data_18921 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18921 _Entry.PDB_ID 2M2M 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 18921 _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 ILE H H 2 8.508 8.508 8.369 0.139 18921 2 1 1 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.670 -0.072 18921 3 1 1 . 1 1 3 3 VAL H H 3 8.089 8.089 8.141 -0.052 18921 4 1 1 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.179 0.019 18921 5 1 1 . 1 1 4 4 GLU H H 4 8.271 8.271 8.727 -0.456 18921 6 1 1 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.283 -0.233 18921 7 1 1 . 1 1 5 5 GLN H H 5 8.272 8.272 7.440 0.832 18921 8 1 1 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.900 0.016 18921 9 1 1 . 1 1 6 6 CYS H H 6 8.273 8.273 8.027 0.246 18921 10 1 1 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.263 0.584 18921 11 1 1 . 1 1 7 7 CYS H H 7 8.269 8.269 8.419 -0.150 18921 12 1 1 . 1 1 8 8 THR HA H 8 4.045 4.045 4.285 -0.240 18921 13 1 1 . 1 1 8 8 THR H H 8 8.227 8.227 8.448 -0.221 18921 14 1 1 . 1 1 9 9 SER HA H 9 4.756 4.756 4.554 0.202 18921 15 1 1 . 1 1 9 9 SER H H 9 7.392 7.392 7.438 -0.046 18921 16 1 1 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.033 0.338 18921 17 1 1 . 1 1 10 10 ILE H H 10 7.792 7.792 8.152 -0.360 18921 18 1 1 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.921 -0.002 18921 19 1 1 . 1 1 11 11 CYS H H 11 9.679 9.679 8.255 1.424 18921 20 1 1 . 1 1 12 12 SER HA H 12 4.579 4.579 4.711 -0.132 18921 21 1 1 . 1 1 12 12 SER H H 12 8.753 8.753 8.252 0.501 18921 22 1 1 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.034 -0.180 18921 23 1 1 . 1 1 13 13 LEU H H 13 8.629 8.629 8.694 -0.065 18921 24 1 1 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.676 -0.533 18921 25 1 1 . 1 1 14 14 TYR H H 14 7.488 7.488 8.386 -0.898 18921 26 1 1 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.426 -0.468 18921 27 1 1 . 1 1 15 15 GLN H H 15 7.560 7.560 7.656 -0.096 18921 28 1 1 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.317 -0.148 18921 29 1 1 . 1 1 16 16 LEU H H 16 8.151 8.151 8.390 -0.239 18921 30 1 1 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.913 0.228 18921 31 1 1 . 1 1 17 17 GLU H H 17 8.083 8.083 8.409 -0.326 18921 32 1 1 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.494 -0.052 18921 33 1 1 . 1 1 18 18 ASN H H 18 7.430 7.430 7.805 -0.375 18921 34 1 1 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.809 -0.315 18921 35 1 1 . 1 1 19 19 TYR H H 19 7.894 7.894 7.734 0.160 18921 36 1 1 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.485 0.160 18921 37 1 1 . 1 1 20 20 CYS H H 20 7.482 7.482 8.083 -0.601 18921 38 1 2 . 1 1 2 2 ILE H H 2 8.508 8.508 8.477 0.031 18921 39 1 2 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.604 -0.006 18921 40 1 2 . 1 1 3 3 VAL H H 3 8.089 8.089 7.844 0.245 18921 41 1 2 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.150 0.048 18921 42 1 2 . 1 1 4 4 GLU H H 4 8.271 8.271 7.606 0.665 18921 43 1 2 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.235 -0.185 18921 44 1 2 . 1 1 5 5 GLN H H 5 8.272 8.272 7.598 0.674 18921 45 1 2 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.930 -0.014 18921 46 1 2 . 1 1 6 6 CYS H H 6 8.273 8.273 8.307 -0.034 18921 47 1 2 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.484 0.363 18921 48 1 2 . 1 1 7 7 CYS H H 7 8.269 8.269 8.073 0.196 18921 49 1 2 . 1 1 8 8 THR HA H 8 4.045 4.045 4.278 -0.233 18921 50 1 2 . 1 1 8 8 THR H H 8 8.227 8.227 8.095 0.132 18921 51 1 2 . 1 1 9 9 SER HA H 9 4.756 4.756 4.539 0.217 18921 52 1 2 . 1 1 9 9 SER H H 9 7.392 7.392 7.306 0.086 18921 53 1 2 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.031 0.340 18921 54 1 2 . 1 1 10 10 ILE H H 10 7.792 7.792 8.187 -0.395 18921 55 1 2 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.951 -0.032 18921 56 1 2 . 1 1 11 11 CYS H H 11 9.679 9.679 8.138 1.541 18921 57 1 2 . 1 1 12 12 SER HA H 12 4.579 4.579 4.727 -0.148 18921 58 1 2 . 1 1 12 12 SER H H 12 8.753 8.753 8.698 0.055 18921 59 1 2 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.045 -0.191 18921 60 1 2 . 1 1 13 13 LEU H H 13 8.629 8.629 8.691 -0.062 18921 61 1 2 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.547 -0.404 18921 62 1 2 . 1 1 14 14 TYR H H 14 7.488 7.488 8.268 -0.780 18921 63 1 2 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.416 -0.458 18921 64 1 2 . 1 1 15 15 GLN H H 15 7.560 7.560 7.562 -0.002 18921 65 1 2 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.517 -0.348 18921 66 1 2 . 1 1 16 16 LEU H H 16 8.151 8.151 7.919 0.232 18921 67 1 2 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.961 0.180 18921 68 1 2 . 1 1 17 17 GLU H H 17 8.083 8.083 8.341 -0.258 18921 69 1 2 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.650 -0.208 18921 70 1 2 . 1 1 18 18 ASN H H 18 7.430 7.430 7.844 -0.414 18921 71 1 2 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.595 -0.101 18921 72 1 2 . 1 1 19 19 TYR H H 19 7.894 7.894 7.722 0.172 18921 73 1 2 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.390 0.255 18921 74 1 2 . 1 1 20 20 CYS H H 20 7.482 7.482 8.133 -0.651 18921 75 1 3 . 1 1 2 2 ILE H H 2 8.508 8.508 8.330 0.178 18921 76 1 3 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.588 0.010 18921 77 1 3 . 1 1 3 3 VAL H H 3 8.089 8.089 7.823 0.266 18921 78 1 3 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.141 0.057 18921 79 1 3 . 1 1 4 4 GLU H H 4 8.271 8.271 7.636 0.635 18921 80 1 3 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.383 -0.334 18921 81 1 3 . 1 1 5 5 GLN H H 5 8.272 8.272 7.612 0.660 18921 82 1 3 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.757 0.159 18921 83 1 3 . 1 1 6 6 CYS H H 6 8.273 8.273 8.271 0.002 18921 84 1 3 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.309 0.538 18921 85 1 3 . 1 1 7 7 CYS H H 7 8.269 8.269 8.096 0.173 18921 86 1 3 . 1 1 8 8 THR HA H 8 4.045 4.045 4.331 -0.286 18921 87 1 3 . 1 1 8 8 THR H H 8 8.227 8.227 7.939 0.288 18921 88 1 3 . 1 1 9 9 SER HA H 9 4.756 4.756 4.653 0.103 18921 89 1 3 . 1 1 9 9 SER H H 9 7.392 7.392 7.578 -0.186 18921 90 1 3 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.007 0.364 18921 91 1 3 . 1 1 10 10 ILE H H 10 7.792 7.792 8.202 -0.410 18921 92 1 3 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.940 -0.021 18921 93 1 3 . 1 1 11 11 CYS H H 11 9.679 9.679 8.309 1.370 18921 94 1 3 . 1 1 12 12 SER HA H 12 4.579 4.579 4.688 -0.109 18921 95 1 3 . 1 1 12 12 SER H H 12 8.753 8.753 8.663 0.090 18921 96 1 3 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.039 -0.185 18921 97 1 3 . 1 1 13 13 LEU H H 13 8.629 8.629 8.686 -0.057 18921 98 1 3 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.687 -0.544 18921 99 1 3 . 1 1 14 14 TYR H H 14 7.488 7.488 8.377 -0.889 18921 100 1 3 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.414 -0.456 18921 101 1 3 . 1 1 15 15 GLN H H 15 7.560 7.560 7.573 -0.013 18921 102 1 3 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.384 -0.215 18921 103 1 3 . 1 1 16 16 LEU H H 16 8.151 8.151 8.236 -0.085 18921 104 1 3 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.936 0.205 18921 105 1 3 . 1 1 17 17 GLU H H 17 8.083 8.083 8.660 -0.577 18921 106 1 3 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.480 -0.038 18921 107 1 3 . 1 1 18 18 ASN H H 18 7.430 7.430 7.681 -0.251 18921 108 1 3 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.568 -0.074 18921 109 1 3 . 1 1 19 19 TYR H H 19 7.894 7.894 7.858 0.036 18921 110 1 3 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.433 0.212 18921 111 1 3 . 1 1 20 20 CYS H H 20 7.482 7.482 8.090 -0.608 18921 112 1 4 . 1 1 2 2 ILE H H 2 8.508 8.508 8.295 0.213 18921 113 1 4 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.538 0.060 18921 114 1 4 . 1 1 3 3 VAL H H 3 8.089 8.089 8.019 0.070 18921 115 1 4 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.111 0.087 18921 116 1 4 . 1 1 4 4 GLU H H 4 8.271 8.271 7.713 0.558 18921 117 1 4 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.262 -0.212 18921 118 1 4 . 1 1 5 5 GLN H H 5 8.272 8.272 7.618 0.654 18921 119 1 4 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.806 0.110 18921 120 1 4 . 1 1 6 6 CYS H H 6 8.273 8.273 8.102 0.171 18921 121 1 4 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.276 0.571 18921 122 1 4 . 1 1 7 7 CYS H H 7 8.269 8.269 8.210 0.059 18921 123 1 4 . 1 1 8 8 THR HA H 8 4.045 4.045 4.258 -0.213 18921 124 1 4 . 1 1 8 8 THR H H 8 8.227 8.227 8.081 0.146 18921 125 1 4 . 1 1 9 9 SER HA H 9 4.756 4.756 4.637 0.119 18921 126 1 4 . 1 1 9 9 SER H H 9 7.392 7.392 7.581 -0.189 18921 127 1 4 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.032 0.339 18921 128 1 4 . 1 1 10 10 ILE H H 10 7.792 7.792 8.221 -0.429 18921 129 1 4 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.667 0.252 18921 130 1 4 . 1 1 11 11 CYS H H 11 9.679 9.679 8.447 1.232 18921 131 1 4 . 1 1 12 12 SER HA H 12 4.579 4.579 4.685 -0.106 18921 132 1 4 . 1 1 12 12 SER H H 12 8.753 8.753 8.112 0.641 18921 133 1 4 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.035 -0.181 18921 134 1 4 . 1 1 13 13 LEU H H 13 8.629 8.629 8.687 -0.058 18921 135 1 4 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.523 -0.380 18921 136 1 4 . 1 1 14 14 TYR H H 14 7.488 7.488 8.361 -0.873 18921 137 1 4 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.413 -0.455 18921 138 1 4 . 1 1 15 15 GLN H H 15 7.560 7.560 7.672 -0.112 18921 139 1 4 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.380 -0.211 18921 140 1 4 . 1 1 16 16 LEU H H 16 8.151 8.151 8.265 -0.114 18921 141 1 4 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.906 0.235 18921 142 1 4 . 1 1 17 17 GLU H H 17 8.083 8.083 8.338 -0.255 18921 143 1 4 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.438 0.004 18921 144 1 4 . 1 1 18 18 ASN H H 18 7.430 7.430 7.684 -0.254 18921 145 1 4 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.587 -0.093 18921 146 1 4 . 1 1 19 19 TYR H H 19 7.894 7.894 7.881 0.013 18921 147 1 4 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.334 0.311 18921 148 1 4 . 1 1 20 20 CYS H H 20 7.482 7.482 8.293 -0.811 18921 149 1 5 . 1 1 2 2 ILE H H 2 8.508 8.508 8.503 0.005 18921 150 1 5 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.499 0.099 18921 151 1 5 . 1 1 3 3 VAL H H 3 8.089 8.089 8.094 -0.005 18921 152 1 5 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.116 0.082 18921 153 1 5 . 1 1 4 4 GLU H H 4 8.271 8.271 7.692 0.579 18921 154 1 5 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.392 -0.342 18921 155 1 5 . 1 1 5 5 GLN H H 5 8.272 8.272 7.638 0.634 18921 156 1 5 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.882 0.034 18921 157 1 5 . 1 1 6 6 CYS H H 6 8.273 8.273 8.225 0.048 18921 158 1 5 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.414 0.433 18921 159 1 5 . 1 1 7 7 CYS H H 7 8.269 8.269 8.182 0.087 18921 160 1 5 . 1 1 8 8 THR HA H 8 4.045 4.045 4.172 -0.127 18921 161 1 5 . 1 1 8 8 THR H H 8 8.227 8.227 8.269 -0.042 18921 162 1 5 . 1 1 9 9 SER HA H 9 4.756 4.756 4.511 0.245 18921 163 1 5 . 1 1 9 9 SER H H 9 7.392 7.392 7.529 -0.137 18921 164 1 5 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.083 0.288 18921 165 1 5 . 