data_18347 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18347 _Entry.PDB_ID 2LR5 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 18347 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.384 -0.434 18347 2 1 1 . 1 1 2 2 PHE H H 2 8.596 8.596 8.316 0.280 18347 3 1 1 . 1 1 3 3 GLY H H 3 8.018 8.018 8.414 -0.396 18347 4 1 1 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.764 -0.421 18347 5 1 1 . 1 1 4 4 CYS H H 4 7.645 7.645 8.456 -0.811 18347 6 1 1 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.496 0.208 18347 7 1 1 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.322 0.334 18347 8 1 1 . 1 1 6 6 PHE H H 6 7.378 7.378 7.566 -0.188 18347 9 1 1 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.942 0.132 18347 10 1 1 . 1 1 7 7 ASN H H 7 8.689 8.689 8.226 0.463 18347 11 1 1 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.127 -0.190 18347 12 1 1 . 1 1 8 8 GLU H H 8 8.572 8.572 8.941 -0.369 18347 13 1 1 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.445 0.045 18347 14 1 1 . 1 1 9 9 ASN H H 9 8.767 8.767 8.697 0.070 18347 15 1 1 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.183 -0.012 18347 16 1 1 . 1 1 10 10 GLU H H 10 7.719 7.719 8.093 -0.374 18347 17 1 1 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.287 0.589 18347 18 1 1 . 1 1 11 11 CYS H H 11 7.274 7.274 8.127 -0.853 18347 19 1 1 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.317 -0.326 18347 20 1 1 . 1 1 12 12 HIS H H 12 8.666 8.666 9.014 -0.348 18347 21 1 1 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.065 -0.070 18347 22 1 1 . 1 1 13 13 ALA H H 13 8.460 8.460 8.480 -0.020 18347 23 1 1 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.276 0.030 18347 24 1 1 . 1 1 14 14 HIS H H 14 8.278 8.278 8.759 -0.481 18347 25 1 1 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.012 -0.076 18347 26 1 1 . 1 1 15 15 CYS H H 15 8.314 8.314 8.361 -0.047 18347 27 1 1 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.379 -0.200 18347 28 1 1 . 1 1 16 16 LEU H H 16 8.030 8.030 8.382 -0.352 18347 29 1 1 . 1 1 17 17 SER HA H 17 4.251 4.251 4.305 -0.054 18347 30 1 1 . 1 1 17 17 SER H H 17 7.951 7.951 7.552 0.399 18347 31 1 1 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.523 0.085 18347 32 1 1 . 1 1 18 18 ILE H H 18 7.008 7.008 7.347 -0.339 18347 33 1 1 . 1 1 19 19 GLY H H 19 7.695 7.695 7.681 0.014 18347 34 1 1 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.227 0.411 18347 35 1 1 . 1 1 20 20 ARG H H 20 8.020 8.020 7.745 0.275 18347 36 1 1 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.194 -0.170 18347 37 1 1 . 1 1 21 21 LYS H H 21 8.317 8.317 8.447 -0.130 18347 38 1 1 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.608 0.011 18347 39 1 1 . 1 1 22 22 PHE H H 22 7.901 7.901 7.562 0.339 18347 40 1 1 . 1 1 23 23 GLY H H 23 7.972 7.972 8.238 -0.266 18347 41 1 1 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.668 -0.656 18347 42 1 1 . 1 1 24 24 PHE H H 24 8.715 8.715 8.291 0.424 18347 43 1 1 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.736 0.460 18347 44 1 1 . 1 1 25 25 CYS H H 25 8.773 8.773 8.514 0.259 18347 45 1 1 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.733 -0.027 18347 46 1 1 . 1 1 26 26 ALA H H 26 9.227 9.227 8.290 0.937 18347 47 1 1 . 1 1 27 27 GLY H H 27 8.273 8.273 8.356 -0.083 18347 48 1 1 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.415 -0.075 18347 49 1 1 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.398 -0.494 18347 50 1 1 . 1 1 29 29 LEU H H 29 9.231 9.231 7.592 1.639 18347 51 1 1 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.620 -0.930 18347 52 1 1 . 1 1 32 32 THR HA H 32 4.306 4.306 4.504 -0.198 18347 53 1 1 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.686 0.265 18347 54 1 1 . 1 1 33 33 CYS H H 33 9.122 9.122 8.329 0.793 18347 55 1 1 . 1 1 34 34 THR HA H 34 4.317 4.317 4.376 -0.059 18347 56 1 1 . 1 1 34 34 THR H H 34 9.245 9.245 8.482 0.763 18347 57 1 1 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.415 0.968 18347 58 1 1 . 1 1 35 35 CYS H H 35 8.797 8.797 8.921 -0.124 18347 59 1 1 . 1 1 36 36 GLY H H 36 8.169 8.169 9.104 -0.935 18347 60 1 1 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.593 -0.317 18347 61 1 1 . 1 1 37 37 LYS H H 37 8.396 8.396 8.005 0.391 18347 62 1 2 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.506 -0.556 18347 63 1 2 . 1 1 2 2 PHE H H 2 8.596 8.596 8.551 0.045 18347 64 1 2 . 1 1 3 3 GLY H H 3 8.018 8.018 8.002 0.016 18347 65 1 2 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.503 -0.160 18347 66 1 2 . 1 1 4 4 CYS H H 4 7.645 7.645 8.574 -0.929 18347 67 1 2 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.519 0.185 18347 68 1 2 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.433 0.223 18347 69 1 2 . 1 1 6 6 PHE H H 6 7.378 7.378 7.477 -0.099 18347 70 1 2 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.848 0.226 18347 71 1 2 . 1 1 7 7 ASN H H 7 8.689 8.689 8.291 0.398 18347 72 1 2 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.151 -0.214 18347 73 1 2 . 1 1 8 8 GLU H H 8 8.572 8.572 7.777 0.795 18347 74 1 2 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.448 0.042 18347 75 1 2 . 1 1 9 9 ASN H H 9 8.767 8.767 8.748 0.019 18347 76 1 2 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.271 -0.100 18347 77 1 2 . 1 1 10 10 GLU H H 10 7.719 7.719 8.101 -0.382 18347 78 1 2 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.309 0.567 18347 79 1 2 . 1 1 11 11 CYS H H 11 7.274 7.274 8.203 -0.929 18347 80 1 2 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.372 -0.381 18347 81 1 2 . 1 1 12 12 HIS H H 12 8.666 8.666 8.969 -0.303 18347 82 1 2 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.077 -0.082 18347 83 1 2 . 1 1 13 13 ALA H H 13 8.460 8.460 8.085 0.375 18347 84 1 2 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.318 -0.012 18347 85 1 2 . 1 1 14 14 HIS H H 14 8.278 8.278 8.796 -0.518 18347 86 1 2 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.014 -0.078 18347 87 1 2 . 1 1 15 15 CYS H H 15 8.314 8.314 8.266 0.048 18347 88 1 2 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.421 -0.242 18347 89 1 2 . 1 1 16 16 LEU H H 16 8.030 8.030 8.325 -0.295 18347 90 1 2 . 1 1 17 17 SER HA H 17 4.251 4.251 4.320 -0.069 18347 91 1 2 . 1 1 17 17 SER H H 17 7.951 7.951 7.629 0.322 18347 92 1 2 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.549 0.059 18347 93 1 2 . 1 1 18 18 ILE H H 18 7.008 7.008 7.327 -0.319 18347 94 1 2 . 1 1 19 19 GLY H H 19 7.695 7.695 7.563 0.132 18347 95 1 2 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.185 0.453 18347 96 1 2 . 1 1 20 20 ARG H H 20 8.020 8.020 7.574 0.446 18347 97 1 2 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.131 -0.107 18347 98 1 2 . 1 1 21 21 LYS H H 21 8.317 8.317 8.570 -0.253 18347 99 1 2 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.667 -0.048 18347 100 1 2 . 1 1 22 22 PHE H H 22 7.901 7.901 7.306 0.595 18347 101 1 2 . 1 1 23 23 GLY H H 23 7.972 7.972 8.265 -0.293 18347 102 1 2 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.191 -0.179 18347 103 1 2 . 1 1 24 24 PHE H H 24 8.715 8.715 8.353 0.362 18347 104 1 2 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.058 0.138 18347 105 1 2 . 1 1 25 25 CYS H H 25 8.773 8.773 8.722 0.051 18347 106 1 2 . 1 1 26 26 ALA HA H 26 4.706 4.706 5.093 -0.387 18347 107 1 2 . 1 1 26 26 ALA H H 26 9.227 9.227 8.691 0.536 18347 108 1 2 . 1 1 27 27 GLY H H 27 8.273 8.273 8.052 0.221 18347 109 1 2 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.458 -0.118 18347 110 1 2 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.520 -0.616 18347 111 1 2 . 1 1 29 29 LEU H H 29 9.231 9.231 7.726 1.505 18347 112 1 2 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.600 -0.910 18347 113 1 2 . 1 1 32 32 THR HA H 32 4.306 4.306 4.340 -0.034 18347 114 1 2 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.606 0.345 18347 115 1 2 . 1 1 33 33 CYS H H 33 9.122 9.122 8.681 0.441 18347 116 1 2 . 1 1 34 34 THR HA H 34 4.317 4.317 4.557 -0.240 18347 117 1 2 . 1 1 34 34 THR H H 34 9.245 9.245 8.955 0.290 18347 118 1 2 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.744 0.639 18347 119 1 2 . 1 1 35 35 CYS H H 35 8.797 8.797 8.985 -0.188 18347 120 1 2 . 1 1 36 36 GLY H H 36 8.169 8.169 8.647 -0.478 18347 121 1 2 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.600 -0.324 18347 122 1 2 . 1 1 37 37 LYS H H 37 8.396 8.396 7.829 0.567 18347 123 1 3 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.576 -0.626 18347 124 1 3 . 1 1 2 2 PHE H H 2 8.596 8.596 8.688 -0.092 18347 125 1 3 . 1 1 3 3 GLY H H 3 8.018 8.018 8.216 -0.198 18347 126 1 3 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.532 -0.189 18347 127 1 3 . 1 1 4 4 CYS H H 4 7.645 7.645 7.759 -0.114 18347 128 1 3 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.571 0.133 18347 129 1 3 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.592 0.064 18347 130 1 3 . 1 1 6 6 PHE H H 6 7.378 7.378 7.476 -0.098 18347 131 1 3 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.296 -0.222 18347 132 1 3 . 1 1 7 7 ASN H H 7 8.689 8.689 8.248 0.441 18347 133 1 3 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.184 -0.247 18347 134 1 3 . 1 1 8 8 GLU H H 8 8.572 8.572 8.665 -0.093 18347 135 1 3 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.502 -0.012 18347 136 1 3 . 1 1 9 9 ASN H H 9 8.767 8.767 8.737 0.030 18347 137 1 3 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.240 -0.069 18347 138 1 3 . 1 1 10 10 GLU H H 10 7.719 7.719 8.269 -0.550 18347 139 1 3 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.306 0.570 18347 140 1 3 . 1 1 11 11 CYS H H 11 7.274 7.274 8.265 -0.991 18347 141 1 3 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.358 -0.367 18347 142 1 3 . 1 1 12 12 HIS H H 12 8.666 8.666 8.599 0.067 18347 143 1 3 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.988 0.007 18347 144 1 3 . 1 1 13 13 ALA H H 13 8.460 8.460 8.578 -0.118 18347 145 1 3 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.367 -0.061 18347 146 1 3 . 1 1 14 14 HIS H H 14 8.278 8.278 8.357 -0.079 18347 147 1 3 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.991 -0.055 18347 148 1 3 . 1 1 15 15 CYS H H 15 8.314 8.314 8.231 0.083 18347 149 1 3 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.469 -0.290 18347 150 1 3 . 1 1 16 16 LEU H H 16 8.030 8.030 8.290 -0.260 18347 151 1 3 . 1 1 17 17 SER HA H 17 4.251 4.251 4.289 -0.038 18347 152 1 3 . 1 1 17 17 SER H H 17 7.951 7.951 7.684 0.267 18347 153 1 3 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.482 0.126 18347 154 1 3 . 1 1 18 18 ILE H H 18 7.008 7.008 7.342 -0.334 18347 155 1 3 . 1 1 19 19 GLY H H 19 7.695 7.695 7.729 -0.034 18347 156 1 3 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.292 0.346 18347 157 1 3 . 1 1 20 20 ARG H H 20 8.020 8.020 7.775 0.245 18347 158 1 3 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.212 -0.188 18347 159 1 3 . 1 1 21 21 LYS H H 21 8.317 8.317 8.438 -0.121 18347 160 1 3 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.679 -0.060 18347 161 1 3 . 1 1 22 22 PHE H H 22 7.901 7.901 7.437 0.464 18347 162 1 3 . 1 1 23 23 GLY H H 23 7.972 7.972 7.901 0.071 18347 163 1 3 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.164 -0.152 18347 164 1 3 . 1 1 24 24 PHE H H 24 8.715 8.715 8.515 0.200 18347 165 1 3 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.525 0.671 18347 166 1 3 . 1 1 25 25 CYS H H 25 8.773 8.773 9.290 -0.517 18347 167 1 3 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.577 0.129 18347 168 1 3 . 1 1 26 26 ALA H H 26 9.227 9.227 8.643 0.584 18347 169 1 3 . 1 1 27 27 GLY H H 27 8.273 8.273 8.205 0.068 18347 170 1 3 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.528 -0.188 18347 171 1 3 . 1 1 29 29 LEU HA H 29 3.904 3.904 3.824 0.080 18347 172 1 3 . 1 1 29 29 LEU H H 29 9.231 9.231 8.566 0.665 18347 173 1 3 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.583 -0.893 18347 174 1 3 . 