513 874 1 17 . 1 1 14 14 SER H H 14 7.714 7.714 7.573 0.141 18513 875 1 17 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.254 0.298 18513 876 1 17 . 1 1 15 15 LEU H H 15 7.395 7.395 7.585 -0.190 18513 877 1 17 . 1 1 16 16 GLY H H 16 8.161 8.161 7.961 0.200 18513 878 1 17 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.480 0.175 18513 879 1 17 . 1 1 17 17 LEU H H 17 7.435 7.435 7.858 -0.423 18513 880 1 17 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.549 -0.226 18513 881 1 17 . 1 1 18 18 LEU H H 18 8.630 8.630 8.531 0.099 18513 882 1 17 . 1 1 19 19 GLY H H 19 8.039 8.039 8.349 -0.310 18513 883 1 17 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.729 -0.344 18513 884 1 17 . 1 1 20 20 LYS H H 20 8.847 8.847 8.856 -0.009 18513 885 1 17 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.882 0.406 18513 886 1 17 . 1 1 21 21 CYS H H 21 8.242 8.242 8.851 -0.609 18513 887 1 17 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.377 -0.111 18513 888 1 17 . 1 1 22 22 ILE H H 22 9.030 9.030 8.839 0.191 18513 889 1 17 . 1 1 23 23 GLY H H 23 9.026 9.026 7.511 1.515 18513 890 1 17 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.708 -0.561 18513 891 1 17 . 1 1 24 24 GLU H H 24 8.856 8.856 8.360 0.496 18513 892 1 17 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.575 -0.048 18513 893 1 17 . 1 1 25 25 GLU H H 25 7.716 7.716 8.095 -0.379 18513 894 1 17 . 1 1 26 26 CYS HA H 26 5.030 5.030 5.249 -0.219 18513 895 1 17 . 1 1 26 26 CYS H H 26 8.670 8.670 8.701 -0.031 18513 896 1 17 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.714 -0.050 18513 897 1 17 . 1 1 27 27 LYS H H 27 9.497 9.497 9.000 0.497 18513 898 1 17 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.554 0.143 18513 899 1 17 . 1 1 28 28 CYS H H 28 8.533 8.533 8.465 0.068 18513 900 1 17 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.608 0.327 18513 901 1 17 . 1 1 29 29 VAL H H 29 9.508 9.508 8.935 0.573 18513 902 1 18 . 1 1 2 2 PHE HA H 2 4.688 4.688 4.263 0.425 18513 903 1 18 . 1 1 2 2 PHE H H 2 8.466 8.466 8.525 -0.059 18513 904 1 18 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.381 0.007 18513 905 1 18 . 1 1 3 3 CYS H H 3 8.244 8.244 8.078 0.166 18513 906 1 18 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.739 0.073 18513 907 1 18 . 1 1 4 4 ASN H H 4 8.692 8.692 8.868 -0.176 18513 908 1 18 . 1 1 5 5 LEU HA H 5 3.979 3.979 3.924 0.055 18513 909 1 18 . 1 1 5 5 LEU H H 5 8.793 8.793 7.922 0.871 18513 910 1 18 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.132 -0.055 18513 911 1 18 . 1 1 6 6 ARG H H 6 8.302 8.302 8.383 -0.081 18513 912 1 18 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.506 -0.484 18513 913 1 18 . 1 1 7 7 ARG H H 7 7.997 7.997 7.933 0.064 18513 914 1 18 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.361 0.267 18513 915 1 18 . 1 1 8 8 CYS H H 8 8.695 8.695 8.540 0.155 18513 916 1 18 . 1 1 9 9 GLU HA H 9 3.802 3.802 3.998 -0.196 18513 917 1 18 . 1 1 9 9 GLU H H 9 9.049 9.049 8.598 0.451 18513 918 1 18 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.195 -0.102 18513 919 1 18 . 1 1 10 10 LEU H H 10 8.094 8.094 7.425 0.669 18513 920 1 18 . 1 1 11 11 SER HA H 11 4.297 4.297 4.347 -0.050 18513 921 1 18 . 1 1 11 11 SER H H 11 8.451 8.451 7.857 0.594 18513 922 1 18 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.733 -0.246 18513 923 1 18 . 1 1 12 12 CYS H H 12 8.280 8.280 8.037 0.243 18513 924 1 18 . 1 1 13 13 ARG HA H 13 4.482 4.482 3.992 0.490 18513 925 1 18 . 1 1 13 13 ARG H H 13 8.321 8.321 8.061 0.260 18513 926 1 18 . 1 1 14 14 SER HA H 14 4.384 4.384 4.296 0.088 18513 927 1 18 . 1 1 14 14 SER H H 14 7.714 7.714 8.324 -0.610 18513 928 1 18 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.618 -0.066 18513 929 1 18 . 