data_25954 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25954 _Entry.PDB_ID 2NAY 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 25954 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.644 0.526 25954 2 1 1 . 1 1 2 2 CYS H H 2 7.978 7.978 8.638 -0.660 25954 3 1 1 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.816 -0.310 25954 4 1 1 . 1 1 3 3 CYS H H 3 8.415 8.415 8.036 0.379 25954 5 1 1 . 1 1 4 4 SER HA H 4 4.488 4.488 4.548 -0.060 25954 6 1 1 . 1 1 4 4 SER H H 4 7.721 7.721 7.627 0.094 25954 7 1 1 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.574 -0.430 25954 8 1 1 . 1 1 5 5 ASN H H 5 7.668 7.668 8.070 -0.402 25954 9 1 1 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.699 -0.620 25954 10 1 1 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.508 -0.460 25954 11 1 1 . 1 1 7 7 ALA H H 7 7.752 7.752 8.144 -0.392 25954 12 1 1 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.206 -0.027 25954 13 1 1 . 1 1 8 8 CYS H H 8 7.758 7.758 8.499 -0.741 25954 14 1 1 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.837 -0.359 25954 15 1 1 . 1 1 9 9 ILE H H 9 7.976 7.976 8.419 -0.443 25954 16 1 1 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.076 -0.131 25954 17 1 1 . 1 1 10 10 LEU H H 10 7.335 7.335 7.761 -0.426 25954 18 1 1 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.817 -0.261 25954 19 1 1 . 1 1 11 11 ASN H H 11 7.399 7.399 8.268 -0.869 25954 20 1 1 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.484 0.588 25954 21 1 1 . 1 1 12 12 ASN H H 12 7.695 7.695 8.183 -0.488 25954 22 1 1 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.421 -0.139 25954 23 1 1 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.573 -0.073 25954 24 1 1 . 1 1 14 14 ASN H H 14 8.448 8.448 7.971 0.477 25954 25 1 1 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.149 0.591 25954 26 1 1 . 1 1 15 15 GLN H H 15 7.823 7.823 8.318 -0.495 25954 27 1 2 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.655 0.515 25954 28 1 2 . 1 1 2 2 CYS H H 2 7.978 7.978 8.445 -0.467 25954 29 1 2 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.536 -0.030 25954 30 1 2 . 1 1 3 3 CYS H H 3 8.415 8.415 7.347 1.068 25954 31 1 2 . 1 1 4 4 SER HA H 4 4.488 4.488 4.391 0.097 25954 32 1 2 . 1 1 4 4 SER H H 4 7.721 7.721 8.367 -0.646 25954 33 1 2 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.906 -0.762 25954 34 1 2 . 1 1 5 5 ASN H H 5 7.668 7.668 8.131 -0.463 25954 35 1 2 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.617 -0.538 25954 36 1 2 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.239 -0.191 25954 37 1 2 . 1 1 7 7 ALA H H 7 7.752 7.752 7.896 -0.144 25954 38 1 2 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.102 0.077 25954 39 1 2 . 1 1 8 8 CYS H H 8 7.758 7.758 8.623 -0.865 25954 40 1 2 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.813 -0.335 25954 41 1 2 . 1 1 9 9 ILE H H 9 7.976 7.976 8.094 -0.118 25954 42 1 2 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.040 -0.095 25954 43 1 2 . 1 1 10 10 LEU H H 10 7.335 7.335 8.017 -0.682 25954 44 1 2 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.782 -0.226 25954 45 1 2 . 1 1 11 11 ASN H H 11 7.399 7.399 8.269 -0.870 25954 46 1 2 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.475 0.597 25954 47 1 2 . 1 1 12 12 ASN H H 12 7.695 7.695 8.299 -0.604 25954 48 1 2 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.435 -0.153 25954 49 1 2 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.598 -0.098 25954 50 1 2 . 1 1 14 14 ASN H H 14 8.448 8.448 7.964 0.484 25954 51 1 2 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.107 0.633 25954 52 1 2 . 1 1 15 15 GLN H H 15 7.823 7.823 8.287 -0.464 25954 53 1 3 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.195 0.975 25954 54 1 3 . 1 1 2 2 CYS H H 2 7.978 7.978 8.688 -0.710 25954 55 1 3 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.552 -0.046 25954 56 1 3 . 1 1 3 3 CYS H H 3 8.415 8.415 8.160 0.255 25954 57 1 3 . 1 1 4 4 SER HA H 4 4.488 4.488 4.491 -0.003 25954 58 1 3 . 1 1 4 4 SER H H 4 7.721 7.721 8.115 -0.394 25954 59 1 3 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.972 -0.828 25954 60 1 3 . 1 1 5 5 ASN H H 5 7.668 7.668 8.042 -0.374 25954 61 1 3 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.911 -0.832 25954 62 1 3 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.450 -0.402 25954 63 1 3 . 1 1 7 7 ALA H H 7 7.752 7.752 8.116 -0.364 25954 64 1 3 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.196 -0.017 25954 65 1 3 . 1 1 8 8 CYS H H 8 7.758 7.758 8.468 -0.710 25954 66 1 3 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.847 -0.369 25954 67 1 3 . 1 1 9 9 ILE H H 9 7.976 7.976 8.271 -0.295 25954 68 1 3 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.064 -0.119 25954 69 1 3 . 1 1 10 10 LEU H H 10 7.335 7.335 7.853 -0.518 25954 70 1 3 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.804 -0.248 25954 71 1 3 . 1 1 11 11 ASN H H 11 7.399 7.399 8.221 -0.822 25954 72 1 3 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.473 0.599 25954 73 1 3 . 1 1 12 12 ASN H H 12 7.695 7.695 8.263 -0.568 25954 74 1 3 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.393 -0.111 25954 75 1 3 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.674 -0.174 25954 76 1 3 . 1 1 14 14 ASN H H 14 8.448 8.448 8.392 0.056 25954 77 1 3 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.128 0.612 25954 78 1 3 . 1 1 15 15 GLN H H 15 7.823 7.823 7.665 0.158 25954 79 1 4 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.527 0.643 25954 80 1 4 . 1 1 2 2 CYS H H 2 7.978 7.978 8.589 -0.611 25954 81 1 4 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.475 0.031 25954 82 1 4 . 