1 1 32 32 THR HA H 32 4.306 4.306 4.787 -0.481 18347 175 1 3 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.485 0.466 18347 176 1 3 . 1 1 33 33 CYS H H 33 9.122 9.122 8.964 0.158 18347 177 1 3 . 1 1 34 34 THR HA H 34 4.317 4.317 4.539 -0.222 18347 178 1 3 . 1 1 34 34 THR H H 34 9.245 9.245 8.794 0.451 18347 179 1 3 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.573 0.810 18347 180 1 3 . 1 1 35 35 CYS H H 35 8.797 8.797 9.040 -0.243 18347 181 1 3 . 1 1 36 36 GLY H H 36 8.169 8.169 8.776 -0.607 18347 182 1 3 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.507 -0.231 18347 183 1 3 . 1 1 37 37 LYS H H 37 8.396 8.396 8.074 0.322 18347 184 1 4 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.532 -0.582 18347 185 1 4 . 1 1 2 2 PHE H H 2 8.596 8.596 8.383 0.213 18347 186 1 4 . 1 1 3 3 GLY H H 3 8.018 8.018 7.881 0.137 18347 187 1 4 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.626 -0.283 18347 188 1 4 . 1 1 4 4 CYS H H 4 7.645 7.645 8.125 -0.480 18347 189 1 4 . 1 1 5 5 PRO HA H 5 4.704 4.704 5.014 -0.310 18347 190 1 4 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.590 0.066 18347 191 1 4 . 1 1 6 6 PHE H H 6 7.378 7.378 7.589 -0.211 18347 192 1 4 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.291 -0.217 18347 193 1 4 . 1 1 7 7 ASN H H 7 8.689 8.689 8.415 0.274 18347 194 1 4 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.205 -0.268 18347 195 1 4 . 1 1 8 8 GLU H H 8 8.572 8.572 8.123 0.449 18347 196 1 4 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.529 -0.039 18347 197 1 4 . 1 1 9 9 ASN H H 9 8.767 8.767 8.772 -0.005 18347 198 1 4 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.225 -0.054 18347 199 1 4 . 1 1 10 10 GLU H H 10 7.719 7.719 8.358 -0.639 18347 200 1 4 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.351 0.525 18347 201 1 4 . 1 1 11 11 CYS H H 11 7.274 7.274 8.231 -0.957 18347 202 1 4 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.532 -0.541 18347 203 1 4 . 1 1 12 12 HIS H H 12 8.666 8.666 8.356 0.310 18347 204 1 4 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.999 -0.004 18347 205 1 4 . 1 1 13 13 ALA H H 13 8.460 8.460 8.659 -0.199 18347 206 1 4 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.373 -0.067 18347 207 1 4 . 1 1 14 14 HIS H H 14 8.278 8.278 8.396 -0.118 18347 208 1 4 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.966 -0.030 18347 209 1 4 . 1 1 15 15 CYS H H 15 8.314 8.314 8.125 0.189 18347 210 1 4 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.482 -0.303 18347 211 1 4 . 1 1 16 16 LEU H H 16 8.030 8.030 8.316 -0.286 18347 212 1 4 . 1 1 17 17 SER HA H 17 4.251 4.251 4.294 -0.043 18347 213 1 4 . 1 1 17 17 SER H H 17 7.951 7.951 7.876 0.075 18347 214 1 4 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.529 0.079 18347 215 1 4 . 1 1 18 18 ILE H H 18 7.008 7.008 7.348 -0.340 18347 216 1 4 . 1 1 19 19 GLY H H 19 7.695 7.695 8.045 -0.350 18347 217 1 4 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.409 0.229 18347 218 1 4 . 1 1 20 20 ARG H H 20 8.020 8.020 7.312 0.708 18347 219 1 4 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.195 -0.171 18347 220 1 4 . 1 1 21 21 LYS H H 21 8.317 8.317 8.530 -0.213 18347 221 1 4 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.596 0.023 18347 222 1 4 . 1 1 22 22 PHE H H 22 7.901 7.901 7.494 0.407 18347 223 1 4 . 1 1 23 23 GLY H H 23 7.972 7.972 7.902 0.070 18347 224 1 4 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.038 -0.026 18347 225 1 4 . 1 1 24 24 PHE H H 24 8.715 8.715 8.421 0.294 18347 226 1 4 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.931 0.265 18347 227 1 4 . 1 1 25 25 CYS H H 25 8.773 8.773 8.630 0.143 18347 228 1 4 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.931 -0.225 18347 229 1 4 . 1 1 26 26 ALA H H 26 9.227 9.227 8.612 0.615 18347 230 1 4 . 1 1 27 27 GLY H H 27 8.273 8.273 8.078 0.195 18347 231 1 4 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.426 -0.085 18347 232 1 4 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.611 -0.707 18347 233 1 4 . 1 1 29 29 LEU H H 29 9.231 9.231 7.778 1.453 18347 234 1 4 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.745 -1.055 18347 235 1 4 . 1 1 32 32 THR HA H 32 4.306 4.306 4.631 -0.325 18347 236 1 4 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.479 0.472 18347 237 1 4 . 1 1 33 33 CYS H H 33 9.122 9.122 9.113 0.009 18347 238 1 4 . 1 1 34 34 THR HA H 34 4.317 4.317 4.905 -0.589 18347 239 1 4 . 1 1 34 34 THR H H 34 9.245 9.245 8.808 0.437 18347 240 1 4 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.597 0.786 18347 241 1 4 . 1 1 35 35 CYS H H 35 8.797 8.797 8.714 0.083 18347 242 1 4 . 1 1 36 36 GLY H H 36 8.169 8.169 8.789 -0.620 18347 243 1 4 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.552 -0.276 18347 244 1 4 . 1 1 37 37 LYS H H 37 8.396 8.396 8.265 0.131 18347 245 1 5 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.703 -0.753 18347 246 1 5 . 1 1 2 2 PHE H H 2 8.596 8.596 8.608 -0.012 18347 247 1 5 . 1 1 3 3 GLY H H 3 8.018 8.018 7.882 0.136 18347 248 1 5 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.654 -0.311 18347 249 1 5 . 1 1 4 4 CYS H H 4 7.645 7.645 7.696 -0.051 18347 250 1 5 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.836 -0.132 18347 251 1 5 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.508 0.148 18347 252 1 5 . 1 1 6 6 PHE H H 6 7.378 7.378 7.473 -0.095 18347 253 1 5 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.888 0.186 18347 254 1 5 . 1 1 7 7 ASN H H 7 8.689 8.689 8.666 0.023 18347 255 1 5 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.038 -0.101 18347 256 1 5 . 1 1 8 8 GLU H H 8 8.572 8.572 7.760 0.812 18347 257 1 5 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.729 -0.239 18347 258 1 5 . 1 1 9 9 ASN H H 9 8.767 8.767 8.497 0.270 18347 259 1 5 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.238 -0.067 18347 260 1 5 . 1 1 10 10 GLU H H 10 7.719 7.719 8.290 -0.571 18347 261 1 5 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.290 0.586 18347 262 1 5 . 1 1 11 11 CYS H H 11 7.274 7.274 8.357 -1.083 18347 263 1 5 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.304 -0.313 18347 264 1 5 . 1 1 12 12 HIS H H 12 8.666 8.666 8.272 0.394 18347 265 1 5 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.805 0.190 18347 266 1 5 . 1 1 13 13 ALA H H 13 8.460 8.460 8.612 -0.152 18347 267 1 5 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.338 -0.032 18347 268 1 5 . 1 1 14 14 HIS H H 14 8.278 8.278 8.116 0.162 18347 269 1 5 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.019 -0.083 18347 270 1 5 . 1 1 15 15 CYS H H 15 8.314 8.314 8.257 0.057 18347 271 1 5 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.246 -0.067 18347 272 1 5 . 1 1 16 16 LEU H H 16 8.030 8.030 8.189 -0.159 18347 273 1 5 . 1 1 17 17 SER HA H 17 4.251 4.251 4.317 -0.066 18347 274 1 5 . 1 1 17 17 SER H H 17 7.951 7.951 7.916 0.035 18347 275 1 5 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.625 -0.017 18347 276 1 5 . 1 1 18 18 ILE H H 18 7.008 7.008 7.442 -0.434 18347 277 1 5 . 1 1 19 19 GLY H H 19 7.695 7.695 7.810 -0.115 18347 278 1 5 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.417 0.221 18347 279 1 5 . 1 1 20 20 ARG H H 20 8.020 8.020 8.168 -0.148 18347 280 1 5 . 1 1 21 21 LYS HA H 21 4.024 4.024 3.856 0.168 18347 281 1 5 . 1 1 21 21 LYS H H 21 8.317 8.317 8.131 0.186 18347 282 1 5 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.924 -0.305 18347 283 1 5 . 1 1 22 22 PHE H H 22 7.901 7.901 7.511 0.390 18347 284 1 5 . 1 1 23 23 GLY H H 23 7.972 7.972 8.202 -0.230 18347 285 1 5 . 1 1 24 24 PHE HA H 24 5.012 5.012 4.879 0.133 18347 286 1 5 . 1 1 24 24 PHE H H 24 8.715 8.715 8.221 0.494 18347 287 1 5 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.643 0.553 18347 288 1 5 . 1 1 25 25 CYS H H 25 8.773 8.773 8.767 0.006 18347 289 1 5 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.397 0.309 18347 290 1 5 . 1 1 26 26 ALA H H 26 9.227 9.227 8.703 0.524 18347 291 1 5 . 1 1 27 27 GLY H H 27 8.273 8.273 8.172 0.101 18347 292 1 5 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.351 -0.011 18347 293 1 5 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.417 -0.513 18347 294 1 5 . 1 1 29 29 LEU H H 29 9.231 9.231 7.493 1.738 18347 295 1 5 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.300 -0.610 18347 296 1 5 . 1 1 32 32 THR HA H 32 4.306 4.306 4.346 -0.040 18347 297 1 5 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.574 0.377 18347 298 1 5 . 1 1 33 33 CYS H H 33 9.122 9.122 8.892 0.230 18347 299 1 5 . 1 1 34 34 THR HA H 34 4.317 4.317 4.558 -0.241 18347 300 1 5 . 1 1 34 34 THR H H 34 9.245 9.245 8.959 0.286 18347 301 1 5 . 1 1 35 35 CYS HA H 35 5.383 5.383 5.153 0.230 18347 302 1 5 . 1 1 35 35 CYS H H 35 8.797 8.797 8.180 0.617 18347 303 1 5 . 1 1 36 36 GLY H H 36 8.169 8.169 8.699 -0.530 18347 304 1 5 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.562 -0.286 18347 305 1 5 . 1 1 37 37 LYS H H 37 8.396 8.396 7.924 0.472 18347 306 1 6 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.472 -0.522 18347 307 1 6 . 1 1 2 2 PHE H H 2 8.596 8.596 8.644 -0.048 18347 308 1 6 . 1 1 3 3 GLY H H 3 8.018 8.018 8.211 -0.193 18347 309 1 6 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.641 -0.298 18347 310 1 6 . 1 1 4 4 CYS H H 4 7.645 7.645 7.899 -0.254 18347 311 1 6 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.462 0.242 18347 312 1 6 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.250 0.406 18347 313 1 6 . 1 1 6 6 PHE H H 6 7.378 7.378 7.425 -0.047 18347 314 1 6 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.829 0.245 18347 315 1 6 . 1 1 7 7 ASN H H 7 8.689 8.689 8.385 0.304 18347 316 1 6 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.072 -0.135 18347 317 1 6 . 1 1 8 8 GLU H H 8 8.572 8.572 7.937 0.635 18347 318 1 6 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.475 0.015 18347 319 1 6 . 1 1 9 9 ASN H H 9 8.767 8.767 8.822 -0.055 18347 320 1 6 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.126 0.045 18347 321 1 6 . 1 1 10 10 GLU H H 10 7.719 7.719 8.440 -0.721 18347 322 1 6 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.289 0.587 18347 323 1 6 . 1 1 11 11 CYS H H 11 7.274 7.274 8.673 -1.399 18347 324 1 6 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.665 -0.674 18347 325 1 6 . 1 1 12 12 HIS H H 12 8.666 8.666 8.512 0.154 18347 326 1 6 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.017 -0.022 18347 327 1 6 . 1 1 13 13 ALA H H 13 8.460 8.460 8.454 0.006 18347 328 1 6 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.372 -0.066 18347 329 1 6 . 1 1 14 14 HIS H H 14 8.278 8.278 8.706 -0.428 18347 330 1 6 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.053 -0.117 18347 331 1 6 . 1 1 15 15 CYS H H 15 8.314 8.314 8.268 0.046 18347 332 1 6 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.421 -0.242 18347 333 1 6 . 1 1 16 16 LEU H H 16 8.030 8.030 8.175 -0.145 18347 334 1 6 . 1 1 17 17 SER HA H 17 4.251 4.251 4.301 -0.050 18347 335 1 6 . 1 1 17 17 SER H H 17 7.951 7.951 7.769 0.182 18347 336 1 6 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.564 0.044 18347 337 1 6 . 1 1 18 18 ILE H H 18 7.008 7.008 7.359 -0.350 18347 338 1 6 . 1 1 19 19 GLY H H 19 7.695 7.695 7.852 -0.157 18347 339 1 6 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.229 0.409 18347 340 1 6 . 1 1 20 20 ARG H H 20 8.020 8.020 7.478 0.542 18347 341 1 6 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.145 -0.121 18347 342 1 6 . 1 1 21 21 LYS H H 21 8.317 8.317 8.615 -0.298 18347 343 1 6 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.593 0.026 18347 344 1 6 . 1 1 22 22 PHE H H 22 7.901 7.901 7.197 0.704 18347 345 1 6 . 1 1 23 23 GLY H H 23 7.972 7.972 8.352 -0.380 18347 346 1 6 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.252 -0.240 18347 347 1 6 . 