data_17956 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17956 _Entry.PDB_ID 2LJS 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 17956 _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 3 3 ALA HA H 3 4.313 4.313 4.373 -0.060 17956 2 1 1 . 1 1 3 3 ALA H H 3 8.169 8.169 8.462 -0.293 17956 3 1 1 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.710 0.130 17956 4 1 1 . 1 1 4 4 CYS H H 4 8.323 8.323 8.327 -0.004 17956 5 1 1 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.467 -0.139 17956 6 1 1 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.310 -0.144 17956 7 1 1 . 1 1 6 6 ARG H H 6 8.227 8.227 8.459 -0.232 17956 8 1 1 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.410 -0.137 17956 9 1 1 . 1 1 7 7 ILE H H 7 7.688 7.688 8.649 -0.961 17956 10 1 1 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.834 -0.418 17956 11 1 1 . 1 1 8 8 LEU H H 8 8.606 8.606 8.542 0.064 17956 12 1 1 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.350 0.141 17956 13 1 1 . 1 1 9 9 LYS H H 9 8.898 8.898 7.628 1.270 17956 14 1 1 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.075 0.158 17956 15 1 1 . 1 1 10 10 LYS H H 10 8.528 8.528 8.179 0.349 17956 16 1 1 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.872 -0.092 17956 17 1 1 . 1 1 11 11 CYS H H 11 8.329 8.329 8.211 0.118 17956 18 1 1 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.394 -0.047 17956 19 1 1 . 1 1 12 12 ARG H H 12 9.287 9.287 9.056 0.231 17956 20 1 1 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.335 0.291 17956 21 1 1 . 1 1 13 13 ARG H H 13 7.963 7.963 7.316 0.647 17956 22 1 1 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.412 -0.382 17956 23 1 1 . 1 1 14 14 ASP H H 14 9.243 9.243 8.822 0.421 17956 24 1 1 . 1 1 15 15 SER HA H 15 4.201 4.201 4.222 -0.021 17956 25 1 1 . 1 1 15 15 SER H H 15 8.090 8.090 8.278 -0.188 17956 26 1 1 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.648 -0.105 17956 27 1 1 . 1 1 16 16 ASP H H 16 7.620 7.620 7.659 -0.039 17956 28 1 1 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.712 0.264 17956 29 1 1 . 1 1 17 17 CYS H H 17 8.006 8.006 7.588 0.418 17956 30 1 1 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.365 0.124 17956 31 1 1 . 1 1 19 19 GLY H H 19 8.408 8.408 8.475 -0.067 17956 32 1 1 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.518 -0.199 17956 33 1 1 . 1 1 20 20 GLU H H 20 8.379 8.379 8.396 -0.017 17956 34 1 1 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.415 0.165 17956 35 1 1 . 1 1 21 21 CYS H H 21 8.130 8.130 7.633 0.497 17956 36 1 1 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.564 -0.262 17956 37 1 1 . 1 1 22 22 ILE H H 22 9.089 9.089 9.090 -0.001 17956 38 1 1 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.415 0.420 17956 39 1 1 . 1 1 23 23 CYS H H 23 8.681 8.681 9.176 -0.495 17956 40 1 1 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.257 -0.028 17956 41 1 1 . 1 1 24 24 LYS H H 24 8.097 8.097 8.780 -0.683 17956 42 1 1 . 1 1 25 25 GLY H H 25 8.754 8.754 8.801 -0.047 17956 43 1 1 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.630 -0.032 17956 44 1 1 . 1 1 26 26 ASN H H 26 7.741 7.741 7.898 -0.157 17956 45 1 1 . 1 1 27 27 GLY H H 27 8.334 8.334 8.505 -0.171 17956 46 1 1 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.280 -0.128 17956 47 1 1 . 1 1 28 28 TYR H H 28 7.196 7.196 7.724 -0.528 17956 48 1 1 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.028 0.238 17956 49 1 1 . 1 1 29 29 CYS H H 29 8.640 8.640 8.681 -0.041 17956 50 1 2 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.561 -0.248 17956 51 1 2 . 1 1 3 3 ALA H H 3 8.169 8.169 9.450 -1.281 17956 52 1 2 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.968 -0.128 17956 53 1 2 . 1 1 4 4 CYS H H 4 8.323 8.323 8.712 -0.389 17956 54 1 2 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.610 -0.282 17956 55 1 2 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.637 -0.471 17956 56 1 2 . 1 1 6 6 ARG H H 6 8.227 8.227 8.471 -0.244 17956 57 1 2 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.477 -0.204 17956 58 1 2 . 1 1 7 7 ILE H H 7 7.688 7.688 8.566 -0.878 17956 59 1 2 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.905 -0.489 17956 60 1 2 . 1 1 8 8 LEU H H 8 8.606 8.606 8.436 0.170 17956 61 1 2 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.275 0.216 17956 62 1 2 . 1 1 9 9 LYS H H 9 8.898 8.898 8.383 0.515 17956 63 1 2 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.320 -0.087 17956 64 1 2 . 1 1 10 10 LYS H H 10 8.528 8.528 8.105 0.423 17956 65 1 2 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.908 -0.128 17956 66 1 2 . 1 1 11 11 CYS H H 11 8.329 8.329 8.346 -0.017 17956 67 1 2 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.423 -0.076 17956 68 1 2 . 1 1 12 12 ARG H H 12 9.287 9.287 9.409 -0.122 17956 69 1 2 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.479 0.147 17956 70 1 2 . 1 1 13 13 ARG H H 13 7.963 7.963 7.155 0.808 17956 71 1 2 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.393 -0.363 17956 72 1 2 . 1 1 14 14 ASP H H 14 9.243 9.243 8.832 0.411 17956 73 1 2 . 1 1 15 15 SER HA H 15 4.201 4.201 4.226 -0.025 17956 74 1 2 . 1 1 15 15 SER H H 15 8.090 8.090 8.293 -0.203 17956 75 1 2 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.722 -0.179 17956 76 1 2 . 1 1 16 16 ASP H H 16 7.620 7.620 7.705 -0.085 17956 77 1 2 . 1 1 17 17 CYS HA H 17 4.976 4.976 5.072 -0.096 17956 78 1 2 . 1 1 17 17 CYS H H 17 8.006 8.006 7.595 0.411 17956 79 1 2 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.352 0.137 17956 80 1 2 . 1 1 19 19 GLY H H 19 8.408 8.408 8.454 -0.046 17956 81 1 2 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.531 -0.212 17956 82 1 2 . 1 1 20 20 GLU H H 20 8.379 8.379 8.141 0.238 17956 83 1 2 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.503 0.077 17956 84 1 2 . 1 1 21 21 CYS H H 21 8.130 8.130 7.708 0.422 17956 85 1 2 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.633 -0.331 17956 86 1 2 . 1 1 22 22 ILE H H 22 9.089 9.089 8.935 0.154 17956 87 1 2 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.710 0.125 17956 88 1 2 . 1 1 23 23 CYS H H 23 8.681 8.681 8.705 -0.024 17956 89 1 2 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.339 -0.110 17956 90 1 2 . 1 1 24 24 LYS H H 24 8.097 8.097 8.702 -0.605 17956 91 1 2 . 1 1 25 25 GLY H H 25 8.754 8.754 8.785 -0.031 17956 92 1 2 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.679 -0.081 17956 93 1 2 . 1 1 26 26 ASN H H 26 7.741 7.741 7.987 -0.246 17956 94 1 2 . 1 1 27 27 GLY H H 27 8.334 8.334 8.235 0.099 17956 95 1 2 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.326 -0.174 17956 96 1 2 . 1 1 28 28 TYR H H 28 7.196 7.196 7.545 -0.349 17956 97 1 2 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.985 0.281 17956 98 1 2 . 1 1 29 29 CYS H H 29 8.640 8.640 8.441 0.200 17956 99 1 3 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.466 -0.153 17956 100 1 3 . 1 1 3 3 ALA H H 3 8.169 8.169 8.387 -0.218 17956 101 1 3 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.809 0.031 17956 102 1 3 . 1 1 4 4 CYS H H 4 8.323 8.323 8.438 -0.115 17956 103 1 3 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.510 -0.182 17956 104 1 3 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.215 -0.049 17956 105 1 3 . 1 1 6 6 ARG H H 6 8.227 8.227 8.529 -0.302 17956 106 1 3 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.421 -0.148 17956 107 1 3 . 1 1 7 7 ILE H H 7 7.688 7.688 8.624 -0.936 17956 108 1 3 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.964 -0.548 17956 109 1 3 . 1 1 8 8 LEU H H 8 8.606 8.606 8.441 0.165 17956 110 1 3 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.304 0.187 17956 111 1 3 . 1 1 9 9 LYS H H 9 8.898 8.898 8.107 0.791 17956 112 1 3 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.146 0.087 17956 113 1 3 . 1 1 10 10 LYS H H 10 8.528 8.528 8.130 0.398 17956 114 1 3 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.690 0.090 17956 115 1 3 . 1 1 11 11 CYS H H 11 8.329 8.329 8.156 0.173 17956 116 1 3 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.445 -0.098 17956 117 1 3 . 1 1 12 12 ARG H H 12 9.287 9.287 8.874 0.413 17956 118 1 3 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.460 0.166 17956 119 1 3 . 1 1 13 13 ARG H H 13 7.963 7.963 7.374 0.589 17956 120 1 3 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.415 -0.385 17956 121 1 3 . 1 1 14 14 ASP H H 14 9.243 9.243 8.803 0.440 17956 122 1 3 . 1 1 15 15 SER HA H 15 4.201 4.201 4.198 0.003 17956 123 1 3 . 1 1 15 15 SER H H 15 8.090 8.090 8.300 -0.210 17956 124 1 3 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.669 -0.126 17956 125 1 3 . 1 1 16 16 ASP H H 16 7.620 7.620 7.776 -0.156 17956 126 1 3 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.770 0.206 17956 127 1 3 . 1 1 17 17 CYS H H 17 8.006 8.006 7.519 0.487 17956 128 1 3 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.441 0.048 17956 129 1 3 . 1 1 19 19 GLY H H 19 8.408 8.408 8.521 -0.113 17956 130 1 3 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.448 -0.129 17956 131 1 3 . 1 1 20 20 GLU H H 20 8.379 8.379 8.507 -0.128 17956 132 1 3 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.492 0.088 17956 133 1 3 . 1 1 21 21 CYS H H 21 8.130 8.130 7.677 0.453 17956 134 1 3 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.791 -0.489 17956 135 1 3 . 1 1 22 22 ILE H H 22 9.089 9.089 9.134 -0.045 17956 136 1 3 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.423 0.412 17956 137 1 3 . 1 1 23 23 CYS H H 23 8.681 8.681 9.337 -0.656 17956 138 1 3 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.314 -0.085 17956 139 1 3 . 1 1 24 24 LYS H H 24 8.097 8.097 8.371 -0.274 17956 140 1 3 . 1 1 25 25 GLY H H 25 8.754 8.754 8.791 -0.037 17956 141 1 3 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.529 0.069 17956 142 1 3 . 