data_25613 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25613 _Entry.PDB_ID 2N2V 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 25613 _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 HA H 2 4.066 4.066 3.979 0.087 25613 2 1 1 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.846 -4.354 25613 3 1 1 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.567 -7.299 25613 4 1 1 . 1 1 2 2 ILE H H 2 8.541 8.541 8.419 0.122 25613 5 1 1 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.537 0.194 25613 6 1 1 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.630 -1.858 25613 7 1 1 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.324 0.272 25613 8 1 1 . 1 1 3 3 VAL H H 3 8.164 8.164 8.085 0.079 25613 9 1 1 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.982 0.309 25613 10 1 1 . 1 1 4 4 GLU CA C 4 57.076 57.076 60.120 -3.044 25613 11 1 1 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.978 -1.195 25613 12 1 1 . 1 1 4 4 GLU H H 4 8.161 8.161 8.702 -0.541 25613 13 1 1 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.051 0.074 25613 14 1 1 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.729 -0.146 25613 15 1 1 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.725 0.293 25613 16 1 1 . 1 1 5 5 GLN H H 5 8.290 8.290 7.866 0.424 25613 17 1 1 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.384 0.575 25613 18 1 1 . 1 1 6 6 CYS H H 6 8.369 8.369 8.111 0.258 25613 19 1 1 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.406 0.467 25613 20 1 1 . 1 1 7 7 CYS CB C 7 38.817 38.817 27.020 11.797 25613 21 1 1 . 1 1 7 7 CYS H H 7 8.308 8.308 8.142 0.166 25613 22 1 1 . 1 1 8 8 THR HA H 8 4.110 4.110 4.350 -0.240 25613 23 1 1 . 1 1 8 8 THR CA C 8 64.398 64.398 63.894 0.504 25613 24 1 1 . 1 1 8 8 THR CB C 8 68.493 68.493 69.221 -0.728 25613 25 1 1 . 1 1 8 8 THR H H 8 8.233 8.233 8.272 -0.039 25613 26 1 1 . 1 1 9 9 SER HA H 9 4.816 4.816 4.708 0.108 25613 27 1 1 . 1 1 9 9 SER CA C 9 55.989 55.989 56.533 -0.544 25613 28 1 1 . 1 1 9 9 SER CB C 9 64.007 64.007 64.986 -0.979 25613 29 1 1 . 1 1 9 9 SER H H 9 7.533 7.533 7.541 -0.008 25613 30 1 1 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.132 0.246 25613 31 1 1 . 1 1 10 10 ILE CA C 10 59.891 59.891 61.198 -1.307 25613 32 1 1 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.076 0.849 25613 33 1 1 . 1 1 10 10 ILE H H 10 7.876 7.876 8.352 -0.476 25613 34 1 1 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.615 0.351 25613 35 1 1 . 1 1 11 11 CYS H H 11 9.710 9.710 8.805 0.905 25613 36 1 1 . 1 1 12 12 SER HA H 12 4.635 4.635 4.659 -0.024 25613 37 1 1 . 1 1 12 12 SER CA C 12 56.435 56.435 57.447 -1.012 25613 38 1 1 . 1 1 12 12 SER CB C 12 65.596 65.596 65.247 0.349 25613 39 1 1 . 1 1 12 12 SER H H 12 8.799 8.799 8.142 0.657 25613 40 1 1 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.788 0.100 25613 41 1 1 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.198 0.031 25613 42 1 1 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.976 0.171 25613 43 1 1 . 1 1 13 13 LEU H H 13 8.652 8.652 8.385 0.267 25613 44 1 1 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.116 0.077 25613 45 1 1 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.634 -0.654 25613 46 1 1 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.748 0.873 25613 47 1 1 . 1 1 14 14 TYR H H 14 7.517 7.517 7.170 0.347 25613 48 1 1 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.932 0.083 25613 49 1 1 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.598 -0.136 25613 50 1 1 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.246 0.701 25613 51 1 1 . 1 1 15 15 GLN H H 15 7.581 7.581 7.590 -0.009 25613 52 1 1 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.312 0.893 25613 53 1 1 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.193 0.842 25613 54 1 1 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.699 0.168 25613 55 1 1 . 1 1 16 16 LEU H H 16 8.084 8.084 7.813 0.271 25613 56 1 1 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.000 0.227 25613 57 1 1 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.212 -1.542 25613 58 1 1 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.022 -0.046 25613 59 1 1 . 1 1 17 17 GLU H H 17 8.121 8.121 8.184 -0.063 25613 60 1 1 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.556 -0.036 25613 61 1 1 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.671 0.048 25613 62 1 1 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.252 0.127 25613 63 1 1 . 1 1 18 18 ASN H H 18 7.469 7.469 7.850 -0.381 25613 64 1 1 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.568 -0.040 25613 65 1 1 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.727 2.193 25613 66 1 1 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.989 0.283 25613 67 1 1 . 1 1 19 19 TYR H H 19 7.928 7.928 7.428 0.500 25613 68 1 1 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.822 0.145 25613 69 1 1 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.656 6.154 25613 70 1 1 . 1 1 20 20 CYS H H 20 7.484 7.484 7.670 -0.186 25613 71 1 2 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.983 0.083 25613 72 1 2 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.174 -4.681 25613 73 1 2 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.303 -7.035 25613 74 1 2 . 1 1 2 2 ILE H H 2 8.541 8.541 8.333 0.208 25613 75 1 2 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.571 0.160 25613 76 1 2 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.494 -1.722 25613 77 1 2 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.152 0.444 25613 78 1 2 . 1 1 3 3 VAL H H 3 8.164 8.164 8.124 0.040 25613 79 1 2 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.988 0.303 25613 80 1 2 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.074 -1.998 25613 81 1 2 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.732 -0.949 25613 82 1 2 . 1 1 4 4 GLU H H 4 8.161 8.161 8.081 0.080 25613 83 1 2 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.116 0.009 25613 84 1 2 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.565 0.018 25613 85 1 2 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.419 0.599 25613 86 1 2 . 1 1 5 5 GLN H H 5 8.290 8.290 7.582 0.708 25613 87 1 2 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.312 0.647 25613 88 1 2 . 1 1 6 6 CYS H H 6 8.369 8.369 8.277 0.092 25613 89 1 2 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.320 0.553 25613 90 1 2 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.668 12.149 25613 91 1 2 . 1 1 7 7 CYS H H 7 8.308 8.308 8.158 0.150 25613 92 1 2 . 1 1 8 8 THR HA H 8 4.110 4.110 4.312 -0.202 25613 93 1 2 . 1 1 8 8 THR CA C 8 64.398 64.398 64.055 0.343 25613 94 1 2 . 1 1 8 8 THR CB C 8 68.493 68.493 69.627 -1.134 25613 95 1 2 . 