1 1 24 24 PHE H H 24 8.715 8.715 8.473 0.242 18347 348 1 6 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.918 0.278 18347 349 1 6 . 1 1 25 25 CYS H H 25 8.773 8.773 8.596 0.177 18347 350 1 6 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.832 -0.126 18347 351 1 6 . 1 1 26 26 ALA H H 26 9.227 9.227 8.587 0.640 18347 352 1 6 . 1 1 27 27 GLY H H 27 8.273 8.273 8.237 0.036 18347 353 1 6 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.573 -0.233 18347 354 1 6 . 1 1 29 29 LEU HA H 29 3.904 3.904 3.961 -0.057 18347 355 1 6 . 1 1 29 29 LEU H H 29 9.231 9.231 8.083 1.148 18347 356 1 6 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.724 -1.034 18347 357 1 6 . 1 1 32 32 THR HA H 32 4.306 4.306 4.472 -0.166 18347 358 1 6 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.552 0.399 18347 359 1 6 . 1 1 33 33 CYS H H 33 9.122 9.122 8.946 0.176 18347 360 1 6 . 1 1 34 34 THR HA H 34 4.317 4.317 4.566 -0.249 18347 361 1 6 . 1 1 34 34 THR H H 34 9.245 9.245 9.003 0.242 18347 362 1 6 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.501 0.882 18347 363 1 6 . 1 1 35 35 CYS H H 35 8.797 8.797 9.053 -0.256 18347 364 1 6 . 1 1 36 36 GLY H H 36 8.169 8.169 8.937 -0.768 18347 365 1 6 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.525 -0.249 18347 366 1 6 . 1 1 37 37 LYS H H 37 8.396 8.396 8.061 0.335 18347 367 1 7 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.451 -0.501 18347 368 1 7 . 1 1 2 2 PHE H H 2 8.596 8.596 8.842 -0.246 18347 369 1 7 . 1 1 3 3 GLY H H 3 8.018 8.018 8.423 -0.405 18347 370 1 7 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.766 -0.423 18347 371 1 7 . 1 1 4 4 CYS H H 4 7.645 7.645 8.012 -0.367 18347 372 1 7 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.386 0.318 18347 373 1 7 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.255 0.401 18347 374 1 7 . 1 1 6 6 PHE H H 6 7.378 7.378 7.187 0.191 18347 375 1 7 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.007 0.067 18347 376 1 7 . 1 1 7 7 ASN H H 7 8.689 8.689 8.179 0.510 18347 377 1 7 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.125 -0.188 18347 378 1 7 . 1 1 8 8 GLU H H 8 8.572 8.572 9.067 -0.495 18347 379 1 7 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.589 -0.099 18347 380 1 7 . 1 1 9 9 ASN H H 9 8.767 8.767 8.284 0.483 18347 381 1 7 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.284 -0.113 18347 382 1 7 . 1 1 10 10 GLU H H 10 7.719 7.719 7.768 -0.049 18347 383 1 7 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.528 0.348 18347 384 1 7 . 1 1 11 11 CYS H H 11 7.274 7.274 7.982 -0.708 18347 385 1 7 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.252 -0.261 18347 386 1 7 . 1 1 12 12 HIS H H 12 8.666 8.666 9.022 -0.356 18347 387 1 7 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.957 0.038 18347 388 1 7 . 1 1 13 13 ALA H H 13 8.460 8.460 8.885 -0.425 18347 389 1 7 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.335 -0.029 18347 390 1 7 . 1 1 14 14 HIS H H 14 8.278 8.278 8.220 0.058 18347 391 1 7 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.976 -0.040 18347 392 1 7 . 1 1 15 15 CYS H H 15 8.314 8.314 8.361 -0.047 18347 393 1 7 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.472 -0.293 18347 394 1 7 . 1 1 16 16 LEU H H 16 8.030 8.030 8.431 -0.401 18347 395 1 7 . 1 1 17 17 SER HA H 17 4.251 4.251 4.273 -0.022 18347 396 1 7 . 1 1 17 17 SER H H 17 7.951 7.951 7.710 0.241 18347 397 1 7 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.552 0.056 18347 398 1 7 . 1 1 18 18 ILE H H 18 7.008 7.008 7.339 -0.331 18347 399 1 7 . 1 1 19 19 GLY H H 19 7.695 7.695 7.609 0.086 18347 400 1 7 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.334 0.304 18347 401 1 7 . 1 1 20 20 ARG H H 20 8.020 8.020 7.597 0.423 18347 402 1 7 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.230 -0.206 18347 403 1 7 . 1 1 21 21 LYS H H 21 8.317 8.317 8.572 -0.255 18347 404 1 7 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.976 -0.357 18347 405 1 7 . 1 1 22 22 PHE H H 22 7.901 7.901 7.581 0.320 18347 406 1 7 . 1 1 23 23 GLY H H 23 7.972 7.972 8.142 -0.170 18347 407 1 7 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.082 -0.070 18347 408 1 7 . 1 1 24 24 PHE H H 24 8.715 8.715 8.129 0.586 18347 409 1 7 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.803 0.393 18347 410 1 7 . 1 1 25 25 CYS H H 25 8.773 8.773 8.711 0.062 18347 411 1 7 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.601 0.105 18347 412 1 7 . 1 1 26 26 ALA H H 26 9.227 9.227 8.981 0.246 18347 413 1 7 . 1 1 27 27 GLY H H 27 8.273 8.273 8.150 0.123 18347 414 1 7 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.377 -0.037 18347 415 1 7 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.273 -0.369 18347 416 1 7 . 1 1 29 29 LEU H H 29 9.231 9.231 8.288 0.943 18347 417 1 7 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.524 -0.834 18347 418 1 7 . 1 1 32 32 THR HA H 32 4.306 4.306 4.558 -0.252 18347 419 1 7 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.441 0.510 18347 420 1 7 . 1 1 33 33 CYS H H 33 9.122 9.122 9.039 0.083 18347 421 1 7 . 1 1 34 34 THR HA H 34 4.317 4.317 4.543 -0.226 18347 422 1 7 . 1 1 34 34 THR H H 34 9.245 9.245 8.860 0.385 18347 423 1 7 . 1 1 35 35 CYS HA H 35 5.383 5.383 5.122 0.261 18347 424 1 7 . 1 1 35 35 CYS H H 35 8.797 8.797 8.427 0.370 18347 425 1 7 . 1 1 36 36 GLY H H 36 8.169 8.169 8.751 -0.582 18347 426 1 7 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.481 -0.205 18347 427 1 7 . 1 1 37 37 LYS H H 37 8.396 8.396 8.071 0.325 18347 428 1 8 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.471 -0.521 18347 429 1 8 . 1 1 2 2 PHE H H 2 8.596 8.596 8.184 0.412 18347 430 1 8 . 1 1 3 3 GLY H H 3 8.018 8.018 7.935 0.083 18347 431 1 8 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.739 -0.396 18347 432 1 8 . 1 1 4 4 CYS H H 4 7.645 7.645 8.022 -0.377 18347 433 1 8 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.647 0.057 18347 434 1 8 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.260 0.396 18347 435 1 8 . 1 1 6 6 PHE H H 6 7.378 7.378 7.783 -0.405 18347 436 1 8 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.791 0.283 18347 437 1 8 . 1 1 7 7 ASN H H 7 8.689 8.689 8.277 0.412 18347 438 1 8 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.071 -0.134 18347 439 1 8 . 1 1 8 8 GLU H H 8 8.572 8.572 8.937 -0.365 18347 440 1 8 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.461 0.029 18347 441 1 8 . 1 1 9 9 ASN H H 9 8.767 8.767 8.201 0.566 18347 442 1 8 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.200 -0.029 18347 443 1 8 . 1 1 10 10 GLU H H 10 7.719 7.719 7.880 -0.161 18347 444 1 8 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.259 0.617 18347 445 1 8 . 1 1 11 11 CYS H H 11 7.274 7.274 8.081 -0.807 18347 446 1 8 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.327 -0.336 18347 447 1 8 . 1 1 12 12 HIS H H 12 8.666 8.666 9.038 -0.372 18347 448 1 8 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.935 0.060 18347 449 1 8 . 1 1 13 13 ALA H H 13 8.460 8.460 8.700 -0.240 18347 450 1 8 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.238 0.068 18347 451 1 8 . 1 1 14 14 HIS H H 14 8.278 8.278 8.361 -0.083 18347 452 1 8 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.001 -0.065 18347 453 1 8 . 1 1 15 15 CYS H H 15 8.314 8.314 8.203 0.111 18347 454 1 8 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.583 -0.404 18347 455 1 8 . 1 1 16 16 LEU H H 16 8.030 8.030 8.476 -0.446 18347 456 1 8 . 1 1 17 17 SER HA H 17 4.251 4.251 4.312 -0.061 18347 457 1 8 . 1 1 17 17 SER H H 17 7.951 7.951 7.955 -0.004 18347 458 1 8 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.586 0.022 18347 459 1 8 . 1 1 18 18 ILE H H 18 7.008 7.008 7.342 -0.334 18347 460 1 8 . 1 1 19 19 GLY H H 19 7.695 7.695 7.713 -0.018 18347 461 1 8 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.160 0.478 18347 462 1 8 . 1 1 20 20 ARG H H 20 8.020 8.020 7.612 0.408 18347 463 1 8 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.103 -0.079 18347 464 1 8 . 1 1 21 21 LYS H H 21 8.317 8.317 8.509 -0.192 18347 465 1 8 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.625 -0.006 18347 466 1 8 . 1 1 22 22 PHE H H 22 7.901 7.901 7.289 0.612 18347 467 1 8 . 1 1 23 23 GLY H H 23 7.972 7.972 8.258 -0.286 18347 468 1 8 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.292 -0.280 18347 469 1 8 . 1 1 24 24 PHE H H 24 8.715 8.715 8.332 0.383 18347 470 1 8 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.690 0.506 18347 471 1 8 . 1 1 25 25 CYS H H 25 8.773 8.773 8.711 0.062 18347 472 1 8 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.941 -0.235 18347 473 1 8 . 1 1 26 26 ALA H H 26 9.227 9.227 9.050 0.177 18347 474 1 8 . 1 1 27 27 GLY H H 27 8.273 8.273 8.400 -0.127 18347 475 1 8 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.302 0.038 18347 476 1 8 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.384 -0.480 18347 477 1 8 . 1 1 29 29 LEU H H 29 9.231 9.231 7.759 1.472 18347 478 1 8 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.040 -0.350 18347 479 1 8 . 1 1 32 32 THR HA H 32 4.306 4.306 4.732 -0.426 18347 480 1 8 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.502 0.449 18347 481 1 8 . 1 1 33 33 CYS H H 33 9.122 9.122 8.961 0.161 18347 482 1 8 . 1 1 34 34 THR HA H 34 4.317 4.317 4.538 -0.221 18347 483 1 8 . 1 1 34 34 THR H H 34 9.245 9.245 9.003 0.242 18347 484 1 8 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.444 0.939 18347 485 1 8 . 1 1 35 35 CYS H H 35 8.797 8.797 9.073 -0.276 18347 486 1 8 . 1 1 36 36 GLY H H 36 8.169 8.169 8.850 -0.681 18347 487 1 8 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.578 -0.302 18347 488 1 8 . 1 1 37 37 LYS H H 37 8.396 8.396 8.146 0.250 18347 489 1 9 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.475 -0.525 18347 490 1 9 . 1 1 2 2 PHE H H 2 8.596 8.596 8.798 -0.202 18347 491 1 9 . 1 1 3 3 GLY H H 3 8.018 8.018 8.562 -0.544 18347 492 1 9 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.637 -0.294 18347 493 1 9 . 1 1 4 4 CYS H H 4 7.645 7.645 8.568 -0.923 18347 494 1 9 . 1 1 5 5 PRO HA H 5 4.704 4.704 5.157 -0.453 18347 495 1 9 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.308 0.348 18347 496 1 9 . 1 1 6 6 PHE H H 6 7.378 7.378 7.341 0.037 18347 497 1 9 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.909 0.165 18347 498 1 9 . 1 1 7 7 ASN H H 7 8.689 8.689 8.502 0.187 18347 499 1 9 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.087 -0.150 18347 500 1 9 . 1 1 8 8 GLU H H 8 8.572 8.572 8.632 -0.060 18347 501 1 9 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.515 -0.025 18347 502 1 9 . 1 1 9 9 ASN H H 9 8.767 8.767 8.612 0.155 18347 503 1 9 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.264 -0.093 18347 504 1 9 . 1 1 10 10 GLU H H 10 7.719 7.719 7.653 0.066 18347 505 1 9 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.340 0.536 18347 506 1 9 . 1 1 11 11 CYS H H 11 7.274 7.274 8.280 -1.006 18347 507 1 9 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.312 -0.321 18347 508 1 9 . 1 1 12 12 HIS H H 12 8.666 8.666 8.650 0.016 18347 509 1 9 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.946 0.049 18347 510 1 9 . 1 1 13 13 ALA H H 13 8.460 8.460 8.449 0.011 18347 511 1 9 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.304 0.002 18347 512 1 9 . 1 1 14 14 HIS H H 14 8.278 8.278 8.309 -0.031 18347 513 1 9 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.986 -0.050 18347 514 1 9 . 1 1 15 15 CYS H H 15 8.314 8.314 8.145 0.169 18347 515 1 9 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.303 -0.124 18347 516 1 9 . 1 1 16 16 LEU H H 16 8.030 8.030 8.486 -0.456 18347 517 1 9 . 1 1 17 17 SER HA H 17 4.251 4.251 4.282 -0.031 18347 518 1 9 . 1 1 17 17 SER H H 17 7.951 7.951 7.934 0.017 18347 519 1 9 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.576 0.032 18347 520 1 9 . 1 1 18 18 ILE H H 18 7.008 7.008 7.374 -0.366 18347 521 1 9 . 