1 1 3 3 CYS H H 3 8.415 8.415 8.185 0.230 25954 83 1 4 . 1 1 4 4 SER HA H 4 4.488 4.488 4.405 0.083 25954 84 1 4 . 1 1 4 4 SER H H 4 7.721 7.721 7.832 -0.111 25954 85 1 4 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.836 -0.692 25954 86 1 4 . 1 1 5 5 ASN H H 5 7.668 7.668 8.294 -0.626 25954 87 1 4 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.920 -0.841 25954 88 1 4 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.534 -0.486 25954 89 1 4 . 1 1 7 7 ALA H H 7 7.752 7.752 8.061 -0.309 25954 90 1 4 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.213 -0.034 25954 91 1 4 . 1 1 8 8 CYS H H 8 7.758 7.758 8.089 -0.331 25954 92 1 4 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.834 -0.356 25954 93 1 4 . 1 1 9 9 ILE H H 9 7.976 7.976 8.218 -0.242 25954 94 1 4 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.050 -0.105 25954 95 1 4 . 1 1 10 10 LEU H H 10 7.335 7.335 8.105 -0.770 25954 96 1 4 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.835 -0.279 25954 97 1 4 . 1 1 11 11 ASN H H 11 7.399 7.399 8.176 -0.777 25954 98 1 4 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.500 0.572 25954 99 1 4 . 1 1 12 12 ASN H H 12 7.695 7.695 7.685 0.010 25954 100 1 4 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.498 -0.216 25954 101 1 4 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.602 -0.102 25954 102 1 4 . 1 1 14 14 ASN H H 14 8.448 8.448 7.972 0.476 25954 103 1 4 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.125 0.615 25954 104 1 4 . 1 1 15 15 GLN H H 15 7.823 7.823 8.366 -0.543 25954 105 1 5 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.598 0.572 25954 106 1 5 . 1 1 2 2 CYS H H 2 7.978 7.978 7.979 -0.001 25954 107 1 5 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.509 -0.003 25954 108 1 5 . 1 1 3 3 CYS H H 3 8.415 8.415 8.059 0.356 25954 109 1 5 . 1 1 4 4 SER HA H 4 4.488 4.488 4.490 -0.002 25954 110 1 5 . 1 1 4 4 SER H H 4 7.721 7.721 7.778 -0.057 25954 111 1 5 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.838 -0.694 25954 112 1 5 . 1 1 5 5 ASN H H 5 7.668 7.668 8.203 -0.535 25954 113 1 5 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.871 -0.792 25954 114 1 5 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.315 -0.267 25954 115 1 5 . 1 1 7 7 ALA H H 7 7.752 7.752 7.949 -0.197 25954 116 1 5 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.109 0.070 25954 117 1 5 . 1 1 8 8 CYS H H 8 7.758 7.758 8.640 -0.882 25954 118 1 5 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.807 -0.329 25954 119 1 5 . 1 1 9 9 ILE H H 9 7.976 7.976 8.138 -0.162 25954 120 1 5 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.008 -0.063 25954 121 1 5 . 1 1 10 10 LEU H H 10 7.335 7.335 7.841 -0.506 25954 122 1 5 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.846 -0.290 25954 123 1 5 . 1 1 11 11 ASN H H 11 7.399 7.399 8.208 -0.809 25954 124 1 5 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.531 0.541 25954 125 1 5 . 1 1 12 12 ASN H H 12 7.695 7.695 8.052 -0.357 25954 126 1 5 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.439 -0.157 25954 127 1 5 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.597 -0.097 25954 128 1 5 . 1 1 14 14 ASN H H 14 8.448 8.448 7.936 0.512 25954 129 1 5 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.166 0.574 25954 130 1 5 . 1 1 15 15 GLN H H 15 7.823 7.823 8.388 -0.565 25954 131 1 6 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.248 0.922 25954 132 1 6 . 1 1 2 2 CYS H H 2 7.978 7.978 7.960 0.018 25954 133 1 6 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.453 0.053 25954 134 1 6 . 1 1 3 3 CYS H H 3 8.415 8.415 8.376 0.039 25954 135 1 6 . 1 1 4 4 SER HA H 4 4.488 4.488 4.520 -0.032 25954 136 1 6 . 1 1 4 4 SER H H 4 7.721 7.721 7.767 -0.046 25954 137 1 6 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.914 -0.770 25954 138 1 6 . 1 1 5 5 ASN H H 5 7.668 7.668 8.003 -0.335 25954 139 1 6 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.918 -0.839 25954 140 1 6 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.484 -0.436 25954 141 1 6 . 1 1 7 7 ALA H H 7 7.752 7.752 8.068 -0.316 25954 142 1 6 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.197 -0.018 25954 143 1 6 . 1 1 8 8 CYS H H 8 7.758 7.758 8.425 -0.667 25954 144 1 6 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.911 -0.433 25954 145 1 6 . 1 1 9 9 ILE H H 9 7.976 7.976 8.064 -0.088 25954 146 1 6 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.089 -0.144 25954 147 1 6 . 1 1 10 10 LEU H H 10 7.335 7.335 7.655 -0.320 25954 148 1 6 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.723 -0.167 25954 149 1 6 . 1 1 11 11 ASN H H 11 7.399 7.399 7.626 -0.227 25954 150 1 6 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.550 0.522 25954 151 1 6 . 1 1 12 12 ASN H H 12 7.695 7.695 8.485 -0.790 25954 152 1 6 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.349 -0.067 25954 153 1 6 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.652 -0.152 25954 154 1 6 . 1 1 14 14 ASN H H 14 8.448 8.448 7.934 0.514 25954 155 1 6 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.020 0.720 25954 156 1 6 . 1 1 15 15 GLN H H 15 7.823 7.823 8.421 -0.598 25954 157 1 7 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.372 0.798 25954 158 1 7 . 1 1 2 2 CYS H H 2 7.978 7.978 7.883 0.095 25954 159 1 7 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.304 0.202 25954 160 1 7 . 1 1 3 3 CYS H H 3 8.415 8.415 8.186 0.229 25954 161 1 7 . 1 1 4 4 SER HA H 4 4.488 4.488 4.432 0.056 25954 162 1 7 . 