data_18736 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18736 _Entry.PDB_ID 2LZ5 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 18736 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.317 0.197 18736 2 1 1 . 1 1 2 2 CYS H H 2 8.939 8.939 8.379 0.560 18736 3 1 1 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.401 0.067 18736 4 1 1 . 1 1 3 3 CYS H H 3 8.753 8.753 8.422 0.331 18736 5 1 1 . 1 1 4 4 SER HA H 4 4.622 4.622 4.442 0.180 18736 6 1 1 . 1 1 4 4 SER H H 4 7.910 7.910 7.479 0.431 18736 7 1 1 . 1 1 5 5 ASP HA H 5 5.356 5.356 4.982 0.374 18736 8 1 1 . 1 1 5 5 ASP H H 5 7.980 7.980 7.577 0.403 18736 9 1 1 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.320 -0.096 18736 10 1 1 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.421 -0.037 18736 11 1 1 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.800 -0.496 18736 12 1 1 . 1 1 8 8 CYS H H 8 7.639 7.639 7.883 -0.244 18736 13 1 1 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.439 -0.435 18736 14 1 1 . 1 1 9 9 ARG H H 9 8.752 8.752 8.086 0.666 18736 15 1 1 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.595 -0.203 18736 16 1 1 . 1 1 10 10 ASN H H 10 8.516 8.516 8.835 -0.319 18736 17 1 1 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.195 0.051 18736 18 1 1 . 1 1 11 11 LYS H H 11 7.321 7.321 8.017 -0.696 18736 19 1 1 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.942 0.247 18736 20 1 1 . 1 1 12 12 HIS H H 12 7.663 7.663 7.857 -0.194 18736 21 1 1 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.885 -0.434 18736 22 1 1 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.456 -0.006 18736 23 1 1 . 1 1 14 14 ASP H H 14 8.806 8.806 8.183 0.623 18736 24 1 1 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.619 -0.246 18736 25 1 1 . 1 1 15 15 LEU H H 15 7.636 7.636 7.952 -0.316 18736 26 1 2 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.961 -0.447 18736 27 1 2 . 1 1 2 2 CYS H H 2 8.939 8.939 8.425 0.514 18736 28 1 2 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.381 0.087 18736 29 1 2 . 1 1 3 3 CYS H H 3 8.753 8.753 8.325 0.428 18736 30 1 2 . 1 1 4 4 SER HA H 4 4.622 4.622 4.610 0.012 18736 31 1 2 . 1 1 4 4 SER H H 4 7.910 7.910 7.848 0.062 18736 32 1 2 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.131 0.225 18736 33 1 2 . 1 1 5 5 ASP H H 5 7.980 7.980 7.798 0.182 18736 34 1 2 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.319 -0.095 18736 35 1 2 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.252 0.132 18736 36 1 2 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.844 -0.540 18736 37 1 2 . 1 1 8 8 CYS H H 8 7.639 7.639 8.145 -0.506 18736 38 1 2 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.170 -0.166 18736 39 1 2 . 1 1 9 9 ARG H H 9 8.752 8.752 8.623 0.129 18736 40 1 2 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.637 -0.245 18736 41 1 2 . 1 1 10 10 ASN H H 10 8.516 8.516 8.199 0.317 18736 42 1 2 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.156 0.090 18736 43 1 2 . 1 1 11 11 LYS H H 11 7.321 7.321 7.642 -0.321 18736 44 1 2 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.976 0.213 18736 45 1 2 . 1 1 12 12 HIS H H 12 7.663 7.663 7.865 -0.202 18736 46 1 2 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.824 -0.373 18736 47 1 2 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.418 0.032 18736 48 1 2 . 1 1 14 14 ASP H H 14 8.806 8.806 8.205 0.601 18736 49 1 2 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.583 -0.210 18736 50 1 2 . 1 1 15 15 LEU H H 15 7.636 7.636 7.917 -0.281 18736 51 1 3 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.344 0.170 18736 52 1 3 . 1 1 2 2 CYS H H 2 8.939 8.939 8.676 0.263 18736 53 1 3 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.335 0.133 18736 54 1 3 . 1 1 3 3 CYS H H 3 8.753 8.753 8.653 0.100 18736 55 1 3 . 1 1 4 4 SER HA H 4 4.622 4.622 4.554 0.068 18736 56 1 3 . 1 1 4 4 SER H H 4 7.910 7.910 7.650 0.260 18736 57 1 3 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.174 0.182 18736 58 1 3 . 1 1 5 5 ASP H H 5 7.980 7.980 7.675 0.305 18736 59 1 3 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.342 -0.118 18736 60 1 3 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.303 0.081 18736 61 1 3 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.289 0.015 18736 62 1 3 . 1 1 8 8 CYS H H 8 7.639 7.639 8.320 -0.681 18736 63 1 3 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.070 -0.066 18736 64 1 3 . 1 1 9 9 ARG H H 9 8.752 8.752 8.805 -0.053 18736 65 1 3 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.587 -0.195 18736 66 1 3 . 1 1 10 10 ASN H H 10 8.516 8.516 8.624 -0.108 18736 67 1 3 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.199 0.047 18736 68 1 3 . 1 1 11 11 LYS H H 11 7.321 7.321 7.534 -0.213 18736 69 1 3 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.072 0.117 18736 70 1 3 . 1 1 12 12 HIS H H 12 7.663 7.663 7.905 -0.242 18736 71 1 3 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.823 -0.372 18736 72 1 3 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.434 0.016 18736 73 1 3 . 1 1 14 14 ASP H H 14 8.806 8.806 8.337 0.469 18736 74 1 3 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.582 -0.209 18736 75 1 3 . 1 1 15 15 LEU H H 15 7.636 7.636 7.692 -0.056 18736 76 1 4 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.496 0.018 18736 77 1 4 . 1 1 2 2 CYS H H 2 8.939 8.939 8.628 0.311 18736 78 1 4 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.230 0.238 18736 79 1 4 . 