1 1 8 8 THR H H 8 8.233 8.233 8.207 0.026 25613 96 1 2 . 1 1 9 9 SER HA H 9 4.816 4.816 4.648 0.168 25613 97 1 2 . 1 1 9 9 SER CA C 9 55.989 55.989 57.356 -1.367 25613 98 1 2 . 1 1 9 9 SER CB C 9 64.007 64.007 65.505 -1.498 25613 99 1 2 . 1 1 9 9 SER H H 9 7.533 7.533 8.139 -0.606 25613 100 1 2 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.115 0.263 25613 101 1 2 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.776 -0.885 25613 102 1 2 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.761 2.163 25613 103 1 2 . 1 1 10 10 ILE H H 10 7.876 7.876 8.259 -0.383 25613 104 1 2 . 1 1 11 11 CYS HA H 11 4.966 4.966 5.086 -0.120 25613 105 1 2 . 1 1 11 11 CYS H H 11 9.710 9.710 8.737 0.973 25613 106 1 2 . 1 1 12 12 SER HA H 12 4.635 4.635 4.705 -0.070 25613 107 1 2 . 1 1 12 12 SER CA C 12 56.435 56.435 57.130 -0.695 25613 108 1 2 . 1 1 12 12 SER CB C 12 65.596 65.596 65.129 0.467 25613 109 1 2 . 1 1 12 12 SER H H 12 8.799 8.799 8.689 0.110 25613 110 1 2 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.754 0.134 25613 111 1 2 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.190 0.039 25613 112 1 2 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.119 0.028 25613 113 1 2 . 1 1 13 13 LEU H H 13 8.652 8.652 8.342 0.310 25613 114 1 2 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.365 -0.172 25613 115 1 2 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.195 -0.215 25613 116 1 2 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.714 0.907 25613 117 1 2 . 1 1 14 14 TYR H H 14 7.517 7.517 6.923 0.594 25613 118 1 2 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.861 0.154 25613 119 1 2 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.439 0.023 25613 120 1 2 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.207 0.740 25613 121 1 2 . 1 1 15 15 GLN H H 15 7.581 7.581 7.638 -0.057 25613 122 1 2 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.490 0.715 25613 123 1 2 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.391 0.644 25613 124 1 2 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.702 0.166 25613 125 1 2 . 1 1 16 16 LEU H H 16 8.084 8.084 7.878 0.206 25613 126 1 2 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.992 0.235 25613 127 1 2 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.284 -1.614 25613 128 1 2 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.363 -0.387 25613 129 1 2 . 1 1 17 17 GLU H H 17 8.121 8.121 8.545 -0.424 25613 130 1 2 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.559 -0.039 25613 131 1 2 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.432 0.287 25613 132 1 2 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.207 0.172 25613 133 1 2 . 1 1 18 18 ASN H H 18 7.469 7.469 7.926 -0.457 25613 134 1 2 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.582 -0.054 25613 135 1 2 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.440 2.480 25613 136 1 2 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.909 0.363 25613 137 1 2 . 1 1 19 19 TYR H H 19 7.928 7.928 7.462 0.466 25613 138 1 2 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.830 0.137 25613 139 1 2 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.675 6.135 25613 140 1 2 . 1 1 20 20 CYS H H 20 7.484 7.484 7.769 -0.285 25613 141 1 3 . 1 1 2 2 ILE HA H 2 4.066 4.066 4.204 -0.138 25613 142 1 3 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.513 -5.020 25613 143 1 3 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.127 -6.859 25613 144 1 3 . 1 1 2 2 ILE H H 2 8.541 8.541 8.461 0.080 25613 145 1 3 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.509 0.222 25613 146 1 3 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.981 -2.209 25613 147 1 3 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.404 0.192 25613 148 1 3 . 1 1 3 3 VAL H H 3 8.164 8.164 8.030 0.134 25613 149 1 3 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.953 0.338 25613 150 1 3 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.764 -2.688 25613 151 1 3 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.236 -1.453 25613 152 1 3 . 1 1 4 4 GLU H H 4 8.161 8.161 7.777 0.384 25613 153 1 3 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.043 0.082 25613 154 1 3 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.954 -0.371 25613 155 1 3 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.735 0.283 25613 156 1 3 . 1 1 5 5 GLN H H 5 8.290 8.290 8.019 0.271 25613 157 1 3 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.362 0.597 25613 158 1 3 . 1 1 6 6 CYS H H 6 8.369 8.369 8.207 0.162 25613 159 1 3 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.344 0.529 25613 160 1 3 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.786 12.031 25613 161 1 3 . 1 1 7 7 CYS H H 7 8.308 8.308 8.086 0.222 25613 162 1 3 . 1 1 8 8 THR HA H 8 4.110 4.110 4.320 -0.210 25613 163 1 3 . 1 1 8 8 THR CA C 8 64.398 64.398 63.716 0.682 25613 164 1 3 . 1 1 8 8 THR CB C 8 68.493 68.493 69.552 -1.059 25613 165 1 3 . 1 1 8 8 THR H H 8 8.233 8.233 8.227 0.006 25613 166 1 3 . 1 1 9 9 SER HA H 9 4.816 4.816 4.686 0.130 25613 167 1 3 . 1 1 9 9 SER CA C 9 55.989 55.989 56.639 -0.650 25613 168 1 3 . 1 1 9 9 SER CB C 9 64.007 64.007 64.793 -0.786 25613 169 1 3 . 1 1 9 9 SER H H 9 7.533 7.533 7.895 -0.362 25613 170 1 3 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.123 0.255 25613 171 1 3 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.736 -0.846 25613 172 1 3 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.020 1.905 25613 173 1 3 . 1 1 10 10 ILE H H 10 7.876 7.876 8.340 -0.464 25613 174 1 3 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.657 0.309 25613 175 1 3 . 1 1 11 11 CYS H H 11 9.710 9.710 8.677 1.033 25613 176 1 3 . 1 1 12 12 SER HA H 12 4.635 4.635 4.655 -0.020 25613 177 1 3 . 1 1 12 12 SER CA C 12 56.435 56.435 57.313 -0.878 25613 178 1 3 . 1 1 12 12 SER CB C 12 65.596 65.596 64.579 1.017 25613 179 1 3 . 1 1 12 12 SER H H 12 8.799 8.799 9.209 -0.410 25613 180 1 3 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.801 0.087 25613 181 1 3 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.420 -0.191 25613 182 1 3 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.042 0.105 25613 183 1 3 . 1 1 13 13 LEU H H 13 8.652 8.652 8.271 0.381 25613 184 1 3 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.080 0.113 25613 185 1 3 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.302 -0.322 25613 186 1 3 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.462 1.159 25613 187 1 3 . 1 1 14 14 TYR H H 14 7.517 7.517 6.941 0.576 25613 188 1 3 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.874 0.141 25613 189 1 3 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.484 -0.022 25613 190 1 3 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.220 0.727 25613 191 1 3 . 