1 1 4 4 SER H H 4 7.721 7.721 7.555 0.166 25954 163 1 7 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.986 -0.842 25954 164 1 7 . 1 1 5 5 ASN H H 5 7.668 7.668 8.490 -0.822 25954 165 1 7 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.804 -0.725 25954 166 1 7 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.445 -0.397 25954 167 1 7 . 1 1 7 7 ALA H H 7 7.752 7.752 8.094 -0.342 25954 168 1 7 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.146 0.033 25954 169 1 7 . 1 1 8 8 CYS H H 8 7.758 7.758 8.361 -0.603 25954 170 1 7 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.936 -0.458 25954 171 1 7 . 1 1 9 9 ILE H H 9 7.976 7.976 8.279 -0.303 25954 172 1 7 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.056 -0.111 25954 173 1 7 . 1 1 10 10 LEU H H 10 7.335 7.335 7.752 -0.417 25954 174 1 7 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.837 -0.281 25954 175 1 7 . 1 1 11 11 ASN H H 11 7.399 7.399 8.184 -0.785 25954 176 1 7 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.707 0.365 25954 177 1 7 . 1 1 12 12 ASN H H 12 7.695 7.695 8.029 -0.334 25954 178 1 7 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.397 -0.115 25954 179 1 7 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.818 -0.318 25954 180 1 7 . 1 1 14 14 ASN H H 14 8.448 8.448 8.244 0.204 25954 181 1 7 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.527 0.213 25954 182 1 7 . 1 1 15 15 GLN H H 15 7.823 7.823 8.327 -0.504 25954 183 1 8 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.417 0.753 25954 184 1 8 . 1 1 2 2 CYS H H 2 7.978 7.978 8.388 -0.410 25954 185 1 8 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.380 0.126 25954 186 1 8 . 1 1 3 3 CYS H H 3 8.415 8.415 8.300 0.115 25954 187 1 8 . 1 1 4 4 SER HA H 4 4.488 4.488 4.488 -0.000 25954 188 1 8 . 1 1 4 4 SER H H 4 7.721 7.721 8.104 -0.383 25954 189 1 8 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.966 -0.822 25954 190 1 8 . 1 1 5 5 ASN H H 5 7.668 7.668 8.000 -0.332 25954 191 1 8 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.926 -0.847 25954 192 1 8 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.409 -0.361 25954 193 1 8 . 1 1 7 7 ALA H H 7 7.752 7.752 8.041 -0.289 25954 194 1 8 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.187 -0.008 25954 195 1 8 . 1 1 8 8 CYS H H 8 7.758 7.758 8.533 -0.775 25954 196 1 8 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.796 -0.318 25954 197 1 8 . 1 1 9 9 ILE H H 9 7.976 7.976 8.197 -0.221 25954 198 1 8 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.012 -0.067 25954 199 1 8 . 1 1 10 10 LEU H H 10 7.335 7.335 7.975 -0.640 25954 200 1 8 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.837 -0.281 25954 201 1 8 . 1 1 11 11 ASN H H 11 7.399 7.399 8.209 -0.810 25954 202 1 8 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.474 0.598 25954 203 1 8 . 1 1 12 12 ASN H H 12 7.695 7.695 7.980 -0.285 25954 204 1 8 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.421 -0.139 25954 205 1 8 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.698 -0.198 25954 206 1 8 . 1 1 14 14 ASN H H 14 8.448 8.448 8.512 -0.064 25954 207 1 8 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.101 0.639 25954 208 1 8 . 1 1 15 15 GLN H H 15 7.823 7.823 7.817 0.006 25954 209 1 9 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.470 0.700 25954 210 1 9 . 1 1 2 2 CYS H H 2 7.978 7.978 8.244 -0.266 25954 211 1 9 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.548 -0.042 25954 212 1 9 . 1 1 3 3 CYS H H 3 8.415 8.415 8.379 0.036 25954 213 1 9 . 1 1 4 4 SER HA H 4 4.488 4.488 4.520 -0.032 25954 214 1 9 . 1 1 4 4 SER H H 4 7.721 7.721 8.066 -0.345 25954 215 1 9 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.917 -0.773 25954 216 1 9 . 1 1 5 5 ASN H H 5 7.668 7.668 8.130 -0.462 25954 217 1 9 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.928 -0.849 25954 218 1 9 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.305 -0.257 25954 219 1 9 . 1 1 7 7 ALA H H 7 7.752 7.752 7.886 -0.134 25954 220 1 9 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.119 0.060 25954 221 1 9 . 1 1 8 8 CYS H H 8 7.758 7.758 8.565 -0.807 25954 222 1 9 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.796 -0.318 25954 223 1 9 . 1 1 9 9 ILE H H 9 7.976 7.976 8.192 -0.216 25954 224 1 9 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.077 -0.132 25954 225 1 9 . 1 1 10 10 LEU H H 10 7.335 7.335 7.937 -0.602 25954 226 1 9 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.768 -0.212 25954 227 1 9 . 1 1 11 11 ASN H H 11 7.399 7.399 8.195 -0.796 25954 228 1 9 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.515 0.557 25954 229 1 9 . 1 1 12 12 ASN H H 12 7.695 7.695 8.063 -0.368 25954 230 1 9 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.537 -0.255 25954 231 1 9 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.753 -0.253 25954 232 1 9 . 1 1 14 14 ASN H H 14 8.448 8.448 8.060 0.388 25954 233 1 9 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.496 0.244 25954 234 1 9 . 1 1 15 15 GLN H H 15 7.823 7.823 8.020 -0.197 25954 235 1 10 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.475 0.695 25954 236 1 10 . 1 1 2 2 CYS H H 2 7.978 7.978 8.090 -0.112 25954 237 1 10 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.500 0.006 25954 238 1 10 . 1 1 3 3 CYS H H 3 8.415 8.415 8.216 0.199 25954 239 1 10 . 1 1 4 4 SER HA H 4 4.488 4.488 4.667 -0.179 25954 240 1 10 . 1 1 4 4 SER H H 4 7.721 7.721 7.993 -0.272 25954 241 1 10 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.966 -0.822 25954 242 1 10 . 1 1 5 5 ASN H H 5 7.668 7.668 7.974 -0.306 25954 243 1 10 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.918 -0.839 25954 244 1 10 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.475 -0.427 25954 245 1 10 . 