1 1 3 3 CYS H H 3 8.753 8.753 8.608 0.145 18736 80 1 4 . 1 1 4 4 SER HA H 4 4.622 4.622 4.589 0.033 18736 81 1 4 . 1 1 4 4 SER H H 4 7.910 7.910 7.713 0.197 18736 82 1 4 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.145 0.211 18736 83 1 4 . 1 1 5 5 ASP H H 5 7.980 7.980 7.796 0.184 18736 84 1 4 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.318 -0.094 18736 85 1 4 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.201 0.183 18736 86 1 4 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.677 -0.373 18736 87 1 4 . 1 1 8 8 CYS H H 8 7.639 7.639 8.531 -0.892 18736 88 1 4 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.037 -0.033 18736 89 1 4 . 1 1 9 9 ARG H H 9 8.752 8.752 8.697 0.055 18736 90 1 4 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.569 -0.177 18736 91 1 4 . 1 1 10 10 ASN H H 10 8.516 8.516 8.295 0.221 18736 92 1 4 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.200 0.046 18736 93 1 4 . 1 1 11 11 LYS H H 11 7.321 7.321 7.709 -0.388 18736 94 1 4 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.050 0.139 18736 95 1 4 . 1 1 12 12 HIS H H 12 7.663 7.663 7.816 -0.153 18736 96 1 4 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.416 0.035 18736 97 1 4 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.427 0.023 18736 98 1 4 . 1 1 14 14 ASP H H 14 8.806 8.806 8.251 0.555 18736 99 1 4 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.652 -0.279 18736 100 1 4 . 1 1 15 15 LEU H H 15 7.636 7.636 7.907 -0.271 18736 101 1 5 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.594 -0.080 18736 102 1 5 . 1 1 2 2 CYS H H 2 8.939 8.939 8.499 0.440 18736 103 1 5 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.320 0.148 18736 104 1 5 . 1 1 3 3 CYS H H 3 8.753 8.753 8.431 0.322 18736 105 1 5 . 1 1 4 4 SER HA H 4 4.622 4.622 4.485 0.137 18736 106 1 5 . 1 1 4 4 SER H H 4 7.910 7.910 7.451 0.459 18736 107 1 5 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.015 0.341 18736 108 1 5 . 1 1 5 5 ASP H H 5 7.980 7.980 7.617 0.363 18736 109 1 5 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.295 -0.071 18736 110 1 5 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.377 0.007 18736 111 1 5 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.738 -0.434 18736 112 1 5 . 1 1 8 8 CYS H H 8 7.639 7.639 7.791 -0.152 18736 113 1 5 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.467 -0.463 18736 114 1 5 . 1 1 9 9 ARG H H 9 8.752 8.752 8.131 0.621 18736 115 1 5 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.516 -0.124 18736 116 1 5 . 1 1 10 10 ASN H H 10 8.516 8.516 8.787 -0.271 18736 117 1 5 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.231 0.015 18736 118 1 5 . 1 1 11 11 LYS H H 11 7.321 7.321 8.176 -0.855 18736 119 1 5 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.974 0.215 18736 120 1 5 . 1 1 12 12 HIS H H 12 7.663 7.663 7.897 -0.234 18736 121 1 5 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.764 -0.313 18736 122 1 5 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.445 0.005 18736 123 1 5 . 1 1 14 14 ASP H H 14 8.806 8.806 8.412 0.394 18736 124 1 5 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.582 -0.209 18736 125 1 5 . 1 1 15 15 LEU H H 15 7.636 7.636 7.720 -0.084 18736 126 1 6 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.523 -0.009 18736 127 1 6 . 1 1 2 2 CYS H H 2 8.939 8.939 8.363 0.576 18736 128 1 6 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.329 0.139 18736 129 1 6 . 1 1 3 3 CYS H H 3 8.753 8.753 8.375 0.378 18736 130 1 6 . 1 1 4 4 SER HA H 4 4.622 4.622 4.432 0.190 18736 131 1 6 . 1 1 4 4 SER H H 4 7.910 7.910 7.954 -0.044 18736 132 1 6 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.093 0.263 18736 133 1 6 . 1 1 5 5 ASP H H 5 7.980 7.980 7.683 0.297 18736 134 1 6 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.346 -0.122 18736 135 1 6 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.262 0.122 18736 136 1 6 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.330 -0.026 18736 137 1 6 . 1 1 8 8 CYS H H 8 7.639 7.639 8.307 -0.668 18736 138 1 6 . 1 1 9 9 ARG HA H 9 4.004 4.004 3.998 0.006 18736 139 1 6 . 1 1 9 9 ARG H H 9 8.752 8.752 8.755 -0.003 18736 140 1 6 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.572 -0.180 18736 141 1 6 . 1 1 10 10 ASN H H 10 8.516 8.516 8.512 0.004 18736 142 1 6 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.267 -0.021 18736 143 1 6 . 1 1 11 11 LYS H H 11 7.321 7.321 7.827 -0.506 18736 144 1 6 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.027 0.162 18736 145 1 6 . 1 1 12 12 HIS H H 12 7.663 7.663 7.974 -0.311 18736 146 1 6 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.464 -0.013 18736 147 1 6 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.444 0.006 18736 148 1 6 . 1 1 14 14 ASP H H 14 8.806 8.806 8.348 0.458 18736 149 1 6 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.598 -0.225 18736 150 1 6 . 1 1 15 15 LEU H H 15 7.636 7.636 7.922 -0.286 18736 151 1 7 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.585 -0.071 18736 152 1 7 . 1 1 2 2 CYS H H 2 8.939 8.939 8.271 0.668 18736 153 1 7 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.390 0.078 18736 154 1 7 . 1 1 3 3 CYS H H 3 8.753 8.753 8.251 0.502 18736 155 1 7 . 1 1 4 4 SER HA H 4 4.622 4.622 4.528 0.094 18736 156 1 7 . 1 1 4 4 SER H H 4 7.910 7.910 8.027 -0.117 18736 157 1 7 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.129 0.227 18736 158 1 7 . 