1 1 26 26 ASN H H 26 7.741 7.741 7.950 -0.209 17956 143 1 3 . 1 1 27 27 GLY H H 27 8.334 8.334 8.436 -0.102 17956 144 1 3 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.444 -0.292 17956 145 1 3 . 1 1 28 28 TYR H H 28 7.196 7.196 7.555 -0.359 17956 146 1 3 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.992 0.274 17956 147 1 3 . 1 1 29 29 CYS H H 29 8.640 8.640 8.481 0.159 17956 148 1 4 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.338 -0.025 17956 149 1 4 . 1 1 3 3 ALA H H 3 8.169 8.169 8.433 -0.264 17956 150 1 4 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.729 0.111 17956 151 1 4 . 1 1 4 4 CYS H H 4 8.323 8.323 8.323 -0.000 17956 152 1 4 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.527 -0.199 17956 153 1 4 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.338 -0.172 17956 154 1 4 . 1 1 6 6 ARG H H 6 8.227 8.227 8.642 -0.415 17956 155 1 4 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.267 0.006 17956 156 1 4 . 1 1 7 7 ILE H H 7 7.688 7.688 8.181 -0.493 17956 157 1 4 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.719 -0.303 17956 158 1 4 . 1 1 8 8 LEU H H 8 8.606 8.606 8.387 0.219 17956 159 1 4 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.259 0.232 17956 160 1 4 . 1 1 9 9 LYS H H 9 8.898 8.898 8.362 0.536 17956 161 1 4 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.186 0.047 17956 162 1 4 . 1 1 10 10 LYS H H 10 8.528 8.528 8.097 0.431 17956 163 1 4 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.067 -0.287 17956 164 1 4 . 1 1 11 11 CYS H H 11 8.329 8.329 8.169 0.160 17956 165 1 4 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.362 -0.015 17956 166 1 4 . 1 1 12 12 ARG H H 12 9.287 9.287 9.537 -0.250 17956 167 1 4 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.453 0.173 17956 168 1 4 . 1 1 13 13 ARG H H 13 7.963 7.963 7.179 0.784 17956 169 1 4 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.444 -0.414 17956 170 1 4 . 1 1 14 14 ASP H H 14 9.243 9.243 8.802 0.441 17956 171 1 4 . 1 1 15 15 SER HA H 15 4.201 4.201 4.223 -0.022 17956 172 1 4 . 1 1 15 15 SER H H 15 8.090 8.090 8.300 -0.210 17956 173 1 4 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.653 -0.110 17956 174 1 4 . 1 1 16 16 ASP H H 16 7.620 7.620 7.605 0.015 17956 175 1 4 . 1 1 17 17 CYS HA H 17 4.976 4.976 5.030 -0.054 17956 176 1 4 . 1 1 17 17 CYS H H 17 8.006 8.006 7.596 0.410 17956 177 1 4 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.385 0.104 17956 178 1 4 . 1 1 19 19 GLY H H 19 8.408 8.408 8.488 -0.080 17956 179 1 4 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.490 -0.171 17956 180 1 4 . 1 1 20 20 GLU H H 20 8.379 8.379 8.448 -0.069 17956 181 1 4 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.269 0.311 17956 182 1 4 . 1 1 21 21 CYS H H 21 8.130 8.130 7.658 0.472 17956 183 1 4 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.692 -0.391 17956 184 1 4 . 1 1 22 22 ILE H H 22 9.089 9.089 8.625 0.464 17956 185 1 4 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.616 0.219 17956 186 1 4 . 1 1 23 23 CYS H H 23 8.681 8.681 8.769 -0.088 17956 187 1 4 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.420 -0.191 17956 188 1 4 . 1 1 24 24 LYS H H 24 8.097 8.097 8.396 -0.299 17956 189 1 4 . 1 1 25 25 GLY H H 25 8.754 8.754 8.750 0.004 17956 190 1 4 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.513 0.085 17956 191 1 4 . 1 1 26 26 ASN H H 26 7.741 7.741 7.901 -0.160 17956 192 1 4 . 1 1 27 27 GLY H H 27 8.334 8.334 8.459 -0.125 17956 193 1 4 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.265 -0.113 17956 194 1 4 . 1 1 28 28 TYR H H 28 7.196 7.196 7.588 -0.392 17956 195 1 4 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.759 0.507 17956 196 1 4 . 1 1 29 29 CYS H H 29 8.640 8.640 8.507 0.133 17956 197 1 5 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.527 -0.214 17956 198 1 5 . 1 1 3 3 ALA H H 3 8.169 8.169 9.370 -1.201 17956 199 1 5 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.827 0.013 17956 200 1 5 . 1 1 4 4 CYS H H 4 8.323 8.323 8.521 -0.198 17956 201 1 5 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.556 -0.228 17956 202 1 5 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.221 -0.055 17956 203 1 5 . 1 1 6 6 ARG H H 6 8.227 8.227 8.412 -0.185 17956 204 1 5 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.406 -0.133 17956 205 1 5 . 1 1 7 7 ILE H H 7 7.688 7.688 8.404 -0.716 17956 206 1 5 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.918 -0.502 17956 207 1 5 . 1 1 8 8 LEU H H 8 8.606 8.606 8.430 0.176 17956 208 1 5 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.256 0.235 17956 209 1 5 . 1 1 9 9 LYS H H 9 8.898 8.898 8.034 0.864 17956 210 1 5 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.232 0.001 17956 211 1 5 . 1 1 10 10 LYS H H 10 8.528 8.528 8.126 0.402 17956 212 1 5 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.961 -0.181 17956 213 1 5 . 1 1 11 11 CYS H H 11 8.329 8.329 8.247 0.082 17956 214 1 5 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.410 -0.063 17956 215 1 5 . 1 1 12 12 ARG H H 12 9.287 9.287 8.910 0.377 17956 216 1 5 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.407 0.219 17956 217 1 5 . 1 1 13 13 ARG H H 13 7.963 7.963 7.376 0.587 17956 218 1 5 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.398 -0.368 17956 219 1 5 . 1 1 14 14 ASP H H 14 9.243 9.243 8.821 0.422 17956 220 1 5 . 1 1 15 15 SER HA H 15 4.201 4.201 4.218 -0.017 17956 221 1 5 . 1 1 15 15 SER H H 15 8.090 8.090 8.371 -0.281 17956 222 1 5 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.689 -0.146 17956 223 1 5 . 1 1 16 16 ASP H H 16 7.620 7.620 7.712 -0.092 17956 224 1 5 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.694 0.282 17956 225 1 5 . 1 1 17 17 CYS H H 17 8.006 8.006 7.603 0.403 17956 226 1 5 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.346 0.143 17956 227 1 5 . 1 1 19 19 GLY H H 19 8.408 8.408 8.460 -0.052 17956 228 1 5 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.537 -0.218 17956 229 1 5 . 1 1 20 20 GLU H H 20 8.379 8.379 8.184 0.195 17956 230 1 5 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.453 0.127 17956 231 1 5 . 1 1 21 21 CYS H H 21 8.130 8.130 7.704 0.426 17956 232 1 5 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.844 -0.542 17956 233 1 5 . 1 1 22 22 ILE H H 22 9.089 9.089 9.023 0.066 17956 234 1 5 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.616 0.219 17956 235 1 5 . 1 1 23 23 CYS H H 23 8.681 8.681 9.179 -0.498 17956 236 1 5 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.474 -0.245 17956 237 1 5 . 1 1 24 24 LYS H H 24 8.097 8.097 8.426 -0.329 17956 238 1 5 . 1 1 25 25 GLY H H 25 8.754 8.754 8.911 -0.157 17956 239 1 5 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.649 -0.051 17956 240 1 5 . 1 1 26 26 ASN H H 26 7.741 7.741 8.016 -0.275 17956 241 1 5 . 1 1 27 27 GLY H H 27 8.334 8.334 8.250 0.084 17956 242 1 5 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.245 -0.093 17956 243 1 5 . 1 1 28 28 TYR H H 28 7.196 7.196 7.703 -0.507 17956 244 1 5 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.066 0.200 17956 245 1 5 . 1 1 29 29 CYS H H 29 8.640 8.640 8.515 0.125 17956 246 1 6 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.693 -0.380 17956 247 1 6 . 1 1 3 3 ALA H H 3 8.169 8.169 9.249 -1.080 17956 248 1 6 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.896 -0.056 17956 249 1 6 . 1 1 4 4 CYS H H 4 8.323 8.323 8.650 -0.327 17956 250 1 6 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.576 -0.248 17956 251 1 6 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.471 -0.305 17956 252 1 6 . 1 1 6 6 ARG H H 6 8.227 8.227 8.357 -0.130 17956 253 1 6 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.422 -0.149 17956 254 1 6 . 1 1 7 7 ILE H H 7 7.688 7.688 8.620 -0.932 17956 255 1 6 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.927 -0.511 17956 256 1 6 . 1 1 8 8 LEU H H 8 8.606 8.606 8.419 0.187 17956 257 1 6 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.343 0.148 17956 258 1 6 . 1 1 9 9 LYS H H 9 8.898 8.898 8.210 0.688 17956 259 1 6 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.125 0.108 17956 260 1 6 . 1 1 10 10 LYS H H 10 8.528 8.528 8.301 0.227 17956 261 1 6 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.542 -0.762 17956 262 1 6 . 1 1 11 11 CYS H H 11 8.329 8.329 8.272 0.057 17956 263 1 6 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.448 -0.101 17956 264 1 6 . 1 1 12 12 ARG H H 12 9.287 9.287 8.812 0.475 17956 265 1 6 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.355 0.271 17956 266 1 6 . 1 1 13 13 ARG H H 13 7.963 7.963 7.457 0.506 17956 267 1 6 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.392 -0.362 17956 268 1 6 . 1 1 14 14 ASP H H 14 9.243 9.243 8.851 0.392 17956 269 1 6 . 1 1 15 15 SER HA H 15 4.201 4.201 4.216 -0.015 17956 270 1 6 . 1 1 15 15 SER H H 15 8.090 8.090 8.382 -0.292 17956 271 1 6 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.658 -0.115 17956 272 1 6 . 1 1 16 16 ASP H H 16 7.620 7.620 7.745 -0.125 17956 273 1 6 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.890 0.086 17956 274 1 6 . 1 1 17 17 CYS H H 17 8.006 8.006 7.623 0.383 17956 275 1 6 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.378 0.111 17956 276 1 6 . 1 1 19 19 GLY H H 19 8.408 8.408 8.472 -0.064 17956 277 1 6 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.527 -0.208 17956 278 1 6 . 1 1 20 20 GLU H H 20 8.379 8.379 8.262 0.117 17956 279 1 6 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.431 0.149 17956 280 1 6 . 1 1 21 21 CYS H H 21 8.130 8.130 7.731 0.399 17956 281 1 6 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.655 -0.353 17956 282 1 6 . 1 1 22 22 ILE H H 22 9.089 9.089 9.066 0.023 17956 283 1 6 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.371 0.464 17956 284 1 6 . 