1 1 19 19 GLY H H 19 7.695 7.695 7.956 -0.261 18347 522 1 9 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.522 0.116 18347 523 1 9 . 1 1 20 20 ARG H H 20 8.020 8.020 8.015 0.005 18347 524 1 9 . 1 1 21 21 LYS HA H 21 4.024 4.024 3.952 0.072 18347 525 1 9 . 1 1 21 21 LYS H H 21 8.317 8.317 8.688 -0.371 18347 526 1 9 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.772 -0.153 18347 527 1 9 . 1 1 22 22 PHE H H 22 7.901 7.901 7.529 0.372 18347 528 1 9 . 1 1 23 23 GLY H H 23 7.972 7.972 8.295 -0.323 18347 529 1 9 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.072 -0.060 18347 530 1 9 . 1 1 24 24 PHE H H 24 8.715 8.715 8.038 0.677 18347 531 1 9 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.071 0.125 18347 532 1 9 . 1 1 25 25 CYS H H 25 8.773 8.773 8.583 0.190 18347 533 1 9 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.780 -0.074 18347 534 1 9 . 1 1 26 26 ALA H H 26 9.227 9.227 8.748 0.479 18347 535 1 9 . 1 1 27 27 GLY H H 27 8.273 8.273 8.274 -0.001 18347 536 1 9 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.331 0.009 18347 537 1 9 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.559 -0.655 18347 538 1 9 . 1 1 29 29 LEU H H 29 9.231 9.231 7.750 1.481 18347 539 1 9 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.360 -0.670 18347 540 1 9 . 1 1 32 32 THR HA H 32 4.306 4.306 4.160 0.146 18347 541 1 9 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.584 0.367 18347 542 1 9 . 1 1 33 33 CYS H H 33 9.122 9.122 8.874 0.248 18347 543 1 9 . 1 1 34 34 THR HA H 34 4.317 4.317 4.445 -0.128 18347 544 1 9 . 1 1 34 34 THR H H 34 9.245 9.245 8.878 0.367 18347 545 1 9 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.509 0.874 18347 546 1 9 . 1 1 35 35 CYS H H 35 8.797 8.797 8.938 -0.141 18347 547 1 9 . 1 1 36 36 GLY H H 36 8.169 8.169 8.947 -0.778 18347 548 1 9 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.577 -0.301 18347 549 1 9 . 1 1 37 37 LYS H H 37 8.396 8.396 7.994 0.402 18347 550 1 10 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.395 -0.445 18347 551 1 10 . 1 1 2 2 PHE H H 2 8.596 8.596 8.586 0.010 18347 552 1 10 . 1 1 3 3 GLY H H 3 8.018 8.018 8.005 0.013 18347 553 1 10 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.434 -0.091 18347 554 1 10 . 1 1 4 4 CYS H H 4 7.645 7.645 7.866 -0.221 18347 555 1 10 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.972 -0.268 18347 556 1 10 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.202 0.454 18347 557 1 10 . 1 1 6 6 PHE H H 6 7.378 7.378 7.456 -0.078 18347 558 1 10 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.948 0.126 18347 559 1 10 . 1 1 7 7 ASN H H 7 8.689 8.689 8.371 0.318 18347 560 1 10 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.118 -0.181 18347 561 1 10 . 1 1 8 8 GLU H H 8 8.572 8.572 7.805 0.767 18347 562 1 10 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.466 0.024 18347 563 1 10 . 1 1 9 9 ASN H H 9 8.767 8.767 8.727 0.040 18347 564 1 10 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.160 0.011 18347 565 1 10 . 1 1 10 10 GLU H H 10 7.719 7.719 8.114 -0.395 18347 566 1 10 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.284 0.592 18347 567 1 10 . 1 1 11 11 CYS H H 11 7.274 7.274 8.680 -1.406 18347 568 1 10 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.658 -0.667 18347 569 1 10 . 1 1 12 12 HIS H H 12 8.666 8.666 8.710 -0.044 18347 570 1 10 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.989 0.006 18347 571 1 10 . 1 1 13 13 ALA H H 13 8.460 8.460 8.458 0.002 18347 572 1 10 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.304 0.002 18347 573 1 10 . 1 1 14 14 HIS H H 14 8.278 8.278 8.620 -0.342 18347 574 1 10 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.969 -0.033 18347 575 1 10 . 1 1 15 15 CYS H H 15 8.314 8.314 8.205 0.109 18347 576 1 10 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.670 -0.491 18347 577 1 10 . 1 1 16 16 LEU H H 16 8.030 8.030 8.103 -0.073 18347 578 1 10 . 1 1 17 17 SER HA H 17 4.251 4.251 4.324 -0.073 18347 579 1 10 . 1 1 17 17 SER H H 17 7.951 7.951 7.826 0.125 18347 580 1 10 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.483 0.125 18347 581 1 10 . 1 1 18 18 ILE H H 18 7.008 7.008 7.309 -0.301 18347 582 1 10 . 1 1 19 19 GLY H H 19 7.695 7.695 7.804 -0.109 18347 583 1 10 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.545 0.093 18347 584 1 10 . 1 1 20 20 ARG H H 20 8.020 8.020 7.486 0.534 18347 585 1 10 . 1 1 21 21 LYS HA H 21 4.024 4.024 3.920 0.104 18347 586 1 10 . 1 1 21 21 LYS H H 21 8.317 8.317 8.696 -0.379 18347 587 1 10 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.558 0.061 18347 588 1 10 . 1 1 22 22 PHE H H 22 7.901 7.901 7.383 0.518 18347 589 1 10 . 1 1 23 23 GLY H H 23 7.972 7.972 8.286 -0.314 18347 590 1 10 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.216 -0.204 18347 591 1 10 . 1 1 24 24 PHE H H 24 8.715 8.715 8.454 0.261 18347 592 1 10 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.783 0.413 18347 593 1 10 . 1 1 25 25 CYS H H 25 8.773 8.773 8.869 -0.096 18347 594 1 10 . 1 1 26 26 ALA HA H 26 4.706 4.706 5.101 -0.395 18347 595 1 10 . 1 1 26 26 ALA H H 26 9.227 9.227 8.858 0.369 18347 596 1 10 . 1 1 27 27 GLY H H 27 8.273 8.273 7.965 0.308 18347 597 1 10 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.430 -0.090 18347 598 1 10 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.563 -0.659 18347 599 1 10 . 1 1 29 29 LEU H H 29 9.231 9.231 7.760 1.471 18347 600 1 10 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.490 -0.800 18347 601 1 10 . 1 1 32 32 THR HA H 32 4.306 4.306 4.259 0.047 18347 602 1 10 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.463 0.488 18347 603 1 10 . 1 1 33 33 CYS H H 33 9.122 9.122 8.544 0.578 18347 604 1 10 . 1 1 34 34 THR HA H 34 4.317 4.317 4.553 -0.236 18347 605 1 10 . 1 1 34 34 THR H H 34 9.245 9.245 8.860 0.385 18347 606 1 10 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.557 0.826 18347 607 1 10 . 1 1 35 35 CYS H H 35 8.797 8.797 8.975 -0.178 18347 608 1 10 . 1 1 36 36 GLY H H 36 8.169 8.169 8.856 -0.687 18347 609 1 10 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.523 -0.247 18347 610 1 10 . 1 1 37 37 LYS H H 37 8.396 8.396 8.130 0.266 18347 611 1 11 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.461 -0.511 18347 612 1 11 . 1 1 2 2 PHE H H 2 8.596 8.596 8.732 -0.136 18347 613 1 11 . 1 1 3 3 GLY H H 3 8.018 8.018 8.091 -0.073 18347 614 1 11 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.802 -0.459 18347 615 1 11 . 1 1 4 4 CYS H H 4 7.645 7.645 8.068 -0.423 18347 616 1 11 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.504 0.200 18347 617 1 11 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.300 0.356 18347 618 1 11 . 1 1 6 6 PHE H H 6 7.378 7.378 7.239 0.139 18347 619 1 11 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.989 0.085 18347 620 1 11 . 1 1 7 7 ASN H H 7 8.689 8.689 8.185 0.504 18347 621 1 11 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.124 -0.187 18347 622 1 11 . 1 1 8 8 GLU H H 8 8.572 8.572 8.979 -0.407 18347 623 1 11 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.614 -0.124 18347 624 1 11 . 1 1 9 9 ASN H H 9 8.767 8.767 8.219 0.548 18347 625 1 11 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.191 -0.020 18347 626 1 11 . 1 1 10 10 GLU H H 10 7.719 7.719 8.111 -0.392 18347 627 1 11 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.406 0.470 18347 628 1 11 . 1 1 11 11 CYS H H 11 7.274 7.274 8.180 -0.906 18347 629 1 11 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.333 -0.342 18347 630 1 11 . 1 1 12 12 HIS H H 12 8.666 8.666 8.577 0.089 18347 631 1 11 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.995 0.000 18347 632 1 11 . 1 1 13 13 ALA H H 13 8.460 8.460 8.776 -0.316 18347 633 1 11 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.300 0.006 18347 634 1 11 . 1 1 14 14 HIS H H 14 8.278 8.278 8.459 -0.181 18347 635 1 11 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.930 0.006 18347 636 1 11 . 1 1 15 15 CYS H H 15 8.314 8.314 8.064 0.250 18347 637 1 11 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.387 -0.208 18347 638 1 11 . 1 1 16 16 LEU H H 16 8.030 8.030 8.286 -0.256 18347 639 1 11 . 1 1 17 17 SER HA H 17 4.251 4.251 4.268 -0.017 18347 640 1 11 . 1 1 17 17 SER H H 17 7.951 7.951 7.989 -0.038 18347 641 1 11 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.522 0.086 18347 642 1 11 . 1 1 18 18 ILE H H 18 7.008 7.008 7.314 -0.306 18347 643 1 11 . 1 1 19 19 GLY H H 19 7.695 7.695 7.993 -0.298 18347 644 1 11 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.341 0.297 18347 645 1 11 . 1 1 20 20 ARG H H 20 8.020 8.020 7.499 0.521 18347 646 1 11 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.225 -0.201 18347 647 1 11 . 1 1 21 21 LYS H H 21 8.317 8.317 8.572 -0.255 18347 648 1 11 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.418 0.201 18347 649 1 11 . 1 1 22 22 PHE H H 22 7.901 7.901 7.577 0.324 18347 650 1 11 . 1 1 23 23 GLY H H 23 7.972 7.972 8.154 -0.182 18347 651 1 11 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.257 -0.245 18347 652 1 11 . 1 1 24 24 PHE H H 24 8.715 8.715 8.368 0.347 18347 653 1 11 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.272 -0.076 18347 654 1 11 . 1 1 25 25 CYS H H 25 8.773 8.773 8.881 -0.108 18347 655 1 11 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.895 -0.189 18347 656 1 11 . 1 1 26 26 ALA H H 26 9.227 9.227 9.155 0.072 18347 657 1 11 . 1 1 27 27 GLY H H 27 8.273 8.273 8.327 -0.054 18347 658 1 11 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.372 -0.032 18347 659 1 11 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.365 -0.461 18347 660 1 11 . 1 1 29 29 LEU H H 29 9.231 9.231 7.801 1.430 18347 661 1 11 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.032 -0.342 18347 662 1 11 . 1 1 32 32 THR HA H 32 4.306 4.306 4.442 -0.136 18347 663 1 11 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.789 0.162 18347 664 1 11 . 1 1 33 33 CYS H H 33 9.122 9.122 8.673 0.449 18347 665 1 11 . 1 1 34 34 THR HA H 34 4.317 4.317 4.526 -0.209 18347 666 1 11 . 1 1 34 34 THR H H 34 9.245 9.245 9.151 0.094 18347 667 1 11 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.470 0.913 18347 668 1 11 . 1 1 35 35 CYS H H 35 8.797 8.797 8.864 -0.067 18347 669 1 11 . 1 1 36 36 GLY H H 36 8.169 8.169 8.838 -0.669 18347 670 1 11 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.561 -0.285 18347 671 1 11 . 1 1 37 37 LYS H H 37 8.396 8.396 7.849 0.547 18347 672 1 12 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.508 -0.558 18347 673 1 12 . 1 1 2 2 PHE H H 2 8.596 8.596 8.456 0.140 18347 674 1 12 . 1 1 3 3 GLY H H 3 8.018 8.018 7.983 0.035 18347 675 1 12 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.690 -0.347 18347 676 1 12 . 1 1 4 4 CYS H H 4 7.645 7.645 7.911 -0.266 18347 677 1 12 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.529 0.175 18347 678 1 12 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.537 0.119 18347 679 1 12 . 1 1 6 6 PHE H H 6 7.378 7.378 7.393 -0.015 18347 680 1 12 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.116 -0.042 18347 681 1 12 . 1 1 7 7 ASN H H 7 8.689 8.689 8.381 0.308 18347 682 1 12 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.183 -0.246 18347 683 1 12 . 1 1 8 8 GLU H H 8 8.572 8.572 7.662 0.910 18347 684 1 12 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.451 0.039 18347 685 1 12 . 1 1 9 9 ASN H H 9 8.767 8.767 8.844 -0.077 18347 686 1 12 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.205 -0.035 18347 687 1 12 . 1 1 10 10 GLU H H 10 7.719 7.719 8.314 -0.595 18347 688 1 12 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.249 0.627 18347 689 1 12 . 1 1 11 11 CYS H H 11 7.274 7.274 8.137 -0.863 18347 690 1 12 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.261 -0.270 18347 691 1 12 . 1 1 12 12 HIS H H 12 8.666 8.666 9.009 -0.343 18347 692 1 12 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.038 -0.043 18347 693 1 12 . 