1 1 15 15 GLN H H 15 7.581 7.581 7.618 -0.037 25613 192 1 3 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.558 0.647 25613 193 1 3 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.447 0.588 25613 194 1 3 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.683 0.184 25613 195 1 3 . 1 1 16 16 LEU H H 16 8.084 8.084 7.973 0.111 25613 196 1 3 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.007 0.220 25613 197 1 3 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.336 -1.666 25613 198 1 3 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.207 -0.231 25613 199 1 3 . 1 1 17 17 GLU H H 17 8.121 8.121 8.395 -0.273 25613 200 1 3 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.543 -0.023 25613 201 1 3 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.449 0.270 25613 202 1 3 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.196 0.183 25613 203 1 3 . 1 1 18 18 ASN H H 18 7.469 7.469 7.938 -0.469 25613 204 1 3 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.574 -0.046 25613 205 1 3 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.792 2.128 25613 206 1 3 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.648 0.624 25613 207 1 3 . 1 1 19 19 TYR H H 19 7.928 7.928 7.487 0.441 25613 208 1 3 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.840 0.127 25613 209 1 3 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.586 5.224 25613 210 1 3 . 1 1 20 20 CYS H H 20 7.484 7.484 7.706 -0.222 25613 211 1 4 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.968 0.098 25613 212 1 4 . 1 1 2 2 ILE CA C 2 57.493 57.493 60.836 -3.343 25613 213 1 4 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.366 -7.098 25613 214 1 4 . 1 1 2 2 ILE H H 2 8.541 8.541 8.361 0.180 25613 215 1 4 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.330 0.401 25613 216 1 4 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.031 -1.259 25613 217 1 4 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.481 0.115 25613 218 1 4 . 1 1 3 3 VAL H H 3 8.164 8.164 7.971 0.193 25613 219 1 4 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.939 0.352 25613 220 1 4 . 1 1 4 4 GLU CA C 4 57.076 57.076 60.003 -2.927 25613 221 1 4 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.239 -1.456 25613 222 1 4 . 1 1 4 4 GLU H H 4 8.161 8.161 7.904 0.257 25613 223 1 4 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.111 0.014 25613 224 1 4 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.741 -0.158 25613 225 1 4 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.532 0.486 25613 226 1 4 . 1 1 5 5 GLN H H 5 8.290 8.290 7.779 0.511 25613 227 1 4 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.338 0.621 25613 228 1 4 . 1 1 6 6 CYS H H 6 8.369 8.369 8.251 0.118 25613 229 1 4 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.394 0.479 25613 230 1 4 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.710 12.107 25613 231 1 4 . 1 1 7 7 CYS H H 7 8.308 8.308 8.204 0.104 25613 232 1 4 . 1 1 8 8 THR HA H 8 4.110 4.110 4.309 -0.199 25613 233 1 4 . 1 1 8 8 THR CA C 8 64.398 64.398 63.968 0.430 25613 234 1 4 . 1 1 8 8 THR CB C 8 68.493 68.493 69.424 -0.931 25613 235 1 4 . 1 1 8 8 THR H H 8 8.233 8.233 8.219 0.014 25613 236 1 4 . 1 1 9 9 SER HA H 9 4.816 4.816 4.675 0.141 25613 237 1 4 . 1 1 9 9 SER CA C 9 55.989 55.989 56.787 -0.798 25613 238 1 4 . 1 1 9 9 SER CB C 9 64.007 64.007 64.847 -0.841 25613 239 1 4 . 1 1 9 9 SER H H 9 7.533 7.533 7.860 -0.327 25613 240 1 4 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.130 0.248 25613 241 1 4 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.723 -0.832 25613 242 1 4 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.791 2.134 25613 243 1 4 . 1 1 10 10 ILE H H 10 7.876 7.876 8.316 -0.440 25613 244 1 4 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.774 0.192 25613 245 1 4 . 1 1 11 11 CYS H H 11 9.710 9.710 8.763 0.947 25613 246 1 4 . 1 1 12 12 SER HA H 12 4.635 4.635 4.568 0.067 25613 247 1 4 . 1 1 12 12 SER CA C 12 56.435 56.435 57.140 -0.705 25613 248 1 4 . 1 1 12 12 SER CB C 12 65.596 65.596 64.042 1.554 25613 249 1 4 . 1 1 12 12 SER H H 12 8.799 8.799 9.048 -0.249 25613 250 1 4 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.914 -0.026 25613 251 1 4 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.558 0.671 25613 252 1 4 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.128 0.019 25613 253 1 4 . 1 1 13 13 LEU H H 13 8.652 8.652 8.031 0.621 25613 254 1 4 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.546 -0.353 25613 255 1 4 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.297 -0.317 25613 256 1 4 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.338 1.283 25613 257 1 4 . 1 1 14 14 TYR H H 14 7.517 7.517 6.922 0.595 25613 258 1 4 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.951 0.064 25613 259 1 4 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.697 -0.235 25613 260 1 4 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.095 0.852 25613 261 1 4 . 1 1 15 15 GLN H H 15 7.581 7.581 8.093 -0.512 25613 262 1 4 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.215 0.990 25613 263 1 4 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.252 0.783 25613 264 1 4 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.652 0.215 25613 265 1 4 . 1 1 16 16 LEU H H 16 8.084 8.084 7.866 0.218 25613 266 1 4 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.936 0.291 25613 267 1 4 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.441 -1.771 25613 268 1 4 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.242 -0.266 25613 269 1 4 . 1 1 17 17 GLU H H 17 8.121 8.121 8.236 -0.115 25613 270 1 4 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.569 -0.049 25613 271 1 4 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.614 0.105 25613 272 1 4 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.395 -0.016 25613 273 1 4 . 1 1 18 18 ASN H H 18 7.469 7.469 7.902 -0.433 25613 274 1 4 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.563 -0.035 25613 275 1 4 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.500 2.420 25613 276 1 4 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.898 0.374 25613 277 1 4 . 1 1 19 19 TYR H H 19 7.928 7.928 7.493 0.435 25613 278 1 4 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.827 0.140 25613 279 1 4 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.310 5.500 25613 280 1 4 . 1 1 20 20 CYS H H 20 7.484 7.484 7.716 -0.232 25613 281 1 5 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.775 0.291 25613 282 1 5 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.357 -4.864 25613 283 1 5 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.193 -6.925 25613 284 1 5 . 