1 1 5 5 ASP H H 5 7.980 7.980 7.649 0.331 18736 159 1 7 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.378 -0.154 18736 160 1 7 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.249 0.135 18736 161 1 7 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.283 0.021 18736 162 1 7 . 1 1 8 8 CYS H H 8 7.639 7.639 8.887 -1.248 18736 163 1 7 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.028 -0.024 18736 164 1 7 . 1 1 9 9 ARG H H 9 8.752 8.752 8.820 -0.068 18736 165 1 7 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.659 -0.267 18736 166 1 7 . 1 1 10 10 ASN H H 10 8.516 8.516 8.679 -0.163 18736 167 1 7 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.237 0.009 18736 168 1 7 . 1 1 11 11 LYS H H 11 7.321 7.321 8.018 -0.697 18736 169 1 7 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.960 0.229 18736 170 1 7 . 1 1 12 12 HIS H H 12 7.663 7.663 7.984 -0.321 18736 171 1 7 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.916 -0.465 18736 172 1 7 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.490 -0.040 18736 173 1 7 . 1 1 14 14 ASP H H 14 8.806 8.806 8.248 0.558 18736 174 1 7 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.676 -0.303 18736 175 1 7 . 1 1 15 15 LEU H H 15 7.636 7.636 7.706 -0.070 18736 176 1 8 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.341 0.173 18736 177 1 8 . 1 1 2 2 CYS H H 2 8.939 8.939 8.358 0.581 18736 178 1 8 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.314 0.154 18736 179 1 8 . 1 1 3 3 CYS H H 3 8.753 8.753 8.532 0.221 18736 180 1 8 . 1 1 4 4 SER HA H 4 4.622 4.622 4.628 -0.006 18736 181 1 8 . 1 1 4 4 SER H H 4 7.910 7.910 7.597 0.313 18736 182 1 8 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.152 0.204 18736 183 1 8 . 1 1 5 5 ASP H H 5 7.980 7.980 7.721 0.259 18736 184 1 8 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.324 -0.100 18736 185 1 8 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.619 -0.235 18736 186 1 8 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.504 -0.200 18736 187 1 8 . 1 1 8 8 CYS H H 8 7.639 7.639 8.192 -0.553 18736 188 1 8 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.099 -0.095 18736 189 1 8 . 1 1 9 9 ARG H H 9 8.752 8.752 8.794 -0.042 18736 190 1 8 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.576 -0.184 18736 191 1 8 . 1 1 10 10 ASN H H 10 8.516 8.516 8.610 -0.094 18736 192 1 8 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.217 0.029 18736 193 1 8 . 1 1 11 11 LYS H H 11 7.321 7.321 7.768 -0.447 18736 194 1 8 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.993 0.196 18736 195 1 8 . 1 1 12 12 HIS H H 12 7.663 7.663 7.914 -0.251 18736 196 1 8 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.431 0.020 18736 197 1 8 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.573 -0.123 18736 198 1 8 . 1 1 14 14 ASP H H 14 8.806 8.806 7.944 0.862 18736 199 1 8 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.460 -0.087 18736 200 1 8 . 1 1 15 15 LEU H H 15 7.636 7.636 7.515 0.121 18736 201 1 9 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.635 -0.121 18736 202 1 9 . 1 1 2 2 CYS H H 2 8.939 8.939 8.497 0.442 18736 203 1 9 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.368 0.100 18736 204 1 9 . 1 1 3 3 CYS H H 3 8.753 8.753 8.265 0.488 18736 205 1 9 . 1 1 4 4 SER HA H 4 4.622 4.622 4.442 0.180 18736 206 1 9 . 1 1 4 4 SER H H 4 7.910 7.910 7.656 0.254 18736 207 1 9 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.135 0.221 18736 208 1 9 . 1 1 5 5 ASP H H 5 7.980 7.980 7.648 0.332 18736 209 1 9 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.354 -0.130 18736 210 1 9 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.384 -0.000 18736 211 1 9 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.229 0.075 18736 212 1 9 . 1 1 8 8 CYS H H 8 7.639 7.639 8.680 -1.041 18736 213 1 9 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.081 -0.077 18736 214 1 9 . 1 1 9 9 ARG H H 9 8.752 8.752 8.734 0.018 18736 215 1 9 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.551 -0.159 18736 216 1 9 . 1 1 10 10 ASN H H 10 8.516 8.516 8.647 -0.131 18736 217 1 9 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.262 -0.016 18736 218 1 9 . 1 1 11 11 LYS H H 11 7.321 7.321 7.792 -0.471 18736 219 1 9 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.018 0.171 18736 220 1 9 . 1 1 12 12 HIS H H 12 7.663 7.663 7.946 -0.283 18736 221 1 9 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.813 -0.362 18736 222 1 9 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.394 0.056 18736 223 1 9 . 1 1 14 14 ASP H H 14 8.806 8.806 8.391 0.415 18736 224 1 9 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.643 -0.270 18736 225 1 9 . 1 1 15 15 LEU H H 15 7.636 7.636 8.075 -0.439 18736 226 1 10 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.560 -0.046 18736 227 1 10 . 1 1 2 2 CYS H H 2 8.939 8.939 8.406 0.533 18736 228 1 10 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.418 0.050 18736 229 1 10 . 1 1 3 3 CYS H H 3 8.753 8.753 8.467 0.286 18736 230 1 10 . 1 1 4 4 SER HA H 4 4.622 4.622 4.592 0.030 18736 231 1 10 . 1 1 4 4 SER H H 4 7.910 7.910 7.443 0.467 18736 232 1 10 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.104 0.252 18736 233 1 10 . 1 1 5 5 ASP H H 5 7.980 7.980 7.687 0.293 18736 234 1 10 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.273 -0.049 18736 235 1 10 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.268 0.116 18736 236 1 10 . 