1 1 15 15 LEU H H 15 7.395 7.395 7.486 -0.091 18513 930 1 18 . 1 1 16 16 GLY H H 16 8.161 8.161 7.638 0.523 18513 931 1 18 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.428 0.227 18513 932 1 18 . 1 1 17 17 LEU H H 17 7.435 7.435 7.372 0.063 18513 933 1 18 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.309 0.014 18513 934 1 18 . 1 1 18 18 LEU H H 18 8.630 8.630 7.847 0.783 18513 935 1 18 . 1 1 19 19 GLY H H 19 8.039 8.039 8.570 -0.531 18513 936 1 18 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.207 0.178 18513 937 1 18 . 1 1 20 20 LYS H H 20 8.847 8.847 7.739 1.108 18513 938 1 18 . 1 1 21 21 CYS HA H 21 5.288 5.288 5.068 0.220 18513 939 1 18 . 1 1 21 21 CYS H H 21 8.242 8.242 8.247 -0.005 18513 940 1 18 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.444 -0.178 18513 941 1 18 . 1 1 22 22 ILE H H 22 9.030 9.030 8.120 0.910 18513 942 1 18 . 1 1 23 23 GLY H H 23 9.026 9.026 8.350 0.676 18513 943 1 18 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.621 -0.474 18513 944 1 18 . 1 1 24 24 GLU H H 24 8.856 8.856 8.468 0.388 18513 945 1 18 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.437 0.090 18513 946 1 18 . 1 1 25 25 GLU H H 25 7.716 7.716 7.880 -0.164 18513 947 1 18 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.571 0.459 18513 948 1 18 . 1 1 26 26 CYS H H 26 8.670 8.670 8.835 -0.165 18513 949 1 18 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.753 -0.089 18513 950 1 18 . 1 1 27 27 LYS H H 27 9.497 9.497 8.683 0.814 18513 951 1 18 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.500 0.197 18513 952 1 18 . 1 1 28 28 CYS H H 28 8.533 8.533 8.337 0.196 18513 953 1 18 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.748 0.187 18513 954 1 18 . 1 1 29 29 VAL H H 29 9.508 9.508 9.025 0.483 18513 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 18513 2 1 1 "Average Difference" HA 25 0.266 0.039 0.269 18513 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18513 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18513 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18513 6 1 1 "Average Difference" HN 28 0.570 -0.245 0.524 18513 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18513 8 1 2 "Average Difference" HA 25 0.273 0.089 0.263 18513 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18513 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18513 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18513 12 1 2 "Average Difference" HN 28 0.577 -0.103 0.578 18513 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18513 14 1 3 "Average Difference" HA 25 0.302 0.030 0.307 18513 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18513 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18513 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18513 18 1 3 "Average Difference" HN 28 0.513 -0.149 0.499 18513 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18513 20 1 4 "Average Difference" HA 25 0.240 -0.037 0.242 18513 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18513 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18513 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18513 24 1 4 "Average Difference" HN 28 0.471 -0.196 0.436 18513 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18513 26 1 5 "Average Difference" HA 25 0.269 0.054 0.269 18513 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18513 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18513 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18513 30 1 5 "Average Difference" HN 28 0.625 -0.146 0.619 18513 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18513 32 1 6 "Average Difference" HA 25 0.304 0.009 0.310 18513 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18513 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18513 