data_25947 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25947 _Entry.PDB_ID 2NAU 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 25947 _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 TYR HA H 2 4.587 4.587 4.604 -0.017 25947 2 1 1 . 1 1 2 2 TYR H H 2 8.713 8.713 7.981 0.732 25947 3 1 1 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.423 -0.046 25947 4 1 1 . 1 1 3 3 GLU H H 3 8.321 8.321 8.653 -0.332 25947 5 1 1 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.107 0.315 25947 6 1 1 . 1 1 4 4 ILE H H 4 8.284 8.284 8.026 0.258 25947 7 1 1 . 1 1 5 5 THR HA H 5 4.388 4.388 4.223 0.165 25947 8 1 1 . 1 1 5 5 THR H H 5 8.145 8.145 8.068 0.077 25947 9 1 1 . 1 1 6 6 THR HA H 6 4.322 4.322 4.272 0.050 25947 10 1 1 . 1 1 6 6 THR H H 6 8.197 8.197 7.891 0.306 25947 11 1 1 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.872 1.033 25947 12 1 1 . 1 1 7 7 ILE H H 7 8.108 8.108 7.617 0.491 25947 13 1 1 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.520 0.205 25947 14 1 1 . 1 1 8 8 HIS H H 8 8.626 8.626 8.002 0.624 25947 15 1 1 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.350 0.327 25947 16 1 1 . 1 1 9 9 ASN H H 9 8.495 8.495 7.965 0.530 25947 17 1 1 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.265 0.041 25947 18 1 1 . 1 1 10 10 LEU H H 10 8.336 8.336 7.556 0.780 25947 19 1 1 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.271 0.012 25947 20 1 1 . 1 1 11 11 ALA H H 11 8.267 8.267 7.709 0.558 25947 21 1 1 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.439 -0.065 25947 22 1 1 . 1 1 12 12 ARG H H 12 8.209 8.209 8.106 0.103 25947 23 1 1 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.204 0.093 25947 24 1 1 . 1 1 13 13 LYS H H 13 8.361 8.361 8.216 0.145 25947 25 1 1 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.046 0.305 25947 26 1 1 . 1 1 14 14 LEU H H 14 8.419 8.419 8.063 0.356 25947 27 1 1 . 1 1 15 15 THR HA H 15 4.301 4.301 3.880 0.421 25947 28 1 1 . 1 1 15 15 THR H H 15 8.145 8.145 7.691 0.454 25947 29 1 1 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.635 0.095 25947 30 1 1 . 1 1 16 16 HIS H H 16 8.547 8.547 7.837 0.710 25947 31 1 1 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.127 0.265 25947 32 1 1 . 1 1 17 17 ARG H H 17 8.495 8.495 8.327 0.168 25947 33 1 1 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.349 0.069 25947 34 1 1 . 1 1 18 18 LEU H H 18 8.361 8.361 7.812 0.549 25947 35 1 1 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.044 0.259 25947 36 1 1 . 1 1 19 19 ALA H H 19 8.369 8.369 7.326 1.043 25947 37 1 1 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.136 0.143 25947 38 1 1 . 1 1 20 20 ARG H H 20 8.211 8.211 7.676 0.535 25947 39 1 1 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.534 -0.231 25947 40 1 1 . 1 1 21 21 ARG H H 21 8.211 8.211 8.283 -0.072 25947 41 1 1 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.851 -0.176 25947 42 1 1 . 1 1 22 22 ASN H H 22 8.568 8.568 8.438 0.130 25947 43 1 1 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.537 -0.228 25947 44 1 1 . 1 1 23 23 ALA H H 23 8.396 8.396 8.813 -0.417 25947 45 1 1 . 1 1 24 24 GLY H H 24 8.390 8.390 7.846 0.544 25947 46 1 1 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.795 -0.494 25947 47 1 1 . 1 1 25 25 ALA H H 25 8.147 8.147 8.270 -0.123 25947 48 1 1 . 1 1 26 26 THR HA H 26 4.350 4.350 4.251 0.099 25947 49 1 1 . 1 1 26 26 THR H H 26 8.278 8.278 8.071 0.207 25947 50 1 1 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.376 0.002 25947 51 1 1 . 1 1 27 27 LEU H H 27 8.319 8.319 7.956 0.363 25947 52 1 2 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.704 -0.117 25947 53 1 2 . 1 1 2 2 TYR H H 2 8.713 8.713 8.154 0.559 25947 54 1 2 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.374 0.003 25947 55 1 2 . 1 1 3 3 GLU H H 3 8.321 8.321 8.991 -0.670 25947 56 1 2 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.115 0.307 25947 57 1 2 . 1 1 4 4 ILE H H 4 8.284 8.284 7.824 0.460 25947 58 1 2 . 1 1 5 5 THR HA H 5 4.388 4.388 4.204 0.184 25947 59 1 2 . 1 1 5 5 THR H H 5 8.145 8.145 7.822 0.323 25947 60 1 2 . 1 1 6 6 THR HA H 6 4.322 4.322 4.415 -0.093 25947 61 1 2 . 1 1 6 6 THR H H 6 8.197 8.197 7.498 0.699 25947 62 1 2 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.771 1.134 25947 63 1 2 . 1 1 7 7 ILE H H 7 8.108 8.108 7.512 0.596 25947 64 1 2 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.655 0.070 25947 65 1 2 . 1 1 8 8 HIS H H 8 8.626 8.626 8.186 0.440 25947 66 1 2 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.942 -0.265 25947 67 1 2 . 1 1 9 9 ASN H H 9 8.495 8.495 7.928 0.567 25947 68 1 2 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.144 0.162 25947 69 1 2 . 1 1 10 10 LEU H H 10 8.336 8.336 8.175 0.161 25947 70 1 2 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.271 0.012 25947 71 1 2 . 1 1 11 11 ALA H H 11 8.267 8.267 7.684 0.583 25947 72 1 2 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.272 0.102 25947 73 1 2 . 1 1 12 12 ARG H H 12 8.209 8.209 8.450 -0.241 25947 74 1 2 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.174 0.123 25947 75 1 2 . 1 1 13 13 LYS H H 13 8.361 8.361 8.593 -0.232 25947 76 1 2 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.057 0.294 25947 77 1 2 . 1 1 14 14 LEU H H 14 8.419 8.419 7.963 0.456 25947 78 1 2 . 1 1 15 15 THR HA H 15 4.301 4.301 3.933 0.368 25947 79 1 2 . 1 1 15 15 THR H H 15 8.145 8.145 8.004 0.141 25947 80 1 2 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.636 0.094 25947 81 1 2 . 1 1 16 16 HIS H H 16 8.547 8.547 8.087 0.460 25947 82 1 2 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.092 0.300 25947 83 1 2 . 1 1 17 17 ARG H H 17 8.495 8.495 8.180 0.315 25947 84 1 2 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.145 0.273 25947 85 1 2 . 1 1 18 18 LEU H H 18 8.361 8.361 7.633 0.728 25947 86 1 2 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.461 -0.158 25947 87 1 2 . 1 1 19 19 ALA H H 19 8.369 8.369 8.276 0.093 25947 88 1 2 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.323 -0.044 25947 89 1 2 . 1 1 20 20 ARG H H 20 8.211 8.211 7.643 0.568 25947 90 1 2 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.094 0.209 25947 91 1 2 . 1 1 21 21 ARG H H 21 8.211 8.211 8.372 -0.161 25947 92 1 2 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.760 -0.085 25947 93 1 2 . 1 1 22 22 ASN H H 22 8.568 8.568 7.933 0.635 25947 94 1 2 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.406 -0.097 25947 95 1 2 . 1 1 23 23 ALA H H 23 8.396 8.396 7.921 0.475 25947 96 1 2 . 1 1 24 24 GLY H H 24 8.390 8.390 8.776 -0.386 25947 97 1 2 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.802 -0.501 25947 98 1 2 . 1 1 25 25 ALA H H 25 8.147 8.147 7.763 0.384 25947 99 1 2 . 1 1 26 26 THR HA H 26 4.350 4.350 4.331 0.019 25947 100 1 2 . 1 1 26 26 THR H H 26 8.278 8.278 8.397 -0.119 25947 101 1 2 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.247 0.131 25947 102 1 2 . 1 1 27 27 LEU H H 27 8.319 8.319 8.326 -0.007 25947 103 1 3 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.559 0.028 25947 104 1 3 . 1 1 2 2 TYR H H 2 8.713 8.713 8.646 0.067 25947 105 1 3 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.479 -0.102 25947 106 1 3 . 1 1 3 3 GLU H H 3 8.321 8.321 8.609 -0.288 25947 107 1 3 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.967 0.455 25947 108 1 3 . 1 1 4 4 ILE H H 4 8.284 8.284 7.543 0.741 25947 109 1 3 . 1 1 5 5 THR HA H 5 4.388 4.388 4.151 0.237 25947 110 1 3 . 1 1 5 5 THR H H 5 8.145 8.145 8.232 -0.087 25947 111 1 3 . 1 1 6 6 THR HA H 6 4.322 4.322 4.399 -0.077 25947 112 1 3 . 1 1 6 6 THR H H 6 8.197 8.197 7.724 0.473 25947 113 1 3 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.719 1.186 25947 114 1 3 . 1 1 7 7 ILE H H 7 8.108 8.108 7.466 0.642 25947 115 1 3 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.555 0.170 25947 116 1 3 . 1 1 8 8 HIS H H 8 8.626 8.626 8.027 0.599 25947 117 1 3 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.772 -0.095 25947 118 1 3 . 1 1 9 9 ASN H H 9 8.495 8.495 8.342 0.153 25947 119 1 3 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.198 0.108 25947 120 1 3 . 1 1 10 10 LEU H H 10 8.336 8.336 7.364 0.972 25947 121 1 3 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.220 0.063 25947 122 1 3 . 1 1 11 11 ALA H H 11 8.267 8.267 7.951 0.316 25947 123 1 3 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.285 0.089 25947 124 1 3 . 1 1 12 12 ARG H H 12 8.209 8.209 8.589 -0.380 25947 125 1 3 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.071 0.226 25947 126 1 3 . 1 1 13 13 LYS H H 13 8.361 8.361 8.526 -0.165 25947 127 1 3 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.171 0.180 25947 128 1 3 . 1 1 14 14 LEU H H 14 8.419 8.419 7.784 0.635 25947 129 1 3 . 1 1 15 15 THR HA H 15 4.301 4.301 3.973 0.328 25947 130 1 3 . 1 1 15 15 THR H H 15 8.145 8.145 8.058 0.087 25947 131 1 3 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.645 0.085 25947 132 1 3 . 1 1 16 16 HIS H H 16 8.547 8.547 7.995 0.552 25947 133 1 3 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.181 0.211 25947 134 1 3 . 1 1 17 17 ARG H H 17 8.495 8.495 8.116 0.379 25947 135 1 3 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.483 -0.065 25947 136 1 3 . 1 1 18 18 LEU H H 18 8.361 8.361 7.864 0.497 25947 137 1 3 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.547 -0.244 25947 138 1 3 . 1 1 19 19 ALA H H 19 8.369 8.369 8.474 -0.105 25947 139 1 3 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.329 -0.050 25947 140 1 3 . 1 1 20 20 ARG H H 20 8.211 8.211 7.833 0.378 25947 141 1 3 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.609 -0.306 25947 142 1 3 . 1 1 21 21 ARG H H 21 8.211 8.211 8.433 -0.222 25947 143 1 3 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.535 0.140 25947 144 1 3 . 1 1 22 22 ASN H H 22 8.568 8.568 8.232 0.336 25947 145 1 3 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.596 -0.287 25947 146 1 3 . 1 1 23 23 ALA H H 23 8.396 8.396 7.568 0.828 25947 147 1 3 . 