1 1 8 8 CYS HA H 8 4.304 4.304 5.318 -1.014 18736 237 1 10 . 1 1 8 8 CYS H H 8 7.639 7.639 7.797 -0.158 18736 238 1 10 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.490 -0.486 18736 239 1 10 . 1 1 9 9 ARG H H 9 8.752 8.752 8.125 0.627 18736 240 1 10 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.548 -0.156 18736 241 1 10 . 1 1 10 10 ASN H H 10 8.516 8.516 8.669 -0.153 18736 242 1 10 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.293 -0.047 18736 243 1 10 . 1 1 11 11 LYS H H 11 7.321 7.321 7.865 -0.544 18736 244 1 10 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.978 0.211 18736 245 1 10 . 1 1 12 12 HIS H H 12 7.663 7.663 7.872 -0.209 18736 246 1 10 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.493 -0.042 18736 247 1 10 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.425 0.025 18736 248 1 10 . 1 1 14 14 ASP H H 14 8.806 8.806 8.438 0.368 18736 249 1 10 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.620 -0.247 18736 250 1 10 . 1 1 15 15 LEU H H 15 7.636 7.636 7.917 -0.281 18736 251 1 11 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.628 -0.114 18736 252 1 11 . 1 1 2 2 CYS H H 2 8.939 8.939 8.412 0.527 18736 253 1 11 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.376 0.092 18736 254 1 11 . 1 1 3 3 CYS H H 3 8.753 8.753 8.348 0.405 18736 255 1 11 . 1 1 4 4 SER HA H 4 4.622 4.622 4.525 0.097 18736 256 1 11 . 1 1 4 4 SER H H 4 7.910 7.910 7.924 -0.014 18736 257 1 11 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.112 0.244 18736 258 1 11 . 1 1 5 5 ASP H H 5 7.980 7.980 7.662 0.318 18736 259 1 11 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.261 -0.037 18736 260 1 11 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.294 0.090 18736 261 1 11 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.511 -0.207 18736 262 1 11 . 1 1 8 8 CYS H H 8 7.639 7.639 8.044 -0.405 18736 263 1 11 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.062 -0.058 18736 264 1 11 . 1 1 9 9 ARG H H 9 8.752 8.752 8.634 0.118 18736 265 1 11 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.539 -0.147 18736 266 1 11 . 1 1 10 10 ASN H H 10 8.516 8.516 8.482 0.034 18736 267 1 11 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.220 0.026 18736 268 1 11 . 1 1 11 11 LYS H H 11 7.321 7.321 7.570 -0.249 18736 269 1 11 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.006 0.183 18736 270 1 11 . 1 1 12 12 HIS H H 12 7.663 7.663 7.927 -0.264 18736 271 1 11 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.496 -0.045 18736 272 1 11 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.436 0.014 18736 273 1 11 . 1 1 14 14 ASP H H 14 8.806 8.806 8.459 0.347 18736 274 1 11 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.680 -0.307 18736 275 1 11 . 1 1 15 15 LEU H H 15 7.636 7.636 7.752 -0.116 18736 276 1 12 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.400 0.114 18736 277 1 12 . 1 1 2 2 CYS H H 2 8.939 8.939 8.484 0.455 18736 278 1 12 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.390 0.078 18736 279 1 12 . 1 1 3 3 CYS H H 3 8.753 8.753 8.540 0.213 18736 280 1 12 . 1 1 4 4 SER HA H 4 4.622 4.622 4.393 0.229 18736 281 1 12 . 1 1 4 4 SER H H 4 7.910 7.910 8.062 -0.152 18736 282 1 12 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.057 0.299 18736 283 1 12 . 1 1 5 5 ASP H H 5 7.980 7.980 7.692 0.288 18736 284 1 12 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.363 -0.139 18736 285 1 12 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.257 0.127 18736 286 1 12 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.289 0.015 18736 287 1 12 . 1 1 8 8 CYS H H 8 7.639 7.639 8.287 -0.648 18736 288 1 12 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.031 -0.027 18736 289 1 12 . 1 1 9 9 ARG H H 9 8.752 8.752 8.839 -0.087 18736 290 1 12 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.578 -0.186 18736 291 1 12 . 1 1 10 10 ASN H H 10 8.516 8.516 8.590 -0.074 18736 292 1 12 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.180 0.066 18736 293 1 12 . 1 1 11 11 LYS H H 11 7.321 7.321 7.635 -0.314 18736 294 1 12 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.911 0.278 18736 295 1 12 . 1 1 12 12 HIS H H 12 7.663 7.663 7.963 -0.300 18736 296 1 12 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.718 -0.267 18736 297 1 12 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.414 0.036 18736 298 1 12 . 1 1 14 14 ASP H H 14 8.806 8.806 8.487 0.319 18736 299 1 12 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.659 -0.286 18736 300 1 12 . 1 1 15 15 LEU H H 15 7.636 7.636 7.943 -0.307 18736 301 1 13 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.377 0.137 18736 302 1 13 . 1 1 2 2 CYS H H 2 8.939 8.939 8.741 0.198 18736 303 1 13 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.285 0.183 18736 304 1 13 . 1 1 3 3 CYS H H 3 8.753 8.753 8.425 0.328 18736 305 1 13 . 1 1 4 4 SER HA H 4 4.622 4.622 4.596 0.026 18736 306 1 13 . 1 1 4 4 SER H H 4 7.910 7.910 7.616 0.294 18736 307 1 13 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.077 0.279 18736 308 1 13 . 1 1 5 5 ASP H H 5 7.980 7.980 7.679 0.301 18736 309 1 13 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.305 -0.081 18736 310 1 13 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.255 0.129 18736 311 1 13 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.729 -0.425 18736 312 1 13 . 1 1 8 8 CYS H H 8 7.639 7.639 8.296 -0.657 18736 313 1 13 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.149 -0.145 18736 314 1 13 . 