1 1 23 23 CYS H H 23 8.681 8.681 9.256 -0.575 17956 285 1 6 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.333 -0.104 17956 286 1 6 . 1 1 24 24 LYS H H 24 8.097 8.097 8.326 -0.229 17956 287 1 6 . 1 1 25 25 GLY H H 25 8.754 8.754 8.803 -0.049 17956 288 1 6 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.601 -0.003 17956 289 1 6 . 1 1 26 26 ASN H H 26 7.741 7.741 8.094 -0.353 17956 290 1 6 . 1 1 27 27 GLY H H 27 8.334 8.334 8.410 -0.076 17956 291 1 6 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.349 -0.197 17956 292 1 6 . 1 1 28 28 TYR H H 28 7.196 7.196 7.522 -0.326 17956 293 1 6 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.001 0.265 17956 294 1 6 . 1 1 29 29 CYS H H 29 8.640 8.640 8.441 0.199 17956 295 1 7 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.472 -0.159 17956 296 1 7 . 1 1 3 3 ALA H H 3 8.169 8.169 8.427 -0.258 17956 297 1 7 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.690 0.150 17956 298 1 7 . 1 1 4 4 CYS H H 4 8.323 8.323 8.398 -0.075 17956 299 1 7 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.512 -0.184 17956 300 1 7 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.285 -0.119 17956 301 1 7 . 1 1 6 6 ARG H H 6 8.227 8.227 8.440 -0.213 17956 302 1 7 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.457 -0.184 17956 303 1 7 . 1 1 7 7 ILE H H 7 7.688 7.688 8.597 -0.909 17956 304 1 7 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.870 -0.454 17956 305 1 7 . 1 1 8 8 LEU H H 8 8.606 8.606 8.623 -0.017 17956 306 1 7 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.377 0.114 17956 307 1 7 . 1 1 9 9 LYS H H 9 8.898 8.898 7.575 1.323 17956 308 1 7 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.989 0.244 17956 309 1 7 . 1 1 10 10 LYS H H 10 8.528 8.528 8.209 0.319 17956 310 1 7 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.129 -0.349 17956 311 1 7 . 1 1 11 11 CYS H H 11 8.329 8.329 8.435 -0.106 17956 312 1 7 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.431 -0.084 17956 313 1 7 . 1 1 12 12 ARG H H 12 9.287 9.287 9.404 -0.117 17956 314 1 7 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.484 0.142 17956 315 1 7 . 1 1 13 13 ARG H H 13 7.963 7.963 7.175 0.788 17956 316 1 7 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.399 -0.369 17956 317 1 7 . 1 1 14 14 ASP H H 14 9.243 9.243 8.819 0.424 17956 318 1 7 . 1 1 15 15 SER HA H 15 4.201 4.201 4.200 0.001 17956 319 1 7 . 1 1 15 15 SER H H 15 8.090 8.090 8.356 -0.266 17956 320 1 7 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.642 -0.099 17956 321 1 7 . 1 1 16 16 ASP H H 16 7.620 7.620 7.763 -0.143 17956 322 1 7 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.807 0.169 17956 323 1 7 . 1 1 17 17 CYS H H 17 8.006 8.006 7.548 0.458 17956 324 1 7 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.462 0.027 17956 325 1 7 . 1 1 19 19 GLY H H 19 8.408 8.408 8.599 -0.191 17956 326 1 7 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.478 -0.159 17956 327 1 7 . 1 1 20 20 GLU H H 20 8.379 8.379 8.462 -0.083 17956 328 1 7 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.467 0.113 17956 329 1 7 . 1 1 21 21 CYS H H 21 8.130 8.130 7.669 0.461 17956 330 1 7 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.778 -0.476 17956 331 1 7 . 1 1 22 22 ILE H H 22 9.089 9.089 9.057 0.032 17956 332 1 7 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.585 0.250 17956 333 1 7 . 1 1 23 23 CYS H H 23 8.681 8.681 9.313 -0.632 17956 334 1 7 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.441 -0.212 17956 335 1 7 . 1 1 24 24 LYS H H 24 8.097 8.097 8.329 -0.232 17956 336 1 7 . 1 1 25 25 GLY H H 25 8.754 8.754 8.784 -0.030 17956 337 1 7 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.511 0.087 17956 338 1 7 . 1 1 26 26 ASN H H 26 7.741 7.741 7.967 -0.226 17956 339 1 7 . 1 1 27 27 GLY H H 27 8.334 8.334 8.459 -0.125 17956 340 1 7 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.494 -0.342 17956 341 1 7 . 1 1 28 28 TYR H H 28 7.196 7.196 7.569 -0.373 17956 342 1 7 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.039 0.227 17956 343 1 7 . 1 1 29 29 CYS H H 29 8.640 8.640 8.726 -0.086 17956 344 1 8 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.479 -0.166 17956 345 1 8 . 1 1 3 3 ALA H H 3 8.169 8.169 8.593 -0.424 17956 346 1 8 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.849 -0.009 17956 347 1 8 . 1 1 4 4 CYS H H 4 8.323 8.323 8.482 -0.159 17956 348 1 8 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.490 -0.162 17956 349 1 8 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.245 -0.079 17956 350 1 8 . 1 1 6 6 ARG H H 6 8.227 8.227 8.460 -0.233 17956 351 1 8 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.420 -0.147 17956 352 1 8 . 1 1 7 7 ILE H H 7 7.688 7.688 8.193 -0.505 17956 353 1 8 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.855 -0.439 17956 354 1 8 . 1 1 8 8 LEU H H 8 8.606 8.606 8.462 0.144 17956 355 1 8 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.302 0.189 17956 356 1 8 . 1 1 9 9 LYS H H 9 8.898 8.898 8.484 0.414 17956 357 1 8 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.896 0.337 17956 358 1 8 . 1 1 10 10 LYS H H 10 8.528 8.528 8.249 0.279 17956 359 1 8 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.379 -0.599 17956 360 1 8 . 1 1 11 11 CYS H H 11 8.329 8.329 8.170 0.159 17956 361 1 8 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.473 -0.126 17956 362 1 8 . 1 1 12 12 ARG H H 12 9.287 9.287 8.483 0.804 17956 363 1 8 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.407 0.219 17956 364 1 8 . 1 1 13 13 ARG H H 13 7.963 7.963 7.240 0.723 17956 365 1 8 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.399 -0.369 17956 366 1 8 . 1 1 14 14 ASP H H 14 9.243 9.243 8.853 0.390 17956 367 1 8 . 1 1 15 15 SER HA H 15 4.201 4.201 4.214 -0.013 17956 368 1 8 . 1 1 15 15 SER H H 15 8.090 8.090 8.347 -0.257 17956 369 1 8 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.659 -0.116 17956 370 1 8 . 1 1 16 16 ASP H H 16 7.620 7.620 7.754 -0.134 17956 371 1 8 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.899 0.076 17956 372 1 8 . 1 1 17 17 CYS H H 17 8.006 8.006 7.529 0.477 17956 373 1 8 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.347 0.142 17956 374 1 8 . 1 1 19 19 GLY H H 19 8.408 8.408 8.549 -0.141 17956 375 1 8 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.586 -0.267 17956 376 1 8 . 1 1 20 20 GLU H H 20 8.379 8.379 8.253 0.126 17956 377 1 8 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.433 0.147 17956 378 1 8 . 1 1 21 21 CYS H H 21 8.130 8.130 7.707 0.423 17956 379 1 8 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.804 -0.502 17956 380 1 8 . 1 1 22 22 ILE H H 22 9.089 9.089 8.968 0.121 17956 381 1 8 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.606 0.229 17956 382 1 8 . 1 1 23 23 CYS H H 23 8.681 8.681 9.173 -0.492 17956 383 1 8 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.543 -0.314 17956 384 1 8 . 1 1 24 24 LYS H H 24 8.097 8.097 8.263 -0.166 17956 385 1 8 . 1 1 25 25 GLY H H 25 8.754 8.754 8.915 -0.161 17956 386 1 8 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.554 0.044 17956 387 1 8 . 1 1 26 26 ASN H H 26 7.741 7.741 7.775 -0.034 17956 388 1 8 . 1 1 27 27 GLY H H 27 8.334 8.334 8.493 -0.159 17956 389 1 8 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.442 -0.290 17956 390 1 8 . 1 1 28 28 TYR H H 28 7.196 7.196 7.519 -0.323 17956 391 1 8 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.117 0.149 17956 392 1 8 . 1 1 29 29 CYS H H 29 8.640 8.640 8.358 0.282 17956 393 1 9 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.405 -0.092 17956 394 1 9 . 1 1 3 3 ALA H H 3 8.169 8.169 8.519 -0.350 17956 395 1 9 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.780 0.060 17956 396 1 9 . 1 1 4 4 CYS H H 4 8.323 8.323 8.436 -0.113 17956 397 1 9 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.550 -0.222 17956 398 1 9 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.379 -0.213 17956 399 1 9 . 1 1 6 6 ARG H H 6 8.227 8.227 8.621 -0.394 17956 400 1 9 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.317 -0.044 17956 401 1 9 . 1 1 7 7 ILE H H 7 7.688 7.688 8.232 -0.544 17956 402 1 9 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.874 -0.458 17956 403 1 9 . 1 1 8 8 LEU H H 8 8.606 8.606 8.457 0.149 17956 404 1 9 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.246 0.245 17956 405 1 9 . 1 1 9 9 LYS H H 9 8.898 8.898 8.388 0.510 17956 406 1 9 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.181 0.052 17956 407 1 9 . 1 1 10 10 LYS H H 10 8.528 8.528 7.979 0.549 17956 408 1 9 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.084 -0.304 17956 409 1 9 . 1 1 11 11 CYS H H 11 8.329 8.329 8.198 0.131 17956 410 1 9 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.379 -0.032 17956 411 1 9 . 1 1 12 12 ARG H H 12 9.287 9.287 9.411 -0.124 17956 412 1 9 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.411 0.215 17956 413 1 9 . 1 1 13 13 ARG H H 13 7.963 7.963 7.348 0.615 17956 414 1 9 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.398 -0.368 17956 415 1 9 . 1 1 14 14 ASP H H 14 9.243 9.243 8.735 0.508 17956 416 1 9 . 1 1 15 15 SER HA H 15 4.201 4.201 4.203 -0.002 17956 417 1 9 . 1 1 15 15 SER H H 15 8.090 8.090 8.355 -0.265 17956 418 1 9 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.640 -0.097 17956 419 1 9 . 1 1 16 16 ASP H H 16 7.620 7.620 7.752 -0.132 17956 420 1 9 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.817 0.159 17956 421 1 9 . 1 1 17 17 CYS H H 17 8.006 8.006 7.525 0.481 17956 422 1 9 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.362 0.127 17956 423 1 9 . 1 1 19 19 GLY H H 19 8.408 8.408 8.512 -0.104 17956 424 1 9 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.471 -0.152 17956 425 1 9 . 