1 1 2 2 ILE H H 2 8.541 8.541 8.119 0.422 25613 285 1 5 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.400 0.331 25613 286 1 5 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.338 -1.566 25613 287 1 5 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.416 0.180 25613 288 1 5 . 1 1 3 3 VAL H H 3 8.164 8.164 7.998 0.166 25613 289 1 5 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.909 0.382 25613 290 1 5 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.727 -2.651 25613 291 1 5 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.335 -1.552 25613 292 1 5 . 1 1 4 4 GLU H H 4 8.161 8.161 7.810 0.351 25613 293 1 5 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.076 0.049 25613 294 1 5 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.191 -0.608 25613 295 1 5 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.464 0.554 25613 296 1 5 . 1 1 5 5 GLN H H 5 8.290 8.290 7.653 0.637 25613 297 1 5 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.474 0.485 25613 298 1 5 . 1 1 6 6 CYS H H 6 8.369 8.369 8.050 0.319 25613 299 1 5 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.247 0.626 25613 300 1 5 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.534 12.283 25613 301 1 5 . 1 1 7 7 CYS H H 7 8.308 8.308 8.119 0.189 25613 302 1 5 . 1 1 8 8 THR HA H 8 4.110 4.110 4.270 -0.160 25613 303 1 5 . 1 1 8 8 THR CA C 8 64.398 64.398 64.029 0.369 25613 304 1 5 . 1 1 8 8 THR CB C 8 68.493 68.493 69.198 -0.705 25613 305 1 5 . 1 1 8 8 THR H H 8 8.233 8.233 8.339 -0.106 25613 306 1 5 . 1 1 9 9 SER HA H 9 4.816 4.816 4.648 0.168 25613 307 1 5 . 1 1 9 9 SER CA C 9 55.989 55.989 57.482 -1.493 25613 308 1 5 . 1 1 9 9 SER CB C 9 64.007 64.007 65.195 -1.188 25613 309 1 5 . 1 1 9 9 SER H H 9 7.533 7.533 7.776 -0.243 25613 310 1 5 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.072 0.306 25613 311 1 5 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.710 -0.819 25613 312 1 5 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.890 2.035 25613 313 1 5 . 1 1 10 10 ILE H H 10 7.876 7.876 8.327 -0.451 25613 314 1 5 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.447 0.519 25613 315 1 5 . 1 1 11 11 CYS H H 11 9.710 9.710 8.663 1.047 25613 316 1 5 . 1 1 12 12 SER HA H 12 4.635 4.635 4.417 0.218 25613 317 1 5 . 1 1 12 12 SER CA C 12 56.435 56.435 57.730 -1.295 25613 318 1 5 . 1 1 12 12 SER CB C 12 65.596 65.596 63.881 1.715 25613 319 1 5 . 1 1 12 12 SER H H 12 8.799 8.799 8.547 0.252 25613 320 1 5 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.816 0.072 25613 321 1 5 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.433 -0.204 25613 322 1 5 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.003 0.144 25613 323 1 5 . 1 1 13 13 LEU H H 13 8.652 8.652 8.373 0.279 25613 324 1 5 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.128 0.065 25613 325 1 5 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.620 -0.640 25613 326 1 5 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.566 1.054 25613 327 1 5 . 1 1 14 14 TYR H H 14 7.517 7.517 7.067 0.450 25613 328 1 5 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.902 0.113 25613 329 1 5 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.515 -0.053 25613 330 1 5 . 1 1 15 15 GLN CB C 15 28.947 28.947 27.989 0.958 25613 331 1 5 . 1 1 15 15 GLN H H 15 7.581 7.581 7.508 0.073 25613 332 1 5 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.662 0.543 25613 333 1 5 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.598 0.437 25613 334 1 5 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.628 0.239 25613 335 1 5 . 1 1 16 16 LEU H H 16 8.084 8.084 8.062 0.022 25613 336 1 5 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.961 0.266 25613 337 1 5 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.345 -1.675 25613 338 1 5 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.929 0.047 25613 339 1 5 . 1 1 17 17 GLU H H 17 8.121 8.121 8.484 -0.363 25613 340 1 5 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.498 0.022 25613 341 1 5 . 1 1 18 18 ASN CA C 18 54.719 54.719 55.277 -0.558 25613 342 1 5 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.539 -0.160 25613 343 1 5 . 1 1 18 18 ASN H H 18 7.469 7.469 7.918 -0.449 25613 344 1 5 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.582 -0.054 25613 345 1 5 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.325 2.595 25613 346 1 5 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.645 0.627 25613 347 1 5 . 1 1 19 19 TYR H H 19 7.928 7.928 7.425 0.503 25613 348 1 5 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.859 0.108 25613 349 1 5 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.308 5.502 25613 350 1 5 . 1 1 20 20 CYS H H 20 7.484 7.484 7.858 -0.374 25613 351 1 6 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.942 0.124 25613 352 1 6 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.368 -4.875 25613 353 1 6 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.161 -6.893 25613 354 1 6 . 1 1 2 2 ILE H H 2 8.541 8.541 8.218 0.323 25613 355 1 6 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.513 0.218 25613 356 1 6 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.469 -1.697 25613 357 1 6 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.448 0.148 25613 358 1 6 . 1 1 3 3 VAL H H 3 8.164 8.164 8.009 0.155 25613 359 1 6 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.952 0.339 25613 360 1 6 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.702 -2.626 25613 361 1 6 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.250 -1.467 25613 362 1 6 . 1 1 4 4 GLU H H 4 8.161 8.161 7.834 0.327 25613 363 1 6 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.066 0.059 25613 364 1 6 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.851 -0.268 25613 365 1 6 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.791 0.227 25613 366 1 6 . 1 1 5 5 GLN H H 5 8.290 8.290 7.978 0.312 25613 367 1 6 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.334 0.625 25613 368 1 6 . 1 1 6 6 CYS H H 6 8.369 8.369 8.306 0.063 25613 369 1 6 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.269 0.604 25613 370 1 6 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.669 12.148 25613 371 1 6 . 1 1 7 7 CYS H H 7 8.308 8.308 8.059 0.249 25613 372 1 6 . 1 1 8 8 THR HA H 8 4.110 4.110 4.271 -0.161 25613 373 1 6 . 1 1 8 8 THR CA C 8 64.398 64.398 64.003 0.395 25613 374 1 6 . 1 1 8 8 THR CB C 8 68.493 68.493 69.506 -1.013 25613 375 1 6 . 1 1 8 8 THR H H 8 8.233 8.233 8.185 0.048 25613 376 1 6 . 1 1 9 9 SER HA H 9 4.816 4.816 4.665 0.151 25613 377 1 6 . 1 1 9 9 SER CA C 9 55.989 55.989 56.801 -0.812 25613 378 1 6 . 1 1 9 9 SER CB C 9 64.007 64.007 64.721 -0.714 25613 379 1 6 . 1 1 9 9 SER H H 9 7.533 7.533 7.999 -0.466 25613 380 1 6 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.158 0.220 25613 381 1 6 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.756 -0.865 25613 382 1 6 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.731 2.194 25613 383 1 6 . 