1 1 9 9 ARG H H 9 8.752 8.752 8.779 -0.027 18736 315 1 13 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.555 -0.163 18736 316 1 13 . 1 1 10 10 ASN H H 10 8.516 8.516 8.279 0.237 18736 317 1 13 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.176 0.070 18736 318 1 13 . 1 1 11 11 LYS H H 11 7.321 7.321 7.443 -0.122 18736 319 1 13 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.042 0.147 18736 320 1 13 . 1 1 12 12 HIS H H 12 7.663 7.663 7.761 -0.098 18736 321 1 13 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.465 -0.014 18736 322 1 13 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.499 -0.049 18736 323 1 13 . 1 1 14 14 ASP H H 14 8.806 8.806 8.110 0.696 18736 324 1 13 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.483 -0.110 18736 325 1 13 . 1 1 15 15 LEU H H 15 7.636 7.636 7.602 0.034 18736 326 1 14 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.462 0.052 18736 327 1 14 . 1 1 2 2 CYS H H 2 8.939 8.939 8.772 0.167 18736 328 1 14 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.360 0.108 18736 329 1 14 . 1 1 3 3 CYS H H 3 8.753 8.753 8.571 0.182 18736 330 1 14 . 1 1 4 4 SER HA H 4 4.622 4.622 4.617 0.005 18736 331 1 14 . 1 1 4 4 SER H H 4 7.910 7.910 7.573 0.337 18736 332 1 14 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.092 0.264 18736 333 1 14 . 1 1 5 5 ASP H H 5 7.980 7.980 7.677 0.303 18736 334 1 14 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.295 -0.071 18736 335 1 14 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.286 0.098 18736 336 1 14 . 1 1 8 8 CYS HA H 8 4.304 4.304 5.047 -0.743 18736 337 1 14 . 1 1 8 8 CYS H H 8 7.639 7.639 7.965 -0.326 18736 338 1 14 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.409 -0.405 18736 339 1 14 . 1 1 9 9 ARG H H 9 8.752 8.752 7.960 0.792 18736 340 1 14 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.538 -0.146 18736 341 1 14 . 1 1 10 10 ASN H H 10 8.516 8.516 8.694 -0.178 18736 342 1 14 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.160 0.086 18736 343 1 14 . 1 1 11 11 LYS H H 11 7.321 7.321 7.970 -0.649 18736 344 1 14 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.943 0.246 18736 345 1 14 . 1 1 12 12 HIS H H 12 7.663 7.663 8.012 -0.349 18736 346 1 14 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.609 -0.158 18736 347 1 14 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.476 -0.026 18736 348 1 14 . 1 1 14 14 ASP H H 14 8.806 8.806 8.265 0.541 18736 349 1 14 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.710 -0.337 18736 350 1 14 . 1 1 15 15 LEU H H 15 7.636 7.636 7.700 -0.064 18736 351 1 15 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.462 0.052 18736 352 1 15 . 1 1 2 2 CYS H H 2 8.939 8.939 8.375 0.564 18736 353 1 15 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.257 0.211 18736 354 1 15 . 1 1 3 3 CYS H H 3 8.753 8.753 8.587 0.166 18736 355 1 15 . 1 1 4 4 SER HA H 4 4.622 4.622 4.437 0.185 18736 356 1 15 . 1 1 4 4 SER H H 4 7.910 7.910 7.984 -0.074 18736 357 1 15 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.159 0.197 18736 358 1 15 . 1 1 5 5 ASP H H 5 7.980 7.980 7.692 0.288 18736 359 1 15 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.329 -0.105 18736 360 1 15 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.216 0.168 18736 361 1 15 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.572 -0.268 18736 362 1 15 . 1 1 8 8 CYS H H 8 7.639 7.639 7.927 -0.288 18736 363 1 15 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.126 -0.122 18736 364 1 15 . 1 1 9 9 ARG H H 9 8.752 8.752 8.897 -0.145 18736 365 1 15 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.558 -0.166 18736 366 1 15 . 1 1 10 10 ASN H H 10 8.516 8.516 8.405 0.111 18736 367 1 15 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.263 -0.017 18736 368 1 15 . 1 1 11 11 LYS H H 11 7.321 7.321 7.629 -0.308 18736 369 1 15 . 1 1 12 12 HIS HA H 12 5.189 5.189 5.000 0.189 18736 370 1 15 . 1 1 12 12 HIS H H 12 7.663 7.663 7.705 -0.042 18736 371 1 15 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.623 -0.172 18736 372 1 15 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.512 -0.062 18736 373 1 15 . 1 1 14 14 ASP H H 14 8.806 8.806 8.268 0.538 18736 374 1 15 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.446 -0.073 18736 375 1 15 . 1 1 15 15 LEU H H 15 7.636 7.636 8.231 -0.595 18736 376 1 16 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.533 -0.019 18736 377 1 16 . 1 1 2 2 CYS H H 2 8.939 8.939 8.175 0.764 18736 378 1 16 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.320 0.148 18736 379 1 16 . 1 1 3 3 CYS H H 3 8.753 8.753 8.537 0.216 18736 380 1 16 . 1 1 4 4 SER HA H 4 4.622 4.622 4.387 0.235 18736 381 1 16 . 1 1 4 4 SER H H 4 7.910 7.910 8.143 -0.233 18736 382 1 16 . 1 1 5 5 ASP HA H 5 5.356 5.356 4.980 0.376 18736 383 1 16 . 1 1 5 5 ASP H H 5 7.980 7.980 7.554 0.426 18736 384 1 16 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.332 -0.108 18736 385 1 16 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.404 -0.020 18736 386 1 16 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.969 -0.665 18736 387 1 16 . 1 1 8 8 CYS H H 8 7.639 7.639 7.976 -0.337 18736 388 1 16 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.464 -0.460 18736 389 1 16 . 1 1 9 9 ARG H H 9 8.752 8.752 8.064 0.688 18736 390 1 16 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.581 -0.189 18736 391 1 16 . 