1 1 7 7 ALA H H 7 7.752 7.752 8.123 -0.371 25954 246 1 10 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.157 0.022 25954 247 1 10 . 1 1 8 8 CYS H H 8 7.758 7.758 8.372 -0.614 25954 248 1 10 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.852 -0.374 25954 249 1 10 . 1 1 9 9 ILE H H 9 7.976 7.976 8.108 -0.132 25954 250 1 10 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.119 -0.174 25954 251 1 10 . 1 1 10 10 LEU H H 10 7.335 7.335 7.682 -0.347 25954 252 1 10 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.784 -0.228 25954 253 1 10 . 1 1 11 11 ASN H H 11 7.399 7.399 8.219 -0.820 25954 254 1 10 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.521 0.551 25954 255 1 10 . 1 1 12 12 ASN H H 12 7.695 7.695 8.256 -0.561 25954 256 1 10 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.382 -0.100 25954 257 1 10 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.563 -0.063 25954 258 1 10 . 1 1 14 14 ASN H H 14 8.448 8.448 8.030 0.418 25954 259 1 10 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.175 0.565 25954 260 1 10 . 1 1 15 15 GLN H H 15 7.823 7.823 8.403 -0.580 25954 261 1 11 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.491 0.679 25954 262 1 11 . 1 1 2 2 CYS H H 2 7.978 7.978 8.004 -0.026 25954 263 1 11 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.454 0.052 25954 264 1 11 . 1 1 3 3 CYS H H 3 8.415 8.415 8.154 0.261 25954 265 1 11 . 1 1 4 4 SER HA H 4 4.488 4.488 4.463 0.024 25954 266 1 11 . 1 1 4 4 SER H H 4 7.721 7.721 8.081 -0.360 25954 267 1 11 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.975 -0.831 25954 268 1 11 . 1 1 5 5 ASN H H 5 7.668 7.668 8.350 -0.682 25954 269 1 11 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.907 -0.828 25954 270 1 11 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.506 -0.458 25954 271 1 11 . 1 1 7 7 ALA H H 7 7.752 7.752 8.059 -0.307 25954 272 1 11 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.128 0.051 25954 273 1 11 . 1 1 8 8 CYS H H 8 7.758 7.758 8.478 -0.720 25954 274 1 11 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.792 -0.314 25954 275 1 11 . 1 1 9 9 ILE H H 9 7.976 7.976 8.075 -0.099 25954 276 1 11 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.078 -0.133 25954 277 1 11 . 1 1 10 10 LEU H H 10 7.335 7.335 7.772 -0.437 25954 278 1 11 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.671 -0.115 25954 279 1 11 . 1 1 11 11 ASN H H 11 7.399 7.399 8.018 -0.619 25954 280 1 11 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.523 0.549 25954 281 1 11 . 1 1 12 12 ASN H H 12 7.695 7.695 8.398 -0.703 25954 282 1 11 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.480 -0.198 25954 283 1 11 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.789 -0.289 25954 284 1 11 . 1 1 14 14 ASN H H 14 8.448 8.448 8.297 0.150 25954 285 1 11 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.441 0.299 25954 286 1 11 . 1 1 15 15 GLN H H 15 7.823 7.823 8.420 -0.597 25954 287 1 12 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.563 0.607 25954 288 1 12 . 1 1 2 2 CYS H H 2 7.978 7.978 8.542 -0.564 25954 289 1 12 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.626 -0.120 25954 290 1 12 . 1 1 3 3 CYS H H 3 8.415 8.415 8.096 0.319 25954 291 1 12 . 1 1 4 4 SER HA H 4 4.488 4.488 4.497 -0.009 25954 292 1 12 . 1 1 4 4 SER H H 4 7.721 7.721 7.975 -0.254 25954 293 1 12 . 1 1 5 5 ASN HA H 5 4.144 4.144 5.001 -0.857 25954 294 1 12 . 1 1 5 5 ASN H H 5 7.668 7.668 8.094 -0.426 25954 295 1 12 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.784 -0.705 25954 296 1 12 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.210 -0.162 25954 297 1 12 . 1 1 7 7 ALA H H 7 7.752 7.752 8.400 -0.648 25954 298 1 12 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.054 0.125 25954 299 1 12 . 1 1 8 8 CYS H H 8 7.758 7.758 8.288 -0.530 25954 300 1 12 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.806 -0.328 25954 301 1 12 . 1 1 9 9 ILE H H 9 7.976 7.976 7.815 0.161 25954 302 1 12 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.131 -0.186 25954 303 1 12 . 1 1 10 10 LEU H H 10 7.335 7.335 7.845 -0.510 25954 304 1 12 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.819 -0.263 25954 305 1 12 . 1 1 11 11 ASN H H 11 7.399 7.399 7.829 -0.430 25954 306 1 12 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.521 0.551 25954 307 1 12 . 1 1 12 12 ASN H H 12 7.695 7.695 8.480 -0.785 25954 308 1 12 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.343 -0.061 25954 309 1 12 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.707 -0.207 25954 310 1 12 . 1 1 14 14 ASN H H 14 8.448 8.448 7.774 0.674 25954 311 1 12 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.118 0.622 25954 312 1 12 . 1 1 15 15 GLN H H 15 7.823 7.823 7.970 -0.147 25954 313 1 13 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.568 0.602 25954 314 1 13 . 1 1 2 2 CYS H H 2 7.978 7.978 8.003 -0.025 25954 315 1 13 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.591 -0.085 25954 316 1 13 . 1 1 3 3 CYS H H 3 8.415 8.415 8.210 0.205 25954 317 1 13 . 1 1 4 4 SER HA H 4 4.488 4.488 4.430 0.058 25954 318 1 13 . 1 1 4 4 SER H H 4 7.721 7.721 7.875 -0.154 25954 319 1 13 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.960 -0.816 25954 320 1 13 . 1 1 5 5 ASN H H 5 7.668 7.668 8.105 -0.437 25954 321 1 13 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.915 -0.836 25954 322 1 13 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.513 -0.465 25954 323 1 13 . 