1 1 13 13 ALA H H 13 8.460 8.460 8.614 -0.154 18347 694 1 12 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.283 0.023 18347 695 1 12 . 1 1 14 14 HIS H H 14 8.278 8.278 8.224 0.054 18347 696 1 12 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.983 -0.047 18347 697 1 12 . 1 1 15 15 CYS H H 15 8.314 8.314 8.093 0.221 18347 698 1 12 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.391 -0.212 18347 699 1 12 . 1 1 16 16 LEU H H 16 8.030 8.030 8.250 -0.220 18347 700 1 12 . 1 1 17 17 SER HA H 17 4.251 4.251 4.321 -0.070 18347 701 1 12 . 1 1 17 17 SER H H 17 7.951 7.951 7.772 0.179 18347 702 1 12 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.530 0.078 18347 703 1 12 . 1 1 18 18 ILE H H 18 7.008 7.008 7.341 -0.333 18347 704 1 12 . 1 1 19 19 GLY H H 19 7.695 7.695 7.788 -0.093 18347 705 1 12 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.296 0.342 18347 706 1 12 . 1 1 20 20 ARG H H 20 8.020 8.020 7.329 0.691 18347 707 1 12 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.118 -0.094 18347 708 1 12 . 1 1 21 21 LYS H H 21 8.317 8.317 8.574 -0.257 18347 709 1 12 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.985 -0.366 18347 710 1 12 . 1 1 22 22 PHE H H 22 7.901 7.901 7.312 0.589 18347 711 1 12 . 1 1 23 23 GLY H H 23 7.972 7.972 8.316 -0.344 18347 712 1 12 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.018 -0.006 18347 713 1 12 . 1 1 24 24 PHE H H 24 8.715 8.715 8.246 0.469 18347 714 1 12 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.917 0.279 18347 715 1 12 . 1 1 25 25 CYS H H 25 8.773 8.773 8.978 -0.205 18347 716 1 12 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.482 0.224 18347 717 1 12 . 1 1 26 26 ALA H H 26 9.227 9.227 8.658 0.569 18347 718 1 12 . 1 1 27 27 GLY H H 27 8.273 8.273 8.542 -0.269 18347 719 1 12 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.642 -0.302 18347 720 1 12 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.375 -0.471 18347 721 1 12 . 1 1 29 29 LEU H H 29 9.231 9.231 8.326 0.905 18347 722 1 12 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.393 -0.703 18347 723 1 12 . 1 1 32 32 THR HA H 32 4.306 4.306 4.767 -0.461 18347 724 1 12 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.544 0.407 18347 725 1 12 . 1 1 33 33 CYS H H 33 9.122 9.122 9.025 0.097 18347 726 1 12 . 1 1 34 34 THR HA H 34 4.317 4.317 4.569 -0.252 18347 727 1 12 . 1 1 34 34 THR H H 34 9.245 9.245 8.822 0.423 18347 728 1 12 . 1 1 35 35 CYS HA H 35 5.383 5.383 5.124 0.259 18347 729 1 12 . 1 1 35 35 CYS H H 35 8.797 8.797 9.156 -0.359 18347 730 1 12 . 1 1 36 36 GLY H H 36 8.169 8.169 8.768 -0.599 18347 731 1 12 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.551 -0.275 18347 732 1 12 . 1 1 37 37 LYS H H 37 8.396 8.396 7.863 0.533 18347 733 1 13 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.255 -0.305 18347 734 1 13 . 1 1 2 2 PHE H H 2 8.596 8.596 8.817 -0.221 18347 735 1 13 . 1 1 3 3 GLY H H 3 8.018 8.018 8.028 -0.010 18347 736 1 13 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.662 -0.319 18347 737 1 13 . 1 1 4 4 CYS H H 4 7.645 7.645 7.956 -0.311 18347 738 1 13 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.947 -0.242 18347 739 1 13 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.276 0.380 18347 740 1 13 . 1 1 6 6 PHE H H 6 7.378 7.378 8.020 -0.642 18347 741 1 13 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.783 0.291 18347 742 1 13 . 1 1 7 7 ASN H H 7 8.689 8.689 8.380 0.309 18347 743 1 13 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.046 -0.109 18347 744 1 13 . 1 1 8 8 GLU H H 8 8.572 8.572 7.657 0.915 18347 745 1 13 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.442 0.048 18347 746 1 13 . 1 1 9 9 ASN H H 9 8.767 8.767 8.873 -0.106 18347 747 1 13 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.021 0.150 18347 748 1 13 . 1 1 10 10 GLU H H 10 7.719 7.719 7.739 -0.020 18347 749 1 13 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.328 0.548 18347 750 1 13 . 1 1 11 11 CYS H H 11 7.274 7.274 8.324 -1.050 18347 751 1 13 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.513 -0.522 18347 752 1 13 . 1 1 12 12 HIS H H 12 8.666 8.666 8.968 -0.302 18347 753 1 13 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.043 -0.048 18347 754 1 13 . 1 1 13 13 ALA H H 13 8.460 8.460 8.402 0.058 18347 755 1 13 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.274 0.032 18347 756 1 13 . 1 1 14 14 HIS H H 14 8.278 8.278 8.494 -0.216 18347 757 1 13 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.936 -0.000 18347 758 1 13 . 1 1 15 15 CYS H H 15 8.314 8.314 8.135 0.179 18347 759 1 13 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.454 -0.275 18347 760 1 13 . 1 1 16 16 LEU H H 16 8.030 8.030 8.167 -0.137 18347 761 1 13 . 1 1 17 17 SER HA H 17 4.251 4.251 4.299 -0.048 18347 762 1 13 . 1 1 17 17 SER H H 17 7.951 7.951 7.703 0.248 18347 763 1 13 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.380 0.228 18347 764 1 13 . 1 1 18 18 ILE H H 18 7.008 7.008 7.312 -0.304 18347 765 1 13 . 1 1 19 19 GLY H H 19 7.695 7.695 7.768 -0.073 18347 766 1 13 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.266 0.372 18347 767 1 13 . 1 1 20 20 ARG H H 20 8.020 8.020 7.401 0.619 18347 768 1 13 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.141 -0.117 18347 769 1 13 . 1 1 21 21 LYS H H 21 8.317 8.317 8.358 -0.041 18347 770 1 13 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.604 0.015 18347 771 1 13 . 1 1 22 22 PHE H H 22 7.901 7.901 7.438 0.463 18347 772 1 13 . 1 1 23 23 GLY H H 23 7.972 7.972 8.228 -0.256 18347 773 1 13 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.224 -0.212 18347 774 1 13 . 1 1 24 24 PHE H H 24 8.715 8.715 8.411 0.304 18347 775 1 13 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.842 0.354 18347 776 1 13 . 1 1 25 25 CYS H H 25 8.773 8.773 8.604 0.169 18347 777 1 13 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.680 0.026 18347 778 1 13 . 1 1 26 26 ALA H H 26 9.227 9.227 8.764 0.463 18347 779 1 13 . 1 1 27 27 GLY H H 27 8.273 8.273 8.210 0.063 18347 780 1 13 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.272 0.068 18347 781 1 13 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.464 -0.560 18347 782 1 13 . 1 1 29 29 LEU H H 29 9.231 9.231 8.162 1.069 18347 783 1 13 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.053 -0.363 18347 784 1 13 . 1 1 32 32 THR HA H 32 4.306 4.306 4.439 -0.133 18347 785 1 13 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.644 0.307 18347 786 1 13 . 1 1 33 33 CYS H H 33 9.122 9.122 8.516 0.606 18347 787 1 13 . 1 1 34 34 THR HA H 34 4.317 4.317 4.487 -0.170 18347 788 1 13 . 1 1 34 34 THR H H 34 9.245 9.245 8.986 0.259 18347 789 1 13 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.544 0.839 18347 790 1 13 . 1 1 35 35 CYS H H 35 8.797 8.797 8.763 0.034 18347 791 1 13 . 1 1 36 36 GLY H H 36 8.169 8.169 8.930 -0.761 18347 792 1 13 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.560 -0.284 18347 793 1 13 . 1 1 37 37 LYS H H 37 8.396 8.396 7.964 0.432 18347 794 1 14 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.790 -0.840 18347 795 1 14 . 1 1 2 2 PHE H H 2 8.596 8.596 8.360 0.236 18347 796 1 14 . 1 1 3 3 GLY H H 3 8.018 8.018 8.332 -0.314 18347 797 1 14 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.937 -0.594 18347 798 1 14 . 1 1 4 4 CYS H H 4 7.645 7.645 8.597 -0.952 18347 799 1 14 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.384 0.320 18347 800 1 14 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.257 0.399 18347 801 1 14 . 1 1 6 6 PHE H H 6 7.378 7.378 7.239 0.139 18347 802 1 14 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.943 0.131 18347 803 1 14 . 1 1 7 7 ASN H H 7 8.689 8.689 8.149 0.540 18347 804 1 14 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.074 -0.137 18347 805 1 14 . 1 1 8 8 GLU H H 8 8.572 8.572 8.990 -0.418 18347 806 1 14 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.521 -0.031 18347 807 1 14 . 1 1 9 9 ASN H H 9 8.767 8.767 8.225 0.542 18347 808 1 14 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.277 -0.106 18347 809 1 14 . 1 1 10 10 GLU H H 10 7.719 7.719 7.802 -0.083 18347 810 1 14 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.502 0.374 18347 811 1 14 . 1 1 11 11 CYS H H 11 7.274 7.274 8.071 -0.797 18347 812 1 14 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.381 -0.391 18347 813 1 14 . 1 1 12 12 HIS H H 12 8.666 8.666 9.065 -0.399 18347 814 1 14 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.043 -0.048 18347 815 1 14 . 1 1 13 13 ALA H H 13 8.460 8.460 8.826 -0.366 18347 816 1 14 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.319 -0.013 18347 817 1 14 . 1 1 14 14 HIS H H 14 8.278 8.278 8.280 -0.002 18347 818 1 14 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.980 -0.044 18347 819 1 14 . 1 1 15 15 CYS H H 15 8.314 8.314 8.219 0.095 18347 820 1 14 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.472 -0.293 18347 821 1 14 . 1 1 16 16 LEU H H 16 8.030 8.030 8.394 -0.364 18347 822 1 14 . 1 1 17 17 SER HA H 17 4.251 4.251 4.300 -0.049 18347 823 1 14 . 1 1 17 17 SER H H 17 7.951 7.951 8.071 -0.120 18347 824 1 14 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.527 0.081 18347 825 1 14 . 1 1 18 18 ILE H H 18 7.008 7.008 7.284 -0.276 18347 826 1 14 . 1 1 19 19 GLY H H 19 7.695 7.695 7.879 -0.184 18347 827 1 14 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.169 0.469 18347 828 1 14 . 1 1 20 20 ARG H H 20 8.020 8.020 7.370 0.650 18347 829 1 14 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.173 -0.149 18347 830 1 14 . 1 1 21 21 LYS H H 21 8.317 8.317 8.682 -0.365 18347 831 1 14 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.642 -0.023 18347 832 1 14 . 1 1 22 22 PHE H H 22 7.901 7.901 7.314 0.587 18347 833 1 14 . 1 1 23 23 GLY H H 23 7.972 7.972 8.239 -0.267 18347 834 1 14 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.340 -0.328 18347 835 1 14 . 1 1 24 24 PHE H H 24 8.715 8.715 8.380 0.335 18347 836 1 14 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.781 0.415 18347 837 1 14 . 1 1 25 25 CYS H H 25 8.773 8.773 8.629 0.144 18347 838 1 14 . 1 1 26 26 ALA HA H 26 4.706 4.706 5.034 -0.328 18347 839 1 14 . 1 1 26 26 ALA H H 26 9.227 9.227 8.932 0.295 18347 840 1 14 . 1 1 27 27 GLY H H 27 8.273 8.273 8.428 -0.155 18347 841 1 14 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.521 -0.181 18347 842 1 14 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.422 -0.518 18347 843 1 14 . 1 1 29 29 LEU H H 29 9.231 9.231 8.428 0.803 18347 844 1 14 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.043 -0.353 18347 845 1 14 . 1 1 32 32 THR HA H 32 4.306 4.306 4.393 -0.087 18347 846 1 14 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.350 0.601 18347 847 1 14 . 1 1 33 33 CYS H H 33 9.122 9.122 8.860 0.262 18347 848 1 14 . 1 1 34 34 THR HA H 34 4.317 4.317 4.574 -0.257 18347 849 1 14 . 1 1 34 34 THR H H 34 9.245 9.245 8.938 0.307 18347 850 1 14 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.530 0.853 18347 851 1 14 . 1 1 35 35 CYS H H 35 8.797 8.797 9.009 -0.212 18347 852 1 14 . 1 1 36 36 GLY H H 36 8.169 8.169 8.665 -0.496 18347 853 1 14 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.507 -0.231 18347 854 1 14 . 1 1 37 37 LYS H H 37 8.396 8.396 8.225 0.171 18347 855 1 15 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.250 -0.300 18347 856 1 15 . 1 1 2 2 PHE H H 2 8.596 8.596 8.578 0.018 18347 857 1 15 . 1 1 3 3 GLY H H 3 8.018 8.018 7.890 0.128 18347 858 1 15 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.499 -0.156 18347 859 1 15 . 1 1 4 4 CYS H H 4 7.645 7.645 8.113 -0.468 18347 860 1 15 . 1 1 5 5 PRO HA H 5 4.704 4.704 5.131 -0.427 18347 861 1 15 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.226 0.430 18347 862 1 15 . 1 1 6 6 PHE H H 6 7.378 7.378 7.505 -0.127 18347 863 1 15 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.996 0.078 18347 864 1 15 . 