1 1 10 10 ASN H H 10 8.516 8.516 8.689 -0.173 18736 392 1 16 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.258 -0.012 18736 393 1 16 . 1 1 11 11 LYS H H 11 7.321 7.321 8.130 -0.809 18736 394 1 16 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.958 0.231 18736 395 1 16 . 1 1 12 12 HIS H H 12 7.663 7.663 7.864 -0.201 18736 396 1 16 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.456 -0.005 18736 397 1 16 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.439 0.011 18736 398 1 16 . 1 1 14 14 ASP H H 14 8.806 8.806 8.349 0.457 18736 399 1 16 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.636 -0.263 18736 400 1 16 . 1 1 15 15 LEU H H 15 7.636 7.636 7.798 -0.162 18736 401 1 17 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.573 -0.059 18736 402 1 17 . 1 1 2 2 CYS H H 2 8.939 8.939 8.628 0.311 18736 403 1 17 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.455 0.013 18736 404 1 17 . 1 1 3 3 CYS H H 3 8.753 8.753 8.589 0.164 18736 405 1 17 . 1 1 4 4 SER HA H 4 4.622 4.622 4.520 0.102 18736 406 1 17 . 1 1 4 4 SER H H 4 7.910 7.910 7.613 0.297 18736 407 1 17 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.009 0.347 18736 408 1 17 . 1 1 5 5 ASP H H 5 7.980 7.980 7.639 0.341 18736 409 1 17 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.361 -0.137 18736 410 1 17 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.294 0.090 18736 411 1 17 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.687 -0.383 18736 412 1 17 . 1 1 8 8 CYS H H 8 7.639 7.639 8.231 -0.592 18736 413 1 17 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.506 -0.502 18736 414 1 17 . 1 1 9 9 ARG H H 9 8.752 8.752 7.870 0.882 18736 415 1 17 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.562 -0.170 18736 416 1 17 . 1 1 10 10 ASN H H 10 8.516 8.516 8.728 -0.212 18736 417 1 17 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.181 0.065 18736 418 1 17 . 1 1 11 11 LYS H H 11 7.321 7.321 7.576 -0.255 18736 419 1 17 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.961 0.228 18736 420 1 17 . 1 1 12 12 HIS H H 12 7.663 7.663 7.867 -0.204 18736 421 1 17 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.392 0.059 18736 422 1 17 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.423 0.027 18736 423 1 17 . 1 1 14 14 ASP H H 14 8.806 8.806 8.310 0.496 18736 424 1 17 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.632 -0.259 18736 425 1 17 . 1 1 15 15 LEU H H 15 7.636 7.636 7.722 -0.086 18736 426 1 18 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.448 0.066 18736 427 1 18 . 1 1 2 2 CYS H H 2 8.939 8.939 8.447 0.492 18736 428 1 18 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.266 0.202 18736 429 1 18 . 1 1 3 3 CYS H H 3 8.753 8.753 8.501 0.252 18736 430 1 18 . 1 1 4 4 SER HA H 4 4.622 4.622 4.550 0.072 18736 431 1 18 . 1 1 4 4 SER H H 4 7.910 7.910 7.599 0.311 18736 432 1 18 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.092 0.264 18736 433 1 18 . 1 1 5 5 ASP H H 5 7.980 7.980 7.951 0.029 18736 434 1 18 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.302 -0.078 18736 435 1 18 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.212 0.172 18736 436 1 18 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.803 -0.499 18736 437 1 18 . 1 1 8 8 CYS H H 8 7.639 7.639 7.897 -0.258 18736 438 1 18 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.044 -0.040 18736 439 1 18 . 1 1 9 9 ARG H H 9 8.752 8.752 8.409 0.343 18736 440 1 18 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.582 -0.190 18736 441 1 18 . 1 1 10 10 ASN H H 10 8.516 8.516 8.369 0.147 18736 442 1 18 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.249 -0.003 18736 443 1 18 . 1 1 11 11 LYS H H 11 7.321 7.321 7.821 -0.500 18736 444 1 18 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.973 0.216 18736 445 1 18 . 1 1 12 12 HIS H H 12 7.663 7.663 7.802 -0.139 18736 446 1 18 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.943 -0.492 18736 447 1 18 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.402 0.048 18736 448 1 18 . 1 1 14 14 ASP H H 14 8.806 8.806 8.366 0.440 18736 449 1 18 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.523 -0.150 18736 450 1 18 . 1 1 15 15 LEU H H 15 7.636 7.636 8.172 -0.536 18736 451 1 19 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.419 0.095 18736 452 1 19 . 1 1 2 2 CYS H H 2 8.939 8.939 8.426 0.513 18736 453 1 19 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.633 -0.165 18736 454 1 19 . 1 1 3 3 CYS H H 3 8.753 8.753 8.368 0.385 18736 455 1 19 . 1 1 4 4 SER HA H 4 4.622 4.622 4.461 0.161 18736 456 1 19 . 1 1 4 4 SER H H 4 7.910 7.910 7.471 0.439 18736 457 1 19 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.020 0.336 18736 458 1 19 . 1 1 5 5 ASP H H 5 7.980 7.980 7.703 0.277 18736 459 1 19 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.261 -0.037 18736 460 1 19 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.398 -0.014 18736 461 1 19 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.911 -0.607 18736 462 1 19 . 1 1 8 8 CYS H H 8 7.639 7.639 7.968 -0.329 18736 463 1 19 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.569 -0.565 18736 464 1 19 . 1 1 9 9 ARG H H 9 8.752 8.752 8.185 0.567 18736 465 1 19 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.556 -0.164 18736 466 1 19 . 1 1 10 10 ASN H H 10 8.516 8.516 8.725 -0.209 18736 467 1 19 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.215 0.031 18736 468 1 19 . 