1 1 7 7 ALA H H 7 7.752 7.752 7.937 -0.185 25954 324 1 13 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.269 -0.090 25954 325 1 13 . 1 1 8 8 CYS H H 8 7.758 7.758 8.329 -0.571 25954 326 1 13 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.922 -0.444 25954 327 1 13 . 1 1 9 9 ILE H H 9 7.976 7.976 8.232 -0.256 25954 328 1 13 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.228 -0.283 25954 329 1 13 . 1 1 10 10 LEU H H 10 7.335 7.335 7.874 -0.539 25954 330 1 13 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.681 -0.125 25954 331 1 13 . 1 1 11 11 ASN H H 11 7.399 7.399 8.263 -0.864 25954 332 1 13 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.523 0.549 25954 333 1 13 . 1 1 12 12 ASN H H 12 7.695 7.695 8.535 -0.840 25954 334 1 13 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.570 -0.288 25954 335 1 13 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.623 -0.123 25954 336 1 13 . 1 1 14 14 ASN H H 14 8.448 8.448 8.027 0.421 25954 337 1 13 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.189 0.551 25954 338 1 13 . 1 1 15 15 GLN H H 15 7.823 7.823 8.490 -0.667 25954 339 1 14 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.581 0.589 25954 340 1 14 . 1 1 2 2 CYS H H 2 7.978 7.978 8.584 -0.606 25954 341 1 14 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.422 0.084 25954 342 1 14 . 1 1 3 3 CYS H H 3 8.415 8.415 8.171 0.244 25954 343 1 14 . 1 1 4 4 SER HA H 4 4.488 4.488 4.438 0.050 25954 344 1 14 . 1 1 4 4 SER H H 4 7.721 7.721 7.854 -0.133 25954 345 1 14 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.958 -0.814 25954 346 1 14 . 1 1 5 5 ASN H H 5 7.668 7.668 8.317 -0.649 25954 347 1 14 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.912 -0.833 25954 348 1 14 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.447 -0.399 25954 349 1 14 . 1 1 7 7 ALA H H 7 7.752 7.752 8.087 -0.335 25954 350 1 14 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.170 0.009 25954 351 1 14 . 1 1 8 8 CYS H H 8 7.758 7.758 8.498 -0.740 25954 352 1 14 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.853 -0.375 25954 353 1 14 . 1 1 9 9 ILE H H 9 7.976 7.976 8.259 -0.283 25954 354 1 14 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.187 -0.242 25954 355 1 14 . 1 1 10 10 LEU H H 10 7.335 7.335 7.875 -0.540 25954 356 1 14 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.710 -0.154 25954 357 1 14 . 1 1 11 11 ASN H H 11 7.399 7.399 8.090 -0.691 25954 358 1 14 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.504 0.568 25954 359 1 14 . 1 1 12 12 ASN H H 12 7.695 7.695 8.647 -0.952 25954 360 1 14 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.362 -0.080 25954 361 1 14 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.573 -0.073 25954 362 1 14 . 1 1 14 14 ASN H H 14 8.448 8.448 7.954 0.494 25954 363 1 14 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.220 0.520 25954 364 1 14 . 1 1 15 15 GLN H H 15 7.823 7.823 8.244 -0.421 25954 365 1 15 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.685 0.485 25954 366 1 15 . 1 1 2 2 CYS H H 2 7.978 7.978 8.397 -0.419 25954 367 1 15 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.452 0.054 25954 368 1 15 . 1 1 3 3 CYS H H 3 8.415 8.415 8.293 0.122 25954 369 1 15 . 1 1 4 4 SER HA H 4 4.488 4.488 4.537 -0.049 25954 370 1 15 . 1 1 4 4 SER H H 4 7.721 7.721 7.989 -0.268 25954 371 1 15 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.966 -0.822 25954 372 1 15 . 1 1 5 5 ASN H H 5 7.668 7.668 8.291 -0.623 25954 373 1 15 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.921 -0.842 25954 374 1 15 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.481 -0.433 25954 375 1 15 . 1 1 7 7 ALA H H 7 7.752 7.752 8.106 -0.354 25954 376 1 15 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.208 -0.029 25954 377 1 15 . 1 1 8 8 CYS H H 8 7.758 7.758 8.484 -0.726 25954 378 1 15 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.838 -0.360 25954 379 1 15 . 1 1 9 9 ILE H H 9 7.976 7.976 8.392 -0.416 25954 380 1 15 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.062 -0.117 25954 381 1 15 . 1 1 10 10 LEU H H 10 7.335 7.335 7.765 -0.430 25954 382 1 15 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.829 -0.273 25954 383 1 15 . 1 1 11 11 ASN H H 11 7.399 7.399 8.320 -0.921 25954 384 1 15 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.482 0.590 25954 385 1 15 . 1 1 12 12 ASN H H 12 7.695 7.695 8.043 -0.348 25954 386 1 15 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.462 -0.180 25954 387 1 15 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.724 -0.224 25954 388 1 15 . 1 1 14 14 ASN H H 14 8.448 8.448 8.212 0.236 25954 389 1 15 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.428 0.312 25954 390 1 15 . 1 1 15 15 GLN H H 15 7.823 7.823 7.815 0.008 25954 391 1 16 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.512 0.658 25954 392 1 16 . 1 1 2 2 CYS H H 2 7.978 7.978 8.131 -0.153 25954 393 1 16 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.523 -0.017 25954 394 1 16 . 1 1 3 3 CYS H H 3 8.415 8.415 8.241 0.174 25954 395 1 16 . 1 1 4 4 SER HA H 4 4.488 4.488 4.493 -0.005 25954 396 1 16 . 1 1 4 4 SER H H 4 7.721 7.721 7.695 0.026 25954 397 1 16 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.894 -0.750 25954 398 1 16 . 1 1 5 5 ASN H H 5 7.668 7.668 8.307 -0.639 25954 399 1 16 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.557 -0.478 25954 400 1 16 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.345 -0.297 25954 401 1 16 . 1 1 7 7 ALA H H 7 7.752 7.752 7.795 -0.043 25954 402 1 16 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.109 0.070 25954 403 1 16 . 