1 1 7 7 ASN H H 7 8.689 8.689 8.397 0.292 18347 865 1 15 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.105 -0.168 18347 866 1 15 . 1 1 8 8 GLU H H 8 8.572 8.572 7.800 0.772 18347 867 1 15 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.505 -0.015 18347 868 1 15 . 1 1 9 9 ASN H H 9 8.767 8.767 8.900 -0.133 18347 869 1 15 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.107 0.064 18347 870 1 15 . 1 1 10 10 GLU H H 10 7.719 7.719 8.559 -0.840 18347 871 1 15 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.357 0.519 18347 872 1 15 . 1 1 11 11 CYS H H 11 7.274 7.274 8.479 -1.205 18347 873 1 15 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.492 -0.501 18347 874 1 15 . 1 1 12 12 HIS H H 12 8.666 8.666 8.717 -0.051 18347 875 1 15 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.000 -0.005 18347 876 1 15 . 1 1 13 13 ALA H H 13 8.460 8.460 8.590 -0.130 18347 877 1 15 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.262 0.044 18347 878 1 15 . 1 1 14 14 HIS H H 14 8.278 8.278 8.437 -0.159 18347 879 1 15 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.909 0.027 18347 880 1 15 . 1 1 15 15 CYS H H 15 8.314 8.314 7.997 0.317 18347 881 1 15 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.449 -0.270 18347 882 1 15 . 1 1 16 16 LEU H H 16 8.030 8.030 8.242 -0.212 18347 883 1 15 . 1 1 17 17 SER HA H 17 4.251 4.251 4.264 -0.013 18347 884 1 15 . 1 1 17 17 SER H H 17 7.951 7.951 8.139 -0.188 18347 885 1 15 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.452 0.156 18347 886 1 15 . 1 1 18 18 ILE H H 18 7.008 7.008 7.308 -0.300 18347 887 1 15 . 1 1 19 19 GLY H H 19 7.695 7.695 7.825 -0.130 18347 888 1 15 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.295 0.343 18347 889 1 15 . 1 1 20 20 ARG H H 20 8.020 8.020 7.626 0.394 18347 890 1 15 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.166 -0.142 18347 891 1 15 . 1 1 21 21 LYS H H 21 8.317 8.317 8.822 -0.505 18347 892 1 15 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.407 0.212 18347 893 1 15 . 1 1 22 22 PHE H H 22 7.901 7.901 7.188 0.713 18347 894 1 15 . 1 1 23 23 GLY H H 23 7.972 7.972 8.003 -0.031 18347 895 1 15 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.041 -0.029 18347 896 1 15 . 1 1 24 24 PHE H H 24 8.715 8.715 8.601 0.114 18347 897 1 15 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.250 -0.054 18347 898 1 15 . 1 1 25 25 CYS H H 25 8.773 8.773 8.536 0.237 18347 899 1 15 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.845 -0.139 18347 900 1 15 . 1 1 26 26 ALA H H 26 9.227 9.227 9.075 0.152 18347 901 1 15 . 1 1 27 27 GLY H H 27 8.273 8.273 8.003 0.270 18347 902 1 15 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.663 -0.323 18347 903 1 15 . 1 1 29 29 LEU HA H 29 3.904 3.904 3.854 0.050 18347 904 1 15 . 1 1 29 29 LEU H H 29 9.231 9.231 8.694 0.537 18347 905 1 15 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.362 -0.672 18347 906 1 15 . 1 1 32 32 THR HA H 32 4.306 4.306 4.405 -0.099 18347 907 1 15 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.721 0.230 18347 908 1 15 . 1 1 33 33 CYS H H 33 9.122 9.122 8.317 0.805 18347 909 1 15 . 1 1 34 34 THR HA H 34 4.317 4.317 4.508 -0.191 18347 910 1 15 . 1 1 34 34 THR H H 34 9.245 9.245 9.125 0.120 18347 911 1 15 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.454 0.929 18347 912 1 15 . 1 1 35 35 CYS H H 35 8.797 8.797 8.722 0.075 18347 913 1 15 . 1 1 36 36 GLY H H 36 8.169 8.169 7.894 0.275 18347 914 1 15 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.637 -0.361 18347 915 1 15 . 1 1 37 37 LYS H H 37 8.396 8.396 8.352 0.044 18347 916 1 16 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.499 -0.549 18347 917 1 16 . 1 1 2 2 PHE H H 2 8.596 8.596 8.933 -0.337 18347 918 1 16 . 1 1 3 3 GLY H H 3 8.018 8.018 8.250 -0.232 18347 919 1 16 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.629 -0.286 18347 920 1 16 . 1 1 4 4 CYS H H 4 7.645 7.645 8.593 -0.948 18347 921 1 16 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.544 0.160 18347 922 1 16 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.389 0.267 18347 923 1 16 . 1 1 6 6 PHE H H 6 7.378 7.378 7.254 0.124 18347 924 1 16 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.010 0.064 18347 925 1 16 . 1 1 7 7 ASN H H 7 8.689 8.689 8.388 0.301 18347 926 1 16 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.177 -0.240 18347 927 1 16 . 1 1 8 8 GLU H H 8 8.572 8.572 8.697 -0.125 18347 928 1 16 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.449 0.041 18347 929 1 16 . 1 1 9 9 ASN H H 9 8.767 8.767 8.522 0.245 18347 930 1 16 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.235 -0.064 18347 931 1 16 . 1 1 10 10 GLU H H 10 7.719 7.719 8.249 -0.530 18347 932 1 16 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.292 0.584 18347 933 1 16 . 1 1 11 11 CYS H H 11 7.274 7.274 8.459 -1.185 18347 934 1 16 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.349 -0.358 18347 935 1 16 . 1 1 12 12 HIS H H 12 8.666 8.666 8.477 0.189 18347 936 1 16 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.075 -0.080 18347 937 1 16 . 1 1 13 13 ALA H H 13 8.460 8.460 8.620 -0.160 18347 938 1 16 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.361 -0.055 18347 939 1 16 . 1 1 14 14 HIS H H 14 8.278 8.278 8.805 -0.527 18347 940 1 16 . 1 1 15 15 CYS HA H 15 3.936 3.936 4.031 -0.095 18347 941 1 16 . 1 1 15 15 CYS H H 15 8.314 8.314 8.204 0.110 18347 942 1 16 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.516 -0.337 18347 943 1 16 . 1 1 16 16 LEU H H 16 8.030 8.030 8.242 -0.212 18347 944 1 16 . 1 1 17 17 SER HA H 17 4.251 4.251 4.314 -0.063 18347 945 1 16 . 1 1 17 17 SER H H 17 7.951 7.951 7.665 0.286 18347 946 1 16 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.556 0.052 18347 947 1 16 . 1 1 18 18 ILE H H 18 7.008 7.008 7.347 -0.339 18347 948 1 16 . 1 1 19 19 GLY H H 19 7.695 7.695 7.582 0.113 18347 949 1 16 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.268 0.370 18347 950 1 16 . 1 1 20 20 ARG H H 20 8.020 8.020 7.681 0.339 18347 951 1 16 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.168 -0.144 18347 952 1 16 . 1 1 21 21 LYS H H 21 8.317 8.317 8.513 -0.196 18347 953 1 16 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.709 -0.090 18347 954 1 16 . 1 1 22 22 PHE H H 22 7.901 7.901 7.338 0.563 18347 955 1 16 . 1 1 23 23 GLY H H 23 7.972 7.972 8.198 -0.226 18347 956 1 16 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.085 -0.073 18347 957 1 16 . 1 1 24 24 PHE H H 24 8.715 8.715 8.330 0.385 18347 958 1 16 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.110 0.086 18347 959 1 16 . 1 1 25 25 CYS H H 25 8.773 8.773 8.492 0.281 18347 960 1 16 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.866 -0.160 18347 961 1 16 . 1 1 26 26 ALA H H 26 9.227 9.227 8.937 0.290 18347 962 1 16 . 1 1 27 27 GLY H H 27 8.273 8.273 8.109 0.164 18347 963 1 16 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.410 -0.070 18347 964 1 16 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.324 -0.420 18347 965 1 16 . 1 1 29 29 LEU H H 29 9.231 9.231 8.035 1.196 18347 966 1 16 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.600 -0.910 18347 967 1 16 . 1 1 32 32 THR HA H 32 4.306 4.306 4.645 -0.339 18347 968 1 16 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.606 0.345 18347 969 1 16 . 1 1 33 33 CYS H H 33 9.122 9.122 8.912 0.210 18347 970 1 16 . 1 1 34 34 THR HA H 34 4.317 4.317 4.550 -0.233 18347 971 1 16 . 1 1 34 34 THR H H 34 9.245 9.245 9.008 0.237 18347 972 1 16 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.675 0.708 18347 973 1 16 . 1 1 35 35 CYS H H 35 8.797 8.797 8.872 -0.075 18347 974 1 16 . 1 1 36 36 GLY H H 36 8.169 8.169 8.675 -0.506 18347 975 1 16 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.533 -0.257 18347 976 1 16 . 1 1 37 37 LYS H H 37 8.396 8.396 7.713 0.683 18347 977 1 17 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.906 -0.956 18347 978 1 17 . 1 1 2 2 PHE H H 2 8.596 8.596 8.450 0.146 18347 979 1 17 . 1 1 3 3 GLY H H 3 8.018 8.018 8.225 -0.207 18347 980 1 17 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.663 -0.320 18347 981 1 17 . 1 1 4 4 CYS H H 4 7.645 7.645 8.076 -0.431 18347 982 1 17 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.481 0.223 18347 983 1 17 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.487 0.169 18347 984 1 17 . 1 1 6 6 PHE H H 6 7.378 7.378 7.740 -0.362 18347 985 1 17 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.745 0.329 18347 986 1 17 . 1 1 7 7 ASN H H 7 8.689 8.689 8.191 0.498 18347 987 1 17 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.161 -0.224 18347 988 1 17 . 1 1 8 8 GLU H H 8 8.572 8.572 7.746 0.826 18347 989 1 17 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.453 0.037 18347 990 1 17 . 1 1 9 9 ASN H H 9 8.767 8.767 8.571 0.196 18347 991 1 17 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.207 -0.036 18347 992 1 17 . 1 1 10 10 GLU H H 10 7.719 7.719 8.226 -0.507 18347 993 1 17 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.667 0.209 18347 994 1 17 . 1 1 11 11 CYS H H 11 7.274 7.274 8.276 -1.002 18347 995 1 17 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.532 -0.541 18347 996 1 17 . 1 1 12 12 HIS H H 12 8.666 8.666 8.551 0.115 18347 997 1 17 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.983 0.012 18347 998 1 17 . 1 1 13 13 ALA H H 13 8.460 8.460 8.610 -0.150 18347 999 1 17 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.208 0.098 18347 1000 1 17 . 1 1 14 14 HIS H H 14 8.278 8.278 8.484 -0.206 18347 1001 1 17 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.904 0.032 18347 1002 1 17 . 1 1 15 15 CYS H H 15 8.314 8.314 8.174 0.140 18347 1003 1 17 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.475 -0.296 18347 1004 1 17 . 1 1 16 16 LEU H H 16 8.030 8.030 8.322 -0.292 18347 1005 1 17 . 1 1 17 17 SER HA H 17 4.251 4.251 4.381 -0.130 18347 1006 1 17 . 1 1 17 17 SER H H 17 7.951 7.951 7.930 0.021 18347 1007 1 17 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.633 -0.025 18347 1008 1 17 . 1 1 18 18 ILE H H 18 7.008 7.008 7.377 -0.369 18347 1009 1 17 . 1 1 19 19 GLY H H 19 7.695 7.695 7.712 -0.017 18347 1010 1 17 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.213 0.425 18347 1011 1 17 . 1 1 20 20 ARG H H 20 8.020 8.020 7.511 0.509 18347 1012 1 17 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.122 -0.098 18347 1013 1 17 . 1 1 21 21 LYS H H 21 8.317 8.317 8.383 -0.066 18347 1014 1 17 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.530 0.089 18347 1015 1 17 . 1 1 22 22 PHE H H 22 7.901 7.901 7.436 0.465 18347 1016 1 17 . 1 1 23 23 GLY H H 23 7.972 7.972 7.838 0.134 18347 1017 1 17 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.185 -0.173 18347 1018 1 17 . 1 1 24 24 PHE H H 24 8.715 8.715 8.422 0.293 18347 1019 1 17 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.845 0.351 18347 1020 1 17 . 1 1 25 25 CYS H H 25 8.773 8.773 8.777 -0.004 18347 1021 1 17 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.207 0.499 18347 1022 1 17 . 1 1 26 26 ALA H H 26 9.227 9.227 8.477 0.750 18347 1023 1 17 . 1 1 27 27 GLY H H 27 8.273 8.273 7.746 0.527 18347 1024 1 17 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.310 0.030 18347 1025 1 17 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.535 -0.631 18347 1026 1 17 . 1 1 29 29 LEU H H 29 9.231 9.231 7.876 1.355 18347 1027 1 17 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.146 -0.456 18347 1028 1 17 . 1 1 32 32 THR HA H 32 4.306 4.306 4.567 -0.261 18347 1029 1 17 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.447 0.504 18347 1030 1 17 . 1 1 33 33 CYS H H 33 9.122 9.122 9.087 0.035 18347 1031 1 17 . 1 1 34 34 THR HA H 34 4.317 4.317 4.425 -0.108 18347 1032 1 17 . 1 1 34 34 THR H H 34 9.245 9.245 8.841 0.404 18347 1033 1 17 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.473 0.910 18347 1034 1 17 . 1 1 35 35 CYS H H 35 8.797 8.797 8.582 0.215 18347 1035 1 17 . 