1 1 10 10 ILE H H 10 7.876 7.876 8.267 -0.391 25613 384 1 6 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.596 0.370 25613 385 1 6 . 1 1 11 11 CYS H H 11 9.710 9.710 8.823 0.887 25613 386 1 6 . 1 1 12 12 SER HA H 12 4.635 4.635 4.651 -0.016 25613 387 1 6 . 1 1 12 12 SER CA C 12 56.435 56.435 57.421 -0.986 25613 388 1 6 . 1 1 12 12 SER CB C 12 65.596 65.596 65.647 -0.051 25613 389 1 6 . 1 1 12 12 SER H H 12 8.799 8.799 8.226 0.573 25613 390 1 6 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.921 -0.033 25613 391 1 6 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.337 0.892 25613 392 1 6 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.896 0.251 25613 393 1 6 . 1 1 13 13 LEU H H 13 8.652 8.652 8.181 0.471 25613 394 1 6 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.532 -0.339 25613 395 1 6 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.379 -0.399 25613 396 1 6 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.456 1.165 25613 397 1 6 . 1 1 14 14 TYR H H 14 7.517 7.517 7.057 0.460 25613 398 1 6 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.947 0.068 25613 399 1 6 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.796 -0.334 25613 400 1 6 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.118 0.829 25613 401 1 6 . 1 1 15 15 GLN H H 15 7.581 7.581 8.184 -0.603 25613 402 1 6 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.177 1.028 25613 403 1 6 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.339 0.696 25613 404 1 6 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.485 0.382 25613 405 1 6 . 1 1 16 16 LEU H H 16 8.084 8.084 7.880 0.204 25613 406 1 6 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.012 0.215 25613 407 1 6 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.152 -1.482 25613 408 1 6 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.372 -0.396 25613 409 1 6 . 1 1 17 17 GLU H H 17 8.121 8.121 8.258 -0.137 25613 410 1 6 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.583 -0.063 25613 411 1 6 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.708 0.011 25613 412 1 6 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.465 -0.086 25613 413 1 6 . 1 1 18 18 ASN H H 18 7.469 7.469 7.926 -0.457 25613 414 1 6 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.528 0.000 25613 415 1 6 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.076 1.844 25613 416 1 6 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.851 0.421 25613 417 1 6 . 1 1 19 19 TYR H H 19 7.928 7.928 7.585 0.343 25613 418 1 6 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.944 0.023 25613 419 1 6 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.053 5.756 25613 420 1 6 . 1 1 20 20 CYS H H 20 7.484 7.484 7.676 -0.192 25613 421 1 7 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.971 0.095 25613 422 1 7 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.715 -5.223 25613 423 1 7 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.073 -6.805 25613 424 1 7 . 1 1 2 2 ILE H H 2 8.541 8.541 8.221 0.320 25613 425 1 7 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.516 0.215 25613 426 1 7 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.586 -1.814 25613 427 1 7 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.398 0.198 25613 428 1 7 . 1 1 3 3 VAL H H 3 8.164 8.164 8.030 0.134 25613 429 1 7 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.981 0.310 25613 430 1 7 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.671 -2.595 25613 431 1 7 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.329 -1.546 25613 432 1 7 . 1 1 4 4 GLU H H 4 8.161 8.161 8.493 -0.332 25613 433 1 7 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.080 0.045 25613 434 1 7 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.072 -0.489 25613 435 1 7 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.530 0.488 25613 436 1 7 . 1 1 5 5 GLN H H 5 8.290 8.290 8.088 0.202 25613 437 1 7 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.283 0.676 25613 438 1 7 . 1 1 6 6 CYS H H 6 8.369 8.369 8.204 0.165 25613 439 1 7 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.252 0.621 25613 440 1 7 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.417 12.400 25613 441 1 7 . 1 1 7 7 CYS H H 7 8.308 8.308 8.175 0.133 25613 442 1 7 . 1 1 8 8 THR HA H 8 4.110 4.110 4.316 -0.206 25613 443 1 7 . 1 1 8 8 THR CA C 8 64.398 64.398 64.074 0.324 25613 444 1 7 . 1 1 8 8 THR CB C 8 68.493 68.493 69.222 -0.729 25613 445 1 7 . 1 1 8 8 THR H H 8 8.233 8.233 8.220 0.013 25613 446 1 7 . 1 1 9 9 SER HA H 9 4.816 4.816 4.651 0.165 25613 447 1 7 . 1 1 9 9 SER CA C 9 55.989 55.989 57.187 -1.198 25613 448 1 7 . 1 1 9 9 SER CB C 9 64.007 64.007 65.697 -1.690 25613 449 1 7 . 1 1 9 9 SER H H 9 7.533 7.533 8.101 -0.568 25613 450 1 7 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.139 0.239 25613 451 1 7 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.656 -0.765 25613 452 1 7 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.512 2.413 25613 453 1 7 . 1 1 10 10 ILE H H 10 7.876 7.876 8.337 -0.461 25613 454 1 7 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.736 0.230 25613 455 1 7 . 1 1 11 11 CYS H H 11 9.710 9.710 8.604 1.106 25613 456 1 7 . 1 1 12 12 SER HA H 12 4.635 4.635 4.592 0.043 25613 457 1 7 . 1 1 12 12 SER CA C 12 56.435 56.435 57.376 -0.941 25613 458 1 7 . 1 1 12 12 SER CB C 12 65.596 65.596 64.260 1.336 25613 459 1 7 . 1 1 12 12 SER H H 12 8.799 8.799 9.414 -0.615 25613 460 1 7 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.838 0.050 25613 461 1 7 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.184 0.045 25613 462 1 7 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.154 -0.007 25613 463 1 7 . 1 1 13 13 LEU H H 13 8.652 8.652 8.289 0.363 25613 464 1 7 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.113 0.080 25613 465 1 7 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.543 -0.563 25613 466 1 7 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.618 1.003 25613 467 1 7 . 1 1 14 14 TYR H H 14 7.517 7.517 6.979 0.538 25613 468 1 7 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.869 0.146 25613 469 1 7 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.419 0.043 25613 470 1 7 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.176 0.771 25613 471 1 7 . 1 1 15 15 GLN H H 15 7.581 7.581 7.491 0.090 25613 472 1 7 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.540 0.665 25613 473 1 7 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.297 0.738 25613 474 1 7 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.719 0.148 25613 475 1 7 . 