1 1 24 24 GLY H H 24 8.390 8.390 8.873 -0.483 25947 148 1 3 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.767 -0.466 25947 149 1 3 . 1 1 25 25 ALA H H 25 8.147 8.147 7.973 0.174 25947 150 1 3 . 1 1 26 26 THR HA H 26 4.350 4.350 4.142 0.208 25947 151 1 3 . 1 1 26 26 THR H H 26 8.278 8.278 7.868 0.410 25947 152 1 3 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.565 -0.187 25947 153 1 3 . 1 1 27 27 LEU H H 27 8.319 8.319 8.264 0.055 25947 154 1 4 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.581 0.006 25947 155 1 4 . 1 1 2 2 TYR H H 2 8.713 8.713 8.178 0.535 25947 156 1 4 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.599 -0.222 25947 157 1 4 . 1 1 3 3 GLU H H 3 8.321 8.321 8.789 -0.468 25947 158 1 4 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.054 0.368 25947 159 1 4 . 1 1 4 4 ILE H H 4 8.284 8.284 7.848 0.436 25947 160 1 4 . 1 1 5 5 THR HA H 5 4.388 4.388 4.304 0.084 25947 161 1 4 . 1 1 5 5 THR H H 5 8.145 8.145 7.796 0.349 25947 162 1 4 . 1 1 6 6 THR HA H 6 4.322 4.322 4.453 -0.131 25947 163 1 4 . 1 1 6 6 THR H H 6 8.197 8.197 7.793 0.404 25947 164 1 4 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.706 1.199 25947 165 1 4 . 1 1 7 7 ILE H H 7 8.108 8.108 7.484 0.624 25947 166 1 4 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.638 0.087 25947 167 1 4 . 1 1 8 8 HIS H H 8 8.626 8.626 7.987 0.639 25947 168 1 4 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.981 -0.304 25947 169 1 4 . 1 1 9 9 ASN H H 9 8.495 8.495 7.901 0.594 25947 170 1 4 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.176 0.130 25947 171 1 4 . 1 1 10 10 LEU H H 10 8.336 8.336 7.935 0.401 25947 172 1 4 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.194 0.089 25947 173 1 4 . 1 1 11 11 ALA H H 11 8.267 8.267 7.767 0.500 25947 174 1 4 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.250 0.124 25947 175 1 4 . 1 1 12 12 ARG H H 12 8.209 8.209 8.389 -0.180 25947 176 1 4 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.413 -0.116 25947 177 1 4 . 1 1 13 13 LYS H H 13 8.361 8.361 8.047 0.314 25947 178 1 4 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.131 0.220 25947 179 1 4 . 1 1 14 14 LEU H H 14 8.419 8.419 8.109 0.310 25947 180 1 4 . 1 1 15 15 THR HA H 15 4.301 4.301 4.137 0.164 25947 181 1 4 . 1 1 15 15 THR H H 15 8.145 8.145 8.258 -0.113 25947 182 1 4 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.507 0.223 25947 183 1 4 . 1 1 16 16 HIS H H 16 8.547 8.547 7.775 0.772 25947 184 1 4 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.189 0.203 25947 185 1 4 . 1 1 17 17 ARG H H 17 8.495 8.495 8.285 0.210 25947 186 1 4 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.338 0.080 25947 187 1 4 . 1 1 18 18 LEU H H 18 8.361 8.361 7.597 0.764 25947 188 1 4 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.646 -0.343 25947 189 1 4 . 1 1 19 19 ALA H H 19 8.369 8.369 7.758 0.611 25947 190 1 4 . 1 1 20 20 ARG HA H 20 4.279 4.279 3.877 0.402 25947 191 1 4 . 1 1 20 20 ARG H H 20 8.211 8.211 8.144 0.067 25947 192 1 4 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.386 -0.083 25947 193 1 4 . 1 1 21 21 ARG H H 21 8.211 8.211 8.111 0.100 25947 194 1 4 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.629 0.046 25947 195 1 4 . 1 1 22 22 ASN H H 22 8.568 8.568 7.921 0.647 25947 196 1 4 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.615 -0.306 25947 197 1 4 . 1 1 23 23 ALA H H 23 8.396 8.396 8.133 0.263 25947 198 1 4 . 1 1 24 24 GLY H H 24 8.390 8.390 8.455 -0.065 25947 199 1 4 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.697 -0.396 25947 200 1 4 . 1 1 25 25 ALA H H 25 8.147 8.147 7.660 0.487 25947 201 1 4 . 1 1 26 26 THR HA H 26 4.350 4.350 4.070 0.280 25947 202 1 4 . 1 1 26 26 THR H H 26 8.278 8.278 8.210 0.068 25947 203 1 4 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.160 0.218 25947 204 1 4 . 1 1 27 27 LEU H H 27 8.319 8.319 8.282 0.037 25947 205 1 5 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.628 -0.041 25947 206 1 5 . 1 1 2 2 TYR H H 2 8.713 8.713 8.108 0.605 25947 207 1 5 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.354 0.023 25947 208 1 5 . 1 1 3 3 GLU H H 3 8.321 8.321 8.385 -0.064 25947 209 1 5 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.009 0.413 25947 210 1 5 . 1 1 4 4 ILE H H 4 8.284 8.284 7.665 0.619 25947 211 1 5 . 1 1 5 5 THR HA H 5 4.388 4.388 4.236 0.152 25947 212 1 5 . 1 1 5 5 THR H H 5 8.145 8.145 8.306 -0.161 25947 213 1 5 . 1 1 6 6 THR HA H 6 4.322 4.322 4.399 -0.077 25947 214 1 5 . 1 1 6 6 THR H H 6 8.197 8.197 7.780 0.417 25947 215 1 5 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.771 1.134 25947 216 1 5 . 1 1 7 7 ILE H H 7 8.108 8.108 7.573 0.535 25947 217 1 5 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.640 0.085 25947 218 1 5 . 1 1 8 8 HIS H H 8 8.626 8.626 8.187 0.439 25947 219 1 5 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.787 -0.110 25947 220 1 5 . 1 1 9 9 ASN H H 9 8.495 8.495 8.177 0.318 25947 221 1 5 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.094 0.212 25947 222 1 5 . 1 1 10 10 LEU H H 10 8.336 8.336 7.724 0.612 25947 223 1 5 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.288 -0.005 25947 224 1 5 . 1 1 11 11 ALA H H 11 8.267 8.267 8.150 0.117 25947 225 1 5 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.471 -0.097 25947 226 1 5 . 1 1 12 12 ARG H H 12 8.209 8.209 7.974 0.235 25947 227 1 5 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.414 -0.117 25947 228 1 5 . 1 1 13 13 LYS H H 13 8.361 8.361 8.267 0.094 25947 229 1 5 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.137 0.214 25947 230 1 5 . 1 1 14 14 LEU H H 14 8.419 8.419 8.099 0.320 25947 231 1 5 . 1 1 15 15 THR HA H 15 4.301 4.301 4.070 0.231 25947 232 1 5 . 1 1 15 15 THR H H 15 8.145 8.145 8.150 -0.005 25947 233 1 5 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.519 0.211 25947 234 1 5 . 1 1 16 16 HIS H H 16 8.547 8.547 7.510 1.037 25947 235 1 5 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.154 0.238 25947 236 1 5 . 1 1 17 17 ARG H H 17 8.495 8.495 8.087 0.408 25947 237 1 5 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.267 0.151 25947 238 1 5 . 1 1 18 18 LEU H H 18 8.361 8.361 7.652 0.709 25947 239 1 5 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.625 -0.322 25947 240 1 5 . 1 1 19 19 ALA H H 19 8.369 8.369 7.306 1.063 25947 241 1 5 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.214 0.065 25947 242 1 5 . 1 1 20 20 ARG H H 20 8.211 8.211 7.622 0.589 25947 243 1 5 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.196 0.107 25947 244 1 5 . 1 1 21 21 ARG H H 21 8.211 8.211 8.167 0.044 25947 245 1 5 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.544 0.131 25947 246 1 5 . 1 1 22 22 ASN H H 22 8.568 8.568 8.184 0.384 25947 247 1 5 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.575 -0.266 25947 248 1 5 . 1 1 23 23 ALA H H 23 8.396 8.396 7.655 0.741 25947 249 1 5 . 1 1 24 24 GLY H H 24 8.390 8.390 8.428 -0.038 25947 250 1 5 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.659 -0.358 25947 251 1 5 . 1 1 25 25 ALA H H 25 8.147 8.147 7.992 0.155 25947 252 1 5 . 1 1 26 26 THR HA H 26 4.350 4.350 4.261 0.089 25947 253 1 5 . 1 1 26 26 THR H H 26 8.278 8.278 8.302 -0.024 25947 254 1 5 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.253 0.125 25947 255 1 5 . 1 1 27 27 LEU H H 27 8.319 8.319 8.292 0.027 25947 256 1 6 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.692 -0.105 25947 257 1 6 . 1 1 2 2 TYR H H 2 8.713 8.713 8.292 0.421 25947 258 1 6 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.389 -0.012 25947 259 1 6 . 1 1 3 3 GLU H H 3 8.321 8.321 8.811 -0.490 25947 260 1 6 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.135 0.287 25947 261 1 6 . 1 1 4 4 ILE H H 4 8.284 8.284 8.008 0.276 25947 262 1 6 . 1 1 5 5 THR HA H 5 4.388 4.388 4.195 0.193 25947 263 1 6 . 1 1 5 5 THR H H 5 8.145 8.145 8.227 -0.082 25947 264 1 6 . 1 1 6 6 THR HA H 6 4.322 4.322 4.268 0.054 25947 265 1 6 . 1 1 6 6 THR H H 6 8.197 8.197 7.609 0.588 25947 266 1 6 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.785 1.120 25947 267 1 6 . 1 1 7 7 ILE H H 7 8.108 8.108 7.649 0.459 25947 268 1 6 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.459 0.266 25947 269 1 6 . 1 1 8 8 HIS H H 8 8.626 8.626 7.892 0.734 25947 270 1 6 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.533 0.144 25947 271 1 6 . 1 1 9 9 ASN H H 9 8.495 8.495 8.004 0.491 25947 272 1 6 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.466 -0.160 25947 273 1 6 . 1 1 10 10 LEU H H 10 8.336 8.336 7.292 1.044 25947 274 1 6 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.519 -0.236 25947 275 1 6 . 1 1 11 11 ALA H H 11 8.267 8.267 7.361 0.906 25947 276 1 6 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.237 0.137 25947 277 1 6 . 1 1 12 12 ARG H H 12 8.209 8.209 8.025 0.184 25947 278 1 6 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.344 -0.047 25947 279 1 6 . 1 1 13 13 LYS H H 13 8.361 8.361 8.081 0.280 25947 280 1 6 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.013 0.338 25947 281 1 6 . 1 1 14 14 LEU H H 14 8.419 8.419 8.149 0.270 25947 282 1 6 . 1 1 15 15 THR HA H 15 4.301 4.301 3.959 0.342 25947 283 1 6 . 1 1 15 15 THR H H 15 8.145 8.145 8.017 0.128 25947 284 1 6 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.496 0.234 25947 285 1 6 . 1 1 16 16 HIS H H 16 8.547 8.547 7.801 0.746 25947 286 1 6 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.301 0.091 25947 287 1 6 . 1 1 17 17 ARG H H 17 8.495 8.495 8.161 0.334 25947 288 1 6 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.464 -0.046 25947 289 1 6 . 1 1 18 18 LEU H H 18 8.361 8.361 7.779 0.582 25947 290 1 6 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.608 -0.305 25947 291 1 6 . 1 1 19 19 ALA H H 19 8.369 8.369 8.111 0.258 25947 292 1 6 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.371 -0.092 25947 293 1 6 . 1 1 20 20 ARG H H 20 8.211 8.211 8.531 -0.320 25947 294 1 6 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.464 -0.161 25947 295 1 6 . 