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18513 36 1 6 "Average Difference" HN 28 0.635 -0.200 0.614 18513 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18513 38 1 7 "Average Difference" HA 25 0.290 -0.046 0.292 18513 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18513 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18513 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18513 42 1 7 "Average Difference" HN 28 0.586 -0.243 0.543 18513 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18513 44 1 8 "Average Difference" HA 25 0.297 -0.062 0.296 18513 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18513 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18513 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18513 48 1 8 "Average Difference" HN 28 0.564 -0.222 0.528 18513 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18513 50 1 9 "Average Difference" HA 25 0.302 -0.045 0.305 18513 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18513 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18513 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18513 54 1 9 "Average Difference" HN 28 0.528 -0.193 0.500 18513 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18513 56 1 10 "Average Difference" HA 25 0.214 0.052 0.212 18513 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18513 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18513 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18513 60 1 10 "Average Difference" HN 28 0.475 -0.099 0.473 18513 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18513 62 1 11 "Average Difference" HA 25 0.326 -0.060 0.327 18513 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18513 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18513 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18513 66 1 11 "Average Difference" HN 28 0.537 -0.175 0.517 18513 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18513 68 1 12 "Average Difference" HA 25 0.246 0.027 0.250 18513 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18513 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18513 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18513 72 1 12 "Average Difference" HN 28 0.525 -0.202 0.493 18513 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18513 74 1 13 "Average Difference" HA 25 0.258 -0.017 0.263 18513 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18513 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18513 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18513 78 1 13 "Average Difference" HN 28 0.517 -0.230 0.471 18513 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18513 80 1 14 "Average Difference" HA 25 0.254 0.020 0.258 18513 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18513 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18513 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18513 84 1 14 "Average Difference" HN 28 0.509 -0.239 0.458 18513 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18513 86 1 15 "Average Difference" HA 25 0.205 0.021 0.208 18513 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18513 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18513 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18513 90 1 15 "Average Difference" HN 28 0.529 -0.184 0.505 18513 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18513 92 1 16 "Average Difference" HA 25 0.222 0.024 0.225 18513 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18513 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18513 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18513 96 1 16 "Average Difference" HN 28 0.501 -0.113 0.497 18513 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18513 98 1 17 "Average Difference" HA 25 0.270 0.020 0.275 18513 