1 1 8 8 CYS H H 8 7.758 7.758 8.528 -0.770 25954 404 1 16 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.808 -0.330 25954 405 1 16 . 1 1 9 9 ILE H H 9 7.976 7.976 8.130 -0.154 25954 406 1 16 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.098 -0.153 25954 407 1 16 . 1 1 10 10 LEU H H 10 7.335 7.335 7.891 -0.556 25954 408 1 16 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.824 -0.268 25954 409 1 16 . 1 1 11 11 ASN H H 11 7.399 7.399 8.136 -0.737 25954 410 1 16 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.460 0.612 25954 411 1 16 . 1 1 12 12 ASN H H 12 7.695 7.695 8.408 -0.713 25954 412 1 16 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.395 -0.113 25954 413 1 16 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.579 -0.079 25954 414 1 16 . 1 1 14 14 ASN H H 14 8.448 8.448 7.985 0.463 25954 415 1 16 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.186 0.554 25954 416 1 16 . 1 1 15 15 GLN H H 15 7.823 7.823 8.380 -0.557 25954 417 1 17 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.507 0.663 25954 418 1 17 . 1 1 2 2 CYS H H 2 7.978 7.978 8.040 -0.062 25954 419 1 17 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.601 -0.095 25954 420 1 17 . 1 1 3 3 CYS H H 3 8.415 8.415 7.882 0.533 25954 421 1 17 . 1 1 4 4 SER HA H 4 4.488 4.488 4.497 -0.009 25954 422 1 17 . 1 1 4 4 SER H H 4 7.721 7.721 7.947 -0.226 25954 423 1 17 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.640 -0.496 25954 424 1 17 . 1 1 5 5 ASN H H 5 7.668 7.668 8.214 -0.546 25954 425 1 17 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.754 -0.675 25954 426 1 17 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.469 -0.421 25954 427 1 17 . 1 1 7 7 ALA H H 7 7.752 7.752 8.026 -0.274 25954 428 1 17 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.232 -0.053 25954 429 1 17 . 1 1 8 8 CYS H H 8 7.758 7.758 8.463 -0.705 25954 430 1 17 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.828 -0.350 25954 431 1 17 . 1 1 9 9 ILE H H 9 7.976 7.976 8.216 -0.240 25954 432 1 17 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.035 -0.090 25954 433 1 17 . 1 1 10 10 LEU H H 10 7.335 7.335 7.876 -0.541 25954 434 1 17 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.732 -0.176 25954 435 1 17 . 1 1 11 11 ASN H H 11 7.399 7.399 8.061 -0.662 25954 436 1 17 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.504 0.568 25954 437 1 17 . 1 1 12 12 ASN H H 12 7.695 7.695 8.071 -0.376 25954 438 1 17 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.478 -0.196 25954 439 1 17 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.580 -0.080 25954 440 1 17 . 1 1 14 14 ASN H H 14 8.448 8.448 7.928 0.520 25954 441 1 17 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.171 0.569 25954 442 1 17 . 1 1 15 15 GLN H H 15 7.823 7.823 8.325 -0.502 25954 443 1 18 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.612 0.558 25954 444 1 18 . 1 1 2 2 CYS H H 2 7.978 7.978 8.599 -0.621 25954 445 1 18 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.597 -0.091 25954 446 1 18 . 1 1 3 3 CYS H H 3 8.415 8.415 7.803 0.612 25954 447 1 18 . 1 1 4 4 SER HA H 4 4.488 4.488 4.559 -0.071 25954 448 1 18 . 1 1 4 4 SER H H 4 7.721 7.721 7.924 -0.203 25954 449 1 18 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.594 -0.450 25954 450 1 18 . 1 1 5 5 ASN H H 5 7.668 7.668 8.323 -0.655 25954 451 1 18 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.735 -0.656 25954 452 1 18 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.461 -0.413 25954 453 1 18 . 1 1 7 7 ALA H H 7 7.752 7.752 8.043 -0.291 25954 454 1 18 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.267 -0.088 25954 455 1 18 . 1 1 8 8 CYS H H 8 7.758 7.758 8.290 -0.532 25954 456 1 18 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.842 -0.364 25954 457 1 18 . 1 1 9 9 ILE H H 9 7.976 7.976 8.273 -0.297 25954 458 1 18 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.031 -0.086 25954 459 1 18 . 1 1 10 10 LEU H H 10 7.335 7.335 8.051 -0.716 25954 460 1 18 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.881 -0.325 25954 461 1 18 . 1 1 11 11 ASN H H 11 7.399 7.399 8.044 -0.645 25954 462 1 18 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.462 0.610 25954 463 1 18 . 1 1 12 12 ASN H H 12 7.695 7.695 7.922 -0.227 25954 464 1 18 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.532 -0.250 25954 465 1 18 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.580 -0.080 25954 466 1 18 . 1 1 14 14 ASN H H 14 8.448 8.448 7.982 0.466 25954 467 1 18 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.133 0.607 25954 468 1 18 . 1 1 15 15 GLN H H 15 7.823 7.823 8.361 -0.538 25954 469 1 19 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.445 0.725 25954 470 1 19 . 1 1 2 2 CYS H H 2 7.978 7.978 8.507 -0.529 25954 471 1 19 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.658 -0.152 25954 472 1 19 . 1 1 3 3 CYS H H 3 8.415 8.415 8.171 0.244 25954 473 1 19 . 1 1 4 4 SER HA H 4 4.488 4.488 4.499 -0.011 25954 474 1 19 . 1 1 4 4 SER H H 4 7.721 7.721 7.587 0.134 25954 475 1 19 . 1 1 5 5 ASN HA H 5 4.144 4.144 5.016 -0.872 25954 476 1 19 . 1 1 5 5 ASN H H 5 7.668 7.668 8.480 -0.812 25954 477 1 19 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.840 -0.761 25954 478 1 19 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.452 -0.404 25954 479 1 19 . 1 1 7 7 ALA H H 7 7.752 7.752 8.046 -0.294 25954 480 1 19 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.151 0.028 25954 481 1 19 . 1 1 8 8 CYS H H 8 7.758 7.758 8.327 -0.569 25954 482 1 19 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.794 -0.316 25954 483 1 19 . 1 1 9 9 ILE H H 9 7.976 7.976 8.142 -0.166 25954 484 1 19 . 