1 1 21 21 ARG H H 21 8.211 8.211 8.107 0.104 25947 296 1 6 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.579 0.096 25947 297 1 6 . 1 1 22 22 ASN H H 22 8.568 8.568 8.264 0.304 25947 298 1 6 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.387 -0.078 25947 299 1 6 . 1 1 23 23 ALA H H 23 8.396 8.396 8.389 0.007 25947 300 1 6 . 1 1 24 24 GLY H H 24 8.390 8.390 8.502 -0.112 25947 301 1 6 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.244 0.057 25947 302 1 6 . 1 1 25 25 ALA H H 25 8.147 8.147 8.167 -0.020 25947 303 1 6 . 1 1 26 26 THR HA H 26 4.350 4.350 4.113 0.237 25947 304 1 6 . 1 1 26 26 THR H H 26 8.278 8.278 7.899 0.379 25947 305 1 6 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.523 -0.145 25947 306 1 6 . 1 1 27 27 LEU H H 27 8.319 8.319 8.073 0.246 25947 307 1 7 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.678 -0.091 25947 308 1 7 . 1 1 2 2 TYR H H 2 8.713 8.713 8.606 0.107 25947 309 1 7 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.398 -0.021 25947 310 1 7 . 1 1 3 3 GLU H H 3 8.321 8.321 8.410 -0.089 25947 311 1 7 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.871 0.551 25947 312 1 7 . 1 1 4 4 ILE H H 4 8.284 8.284 7.887 0.397 25947 313 1 7 . 1 1 5 5 THR HA H 5 4.388 4.388 4.085 0.303 25947 314 1 7 . 1 1 5 5 THR H H 5 8.145 8.145 8.172 -0.027 25947 315 1 7 . 1 1 6 6 THR HA H 6 4.322 4.322 4.382 -0.060 25947 316 1 7 . 1 1 6 6 THR H H 6 8.197 8.197 7.818 0.379 25947 317 1 7 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.701 1.204 25947 318 1 7 . 1 1 7 7 ILE H H 7 8.108 8.108 7.572 0.536 25947 319 1 7 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.566 0.159 25947 320 1 7 . 1 1 8 8 HIS H H 8 8.626 8.626 8.297 0.329 25947 321 1 7 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.541 0.136 25947 322 1 7 . 1 1 9 9 ASN H H 9 8.495 8.495 8.273 0.222 25947 323 1 7 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.265 0.041 25947 324 1 7 . 1 1 10 10 LEU H H 10 8.336 8.336 7.961 0.375 25947 325 1 7 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.286 -0.003 25947 326 1 7 . 1 1 11 11 ALA H H 11 8.267 8.267 7.156 1.111 25947 327 1 7 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.244 0.130 25947 328 1 7 . 1 1 12 12 ARG H H 12 8.209 8.209 8.487 -0.278 25947 329 1 7 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.058 0.239 25947 330 1 7 . 1 1 13 13 LYS H H 13 8.361 8.361 8.172 0.189 25947 331 1 7 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.060 0.291 25947 332 1 7 . 1 1 14 14 LEU H H 14 8.419 8.419 7.862 0.557 25947 333 1 7 . 1 1 15 15 THR HA H 15 4.301 4.301 3.942 0.359 25947 334 1 7 . 1 1 15 15 THR H H 15 8.145 8.145 7.671 0.474 25947 335 1 7 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.599 0.131 25947 336 1 7 . 1 1 16 16 HIS H H 16 8.547 8.547 8.007 0.540 25947 337 1 7 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.159 0.233 25947 338 1 7 . 1 1 17 17 ARG H H 17 8.495 8.495 8.175 0.320 25947 339 1 7 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.474 -0.056 25947 340 1 7 . 1 1 18 18 LEU H H 18 8.361 8.361 7.934 0.427 25947 341 1 7 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.495 -0.192 25947 342 1 7 . 1 1 19 19 ALA H H 19 8.369 8.369 8.748 -0.379 25947 343 1 7 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.465 -0.186 25947 344 1 7 . 1 1 20 20 ARG H H 20 8.211 8.211 7.722 0.489 25947 345 1 7 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.181 0.122 25947 346 1 7 . 1 1 21 21 ARG H H 21 8.211 8.211 8.059 0.152 25947 347 1 7 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.644 0.031 25947 348 1 7 . 1 1 22 22 ASN H H 22 8.568 8.568 8.232 0.336 25947 349 1 7 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.400 -0.091 25947 350 1 7 . 1 1 23 23 ALA H H 23 8.396 8.396 8.201 0.195 25947 351 1 7 . 1 1 24 24 GLY H H 24 8.390 8.390 8.100 0.290 25947 352 1 7 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.548 -0.247 25947 353 1 7 . 1 1 25 25 ALA H H 25 8.147 8.147 8.070 0.077 25947 354 1 7 . 1 1 26 26 THR HA H 26 4.350 4.350 4.210 0.140 25947 355 1 7 . 1 1 26 26 THR H H 26 8.278 8.278 8.127 0.151 25947 356 1 7 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.550 -0.172 25947 357 1 7 . 1 1 27 27 LEU H H 27 8.319 8.319 8.267 0.052 25947 358 1 8 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.702 -0.115 25947 359 1 8 . 1 1 2 2 TYR H H 2 8.713 8.713 8.459 0.254 25947 360 1 8 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.437 -0.060 25947 361 1 8 . 1 1 3 3 GLU H H 3 8.321 8.321 8.661 -0.340 25947 362 1 8 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.951 0.471 25947 363 1 8 . 1 1 4 4 ILE H H 4 8.284 8.284 7.989 0.295 25947 364 1 8 . 1 1 5 5 THR HA H 5 4.388 4.388 4.242 0.146 25947 365 1 8 . 1 1 5 5 THR H H 5 8.145 8.145 8.195 -0.050 25947 366 1 8 . 1 1 6 6 THR HA H 6 4.322 4.322 4.256 0.066 25947 367 1 8 . 1 1 6 6 THR H H 6 8.197 8.197 7.836 0.361 25947 368 1 8 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.714 1.191 25947 369 1 8 . 1 1 7 7 ILE H H 7 8.108 8.108 7.880 0.228 25947 370 1 8 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.457 0.268 25947 371 1 8 . 1 1 8 8 HIS H H 8 8.626 8.626 7.674 0.952 25947 372 1 8 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.660 0.017 25947 373 1 8 . 1 1 9 9 ASN H H 9 8.495 8.495 7.887 0.608 25947 374 1 8 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.592 -0.286 25947 375 1 8 . 1 1 10 10 LEU H H 10 8.336 8.336 7.464 0.872 25947 376 1 8 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.383 -0.100 25947 377 1 8 . 1 1 11 11 ALA H H 11 8.267 8.267 7.152 1.115 25947 378 1 8 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.335 0.039 25947 379 1 8 . 1 1 12 12 ARG H H 12 8.209 8.209 8.383 -0.174 25947 380 1 8 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.036 0.261 25947 381 1 8 . 1 1 13 13 LYS H H 13 8.361 8.361 8.527 -0.166 25947 382 1 8 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.158 0.193 25947 383 1 8 . 1 1 14 14 LEU H H 14 8.419 8.419 7.867 0.552 25947 384 1 8 . 1 1 15 15 THR HA H 15 4.301 4.301 3.978 0.323 25947 385 1 8 . 1 1 15 15 THR H H 15 8.145 8.145 8.246 -0.101 25947 386 1 8 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.616 0.114 25947 387 1 8 . 1 1 16 16 HIS H H 16 8.547 8.547 7.868 0.679 25947 388 1 8 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.171 0.221 25947 389 1 8 . 1 1 17 17 ARG H H 17 8.495 8.495 8.196 0.299 25947 390 1 8 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.251 0.167 25947 391 1 8 . 1 1 18 18 LEU H H 18 8.361 8.361 7.569 0.792 25947 392 1 8 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.512 -0.209 25947 393 1 8 . 1 1 19 19 ALA H H 19 8.369 8.369 7.338 1.031 25947 394 1 8 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.435 -0.156 25947 395 1 8 . 1 1 20 20 ARG H H 20 8.211 8.211 7.942 0.269 25947 396 1 8 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.342 -0.039 25947 397 1 8 . 1 1 21 21 ARG H H 21 8.211 8.211 8.774 -0.563 25947 398 1 8 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.854 -0.179 25947 399 1 8 . 1 1 22 22 ASN H H 22 8.568 8.568 8.220 0.348 25947 400 1 8 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.644 -0.335 25947 401 1 8 . 1 1 23 23 ALA H H 23 8.396 8.396 8.700 -0.303 25947 402 1 8 . 1 1 24 24 GLY H H 24 8.390 8.390 8.219 0.171 25947 403 1 8 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.774 -0.473 25947 404 1 8 . 1 1 25 25 ALA H H 25 8.147 8.147 7.996 0.151 25947 405 1 8 . 1 1 26 26 THR HA H 26 4.350 4.350 4.174 0.176 25947 406 1 8 . 1 1 26 26 THR H H 26 8.278 8.278 8.271 0.007 25947 407 1 8 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.363 0.015 25947 408 1 8 . 1 1 27 27 LEU H H 27 8.319 8.319 8.062 0.257 25947 409 1 9 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.661 -0.074 25947 410 1 9 . 1 1 2 2 TYR H H 2 8.713 8.713 8.109 0.604 25947 411 1 9 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.479 -0.102 25947 412 1 9 . 1 1 3 3 GLU H H 3 8.321 8.321 8.626 -0.305 25947 413 1 9 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.978 0.444 25947 414 1 9 . 1 1 4 4 ILE H H 4 8.284 8.284 7.958 0.326 25947 415 1 9 . 1 1 5 5 THR HA H 5 4.388 4.388 4.278 0.110 25947 416 1 9 . 1 1 5 5 THR H H 5 8.145 8.145 7.724 0.421 25947 417 1 9 . 1 1 6 6 THR HA H 6 4.322 4.322 4.377 -0.055 25947 418 1 9 . 1 1 6 6 THR H H 6 8.197 8.197 7.817 0.380 25947 419 1 9 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.778 1.127 25947 420 1 9 . 1 1 7 7 ILE H H 7 8.108 8.108 7.478 0.630 25947 421 1 9 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.618 0.107 25947 422 1 9 . 1 1 8 8 HIS H H 8 8.626 8.626 8.148 0.478 25947 423 1 9 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.930 -0.253 25947 424 1 9 . 1 1 9 9 ASN H H 9 8.495 8.495 8.113 0.382 25947 425 1 9 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.473 -0.167 25947 426 1 9 . 1 1 10 10 LEU H H 10 8.336 8.336 7.788 0.548 25947 427 1 9 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.218 0.065 25947 428 1 9 . 1 1 11 11 ALA H H 11 8.267 8.267 7.813 0.454 25947 429 1 9 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.426 -0.052 25947 430 1 9 . 1 1 12 12 ARG H H 12 8.209 8.209 8.338 -0.129 25947 431 1 9 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.078 0.219 25947 432 1 9 . 1 1 13 13 LYS H H 13 8.361 8.361 8.600 -0.239 25947 433 1 9 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.142 0.209 25947 434 1 9 . 1 1 14 14 LEU H H 14 8.419 8.419 7.783 0.636 25947 435 1 9 . 1 1 15 15 THR HA H 15 4.301 4.301 3.962 0.339 25947 436 1 9 . 1 1 15 15 THR H H 15 8.145 8.145 7.990 0.155 25947 437 1 9 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.635 0.095 25947 438 1 9 . 1 1 16 16 HIS H H 16 8.547 8.547 8.017 0.530 25947 439 1 9 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.227 0.165 25947 440 1 9 . 1 1 17 17 ARG H H 17 8.495 8.495 8.138 0.357 25947 441 1 9 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.476 -0.058 25947 442 1 9 . 