1 1 10 10 ILE H H 10 7.792 7.792 8.156 -0.364 18921 166 1 5 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.876 0.043 18921 167 1 5 . 1 1 11 11 CYS H H 11 9.679 9.679 8.359 1.320 18921 168 1 5 . 1 1 12 12 SER HA H 12 4.579 4.579 4.656 -0.077 18921 169 1 5 . 1 1 12 12 SER H H 12 8.753 8.753 8.593 0.160 18921 170 1 5 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.042 -0.188 18921 171 1 5 . 1 1 13 13 LEU H H 13 8.629 8.629 8.665 -0.036 18921 172 1 5 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.747 -0.604 18921 173 1 5 . 1 1 14 14 TYR H H 14 7.488 7.488 8.318 -0.830 18921 174 1 5 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.468 -0.510 18921 175 1 5 . 1 1 15 15 GLN H H 15 7.560 7.560 7.641 -0.081 18921 176 1 5 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.284 -0.115 18921 177 1 5 . 1 1 16 16 LEU H H 16 8.151 8.151 8.370 -0.219 18921 178 1 5 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.920 0.221 18921 179 1 5 . 1 1 17 17 GLU H H 17 8.083 8.083 8.506 -0.423 18921 180 1 5 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.495 -0.053 18921 181 1 5 . 1 1 18 18 ASN H H 18 7.430 7.430 7.831 -0.401 18921 182 1 5 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.534 -0.040 18921 183 1 5 . 1 1 19 19 TYR H H 19 7.894 7.894 7.865 0.029 18921 184 1 5 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.420 0.225 18921 185 1 5 . 1 1 20 20 CYS H H 20 7.482 7.482 8.016 -0.534 18921 186 1 6 . 1 1 2 2 ILE H H 2 8.508 8.508 8.480 0.028 18921 187 1 6 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.521 0.077 18921 188 1 6 . 1 1 3 3 VAL H H 3 8.089 8.089 8.022 0.067 18921 189 1 6 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.222 -0.024 18921 190 1 6 . 1 1 4 4 GLU H H 4 8.271 8.271 7.768 0.503 18921 191 1 6 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.254 -0.204 18921 192 1 6 . 1 1 5 5 GLN H H 5 8.272 8.272 7.735 0.537 18921 193 1 6 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.761 0.155 18921 194 1 6 . 1 1 6 6 CYS H H 6 8.273 8.273 8.109 0.164 18921 195 1 6 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.256 0.591 18921 196 1 6 . 1 1 7 7 CYS H H 7 8.269 8.269 8.240 0.029 18921 197 1 6 . 1 1 8 8 THR HA H 8 4.045 4.045 4.320 -0.275 18921 198 1 6 . 1 1 8 8 THR H H 8 8.227 8.227 8.260 -0.033 18921 199 1 6 . 1 1 9 9 SER HA H 9 4.756 4.756 4.630 0.126 18921 200 1 6 . 1 1 9 9 SER H H 9 7.392 7.392 7.590 -0.198 18921 201 1 6 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.997 0.374 18921 202 1 6 . 1 1 10 10 ILE H H 10 7.792 7.792 8.183 -0.391 18921 203 1 6 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.087 -0.168 18921 204 1 6 . 1 1 11 11 CYS H H 11 9.679 9.679 8.239 1.440 18921 205 1 6 . 1 1 12 12 SER HA H 12 4.579 4.579 4.753 -0.174 18921 206 1 6 . 1 1 12 12 SER H H 12 8.753 8.753 8.590 0.163 18921 207 1 6 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.051 -0.197 18921 208 1 6 . 1 1 13 13 LEU H H 13 8.629 8.629 8.635 -0.006 18921 209 1 6 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.521 -0.378 18921 210 1 6 . 1 1 14 14 TYR H H 14 7.488 7.488 7.905 -0.417 18921 211 1 6 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.507 -0.549 18921 212 1 6 . 1 1 15 15 GLN H H 15 7.560 7.560 7.339 0.221 18921 213 1 6 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.514 -0.345 18921 214 1 6 . 1 1 16 16 LEU H H 16 8.151 8.151 8.209 -0.058 18921 215 1 6 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.967 0.174 18921 216 1 6 . 1 1 17 17 GLU H H 17 8.083 8.083 8.578 -0.495 18921 217 1 6 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.514 -0.072 18921 218 1 6 . 1 1 18 18 ASN H H 18 7.430 7.430 7.730 -0.300 18921 219 1 6 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.541 -0.047 18921 220 1 6 . 1 1 19 19 TYR H H 19 7.894 7.894 7.973 -0.079 18921 221 1 6 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.313 0.332 18921 222 1 6 . 1 1 20 20 CYS H H 20 7.482 7.482 8.204 -0.722 18921 223 1 7 . 1 1 2 2 ILE H H 2 8.508 8.508 8.377 0.131 18921 224 1 7 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.596 0.002 18921 225 1 7 . 1 1 3 3 VAL H H 3 8.089 8.089 8.062 0.027 18921 226 1 7 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.132 0.066 18921 227 1 7 . 1 1 4 4 GLU H H 4 8.271 8.271 7.686 0.585 18921 228 1 7 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.344 -0.294 18921 229 1 7 . 1 1 5 5 GLN H H 5 8.272 8.272 7.571 0.701 18921 230 1 7 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.919 -0.003 18921 231 1 7 . 1 1 6 6 CYS H H 6 8.273 8.273 8.190 0.083 18921 232 1 7 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.273 0.574 18921 233 1 7 . 1 1 7 7 CYS H H 7 8.269 8.269 8.195 0.074 18921 234 1 7 . 1 1 8 8 THR HA H 8 4.045 4.045 4.388 -0.343 18921 235 1 7 . 1 1 8 8 THR H H 8 8.227 8.227 8.415 -0.188 18921 236 1 7 . 1 1 9 9 SER HA H 9 4.756 4.756 4.549 0.207 18921 237 1 7 . 1 1 9 9 SER H H 9 7.392 7.392 7.392 -0.000 18921 238 1 7 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.068 0.303 18921 239 1 7 . 1 1 10 10 ILE H H 10 7.792 7.792 8.203 -0.411 18921 240 1 7 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.859 0.060 18921 241 1 7 . 1 1 11 11 CYS H H 11 9.679 9.679 8.314 1.365 18921 242 1 7 . 1 1 12 12 SER HA H 12 4.579 4.579 4.687 -0.108 18921 243 1 7 . 1 1 12 12 SER H H 12 8.753 8.753 8.356 0.397 18921 244 1 7 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.109 -0.255 18921 245 1 7 . 1 1 13 13 LEU H H 13 8.629 8.629 8.620 0.009 18921 246 1 7 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.415 -0.272 18921 247 1 7 . 1 1 14 14 TYR H H 14 7.488 7.488 8.316 -0.828 18921 248 1 7 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.345 -0.387 18921 249 1 7 . 1 1 15 15 GLN H H 15 7.560 7.560 7.356 0.204 18921 250 1 7 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.332 -0.163 18921 251 1 7 . 1 1 16 16 LEU H H 16 8.151 8.151 8.044 0.107 18921 252 1 7 . 1 1 17 17 GLU HA H 17 4.141 4.141 4.144 -0.003 18921 253 1 7 . 1 1 17 17 GLU H H 17 8.083 8.083 8.186 -0.103 18921 254 1 7 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.447 -0.005 18921 255 1 7 . 1 1 18 18 ASN H H 18 7.430 7.430 7.770 -0.340 18921 256 1 7 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.504 -0.010 18921 257 1 7 . 1 1 19 19 TYR H H 19 7.894 7.894 7.736 0.158 18921 258 1 7 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.394 0.251 18921 259 1 7 . 1 1 20 20 CYS H H 20 7.482 7.482 8.022 -0.540 18921 260 1 8 . 1 1 2 2 ILE H H 2 8.508 8.508 8.610 -0.102 18921 261 1 8 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.599 -0.001 18921 262 1 8 . 1 1 3 3 VAL H H 3 8.089 8.089 7.838 0.251 18921 263 1 8 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.039 0.159 18921 264 1 8 . 1 1 4 4 GLU H H 4 8.271 8.271 7.977 0.294 18921 265 1 8 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.298 -0.248 18921 266 1 8 . 1 1 5 5 GLN H H 5 8.272 8.272 7.549 0.723 18921 267 1 8 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.971 -0.055 18921 268 1 8 . 1 1 6 6 CYS H H 6 8.273 8.273 8.167 0.106 18921 269 1 8 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.353 0.494 18921 270 1 8 . 1 1 7 7 CYS H H 7 8.269 8.269 8.151 0.118 18921 271 1 8 . 1 1 8 8 THR HA H 8 4.045 4.045 4.389 -0.344 18921 272 1 8 . 1 1 8 8 THR H H 8 8.227 8.227 8.181 0.046 18921 273 1 8 . 1 1 9 9 SER HA H 9 4.756 4.756 4.666 0.090 18921 274 1 8 . 1 1 9 9 SER H H 9 7.392 7.392 7.561 -0.169 18921 275 1 8 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.947 0.424 18921 276 1 8 . 1 1 10 10 ILE H H 10 7.792 7.792 8.264 -0.472 18921 277 1 8 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.044 -0.125 18921 278 1 8 . 1 1 11 11 CYS H H 11 9.679 9.679 8.412 1.267 18921 279 1 8 . 1 1 12 12 SER HA H 12 4.579 4.579 4.643 -0.064 18921 280 1 8 . 1 1 12 12 SER H H 12 8.753 8.753 8.727 0.026 18921 281 1 8 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.047 -0.193 18921 282 1 8 . 1 1 13 13 LEU H H 13 8.629 8.629 8.635 -0.006 18921 283 1 8 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.731 -0.588 18921 284 1 8 . 1 1 14 14 TYR H H 14 7.488 7.488 8.314 -0.826 18921 285 1 8 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.448 -0.490 18921 286 1 8 . 1 1 15 15 GLN H H 15 7.560 7.560 7.627 -0.067 18921 287 1 8 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.306 -0.137 18921 288 1 8 . 1 1 16 16 LEU H H 16 8.151 8.151 8.379 -0.228 18921 289 1 8 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.934 0.207 18921 290 1 8 . 1 1 17 17 GLU H H 17 8.083 8.083 8.497 -0.414 18921 291 1 8 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.550 -0.108 18921 292 1 8 . 1 1 18 18 ASN H H 18 7.430 7.430 7.720 -0.290 18921 293 1 8 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.608 -0.114 18921 294 1 8 . 1 1 19 19 TYR H H 19 7.894 7.894 7.846 0.048 18921 295 1 8 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.339 0.306 18921 296 1 8 . 1 1 20 20 CYS H H 20 7.482 7.482 8.038 -0.556 18921 297 1 9 . 1 1 2 2 ILE H H 2 8.508 8.508 8.375 0.133 18921 298 1 9 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.764 -0.166 18921 299 1 9 . 1 1 3 3 VAL H H 3 8.089 8.089 8.108 -0.019 18921 300 1 9 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.242 -0.044 18921 301 1 9 . 1 1 4 4 GLU H H 4 8.271 8.271 8.577 -0.306 18921 302 1 9 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.269 -0.219 18921 303 1 9 . 1 1 5 5 GLN H H 5 8.272 8.272 7.513 0.759 18921 304 1 9 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.720 0.196 18921 305 1 9 . 1 1 6 6 CYS H H 6 8.273 8.273 8.300 -0.027 18921 306 1 9 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.398 0.449 18921 307 1 9 . 1 1 7 7 CYS H H 7 8.269 8.269 8.363 -0.094 18921 308 1 9 . 1 1 8 8 THR HA H 8 4.045 4.045 4.303 -0.258 18921 309 1 9 . 1 1 8 8 THR H H 8 8.227 8.227 8.118 0.109 18921 310 1 9 . 1 1 9 9 SER HA H 9 4.756 4.756 4.641 0.115 18921 311 1 9 . 1 1 9 9 SER H H 9 7.392 7.392 7.539 -0.147 18921 312 1 9 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.994 0.377 18921 313 1 9 . 1 1 10 10 ILE H H 10 7.792 7.792 8.228 -0.436 18921 314 1 9 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.033 -0.114 18921 315 1 9 . 1 1 11 11 CYS H H 11 9.679 9.679 8.136 1.543 18921 316 1 9 . 1 1 12 12 SER HA H 12 4.579 4.579 4.756 -0.177 18921 317 1 9 . 1 1 12 12 SER H H 12 8.753 8.753 8.624 0.129 18921 318 1 9 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.053 -0.199 18921 319 1 9 . 1 1 13 13 LEU H H 13 8.629 8.629 8.626 0.003 18921 320 1 9 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.583 -0.440 18921 321 1 9 . 1 1 14 14 TYR H H 14 7.488 7.488 8.243 -0.755 18921 322 1 9 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.449 -0.491 18921 323 1 9 . 1 1 15 15 GLN H H 15 7.560 7.560 7.630 -0.070 18921 324 1 9 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.231 -0.062 18921 325 1 9 . 1 1 16 16 LEU H H 16 8.151 8.151 8.330 -0.179 18921 326 1 9 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.927 0.214 18921 327 1 9 . 1 1 17 17 GLU H H 17 8.083 8.083 8.255 -0.172 18921 328 1 9 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.519 -0.077 18921 329 1 9 . 