1 1 11 11 LYS H H 11 7.321 7.321 8.131 -0.810 18736 469 1 19 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.945 0.244 18736 470 1 19 . 1 1 12 12 HIS H H 12 7.663 7.663 7.855 -0.192 18736 471 1 19 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.621 -0.170 18736 472 1 19 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.470 -0.020 18736 473 1 19 . 1 1 14 14 ASP H H 14 8.806 8.806 8.249 0.557 18736 474 1 19 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.581 -0.208 18736 475 1 19 . 1 1 15 15 LEU H H 15 7.636 7.636 7.720 -0.084 18736 476 1 20 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.540 -0.026 18736 477 1 20 . 1 1 2 2 CYS H H 2 8.939 8.939 8.438 0.501 18736 478 1 20 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.373 0.095 18736 479 1 20 . 1 1 3 3 CYS H H 3 8.753 8.753 8.504 0.249 18736 480 1 20 . 1 1 4 4 SER HA H 4 4.622 4.622 4.346 0.276 18736 481 1 20 . 1 1 4 4 SER H H 4 7.910 7.910 7.841 0.069 18736 482 1 20 . 1 1 5 5 ASP HA H 5 5.356 5.356 4.993 0.363 18736 483 1 20 . 1 1 5 5 ASP H H 5 7.980 7.980 7.658 0.322 18736 484 1 20 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.273 -0.049 18736 485 1 20 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.305 0.079 18736 486 1 20 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.374 -0.070 18736 487 1 20 . 1 1 8 8 CYS H H 8 7.639 7.639 7.889 -0.250 18736 488 1 20 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.081 -0.077 18736 489 1 20 . 1 1 9 9 ARG H H 9 8.752 8.752 8.592 0.160 18736 490 1 20 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.563 -0.171 18736 491 1 20 . 1 1 10 10 ASN H H 10 8.516 8.516 8.713 -0.197 18736 492 1 20 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.180 0.066 18736 493 1 20 . 1 1 11 11 LYS H H 11 7.321 7.321 7.731 -0.410 18736 494 1 20 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.955 0.234 18736 495 1 20 . 1 1 12 12 HIS H H 12 7.663 7.663 7.958 -0.295 18736 496 1 20 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.936 -0.485 18736 497 1 20 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.406 0.044 18736 498 1 20 . 1 1 14 14 ASP H H 14 8.806 8.806 8.213 0.593 18736 499 1 20 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.568 -0.195 18736 500 1 20 . 1 1 15 15 LEU H H 15 7.636 7.636 8.035 -0.399 18736 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 18736 2 1 1 "Average Difference" HA 14 0.269 0.060 0.272 18736 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18736 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18736 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18736 6 1 1 "Average Difference" HN 11 0.466 -0.113 0.474 18736 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18736 8 1 2 "Average Difference" HA 14 0.254 0.092 0.246 18736 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18736 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18736 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18736 12 1 2 "Average Difference" HN 11 0.362 -0.084 0.369 18736 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18736 14 1 3 "Average Difference" HA 14 0.157 0.009 0.163 18736 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18736 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18736 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18736 18 1 3 "Average Difference" HN 11 0.308 -0.004 0.323 18736 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18736 20 1 4 "Average Difference" HA 14 0.173 0.002 0.179 18736 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18736 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18736 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18736 24 1 4 "Average Difference" HN 11 0.381 0.004 0.399 18736 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18736 26 1 5 "Average Difference" HA 14 0.235 0.059 0.236 18736 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18736 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18736 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18736 30 1 5 "Average Difference" HN 11 0.434 -0.091 0.445 18736 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18736 32 1 6 "Average Difference" HA 14 0.138 -0.021 0.141 18736 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18736 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18736 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18736 36 1 6 "Average Difference" HN 11 0.388 0.010 0.407 18736 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18736 38 1 7 "Average Difference" HA 14 0.198 0.038 0.202 18736 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18736 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18736 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18736 42 1 7 "Average Difference" HN 11 0.549 0.057 0.573 18736 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18736 44 1 8 "Average Difference" HA 14 0.148 0.018 0.152 18736 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18736 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18736 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18736 48 1 8 "Average Difference" HN 11 0.414 -0.088 0.425 18736 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18736 50 1 9 "Average Difference" HA 14 0.168 0.024 0.173 18736 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18736 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18736 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18736 54 1 9 "Average Difference" HN 11 0.465 0.038 0.486 18736 