1 1 20 20 GLU H H 20 8.379 8.379 8.353 0.026 17956 426 1 9 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.498 0.082 17956 427 1 9 . 1 1 21 21 CYS H H 21 8.130 8.130 7.769 0.361 17956 428 1 9 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.654 -0.352 17956 429 1 9 . 1 1 22 22 ILE H H 22 9.089 9.089 9.132 -0.043 17956 430 1 9 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.473 0.362 17956 431 1 9 . 1 1 23 23 CYS H H 23 8.681 8.681 9.379 -0.698 17956 432 1 9 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.567 -0.338 17956 433 1 9 . 1 1 24 24 LYS H H 24 8.097 8.097 8.244 -0.147 17956 434 1 9 . 1 1 25 25 GLY H H 25 8.754 8.754 8.952 -0.198 17956 435 1 9 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.547 0.051 17956 436 1 9 . 1 1 26 26 ASN H H 26 7.741 7.741 7.771 -0.030 17956 437 1 9 . 1 1 27 27 GLY H H 27 8.334 8.334 8.470 -0.136 17956 438 1 9 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.302 -0.150 17956 439 1 9 . 1 1 28 28 TYR H H 28 7.196 7.196 7.562 -0.366 17956 440 1 9 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.002 0.264 17956 441 1 9 . 1 1 29 29 CYS H H 29 8.640 8.640 8.462 0.178 17956 442 1 10 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.521 -0.208 17956 443 1 10 . 1 1 3 3 ALA H H 3 8.169 8.169 9.003 -0.834 17956 444 1 10 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.862 -0.022 17956 445 1 10 . 1 1 4 4 CYS H H 4 8.323 8.323 8.656 -0.333 17956 446 1 10 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.721 -0.393 17956 447 1 10 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.398 -0.232 17956 448 1 10 . 1 1 6 6 ARG H H 6 8.227 8.227 8.594 -0.367 17956 449 1 10 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.261 0.012 17956 450 1 10 . 1 1 7 7 ILE H H 7 7.688 7.688 7.959 -0.271 17956 451 1 10 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.755 -0.339 17956 452 1 10 . 1 1 8 8 LEU H H 8 8.606 8.606 8.366 0.240 17956 453 1 10 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.233 0.258 17956 454 1 10 . 1 1 9 9 LYS H H 9 8.898 8.898 8.343 0.555 17956 455 1 10 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.228 0.005 17956 456 1 10 . 1 1 10 10 LYS H H 10 8.528 8.528 8.026 0.502 17956 457 1 10 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.523 0.257 17956 458 1 10 . 1 1 11 11 CYS H H 11 8.329 8.329 8.216 0.113 17956 459 1 10 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.431 -0.084 17956 460 1 10 . 1 1 12 12 ARG H H 12 9.287 9.287 8.788 0.499 17956 461 1 10 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.362 0.264 17956 462 1 10 . 1 1 13 13 ARG H H 13 7.963 7.963 7.400 0.563 17956 463 1 10 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.407 -0.377 17956 464 1 10 . 1 1 14 14 ASP H H 14 9.243 9.243 8.830 0.413 17956 465 1 10 . 1 1 15 15 SER HA H 15 4.201 4.201 4.226 -0.025 17956 466 1 10 . 1 1 15 15 SER H H 15 8.090 8.090 8.289 -0.199 17956 467 1 10 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.643 -0.100 17956 468 1 10 . 1 1 16 16 ASP H H 16 7.620 7.620 7.684 -0.064 17956 469 1 10 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.817 0.159 17956 470 1 10 . 1 1 17 17 CYS H H 17 8.006 8.006 7.621 0.385 17956 471 1 10 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.354 0.135 17956 472 1 10 . 1 1 19 19 GLY H H 19 8.408 8.408 8.455 -0.047 17956 473 1 10 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.520 -0.201 17956 474 1 10 . 1 1 20 20 GLU H H 20 8.379 8.379 8.188 0.191 17956 475 1 10 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.401 0.179 17956 476 1 10 . 1 1 21 21 CYS H H 21 8.130 8.130 7.671 0.459 17956 477 1 10 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.565 -0.263 17956 478 1 10 . 1 1 22 22 ILE H H 22 9.089 9.089 9.076 0.013 17956 479 1 10 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.596 0.239 17956 480 1 10 . 1 1 23 23 CYS H H 23 8.681 8.681 9.132 -0.451 17956 481 1 10 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.526 -0.297 17956 482 1 10 . 1 1 24 24 LYS H H 24 8.097 8.097 8.533 -0.436 17956 483 1 10 . 1 1 25 25 GLY H H 25 8.754 8.754 8.909 -0.155 17956 484 1 10 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.660 -0.062 17956 485 1 10 . 1 1 26 26 ASN H H 26 7.741 7.741 8.015 -0.274 17956 486 1 10 . 1 1 27 27 GLY H H 27 8.334 8.334 8.234 0.100 17956 487 1 10 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.256 -0.104 17956 488 1 10 . 1 1 28 28 TYR H H 28 7.196 7.196 7.724 -0.528 17956 489 1 10 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.943 0.323 17956 490 1 10 . 1 1 29 29 CYS H H 29 8.640 8.640 8.476 0.164 17956 491 1 11 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.620 -0.307 17956 492 1 11 . 1 1 3 3 ALA H H 3 8.169 8.169 9.424 -1.255 17956 493 1 11 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.838 0.002 17956 494 1 11 . 1 1 4 4 CYS H H 4 8.323 8.323 8.578 -0.255 17956 495 1 11 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.585 -0.257 17956 496 1 11 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.313 -0.147 17956 497 1 11 . 1 1 6 6 ARG H H 6 8.227 8.227 8.557 -0.330 17956 498 1 11 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.218 0.055 17956 499 1 11 . 1 1 7 7 ILE H H 7 7.688 7.688 8.146 -0.458 17956 500 1 11 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.854 -0.438 17956 501 1 11 . 1 1 8 8 LEU H H 8 8.606 8.606 8.313 0.293 17956 502 1 11 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.349 0.142 17956 503 1 11 . 1 1 9 9 LYS H H 9 8.898 8.898 8.172 0.726 17956 504 1 11 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.944 0.289 17956 505 1 11 . 1 1 10 10 LYS H H 10 8.528 8.528 8.201 0.327 17956 506 1 11 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.647 0.133 17956 507 1 11 . 1 1 11 11 CYS H H 11 8.329 8.329 8.211 0.118 17956 508 1 11 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.431 -0.084 17956 509 1 11 . 1 1 12 12 ARG H H 12 9.287 9.287 8.482 0.805 17956 510 1 11 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.387 0.239 17956 511 1 11 . 1 1 13 13 ARG H H 13 7.963 7.963 7.494 0.469 17956 512 1 11 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.411 -0.381 17956 513 1 11 . 1 1 14 14 ASP H H 14 9.243 9.243 8.853 0.390 17956 514 1 11 . 1 1 15 15 SER HA H 15 4.201 4.201 4.213 -0.012 17956 515 1 11 . 1 1 15 15 SER H H 15 8.090 8.090 8.352 -0.262 17956 516 1 11 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.690 -0.147 17956 517 1 11 . 1 1 16 16 ASP H H 16 7.620 7.620 7.768 -0.148 17956 518 1 11 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.783 0.193 17956 519 1 11 . 1 1 17 17 CYS H H 17 8.006 8.006 7.571 0.435 17956 520 1 11 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.461 0.028 17956 521 1 11 . 1 1 19 19 GLY H H 19 8.408 8.408 8.549 -0.141 17956 522 1 11 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.495 -0.176 17956 523 1 11 . 1 1 20 20 GLU H H 20 8.379 8.379 8.261 0.118 17956 524 1 11 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.438 0.142 17956 525 1 11 . 1 1 21 21 CYS H H 21 8.130 8.130 7.653 0.477 17956 526 1 11 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.558 -0.256 17956 527 1 11 . 1 1 22 22 ILE H H 22 9.089 9.089 9.020 0.069 17956 528 1 11 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.391 0.444 17956 529 1 11 . 1 1 23 23 CYS H H 23 8.681 8.681 9.188 -0.507 17956 530 1 11 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.562 -0.333 17956 531 1 11 . 1 1 24 24 LYS H H 24 8.097 8.097 8.326 -0.229 17956 532 1 11 . 1 1 25 25 GLY H H 25 8.754 8.754 8.975 -0.221 17956 533 1 11 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.600 -0.002 17956 534 1 11 . 1 1 26 26 ASN H H 26 7.741 7.741 8.061 -0.320 17956 535 1 11 . 1 1 27 27 GLY H H 27 8.334 8.334 8.465 -0.131 17956 536 1 11 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.326 -0.174 17956 537 1 11 . 1 1 28 28 TYR H H 28 7.196 7.196 7.538 -0.342 17956 538 1 11 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.920 0.346 17956 539 1 11 . 1 1 29 29 CYS H H 29 8.640 8.640 8.456 0.184 17956 540 1 12 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.694 -0.381 17956 541 1 12 . 1 1 3 3 ALA H H 3 8.169 8.169 9.209 -1.040 17956 542 1 12 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.885 -0.045 17956 543 1 12 . 1 1 4 4 CYS H H 4 8.323 8.323 8.601 -0.278 17956 544 1 12 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.562 -0.234 17956 545 1 12 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.472 -0.306 17956 546 1 12 . 1 1 6 6 ARG H H 6 8.227 8.227 8.347 -0.120 17956 547 1 12 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.442 -0.169 17956 548 1 12 . 1 1 7 7 ILE H H 7 7.688 7.688 8.530 -0.842 17956 549 1 12 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.956 -0.540 17956 550 1 12 . 1 1 8 8 LEU H H 8 8.606 8.606 8.409 0.197 17956 551 1 12 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.352 0.139 17956 552 1 12 . 1 1 9 9 LYS H H 9 8.898 8.898 8.197 0.701 17956 553 1 12 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.874 0.359 17956 554 1 12 . 1 1 10 10 LYS H H 10 8.528 8.528 8.179 0.349 17956 555 1 12 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.540 0.240 17956 556 1 12 . 1 1 11 11 CYS H H 11 8.329 8.329 8.153 0.176 17956 557 1 12 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.420 -0.073 17956 558 1 12 . 1 1 12 12 ARG H H 12 9.287 9.287 8.730 0.557 17956 559 1 12 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.337 0.289 17956 560 1 12 . 1 1 13 13 ARG H H 13 7.963 7.963 7.393 0.570 17956 561 1 12 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.373 -0.343 17956 562 1 12 . 1 1 14 14 ASP H H 14 9.243 9.243 8.856 0.387 17956 563 1 12 . 1 1 15 15 SER HA H 15 4.201 4.201 4.213 -0.012 17956 564 1 12 . 