1 1 16 16 LEU H H 16 8.084 8.084 7.882 0.202 25613 476 1 7 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.028 0.199 25613 477 1 7 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.151 -1.480 25613 478 1 7 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.130 -0.154 25613 479 1 7 . 1 1 17 17 GLU H H 17 8.121 8.121 8.271 -0.150 25613 480 1 7 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.559 -0.039 25613 481 1 7 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.276 0.443 25613 482 1 7 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.308 0.071 25613 483 1 7 . 1 1 18 18 ASN H H 18 7.469 7.469 7.916 -0.447 25613 484 1 7 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.614 -0.086 25613 485 1 7 . 1 1 19 19 TYR CA C 19 58.920 58.920 55.999 2.921 25613 486 1 7 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.687 0.585 25613 487 1 7 . 1 1 19 19 TYR H H 19 7.928 7.928 7.361 0.567 25613 488 1 7 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.657 0.310 25613 489 1 7 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.620 7.190 25613 490 1 7 . 1 1 20 20 CYS H H 20 7.484 7.484 7.633 -0.149 25613 491 1 8 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.989 0.077 25613 492 1 8 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.733 -4.240 25613 493 1 8 . 1 1 2 2 ILE CB C 2 31.268 31.268 37.983 -6.715 25613 494 1 8 . 1 1 2 2 ILE H H 2 8.541 8.541 8.178 0.363 25613 495 1 8 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.500 0.231 25613 496 1 8 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.472 -1.700 25613 497 1 8 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.427 0.170 25613 498 1 8 . 1 1 3 3 VAL H H 3 8.164 8.164 8.012 0.152 25613 499 1 8 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.906 0.385 25613 500 1 8 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.754 -2.678 25613 501 1 8 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.340 -1.557 25613 502 1 8 . 1 1 4 4 GLU H H 4 8.161 8.161 7.753 0.408 25613 503 1 8 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.108 0.017 25613 504 1 8 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.460 0.123 25613 505 1 8 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.255 0.763 25613 506 1 8 . 1 1 5 5 GLN H H 5 8.290 8.290 7.768 0.522 25613 507 1 8 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.349 0.610 25613 508 1 8 . 1 1 6 6 CYS H H 6 8.369 8.369 8.395 -0.026 25613 509 1 8 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.272 0.601 25613 510 1 8 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.490 12.327 25613 511 1 8 . 1 1 7 7 CYS H H 7 8.308 8.308 8.167 0.141 25613 512 1 8 . 1 1 8 8 THR HA H 8 4.110 4.110 4.308 -0.198 25613 513 1 8 . 1 1 8 8 THR CA C 8 64.398 64.398 64.215 0.183 25613 514 1 8 . 1 1 8 8 THR CB C 8 68.493 68.493 69.226 -0.733 25613 515 1 8 . 1 1 8 8 THR H H 8 8.233 8.233 8.289 -0.056 25613 516 1 8 . 1 1 9 9 SER HA H 9 4.816 4.816 4.674 0.142 25613 517 1 8 . 1 1 9 9 SER CA C 9 55.989 55.989 57.088 -1.099 25613 518 1 8 . 1 1 9 9 SER CB C 9 64.007 64.007 65.757 -1.750 25613 519 1 8 . 1 1 9 9 SER H H 9 7.533 7.533 8.168 -0.635 25613 520 1 8 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.167 0.211 25613 521 1 8 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.636 -0.745 25613 522 1 8 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.439 2.486 25613 523 1 8 . 1 1 10 10 ILE H H 10 7.876 7.876 8.308 -0.432 25613 524 1 8 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.490 0.476 25613 525 1 8 . 1 1 11 11 CYS H H 11 9.710 9.710 8.851 0.859 25613 526 1 8 . 1 1 12 12 SER HA H 12 4.635 4.635 4.649 -0.014 25613 527 1 8 . 1 1 12 12 SER CA C 12 56.435 56.435 57.077 -0.642 25613 528 1 8 . 1 1 12 12 SER CB C 12 65.596 65.596 65.240 0.356 25613 529 1 8 . 1 1 12 12 SER H H 12 8.799 8.799 8.178 0.621 25613 530 1 8 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.760 0.128 25613 531 1 8 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.173 0.056 25613 532 1 8 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.926 0.221 25613 533 1 8 . 1 1 13 13 LEU H H 13 8.652 8.652 8.419 0.233 25613 534 1 8 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.359 -0.166 25613 535 1 8 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.161 -0.181 25613 536 1 8 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.739 0.882 25613 537 1 8 . 1 1 14 14 TYR H H 14 7.517 7.517 7.121 0.396 25613 538 1 8 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.930 0.085 25613 539 1 8 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.456 0.006 25613 540 1 8 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.408 0.539 25613 541 1 8 . 1 1 15 15 GLN H H 15 7.581 7.581 7.496 0.085 25613 542 1 8 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.288 0.917 25613 543 1 8 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.407 0.628 25613 544 1 8 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.594 0.273 25613 545 1 8 . 1 1 16 16 LEU H H 16 8.084 8.084 7.995 0.089 25613 546 1 8 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.920 0.307 25613 547 1 8 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.521 -1.851 25613 548 1 8 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.244 -0.268 25613 549 1 8 . 1 1 17 17 GLU H H 17 8.121 8.121 8.542 -0.421 25613 550 1 8 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.533 -0.013 25613 551 1 8 . 1 1 18 18 ASN CA C 18 54.719 54.719 55.351 -0.632 25613 552 1 8 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.642 -0.262 25613 553 1 8 . 1 1 18 18 ASN H H 18 7.469 7.469 7.891 -0.422 25613 554 1 8 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.582 -0.054 25613 555 1 8 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.307 2.613 25613 556 1 8 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.848 0.424 25613 557 1 8 . 1 1 19 19 TYR H H 19 7.928 7.928 7.450 0.478 25613 558 1 8 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.856 0.111 25613 559 1 8 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.348 5.462 25613 560 1 8 . 1 1 20 20 CYS H H 20 7.484 7.484 7.684 -0.200 25613 561 1 9 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.957 0.109 25613 562 1 9 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.476 -4.983 25613 563 1 9 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.032 -6.764 25613 564 1 9 . 1 1 2 2 ILE H H 2 8.541 8.541 8.189 0.352 25613 565 1 9 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.508 0.223 25613 566 1 9 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.618 -1.846 25613 567 1 9 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.509 0.087 25613 568 1 9 . 