1 1 36 36 GLY H H 36 8.169 8.169 8.871 -0.702 18347 1036 1 17 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.494 -0.218 18347 1037 1 17 . 1 1 37 37 LYS H H 37 8.396 8.396 8.050 0.346 18347 1038 1 18 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.395 -0.445 18347 1039 1 18 . 1 1 2 2 PHE H H 2 8.596 8.596 8.418 0.178 18347 1040 1 18 . 1 1 3 3 GLY H H 3 8.018 8.018 7.911 0.107 18347 1041 1 18 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.686 -0.343 18347 1042 1 18 . 1 1 4 4 CYS H H 4 7.645 7.645 8.086 -0.441 18347 1043 1 18 . 1 1 5 5 PRO HA H 5 4.704 4.704 5.303 -0.599 18347 1044 1 18 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.559 0.097 18347 1045 1 18 . 1 1 6 6 PHE H H 6 7.378 7.378 7.877 -0.499 18347 1046 1 18 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.349 -0.275 18347 1047 1 18 . 1 1 7 7 ASN H H 7 8.689 8.689 8.243 0.446 18347 1048 1 18 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.140 -0.203 18347 1049 1 18 . 1 1 8 8 GLU H H 8 8.572 8.572 8.619 -0.047 18347 1050 1 18 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.492 -0.002 18347 1051 1 18 . 1 1 9 9 ASN H H 9 8.767 8.767 8.756 0.011 18347 1052 1 18 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.185 -0.014 18347 1053 1 18 . 1 1 10 10 GLU H H 10 7.719 7.719 8.328 -0.609 18347 1054 1 18 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.312 0.564 18347 1055 1 18 . 1 1 11 11 CYS H H 11 7.274 7.274 8.270 -0.996 18347 1056 1 18 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.326 -0.335 18347 1057 1 18 . 1 1 12 12 HIS H H 12 8.666 8.666 8.532 0.134 18347 1058 1 18 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.982 0.013 18347 1059 1 18 . 1 1 13 13 ALA H H 13 8.460 8.460 8.702 -0.242 18347 1060 1 18 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.358 -0.052 18347 1061 1 18 . 1 1 14 14 HIS H H 14 8.278 8.278 8.409 -0.131 18347 1062 1 18 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.973 -0.037 18347 1063 1 18 . 1 1 15 15 CYS H H 15 8.314 8.314 8.184 0.130 18347 1064 1 18 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.631 -0.452 18347 1065 1 18 . 1 1 16 16 LEU H H 16 8.030 8.030 8.106 -0.076 18347 1066 1 18 . 1 1 17 17 SER HA H 17 4.251 4.251 4.329 -0.078 18347 1067 1 18 . 1 1 17 17 SER H H 17 7.951 7.951 7.859 0.092 18347 1068 1 18 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.597 0.011 18347 1069 1 18 . 1 1 18 18 ILE H H 18 7.008 7.008 7.357 -0.349 18347 1070 1 18 . 1 1 19 19 GLY H H 19 7.695 7.695 7.753 -0.058 18347 1071 1 18 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.248 0.390 18347 1072 1 18 . 1 1 20 20 ARG H H 20 8.020 8.020 7.511 0.509 18347 1073 1 18 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.164 -0.140 18347 1074 1 18 . 1 1 21 21 LYS H H 21 8.317 8.317 8.502 -0.185 18347 1075 1 18 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.687 -0.068 18347 1076 1 18 . 1 1 22 22 PHE H H 22 7.901 7.901 7.535 0.366 18347 1077 1 18 . 1 1 23 23 GLY H H 23 7.972 7.972 8.219 -0.247 18347 1078 1 18 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.108 -0.096 18347 1079 1 18 . 1 1 24 24 PHE H H 24 8.715 8.715 8.556 0.159 18347 1080 1 18 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.882 0.314 18347 1081 1 18 . 1 1 25 25 CYS H H 25 8.773 8.773 8.613 0.160 18347 1082 1 18 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.582 0.124 18347 1083 1 18 . 1 1 26 26 ALA H H 26 9.227 9.227 8.655 0.572 18347 1084 1 18 . 1 1 27 27 GLY H H 27 8.273 8.273 7.808 0.466 18347 1085 1 18 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.393 -0.053 18347 1086 1 18 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.266 -0.362 18347 1087 1 18 . 1 1 29 29 LEU H H 29 9.231 9.231 7.761 1.470 18347 1088 1 18 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.466 -0.776 18347 1089 1 18 . 1 1 32 32 THR HA H 32 4.306 4.306 4.756 -0.450 18347 1090 1 18 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.521 0.430 18347 1091 1 18 . 1 1 33 33 CYS H H 33 9.122 9.122 8.802 0.320 18347 1092 1 18 . 1 1 34 34 THR HA H 34 4.317 4.317 4.551 -0.234 18347 1093 1 18 . 1 1 34 34 THR H H 34 9.245 9.245 9.020 0.225 18347 1094 1 18 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.739 0.644 18347 1095 1 18 . 1 1 35 35 CYS H H 35 8.797 8.797 8.532 0.265 18347 1096 1 18 . 1 1 36 36 GLY H H 36 8.169 8.169 8.777 -0.608 18347 1097 1 18 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.477 -0.201 18347 1098 1 18 . 1 1 37 37 LYS H H 37 8.396 8.396 8.090 0.306 18347 1099 1 19 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.354 -0.404 18347 1100 1 19 . 1 1 2 2 PHE H H 2 8.596 8.596 8.491 0.105 18347 1101 1 19 . 1 1 3 3 GLY H H 3 8.018 8.018 8.609 -0.591 18347 1102 1 19 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.592 -0.249 18347 1103 1 19 . 1 1 4 4 CYS H H 4 7.645 7.645 8.558 -0.913 18347 1104 1 19 . 1 1 5 5 PRO HA H 5 4.704 4.704 5.093 -0.389 18347 1105 1 19 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.263 0.393 18347 1106 1 19 . 1 1 6 6 PHE H H 6 7.378 7.378 7.437 -0.059 18347 1107 1 19 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.140 -0.066 18347 1108 1 19 . 1 1 7 7 ASN H H 7 8.689 8.689 8.530 0.159 18347 1109 1 19 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.017 -0.080 18347 1110 1 19 . 1 1 8 8 GLU H H 8 8.572 8.572 7.961 0.611 18347 1111 1 19 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.508 -0.018 18347 1112 1 19 . 1 1 9 9 ASN H H 9 8.767 8.767 8.940 -0.173 18347 1113 1 19 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.187 -0.016 18347 1114 1 19 . 1 1 10 10 GLU H H 10 7.719 7.719 8.642 -0.923 18347 1115 1 19 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.333 0.543 18347 1116 1 19 . 1 1 11 11 CYS H H 11 7.274 7.274 8.294 -1.020 18347 1117 1 19 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.503 -0.512 18347 1118 1 19 . 1 1 12 12 HIS H H 12 8.666 8.666 8.704 -0.038 18347 1119 1 19 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.990 0.005 18347 1120 1 19 . 1 1 13 13 ALA H H 13 8.460 8.460 8.636 -0.176 18347 1121 1 19 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.279 0.027 18347 1122 1 19 . 1 1 14 14 HIS H H 14 8.278 8.278 8.331 -0.053 18347 1123 1 19 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.989 -0.053 18347 1124 1 19 . 1 1 15 15 CYS H H 15 8.314 8.314 8.098 0.216 18347 1125 1 19 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.599 -0.420 18347 1126 1 19 . 1 1 16 16 LEU H H 16 8.030 8.030 8.186 -0.156 18347 1127 1 19 . 1 1 17 17 SER HA H 17 4.251 4.251 4.289 -0.038 18347 1128 1 19 . 1 1 17 17 SER H H 17 7.951 7.951 7.792 0.159 18347 1129 1 19 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.531 0.077 18347 1130 1 19 . 1 1 18 18 ILE H H 18 7.008 7.008 7.289 -0.281 18347 1131 1 19 . 1 1 19 19 GLY H H 19 7.695 7.695 7.853 -0.158 18347 1132 1 19 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.262 0.376 18347 1133 1 19 . 1 1 20 20 ARG H H 20 8.020 8.020 7.419 0.601 18347 1134 1 19 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.146 -0.122 18347 1135 1 19 . 1 1 21 21 LYS H H 21 8.317 8.317 8.481 -0.164 18347 1136 1 19 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.536 0.083 18347 1137 1 19 . 1 1 22 22 PHE H H 22 7.901 7.901 7.359 0.542 18347 1138 1 19 . 1 1 23 23 GLY H H 23 7.972 7.972 8.247 -0.275 18347 1139 1 19 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.256 -0.244 18347 1140 1 19 . 1 1 24 24 PHE H H 24 8.715 8.715 8.452 0.263 18347 1141 1 19 . 1 1 25 25 CYS HA H 25 5.196 5.196 5.004 0.192 18347 1142 1 19 . 1 1 25 25 CYS H H 25 8.773 8.773 8.824 -0.051 18347 1143 1 19 . 1 1 26 26 ALA HA H 26 4.706 4.706 5.094 -0.388 18347 1144 1 19 . 1 1 26 26 ALA H H 26 9.227 9.227 8.971 0.256 18347 1145 1 19 . 1 1 27 27 GLY H H 27 8.273 8.273 7.994 0.279 18347 1146 1 19 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.366 -0.026 18347 1147 1 19 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.558 -0.654 18347 1148 1 19 . 1 1 29 29 LEU H H 29 9.231 9.231 7.616 1.615 18347 1149 1 19 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.553 -0.863 18347 1150 1 19 . 1 1 32 32 THR HA H 32 4.306 4.306 4.586 -0.280 18347 1151 1 19 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.307 0.644 18347 1152 1 19 . 1 1 33 33 CYS H H 33 9.122 9.122 8.483 0.639 18347 1153 1 19 . 1 1 34 34 THR HA H 34 4.317 4.317 4.480 -0.163 18347 1154 1 19 . 1 1 34 34 THR H H 34 9.245 9.245 8.954 0.291 18347 1155 1 19 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.633 0.750 18347 1156 1 19 . 1 1 35 35 CYS H H 35 8.797 8.797 8.800 -0.003 18347 1157 1 19 . 1 1 36 36 GLY H H 36 8.169 8.169 8.789 -0.620 18347 1158 1 19 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.571 -0.295 18347 1159 1 19 . 1 1 37 37 LYS H H 37 8.396 8.396 8.251 0.145 18347 1160 1 20 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.439 -0.489 18347 1161 1 20 . 1 1 2 2 PHE H H 2 8.596 8.596 8.570 0.026 18347 1162 1 20 . 1 1 3 3 GLY H H 3 8.018 8.018 7.893 0.125 18347 1163 1 20 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.601 -0.258 18347 1164 1 20 . 1 1 4 4 CYS H H 4 7.645 7.645 8.144 -0.499 18347 1165 1 20 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.647 0.057 18347 1166 1 20 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.358 0.298 18347 1167 1 20 . 1 1 6 6 PHE H H 6 7.378 7.378 7.646 -0.268 18347 1168 1 20 . 1 1 7 7 ASN HA H 7 5.074 5.074 5.034 0.040 18347 1169 1 20 . 1 1 7 7 ASN H H 7 8.689 8.689 8.419 0.270 18347 1170 1 20 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.201 -0.264 18347 1171 1 20 . 1 1 8 8 GLU H H 8 8.572 8.572 8.486 0.086 18347 1172 1 20 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.501 -0.011 18347 1173 1 20 . 1 1 9 9 ASN H H 9 8.767 8.767 8.594 0.173 18347 1174 1 20 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.220 -0.049 18347 1175 1 20 . 1 1 10 10 GLU H H 10 7.719 7.719 8.349 -0.630 18347 1176 1 20 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.346 0.530 18347 1177 1 20 . 1 1 11 11 CYS H H 11 7.274 7.274 8.456 -1.182 18347 1178 1 20 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.363 -0.372 18347 1179 1 20 . 1 1 12 12 HIS H H 12 8.666 8.666 8.507 0.159 18347 1180 1 20 . 1 1 13 13 ALA HA H 13 3.995 3.995 4.040 -0.045 18347 1181 1 20 . 1 1 13 13 ALA H H 13 8.460 8.460 8.705 -0.245 18347 1182 1 20 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.344 -0.038 18347 1183 1 20 . 1 1 14 14 HIS H H 14 8.278 8.278 8.353 -0.075 18347 1184 1 20 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.910 0.026 18347 1185 1 20 . 1 1 15 15 CYS H H 15 8.314 8.314 8.229 0.085 18347 1186 1 20 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.610 -0.431 18347 1187 1 20 . 1 1 16 16 LEU H H 16 8.030 8.030 8.133 -0.103 18347 1188 1 20 . 1 1 17 17 SER HA H 17 4.251 4.251 4.306 -0.055 18347 1189 1 20 . 1 1 17 17 SER H H 17 7.951 7.951 7.706 0.245 18347 1190 1 20 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.438 0.170 18347 1191 1 20 . 1 1 18 18 ILE H H 18 7.008 7.008 7.354 -0.346 18347 1192 1 20 . 1 1 19 19 GLY H H 19 7.695 7.695 7.910 -0.215 18347 1193 1 20 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.569 0.069 18347 1194 1 20 . 1 1 20 20 ARG H H 20 8.020 8.020 7.337 0.683 18347 1195 1 20 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.231 -0.207 18347 1196 1 20 . 1 1 21 21 LYS H H 21 8.317 8.317 8.468 -0.151 18347 1197 1 20 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.694 -0.075 18347 1198 1 20 . 1 1 22 22 PHE H H 22 7.901 7.901 7.389 0.512 18347 1199 1 20 . 1 1 23 23 GLY H H 23 7.972 7.972 8.234 -0.262 18347 1200 1 20 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.053 -0.041 18347 1201 1 20 . 1 1 24 24 PHE H H 24 8.715 8.715 8.493 0.222 18347 1202 1 20 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.737 0.459 18347 1203 1 20 . 1 1 25 25 CYS H H 25 8.773 8.773 8.612 0.161 18347 1204 1 20 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.594 0.112 18347 1205 1 20 . 