1 1 15 15 SER H H 15 8.090 8.090 8.359 -0.269 17956 565 1 12 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.673 -0.130 17956 566 1 12 . 1 1 16 16 ASP H H 16 7.620 7.620 7.762 -0.142 17956 567 1 12 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.812 0.164 17956 568 1 12 . 1 1 17 17 CYS H H 17 8.006 8.006 7.573 0.433 17956 569 1 12 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.449 0.040 17956 570 1 12 . 1 1 19 19 GLY H H 19 8.408 8.408 8.588 -0.180 17956 571 1 12 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.494 -0.175 17956 572 1 12 . 1 1 20 20 GLU H H 20 8.379 8.379 8.360 0.019 17956 573 1 12 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.486 0.094 17956 574 1 12 . 1 1 21 21 CYS H H 21 8.130 8.130 7.632 0.498 17956 575 1 12 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.677 -0.375 17956 576 1 12 . 1 1 22 22 ILE H H 22 9.089 9.089 8.895 0.194 17956 577 1 12 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.502 0.333 17956 578 1 12 . 1 1 23 23 CYS H H 23 8.681 8.681 8.670 0.011 17956 579 1 12 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.555 -0.326 17956 580 1 12 . 1 1 24 24 LYS H H 24 8.097 8.097 8.326 -0.229 17956 581 1 12 . 1 1 25 25 GLY H H 25 8.754 8.754 8.960 -0.206 17956 582 1 12 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.545 0.053 17956 583 1 12 . 1 1 26 26 ASN H H 26 7.741 7.741 7.777 -0.036 17956 584 1 12 . 1 1 27 27 GLY H H 27 8.334 8.334 8.439 -0.105 17956 585 1 12 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.348 -0.196 17956 586 1 12 . 1 1 28 28 TYR H H 28 7.196 7.196 7.531 -0.335 17956 587 1 12 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.178 0.088 17956 588 1 12 . 1 1 29 29 CYS H H 29 8.640 8.640 8.457 0.183 17956 589 1 13 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.490 -0.177 17956 590 1 13 . 1 1 3 3 ALA H H 3 8.169 8.169 9.393 -1.224 17956 591 1 13 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.820 0.020 17956 592 1 13 . 1 1 4 4 CYS H H 4 8.323 8.323 8.536 -0.213 17956 593 1 13 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.551 -0.223 17956 594 1 13 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.325 -0.159 17956 595 1 13 . 1 1 6 6 ARG H H 6 8.227 8.227 8.608 -0.381 17956 596 1 13 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.379 -0.106 17956 597 1 13 . 1 1 7 7 ILE H H 7 7.688 7.688 8.262 -0.574 17956 598 1 13 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.877 -0.461 17956 599 1 13 . 1 1 8 8 LEU H H 8 8.606 8.606 8.463 0.143 17956 600 1 13 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.249 0.242 17956 601 1 13 . 1 1 9 9 LYS H H 9 8.898 8.898 8.355 0.543 17956 602 1 13 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.324 -0.091 17956 603 1 13 . 1 1 10 10 LYS H H 10 8.528 8.528 8.039 0.489 17956 604 1 13 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.148 -0.368 17956 605 1 13 . 1 1 11 11 CYS H H 11 8.329 8.329 8.152 0.177 17956 606 1 13 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.446 -0.099 17956 607 1 13 . 1 1 12 12 ARG H H 12 9.287 9.287 8.713 0.574 17956 608 1 13 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.426 0.200 17956 609 1 13 . 1 1 13 13 ARG H H 13 7.963 7.963 7.225 0.738 17956 610 1 13 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.416 -0.386 17956 611 1 13 . 1 1 14 14 ASP H H 14 9.243 9.243 8.835 0.408 17956 612 1 13 . 1 1 15 15 SER HA H 15 4.201 4.201 4.196 0.005 17956 613 1 13 . 1 1 15 15 SER H H 15 8.090 8.090 8.328 -0.238 17956 614 1 13 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.655 -0.112 17956 615 1 13 . 1 1 16 16 ASP H H 16 7.620 7.620 7.787 -0.167 17956 616 1 13 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.611 0.365 17956 617 1 13 . 1 1 17 17 CYS H H 17 8.006 8.006 7.618 0.388 17956 618 1 13 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.460 0.029 17956 619 1 13 . 1 1 19 19 GLY H H 19 8.408 8.408 8.546 -0.138 17956 620 1 13 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.509 -0.190 17956 621 1 13 . 1 1 20 20 GLU H H 20 8.379 8.379 8.220 0.159 17956 622 1 13 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.495 0.085 17956 623 1 13 . 1 1 21 21 CYS H H 21 8.130 8.130 7.697 0.433 17956 624 1 13 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.547 -0.245 17956 625 1 13 . 1 1 22 22 ILE H H 22 9.089 9.089 8.954 0.135 17956 626 1 13 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.606 0.229 17956 627 1 13 . 1 1 23 23 CYS H H 23 8.681 8.681 9.196 -0.515 17956 628 1 13 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.452 -0.224 17956 629 1 13 . 1 1 24 24 LYS H H 24 8.097 8.097 8.395 -0.298 17956 630 1 13 . 1 1 25 25 GLY H H 25 8.754 8.754 8.788 -0.034 17956 631 1 13 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.544 0.054 17956 632 1 13 . 1 1 26 26 ASN H H 26 7.741 7.741 7.765 -0.024 17956 633 1 13 . 1 1 27 27 GLY H H 27 8.334 8.334 8.473 -0.139 17956 634 1 13 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.352 -0.200 17956 635 1 13 . 1 1 28 28 TYR H H 28 7.196 7.196 7.539 -0.343 17956 636 1 13 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.997 0.269 17956 637 1 13 . 1 1 29 29 CYS H H 29 8.640 8.640 8.416 0.224 17956 638 1 14 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.510 -0.197 17956 639 1 14 . 1 1 3 3 ALA H H 3 8.169 8.169 8.892 -0.723 17956 640 1 14 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.853 -0.013 17956 641 1 14 . 1 1 4 4 CYS H H 4 8.323 8.323 8.505 -0.182 17956 642 1 14 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.566 -0.238 17956 643 1 14 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.291 -0.125 17956 644 1 14 . 1 1 6 6 ARG H H 6 8.227 8.227 8.543 -0.316 17956 645 1 14 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.405 -0.132 17956 646 1 14 . 1 1 7 7 ILE H H 7 7.688 7.688 8.551 -0.863 17956 647 1 14 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.942 -0.526 17956 648 1 14 . 1 1 8 8 LEU H H 8 8.606 8.606 8.479 0.127 17956 649 1 14 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.301 0.190 17956 650 1 14 . 1 1 9 9 LYS H H 9 8.898 8.898 8.138 0.760 17956 651 1 14 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.041 0.192 17956 652 1 14 . 1 1 10 10 LYS H H 10 8.528 8.528 8.129 0.399 17956 653 1 14 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.854 -0.074 17956 654 1 14 . 1 1 11 11 CYS H H 11 8.329 8.329 8.162 0.167 17956 655 1 14 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.403 -0.056 17956 656 1 14 . 1 1 12 12 ARG H H 12 9.287 9.287 8.906 0.381 17956 657 1 14 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.438 0.188 17956 658 1 14 . 1 1 13 13 ARG H H 13 7.963 7.963 7.206 0.757 17956 659 1 14 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.399 -0.369 17956 660 1 14 . 1 1 14 14 ASP H H 14 9.243 9.243 8.821 0.422 17956 661 1 14 . 1 1 15 15 SER HA H 15 4.201 4.201 4.267 -0.066 17956 662 1 14 . 1 1 15 15 SER H H 15 8.090 8.090 8.451 -0.361 17956 663 1 14 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.700 -0.157 17956 664 1 14 . 1 1 16 16 ASP H H 16 7.620 7.620 7.626 -0.006 17956 665 1 14 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.718 0.258 17956 666 1 14 . 1 1 17 17 CYS H H 17 8.006 8.006 7.605 0.401 17956 667 1 14 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.333 0.156 17956 668 1 14 . 1 1 19 19 GLY H H 19 8.408 8.408 8.619 -0.211 17956 669 1 14 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.450 -0.131 17956 670 1 14 . 1 1 20 20 GLU H H 20 8.379 8.379 8.296 0.083 17956 671 1 14 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.311 0.269 17956 672 1 14 . 1 1 21 21 CYS H H 21 8.130 8.130 7.675 0.455 17956 673 1 14 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.658 -0.356 17956 674 1 14 . 1 1 22 22 ILE H H 22 9.089 9.089 8.801 0.288 17956 675 1 14 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.677 0.158 17956 676 1 14 . 1 1 23 23 CYS H H 23 8.681 8.681 9.165 -0.484 17956 677 1 14 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.392 -0.163 17956 678 1 14 . 1 1 24 24 LYS H H 24 8.097 8.097 8.437 -0.340 17956 679 1 14 . 1 1 25 25 GLY H H 25 8.754 8.754 8.791 -0.037 17956 680 1 14 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.544 0.054 17956 681 1 14 . 1 1 26 26 ASN H H 26 7.741 7.741 7.765 -0.024 17956 682 1 14 . 1 1 27 27 GLY H H 27 8.334 8.334 8.463 -0.129 17956 683 1 14 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.310 -0.158 17956 684 1 14 . 1 1 28 28 TYR H H 28 7.196 7.196 7.581 -0.385 17956 685 1 14 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.128 0.138 17956 686 1 14 . 1 1 29 29 CYS H H 29 8.640 8.640 8.529 0.111 17956 687 1 15 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.514 -0.201 17956 688 1 15 . 1 1 3 3 ALA H H 3 8.169 8.169 8.739 -0.570 17956 689 1 15 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.795 0.045 17956 690 1 15 . 1 1 4 4 CYS H H 4 8.323 8.323 8.540 -0.217 17956 691 1 15 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.571 -0.243 17956 692 1 15 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.595 -0.429 17956 693 1 15 . 1 1 6 6 ARG H H 6 8.227 8.227 8.411 -0.184 17956 694 1 15 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.445 -0.172 17956 695 1 15 . 1 1 7 7 ILE H H 7 7.688 7.688 8.658 -0.970 17956 696 1 15 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.955 -0.539 17956 697 1 15 . 1 1 8 8 LEU H H 8 8.606 8.606 8.441 0.165 17956 698 1 15 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.298 0.193 17956 699 1 15 . 1 1 9 9 LYS H H 9 8.898 8.898 7.872 1.026 17956 700 1 15 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.790 0.443 17956 701 1 15 . 1 1 10 10 LYS H H 10 8.528 8.528 8.278 0.250 17956 702 1 15 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.248 -0.468 17956 703 1 15 . 1 1 11 11 CYS H H 11 8.329 8.329 8.125 0.204 17956 704 1 15 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.450 -0.103 17956 705 1 15 . 