1 1 18 18 LEU H H 18 8.361 8.361 7.516 0.845 25947 443 1 9 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.632 -0.329 25947 444 1 9 . 1 1 19 19 ALA H H 19 8.369 8.369 8.372 -0.003 25947 445 1 9 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.421 -0.142 25947 446 1 9 . 1 1 20 20 ARG H H 20 8.211 8.211 8.135 0.076 25947 447 1 9 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.116 0.187 25947 448 1 9 . 1 1 21 21 ARG H H 21 8.211 8.211 8.362 -0.151 25947 449 1 9 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.696 -0.021 25947 450 1 9 . 1 1 22 22 ASN H H 22 8.568 8.568 8.088 0.480 25947 451 1 9 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.619 -0.310 25947 452 1 9 . 1 1 23 23 ALA H H 23 8.396 8.396 8.502 -0.106 25947 453 1 9 . 1 1 24 24 GLY H H 24 8.390 8.390 8.231 0.159 25947 454 1 9 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.550 -0.249 25947 455 1 9 . 1 1 25 25 ALA H H 25 8.147 8.147 8.106 0.041 25947 456 1 9 . 1 1 26 26 THR HA H 26 4.350 4.350 4.429 -0.079 25947 457 1 9 . 1 1 26 26 THR H H 26 8.278 8.278 8.433 -0.155 25947 458 1 9 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.541 -0.163 25947 459 1 9 . 1 1 27 27 LEU H H 27 8.319 8.319 7.973 0.346 25947 460 1 10 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.723 -0.136 25947 461 1 10 . 1 1 2 2 TYR H H 2 8.713 8.713 8.018 0.695 25947 462 1 10 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.386 -0.009 25947 463 1 10 . 1 1 3 3 GLU H H 3 8.321 8.321 8.762 -0.441 25947 464 1 10 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.015 0.407 25947 465 1 10 . 1 1 4 4 ILE H H 4 8.284 8.284 8.076 0.208 25947 466 1 10 . 1 1 5 5 THR HA H 5 4.388 4.388 4.218 0.170 25947 467 1 10 . 1 1 5 5 THR H H 5 8.145 8.145 7.989 0.156 25947 468 1 10 . 1 1 6 6 THR HA H 6 4.322 4.322 4.490 -0.168 25947 469 1 10 . 1 1 6 6 THR H H 6 8.197 8.197 7.877 0.320 25947 470 1 10 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.817 1.088 25947 471 1 10 . 1 1 7 7 ILE H H 7 8.108 8.108 7.526 0.582 25947 472 1 10 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.631 0.094 25947 473 1 10 . 1 1 8 8 HIS H H 8 8.626 8.626 8.108 0.518 25947 474 1 10 . 1 1 9 9 ASN HA H 9 4.677 4.677 5.009 -0.332 25947 475 1 10 . 1 1 9 9 ASN H H 9 8.495 8.495 8.069 0.426 25947 476 1 10 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.771 -0.465 25947 477 1 10 . 1 1 10 10 LEU H H 10 8.336 8.336 7.864 0.472 25947 478 1 10 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.561 -0.278 25947 479 1 10 . 1 1 11 11 ALA H H 11 8.267 8.267 7.855 0.412 25947 480 1 10 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.221 0.153 25947 481 1 10 . 1 1 12 12 ARG H H 12 8.209 8.209 8.833 -0.624 25947 482 1 10 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.311 -0.014 25947 483 1 10 . 1 1 13 13 LYS H H 13 8.361 8.361 8.089 0.272 25947 484 1 10 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.080 0.271 25947 485 1 10 . 1 1 14 14 LEU H H 14 8.419 8.419 8.001 0.418 25947 486 1 10 . 1 1 15 15 THR HA H 15 4.301 4.301 3.929 0.372 25947 487 1 10 . 1 1 15 15 THR H H 15 8.145 8.145 8.258 -0.113 25947 488 1 10 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.399 0.331 25947 489 1 10 . 1 1 16 16 HIS H H 16 8.547 8.547 7.614 0.933 25947 490 1 10 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.149 0.243 25947 491 1 10 . 1 1 17 17 ARG H H 17 8.495 8.495 8.021 0.474 25947 492 1 10 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.503 -0.085 25947 493 1 10 . 1 1 18 18 LEU H H 18 8.361 8.361 8.196 0.165 25947 494 1 10 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.508 -0.205 25947 495 1 10 . 1 1 19 19 ALA H H 19 8.369 8.369 8.425 -0.056 25947 496 1 10 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.290 -0.011 25947 497 1 10 . 1 1 20 20 ARG H H 20 8.211 8.211 8.328 -0.117 25947 498 1 10 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.186 0.117 25947 499 1 10 . 1 1 21 21 ARG H H 21 8.211 8.211 8.443 -0.232 25947 500 1 10 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.829 -0.154 25947 501 1 10 . 1 1 22 22 ASN H H 22 8.568 8.568 8.151 0.417 25947 502 1 10 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.724 -0.415 25947 503 1 10 . 1 1 23 23 ALA H H 23 8.396 8.396 7.247 1.149 25947 504 1 10 . 1 1 24 24 GLY H H 24 8.390 8.390 8.486 -0.096 25947 505 1 10 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.133 0.168 25947 506 1 10 . 1 1 25 25 ALA H H 25 8.147 8.147 8.192 -0.045 25947 507 1 10 . 1 1 26 26 THR HA H 26 4.350 4.350 4.146 0.204 25947 508 1 10 . 1 1 26 26 THR H H 26 8.278 8.278 7.928 0.350 25947 509 1 10 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.704 -0.326 25947 510 1 10 . 1 1 27 27 LEU H H 27 8.319 8.319 7.428 0.891 25947 511 1 11 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.548 0.039 25947 512 1 11 . 1 1 2 2 TYR H H 2 8.713 8.713 8.201 0.512 25947 513 1 11 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.381 -0.004 25947 514 1 11 . 1 1 3 3 GLU H H 3 8.321 8.321 8.261 0.060 25947 515 1 11 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.981 0.441 25947 516 1 11 . 1 1 4 4 ILE H H 4 8.284 8.284 7.973 0.311 25947 517 1 11 . 1 1 5 5 THR HA H 5 4.388 4.388 4.273 0.115 25947 518 1 11 . 1 1 5 5 THR H H 5 8.145 8.145 7.802 0.343 25947 519 1 11 . 1 1 6 6 THR HA H 6 4.322 4.322 4.404 -0.082 25947 520 1 11 . 1 1 6 6 THR H H 6 8.197 8.197 7.803 0.394 25947 521 1 11 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.829 1.076 25947 522 1 11 . 1 1 7 7 ILE H H 7 8.108 8.108 7.537 0.571 25947 523 1 11 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.642 0.083 25947 524 1 11 . 1 1 8 8 HIS H H 8 8.626 8.626 8.162 0.464 25947 525 1 11 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.854 -0.177 25947 526 1 11 . 1 1 9 9 ASN H H 9 8.495 8.495 8.441 0.054 25947 527 1 11 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.450 -0.144 25947 528 1 11 . 1 1 10 10 LEU H H 10 8.336 8.336 7.690 0.646 25947 529 1 11 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.313 -0.030 25947 530 1 11 . 1 1 11 11 ALA H H 11 8.267 8.267 7.944 0.323 25947 531 1 11 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.167 0.207 25947 532 1 11 . 1 1 12 12 ARG H H 12 8.209 8.209 8.165 0.044 25947 533 1 11 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.365 -0.068 25947 534 1 11 . 1 1 13 13 LYS H H 13 8.361 8.361 8.273 0.088 25947 535 1 11 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.119 0.232 25947 536 1 11 . 1 1 14 14 LEU H H 14 8.419 8.419 8.195 0.224 25947 537 1 11 . 1 1 15 15 THR HA H 15 4.301 4.301 3.981 0.320 25947 538 1 11 . 1 1 15 15 THR H H 15 8.145 8.145 8.058 0.087 25947 539 1 11 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.622 0.108 25947 540 1 11 . 1 1 16 16 HIS H H 16 8.547 8.547 7.888 0.659 25947 541 1 11 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.131 0.261 25947 542 1 11 . 1 1 17 17 ARG H H 17 8.495 8.495 8.361 0.134 25947 543 1 11 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.351 0.067 25947 544 1 11 . 1 1 18 18 LEU H H 18 8.361 8.361 7.445 0.916 25947 545 1 11 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.284 0.019 25947 546 1 11 . 1 1 19 19 ALA H H 19 8.369 8.369 7.506 0.863 25947 547 1 11 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.411 -0.132 25947 548 1 11 . 1 1 20 20 ARG H H 20 8.211 8.211 7.879 0.332 25947 549 1 11 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.174 0.129 25947 550 1 11 . 1 1 21 21 ARG H H 21 8.211 8.211 8.139 0.072 25947 551 1 11 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.846 -0.171 25947 552 1 11 . 1 1 22 22 ASN H H 22 8.568 8.568 8.315 0.253 25947 553 1 11 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.620 -0.311 25947 554 1 11 . 1 1 23 23 ALA H H 23 8.396 8.396 7.261 1.135 25947 555 1 11 . 1 1 24 24 GLY H H 24 8.390 8.390 8.598 -0.208 25947 556 1 11 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.594 -0.293 25947 557 1 11 . 1 1 25 25 ALA H H 25 8.147 8.147 7.635 0.512 25947 558 1 11 . 1 1 26 26 THR HA H 26 4.350 4.350 4.074 0.276 25947 559 1 11 . 1 1 26 26 THR H H 26 8.278 8.278 8.138 0.140 25947 560 1 11 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.345 0.033 25947 561 1 11 . 1 1 27 27 LEU H H 27 8.319 8.319 7.956 0.363 25947 562 1 12 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.712 -0.125 25947 563 1 12 . 1 1 2 2 TYR H H 2 8.713 8.713 8.244 0.469 25947 564 1 12 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.374 0.003 25947 565 1 12 . 1 1 3 3 GLU H H 3 8.321 8.321 8.218 0.103 25947 566 1 12 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.896 0.526 25947 567 1 12 . 1 1 4 4 ILE H H 4 8.284 8.284 7.735 0.549 25947 568 1 12 . 1 1 5 5 THR HA H 5 4.388 4.388 4.119 0.269 25947 569 1 12 . 1 1 5 5 THR H H 5 8.145 8.145 8.023 0.122 25947 570 1 12 . 1 1 6 6 THR HA H 6 4.322 4.322 4.314 0.008 25947 571 1 12 . 1 1 6 6 THR H H 6 8.197 8.197 7.666 0.531 25947 572 1 12 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.808 1.097 25947 573 1 12 . 1 1 7 7 ILE H H 7 8.108 8.108 7.465 0.643 25947 574 1 12 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.605 0.120 25947 575 1 12 . 1 1 8 8 HIS H H 8 8.626 8.626 8.166 0.460 25947 576 1 12 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.809 -0.132 25947 577 1 12 . 1 1 9 9 ASN H H 9 8.495 8.495 8.444 0.051 25947 578 1 12 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.382 -0.076 25947 579 1 12 . 1 1 10 10 LEU H H 10 8.336 8.336 7.513 0.823 25947 580 1 12 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.561 -0.278 25947 581 1 12 . 1 1 11 11 ALA H H 11 8.267 8.267 7.858 0.409 25947 582 1 12 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.371 0.003 25947 583 1 12 . 1 1 12 12 ARG H H 12 8.209 8.209 8.544 -0.335 25947 584 1 12 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.326 -0.029 25947 585 1 12 . 1 1 13 13 LYS H H 13 8.361 8.361 8.486 -0.125 25947 586 1 12 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.150 0.201 25947 587 1 12 . 1 1 14 14 LEU H H 14 8.419 8.419 8.123 0.296 25947 588 1 12 . 