1 1 18 18 ASN H H 18 7.430 7.430 8.088 -0.658 18921 330 1 9 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.541 -0.047 18921 331 1 9 . 1 1 19 19 TYR H H 19 7.894 7.894 7.878 0.016 18921 332 1 9 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.396 0.249 18921 333 1 9 . 1 1 20 20 CYS H H 20 7.482 7.482 8.006 -0.524 18921 334 1 10 . 1 1 2 2 ILE H H 2 8.508 8.508 8.499 0.009 18921 335 1 10 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.668 -0.070 18921 336 1 10 . 1 1 3 3 VAL H H 3 8.089 8.089 7.988 0.101 18921 337 1 10 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.122 0.076 18921 338 1 10 . 1 1 4 4 GLU H H 4 8.271 8.271 8.782 -0.511 18921 339 1 10 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.437 -0.387 18921 340 1 10 . 1 1 5 5 GLN H H 5 8.272 8.272 7.516 0.756 18921 341 1 10 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.670 0.246 18921 342 1 10 . 1 1 6 6 CYS H H 6 8.273 8.273 8.253 0.020 18921 343 1 10 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.381 0.466 18921 344 1 10 . 1 1 7 7 CYS H H 7 8.269 8.269 8.202 0.067 18921 345 1 10 . 1 1 8 8 THR HA H 8 4.045 4.045 4.352 -0.307 18921 346 1 10 . 1 1 8 8 THR H H 8 8.227 8.227 8.237 -0.010 18921 347 1 10 . 1 1 9 9 SER HA H 9 4.756 4.756 4.654 0.102 18921 348 1 10 . 1 1 9 9 SER H H 9 7.392 7.392 7.966 -0.574 18921 349 1 10 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.061 0.310 18921 350 1 10 . 1 1 10 10 ILE H H 10 7.792 7.792 8.246 -0.454 18921 351 1 10 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.919 0.000 18921 352 1 10 . 1 1 11 11 CYS H H 11 9.679 9.679 8.386 1.293 18921 353 1 10 . 1 1 12 12 SER HA H 12 4.579 4.579 4.682 -0.103 18921 354 1 10 . 1 1 12 12 SER H H 12 8.753 8.753 8.628 0.125 18921 355 1 10 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.057 -0.203 18921 356 1 10 . 1 1 13 13 LEU H H 13 8.629 8.629 8.660 -0.031 18921 357 1 10 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.532 -0.389 18921 358 1 10 . 1 1 14 14 TYR H H 14 7.488 7.488 8.255 -0.767 18921 359 1 10 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.427 -0.469 18921 360 1 10 . 1 1 15 15 GLN H H 15 7.560 7.560 7.454 0.106 18921 361 1 10 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.455 -0.286 18921 362 1 10 . 1 1 16 16 LEU H H 16 8.151 8.151 8.066 0.085 18921 363 1 10 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.974 0.167 18921 364 1 10 . 1 1 17 17 GLU H H 17 8.083 8.083 8.278 -0.195 18921 365 1 10 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.532 -0.090 18921 366 1 10 . 1 1 18 18 ASN H H 18 7.430 7.430 7.770 -0.340 18921 367 1 10 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.587 -0.093 18921 368 1 10 . 1 1 19 19 TYR H H 19 7.894 7.894 7.822 0.073 18921 369 1 10 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.375 0.270 18921 370 1 10 . 1 1 20 20 CYS H H 20 7.482 7.482 8.206 -0.724 18921 371 1 11 . 1 1 2 2 ILE H H 2 8.508 8.508 8.330 0.178 18921 372 1 11 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.679 -0.081 18921 373 1 11 . 1 1 3 3 VAL H H 3 8.089 8.089 7.911 0.178 18921 374 1 11 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.170 0.028 18921 375 1 11 . 1 1 4 4 GLU H H 4 8.271 8.271 8.742 -0.471 18921 376 1 11 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.228 -0.178 18921 377 1 11 . 1 1 5 5 GLN H H 5 8.272 8.272 7.630 0.642 18921 378 1 11 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.898 0.018 18921 379 1 11 . 1 1 6 6 CYS H H 6 8.273 8.273 8.294 -0.021 18921 380 1 11 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.319 0.528 18921 381 1 11 . 1 1 7 7 CYS H H 7 8.269 8.269 8.234 0.035 18921 382 1 11 . 1 1 8 8 THR HA H 8 4.045 4.045 4.266 -0.221 18921 383 1 11 . 1 1 8 8 THR H H 8 8.227 8.227 8.110 0.117 18921 384 1 11 . 1 1 9 9 SER HA H 9 4.756 4.756 4.630 0.126 18921 385 1 11 . 1 1 9 9 SER H H 9 7.392 7.392 7.663 -0.271 18921 386 1 11 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.012 0.359 18921 387 1 11 . 1 1 10 10 ILE H H 10 7.792 7.792 8.153 -0.361 18921 388 1 11 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.681 0.238 18921 389 1 11 . 1 1 11 11 CYS H H 11 9.679 9.679 8.530 1.149 18921 390 1 11 . 1 1 12 12 SER HA H 12 4.579 4.579 4.667 -0.088 18921 391 1 11 . 1 1 12 12 SER H H 12 8.753 8.753 8.792 -0.039 18921 392 1 11 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.109 -0.255 18921 393 1 11 . 1 1 13 13 LEU H H 13 8.629 8.629 8.517 0.112 18921 394 1 11 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.760 -0.617 18921 395 1 11 . 1 1 14 14 TYR H H 14 7.488 7.488 8.341 -0.853 18921 396 1 11 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.647 -0.689 18921 397 1 11 . 1 1 15 15 GLN H H 15 7.560 7.560 7.346 0.214 18921 398 1 11 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.562 -0.393 18921 399 1 11 . 1 1 16 16 LEU H H 16 8.151 8.151 7.688 0.463 18921 400 1 11 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.915 0.226 18921 401 1 11 . 1 1 17 17 GLU H H 17 8.083 8.083 8.317 -0.234 18921 402 1 11 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.441 0.001 18921 403 1 11 . 1 1 18 18 ASN H H 18 7.430 7.430 8.025 -0.596 18921 404 1 11 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.566 -0.072 18921 405 1 11 . 1 1 19 19 TYR H H 19 7.894 7.894 7.773 0.121 18921 406 1 11 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.437 0.208 18921 407 1 11 . 1 1 20 20 CYS H H 20 7.482 7.482 8.084 -0.602 18921 408 1 12 . 1 1 2 2 ILE H H 2 8.508 8.508 8.341 0.167 18921 409 1 12 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.679 -0.081 18921 410 1 12 . 1 1 3 3 VAL H H 3 8.089 8.089 8.122 -0.033 18921 411 1 12 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.142 0.056 18921 412 1 12 . 1 1 4 4 GLU H H 4 8.271 8.271 8.550 -0.279 18921 413 1 12 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.274 -0.224 18921 414 1 12 . 1 1 5 5 GLN H H 5 8.272 8.272 7.509 0.763 18921 415 1 12 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.748 0.168 18921 416 1 12 . 1 1 6 6 CYS H H 6 8.273 8.273 8.206 0.067 18921 417 1 12 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.363 0.484 18921 418 1 12 . 1 1 7 7 CYS H H 7 8.269 8.269 8.315 -0.046 18921 419 1 12 . 1 1 8 8 THR HA H 8 4.045 4.045 4.301 -0.256 18921 420 1 12 . 1 1 8 8 THR H H 8 8.227 8.227 8.480 -0.253 18921 421 1 12 . 1 1 9 9 SER HA H 9 4.756 4.756 4.550 0.206 18921 422 1 12 . 1 1 9 9 SER H H 9 7.392 7.392 7.660 -0.268 18921 423 1 12 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.042 0.329 18921 424 1 12 . 1 1 10 10 ILE H H 10 7.792 7.792 8.254 -0.462 18921 425 1 12 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.057 -0.138 18921 426 1 12 . 1 1 11 11 CYS H H 11 9.679 9.679 8.317 1.362 18921 427 1 12 . 1 1 12 12 SER HA H 12 4.579 4.579 4.756 -0.177 18921 428 1 12 . 1 1 12 12 SER H H 12 8.753 8.753 8.641 0.112 18921 429 1 12 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.051 -0.197 18921 430 1 12 . 1 1 13 13 LEU H H 13 8.629 8.629 8.624 0.005 18921 431 1 12 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.508 -0.365 18921 432 1 12 . 1 1 14 14 TYR H H 14 7.488 7.488 8.191 -0.703 18921 433 1 12 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.466 -0.508 18921 434 1 12 . 1 1 15 15 GLN H H 15 7.560 7.560 7.523 0.037 18921 435 1 12 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.520 -0.351 18921 436 1 12 . 1 1 16 16 LEU H H 16 8.151 8.151 8.070 0.081 18921 437 1 12 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.974 0.167 18921 438 1 12 . 1 1 17 17 GLU H H 17 8.083 8.083 8.092 -0.009 18921 439 1 12 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.469 -0.027 18921 440 1 12 . 1 1 18 18 ASN H H 18 7.430 7.430 7.838 -0.408 18921 441 1 12 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.517 -0.023 18921 442 1 12 . 1 1 19 19 TYR H H 19 7.894 7.894 7.773 0.121 18921 443 1 12 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.471 0.174 18921 444 1 12 . 1 1 20 20 CYS H H 20 7.482 7.482 8.030 -0.548 18921 445 1 13 . 1 1 2 2 ILE H H 2 8.508 8.508 8.271 0.237 18921 446 1 13 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.646 -0.048 18921 447 1 13 . 1 1 3 3 VAL H H 3 8.089 8.089 7.913 0.176 18921 448 1 13 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.125 0.073 18921 449 1 13 . 1 1 4 4 GLU H H 4 8.271 8.271 8.733 -0.462 18921 450 1 13 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.348 -0.298 18921 451 1 13 . 1 1 5 5 GLN H H 5 8.272 8.272 7.573 0.699 18921 452 1 13 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.933 -0.017 18921 453 1 13 . 1 1 6 6 CYS H H 6 8.273 8.273 7.899 0.374 18921 454 1 13 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.385 0.462 18921 455 1 13 . 1 1 7 7 CYS H H 7 8.269 8.269 8.445 -0.176 18921 456 1 13 . 1 1 8 8 THR HA H 8 4.045 4.045 4.201 -0.156 18921 457 1 13 . 1 1 8 8 THR H H 8 8.227 8.227 8.322 -0.095 18921 458 1 13 . 1 1 9 9 SER HA H 9 4.756 4.756 4.579 0.177 18921 459 1 13 . 1 1 9 9 SER H H 9 7.392 7.392 7.621 -0.229 18921 460 1 13 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.991 0.380 18921 461 1 13 . 1 1 10 10 ILE H H 10 7.792 7.792 8.268 -0.476 18921 462 1 13 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.783 0.136 18921 463 1 13 . 1 1 11 11 CYS H H 11 9.679 9.679 8.362 1.317 18921 464 1 13 . 1 1 12 12 SER HA H 12 4.579 4.579 4.500 0.079 18921 465 1 13 . 1 1 12 12 SER H H 12 8.753 8.753 8.258 0.495 18921 466 1 13 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.066 -0.211 18921 467 1 13 . 1 1 13 13 LEU H H 13 8.629 8.629 8.649 -0.020 18921 468 1 13 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.813 -0.670 18921 469 1 13 . 1 1 14 14 TYR H H 14 7.488 7.488 8.352 -0.864 18921 470 1 13 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.445 -0.487 18921 471 1 13 . 1 1 15 15 GLN H H 15 7.560 7.560 7.624 -0.064 18921 472 1 13 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.551 -0.382 18921 473 1 13 . 1 1 16 16 LEU H H 16 8.151 8.151 7.873 0.278 18921 474 1 13 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.946 0.195 18921 475 1 13 . 1 1 17 17 GLU H H 17 8.083 8.083 8.530 -0.447 18921 476 1 13 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.503 -0.061 18921 477 1 13 . 1 1 18 18 ASN H H 18 7.430 7.430 7.695 -0.265 18921 478 1 13 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.583 -0.089 18921 479 1 13 . 1 1 19 19 TYR H H 19 7.894 7.894 7.802 0.092 18921 480 1 13 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.359 0.286 18921 481 1 13 . 1 1 20 20 CYS H H 20 7.482 7.482 8.128 -0.646 18921 482 1 14 . 1 1 2 2 ILE H H 2 8.508 8.508 8.332 0.176 18921 483 1 14 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.766 -0.168 18921 484 1 14 . 1 1 3 3 VAL H H 3 8.089 8.089 8.000 0.089 18921 485 1 14 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.178 0.020 18921 486 1 14 . 1 1 4 4 GLU H H 4 8.271 8.271 8.761 -0.490 18921 487 1 14 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.300 -0.250 18921 488 1 14 . 1 1 5 5 GLN H H 5 8.272 8.272 7.410 0.862 18921 489 1 14 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.933 -0.017 18921 490 1 14 . 