1 1 3 3 VAL H H 3 8.164 8.164 7.963 0.201 25613 569 1 9 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.923 0.368 25613 570 1 9 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.767 -2.692 25613 571 1 9 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.234 -1.451 25613 572 1 9 . 1 1 4 4 GLU H H 4 8.161 8.161 7.845 0.316 25613 573 1 9 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.048 0.077 25613 574 1 9 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.867 -0.284 25613 575 1 9 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.683 0.335 25613 576 1 9 . 1 1 5 5 GLN H H 5 8.290 8.290 7.780 0.510 25613 577 1 9 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.343 0.617 25613 578 1 9 . 1 1 6 6 CYS H H 6 8.369 8.369 8.326 0.043 25613 579 1 9 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.340 0.533 25613 580 1 9 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.841 11.976 25613 581 1 9 . 1 1 7 7 CYS H H 7 8.308 8.308 8.324 -0.016 25613 582 1 9 . 1 1 8 8 THR HA H 8 4.110 4.110 4.262 -0.152 25613 583 1 9 . 1 1 8 8 THR CA C 8 64.398 64.398 64.021 0.377 25613 584 1 9 . 1 1 8 8 THR CB C 8 68.493 68.493 69.112 -0.619 25613 585 1 9 . 1 1 8 8 THR H H 8 8.233 8.233 8.381 -0.148 25613 586 1 9 . 1 1 9 9 SER HA H 9 4.816 4.816 4.691 0.125 25613 587 1 9 . 1 1 9 9 SER CA C 9 55.989 55.989 56.979 -0.990 25613 588 1 9 . 1 1 9 9 SER CB C 9 64.007 64.007 65.966 -1.959 25613 589 1 9 . 1 1 9 9 SER H H 9 7.533 7.533 8.253 -0.720 25613 590 1 9 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.227 0.151 25613 591 1 9 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.584 -0.693 25613 592 1 9 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.720 0.205 25613 593 1 9 . 1 1 10 10 ILE H H 10 7.876 7.876 8.245 -0.369 25613 594 1 9 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.584 0.382 25613 595 1 9 . 1 1 11 11 CYS H H 11 9.710 9.710 8.848 0.862 25613 596 1 9 . 1 1 12 12 SER HA H 12 4.635 4.635 4.644 -0.009 25613 597 1 9 . 1 1 12 12 SER CA C 12 56.435 56.435 57.389 -0.954 25613 598 1 9 . 1 1 12 12 SER CB C 12 65.596 65.596 65.482 0.114 25613 599 1 9 . 1 1 12 12 SER H H 12 8.799 8.799 8.167 0.632 25613 600 1 9 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.706 0.182 25613 601 1 9 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.259 -0.030 25613 602 1 9 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.851 0.296 25613 603 1 9 . 1 1 13 13 LEU H H 13 8.652 8.652 8.375 0.277 25613 604 1 9 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.119 0.074 25613 605 1 9 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.652 -0.672 25613 606 1 9 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.723 0.898 25613 607 1 9 . 1 1 14 14 TYR H H 14 7.517 7.517 6.802 0.715 25613 608 1 9 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.858 0.157 25613 609 1 9 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.752 -0.290 25613 610 1 9 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.288 0.659 25613 611 1 9 . 1 1 15 15 GLN H H 15 7.581 7.581 7.639 -0.058 25613 612 1 9 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.386 0.819 25613 613 1 9 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.418 0.617 25613 614 1 9 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.891 -0.023 25613 615 1 9 . 1 1 16 16 LEU H H 16 8.084 8.084 7.975 0.109 25613 616 1 9 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.024 0.203 25613 617 1 9 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.506 -0.836 25613 618 1 9 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.852 0.124 25613 619 1 9 . 1 1 17 17 GLU H H 17 8.121 8.121 8.462 -0.341 25613 620 1 9 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.524 -0.004 25613 621 1 9 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.995 -0.276 25613 622 1 9 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.435 -0.056 25613 623 1 9 . 1 1 18 18 ASN H H 18 7.469 7.469 7.840 -0.371 25613 624 1 9 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.564 -0.036 25613 625 1 9 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.422 2.498 25613 626 1 9 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.798 0.474 25613 627 1 9 . 1 1 19 19 TYR H H 19 7.928 7.928 7.479 0.449 25613 628 1 9 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.771 0.196 25613 629 1 9 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.745 7.064 25613 630 1 9 . 1 1 20 20 CYS H H 20 7.484 7.484 7.681 -0.197 25613 631 1 10 . 1 1 2 2 ILE HA H 2 4.066 4.066 4.207 -0.141 25613 632 1 10 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.252 -4.759 25613 633 1 10 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.042 -6.774 25613 634 1 10 . 1 1 2 2 ILE H H 2 8.541 8.541 8.325 0.216 25613 635 1 10 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.518 0.213 25613 636 1 10 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.620 -1.848 25613 637 1 10 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.384 0.212 25613 638 1 10 . 1 1 3 3 VAL H H 3 8.164 8.164 8.152 0.012 25613 639 1 10 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.933 0.358 25613 640 1 10 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.659 -2.583 25613 641 1 10 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.321 -1.538 25613 642 1 10 . 1 1 4 4 GLU H H 4 8.161 8.161 7.800 0.361 25613 643 1 10 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.085 0.040 25613 644 1 10 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.296 -0.713 25613 645 1 10 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.730 0.287 25613 646 1 10 . 1 1 5 5 GLN H H 5 8.290 8.290 7.714 0.576 25613 647 1 10 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.413 0.546 25613 648 1 10 . 1 1 6 6 CYS H H 6 8.369 8.369 8.146 0.223 25613 649 1 10 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.337 0.536 25613 650 1 10 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.966 11.851 25613 651 1 10 . 1 1 7 7 CYS H H 7 8.308 8.308 8.086 0.222 25613 652 1 10 . 1 1 8 8 THR HA H 8 4.110 4.110 4.319 -0.209 25613 653 1 10 . 1 1 8 8 THR CA C 8 64.398 64.398 63.275 1.123 25613 654 1 10 . 1 1 8 8 THR CB C 8 68.493 68.493 69.428 -0.935 25613 655 1 10 . 1 1 8 8 THR H H 8 8.233 8.233 8.103 0.130 25613 656 1 10 . 1 1 9 9 SER HA H 9 4.816 4.816 4.687 0.129 25613 657 1 10 . 1 1 9 9 SER CA C 9 55.989 55.989 56.805 -0.816 25613 658 1 10 . 1 1 9 9 SER CB C 9 64.007 64.007 64.929 -0.922 25613 659 1 10 . 1 1 9 9 SER H H 9 7.533 7.533 8.178 -0.645 25613 660 1 10 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.148 0.230 25613 661 1 10 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.730 -0.839 25613 662 1 10 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.823 2.102 25613 663 1 10 . 1 1 10 10 ILE H H 10 7.876 7.876 8.327 -0.451 25613 664 1 10 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.617 0.349 25613 665 1 10 . 