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18736 56 1 10 "Average Difference" HA 14 0.325 0.100 0.321 18736 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18736 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18736 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18736 60 1 10 "Average Difference" HN 11 0.389 -0.112 0.391 18736 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18736 62 1 11 "Average Difference" HA 14 0.146 0.012 0.151 18736 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18736 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18736 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18736 66 1 11 "Average Difference" HN 11 0.300 -0.064 0.307 18736 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18736 68 1 12 "Average Difference" HA 14 0.183 -0.024 0.188 18736 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18736 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18736 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18736 72 1 12 "Average Difference" HN 11 0.327 0.055 0.338 18736 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18736 74 1 13 "Average Difference" HA 14 0.174 0.001 0.180 18736 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18736 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18736 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18736 78 1 13 "Average Difference" HN 11 0.347 -0.108 0.346 18736 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18736 80 1 14 "Average Difference" HA 14 0.273 0.073 0.273 18736 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18736 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18736 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18736 84 1 14 "Average Difference" HN 11 0.413 -0.069 0.427 18736 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18736 86 1 15 "Average Difference" HA 14 0.158 -0.001 0.164 18736 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18736 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18736 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18736 90 1 15 "Average Difference" HN 11 0.343 -0.019 0.359 18736 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18736 92 1 16 "Average Difference" HA 14 0.273 0.053 0.278 18736 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18736 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18736 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18736 96 1 16 "Average Difference" HN 11 0.468 -0.058 0.487 18736 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18736 98 1 17 "Average Difference" HA 14 0.226 0.041 0.231 18736 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18736 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18736 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18736 102 1 17 "Average Difference" HN 11 0.411 -0.104 0.418 18736 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18736 104 1 18 "Average Difference" HA 14 0.232 0.029 0.239 18736 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18736 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18736 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18736 108 1 18 "Average Difference" HN 11 0.351 -0.053 0.364 18736 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18736 110 1 19 "Average Difference" HA 14 0.271 0.078 0.269 18736 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18736 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18736 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18736 114 1 19 "Average Difference" HN 11 0.444 -0.101 0.453 18736 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18736 116 1 20 "Average Difference" HA 14 0.207 -0.006 0.215 18736 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18736 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18736 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18736 120 1 20 "Average Difference" HN 11 0.346 -0.031 0.361 18736 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 18736 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 CYS HA H 2 4.514 4.514 4.510 0.004 18736 2 1 . 1 1 2 2 CYS H H 2 8.939 8.939 8.470 0.469 18736 3 1 . 1 1 3 3 CYS HA H 3 4.468 4.468 4.360 0.108 18736 4 1 . 1 1 3 3 CYS H H 3 8.753 8.753 8.465 0.288 18736 5 1 . 1 1 4 4 SER HA H 4 4.622 4.622 4.507 0.115 18736 6 1 . 1 1 4 4 SER H H 4 7.910 7.910 7.732 0.178 18736 7 1 . 1 1 5 5 ASP HA H 5 5.356 5.356 5.083 0.273 18736 8 1 . 1 1 5 5 ASP H H 5 7.980 7.980 7.688 0.292 18736 9 1 . 1 1 6 6 PRO HA H 6 4.224 4.224 4.318 -0.094 18736 10 1 . 1 1 7 7 PRO HA H 7 4.384 4.384 4.313 0.071 18736 11 1 . 1 1 8 8 CYS HA H 8 4.304 4.304 4.645 -0.341 18736 12 1 . 1 1 8 8 CYS H H 8 7.639 7.639 8.151 -0.512 18736 13 1 . 1 1 9 9 ARG HA H 9 4.004 4.004 4.216 -0.212 18736 14 1 . 1 1 9 9 ARG H H 9 8.752 8.752 8.490 0.262 18736 15 1 . 1 1 10 10 ASN HA H 10 4.392 4.392 4.571 -0.179 18736 16 1 . 1 1 10 10 ASN H H 10 8.516 8.516 8.577 -0.061 18736 17 1 . 1 1 11 11 LYS HA H 11 4.246 4.246 4.217 0.029 18736 18 1 . 1 1 11 11 LYS H H 11 7.321 7.321 7.799 -0.478 18736 19 1 . 1 1 12 12 HIS HA H 12 5.189 5.189 4.984 0.205 18736 20 1 . 1 1 12 12 HIS H H 12 7.663 7.663 7.887 -0.224 18736 21 1 . 1 1 13 13 PRO HA H 13 4.451 4.451 4.654 -0.203 18736 22 1 . 1 1 14 14 ASP HA H 14 4.450 4.450 4.449 0.001 18736 23 1 . 1 1 14 14 ASP H H 14 8.806 8.806 8.292 0.514 18736 24 1 . 1 1 15 15 LEU HA H 15 4.373 4.373 4.597 -0.224 18736 25 1 . 1 1 15 15 LEU H H 15 7.636 7.636 7.850 -0.214 18736 stop_ save_