1 1 6 6 CYS H H 6 8.273 8.273 8.221 0.052 18921 491 1 14 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.425 0.422 18921 492 1 14 . 1 1 7 7 CYS H H 7 8.269 8.269 8.185 0.084 18921 493 1 14 . 1 1 8 8 THR HA H 8 4.045 4.045 4.308 -0.263 18921 494 1 14 . 1 1 8 8 THR H H 8 8.227 8.227 8.371 -0.144 18921 495 1 14 . 1 1 9 9 SER HA H 9 4.756 4.756 4.620 0.136 18921 496 1 14 . 1 1 9 9 SER H H 9 7.392 7.392 7.566 -0.174 18921 497 1 14 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.973 0.398 18921 498 1 14 . 1 1 10 10 ILE H H 10 7.792 7.792 8.259 -0.467 18921 499 1 14 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.046 -0.127 18921 500 1 14 . 1 1 11 11 CYS H H 11 9.679 9.679 8.522 1.157 18921 501 1 14 . 1 1 12 12 SER HA H 12 4.579 4.579 4.774 -0.195 18921 502 1 14 . 1 1 12 12 SER H H 12 8.753 8.753 8.560 0.193 18921 503 1 14 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.049 -0.195 18921 504 1 14 . 1 1 13 13 LEU H H 13 8.629 8.629 8.648 -0.019 18921 505 1 14 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.725 -0.582 18921 506 1 14 . 1 1 14 14 TYR H H 14 7.488 7.488 8.323 -0.835 18921 507 1 14 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.458 -0.500 18921 508 1 14 . 1 1 15 15 GLN H H 15 7.560 7.560 7.654 -0.094 18921 509 1 14 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.353 -0.184 18921 510 1 14 . 1 1 16 16 LEU H H 16 8.151 8.151 8.223 -0.072 18921 511 1 14 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.904 0.237 18921 512 1 14 . 1 1 17 17 GLU H H 17 8.083 8.083 8.397 -0.314 18921 513 1 14 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.506 -0.064 18921 514 1 14 . 1 1 18 18 ASN H H 18 7.430 7.430 7.701 -0.271 18921 515 1 14 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.564 -0.070 18921 516 1 14 . 1 1 19 19 TYR H H 19 7.894 7.894 7.780 0.114 18921 517 1 14 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.356 0.289 18921 518 1 14 . 1 1 20 20 CYS H H 20 7.482 7.482 8.097 -0.615 18921 519 1 15 . 1 1 2 2 ILE H H 2 8.508 8.508 8.200 0.308 18921 520 1 15 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.651 -0.053 18921 521 1 15 . 1 1 3 3 VAL H H 3 8.089 8.089 7.972 0.117 18921 522 1 15 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.084 0.114 18921 523 1 15 . 1 1 4 4 GLU H H 4 8.271 8.271 7.948 0.323 18921 524 1 15 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.236 -0.186 18921 525 1 15 . 1 1 5 5 GLN H H 5 8.272 8.272 7.470 0.802 18921 526 1 15 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.958 -0.042 18921 527 1 15 . 1 1 6 6 CYS H H 6 8.273 8.273 7.911 0.362 18921 528 1 15 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.429 0.418 18921 529 1 15 . 1 1 7 7 CYS H H 7 8.269 8.269 8.353 -0.084 18921 530 1 15 . 1 1 8 8 THR HA H 8 4.045 4.045 4.178 -0.133 18921 531 1 15 . 1 1 8 8 THR H H 8 8.227 8.227 8.072 0.155 18921 532 1 15 . 1 1 9 9 SER HA H 9 4.756 4.756 4.596 0.160 18921 533 1 15 . 1 1 9 9 SER H H 9 7.392 7.392 7.587 -0.195 18921 534 1 15 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.027 0.344 18921 535 1 15 . 1 1 10 10 ILE H H 10 7.792 7.792 8.275 -0.483 18921 536 1 15 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.035 -0.116 18921 537 1 15 . 1 1 11 11 CYS H H 11 9.679 9.679 8.373 1.306 18921 538 1 15 . 1 1 12 12 SER HA H 12 4.579 4.579 4.638 -0.059 18921 539 1 15 . 1 1 12 12 SER H H 12 8.753 8.753 8.085 0.668 18921 540 1 15 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.088 -0.234 18921 541 1 15 . 1 1 13 13 LEU H H 13 8.629 8.629 8.643 -0.014 18921 542 1 15 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.369 -0.226 18921 543 1 15 . 1 1 14 14 TYR H H 14 7.488 7.488 8.419 -0.931 18921 544 1 15 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.340 -0.382 18921 545 1 15 . 1 1 15 15 GLN H H 15 7.560 7.560 7.370 0.190 18921 546 1 15 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.531 -0.362 18921 547 1 15 . 1 1 16 16 LEU H H 16 8.151 8.151 8.030 0.121 18921 548 1 15 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.921 0.220 18921 549 1 15 . 1 1 17 17 GLU H H 17 8.083 8.083 8.577 -0.494 18921 550 1 15 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.483 -0.041 18921 551 1 15 . 1 1 18 18 ASN H H 18 7.430 7.430 8.455 -1.025 18921 552 1 15 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.559 -0.065 18921 553 1 15 . 1 1 19 19 TYR H H 19 7.894 7.894 8.038 -0.144 18921 554 1 15 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.375 0.270 18921 555 1 15 . 1 1 20 20 CYS H H 20 7.482 7.482 8.172 -0.690 18921 556 1 16 . 1 1 2 2 ILE H H 2 8.508 8.508 8.392 0.116 18921 557 1 16 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.815 -0.217 18921 558 1 16 . 1 1 3 3 VAL H H 3 8.089 8.089 8.008 0.081 18921 559 1 16 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.127 0.071 18921 560 1 16 . 1 1 4 4 GLU H H 4 8.271 8.271 8.558 -0.287 18921 561 1 16 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.383 -0.333 18921 562 1 16 . 1 1 5 5 GLN H H 5 8.272 8.272 7.484 0.788 18921 563 1 16 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.799 0.117 18921 564 1 16 . 1 1 6 6 CYS H H 6 8.273 8.273 8.226 0.047 18921 565 1 16 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.362 0.485 18921 566 1 16 . 1 1 7 7 CYS H H 7 8.269 8.269 8.339 -0.070 18921 567 1 16 . 1 1 8 8 THR HA H 8 4.045 4.045 4.421 -0.376 18921 568 1 16 . 1 1 8 8 THR H H 8 8.227 8.227 7.791 0.436 18921 569 1 16 . 1 1 9 9 SER HA H 9 4.756 4.756 4.678 0.078 18921 570 1 16 . 1 1 9 9 SER H H 9 7.392 7.392 8.068 -0.676 18921 571 1 16 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.953 0.418 18921 572 1 16 . 1 1 10 10 ILE H H 10 7.792 7.792 8.148 -0.356 18921 573 1 16 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.821 0.098 18921 574 1 16 . 1 1 11 11 CYS H H 11 9.679 9.679 8.496 1.183 18921 575 1 16 . 1 1 12 12 SER HA H 12 4.579 4.579 4.757 -0.178 18921 576 1 16 . 1 1 12 12 SER H H 12 8.753 8.753 8.067 0.686 18921 577 1 16 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.074 -0.220 18921 578 1 16 . 1 1 13 13 LEU H H 13 8.629 8.629 8.685 -0.056 18921 579 1 16 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.497 -0.354 18921 580 1 16 . 1 1 14 14 TYR H H 14 7.488 7.488 8.267 -0.779 18921 581 1 16 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.463 -0.505 18921 582 1 16 . 1 1 15 15 GLN H H 15 7.560 7.560 7.732 -0.172 18921 583 1 16 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.424 -0.255 18921 584 1 16 . 1 1 16 16 LEU H H 16 8.151 8.151 8.332 -0.181 18921 585 1 16 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.979 0.162 18921 586 1 16 . 1 1 17 17 GLU H H 17 8.083 8.083 8.212 -0.129 18921 587 1 16 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.501 -0.059 18921 588 1 16 . 1 1 18 18 ASN H H 18 7.430 7.430 7.832 -0.402 18921 589 1 16 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.576 -0.082 18921 590 1 16 . 1 1 19 19 TYR H H 19 7.894 7.894 7.816 0.078 18921 591 1 16 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.488 0.157 18921 592 1 16 . 1 1 20 20 CYS H H 20 7.482 7.482 7.970 -0.488 18921 593 1 17 . 1 1 2 2 ILE H H 2 8.508 8.508 8.377 0.131 18921 594 1 17 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.688 -0.090 18921 595 1 17 . 1 1 3 3 VAL H H 3 8.089 8.089 7.974 0.115 18921 596 1 17 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.148 0.050 18921 597 1 17 . 1 1 4 4 GLU H H 4 8.271 8.271 8.790 -0.519 18921 598 1 17 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.484 -0.434 18921 599 1 17 . 1 1 5 5 GLN H H 5 8.272 8.272 7.500 0.772 18921 600 1 17 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.688 0.228 18921 601 1 17 . 1 1 6 6 CYS H H 6 8.273 8.273 8.306 -0.033 18921 602 1 17 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.328 0.519 18921 603 1 17 . 1 1 7 7 CYS H H 7 8.269 8.269 8.271 -0.002 18921 604 1 17 . 1 1 8 8 THR HA H 8 4.045 4.045 4.364 -0.319 18921 605 1 17 . 1 1 8 8 THR H H 8 8.227 8.227 8.157 0.070 18921 606 1 17 . 1 1 9 9 SER HA H 9 4.756 4.756 4.615 0.141 18921 607 1 17 . 1 1 9 9 SER H H 9 7.392 7.392 8.019 -0.627 18921 608 1 17 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.088 0.283 18921 609 1 17 . 1 1 10 10 ILE H H 10 7.792 7.792 8.234 -0.442 18921 610 1 17 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.938 -0.019 18921 611 1 17 . 1 1 11 11 CYS H H 11 9.679 9.679 8.399 1.280 18921 612 1 17 . 1 1 12 12 SER HA H 12 4.579 4.579 4.647 -0.068 18921 613 1 17 . 1 1 12 12 SER H H 12 8.753 8.753 8.656 0.097 18921 614 1 17 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.053 -0.199 18921 615 1 17 . 1 1 13 13 LEU H H 13 8.629 8.629 8.624 0.005 18921 616 1 17 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.778 -0.635 18921 617 1 17 . 1 1 14 14 TYR H H 14 7.488 7.488 8.255 -0.767 18921 618 1 17 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.459 -0.501 18921 619 1 17 . 1 1 15 15 GLN H H 15 7.560 7.560 7.603 -0.043 18921 620 1 17 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.394 -0.225 18921 621 1 17 . 1 1 16 16 LEU H H 16 8.151 8.151 8.200 -0.049 18921 622 1 17 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.921 0.220 18921 623 1 17 . 1 1 17 17 GLU H H 17 8.083 8.083 8.245 -0.162 18921 624 1 17 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.519 -0.077 18921 625 1 17 . 1 1 18 18 ASN H H 18 7.430 7.430 7.732 -0.302 18921 626 1 17 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.554 -0.060 18921 627 1 17 . 1 1 19 19 TYR H H 19 7.894 7.894 7.869 0.025 18921 628 1 17 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.364 0.281 18921 629 1 17 . 1 1 20 20 CYS H H 20 7.482 7.482 8.136 -0.654 18921 630 1 18 . 1 1 2 2 ILE H H 2 8.508 8.508 8.390 0.118 18921 631 1 18 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.574 0.024 18921 632 1 18 . 1 1 3 3 VAL H H 3 8.089 8.089 8.043 0.046 18921 633 1 18 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.133 0.065 18921 634 1 18 . 1 1 4 4 GLU H H 4 8.271 8.271 8.721 -0.450 18921 635 1 18 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.445 -0.395 18921 636 1 18 . 1 1 5 5 GLN H H 5 8.272 8.272 7.702 0.570 18921 637 1 18 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.805 0.111 18921 638 1 18 . 1 1 6 6 CYS H H 6 8.273 8.273 7.986 0.287 18921 639 1 18 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.252 0.595 18921 640 1 18 . 1 1 7 7 CYS H H 7 8.269 8.269 8.507 -0.238 18921 641 1 18 . 1 1 8 8 THR HA H 8 4.045 4.045 4.145 -0.100 18921 642 1 18 . 1 1 8 8 THR H H 8 8.227 8.227 8.383 -0.156 18921 643 1 18 . 1 1 9 9 SER HA H 9 4.756 4.756 4.583 0.173 18921 644 1 18 . 1 1 9 9 SER H H 9 7.392 7.392 7.635 -0.243 18921 645 1 18 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.054 0.317 18921 646 1 18 . 1 1 10 10 ILE H H 10 7.792 7.792 8.265 -0.473 18921 647 1 18 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.693 0.226 18921 648 1 18 . 1 1 11 11 CYS H H 11 9.679 9.679 8.379 1.300 18921 649 1 18 . 1 1 12 12 SER HA H 12 4.579 4.579 4.663 -0.084 18921 650 1 18 . 1 1 12 12 SER H H 12 8.753 8.753 8.135 0.618 18921 651 1 18 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.029 -0.175 18921 652 1 18 . 