1 1 15 15 THR HA H 15 4.301 4.301 4.019 0.282 25947 589 1 12 . 1 1 15 15 THR H H 15 8.145 8.145 8.205 -0.060 25947 590 1 12 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.591 0.139 25947 591 1 12 . 1 1 16 16 HIS H H 16 8.547 8.547 7.944 0.603 25947 592 1 12 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.015 0.377 25947 593 1 12 . 1 1 17 17 ARG H H 17 8.495 8.495 8.216 0.279 25947 594 1 12 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.391 0.027 25947 595 1 12 . 1 1 18 18 LEU H H 18 8.361 8.361 7.538 0.823 25947 596 1 12 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.335 -0.032 25947 597 1 12 . 1 1 19 19 ALA H H 19 8.369 8.369 7.302 1.067 25947 598 1 12 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.066 0.213 25947 599 1 12 . 1 1 20 20 ARG H H 20 8.211 8.211 7.498 0.713 25947 600 1 12 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.495 -0.192 25947 601 1 12 . 1 1 21 21 ARG H H 21 8.211 8.211 8.237 -0.026 25947 602 1 12 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.828 -0.153 25947 603 1 12 . 1 1 22 22 ASN H H 22 8.568 8.568 8.142 0.426 25947 604 1 12 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.581 -0.272 25947 605 1 12 . 1 1 23 23 ALA H H 23 8.396 8.396 8.469 -0.073 25947 606 1 12 . 1 1 24 24 GLY H H 24 8.390 8.390 8.205 0.185 25947 607 1 12 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.664 -0.363 25947 608 1 12 . 1 1 25 25 ALA H H 25 8.147 8.147 7.803 0.344 25947 609 1 12 . 1 1 26 26 THR HA H 26 4.350 4.350 4.058 0.292 25947 610 1 12 . 1 1 26 26 THR H H 26 8.278 8.278 8.309 -0.031 25947 611 1 12 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.368 0.010 25947 612 1 12 . 1 1 27 27 LEU H H 27 8.319 8.319 7.895 0.424 25947 613 1 13 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.659 -0.072 25947 614 1 13 . 1 1 2 2 TYR H H 2 8.713 8.713 8.530 0.183 25947 615 1 13 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.440 -0.063 25947 616 1 13 . 1 1 3 3 GLU H H 3 8.321 8.321 8.582 -0.261 25947 617 1 13 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.962 0.460 25947 618 1 13 . 1 1 4 4 ILE H H 4 8.284 8.284 8.243 0.041 25947 619 1 13 . 1 1 5 5 THR HA H 5 4.388 4.388 4.153 0.235 25947 620 1 13 . 1 1 5 5 THR H H 5 8.145 8.145 8.292 -0.147 25947 621 1 13 . 1 1 6 6 THR HA H 6 4.322 4.322 4.220 0.102 25947 622 1 13 . 1 1 6 6 THR H H 6 8.197 8.197 7.995 0.202 25947 623 1 13 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.837 1.068 25947 624 1 13 . 1 1 7 7 ILE H H 7 8.108 8.108 7.652 0.456 25947 625 1 13 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.572 0.153 25947 626 1 13 . 1 1 8 8 HIS H H 8 8.626 8.626 7.892 0.734 25947 627 1 13 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.846 -0.169 25947 628 1 13 . 1 1 9 9 ASN H H 9 8.495 8.495 7.881 0.614 25947 629 1 13 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.270 0.036 25947 630 1 13 . 1 1 10 10 LEU H H 10 8.336 8.336 7.268 1.068 25947 631 1 13 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.622 -0.339 25947 632 1 13 . 1 1 11 11 ALA H H 11 8.267 8.267 7.947 0.320 25947 633 1 13 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.426 -0.052 25947 634 1 13 . 1 1 12 12 ARG H H 12 8.209 8.209 8.614 -0.405 25947 635 1 13 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.082 0.215 25947 636 1 13 . 1 1 13 13 LYS H H 13 8.361 8.361 8.545 -0.184 25947 637 1 13 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.133 0.218 25947 638 1 13 . 1 1 14 14 LEU H H 14 8.419 8.419 7.784 0.635 25947 639 1 13 . 1 1 15 15 THR HA H 15 4.301 4.301 3.973 0.328 25947 640 1 13 . 1 1 15 15 THR H H 15 8.145 8.145 7.997 0.148 25947 641 1 13 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.648 0.082 25947 642 1 13 . 1 1 16 16 HIS H H 16 8.547 8.547 7.942 0.605 25947 643 1 13 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.170 0.222 25947 644 1 13 . 1 1 17 17 ARG H H 17 8.495 8.495 8.327 0.168 25947 645 1 13 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.209 0.209 25947 646 1 13 . 1 1 18 18 LEU H H 18 8.361 8.361 7.511 0.850 25947 647 1 13 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.515 -0.212 25947 648 1 13 . 1 1 19 19 ALA H H 19 8.369 8.369 7.151 1.218 25947 649 1 13 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.228 0.051 25947 650 1 13 . 1 1 20 20 ARG H H 20 8.211 8.211 7.881 0.330 25947 651 1 13 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.194 0.109 25947 652 1 13 . 1 1 21 21 ARG H H 21 8.211 8.211 8.403 -0.192 25947 653 1 13 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.886 -0.211 25947 654 1 13 . 1 1 22 22 ASN H H 22 8.568 8.568 7.915 0.653 25947 655 1 13 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.566 -0.257 25947 656 1 13 . 1 1 23 23 ALA H H 23 8.396 8.396 7.496 0.900 25947 657 1 13 . 1 1 24 24 GLY H H 24 8.390 8.390 8.318 0.072 25947 658 1 13 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.563 -0.262 25947 659 1 13 . 1 1 25 25 ALA H H 25 8.147 8.147 7.667 0.480 25947 660 1 13 . 1 1 26 26 THR HA H 26 4.350 4.350 4.007 0.343 25947 661 1 13 . 1 1 26 26 THR H H 26 8.278 8.278 8.223 0.055 25947 662 1 13 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.232 0.146 25947 663 1 13 . 1 1 27 27 LEU H H 27 8.319 8.319 8.026 0.293 25947 664 1 14 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.571 0.016 25947 665 1 14 . 1 1 2 2 TYR H H 2 8.713 8.713 8.758 -0.045 25947 666 1 14 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.255 0.122 25947 667 1 14 . 1 1 3 3 GLU H H 3 8.321 8.321 8.634 -0.313 25947 668 1 14 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.925 0.497 25947 669 1 14 . 1 1 4 4 ILE H H 4 8.284 8.284 7.683 0.601 25947 670 1 14 . 1 1 5 5 THR HA H 5 4.388 4.388 4.086 0.302 25947 671 1 14 . 1 1 5 5 THR H H 5 8.145 8.145 8.041 0.104 25947 672 1 14 . 1 1 6 6 THR HA H 6 4.322 4.322 4.391 -0.069 25947 673 1 14 . 1 1 6 6 THR H H 6 8.197 8.197 7.398 0.799 25947 674 1 14 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.748 1.157 25947 675 1 14 . 1 1 7 7 ILE H H 7 8.108 8.108 7.445 0.663 25947 676 1 14 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.584 0.141 25947 677 1 14 . 1 1 8 8 HIS H H 8 8.626 8.626 8.045 0.581 25947 678 1 14 . 1 1 9 9 ASN HA H 9 4.677 4.677 5.011 -0.334 25947 679 1 14 . 1 1 9 9 ASN H H 9 8.495 8.495 8.095 0.400 25947 680 1 14 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.517 -0.211 25947 681 1 14 . 1 1 10 10 LEU H H 10 8.336 8.336 8.098 0.238 25947 682 1 14 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.467 -0.184 25947 683 1 14 . 1 1 11 11 ALA H H 11 8.267 8.267 7.857 0.410 25947 684 1 14 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.488 -0.114 25947 685 1 14 . 1 1 12 12 ARG H H 12 8.209 8.209 8.463 -0.254 25947 686 1 14 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.171 0.126 25947 687 1 14 . 1 1 13 13 LYS H H 13 8.361 8.361 8.607 -0.246 25947 688 1 14 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.374 -0.023 25947 689 1 14 . 1 1 14 14 LEU H H 14 8.419 8.419 7.785 0.634 25947 690 1 14 . 1 1 15 15 THR HA H 15 4.301 4.301 4.130 0.171 25947 691 1 14 . 1 1 15 15 THR H H 15 8.145 8.145 8.073 0.072 25947 692 1 14 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.656 0.074 25947 693 1 14 . 1 1 16 16 HIS H H 16 8.547 8.547 7.617 0.930 25947 694 1 14 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.073 0.319 25947 695 1 14 . 1 1 17 17 ARG H H 17 8.495 8.495 8.074 0.421 25947 696 1 14 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.497 -0.079 25947 697 1 14 . 1 1 18 18 LEU H H 18 8.361 8.361 7.583 0.778 25947 698 1 14 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.171 0.132 25947 699 1 14 . 1 1 19 19 ALA H H 19 8.369 8.369 7.404 0.965 25947 700 1 14 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.273 0.006 25947 701 1 14 . 1 1 20 20 ARG H H 20 8.211 8.211 7.425 0.786 25947 702 1 14 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.515 -0.212 25947 703 1 14 . 1 1 21 21 ARG H H 21 8.211 8.211 8.494 -0.283 25947 704 1 14 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.658 0.017 25947 705 1 14 . 1 1 22 22 ASN H H 22 8.568 8.568 8.076 0.492 25947 706 1 14 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.530 -0.221 25947 707 1 14 . 1 1 23 23 ALA H H 23 8.396 8.396 7.836 0.560 25947 708 1 14 . 1 1 24 24 GLY H H 24 8.390 8.390 8.365 0.025 25947 709 1 14 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.617 -0.316 25947 710 1 14 . 1 1 25 25 ALA H H 25 8.147 8.147 7.709 0.438 25947 711 1 14 . 1 1 26 26 THR HA H 26 4.350 4.350 4.094 0.256 25947 712 1 14 . 1 1 26 26 THR H H 26 8.278 8.278 8.678 -0.400 25947 713 1 14 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.188 0.190 25947 714 1 14 . 1 1 27 27 LEU H H 27 8.319 8.319 8.225 0.094 25947 715 1 15 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.763 -0.176 25947 716 1 15 . 1 1 2 2 TYR H H 2 8.713 8.713 8.152 0.561 25947 717 1 15 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.299 0.078 25947 718 1 15 . 1 1 3 3 GLU H H 3 8.321 8.321 8.543 -0.222 25947 719 1 15 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.906 0.516 25947 720 1 15 . 1 1 4 4 ILE H H 4 8.284 8.284 7.766 0.518 25947 721 1 15 . 1 1 5 5 THR HA H 5 4.388 4.388 4.119 0.269 25947 722 1 15 . 1 1 5 5 THR H H 5 8.145 8.145 8.123 0.022 25947 723 1 15 . 1 1 6 6 THR HA H 6 4.322 4.322 4.357 -0.035 25947 724 1 15 . 1 1 6 6 THR H H 6 8.197 8.197 7.653 0.544 25947 725 1 15 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.624 1.281 25947 726 1 15 . 1 1 7 7 ILE H H 7 8.108 8.108 7.567 0.541 25947 727 1 15 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.410 0.315 25947 728 1 15 . 1 1 8 8 HIS H H 8 8.626 8.626 8.159 0.467 25947 729 1 15 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.577 0.100 25947 730 1 15 . 1 1 9 9 ASN H H 9 8.495 8.495 7.497 0.998 25947 731 1 15 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.270 0.036 25947 732 1 15 . 1 1 10 10 LEU H H 10 8.336 8.336 8.076 0.260 25947 733 1 15 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.331 -0.048 25947 734 1 15 . 