1 1 10 10 LEU HA H 10 3.945 3.945 3.996 -0.051 25954 485 1 19 . 1 1 10 10 LEU H H 10 7.335 7.335 7.841 -0.506 25954 486 1 19 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.789 -0.233 25954 487 1 19 . 1 1 11 11 ASN H H 11 7.399 7.399 7.922 -0.523 25954 488 1 19 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.463 0.609 25954 489 1 19 . 1 1 12 12 ASN H H 12 7.695 7.695 8.144 -0.449 25954 490 1 19 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.450 -0.168 25954 491 1 19 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.581 -0.081 25954 492 1 19 . 1 1 14 14 ASN H H 14 8.448 8.448 7.980 0.468 25954 493 1 19 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.170 0.570 25954 494 1 19 . 1 1 15 15 GLN H H 15 7.823 7.823 8.352 -0.529 25954 495 1 20 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.241 0.929 25954 496 1 20 . 1 1 2 2 CYS H H 2 7.978 7.978 8.508 -0.530 25954 497 1 20 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.330 0.176 25954 498 1 20 . 1 1 3 3 CYS H H 3 8.415 8.415 8.239 0.176 25954 499 1 20 . 1 1 4 4 SER HA H 4 4.488 4.488 4.458 0.030 25954 500 1 20 . 1 1 4 4 SER H H 4 7.721 7.721 8.136 -0.415 25954 501 1 20 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.932 -0.788 25954 502 1 20 . 1 1 5 5 ASN H H 5 7.668 7.668 8.151 -0.483 25954 503 1 20 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.905 -0.826 25954 504 1 20 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.493 -0.445 25954 505 1 20 . 1 1 7 7 ALA H H 7 7.752 7.752 8.114 -0.362 25954 506 1 20 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.159 0.020 25954 507 1 20 . 1 1 8 8 CYS H H 8 7.758 7.758 8.105 -0.347 25954 508 1 20 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.851 -0.373 25954 509 1 20 . 1 1 9 9 ILE H H 9 7.976 7.976 8.182 -0.206 25954 510 1 20 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.117 -0.172 25954 511 1 20 . 1 1 10 10 LEU H H 10 7.335 7.335 8.161 -0.826 25954 512 1 20 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.764 -0.208 25954 513 1 20 . 1 1 11 11 ASN H H 11 7.399 7.399 7.706 -0.307 25954 514 1 20 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.543 0.529 25954 515 1 20 . 1 1 12 12 ASN H H 12 7.695 7.695 8.604 -0.909 25954 516 1 20 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.335 -0.053 25954 517 1 20 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.614 -0.114 25954 518 1 20 . 1 1 14 14 ASN H H 14 8.448 8.448 7.918 0.530 25954 519 1 20 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.127 0.613 25954 520 1 20 . 1 1 15 15 GLN H H 15 7.823 7.823 8.060 -0.237 25954 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 25954 2 1 1 "Average Difference" HA 14 0.387 0.083 0.392 25954 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25954 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25954 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25954 6 1 1 "Average Difference" HN 12 0.524 0.330 0.425 25954 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25954 8 1 2 "Average Difference" HA 14 0.392 0.036 0.405 25954 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25954 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25954 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25954 12 1 2 "Average Difference" HN 12 0.633 0.314 0.574 25954 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25954 14 1 3 "Average Difference" HA 14 0.499 0.069 0.513 25954 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25954 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25954 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25954 18 1 3 "Average Difference" HN 12 0.490 0.357 0.350 25954 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25954 20 1 4 "Average Difference" HA 14 0.449 0.083 0.458 25954 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25954 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25954 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25954 24 1 4 "Average Difference" HN 12 0.484 0.300 0.397 25954 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25954 26 1 5 "Average Difference" HA 14 0.411 0.067 0.421 25954 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25954 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25954 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25954 30 1 5 "Average Difference" HN 12 0.490 0.267 0.429 25954 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25954 32 1 6 "Average Difference" HA 14 0.493 0.060 0.507 25954 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25954 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25954 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25954 36 1 6 "Average Difference" HN 12 0.415 0.235 0.358 25954 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25954 38 1 7 "Average Difference" HA 14 0.437 0.113 0.438 25954 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25954 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25954 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25954 42 1 7 "Average Difference" HN 12 0.459 0.285 0.377 25954 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25954 44 1 8 "Average Difference" HA 14 0.472 0.066 0.485 25954 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25954 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25954 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25954 48 1 8 "Average Difference" HN 12 0.440 0.341 0.291 25954 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25954 50 1 9 "Average Difference" HA 14 0.426 0.112 0.427 25954 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25954 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25954 