1 1 13 13 LEU H H 13 8.629 8.629 8.712 -0.083 18921 653 1 18 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.720 -0.577 18921 654 1 18 . 1 1 14 14 TYR H H 14 7.488 7.488 8.254 -0.766 18921 655 1 18 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.476 -0.518 18921 656 1 18 . 1 1 15 15 GLN H H 15 7.560 7.560 7.687 -0.127 18921 657 1 18 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.364 -0.195 18921 658 1 18 . 1 1 16 16 LEU H H 16 8.151 8.151 8.295 -0.144 18921 659 1 18 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.904 0.237 18921 660 1 18 . 1 1 17 17 GLU H H 17 8.083 8.083 8.341 -0.258 18921 661 1 18 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.492 -0.050 18921 662 1 18 . 1 1 18 18 ASN H H 18 7.430 7.430 7.760 -0.330 18921 663 1 18 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.527 -0.033 18921 664 1 18 . 1 1 19 19 TYR H H 19 7.894 7.894 7.888 0.006 18921 665 1 18 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.412 0.233 18921 666 1 18 . 1 1 20 20 CYS H H 20 7.482 7.482 8.108 -0.626 18921 667 1 19 . 1 1 2 2 ILE H H 2 8.508 8.508 8.450 0.058 18921 668 1 19 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.691 -0.093 18921 669 1 19 . 1 1 3 3 VAL H H 3 8.089 8.089 8.130 -0.041 18921 670 1 19 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.096 0.102 18921 671 1 19 . 1 1 4 4 GLU H H 4 8.271 8.271 8.689 -0.418 18921 672 1 19 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.246 -0.196 18921 673 1 19 . 1 1 5 5 GLN H H 5 8.272 8.272 7.378 0.894 18921 674 1 19 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.814 0.102 18921 675 1 19 . 1 1 6 6 CYS H H 6 8.273 8.273 7.947 0.326 18921 676 1 19 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.412 0.435 18921 677 1 19 . 1 1 7 7 CYS H H 7 8.269 8.269 8.386 -0.117 18921 678 1 19 . 1 1 8 8 THR HA H 8 4.045 4.045 4.191 -0.146 18921 679 1 19 . 1 1 8 8 THR H H 8 8.227 8.227 8.114 0.113 18921 680 1 19 . 1 1 9 9 SER HA H 9 4.756 4.756 4.566 0.190 18921 681 1 19 . 1 1 9 9 SER H H 9 7.392 7.392 7.680 -0.288 18921 682 1 19 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.033 0.338 18921 683 1 19 . 1 1 10 10 ILE H H 10 7.792 7.792 8.220 -0.428 18921 684 1 19 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.864 0.055 18921 685 1 19 . 1 1 11 11 CYS H H 11 9.679 9.679 8.261 1.418 18921 686 1 19 . 1 1 12 12 SER HA H 12 4.579 4.579 4.677 -0.098 18921 687 1 19 . 1 1 12 12 SER H H 12 8.753 8.753 8.617 0.136 18921 688 1 19 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.093 -0.239 18921 689 1 19 . 1 1 13 13 LEU H H 13 8.629 8.629 8.614 0.015 18921 690 1 19 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.767 -0.624 18921 691 1 19 . 1 1 14 14 TYR H H 14 7.488 7.488 8.336 -0.848 18921 692 1 19 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.657 -0.699 18921 693 1 19 . 1 1 15 15 GLN H H 15 7.560 7.560 7.477 0.083 18921 694 1 19 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.357 -0.188 18921 695 1 19 . 1 1 16 16 LEU H H 16 8.151 8.151 8.139 0.012 18921 696 1 19 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.918 0.223 18921 697 1 19 . 1 1 17 17 GLU H H 17 8.083 8.083 8.497 -0.414 18921 698 1 19 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.466 -0.024 18921 699 1 19 . 1 1 18 18 ASN H H 18 7.430 7.430 7.776 -0.346 18921 700 1 19 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.511 -0.017 18921 701 1 19 . 1 1 19 19 TYR H H 19 7.894 7.894 7.883 0.011 18921 702 1 19 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.398 0.247 18921 703 1 19 . 1 1 20 20 CYS H H 20 7.482 7.482 8.050 -0.568 18921 704 1 20 . 1 1 2 2 ILE H H 2 8.508 8.508 8.435 0.073 18921 705 1 20 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.578 0.020 18921 706 1 20 . 1 1 3 3 VAL H H 3 8.089 8.089 8.052 0.037 18921 707 1 20 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.114 0.084 18921 708 1 20 . 1 1 4 4 GLU H H 4 8.271 8.271 8.638 -0.367 18921 709 1 20 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.333 -0.283 18921 710 1 20 . 1 1 5 5 GLN H H 5 8.272 8.272 7.384 0.888 18921 711 1 20 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.972 -0.056 18921 712 1 20 . 1 1 6 6 CYS H H 6 8.273 8.273 8.289 -0.016 18921 713 1 20 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.335 0.512 18921 714 1 20 . 1 1 7 7 CYS H H 7 8.269 8.269 8.332 -0.063 18921 715 1 20 . 1 1 8 8 THR HA H 8 4.045 4.045 4.382 -0.337 18921 716 1 20 . 1 1 8 8 THR H H 8 8.227 8.227 8.265 -0.038 18921 717 1 20 . 1 1 9 9 SER HA H 9 4.756 4.756 4.699 0.057 18921 718 1 20 . 1 1 9 9 SER H H 9 7.392 7.392 7.798 -0.406 18921 719 1 20 . 1 1 10 10 ILE HA H 10 4.371 4.371 3.994 0.377 18921 720 1 20 . 1 1 10 10 ILE H H 10 7.792 7.792 8.283 -0.491 18921 721 1 20 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.110 -0.191 18921 722 1 20 . 1 1 11 11 CYS H H 11 9.679 9.679 8.358 1.321 18921 723 1 20 . 1 1 12 12 SER HA H 12 4.579 4.579 4.704 -0.125 18921 724 1 20 . 1 1 12 12 SER H H 12 8.753 8.753 8.630 0.123 18921 725 1 20 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.063 -0.209 18921 726 1 20 . 1 1 13 13 LEU H H 13 8.629 8.629 8.634 -0.005 18921 727 1 20 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.542 -0.399 18921 728 1 20 . 1 1 14 14 TYR H H 14 7.488 7.488 8.225 -0.737 18921 729 1 20 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.471 -0.513 18921 730 1 20 . 1 1 15 15 GLN H H 15 7.560 7.560 7.559 0.001 18921 731 1 20 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.499 -0.330 18921 732 1 20 . 1 1 16 16 LEU H H 16 8.151 8.151 8.056 0.095 18921 733 1 20 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.941 0.200 18921 734 1 20 . 1 1 17 17 GLU H H 17 8.083 8.083 8.159 -0.076 18921 735 1 20 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.484 -0.042 18921 736 1 20 . 1 1 18 18 ASN H H 18 7.430 7.430 7.904 -0.474 18921 737 1 20 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.542 -0.048 18921 738 1 20 . 1 1 19 19 TYR H H 19 7.894 7.894 7.800 0.094 18921 739 1 20 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.433 0.212 18921 740 1 20 . 1 1 20 20 CYS H H 20 7.482 7.482 8.118 -0.636 18921 741 1 21 . 1 1 2 2 ILE H H 2 8.508 8.508 8.552 -0.044 18921 742 1 21 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.609 -0.011 18921 743 1 21 . 1 1 3 3 VAL H H 3 8.089 8.089 7.985 0.104 18921 744 1 21 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.119 0.079 18921 745 1 21 . 1 1 4 4 GLU H H 4 8.271 8.271 7.807 0.464 18921 746 1 21 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.322 -0.272 18921 747 1 21 . 1 1 5 5 GLN H H 5 8.272 8.272 7.640 0.632 18921 748 1 21 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.935 -0.019 18921 749 1 21 . 1 1 6 6 CYS H H 6 8.273 8.273 8.219 0.054 18921 750 1 21 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.362 0.485 18921 751 1 21 . 1 1 7 7 CYS H H 7 8.269 8.269 8.131 0.138 18921 752 1 21 . 1 1 8 8 THR HA H 8 4.045 4.045 4.210 -0.165 18921 753 1 21 . 1 1 8 8 THR H H 8 8.227 8.227 8.078 0.149 18921 754 1 21 . 1 1 9 9 SER HA H 9 4.756 4.756 4.617 0.139 18921 755 1 21 . 1 1 9 9 SER H H 9 7.392 7.392 7.551 -0.159 18921 756 1 21 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.013 0.358 18921 757 1 21 . 1 1 10 10 ILE H H 10 7.792 7.792 8.233 -0.441 18921 758 1 21 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.061 -0.142 18921 759 1 21 . 1 1 11 11 CYS H H 11 9.679 9.679 8.455 1.224 18921 760 1 21 . 1 1 12 12 SER HA H 12 4.579 4.579 4.744 -0.165 18921 761 1 21 . 1 1 12 12 SER H H 12 8.753 8.753 8.609 0.144 18921 762 1 21 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.058 -0.204 18921 763 1 21 . 1 1 13 13 LEU H H 13 8.629 8.629 8.654 -0.025 18921 764 1 21 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.550 -0.407 18921 765 1 21 . 1 1 14 14 TYR H H 14 7.488 7.488 8.295 -0.807 18921 766 1 21 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.464 -0.506 18921 767 1 21 . 1 1 15 15 GLN H H 15 7.560 7.560 7.597 -0.037 18921 768 1 21 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.513 -0.344 18921 769 1 21 . 1 1 16 16 LEU H H 16 8.151 8.151 8.230 -0.079 18921 770 1 21 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.935 0.206 18921 771 1 21 . 1 1 17 17 GLU H H 17 8.083 8.083 8.497 -0.414 18921 772 1 21 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.514 -0.072 18921 773 1 21 . 1 1 18 18 ASN H H 18 7.430 7.430 7.674 -0.244 18921 774 1 21 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.556 -0.062 18921 775 1 21 . 1 1 19 19 TYR H H 19 7.894 7.894 7.858 0.036 18921 776 1 21 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.396 0.249 18921 777 1 21 . 1 1 20 20 CYS H H 20 7.482 7.482 8.098 -0.616 18921 778 1 22 . 1 1 2 2 ILE H H 2 8.508 8.508 8.509 -0.001 18921 779 1 22 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.578 0.020 18921 780 1 22 . 1 1 3 3 VAL H H 3 8.089 8.089 8.118 -0.029 18921 781 1 22 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.087 0.111 18921 782 1 22 . 1 1 4 4 GLU H H 4 8.271 8.271 7.710 0.561 18921 783 1 22 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.257 -0.207 18921 784 1 22 . 1 1 5 5 GLN H H 5 8.272 8.272 7.481 0.791 18921 785 1 22 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.714 0.202 18921 786 1 22 . 1 1 6 6 CYS H H 6 8.273 8.273 7.978 0.295 18921 787 1 22 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.408 0.439 18921 788 1 22 . 1 1 7 7 CYS H H 7 8.269 8.269 8.202 0.067 18921 789 1 22 . 1 1 8 8 THR HA H 8 4.045 4.045 4.235 -0.190 18921 790 1 22 . 1 1 8 8 THR H H 8 8.227 8.227 8.198 0.029 18921 791 1 22 . 1 1 9 9 SER HA H 9 4.756 4.756 4.550 0.206 18921 792 1 22 . 1 1 9 9 SER H H 9 7.392 7.392 7.630 -0.238 18921 793 1 22 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.060 0.311 18921 794 1 22 . 1 1 10 10 ILE H H 10 7.792 7.792 8.163 -0.371 18921 795 1 22 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.039 -0.120 18921 796 1 22 . 1 1 11 11 CYS H H 11 9.679 9.679 8.250 1.429 18921 797 1 22 . 1 1 12 12 SER HA H 12 4.579 4.579 4.721 -0.142 18921 798 1 22 . 1 1 12 12 SER H H 12 8.753 8.753 8.763 -0.010 18921 799 1 22 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.059 -0.205 18921 800 1 22 . 1 1 13 13 LEU H H 13 8.629 8.629 8.633 -0.004 18921 801 1 22 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.531 -0.388 18921 802 1 22 . 1 1 14 14 TYR H H 14 7.488 7.488 8.263 -0.775 18921 803 1 22 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.468 -0.510 18921 804 1 22 . 1 1 15 15 GLN H H 15 7.560 7.560 7.576 -0.016 18921 805 1 22 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.611 -0.442 18921 806 1 22 . 1 1 16 16 LEU H H 16 8.151 8.151 8.079 0.072 18921 807 1 22 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.980 0.161 18921 808 1 22 . 1 1 17 17 GLU H H 17 8.083 8.083 8.477 -0.394 18921 809 1 22 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.501 -0.059 18921 810 1 22 . 1 1 18 18 ASN H H 18 7.430 7.430 7.699 -0.269 18921 811 1 22 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.619 -0.125 18921 812 1 22 . 1 1 19 19 TYR H H 19 7.894 7.894 7.814 0.080 18921 813 1 22 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.383 0.262 18921 814 1 22 . 