1 1 26 26 ALA H H 26 9.227 9.227 8.544 0.683 18347 1206 1 20 . 1 1 27 27 GLY H H 27 8.273 8.273 7.807 0.466 18347 1207 1 20 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.442 -0.102 18347 1208 1 20 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.362 -0.458 18347 1209 1 20 . 1 1 29 29 LEU H H 29 9.231 9.231 7.659 1.572 18347 1210 1 20 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.594 -0.904 18347 1211 1 20 . 1 1 32 32 THR HA H 32 4.306 4.306 4.587 -0.281 18347 1212 1 20 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.541 0.410 18347 1213 1 20 . 1 1 33 33 CYS H H 33 9.122 9.122 8.713 0.409 18347 1214 1 20 . 1 1 34 34 THR HA H 34 4.317 4.317 4.532 -0.215 18347 1215 1 20 . 1 1 34 34 THR H H 34 9.245 9.245 8.874 0.371 18347 1216 1 20 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.732 0.651 18347 1217 1 20 . 1 1 35 35 CYS H H 35 8.797 8.797 8.403 0.394 18347 1218 1 20 . 1 1 36 36 GLY H H 36 8.169 8.169 8.784 -0.615 18347 1219 1 20 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.446 -0.170 18347 1220 1 20 . 1 1 37 37 LYS H H 37 8.396 8.396 8.041 0.355 18347 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 18347 2 1 1 "Average Difference" HA 40 0.386 -0.030 0.390 18347 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18347 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18347 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18347 6 1 1 "Average Difference" HN 31 0.546 -0.030 0.554 18347 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18347 8 1 2 "Average Difference" HA 40 0.363 0.006 0.368 18347 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18347 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18347 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18347 12 1 2 "Average Difference" HN 31 0.501 -0.070 0.504 18347 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18347 14 1 3 "Average Difference" HA 40 0.377 -0.023 0.381 18347 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18347 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18347 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18347 18 1 3 "Average Difference" HN 31 0.359 0.011 0.364 18347 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18347 20 1 4 "Average Difference" HA 40 0.400 0.042 0.403 18347 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18347 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18347 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18347 24 1 4 "Average Difference" HN 31 0.454 -0.057 0.458 18347 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18347 26 1 5 "Average Difference" HA 40 0.360 -0.057 0.360 18347 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18347 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18347 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18347 30 1 5 "Average Difference" HN 31 0.493 -0.108 0.489 18347 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18347 32 1 6 "Average Difference" HA 40 0.379 -0.018 0.383 18347 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18347 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18347 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18347 36 1 6 "Average Difference" HN 31 0.482 -0.002 0.490 18347 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18347 38 1 7 "Average Difference" HA 40 0.358 -0.013 0.362 18347 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18347 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18347 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18347 42 1 7 "Average Difference" HN 31 0.390 -0.019 0.396 18347 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18347 44 1 8 "Average Difference" HA 40 0.381 -0.028 0.385 18347 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18347 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18347 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18347 48 1 8 "Average Difference" HN 31 0.441 -0.006 0.448 18347 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18347 50 1 9 "Average Difference" HA 40 0.344 -0.001 0.348 18347 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18347 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18347 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18347 54 1 9 "Average Difference" HN 31 0.475 0.019 0.482 18347 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18347 56 1 10 "Average Difference" HA 40 0.383 -0.008 0.387 18347 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18347 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18347 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18347 60 1 10 "Average Difference" HN 31 0.491 -0.047 0.496 18347 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18347 62 1 11 "Average Difference" HA 40 0.342 -0.012 0.346 18347 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18347 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18347 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18347 66 1 11 "Average Difference" HN 31 0.440 -0.008 0.447 18347 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18347 68 1 12 "Average Difference" HA 40 0.347 0.002 0.351 18347 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18347 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18347 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18347 72 1 12 "Average Difference" HN 31 0.438 -0.037 0.444 18347 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18347 74 1 13 "Average Difference" HA 40 0.343 -0.038 0.346 18347 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18347 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18347 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18347 78 1 13 "Average Difference" HN 31 0.451 -0.056 0.455 18347 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18347 80 1 14 "Average Difference" HA 40 0.396 -0.009 0.401 18347 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18347 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18347 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18347 84 1 14 "Average Difference" HN 31 0.417 0.021 0.423 18347 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18347 86 1 15 "Average Difference" HA 40 0.344 -0.014 0.348 18347 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18347 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18347 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18347 90 1 15 "Average Difference" HN 31 0.423 -0.025 0.430 18347 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18347 92 1 16 "Average Difference" HA 40 0.356 0.022 0.360 18347 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18347 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18347 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18347 96 1 16 "Average Difference" HN 31 0.463 -0.004 0.471 18347 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18347 98 1 17 "Average Difference" HA 40 0.394 -0.019 0.398 18347 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18347 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18347 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18347 102 1 17 "Average Difference" HN 31 0.476 -0.086 0.476 18347 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18347 104 1 18 "Average Difference" HA 40 0.368 0.047 0.369 18347 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18347 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18347 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18347 108 1 18 "Average Difference" HN 31 0.448 -0.046 0.453 18347 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18347 110 1 19 "Average Difference" HA 40 0.380 0.017 0.385 18347 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18347 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18347 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18347 114 1 19 "Average Difference" HN 31 0.515 -0.007 0.524 18347 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18347 116 1 20 "Average Difference" HA 40 0.361 0.023 0.365 18347 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18347 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18347 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18347 120 1 20 "Average Difference" HN 31 0.495 -0.078 0.497 18347 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 18347 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 PHE HA H 2 3.950 3.950 4.491 -0.541 18347 2 1 . 1 1 2 2 PHE H H 2 8.596 8.596 8.570 0.026 18347 3 1 . 1 1 3 3 GLY H H 3 8.018 8.018 8.137 -0.119 18347 4 1 . 1 1 4 4 CYS HA H 4 4.343 4.343 4.653 -0.310 18347 5 1 . 1 1 4 4 CYS H H 4 7.645 7.645 8.154 -0.509 18347 6 1 . 1 1 5 5 PRO HA H 5 4.704 4.704 4.731 -0.027 18347 7 1 . 1 1 6 6 PHE HA H 6 4.656 4.656 4.369 0.287 18347 8 1 . 1 1 6 6 PHE H H 6 7.378 7.378 7.506 -0.128 18347 9 1 . 1 1 7 7 ASN HA H 7 5.074 5.074 4.993 0.081 18347 10 1 . 1 1 7 7 ASN H H 7 8.689 8.689 8.341 0.348 18347 11 1 . 1 1 8 8 GLU HA H 8 3.937 3.937 4.120 -0.183 18347 12 1 . 1 1 8 8 GLU H H 8 8.572 8.572 8.312 0.260 18347 13 1 . 1 1 9 9 ASN HA H 9 4.490 4.490 4.505 -0.015 18347 14 1 . 1 1 9 9 ASN H H 9 8.767 8.767 8.627 0.140 18347 15 1 . 1 1 10 10 GLU HA H 10 4.171 4.171 4.201 -0.030 18347 16 1 . 1 1 10 10 GLU H H 10 7.719 7.719 8.164 -0.445 18347 17 1 . 1 1 11 11 CYS HA H 11 4.876 4.876 4.352 0.524 18347 18 1 . 1 1 11 11 CYS H H 11 7.274 7.274 8.291 -1.017 18347 19 1 . 1 1 12 12 HIS HA H 12 3.991 3.991 4.407 -0.417 18347 20 1 . 1 1 12 12 HIS H H 12 8.666 8.666 8.712 -0.046 18347 21 1 . 1 1 13 13 ALA HA H 13 3.995 3.995 3.998 -0.003 18347 22 1 . 1 1 13 13 ALA H H 13 8.460 8.460 8.592 -0.132 18347 23 1 . 1 1 14 14 HIS HA H 14 4.306 4.306 4.311 -0.005 18347 24 1 . 1 1 14 14 HIS H H 14 8.278 8.278 8.446 -0.168 18347 25 1 . 1 1 15 15 CYS HA H 15 3.936 3.936 3.977 -0.041 18347 26 1 . 1 1 15 15 CYS H H 15 8.314 8.314 8.191 0.123 18347 27 1 . 1 1 16 16 LEU HA H 16 4.179 4.179 4.472 -0.293 18347 28 1 . 1 1 16 16 LEU H H 16 8.030 8.030 8.275 -0.245 18347 29 1 . 1 1 17 17 SER HA H 17 4.251 4.251 4.304 -0.053 18347 30 1 . 1 1 17 17 SER H H 17 7.951 7.951 7.824 0.127 18347 31 1 . 1 1 18 18 ILE HA H 18 4.608 4.608 4.532 0.076 18347 32 1 . 1 1 18 18 ILE H H 18 7.008 7.008 7.341 -0.333 18347 33 1 . 1 1 19 19 GLY H H 19 7.695 7.695 7.791 -0.096 18347 34 1 . 1 1 20 20 ARG HA H 20 4.638 4.638 4.312 0.326 18347 35 1 . 1 1 20 20 ARG H H 20 8.020 8.020 7.572 0.448 18347 36 1 . 1 1 21 21 LYS HA H 21 4.024 4.024 4.130 -0.106 18347 37 1 . 1 1 21 21 LYS H H 21 8.317 8.317 8.528 -0.211 18347 38 1 . 1 1 22 22 PHE HA H 22 4.619 4.619 4.660 -0.042 18347 39 1 . 1 1 22 22 PHE H H 22 7.901 7.901 7.409 0.492 18347 40 1 . 1 1 23 23 GLY H H 23 7.972 7.972 8.176 -0.204 18347 41 1 . 1 1 24 24 PHE HA H 24 5.012 5.012 5.171 -0.159 18347 42 1 . 1 1 24 24 PHE H H 24 8.715 8.715 8.374 0.341 18347 43 1 . 1 1 25 25 CYS HA H 25 5.196 5.196 4.890 0.306 18347 44 1 . 1 1 25 25 CYS H H 25 8.773 8.773 8.717 0.056 18347 45 1 . 1 1 26 26 ALA HA H 26 4.706 4.706 4.763 -0.057 18347 46 1 . 1 1 26 26 ALA H H 26 9.227 9.227 8.767 0.460 18347 47 1 . 1 1 27 27 GLY H H 27 8.273 8.273 8.143 0.130 18347 48 1 . 1 1 28 28 PRO HA H 28 4.340 4.340 4.429 -0.089 18347 49 1 . 1 1 29 29 LEU HA H 29 3.904 3.904 4.352 -0.448 18347 50 1 . 1 1 29 29 LEU H H 29 9.231 9.231 7.958 1.273 18347 51 1 . 1 1 31 31 ALA HA H 31 3.690 3.690 4.411 -0.721 18347 52 1 . 1 1 32 32 THR HA H 32 4.306 4.306 4.519 -0.213 18347 53 1 . 1 1 33 33 CYS HA H 33 4.951 4.951 4.542 0.409 18347 54 1 . 1 1 33 33 CYS H H 33 9.122 9.122 8.787 0.335 18347 55 1 . 1 1 34 34 THR HA H 34 4.317 4.317 4.539 -0.222 18347 56 1 . 1 1 34 34 THR H H 34 9.245 9.245 8.916 0.329 18347 57 1 . 1 1 35 35 CYS HA H 35 5.383 5.383 4.649 0.734 18347 58 1 . 1 1 35 35 CYS H H 35 8.797 8.797 8.800 -0.003 18347 59 1 . 1 1 36 36 GLY H H 36 8.169 8.169 8.767 -0.598 18347 60 1 . 1 1 37 37 LYS HA H 37 4.276 4.276 4.542 -0.266 18347 61 1 . 1 1 37 37 LYS H H 37 8.396 8.396 8.045 0.351 18347 stop_ save_