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18513 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18513 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18513 102 1 17 "Average Difference" HN 28 0.521 -0.222 0.480 18513 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18513 104 1 18 "Average Difference" HA 25 0.249 -0.042 0.251 18513 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18513 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18513 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18513 108 1 18 "Average Difference" HN 28 0.507 -0.269 0.437 18513 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 18513 _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 PHE HA H 2 4.688 4.688 4.648 0.040 18513 2 1 . 1 1 2 2 PHE H H 2 8.466 8.466 8.115 0.351 18513 3 1 . 1 1 3 3 CYS HA H 3 4.388 4.388 4.536 -0.148 18513 4 1 . 1 1 3 3 CYS H H 3 8.244 8.244 7.853 0.391 18513 5 1 . 1 1 4 4 ASN HA H 4 4.812 4.812 4.702 0.110 18513 6 1 . 1 1 4 4 ASN H H 4 8.692 8.692 8.826 -0.134 18513 7 1 . 1 1 5 5 LEU HA H 5 3.979 3.979 4.049 -0.070 18513 8 1 . 1 1 5 5 LEU H H 5 8.793 8.793 7.912 0.881 18513 9 1 . 1 1 6 6 ARG HA H 6 4.077 4.077 4.066 0.011 18513 10 1 . 1 1 6 6 ARG H H 6 8.302 8.302 8.437 -0.135 18513 11 1 . 1 1 7 7 ARG HA H 7 4.022 4.022 4.299 -0.277 18513 12 1 . 1 1 7 7 ARG H H 7 7.997 7.997 7.921 0.076 18513 13 1 . 1 1 8 8 CYS HA H 8 4.628 4.628 4.311 0.317 18513 14 1 . 1 1 8 8 CYS H H 8 8.695 8.695 8.296 0.399 18513 15 1 . 1 1 9 9 GLU HA H 9 3.802 3.802 4.030 -0.228 18513 16 1 . 1 1 9 9 GLU H H 9 9.049 9.049 8.264 0.785 18513 17 1 . 1 1 10 10 LEU HA H 10 4.093 4.093 4.207 -0.114 18513 18 1 . 1 1 10 10 LEU H H 10 8.094 8.094 7.801 0.293 18513 19 1 . 1 1 11 11 SER HA H 11 4.297 4.297 4.395 -0.098 18513 20 1 . 1 1 11 11 SER H H 11 8.451 8.451 7.855 0.596 18513 21 1 . 1 1 12 12 CYS HA H 12 4.487 4.487 4.521 -0.034 18513 22 1 . 1 1 12 12 CYS H H 12 8.280 8.280 8.061 0.219 18513 23 1 . 1 1 13 13 ARG HA H 13 4.482 4.482 4.231 0.251 18513 24 1 . 1 1 13 13 ARG H H 13 8.321 8.321 8.270 0.051 18513 25 1 . 1 1 14 14 SER HA H 14 4.384 4.384 4.273 0.111 18513 26 1 . 1 1 14 14 SER H H 14 7.714 7.714 8.186 -0.472 18513 27 1 . 1 1 15 15 LEU HA H 15 4.552 4.552 4.520 0.032 18513 28 1 . 1 1 15 15 LEU H H 15 7.395 7.395 7.660 -0.265 18513 29 1 . 1 1 16 16 GLY H H 16 8.161 8.161 7.757 0.404 18513 30 1 . 1 1 17 17 LEU HA H 17 4.655 4.655 4.630 0.025 18513 31 1 . 1 1 17 17 LEU H H 17 7.435 7.435 7.640 -0.205 18513 32 1 . 1 1 18 18 LEU HA H 18 4.323 4.323 4.607 -0.284 18513 33 1 . 1 1 18 18 LEU H H 18 8.630 8.630 8.401 0.229 18513 34 1 . 1 1 19 19 GLY H H 19 8.039 8.039 8.618 -0.579 18513 35 1 . 1 1 20 20 LYS HA H 20 4.385 4.385 4.664 -0.279 18513 36 1 . 1 1 20 20 LYS H H 20 8.847 8.847 8.707 0.140 18513 37 1 . 1 1 21 21 CYS HA H 21 5.288 5.288 4.803 0.486 18513 38 1 . 1 1 21 21 CYS H H 21 8.242 8.242 8.783 -0.541 18513 39 1 . 1 1 22 22 ILE HA H 22 4.266 4.266 4.335 -0.069 18513 40 1 . 1 1 22 22 ILE H H 22 9.030 9.030 8.817 0.213 18513 41 1 . 1 1 23 23 GLY H H 23 9.026 9.026 8.077 0.949 18513 42 1 . 1 1 24 24 GLU HA H 24 4.147 4.147 4.510 -0.363 18513 43 1 . 1 1 24 24 GLU H H 24 8.856 8.856 8.336 0.520 18513 44 1 . 1 1 25 25 GLU HA H 25 4.527 4.527 4.506 0.021 18513 45 1 . 1 1 25 25 GLU H H 25 7.716 7.716 7.963 -0.247 18513 46 1 . 1 1 26 26 CYS HA H 26 5.030 5.030 4.877 0.153 18513 47 1 . 1 1 26 26 CYS H H 26 8.670 8.670 8.602 0.068 18513 48 1 . 1 1 27 27 LYS HA H 27 4.664 4.664 4.717 -0.053 18513 49 1 . 1 1 27 27 LYS H H 27 9.497 9.497 8.829 0.669 18513 50 1 . 1 1 28 28 CYS HA H 28 5.697 5.697 5.580 0.117 18513 51 1 . 1 1 28 28 CYS H H 28 8.533 8.533 8.482 0.051 18513 52 1 . 1 1 29 29 VAL HA H 29 4.935 4.935 4.699 0.236 18513 53 1 . 1 1 29 29 VAL H H 29 9.508 9.508 8.877 0.631 18513 stop_ save_