1 1 20 20 CYS H H 20 7.482 7.482 8.141 -0.659 18921 815 1 23 . 1 1 2 2 ILE H H 2 8.508 8.508 8.486 0.022 18921 816 1 23 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.578 0.020 18921 817 1 23 . 1 1 3 3 VAL H H 3 8.089 8.089 8.075 0.014 18921 818 1 23 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.083 0.115 18921 819 1 23 . 1 1 4 4 GLU H H 4 8.271 8.271 7.708 0.563 18921 820 1 23 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.292 -0.242 18921 821 1 23 . 1 1 5 5 GLN H H 5 8.272 8.272 7.517 0.755 18921 822 1 23 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.647 0.269 18921 823 1 23 . 1 1 6 6 CYS H H 6 8.273 8.273 8.120 0.153 18921 824 1 23 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.262 0.585 18921 825 1 23 . 1 1 7 7 CYS H H 7 8.269 8.269 8.179 0.090 18921 826 1 23 . 1 1 8 8 THR HA H 8 4.045 4.045 4.292 -0.247 18921 827 1 23 . 1 1 8 8 THR H H 8 8.227 8.227 8.165 0.062 18921 828 1 23 . 1 1 9 9 SER HA H 9 4.756 4.756 4.560 0.196 18921 829 1 23 . 1 1 9 9 SER H H 9 7.392 7.392 7.582 -0.190 18921 830 1 23 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.068 0.303 18921 831 1 23 . 1 1 10 10 ILE H H 10 7.792 7.792 8.166 -0.374 18921 832 1 23 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.928 -0.009 18921 833 1 23 . 1 1 11 11 CYS H H 11 9.679 9.679 8.210 1.469 18921 834 1 23 . 1 1 12 12 SER HA H 12 4.579 4.579 4.710 -0.131 18921 835 1 23 . 1 1 12 12 SER H H 12 8.753 8.753 8.571 0.182 18921 836 1 23 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.040 -0.186 18921 837 1 23 . 1 1 13 13 LEU H H 13 8.629 8.629 8.690 -0.061 18921 838 1 23 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.555 -0.412 18921 839 1 23 . 1 1 14 14 TYR H H 14 7.488 7.488 8.293 -0.805 18921 840 1 23 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.435 -0.477 18921 841 1 23 . 1 1 15 15 GLN H H 15 7.560 7.560 7.607 -0.047 18921 842 1 23 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.426 -0.257 18921 843 1 23 . 1 1 16 16 LEU H H 16 8.151 8.151 8.182 -0.031 18921 844 1 23 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.921 0.220 18921 845 1 23 . 1 1 17 17 GLU H H 17 8.083 8.083 8.304 -0.221 18921 846 1 23 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.481 -0.039 18921 847 1 23 . 1 1 18 18 ASN H H 18 7.430 7.430 7.746 -0.316 18921 848 1 23 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.521 -0.027 18921 849 1 23 . 1 1 19 19 TYR H H 19 7.894 7.894 7.757 0.137 18921 850 1 23 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.406 0.239 18921 851 1 23 . 1 1 20 20 CYS H H 20 7.482 7.482 8.136 -0.654 18921 852 1 24 . 1 1 2 2 ILE H H 2 8.508 8.508 8.086 0.422 18921 853 1 24 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.648 -0.050 18921 854 1 24 . 1 1 3 3 VAL H H 3 8.089 8.089 8.106 -0.017 18921 855 1 24 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.071 0.127 18921 856 1 24 . 1 1 4 4 GLU H H 4 8.271 8.271 8.573 -0.302 18921 857 1 24 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.221 -0.171 18921 858 1 24 . 1 1 5 5 GLN H H 5 8.272 8.272 7.564 0.708 18921 859 1 24 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.743 0.173 18921 860 1 24 . 1 1 6 6 CYS H H 6 8.273 8.273 7.966 0.307 18921 861 1 24 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.236 0.611 18921 862 1 24 . 1 1 7 7 CYS H H 7 8.269 8.269 8.312 -0.043 18921 863 1 24 . 1 1 8 8 THR HA H 8 4.045 4.045 4.382 -0.337 18921 864 1 24 . 1 1 8 8 THR H H 8 8.227 8.227 8.250 -0.023 18921 865 1 24 . 1 1 9 9 SER HA H 9 4.756 4.756 4.653 0.103 18921 866 1 24 . 1 1 9 9 SER H H 9 7.392 7.392 7.532 -0.140 18921 867 1 24 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.004 0.367 18921 868 1 24 . 1 1 10 10 ILE H H 10 7.792 7.792 8.180 -0.388 18921 869 1 24 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.903 0.016 18921 870 1 24 . 1 1 11 11 CYS H H 11 9.679 9.679 8.225 1.454 18921 871 1 24 . 1 1 12 12 SER HA H 12 4.579 4.579 4.699 -0.120 18921 872 1 24 . 1 1 12 12 SER H H 12 8.753 8.753 8.273 0.480 18921 873 1 24 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.051 -0.197 18921 874 1 24 . 1 1 13 13 LEU H H 13 8.629 8.629 8.673 -0.044 18921 875 1 24 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.416 -0.273 18921 876 1 24 . 1 1 14 14 TYR H H 14 7.488 7.488 8.225 -0.737 18921 877 1 24 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.445 -0.487 18921 878 1 24 . 1 1 15 15 GLN H H 15 7.560 7.560 7.718 -0.158 18921 879 1 24 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.415 -0.246 18921 880 1 24 . 1 1 16 16 LEU H H 16 8.151 8.151 8.403 -0.252 18921 881 1 24 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.924 0.217 18921 882 1 24 . 1 1 17 17 GLU H H 17 8.083 8.083 8.312 -0.229 18921 883 1 24 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.477 -0.035 18921 884 1 24 . 1 1 18 18 ASN H H 18 7.430 7.430 7.727 -0.297 18921 885 1 24 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.652 -0.158 18921 886 1 24 . 1 1 19 19 TYR H H 19 7.894 7.894 7.719 0.175 18921 887 1 24 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.346 0.299 18921 888 1 24 . 1 1 20 20 CYS H H 20 7.482 7.482 8.088 -0.606 18921 889 1 25 . 1 1 2 2 ILE H H 2 8.508 8.508 8.198 0.310 18921 890 1 25 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.616 -0.018 18921 891 1 25 . 1 1 3 3 VAL H H 3 8.089 8.089 7.953 0.136 18921 892 1 25 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.089 0.109 18921 893 1 25 . 1 1 4 4 GLU H H 4 8.271 8.271 8.565 -0.294 18921 894 1 25 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.314 -0.264 18921 895 1 25 . 1 1 5 5 GLN H H 5 8.272 8.272 7.580 0.692 18921 896 1 25 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.950 -0.034 18921 897 1 25 . 1 1 6 6 CYS H H 6 8.273 8.273 8.352 -0.079 18921 898 1 25 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.395 0.452 18921 899 1 25 . 1 1 7 7 CYS H H 7 8.269 8.269 8.143 0.126 18921 900 1 25 . 1 1 8 8 THR HA H 8 4.045 4.045 4.331 -0.286 18921 901 1 25 . 1 1 8 8 THR H H 8 8.227 8.227 7.943 0.284 18921 902 1 25 . 1 1 9 9 SER HA H 9 4.756 4.756 4.635 0.121 18921 903 1 25 . 1 1 9 9 SER H H 9 7.392 7.392 7.508 -0.116 18921 904 1 25 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.024 0.347 18921 905 1 25 . 1 1 10 10 ILE H H 10 7.792 7.792 8.236 -0.444 18921 906 1 25 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.031 -0.112 18921 907 1 25 . 1 1 11 11 CYS H H 11 9.679 9.679 8.439 1.240 18921 908 1 25 . 1 1 12 12 SER HA H 12 4.579 4.579 4.724 -0.145 18921 909 1 25 . 1 1 12 12 SER H H 12 8.753 8.753 8.634 0.119 18921 910 1 25 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.072 -0.218 18921 911 1 25 . 1 1 13 13 LEU H H 13 8.629 8.629 8.639 -0.010 18921 912 1 25 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.575 -0.432 18921 913 1 25 . 1 1 14 14 TYR H H 14 7.488 7.488 8.231 -0.743 18921 914 1 25 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.465 -0.507 18921 915 1 25 . 1 1 15 15 GLN H H 15 7.560 7.560 7.574 -0.014 18921 916 1 25 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.382 -0.213 18921 917 1 25 . 1 1 16 16 LEU H H 16 8.151 8.151 8.280 -0.129 18921 918 1 25 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.933 0.208 18921 919 1 25 . 1 1 17 17 GLU H H 17 8.083 8.083 8.253 -0.170 18921 920 1 25 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.476 -0.034 18921 921 1 25 . 1 1 18 18 ASN H H 18 7.430 7.430 7.899 -0.469 18921 922 1 25 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.537 -0.043 18921 923 1 25 . 1 1 19 19 TYR H H 19 7.894 7.894 7.739 0.155 18921 924 1 25 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.365 0.280 18921 925 1 25 . 1 1 20 20 CYS H H 20 7.482 7.482 8.106 -0.624 18921 926 1 26 . 1 1 2 2 ILE H H 2 8.508 8.508 8.455 0.053 18921 927 1 26 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.611 -0.013 18921 928 1 26 . 1 1 3 3 VAL H H 3 8.089 8.089 7.961 0.128 18921 929 1 26 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.089 0.109 18921 930 1 26 . 1 1 4 4 GLU H H 4 8.271 8.271 7.722 0.549 18921 931 1 26 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.286 -0.236 18921 932 1 26 . 1 1 5 5 GLN H H 5 8.272 8.272 7.575 0.697 18921 933 1 26 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.941 -0.025 18921 934 1 26 . 1 1 6 6 CYS H H 6 8.273 8.273 7.870 0.403 18921 935 1 26 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.458 0.389 18921 936 1 26 . 1 1 7 7 CYS H H 7 8.269 8.269 8.171 0.098 18921 937 1 26 . 1 1 8 8 THR HA H 8 4.045 4.045 4.137 -0.092 18921 938 1 26 . 1 1 8 8 THR H H 8 8.227 8.227 7.887 0.340 18921 939 1 26 . 1 1 9 9 SER HA H 9 4.756 4.756 4.519 0.237 18921 940 1 26 . 1 1 9 9 SER H H 9 7.392 7.392 7.676 -0.284 18921 941 1 26 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.023 0.348 18921 942 1 26 . 1 1 10 10 ILE H H 10 7.792 7.792 8.223 -0.431 18921 943 1 26 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.184 -0.265 18921 944 1 26 . 1 1 11 11 CYS H H 11 9.679 9.679 8.379 1.300 18921 945 1 26 . 1 1 12 12 SER HA H 12 4.579 4.579 4.727 -0.148 18921 946 1 26 . 1 1 12 12 SER H H 12 8.753 8.753 8.506 0.247 18921 947 1 26 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.121 -0.267 18921 948 1 26 . 1 1 13 13 LEU H H 13 8.629 8.629 8.564 0.065 18921 949 1 26 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.419 -0.276 18921 950 1 26 . 1 1 14 14 TYR H H 14 7.488 7.488 8.283 -0.795 18921 951 1 26 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.462 -0.504 18921 952 1 26 . 1 1 15 15 GLN H H 15 7.560 7.560 7.488 0.072 18921 953 1 26 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.440 -0.271 18921 954 1 26 . 1 1 16 16 LEU H H 16 8.151 8.151 7.906 0.245 18921 955 1 26 . 1 1 17 17 GLU HA H 17 4.141 4.141 4.129 0.012 18921 956 1 26 . 1 1 17 17 GLU H H 17 8.083 8.083 8.188 -0.105 18921 957 1 26 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.431 0.011 18921 958 1 26 . 1 1 18 18 ASN H H 18 7.430 7.430 8.686 -1.256 18921 959 1 26 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.582 -0.088 18921 960 1 26 . 1 1 19 19 TYR H H 19 7.894 7.894 7.714 0.180 18921 961 1 26 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.276 0.369 18921 962 1 26 . 1 1 20 20 CYS H H 20 7.482 7.482 8.002 -0.520 18921 963 1 27 . 1 1 2 2 ILE H H 2 8.508 8.508 8.537 -0.029 18921 964 1 27 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.535 0.063 18921 965 1 27 . 1 1 3 3 VAL H H 3 8.089 8.089 8.045 0.044 18921 966 1 27 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.121 0.077 18921 967 1 27 . 1 1 4 4 GLU H H 4 8.271 8.271 7.759 0.512 18921 968 1 27 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.235 -0.185 18921 969 1 27 . 1 1 5 5 GLN H H 5 8.272 8.272 7.569 0.703 18921 970 1 27 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.822 0.094 18921 971 1 27 . 1 1 6 6 CYS H H 6 8.273 8.273 7.978 0.295 18921 972 1 27 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.390 0.457 18921 973 1 27 . 1 1 7 7 CYS H H 7 8.269 8.269 8.249 0.020 18921 974 1 27 . 1 1 8 8 THR HA H 8 4.045 4.045 4.120 -0.075 18921 975 1 27 . 1 1 8 8 THR H H 8 8.227 8.227 8.085 0.142 18921 976 1 27 . 1 1 9 9 SER HA H 9 4.756 4.756 4.547 0.209 18921 977 1 27 . 