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25954 54 1 9 "Average Difference" HN 12 0.451 0.314 0.338 25954 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25954 56 1 10 "Average Difference" HA 14 0.458 0.098 0.464 25954 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25954 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25954 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25954 60 1 10 "Average Difference" HN 12 0.445 0.292 0.350 25954 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25954 62 1 11 "Average Difference" HA 14 0.439 0.108 0.441 25954 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25954 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25954 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25954 66 1 11 "Average Difference" HN 12 0.477 0.345 0.345 25954 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25954 68 1 12 "Average Difference" HA 14 0.431 0.071 0.442 25954 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25954 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25954 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25954 72 1 12 "Average Difference" HN 12 0.494 0.262 0.438 25954 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25954 74 1 13 "Average Difference" HA 14 0.460 0.128 0.458 25954 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25954 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25954 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25954 78 1 13 "Average Difference" HN 12 0.504 0.326 0.401 25954 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25954 80 1 14 "Average Difference" HA 14 0.439 0.082 0.448 25954 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25954 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25954 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25954 84 1 14 "Average Difference" HN 12 0.555 0.384 0.419 25954 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25954 86 1 15 "Average Difference" HA 14 0.428 0.135 0.421 25954 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25954 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25954 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25954 90 1 15 "Average Difference" HN 12 0.473 0.345 0.338 25954 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25954 92 1 16 "Average Difference" HA 14 0.398 0.042 0.411 25954 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25954 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25954 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25954 96 1 16 "Average Difference" HN 12 0.497 0.305 0.410 25954 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25954 98 1 17 "Average Difference" HA 14 0.395 0.060 0.405 25954 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25954 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25954 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25954 102 1 17 "Average Difference" HN 12 0.471 0.257 0.412 25954 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25954 104 1 18 "Average Difference" HA 14 0.396 0.078 0.402 25954 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25954 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25954 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25954 108 1 18 "Average Difference" HN 12 0.514 0.304 0.433 25954 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25954 110 1 19 "Average Difference" HA 14 0.458 0.080 0.468 25954 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25954 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25954 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25954 114 1 19 "Average Difference" HN 12 0.473 0.294 0.387 25954 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25954 116 1 20 "Average Difference" HA 14 0.484 0.049 0.500 25954 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25954 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25954 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25954 120 1 20 "Average Difference" HN 12 0.496 0.326 0.390 25954 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 25954 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 CYS HA H 2 5.170 5.170 4.490 0.680 25954 2 1 . 1 1 2 2 CYS H H 2 7.978 7.978 8.311 -0.333 25954 3 1 . 1 1 3 3 CYS HA H 3 4.506 4.506 4.516 -0.010 25954 4 1 . 1 1 3 3 CYS H H 3 8.415 8.415 8.125 0.290 25954 5 1 . 1 1 4 4 SER HA H 4 4.488 4.488 4.491 -0.003 25954 6 1 . 1 1 4 4 SER H H 4 7.721 7.721 7.913 -0.192 25954 7 1 . 1 1 5 5 ASN HA H 5 4.144 4.144 4.891 -0.747 25954 8 1 . 1 1 5 5 ASN H H 5 7.668 7.668 8.198 -0.530 25954 9 1 . 1 1 6 6 PRO HA H 6 4.079 4.079 4.837 -0.758 25954 10 1 . 1 1 7 7 ALA HA H 7 4.048 4.048 4.427 -0.379 25954 11 1 . 1 1 7 7 ALA H H 7 7.752 7.752 8.050 -0.298 25954 12 1 . 1 1 8 8 CYS HA H 8 4.179 4.179 4.169 0.010 25954 13 1 . 1 1 8 8 CYS H H 8 7.758 7.758 8.418 -0.660 25954 14 1 . 1 1 9 9 ILE HA H 9 3.478 3.478 3.838 -0.360 25954 15 1 . 1 1 9 9 ILE H H 9 7.976 7.976 8.185 -0.209 25954 16 1 . 1 1 10 10 LEU HA H 10 3.945 3.945 4.078 -0.133 25954 17 1 . 1 1 10 10 LEU H H 10 7.335 7.335 7.876 -0.541 25954 18 1 . 1 1 11 11 ASN HA H 11 4.556 4.556 4.787 -0.231 25954 19 1 . 1 1 11 11 ASN H H 11 7.399 7.399 8.098 -0.699 25954 20 1 . 1 1 12 12 ASN HA H 12 5.072 5.072 4.511 0.561 25954 21 1 . 1 1 12 12 ASN H H 12 7.695 7.695 8.227 -0.532 25954 22 1 . 1 1 13 13 PRO HA H 13 4.282 4.282 4.434 -0.152 25954 23 1 . 1 1 14 14 ASN HA H 14 4.500 4.500 4.644 -0.144 25954 24 1 . 1 1 14 14 ASN H H 14 8.448 8.448 8.054 0.394 25954 25 1 . 1 1 15 15 GLN HA H 15 4.740 4.740 4.209 0.531 25954 26 1 . 1 1 15 15 GLN H H 15 7.823 7.823 8.221 -0.398 25954 stop_ save_