1 1 11 11 ALA H H 11 8.267 8.267 7.286 0.981 25947 735 1 15 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.365 0.009 25947 736 1 15 . 1 1 12 12 ARG H H 12 8.209 8.209 8.128 0.081 25947 737 1 15 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.406 -0.109 25947 738 1 15 . 1 1 13 13 LYS H H 13 8.361 8.361 8.281 0.080 25947 739 1 15 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.056 0.295 25947 740 1 15 . 1 1 14 14 LEU H H 14 8.419 8.419 8.109 0.310 25947 741 1 15 . 1 1 15 15 THR HA H 15 4.301 4.301 3.969 0.332 25947 742 1 15 . 1 1 15 15 THR H H 15 8.145 8.145 8.288 -0.143 25947 743 1 15 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.517 0.213 25947 744 1 15 . 1 1 16 16 HIS H H 16 8.547 8.547 7.628 0.919 25947 745 1 15 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.064 0.328 25947 746 1 15 . 1 1 17 17 ARG H H 17 8.495 8.495 8.151 0.344 25947 747 1 15 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.039 0.379 25947 748 1 15 . 1 1 18 18 LEU H H 18 8.361 8.361 7.602 0.759 25947 749 1 15 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.352 -0.049 25947 750 1 15 . 1 1 19 19 ALA H H 19 8.369 8.369 8.270 0.099 25947 751 1 15 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.161 0.118 25947 752 1 15 . 1 1 20 20 ARG H H 20 8.211 8.211 7.695 0.516 25947 753 1 15 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.100 0.203 25947 754 1 15 . 1 1 21 21 ARG H H 21 8.211 8.211 8.462 -0.251 25947 755 1 15 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.652 0.023 25947 756 1 15 . 1 1 22 22 ASN H H 22 8.568 8.568 7.652 0.916 25947 757 1 15 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.300 0.009 25947 758 1 15 . 1 1 23 23 ALA H H 23 8.396 8.396 8.163 0.233 25947 759 1 15 . 1 1 24 24 GLY H H 24 8.390 8.390 8.372 0.018 25947 760 1 15 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.790 -0.489 25947 761 1 15 . 1 1 25 25 ALA H H 25 8.147 8.147 8.406 -0.259 25947 762 1 15 . 1 1 26 26 THR HA H 26 4.350 4.350 4.088 0.262 25947 763 1 15 . 1 1 26 26 THR H H 26 8.278 8.278 8.211 0.067 25947 764 1 15 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.081 0.297 25947 765 1 15 . 1 1 27 27 LEU H H 27 8.319 8.319 8.199 0.120 25947 766 1 16 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.786 -0.199 25947 767 1 16 . 1 1 2 2 TYR H H 2 8.713 8.713 8.620 0.093 25947 768 1 16 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.403 -0.026 25947 769 1 16 . 1 1 3 3 GLU H H 3 8.321 8.321 8.694 -0.373 25947 770 1 16 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.046 0.376 25947 771 1 16 . 1 1 4 4 ILE H H 4 8.284 8.284 7.954 0.330 25947 772 1 16 . 1 1 5 5 THR HA H 5 4.388 4.388 4.293 0.095 25947 773 1 16 . 1 1 5 5 THR H H 5 8.145 8.145 7.929 0.216 25947 774 1 16 . 1 1 6 6 THR HA H 6 4.322 4.322 4.434 -0.112 25947 775 1 16 . 1 1 6 6 THR H H 6 8.197 8.197 7.805 0.392 25947 776 1 16 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.686 1.219 25947 777 1 16 . 1 1 7 7 ILE H H 7 8.108 8.108 7.600 0.508 25947 778 1 16 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.541 0.184 25947 779 1 16 . 1 1 8 8 HIS H H 8 8.626 8.626 8.218 0.408 25947 780 1 16 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.521 0.156 25947 781 1 16 . 1 1 9 9 ASN H H 9 8.495 8.495 8.342 0.153 25947 782 1 16 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.233 0.073 25947 783 1 16 . 1 1 10 10 LEU H H 10 8.336 8.336 7.582 0.754 25947 784 1 16 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.534 -0.251 25947 785 1 16 . 1 1 11 11 ALA H H 11 8.267 8.267 7.382 0.885 25947 786 1 16 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.191 0.183 25947 787 1 16 . 1 1 12 12 ARG H H 12 8.209 8.209 7.713 0.496 25947 788 1 16 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.374 -0.077 25947 789 1 16 . 1 1 13 13 LYS H H 13 8.361 8.361 8.496 -0.135 25947 790 1 16 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.012 0.339 25947 791 1 16 . 1 1 14 14 LEU H H 14 8.419 8.419 8.374 0.045 25947 792 1 16 . 1 1 15 15 THR HA H 15 4.301 4.301 3.958 0.343 25947 793 1 16 . 1 1 15 15 THR H H 15 8.145 8.145 8.276 -0.131 25947 794 1 16 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.669 0.061 25947 795 1 16 . 1 1 16 16 HIS H H 16 8.547 8.547 7.949 0.598 25947 796 1 16 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.159 0.233 25947 797 1 16 . 1 1 17 17 ARG H H 17 8.495 8.495 8.160 0.335 25947 798 1 16 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.658 -0.240 25947 799 1 16 . 1 1 18 18 LEU H H 18 8.361 8.361 7.414 0.947 25947 800 1 16 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.554 -0.251 25947 801 1 16 . 1 1 19 19 ALA H H 19 8.369 8.369 8.118 0.251 25947 802 1 16 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.534 -0.255 25947 803 1 16 . 1 1 20 20 ARG H H 20 8.211 8.211 8.443 -0.232 25947 804 1 16 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.456 -0.153 25947 805 1 16 . 1 1 21 21 ARG H H 21 8.211 8.211 8.042 0.169 25947 806 1 16 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.544 0.131 25947 807 1 16 . 1 1 22 22 ASN H H 22 8.568 8.568 8.424 0.144 25947 808 1 16 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.601 -0.292 25947 809 1 16 . 1 1 23 23 ALA H H 23 8.396 8.396 8.198 0.198 25947 810 1 16 . 1 1 24 24 GLY H H 24 8.390 8.390 7.633 0.757 25947 811 1 16 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.444 -0.143 25947 812 1 16 . 1 1 25 25 ALA H H 25 8.147 8.147 8.201 -0.054 25947 813 1 16 . 1 1 26 26 THR HA H 26 4.350 4.350 4.169 0.181 25947 814 1 16 . 1 1 26 26 THR H H 26 8.278 8.278 8.421 -0.143 25947 815 1 16 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.357 0.021 25947 816 1 16 . 1 1 27 27 LEU H H 27 8.319 8.319 8.286 0.033 25947 817 1 17 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.644 -0.057 25947 818 1 17 . 1 1 2 2 TYR H H 2 8.713 8.713 8.011 0.702 25947 819 1 17 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.476 -0.099 25947 820 1 17 . 1 1 3 3 GLU H H 3 8.321 8.321 8.563 -0.242 25947 821 1 17 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.813 0.609 25947 822 1 17 . 1 1 4 4 ILE H H 4 8.284 8.284 7.991 0.293 25947 823 1 17 . 1 1 5 5 THR HA H 5 4.388 4.388 4.088 0.300 25947 824 1 17 . 1 1 5 5 THR H H 5 8.145 8.145 7.943 0.202 25947 825 1 17 . 1 1 6 6 THR HA H 6 4.322 4.322 4.249 0.073 25947 826 1 17 . 1 1 6 6 THR H H 6 8.197 8.197 7.744 0.453 25947 827 1 17 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.820 1.085 25947 828 1 17 . 1 1 7 7 ILE H H 7 8.108 8.108 7.822 0.286 25947 829 1 17 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.542 0.183 25947 830 1 17 . 1 1 8 8 HIS H H 8 8.626 8.626 7.834 0.792 25947 831 1 17 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.590 0.087 25947 832 1 17 . 1 1 9 9 ASN H H 9 8.495 8.495 7.643 0.852 25947 833 1 17 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.107 0.199 25947 834 1 17 . 1 1 10 10 LEU H H 10 8.336 8.336 7.452 0.884 25947 835 1 17 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.170 0.113 25947 836 1 17 . 1 1 11 11 ALA H H 11 8.267 8.267 7.343 0.924 25947 837 1 17 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.399 -0.025 25947 838 1 17 . 1 1 12 12 ARG H H 12 8.209 8.209 8.031 0.178 25947 839 1 17 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.410 -0.113 25947 840 1 17 . 1 1 13 13 LYS H H 13 8.361 8.361 8.288 0.073 25947 841 1 17 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.124 0.227 25947 842 1 17 . 1 1 14 14 LEU H H 14 8.419 8.419 8.047 0.372 25947 843 1 17 . 1 1 15 15 THR HA H 15 4.301 4.301 4.032 0.269 25947 844 1 17 . 1 1 15 15 THR H H 15 8.145 8.145 8.265 -0.120 25947 845 1 17 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.555 0.175 25947 846 1 17 . 1 1 16 16 HIS H H 16 8.547 8.547 7.718 0.829 25947 847 1 17 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.130 0.262 25947 848 1 17 . 1 1 17 17 ARG H H 17 8.495 8.495 8.157 0.338 25947 849 1 17 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.749 -0.331 25947 850 1 17 . 1 1 18 18 LEU H H 18 8.361 8.361 7.724 0.637 25947 851 1 17 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.440 -0.137 25947 852 1 17 . 1 1 19 19 ALA H H 19 8.369 8.369 8.464 -0.095 25947 853 1 17 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.455 -0.176 25947 854 1 17 . 1 1 20 20 ARG H H 20 8.211 8.211 8.040 0.171 25947 855 1 17 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.181 0.122 25947 856 1 17 . 1 1 21 21 ARG H H 21 8.211 8.211 8.197 0.014 25947 857 1 17 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.572 0.103 25947 858 1 17 . 1 1 22 22 ASN H H 22 8.568 8.568 8.306 0.262 25947 859 1 17 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.266 0.043 25947 860 1 17 . 1 1 23 23 ALA H H 23 8.396 8.396 7.928 0.468 25947 861 1 17 . 1 1 24 24 GLY H H 24 8.390 8.390 7.663 0.727 25947 862 1 17 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.617 -0.316 25947 863 1 17 . 1 1 25 25 ALA H H 25 8.147 8.147 7.417 0.730 25947 864 1 17 . 1 1 26 26 THR HA H 26 4.350 4.350 4.010 0.340 25947 865 1 17 . 1 1 26 26 THR H H 26 8.278 8.278 8.063 0.215 25947 866 1 17 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.034 0.344 25947 867 1 17 . 1 1 27 27 LEU H H 27 8.319 8.319 8.260 0.059 25947 868 1 18 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.552 0.035 25947 869 1 18 . 1 1 2 2 TYR H H 2 8.713 8.713 8.313 0.400 25947 870 1 18 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.328 0.049 25947 871 1 18 . 1 1 3 3 GLU H H 3 8.321 8.321 8.584 -0.263 25947 872 1 18 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.935 0.487 25947 873 1 18 . 1 1 4 4 ILE H H 4 8.284 8.284 7.852 0.432 25947 874 1 18 . 1 1 5 5 THR HA H 5 4.388 4.388 4.214 0.174 25947 875 1 18 . 1 1 5 5 THR H H 5 8.145 8.145 8.204 -0.059 25947 876 1 18 . 1 1 6 6 THR HA H 6 4.322 4.322 4.412 -0.090 25947 877 1 18 . 1 1 6 6 THR H H 6 8.197 8.197 7.884 0.313 25947 878 1 18 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.731 1.174 25947 879 1 18 . 