1 1 12 12 ARG H H 12 9.287 9.287 8.576 0.711 17956 706 1 15 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.406 0.220 17956 707 1 15 . 1 1 13 13 ARG H H 13 7.963 7.963 7.407 0.556 17956 708 1 15 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.376 -0.346 17956 709 1 15 . 1 1 14 14 ASP H H 14 9.243 9.243 8.828 0.415 17956 710 1 15 . 1 1 15 15 SER HA H 15 4.201 4.201 4.205 -0.004 17956 711 1 15 . 1 1 15 15 SER H H 15 8.090 8.090 8.339 -0.249 17956 712 1 15 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.674 -0.131 17956 713 1 15 . 1 1 16 16 ASP H H 16 7.620 7.620 7.773 -0.153 17956 714 1 15 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.956 0.020 17956 715 1 15 . 1 1 17 17 CYS H H 17 8.006 8.006 7.665 0.341 17956 716 1 15 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.331 0.158 17956 717 1 15 . 1 1 19 19 GLY H H 19 8.408 8.408 8.613 -0.205 17956 718 1 15 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.455 -0.136 17956 719 1 15 . 1 1 20 20 GLU H H 20 8.379 8.379 8.307 0.072 17956 720 1 15 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.329 0.251 17956 721 1 15 . 1 1 21 21 CYS H H 21 8.130 8.130 7.757 0.373 17956 722 1 15 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.893 -0.591 17956 723 1 15 . 1 1 22 22 ILE H H 22 9.089 9.089 8.693 0.396 17956 724 1 15 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.570 0.265 17956 725 1 15 . 1 1 23 23 CYS H H 23 8.681 8.681 8.663 0.018 17956 726 1 15 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.548 -0.319 17956 727 1 15 . 1 1 24 24 LYS H H 24 8.097 8.097 8.302 -0.205 17956 728 1 15 . 1 1 25 25 GLY H H 25 8.754 8.754 8.919 -0.165 17956 729 1 15 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.544 0.054 17956 730 1 15 . 1 1 26 26 ASN H H 26 7.741 7.741 7.770 -0.029 17956 731 1 15 . 1 1 27 27 GLY H H 27 8.334 8.334 8.522 -0.188 17956 732 1 15 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.521 -0.369 17956 733 1 15 . 1 1 28 28 TYR H H 28 7.196 7.196 7.530 -0.334 17956 734 1 15 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.091 0.175 17956 735 1 15 . 1 1 29 29 CYS H H 29 8.640 8.640 8.444 0.196 17956 736 1 16 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.380 -0.067 17956 737 1 16 . 1 1 3 3 ALA H H 3 8.169 8.169 8.478 -0.309 17956 738 1 16 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.633 0.207 17956 739 1 16 . 1 1 4 4 CYS H H 4 8.323 8.323 8.359 -0.036 17956 740 1 16 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.469 -0.141 17956 741 1 16 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.314 -0.148 17956 742 1 16 . 1 1 6 6 ARG H H 6 8.227 8.227 8.407 -0.180 17956 743 1 16 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.418 -0.145 17956 744 1 16 . 1 1 7 7 ILE H H 7 7.688 7.688 8.706 -1.018 17956 745 1 16 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.861 -0.445 17956 746 1 16 . 1 1 8 8 LEU H H 8 8.606 8.606 8.540 0.066 17956 747 1 16 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.358 0.133 17956 748 1 16 . 1 1 9 9 LYS H H 9 8.898 8.898 7.605 1.293 17956 749 1 16 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.943 0.290 17956 750 1 16 . 1 1 10 10 LYS H H 10 8.528 8.528 8.171 0.357 17956 751 1 16 . 1 1 11 11 CYS HA H 11 4.780 4.780 5.376 -0.596 17956 752 1 16 . 1 1 11 11 CYS H H 11 8.329 8.329 8.295 0.034 17956 753 1 16 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.488 -0.141 17956 754 1 16 . 1 1 12 12 ARG H H 12 9.287 9.287 9.321 -0.034 17956 755 1 16 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.520 0.106 17956 756 1 16 . 1 1 13 13 ARG H H 13 7.963 7.963 7.296 0.667 17956 757 1 16 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.410 -0.380 17956 758 1 16 . 1 1 14 14 ASP H H 14 9.243 9.243 8.830 0.413 17956 759 1 16 . 1 1 15 15 SER HA H 15 4.201 4.201 4.223 -0.022 17956 760 1 16 . 1 1 15 15 SER H H 15 8.090 8.090 8.378 -0.288 17956 761 1 16 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.641 -0.098 17956 762 1 16 . 1 1 16 16 ASP H H 16 7.620 7.620 7.697 -0.077 17956 763 1 16 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.803 0.173 17956 764 1 16 . 1 1 17 17 CYS H H 17 8.006 8.006 7.596 0.410 17956 765 1 16 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.346 0.143 17956 766 1 16 . 1 1 19 19 GLY H H 19 8.408 8.408 8.547 -0.139 17956 767 1 16 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.521 -0.202 17956 768 1 16 . 1 1 20 20 GLU H H 20 8.379 8.379 8.407 -0.028 17956 769 1 16 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.315 0.265 17956 770 1 16 . 1 1 21 21 CYS H H 21 8.130 8.130 7.763 0.367 17956 771 1 16 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.946 -0.644 17956 772 1 16 . 1 1 22 22 ILE H H 22 9.089 9.089 8.673 0.416 17956 773 1 16 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.449 0.386 17956 774 1 16 . 1 1 23 23 CYS H H 23 8.681 8.681 9.293 -0.612 17956 775 1 16 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.637 -0.408 17956 776 1 16 . 1 1 24 24 LYS H H 24 8.097 8.097 8.319 -0.222 17956 777 1 16 . 1 1 25 25 GLY H H 25 8.754 8.754 8.929 -0.175 17956 778 1 16 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.539 0.059 17956 779 1 16 . 1 1 26 26 ASN H H 26 7.741 7.741 7.787 -0.046 17956 780 1 16 . 1 1 27 27 GLY H H 27 8.334 8.334 8.481 -0.147 17956 781 1 16 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.354 -0.202 17956 782 1 16 . 1 1 28 28 TYR H H 28 7.196 7.196 7.547 -0.351 17956 783 1 16 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.071 0.195 17956 784 1 16 . 1 1 29 29 CYS H H 29 8.640 8.640 8.466 0.174 17956 785 1 17 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.556 -0.243 17956 786 1 17 . 1 1 3 3 ALA H H 3 8.169 8.169 9.389 -1.220 17956 787 1 17 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.920 -0.080 17956 788 1 17 . 1 1 4 4 CYS H H 4 8.323 8.323 8.590 -0.267 17956 789 1 17 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.506 -0.178 17956 790 1 17 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.251 -0.085 17956 791 1 17 . 1 1 6 6 ARG H H 6 8.227 8.227 8.508 -0.281 17956 792 1 17 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.423 -0.150 17956 793 1 17 . 1 1 7 7 ILE H H 7 7.688 7.688 8.097 -0.409 17956 794 1 17 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.887 -0.471 17956 795 1 17 . 1 1 8 8 LEU H H 8 8.606 8.606 8.468 0.138 17956 796 1 17 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.245 0.246 17956 797 1 17 . 1 1 9 9 LYS H H 9 8.898 8.898 8.392 0.506 17956 798 1 17 . 1 1 10 10 LYS HA H 10 4.233 4.233 3.960 0.273 17956 799 1 17 . 1 1 10 10 LYS H H 10 8.528 8.528 8.061 0.467 17956 800 1 17 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.888 -0.108 17956 801 1 17 . 1 1 11 11 CYS H H 11 8.329 8.329 8.156 0.173 17956 802 1 17 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.458 -0.111 17956 803 1 17 . 1 1 12 12 ARG H H 12 9.287 9.287 9.406 -0.119 17956 804 1 17 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.447 0.179 17956 805 1 17 . 1 1 13 13 ARG H H 13 7.963 7.963 7.589 0.374 17956 806 1 17 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.382 -0.352 17956 807 1 17 . 1 1 14 14 ASP H H 14 9.243 9.243 8.834 0.409 17956 808 1 17 . 1 1 15 15 SER HA H 15 4.201 4.201 4.237 -0.036 17956 809 1 17 . 1 1 15 15 SER H H 15 8.090 8.090 8.369 -0.279 17956 810 1 17 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.588 -0.045 17956 811 1 17 . 1 1 16 16 ASP H H 16 7.620 7.620 7.812 -0.192 17956 812 1 17 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.797 0.179 17956 813 1 17 . 1 1 17 17 CYS H H 17 8.006 8.006 7.585 0.421 17956 814 1 17 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.354 0.135 17956 815 1 17 . 1 1 19 19 GLY H H 19 8.408 8.408 8.474 -0.066 17956 816 1 17 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.522 -0.203 17956 817 1 17 . 1 1 20 20 GLU H H 20 8.379 8.379 8.245 0.134 17956 818 1 17 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.289 0.291 17956 819 1 17 . 1 1 21 21 CYS H H 21 8.130 8.130 7.617 0.513 17956 820 1 17 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.591 -0.289 17956 821 1 17 . 1 1 22 22 ILE H H 22 9.089 9.089 8.570 0.519 17956 822 1 17 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.628 0.207 17956 823 1 17 . 1 1 23 23 CYS H H 23 8.681 8.681 9.178 -0.497 17956 824 1 17 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.445 -0.216 17956 825 1 17 . 1 1 24 24 LYS H H 24 8.097 8.097 8.422 -0.325 17956 826 1 17 . 1 1 25 25 GLY H H 25 8.754 8.754 8.790 -0.036 17956 827 1 17 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.518 0.080 17956 828 1 17 . 1 1 26 26 ASN H H 26 7.741 7.741 7.890 -0.149 17956 829 1 17 . 1 1 27 27 GLY H H 27 8.334 8.334 8.540 -0.206 17956 830 1 17 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.289 -0.137 17956 831 1 17 . 1 1 28 28 TYR H H 28 7.196 7.196 7.572 -0.376 17956 832 1 17 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.054 0.212 17956 833 1 17 . 1 1 29 29 CYS H H 29 8.640 8.640 8.445 0.195 17956 834 1 18 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.451 -0.138 17956 835 1 18 . 1 1 3 3 ALA H H 3 8.169 8.169 8.993 -0.824 17956 836 1 18 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.836 0.004 17956 837 1 18 . 1 1 4 4 CYS H H 4 8.323 8.323 8.517 -0.194 17956 838 1 18 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.560 -0.232 17956 839 1 18 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.289 -0.123 17956 840 1 18 . 1 1 6 6 ARG H H 6 8.227 8.227 8.552 -0.325 17956 841 1 18 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.438 -0.165 17956 842 1 18 . 1 1 7 7 ILE H H 7 7.688 7.688 8.164 -0.476 17956 843 1 18 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.889 -0.473 17956 844 1 18 . 