1 1 9 9 SER H H 9 7.392 7.392 7.577 -0.185 18921 978 1 27 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.057 0.314 18921 979 1 27 . 1 1 10 10 ILE H H 10 7.792 7.792 8.185 -0.393 18921 980 1 27 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.883 0.036 18921 981 1 27 . 1 1 11 11 CYS H H 11 9.679 9.679 8.292 1.387 18921 982 1 27 . 1 1 12 12 SER HA H 12 4.579 4.579 4.657 -0.078 18921 983 1 27 . 1 1 12 12 SER H H 12 8.753 8.753 8.642 0.111 18921 984 1 27 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.049 -0.195 18921 985 1 27 . 1 1 13 13 LEU H H 13 8.629 8.629 8.654 -0.025 18921 986 1 27 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.770 -0.627 18921 987 1 27 . 1 1 14 14 TYR H H 14 7.488 7.488 8.302 -0.814 18921 988 1 27 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.416 -0.458 18921 989 1 27 . 1 1 15 15 GLN H H 15 7.560 7.560 7.462 0.098 18921 990 1 27 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.468 -0.299 18921 991 1 27 . 1 1 16 16 LEU H H 16 8.151 8.151 7.757 0.394 18921 992 1 27 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.938 0.203 18921 993 1 27 . 1 1 17 17 GLU H H 17 8.083 8.083 8.408 -0.325 18921 994 1 27 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.683 -0.241 18921 995 1 27 . 1 1 18 18 ASN H H 18 7.430 7.430 8.741 -1.311 18921 996 1 27 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.573 -0.079 18921 997 1 27 . 1 1 19 19 TYR H H 19 7.894 7.894 7.773 0.121 18921 998 1 27 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.415 0.230 18921 999 1 27 . 1 1 20 20 CYS H H 20 7.482 7.482 8.087 -0.605 18921 1000 1 28 . 1 1 2 2 ILE H H 2 8.508 8.508 8.026 0.482 18921 1001 1 28 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.562 0.036 18921 1002 1 28 . 1 1 3 3 VAL H H 3 8.089 8.089 8.022 0.067 18921 1003 1 28 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.107 0.091 18921 1004 1 28 . 1 1 4 4 GLU H H 4 8.271 8.271 7.683 0.588 18921 1005 1 28 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.277 -0.227 18921 1006 1 28 . 1 1 5 5 GLN H H 5 8.272 8.272 7.452 0.820 18921 1007 1 28 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.733 0.183 18921 1008 1 28 . 1 1 6 6 CYS H H 6 8.273 8.273 8.368 -0.095 18921 1009 1 28 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.387 0.460 18921 1010 1 28 . 1 1 7 7 CYS H H 7 8.269 8.269 8.230 0.039 18921 1011 1 28 . 1 1 8 8 THR HA H 8 4.045 4.045 4.345 -0.300 18921 1012 1 28 . 1 1 8 8 THR H H 8 8.227 8.227 8.212 0.015 18921 1013 1 28 . 1 1 9 9 SER HA H 9 4.756 4.756 4.611 0.145 18921 1014 1 28 . 1 1 9 9 SER H H 9 7.392 7.392 7.532 -0.140 18921 1015 1 28 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.044 0.327 18921 1016 1 28 . 1 1 10 10 ILE H H 10 7.792 7.792 8.215 -0.423 18921 1017 1 28 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.928 -0.009 18921 1018 1 28 . 1 1 11 11 CYS H H 11 9.679 9.679 8.271 1.408 18921 1019 1 28 . 1 1 12 12 SER HA H 12 4.579 4.579 4.717 -0.138 18921 1020 1 28 . 1 1 12 12 SER H H 12 8.753 8.753 8.645 0.108 18921 1021 1 28 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.038 -0.184 18921 1022 1 28 . 1 1 13 13 LEU H H 13 8.629 8.629 8.681 -0.052 18921 1023 1 28 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.627 -0.484 18921 1024 1 28 . 1 1 14 14 TYR H H 14 7.488 7.488 8.393 -0.905 18921 1025 1 28 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.365 -0.407 18921 1026 1 28 . 1 1 15 15 GLN H H 15 7.560 7.560 7.434 0.126 18921 1027 1 28 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.424 -0.255 18921 1028 1 28 . 1 1 16 16 LEU H H 16 8.151 8.151 8.053 0.098 18921 1029 1 28 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.935 0.206 18921 1030 1 28 . 1 1 17 17 GLU H H 17 8.083 8.083 8.595 -0.512 18921 1031 1 28 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.453 -0.011 18921 1032 1 28 . 1 1 18 18 ASN H H 18 7.430 7.430 7.820 -0.390 18921 1033 1 28 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.617 -0.123 18921 1034 1 28 . 1 1 19 19 TYR H H 19 7.894 7.894 7.852 0.042 18921 1035 1 28 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.312 0.333 18921 1036 1 28 . 1 1 20 20 CYS H H 20 7.482 7.482 8.203 -0.721 18921 1037 1 29 . 1 1 2 2 ILE H H 2 8.508 8.508 7.779 0.729 18921 1038 1 29 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.659 -0.061 18921 1039 1 29 . 1 1 3 3 VAL H H 3 8.089 8.089 7.903 0.186 18921 1040 1 29 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.192 0.006 18921 1041 1 29 . 1 1 4 4 GLU H H 4 8.271 8.271 8.673 -0.402 18921 1042 1 29 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.417 -0.367 18921 1043 1 29 . 1 1 5 5 GLN H H 5 8.272 8.272 7.482 0.790 18921 1044 1 29 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.677 0.239 18921 1045 1 29 . 1 1 6 6 CYS H H 6 8.273 8.273 8.416 -0.143 18921 1046 1 29 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.351 0.496 18921 1047 1 29 . 1 1 7 7 CYS H H 7 8.269 8.269 8.150 0.119 18921 1048 1 29 . 1 1 8 8 THR HA H 8 4.045 4.045 4.236 -0.191 18921 1049 1 29 . 1 1 8 8 THR H H 8 8.227 8.227 7.915 0.312 18921 1050 1 29 . 1 1 9 9 SER HA H 9 4.756 4.756 4.641 0.115 18921 1051 1 29 . 1 1 9 9 SER H H 9 7.392 7.392 7.828 -0.436 18921 1052 1 29 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.058 0.313 18921 1053 1 29 . 1 1 10 10 ILE H H 10 7.792 7.792 8.186 -0.394 18921 1054 1 29 . 1 1 11 11 CYS HA H 11 4.919 4.919 5.056 -0.137 18921 1055 1 29 . 1 1 11 11 CYS H H 11 9.679 9.679 8.323 1.356 18921 1056 1 29 . 1 1 12 12 SER HA H 12 4.579 4.579 4.769 -0.190 18921 1057 1 29 . 1 1 12 12 SER H H 12 8.753 8.753 8.665 0.088 18921 1058 1 29 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.063 -0.209 18921 1059 1 29 . 1 1 13 13 LEU H H 13 8.629 8.629 8.585 0.044 18921 1060 1 29 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.620 -0.477 18921 1061 1 29 . 1 1 14 14 TYR H H 14 7.488 7.488 8.420 -0.932 18921 1062 1 29 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.354 -0.396 18921 1063 1 29 . 1 1 15 15 GLN H H 15 7.560 7.560 7.496 0.064 18921 1064 1 29 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.498 -0.329 18921 1065 1 29 . 1 1 16 16 LEU H H 16 8.151 8.151 7.995 0.156 18921 1066 1 29 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.911 0.230 18921 1067 1 29 . 1 1 17 17 GLU H H 17 8.083 8.083 8.631 -0.548 18921 1068 1 29 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.433 0.009 18921 1069 1 29 . 1 1 18 18 ASN H H 18 7.430 7.430 8.664 -1.234 18921 1070 1 29 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.633 -0.139 18921 1071 1 29 . 1 1 19 19 TYR H H 19 7.894 7.894 7.808 0.086 18921 1072 1 29 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.320 0.325 18921 1073 1 29 . 1 1 20 20 CYS H H 20 7.482 7.482 8.141 -0.659 18921 1074 1 30 . 1 1 2 2 ILE H H 2 8.508 8.508 9.200 -0.692 18921 1075 1 30 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.653 -0.055 18921 1076 1 30 . 1 1 3 3 VAL H H 3 8.089 8.089 8.042 0.047 18921 1077 1 30 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.179 0.019 18921 1078 1 30 . 1 1 4 4 GLU H H 4 8.271 8.271 8.733 -0.462 18921 1079 1 30 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.453 -0.403 18921 1080 1 30 . 1 1 5 5 GLN H H 5 8.272 8.272 7.662 0.610 18921 1081 1 30 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.843 0.073 18921 1082 1 30 . 1 1 6 6 CYS H H 6 8.273 8.273 8.354 -0.081 18921 1083 1 30 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.337 0.510 18921 1084 1 30 . 1 1 7 7 CYS H H 7 8.269 8.269 8.206 0.063 18921 1085 1 30 . 1 1 8 8 THR HA H 8 4.045 4.045 4.348 -0.303 18921 1086 1 30 . 1 1 8 8 THR H H 8 8.227 8.227 8.021 0.206 18921 1087 1 30 . 1 1 9 9 SER HA H 9 4.756 4.756 4.671 0.085 18921 1088 1 30 . 1 1 9 9 SER H H 9 7.392 7.392 7.915 -0.523 18921 1089 1 30 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.007 0.364 18921 1090 1 30 . 1 1 10 10 ILE H H 10 7.792 7.792 8.215 -0.423 18921 1091 1 30 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.816 0.103 18921 1092 1 30 . 1 1 11 11 CYS H H 11 9.679 9.679 8.747 0.932 18921 1093 1 30 . 1 1 12 12 SER HA H 12 4.579 4.579 4.712 -0.133 18921 1094 1 30 . 1 1 12 12 SER H H 12 8.753 8.753 8.131 0.622 18921 1095 1 30 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.041 -0.187 18921 1096 1 30 . 1 1 13 13 LEU H H 13 8.629 8.629 8.679 -0.050 18921 1097 1 30 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.463 -0.320 18921 1098 1 30 . 1 1 14 14 TYR H H 14 7.488 7.488 8.285 -0.797 18921 1099 1 30 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.469 -0.511 18921 1100 1 30 . 1 1 15 15 GLN H H 15 7.560 7.560 7.737 -0.177 18921 1101 1 30 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.405 -0.236 18921 1102 1 30 . 1 1 16 16 LEU H H 16 8.151 8.151 8.446 -0.295 18921 1103 1 30 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.942 0.199 18921 1104 1 30 . 1 1 17 17 GLU H H 17 8.083 8.083 8.230 -0.147 18921 1105 1 30 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.534 -0.092 18921 1106 1 30 . 1 1 18 18 ASN H H 18 7.430 7.430 7.816 -0.386 18921 1107 1 30 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.536 -0.042 18921 1108 1 30 . 1 1 19 19 TYR H H 19 7.894 7.894 7.822 0.072 18921 1109 1 30 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.297 0.348 18921 1110 1 30 . 1 1 20 20 CYS H H 20 7.482 7.482 7.972 -0.490 18921 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 18921 2 1 1 "Average Difference" HA 18 0.276 0.046 0.280 18921 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18921 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18921 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18921 6 1 1 "Average Difference" HN 19 0.512 0.031 0.525 18921 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18921 8 1 2 "Average Difference" HA 18 0.246 0.051 0.248 18921 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18921 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18921 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18921 12 1 2 "Average Difference" HN 19 0.508 -0.075 0.517 18921 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18921 14 1 3 "Average Difference" HA 18 0.273 0.034 0.279 18921 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18921 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18921 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18921 18 1 3 "Average Difference" HN 19 0.498 -0.033 0.510 18921 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18921 20 1 4 "Average Difference" HA 18 0.262 -0.013 0.269 18921 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18921 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18921 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18921 24 1 4 "Average Difference" HN 19 0.490 -0.035 0.503 18921 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18921 26 1 5 "Average Difference" HA 18 0.265 0.021 0.272 18921 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18921 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18921 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18921 30 1 5 "Average Difference" HN 19 0.461 0.011 0.474 18921 