1 1 7 7 ILE H H 7 8.108 8.108 7.814 0.294 25947 880 1 18 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.624 0.101 25947 881 1 18 . 1 1 8 8 HIS H H 8 8.626 8.626 8.078 0.548 25947 882 1 18 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.510 0.167 25947 883 1 18 . 1 1 9 9 ASN H H 9 8.495 8.495 7.969 0.526 25947 884 1 18 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.457 -0.151 25947 885 1 18 . 1 1 10 10 LEU H H 10 8.336 8.336 7.765 0.571 25947 886 1 18 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.322 -0.039 25947 887 1 18 . 1 1 11 11 ALA H H 11 8.267 8.267 7.554 0.713 25947 888 1 18 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.099 0.275 25947 889 1 18 . 1 1 12 12 ARG H H 12 8.209 8.209 7.696 0.513 25947 890 1 18 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.414 -0.117 25947 891 1 18 . 1 1 13 13 LYS H H 13 8.361 8.361 8.433 -0.072 25947 892 1 18 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.103 0.248 25947 893 1 18 . 1 1 14 14 LEU H H 14 8.419 8.419 8.243 0.176 25947 894 1 18 . 1 1 15 15 THR HA H 15 4.301 4.301 4.085 0.215 25947 895 1 18 . 1 1 15 15 THR H H 15 8.145 8.145 8.063 0.082 25947 896 1 18 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.592 0.138 25947 897 1 18 . 1 1 16 16 HIS H H 16 8.547 8.547 7.623 0.924 25947 898 1 18 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.055 0.337 25947 899 1 18 . 1 1 17 17 ARG H H 17 8.495 8.495 8.303 0.192 25947 900 1 18 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.428 -0.010 25947 901 1 18 . 1 1 18 18 LEU H H 18 8.361 8.361 7.491 0.870 25947 902 1 18 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.347 -0.044 25947 903 1 18 . 1 1 19 19 ALA H H 19 8.369 8.369 7.483 0.886 25947 904 1 18 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.534 -0.255 25947 905 1 18 . 1 1 20 20 ARG H H 20 8.211 8.211 7.837 0.374 25947 906 1 18 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.397 -0.094 25947 907 1 18 . 1 1 21 21 ARG H H 21 8.211 8.211 7.977 0.234 25947 908 1 18 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.635 0.040 25947 909 1 18 . 1 1 22 22 ASN H H 22 8.568 8.568 8.283 0.285 25947 910 1 18 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.536 -0.227 25947 911 1 18 . 1 1 23 23 ALA H H 23 8.396 8.396 8.481 -0.085 25947 912 1 18 . 1 1 24 24 GLY H H 24 8.390 8.390 8.660 -0.270 25947 913 1 18 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.641 -0.340 25947 914 1 18 . 1 1 25 25 ALA H H 25 8.147 8.147 8.092 0.055 25947 915 1 18 . 1 1 26 26 THR HA H 26 4.350 4.350 4.063 0.287 25947 916 1 18 . 1 1 26 26 THR H H 26 8.278 8.278 8.149 0.129 25947 917 1 18 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.102 0.276 25947 918 1 18 . 1 1 27 27 LEU H H 27 8.319 8.319 8.101 0.218 25947 919 1 19 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.673 -0.086 25947 920 1 19 . 1 1 2 2 TYR H H 2 8.713 8.713 8.403 0.310 25947 921 1 19 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.345 0.032 25947 922 1 19 . 1 1 3 3 GLU H H 3 8.321 8.321 8.509 -0.188 25947 923 1 19 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.958 0.464 25947 924 1 19 . 1 1 4 4 ILE H H 4 8.284 8.284 7.851 0.433 25947 925 1 19 . 1 1 5 5 THR HA H 5 4.388 4.388 4.085 0.303 25947 926 1 19 . 1 1 5 5 THR H H 5 8.145 8.145 8.425 -0.280 25947 927 1 19 . 1 1 6 6 THR HA H 6 4.322 4.322 4.186 0.136 25947 928 1 19 . 1 1 6 6 THR H H 6 8.197 8.197 7.779 0.418 25947 929 1 19 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.884 1.021 25947 930 1 19 . 1 1 7 7 ILE H H 7 8.108 8.108 7.559 0.549 25947 931 1 19 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.485 0.240 25947 932 1 19 . 1 1 8 8 HIS H H 8 8.626 8.626 7.803 0.823 25947 933 1 19 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.689 -0.012 25947 934 1 19 . 1 1 9 9 ASN H H 9 8.495 8.495 7.759 0.736 25947 935 1 19 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.346 -0.040 25947 936 1 19 . 1 1 10 10 LEU H H 10 8.336 8.336 7.403 0.933 25947 937 1 19 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.617 -0.334 25947 938 1 19 . 1 1 11 11 ALA H H 11 8.267 8.267 7.821 0.446 25947 939 1 19 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.266 0.108 25947 940 1 19 . 1 1 12 12 ARG H H 12 8.209 8.209 8.684 -0.475 25947 941 1 19 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.291 0.006 25947 942 1 19 . 1 1 13 13 LYS H H 13 8.361 8.361 8.320 0.041 25947 943 1 19 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.198 0.153 25947 944 1 19 . 1 1 14 14 LEU H H 14 8.419 8.419 7.885 0.534 25947 945 1 19 . 1 1 15 15 THR HA H 15 4.301 4.301 4.071 0.230 25947 946 1 19 . 1 1 15 15 THR H H 15 8.145 8.145 8.258 -0.113 25947 947 1 19 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.621 0.109 25947 948 1 19 . 1 1 16 16 HIS H H 16 8.547 8.547 7.777 0.770 25947 949 1 19 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.084 0.308 25947 950 1 19 . 1 1 17 17 ARG H H 17 8.495 8.495 8.474 0.021 25947 951 1 19 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.304 0.114 25947 952 1 19 . 1 1 18 18 LEU H H 18 8.361 8.361 7.422 0.939 25947 953 1 19 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.114 0.189 25947 954 1 19 . 1 1 19 19 ALA H H 19 8.369 8.369 7.194 1.175 25947 955 1 19 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.098 0.181 25947 956 1 19 . 1 1 20 20 ARG H H 20 8.211 8.211 7.344 0.867 25947 957 1 19 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.032 0.271 25947 958 1 19 . 1 1 21 21 ARG H H 21 8.211 8.211 8.382 -0.171 25947 959 1 19 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.831 -0.156 25947 960 1 19 . 1 1 22 22 ASN H H 22 8.568 8.568 8.048 0.520 25947 961 1 19 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.454 -0.145 25947 962 1 19 . 1 1 23 23 ALA H H 23 8.396 8.396 8.539 -0.143 25947 963 1 19 . 1 1 24 24 GLY H H 24 8.390 8.390 8.716 -0.326 25947 964 1 19 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.566 -0.265 25947 965 1 19 . 1 1 25 25 ALA H H 25 8.147 8.147 7.800 0.347 25947 966 1 19 . 1 1 26 26 THR HA H 26 4.350 4.350 4.032 0.318 25947 967 1 19 . 1 1 26 26 THR H H 26 8.278 8.278 8.388 -0.110 25947 968 1 19 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.359 0.019 25947 969 1 19 . 1 1 27 27 LEU H H 27 8.319 8.319 7.831 0.488 25947 970 1 20 . 1 1 2 2 TYR HA H 2 4.587 4.587 4.736 -0.149 25947 971 1 20 . 1 1 2 2 TYR H H 2 8.713 8.713 8.056 0.657 25947 972 1 20 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.481 -0.104 25947 973 1 20 . 1 1 3 3 GLU H H 3 8.321 8.321 8.718 -0.397 25947 974 1 20 . 1 1 4 4 ILE HA H 4 4.422 4.422 4.119 0.303 25947 975 1 20 . 1 1 4 4 ILE H H 4 8.284 8.284 7.860 0.424 25947 976 1 20 . 1 1 5 5 THR HA H 5 4.388 4.388 4.317 0.071 25947 977 1 20 . 1 1 5 5 THR H H 5 8.145 8.145 7.900 0.245 25947 978 1 20 . 1 1 6 6 THR HA H 6 4.322 4.322 4.391 -0.069 25947 979 1 20 . 1 1 6 6 THR H H 6 8.197 8.197 7.902 0.295 25947 980 1 20 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.687 1.218 25947 981 1 20 . 1 1 7 7 ILE H H 7 8.108 8.108 7.681 0.427 25947 982 1 20 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.461 0.264 25947 983 1 20 . 1 1 8 8 HIS H H 8 8.626 8.626 8.227 0.399 25947 984 1 20 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.813 -0.136 25947 985 1 20 . 1 1 9 9 ASN H H 9 8.495 8.495 7.877 0.618 25947 986 1 20 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.512 -0.206 25947 987 1 20 . 1 1 10 10 LEU H H 10 8.336 8.336 7.374 0.962 25947 988 1 20 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.509 -0.226 25947 989 1 20 . 1 1 11 11 ALA H H 11 8.267 8.267 8.418 -0.151 25947 990 1 20 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.337 0.037 25947 991 1 20 . 1 1 12 12 ARG H H 12 8.209 8.209 7.960 0.249 25947 992 1 20 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.388 -0.091 25947 993 1 20 . 1 1 13 13 LYS H H 13 8.361 8.361 7.937 0.424 25947 994 1 20 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.052 0.299 25947 995 1 20 . 1 1 14 14 LEU H H 14 8.419 8.419 7.806 0.613 25947 996 1 20 . 1 1 15 15 THR HA H 15 4.301 4.301 3.927 0.374 25947 997 1 20 . 1 1 15 15 THR H H 15 8.145 8.145 8.183 -0.038 25947 998 1 20 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.455 0.275 25947 999 1 20 . 1 1 16 16 HIS H H 16 8.547 8.547 8.164 0.383 25947 1000 1 20 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.290 0.102 25947 1001 1 20 . 1 1 17 17 ARG H H 17 8.495 8.495 7.947 0.548 25947 1002 1 20 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.456 -0.038 25947 1003 1 20 . 1 1 18 18 LEU H H 18 8.361 8.361 8.271 0.090 25947 1004 1 20 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.651 -0.348 25947 1005 1 20 . 1 1 19 19 ALA H H 19 8.369 8.369 8.341 0.028 25947 1006 1 20 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.249 0.030 25947 1007 1 20 . 1 1 20 20 ARG H H 20 8.211 8.211 8.069 0.142 25947 1008 1 20 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.225 0.078 25947 1009 1 20 . 1 1 21 21 ARG H H 21 8.211 8.211 8.154 0.057 25947 1010 1 20 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.614 0.061 25947 1011 1 20 . 1 1 22 22 ASN H H 22 8.568 8.568 8.454 0.114 25947 1012 1 20 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.530 -0.221 25947 1013 1 20 . 1 1 23 23 ALA H H 23 8.396 8.396 8.430 -0.033 25947 1014 1 20 . 1 1 24 24 GLY H H 24 8.390 8.390 8.312 0.078 25947 1015 1 20 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.772 -0.471 25947 1016 1 20 . 1 1 25 25 ALA H H 25 8.147 8.147 7.667 0.480 25947 1017 1 20 . 1 1 26 26 THR HA H 26 4.350 4.350 4.274 0.076 25947 1018 1 20 . 1 1 26 26 THR H H 26 8.278 8.278 8.173 0.105 25947 1019 1 20 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.275 0.103 25947 1020 1 20 . 