1 1 8 8 LEU H H 8 8.606 8.606 8.466 0.140 17956 845 1 18 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.296 0.195 17956 846 1 18 . 1 1 9 9 LYS H H 9 8.898 8.898 8.422 0.476 17956 847 1 18 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.198 0.035 17956 848 1 18 . 1 1 10 10 LYS H H 10 8.528 8.528 8.132 0.396 17956 849 1 18 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.987 -0.207 17956 850 1 18 . 1 1 11 11 CYS H H 11 8.329 8.329 8.401 -0.072 17956 851 1 18 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.378 -0.031 17956 852 1 18 . 1 1 12 12 ARG H H 12 9.287 9.287 9.158 0.129 17956 853 1 18 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.458 0.168 17956 854 1 18 . 1 1 13 13 ARG H H 13 7.963 7.963 7.234 0.729 17956 855 1 18 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.381 -0.351 17956 856 1 18 . 1 1 14 14 ASP H H 14 9.243 9.243 8.843 0.400 17956 857 1 18 . 1 1 15 15 SER HA H 15 4.201 4.201 4.223 -0.022 17956 858 1 18 . 1 1 15 15 SER H H 15 8.090 8.090 8.306 -0.216 17956 859 1 18 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.629 -0.086 17956 860 1 18 . 1 1 16 16 ASP H H 16 7.620 7.620 7.693 -0.073 17956 861 1 18 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.646 0.330 17956 862 1 18 . 1 1 17 17 CYS H H 17 8.006 8.006 7.635 0.371 17956 863 1 18 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.469 0.020 17956 864 1 18 . 1 1 19 19 GLY H H 19 8.408 8.408 8.575 -0.167 17956 865 1 18 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.486 -0.167 17956 866 1 18 . 1 1 20 20 GLU H H 20 8.379 8.379 8.337 0.042 17956 867 1 18 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.411 0.169 17956 868 1 18 . 1 1 21 21 CYS H H 21 8.130 8.130 7.591 0.539 17956 869 1 18 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.633 -0.331 17956 870 1 18 . 1 1 22 22 ILE H H 22 9.089 9.089 8.836 0.253 17956 871 1 18 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.648 0.187 17956 872 1 18 . 1 1 23 23 CYS H H 23 8.681 8.681 9.121 -0.440 17956 873 1 18 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.460 -0.231 17956 874 1 18 . 1 1 24 24 LYS H H 24 8.097 8.097 8.376 -0.279 17956 875 1 18 . 1 1 25 25 GLY H H 25 8.754 8.754 8.883 -0.129 17956 876 1 18 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.606 -0.008 17956 877 1 18 . 1 1 26 26 ASN H H 26 7.741 7.741 8.048 -0.307 17956 878 1 18 . 1 1 27 27 GLY H H 27 8.334 8.334 8.470 -0.136 17956 879 1 18 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.384 -0.232 17956 880 1 18 . 1 1 28 28 TYR H H 28 7.196 7.196 7.521 -0.325 17956 881 1 18 . 1 1 29 29 CYS HA H 29 5.266 5.266 4.998 0.268 17956 882 1 18 . 1 1 29 29 CYS H H 29 8.640 8.640 8.390 0.250 17956 883 1 19 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.793 -0.480 17956 884 1 19 . 1 1 3 3 ALA H H 3 8.169 8.169 8.429 -0.260 17956 885 1 19 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.908 -0.068 17956 886 1 19 . 1 1 4 4 CYS H H 4 8.323 8.323 8.597 -0.274 17956 887 1 19 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.546 -0.218 17956 888 1 19 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.334 -0.168 17956 889 1 19 . 1 1 6 6 ARG H H 6 8.227 8.227 8.591 -0.364 17956 890 1 19 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.238 0.035 17956 891 1 19 . 1 1 7 7 ILE H H 7 7.688 7.688 8.104 -0.416 17956 892 1 19 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.836 -0.420 17956 893 1 19 . 1 1 8 8 LEU H H 8 8.606 8.606 8.348 0.258 17956 894 1 19 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.279 0.212 17956 895 1 19 . 1 1 9 9 LYS H H 9 8.898 8.898 8.170 0.728 17956 896 1 19 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.093 0.140 17956 897 1 19 . 1 1 10 10 LYS H H 10 8.528 8.528 8.134 0.394 17956 898 1 19 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.986 -0.206 17956 899 1 19 . 1 1 11 11 CYS H H 11 8.329 8.329 8.221 0.108 17956 900 1 19 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.372 -0.025 17956 901 1 19 . 1 1 12 12 ARG H H 12 9.287 9.287 9.388 -0.101 17956 902 1 19 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.349 0.277 17956 903 1 19 . 1 1 13 13 ARG H H 13 7.963 7.963 7.412 0.551 17956 904 1 19 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.376 -0.346 17956 905 1 19 . 1 1 14 14 ASP H H 14 9.243 9.243 8.827 0.416 17956 906 1 19 . 1 1 15 15 SER HA H 15 4.201 4.201 4.218 -0.017 17956 907 1 19 . 1 1 15 15 SER H H 15 8.090 8.090 8.371 -0.281 17956 908 1 19 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.638 -0.095 17956 909 1 19 . 1 1 16 16 ASP H H 16 7.620 7.620 7.737 -0.117 17956 910 1 19 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.792 0.184 17956 911 1 19 . 1 1 17 17 CYS H H 17 8.006 8.006 7.575 0.431 17956 912 1 19 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.348 0.141 17956 913 1 19 . 1 1 19 19 GLY H H 19 8.408 8.408 8.529 -0.121 17956 914 1 19 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.509 -0.190 17956 915 1 19 . 1 1 20 20 GLU H H 20 8.379 8.379 8.497 -0.118 17956 916 1 19 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.350 0.230 17956 917 1 19 . 1 1 21 21 CYS H H 21 8.130 8.130 7.664 0.466 17956 918 1 19 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.730 -0.428 17956 919 1 19 . 1 1 22 22 ILE H H 22 9.089 9.089 8.622 0.467 17956 920 1 19 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.763 0.072 17956 921 1 19 . 1 1 23 23 CYS H H 23 8.681 8.681 8.656 0.025 17956 922 1 19 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.387 -0.158 17956 923 1 19 . 1 1 24 24 LYS H H 24 8.097 8.097 8.458 -0.361 17956 924 1 19 . 1 1 25 25 GLY H H 25 8.754 8.754 8.892 -0.138 17956 925 1 19 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.653 -0.055 17956 926 1 19 . 1 1 26 26 ASN H H 26 7.741 7.741 7.929 -0.188 17956 927 1 19 . 1 1 27 27 GLY H H 27 8.334 8.334 8.256 0.078 17956 928 1 19 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.295 -0.143 17956 929 1 19 . 1 1 28 28 TYR H H 28 7.196 7.196 7.555 -0.359 17956 930 1 19 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.139 0.127 17956 931 1 19 . 1 1 29 29 CYS H H 29 8.640 8.640 8.558 0.082 17956 932 1 20 . 1 1 3 3 ALA HA H 3 4.313 4.313 4.616 -0.303 17956 933 1 20 . 1 1 3 3 ALA H H 3 8.169 8.169 8.324 -0.155 17956 934 1 20 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.974 -0.134 17956 935 1 20 . 1 1 4 4 CYS H H 4 8.323 8.323 8.348 -0.025 17956 936 1 20 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.537 -0.209 17956 937 1 20 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.439 -0.273 17956 938 1 20 . 1 1 6 6 ARG H H 6 8.227 8.227 8.349 -0.122 17956 939 1 20 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.431 -0.158 17956 940 1 20 . 1 1 7 7 ILE H H 7 7.688 7.688 8.451 -0.763 17956 941 1 20 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.955 -0.539 17956 942 1 20 . 1 1 8 8 LEU H H 8 8.606 8.606 8.445 0.161 17956 943 1 20 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.279 0.212 17956 944 1 20 . 1 1 9 9 LYS H H 9 8.898 8.898 8.328 0.570 17956 945 1 20 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.176 0.057 17956 946 1 20 . 1 1 10 10 LYS H H 10 8.528 8.528 8.122 0.406 17956 947 1 20 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.650 0.130 17956 948 1 20 . 1 1 11 11 CYS H H 11 8.329 8.329 8.218 0.111 17956 949 1 20 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.398 -0.051 17956 950 1 20 . 1 1 12 12 ARG H H 12 9.287 9.287 8.470 0.817 17956 951 1 20 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.396 0.230 17956 952 1 20 . 1 1 13 13 ARG H H 13 7.963 7.963 7.213 0.750 17956 953 1 20 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.401 -0.371 17956 954 1 20 . 1 1 14 14 ASP H H 14 9.243 9.243 8.848 0.395 17956 955 1 20 . 1 1 15 15 SER HA H 15 4.201 4.201 4.206 -0.005 17956 956 1 20 . 1 1 15 15 SER H H 15 8.090 8.090 8.310 -0.220 17956 957 1 20 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.702 -0.159 17956 958 1 20 . 1 1 16 16 ASP H H 16 7.620 7.620 7.768 -0.148 17956 959 1 20 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.793 0.183 17956 960 1 20 . 1 1 17 17 CYS H H 17 8.006 8.006 7.586 0.420 17956 961 1 20 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.453 0.036 17956 962 1 20 . 1 1 19 19 GLY H H 19 8.408 8.408 8.591 -0.183 17956 963 1 20 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.526 -0.207 17956 964 1 20 . 1 1 20 20 GLU H H 20 8.379 8.379 8.483 -0.104 17956 965 1 20 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.393 0.187 17956 966 1 20 . 1 1 21 21 CYS H H 21 8.130 8.130 7.677 0.453 17956 967 1 20 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.732 -0.430 17956 968 1 20 . 1 1 22 22 ILE H H 22 9.089 9.089 8.722 0.367 17956 969 1 20 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.486 0.349 17956 970 1 20 . 1 1 23 23 CYS H H 23 8.681 8.681 8.920 -0.239 17956 971 1 20 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.424 -0.195 17956 972 1 20 . 1 1 24 24 LYS H H 24 8.097 8.097 8.277 -0.180 17956 973 1 20 . 1 1 25 25 GLY H H 25 8.754 8.754 8.897 -0.143 17956 974 1 20 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.601 -0.003 17956 975 1 20 . 1 1 26 26 ASN H H 26 7.741 7.741 8.072 -0.331 17956 976 1 20 . 1 1 27 27 GLY H H 27 8.334 8.334 8.441 -0.107 17956 977 1 20 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.395 -0.243 17956 978 1 20 . 1 1 28 28 TYR H H 28 7.196 7.196 7.538 -0.342 17956 979 1 20 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.148 0.118 17956 980 1 20 . 