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18921 32 1 6 "Average Difference" HA 18 0.285 0.034 0.291 18921 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18921 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18921 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18921 36 1 6 "Average Difference" HN 19 0.456 -0.024 0.468 18921 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18921 38 1 7 "Average Difference" HA 18 0.244 0.021 0.250 18921 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18921 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18921 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18921 42 1 7 "Average Difference" HN 19 0.474 -0.075 0.481 18921 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18921 44 1 8 "Average Difference" HA 18 0.285 0.044 0.290 18921 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18921 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18921 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18921 48 1 8 "Average Difference" HN 19 0.451 0.013 0.464 18921 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18921 50 1 9 "Average Difference" HA 18 0.256 0.039 0.260 18921 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18921 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18921 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18921 54 1 9 "Average Difference" HN 19 0.496 0.037 0.508 18921 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18921 56 1 10 "Average Difference" HA 18 0.265 0.042 0.269 18921 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18921 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18921 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18921 60 1 10 "Average Difference" HN 19 0.479 0.051 0.489 18921 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18921 62 1 11 "Average Difference" HA 18 0.312 0.048 0.317 18921 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18921 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18921 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18921 66 1 11 "Average Difference" HN 19 0.460 0.013 0.473 18921 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18921 68 1 12 "Average Difference" HA 18 0.258 0.042 0.262 18921 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18921 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18921 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18921 72 1 12 "Average Difference" HN 19 0.453 0.016 0.465 18921 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18921 74 1 13 "Average Difference" HA 18 0.293 0.035 0.299 18921 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18921 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18921 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18921 78 1 13 "Average Difference" HN 19 0.500 0.004 0.514 18921 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18921 80 1 14 "Average Difference" HA 18 0.277 0.062 0.277 18921 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18921 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18921 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18921 84 1 14 "Average Difference" HN 19 0.456 0.040 0.467 18921 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18921 86 1 15 "Average Difference" HA 18 0.226 0.021 0.231 18921 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18921 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18921 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18921 90 1 15 "Average Difference" HN 19 0.569 -0.015 0.584 18921 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18921 92 1 16 "Average Difference" HA 18 0.272 0.055 0.274 18921 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18921 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18921 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18921 96 1 16 "Average Difference" HN 19 0.485 0.009 0.498 18921 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18921 98 1 17 "Average Difference" HA 18 0.299 0.050 0.303 18921 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18921 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18921 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18921 102 1 17 "Average Difference" HN 19 0.474 0.058 0.484 18921 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18921 104 1 18 "Average Difference" HA 18 0.290 0.008 0.298 18921 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18921 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18921 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18921 108 1 18 "Average Difference" HN 19 0.474 0.050 0.484 18921 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18921 110 1 19 "Average Difference" HA 18 0.291 0.035 0.297 18921 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18921 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18921 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18921 114 1 19 "Average Difference" HN 19 0.500 0.021 0.513 18921 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18921 116 1 20 "Average Difference" HA 18 0.272 0.059 0.273 18921 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18921 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18921 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18921 120 1 20 "Average Difference" HN 19 0.476 0.036 0.487 18921 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 18921 122 1 21 "Average Difference" HA 18 0.262 0.047 0.265 18921 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 18921 124 1 21 "Average Difference" CA 0 0.000 0.000 0.000 18921 125 1 21 "Average Difference" CB 0 0.000 0.000 0.000 18921 126 1 21 "Average Difference" HN 19 0.440 -0.004 0.452 18921 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 18921 128 1 22 "Average Difference" HA 18 0.265 0.038 0.270 18921 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 18921 130 1 22 "Average Difference" CA 0 0.000 0.000 0.000 18921 131 1 22 "Average Difference" CB 0 0.000 0.000 0.000 18921 132 1 22 "Average Difference" HN 19 0.489 -0.029 0.501 18921 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 18921 134 1 23 "Average Difference" HA 18 0.269 0.004 0.277 18921 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 18921 136 1 23 "Average Difference" CA 0 0.000 0.000 0.000 18921 137 1 23 "Average Difference" CB 0 0.000 0.000 0.000 18921 138 1 23 "Average Difference" HN 19 0.489 -0.039 0.501 18921 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 18921 140 1 24 "Average Difference" HA 18 0.269 0.009 0.276 18921 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 18921 142 1 24 "Average Difference" CA 0 0.000 0.000 0.000 18921 143 1 24 "Average Difference" CB 0 0.000 0.000 0.000 18921 144 1 24 "Average Difference" HN 19 0.490 -0.016 0.503 18921 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 18921 146 1 25 "Average Difference" HA 18 0.258 0.044 0.262 18921 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 18921 148 1 25 "Average Difference" CA 0 0.000 0.000 0.000 18921 149 1 25 "Average Difference" CB 0 0.000 0.000 0.000 18921 150 1 25 "Average Difference" HN 19 0.446 0.001 0.458 18921 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 18921 152 1 26 "Average Difference" HA 18 0.249 0.039 0.253 18921 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 18921 154 1 26 "Average Difference" CA 0 0.000 0.000 0.000 18921 155 1 26 "Average Difference" CB 0 0.000 0.000 0.000 18921 156 1 26 "Average Difference" HN 19 0.548 -0.052 0.560 18921 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 18921 158 1 27 "Average Difference" HA 18 0.269 0.031 0.275 18921 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 18921 160 1 27 "Average Difference" CA 0 0.000 0.000 0.000 18921 161 1 27 "Average Difference" CB 0 0.000 0.000 0.000 18921 162 1 27 "Average Difference" HN 19 0.563 -0.007 0.579 18921 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 18921 164 1 28 "Average Difference" HA 18 0.259 0.020 0.266 18921 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 18921 166 1 28 "Average Difference" CA 0 0.000 0.000 0.000 18921 167 1 28 "Average Difference" CB 0 0.000 0.000 0.000 18921 168 1 28 "Average Difference" HN 19 0.525 -0.029 0.539 18921 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 18921 170 1 29 "Average Difference" HA 18 0.275 0.042 0.279 18921 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 18921 172 1 29 "Average Difference" CA 0 0.000 0.000 0.000 18921 173 1 29 "Average Difference" CB 0 0.000 0.000 0.000 18921 174 1 29 "Average Difference" HN 19 0.600 0.043 0.615 18921 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 18921 176 1 30 "Average Difference" HA 18 0.271 0.032 0.276 18921 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 18921 178 1 30 "Average Difference" CA 0 0.000 0.000 0.000 18921 179 1 30 "Average Difference" CB 0 0.000 0.000 0.000 18921 180 1 30 "Average Difference" HN 19 0.459 0.104 0.459 18921 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 18921 _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 ILE H H 2 8.508 8.508 8.389 0.119 18921 2 1 . 1 1 3 3 VAL HA H 3 3.598 3.598 3.629 -0.031 18921 3 1 . 1 1 3 3 VAL H H 3 8.089 8.089 8.009 0.080 18921 4 1 . 1 1 4 4 GLU HA H 4 4.198 4.198 4.130 0.068 18921 5 1 . 1 1 4 4 GLU H H 4 8.271 8.271 8.241 0.030 18921 6 1 . 1 1 5 5 GLN HA H 5 4.050 4.050 4.317 -0.267 18921 7 1 . 1 1 5 5 GLN H H 5 8.272 8.272 7.545 0.727 18921 8 1 . 1 1 6 6 CYS HA H 6 4.916 4.916 4.829 0.087 18921 9 1 . 1 1 6 6 CYS H H 6 8.273 8.273 8.162 0.111 18921 10 1 . 1 1 7 7 CYS HA H 7 4.847 4.847 4.353 0.494 18921 11 1 . 1 1 7 7 CYS H H 7 8.269 8.269 8.249 0.020 18921 12 1 . 1 1 8 8 THR HA H 8 4.045 4.045 4.282 -0.237 18921 13 1 . 1 1 8 8 THR H H 8 8.227 8.227 8.162 0.065 18921 14 1 . 1 1 9 9 SER HA H 9 4.756 4.756 4.605 0.151 18921 15 1 . 1 1 9 9 SER H H 9 7.392 7.392 7.637 -0.245 18921 16 1 . 1 1 10 10 ILE HA H 10 4.371 4.371 4.026 0.345 18921 17 1 . 1 1 10 10 ILE H H 10 7.792 7.792 8.213 -0.421 18921 18 1 . 1 1 11 11 CYS HA H 11 4.919 4.919 4.938 -0.019 18921 19 1 . 1 1 11 11 CYS H H 11 9.679 9.679 8.353 1.326 18921 20 1 . 1 1 12 12 SER HA H 12 4.579 4.579 4.698 -0.119 18921 21 1 . 1 1 12 12 SER H H 12 8.753 8.753 8.504 0.249 18921 22 1 . 1 1 13 13 LEU HA H 13 3.854 3.854 4.059 -0.205 18921 23 1 . 1 1 13 13 LEU H H 13 8.629 8.629 8.647 -0.018 18921 24 1 . 1 1 14 14 TYR HA H 14 4.143 4.143 4.599 -0.456 18921 25 1 . 1 1 14 14 TYR H H 14 7.488 7.488 8.290 -0.802 18921 26 1 . 1 1 15 15 GLN HA H 15 3.958 3.958 4.451 -0.493 18921 27 1 . 1 1 15 15 GLN H H 15 7.560 7.560 7.559 0.001 18921 28 1 . 1 1 16 16 LEU HA H 16 4.169 4.169 4.429 -0.260 18921 29 1 . 1 1 16 16 LEU H H 16 8.151 8.151 8.148 0.003 18921 30 1 . 1 1 17 17 GLU HA H 17 4.141 4.141 3.948 0.193 18921 31 1 . 1 1 17 17 GLU H H 17 8.083 8.083 8.377 -0.294 18921 32 1 . 1 1 18 18 ASN HA H 18 4.442 4.442 4.499 -0.057 18921 33 1 . 1 1 18 18 ASN H H 18 7.430 7.430 7.904 -0.474 18921 34 1 . 1 1 19 19 TYR HA H 19 4.494 4.494 4.573 -0.079 18921 35 1 . 1 1 19 19 TYR H H 19 7.894 7.894 7.820 0.074 18921 36 1 . 1 1 20 20 CYS HA H 20 4.645 4.645 4.383 0.262 18921 37 1 . 1 1 20 20 CYS H H 20 7.482 7.482 8.099 -0.617 18921 stop_ save_