1 1 27 27 LEU H H 27 8.319 8.319 8.101 0.218 25947 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 25947 2 1 1 "Average Difference" HA 27 0.285 -0.098 0.273 25947 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25947 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25947 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25947 6 1 1 "Average Difference" HN 26 0.476 -0.335 0.345 25947 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25947 8 1 2 "Average Difference" HA 27 0.293 -0.088 0.285 25947 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25947 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25947 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25947 12 1 2 "Average Difference" HN 26 0.451 -0.263 0.374 25947 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25947 14 1 3 "Average Difference" HA 27 0.308 -0.074 0.305 25947 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25947 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25947 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25947 18 1 3 "Average Difference" HN 26 0.457 -0.252 0.388 25947 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25947 20 1 4 "Average Difference" HA 27 0.313 -0.068 0.312 25947 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25947 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25947 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25947 24 1 4 "Average Difference" HN 26 0.444 -0.319 0.315 25947 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25947 26 1 5 "Average Difference" HA 27 0.284 -0.075 0.279 25947 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25947 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25947 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25947 30 1 5 "Average Difference" HN 26 0.482 -0.353 0.334 25947 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25947 32 1 6 "Average Difference" HA 27 0.283 -0.094 0.272 25947 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25947 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25947 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25947 36 1 6 "Average Difference" HN 26 0.458 -0.297 0.355 25947 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25947 38 1 7 "Average Difference" HA 27 0.305 -0.120 0.286 25947 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25947 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25947 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25947 42 1 7 "Average Difference" HN 26 0.394 -0.267 0.296 25947 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25947 44 1 8 "Average Difference" HA 27 0.312 -0.069 0.310 25947 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25947 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25947 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25947 48 1 8 "Average Difference" HN 26 0.521 -0.290 0.442 25947 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25947 50 1 9 "Average Difference" HA 27 0.286 -0.038 0.289 25947 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25947 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25947 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25947 54 1 9 "Average Difference" HN 26 0.403 -0.260 0.315 25947 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25947 56 1 10 "Average Difference" HA 27 0.315 -0.036 0.319 25947 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25947 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25947 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25947 60 1 10 "Average Difference" HN 26 0.492 -0.274 0.417 25947 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25947 62 1 11 "Average Difference" HA 27 0.282 -0.057 0.281 25947 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25947 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25947 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25947 66 1 11 "Average Difference" HN 26 0.469 -0.357 0.310 25947 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25947 68 1 12 "Average Difference" HA 27 0.298 -0.061 0.297 25947 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25947 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25947 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25947 72 1 12 "Average Difference" HN 26 0.473 -0.333 0.342 25947 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25947 74 1 13 "Average Difference" HA 27 0.291 -0.081 0.285 25947 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25947 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25947 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25947 78 1 13 "Average Difference" HN 26 0.536 -0.340 0.422 25947 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25947 80 1 14 "Average Difference" HA 27 0.303 -0.081 0.298 25947 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25947 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25947 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25947 84 1 14 "Average Difference" HN 26 0.519 -0.325 0.412 25947 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25947 86 1 15 "Average Difference" HA 27 0.340 -0.144 0.314 25947 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25947 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25947 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25947 90 1 15 "Average Difference" HN 26 0.498 -0.326 0.384 25947 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25947 92 1 16 "Average Difference" HA 27 0.307 -0.069 0.305 25947 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25947 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25947 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25947 96 1 16 "Average Difference" HN 26 0.426 -0.256 0.347 25947 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25947 98 1 17 "Average Difference" HA 27 0.307 -0.112 0.291 25947 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25947 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25947 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25947 102 1 17 "Average Difference" HN 26 0.511 -0.385 0.343 25947 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25947 104 1 18 "Average Difference" HA 27 0.301 -0.099 0.290 25947 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25947 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25947 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25947 108 1 18 "Average Difference" HN 26 0.446 -0.307 0.330 25947 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25947 110 1 19 "Average Difference" HA 27 0.281 -0.111 0.262 25947 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25947 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25947 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25947 114 1 19 "Average Difference" HN 26 0.558 -0.329 0.460 25947 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25947 116 1 20 "Average Difference" HA 27 0.309 -0.036 0.312 25947 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25947 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25947 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25947 120 1 20 "Average Difference" HN 26 0.392 -0.267 0.293 25947 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 25947 _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 TYR HA H 2 4.587 4.587 4.659 -0.072 25947 2 1 . 1 1 2 2 TYR H H 2 8.713 8.713 8.292 0.421 25947 3 1 . 1 1 3 3 GLU HA H 3 4.377 4.377 4.405 -0.028 25947 4 1 . 1 1 3 3 GLU H H 3 8.321 8.321 8.600 -0.279 25947 5 1 . 1 1 4 4 ILE HA H 4 4.422 4.422 3.987 0.435 25947 6 1 . 1 1 4 4 ILE H H 4 8.284 8.284 7.887 0.397 25947 7 1 . 1 1 5 5 THR HA H 5 4.388 4.388 4.194 0.194 25947 8 1 . 1 1 5 5 THR H H 5 8.145 8.145 8.061 0.084 25947 9 1 . 1 1 6 6 THR HA H 6 4.322 4.322 4.353 -0.031 25947 10 1 . 1 1 6 6 THR H H 6 8.197 8.197 7.764 0.433 25947 11 1 . 1 1 7 7 ILE HA H 7 4.905 4.905 3.764 1.141 25947 12 1 . 1 1 7 7 ILE H H 7 8.108 8.108 7.595 0.513 25947 13 1 . 1 1 8 8 HIS HA H 8 4.725 4.725 4.560 0.165 25947 14 1 . 1 1 8 8 HIS H H 8 8.626 8.626 8.055 0.571 25947 15 1 . 1 1 9 9 ASN HA H 9 4.677 4.677 4.736 -0.059 25947 16 1 . 1 1 9 9 ASN H H 9 8.495 8.495 8.030 0.465 25947 17 1 . 1 1 10 10 LEU HA H 10 4.306 4.306 4.349 -0.043 25947 18 1 . 1 1 10 10 LEU H H 10 8.336 8.336 7.667 0.669 25947 19 1 . 1 1 11 11 ALA HA H 11 4.283 4.283 4.383 -0.100 25947 20 1 . 1 1 11 11 ALA H H 11 8.267 8.267 7.700 0.567 25947 21 1 . 1 1 12 12 ARG HA H 12 4.374 4.374 4.314 0.060 25947 22 1 . 1 1 12 12 ARG H H 12 8.209 8.209 8.279 -0.070 25947 23 1 . 1 1 13 13 LYS HA H 13 4.297 4.297 4.267 0.030 25947 24 1 . 1 1 13 13 LYS H H 13 8.361 8.361 8.339 0.022 25947 25 1 . 1 1 14 14 LEU HA H 14 4.351 4.351 4.116 0.235 25947 26 1 . 1 1 14 14 LEU H H 14 8.419 8.419 8.002 0.417 25947 27 1 . 1 1 15 15 THR HA H 15 4.301 4.301 3.995 0.306 25947 28 1 . 1 1 15 15 THR H H 15 8.145 8.145 8.100 0.045 25947 29 1 . 1 1 16 16 HIS HA H 16 4.730 4.730 4.581 0.149 25947 30 1 . 1 1 16 16 HIS H H 16 8.547 8.547 7.838 0.709 25947 31 1 . 1 1 17 17 ARG HA H 17 4.392 4.392 4.146 0.246 25947 32 1 . 1 1 17 17 ARG H H 17 8.495 8.495 8.193 0.302 25947 33 1 . 1 1 18 18 LEU HA H 18 4.418 4.418 4.392 0.026 25947 34 1 . 1 1 18 18 LEU H H 18 8.361 8.361 7.678 0.683 25947 35 1 . 1 1 19 19 ALA HA H 19 4.303 4.303 4.442 -0.139 25947 36 1 . 1 1 19 19 ALA H H 19 8.369 8.369 7.868 0.501 25947 37 1 . 1 1 20 20 ARG HA H 20 4.279 4.279 4.293 -0.015 25947 38 1 . 1 1 20 20 ARG H H 20 8.211 8.211 7.884 0.327 25947 39 1 . 1 1 21 21 ARG HA H 21 4.303 4.303 4.294 0.009 25947 40 1 . 1 1 21 21 ARG H H 21 8.211 8.211 8.280 -0.069 25947 41 1 . 1 1 22 22 ASN HA H 22 4.675 4.675 4.699 -0.024 25947 42 1 . 1 1 22 22 ASN H H 22 8.568 8.568 8.164 0.404 25947 43 1 . 1 1 23 23 ALA HA H 23 4.309 4.309 4.524 -0.215 25947 44 1 . 1 1 23 23 ALA H H 23 8.396 8.396 8.096 0.300 25947 45 1 . 1 1 24 24 GLY H H 24 8.390 8.390 8.338 0.052 25947 46 1 . 1 1 25 25 ALA HA H 25 4.301 4.301 4.612 -0.311 25947 47 1 . 1 1 25 25 ALA H H 25 8.147 8.147 7.929 0.218 25947 48 1 . 1 1 26 26 THR HA H 26 4.350 4.350 4.150 0.200 25947 49 1 . 1 1 26 26 THR H H 26 8.278 8.278 8.213 0.065 25947 50 1 . 1 1 27 27 LEU HA H 27 4.378 4.378 4.331 0.047 25947 51 1 . 1 1 27 27 LEU H H 27 8.319 8.319 8.090 0.229 25947 stop_ save_