1 1 29 29 CYS H H 29 8.640 8.640 8.392 0.248 17956 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 17956 2 1 1 "Average Difference" HA 30 0.194 -0.009 0.198 17956 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17956 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17956 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17956 6 1 1 "Average Difference" HN 25 0.446 -0.004 0.455 17956 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 17956 8 1 2 "Average Difference" HA 30 0.217 0.065 0.211 17956 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17956 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17956 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17956 12 1 2 "Average Difference" HN 25 0.448 0.027 0.456 17956 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 17956 14 1 3 "Average Difference" HA 30 0.225 0.002 0.229 17956 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17956 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17956 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17956 18 1 3 "Average Difference" HN 25 0.392 -0.008 0.400 17956 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 17956 20 1 4 "Average Difference" HA 30 0.212 -0.002 0.215 17956 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17956 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17956 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17956 24 1 4 "Average Difference" HN 25 0.339 -0.049 0.342 17956 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 17956 26 1 5 "Average Difference" HA 30 0.219 0.031 0.221 17956 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17956 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17956 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17956 30 1 5 "Average Difference" HN 25 0.440 0.011 0.449 17956 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 17956 32 1 6 "Average Difference" HA 30 0.267 0.052 0.267 17956 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17956 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17956 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17956 36 1 6 "Average Difference" HN 25 0.422 0.036 0.429 17956 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 17956 38 1 7 "Average Difference" HA 30 0.229 0.025 0.232 17956 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17956 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17956 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17956 42 1 7 "Average Difference" HN 25 0.440 0.011 0.449 17956 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 17956 44 1 8 "Average Difference" HA 30 0.247 0.040 0.247 17956 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17956 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17956 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17956 48 1 8 "Average Difference" HN 25 0.357 -0.046 0.361 17956 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 17956 50 1 9 "Average Difference" HA 30 0.217 0.010 0.220 17956 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17956 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17956 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17956 54 1 9 "Average Difference" HN 25 0.348 0.006 0.356 17956 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 17956 56 1 10 "Average Difference" HA 30 0.211 0.006 0.214 17956 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17956 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17956 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17956 60 1 10 "Average Difference" HN 25 0.381 -0.010 0.389 17956 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 17956 62 1 11 "Average Difference" HA 30 0.230 -0.008 0.234 17956 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17956 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17956 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17956 66 1 11 "Average Difference" HN 25 0.442 0.008 0.451 17956 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 17956 68 1 12 "Average Difference" HA 30 0.243 0.019 0.246 17956 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17956 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17956 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17956 72 1 12 "Average Difference" HN 25 0.410 -0.020 0.418 17956 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 17956 74 1 13 "Average Difference" HA 30 0.219 0.018 0.222 17956 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17956 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17956 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17956 78 1 13 "Average Difference" HN 25 0.432 -0.005 0.441 17956 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 17956 80 1 14 "Average Difference" HA 30 0.207 0.012 0.210 17956 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17956 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17956 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17956 84 1 14 "Average Difference" HN 25 0.412 -0.012 0.420 17956 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 17956 86 1 15 "Average Difference" HA 30 0.274 0.046 0.274 17956 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17956 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17956 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17956 90 1 15 "Average Difference" HN 25 0.416 -0.050 0.421 17956 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 17956 92 1 16 "Average Difference" HA 30 0.266 0.027 0.269 17956 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17956 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 17956 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17956 96 1 16 "Average Difference" HN 25 0.438 -0.021 0.447 17956 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 17956 98 1 17 "Average Difference" HA 30 0.207 0.003 0.211 17956 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17956 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 17956 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17956 102 1 17 "Average Difference" HN 25 0.405 0.023 0.412 17956 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 17956 104 1 18 "Average Difference" HA 30 0.209 0.016 0.212 17956 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17956 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 17956 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17956 108 1 18 "Average Difference" HN 25 0.364 0.010 0.371 17956 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 17956 110 1 19 "Average Difference" HA 30 0.215 0.025 0.217 17956 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17956 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 17956 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17956 114 1 19 "Average Difference" HN 25 0.333 -0.036 0.338 17956 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 17956 116 1 20 "Average Difference" HA 30 0.230 0.029 0.232 17956 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17956 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 17956 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17956 120 1 20 "Average Difference" HN 25 0.378 -0.065 0.380 17956 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 17956 _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 3 3 ALA HA H 3 4.313 4.313 4.523 -0.210 17956 2 1 . 1 1 3 3 ALA H H 3 8.169 8.169 8.858 -0.689 17956 3 1 . 1 1 4 4 CYS HA H 4 4.840 4.840 4.829 0.011 17956 4 1 . 1 1 4 4 CYS H H 4 8.323 8.323 8.506 -0.183 17956 5 1 . 1 1 5 5 PRO HA H 5 4.328 4.328 4.549 -0.221 17956 6 1 . 1 1 6 6 ARG HA H 6 4.166 4.166 4.356 -0.190 17956 7 1 . 1 1 6 6 ARG H H 6 8.227 8.227 8.493 -0.266 17956 8 1 . 1 1 7 7 ILE HA H 7 4.273 4.273 4.385 -0.112 17956 9 1 . 1 1 7 7 ILE H H 7 7.688 7.688 8.385 -0.697 17956 10 1 . 1 1 8 8 LEU HA H 8 4.416 4.416 4.882 -0.466 17956 11 1 . 1 1 8 8 LEU H H 8 8.606 8.606 8.447 0.159 17956 12 1 . 1 1 9 9 LYS HA H 9 4.491 4.491 4.298 0.193 17956 13 1 . 1 1 9 9 LYS H H 9 8.898 8.898 8.158 0.740 17956 14 1 . 1 1 10 10 LYS HA H 10 4.233 4.233 4.086 0.147 17956 15 1 . 1 1 10 10 LYS H H 10 8.528 8.528 8.142 0.386 17956 16 1 . 1 1 11 11 CYS HA H 11 4.780 4.780 4.974 -0.194 17956 17 1 . 1 1 11 11 CYS H H 11 8.329 8.329 8.226 0.103 17956 18 1 . 1 1 12 12 ARG HA H 12 4.347 4.347 4.422 -0.075 17956 19 1 . 1 1 12 12 ARG H H 12 9.287 9.287 8.992 0.295 17956 20 1 . 1 1 13 13 ARG HA H 13 4.626 4.626 4.416 0.210 17956 21 1 . 1 1 13 13 ARG H H 13 7.963 7.963 7.324 0.639 17956 22 1 . 1 1 14 14 ASP HA H 14 4.030 4.030 4.399 -0.369 17956 23 1 . 1 1 14 14 ASP H H 14 9.243 9.243 8.827 0.416 17956 24 1 . 1 1 15 15 SER HA H 15 4.201 4.201 4.217 -0.016 17956 25 1 . 1 1 15 15 SER H H 15 8.090 8.090 8.342 -0.252 17956 26 1 . 1 1 16 16 ASP HA H 16 4.543 4.543 4.661 -0.118 17956 27 1 . 1 1 16 16 ASP H H 16 7.620 7.620 7.729 -0.109 17956 28 1 . 1 1 17 17 CYS HA H 17 4.976 4.976 4.811 0.165 17956 29 1 . 1 1 17 17 CYS H H 17 8.006 8.006 7.588 0.418 17956 30 1 . 1 1 18 18 PRO HA H 18 4.489 4.489 4.390 0.099 17956 31 1 . 1 1 19 19 GLY H H 19 8.408 8.408 8.531 -0.123 17956 32 1 . 1 1 20 20 GLU HA H 20 4.319 4.319 4.504 -0.185 17956 33 1 . 1 1 20 20 GLU H H 20 8.379 8.379 8.330 0.049 17956 34 1 . 1 1 21 21 CYS HA H 21 4.580 4.580 4.409 0.171 17956 35 1 . 1 1 21 21 CYS H H 21 8.130 8.130 7.683 0.447 17956 36 1 . 1 1 22 22 ILE HA H 22 4.302 4.302 4.697 -0.395 17956 37 1 . 1 1 22 22 ILE H H 22 9.089 9.089 8.895 0.194 17956 38 1 . 1 1 23 23 CYS HA H 23 4.835 4.835 4.557 0.278 17956 39 1 . 1 1 23 23 CYS H H 23 8.681 8.681 9.073 -0.392 17956 40 1 . 1 1 24 24 LYS HA H 24 4.229 4.229 4.454 -0.225 17956 41 1 . 1 1 24 24 LYS H H 24 8.097 8.097 8.400 -0.303 17956 42 1 . 1 1 25 25 GLY H H 25 8.754 8.754 8.861 -0.107 17956 43 1 . 1 1 26 26 ASN HA H 26 4.598 4.598 4.578 0.020 17956 44 1 . 1 1 26 26 ASN H H 26 7.741 7.741 7.912 -0.171 17956 45 1 . 1 1 27 27 GLY H H 27 8.334 8.334 8.425 -0.091 17956 46 1 . 1 1 28 28 TYR HA H 28 5.152 5.152 5.349 -0.197 17956 47 1 . 1 1 28 28 TYR H H 28 7.196 7.196 7.573 -0.377 17956 48 1 . 1 1 29 29 CYS HA H 29 5.266 5.266 5.033 0.233 17956 49 1 . 1 1 29 29 CYS H H 29 8.640 8.640 8.482 0.158 17956 stop_ save_