1 1 11 11 CYS H H 11 9.710 9.710 8.760 0.950 25613 666 1 10 . 1 1 12 12 SER HA H 12 4.635 4.635 4.566 0.069 25613 667 1 10 . 1 1 12 12 SER CA C 12 56.435 56.435 57.284 -0.849 25613 668 1 10 . 1 1 12 12 SER CB C 12 65.596 65.596 65.388 0.208 25613 669 1 10 . 1 1 12 12 SER H H 12 8.799 8.799 8.197 0.602 25613 670 1 10 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.790 0.098 25613 671 1 10 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.964 0.265 25613 672 1 10 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.935 0.212 25613 673 1 10 . 1 1 13 13 LEU H H 13 8.652 8.652 8.439 0.213 25613 674 1 10 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.081 0.112 25613 675 1 10 . 1 1 14 14 TYR CA C 14 59.980 59.980 59.861 0.119 25613 676 1 10 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.367 1.254 25613 677 1 10 . 1 1 14 14 TYR H H 14 7.517 7.517 7.245 0.272 25613 678 1 10 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.891 0.124 25613 679 1 10 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.385 0.077 25613 680 1 10 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.431 0.516 25613 681 1 10 . 1 1 15 15 GLN H H 15 7.581 7.581 7.429 0.152 25613 682 1 10 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.380 0.825 25613 683 1 10 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.519 0.516 25613 684 1 10 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.556 0.311 25613 685 1 10 . 1 1 16 16 LEU H H 16 8.084 8.084 8.031 0.053 25613 686 1 10 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.983 0.244 25613 687 1 10 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.442 -1.772 25613 688 1 10 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.142 -0.166 25613 689 1 10 . 1 1 17 17 GLU H H 17 8.121 8.121 8.333 -0.212 25613 690 1 10 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.562 -0.042 25613 691 1 10 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.318 0.401 25613 692 1 10 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.269 0.110 25613 693 1 10 . 1 1 18 18 ASN H H 18 7.469 7.469 7.825 -0.356 25613 694 1 10 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.606 -0.078 25613 695 1 10 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.503 2.417 25613 696 1 10 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.706 0.566 25613 697 1 10 . 1 1 19 19 TYR H H 19 7.928 7.928 7.529 0.399 25613 698 1 10 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.841 0.126 25613 699 1 10 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.145 5.665 25613 700 1 10 . 1 1 20 20 CYS H H 20 7.484 7.484 7.702 -0.218 25613 701 1 11 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.852 0.214 25613 702 1 11 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.635 -5.142 25613 703 1 11 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.168 -6.900 25613 704 1 11 . 1 1 2 2 ILE H H 2 8.541 8.541 8.160 0.381 25613 705 1 11 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.582 0.149 25613 706 1 11 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.491 -1.719 25613 707 1 11 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.139 0.457 25613 708 1 11 . 1 1 3 3 VAL H H 3 8.164 8.164 8.194 -0.030 25613 709 1 11 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.021 0.270 25613 710 1 11 . 1 1 4 4 GLU CA C 4 57.076 57.076 58.944 -1.868 25613 711 1 11 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.654 -0.871 25613 712 1 11 . 1 1 4 4 GLU H H 4 8.161 8.161 7.926 0.235 25613 713 1 11 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.101 0.024 25613 714 1 11 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.823 -0.240 25613 715 1 11 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.807 0.211 25613 716 1 11 . 1 1 5 5 GLN H H 5 8.290 8.290 7.664 0.626 25613 717 1 11 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.430 0.529 25613 718 1 11 . 1 1 6 6 CYS H H 6 8.369 8.369 8.061 0.308 25613 719 1 11 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.345 0.528 25613 720 1 11 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.965 11.852 25613 721 1 11 . 1 1 7 7 CYS H H 7 8.308 8.308 8.092 0.216 25613 722 1 11 . 1 1 8 8 THR HA H 8 4.110 4.110 4.247 -0.137 25613 723 1 11 . 1 1 8 8 THR CA C 8 64.398 64.398 63.807 0.591 25613 724 1 11 . 1 1 8 8 THR CB C 8 68.493 68.493 69.281 -0.788 25613 725 1 11 . 1 1 8 8 THR H H 8 8.233 8.233 8.140 0.093 25613 726 1 11 . 1 1 9 9 SER HA H 9 4.816 4.816 4.702 0.114 25613 727 1 11 . 1 1 9 9 SER CA C 9 55.989 55.989 56.757 -0.768 25613 728 1 11 . 1 1 9 9 SER CB C 9 64.007 64.007 65.045 -1.038 25613 729 1 11 . 1 1 9 9 SER H H 9 7.533 7.533 7.977 -0.444 25613 730 1 11 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.192 0.186 25613 731 1 11 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.744 -0.853 25613 732 1 11 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.112 1.813 25613 733 1 11 . 1 1 10 10 ILE H H 10 7.876 7.876 8.304 -0.428 25613 734 1 11 . 1 1 11 11 CYS HA H 11 4.966 4.966 5.243 -0.277 25613 735 1 11 . 1 1 11 11 CYS H H 11 9.710 9.710 8.711 0.999 25613 736 1 11 . 1 1 12 12 SER HA H 12 4.635 4.635 4.693 -0.058 25613 737 1 11 . 1 1 12 12 SER CA C 12 56.435 56.435 56.533 -0.098 25613 738 1 11 . 1 1 12 12 SER CB C 12 65.596 65.596 64.237 1.359 25613 739 1 11 . 1 1 12 12 SER H H 12 8.799 8.799 8.747 0.052 25613 740 1 11 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.903 -0.015 25613 741 1 11 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.892 0.338 25613 742 1 11 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.436 0.711 25613 743 1 11 . 1 1 13 13 LEU H H 13 8.652 8.652 8.516 0.136 25613 744 1 11 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.198 -0.005 25613 745 1 11 . 1 1 14 14 TYR CA C 14 59.980 59.980 61.117 -1.137 25613 746 1 11 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.349 1.272 25613 747 1 11 . 1 1 14 14 TYR H H 14 7.517 7.517 7.477 0.040 25613 748 1 11 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.899 0.116 25613 749 1 11 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.718 -0.256 25613 750 1 11 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.142 0.805 25613 751 1 11 . 1 1 15 15 GLN H H 15 7.581 7.581 8.319 -0.738 25613 752 1 11 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.406 0.799 25613 753 1 11 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.485 0.550 25613 754 1 11 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.691 0.176 25613 755 1 11 . 1 1 16 16 LEU H H 16 8.084 8.084 8.012 0.072 25613 756 1 11 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.960 0.267 25613 757 1 11 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.367 -1.697 25613 758 1 11 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.356 -0.380 25613 759 1 11 . 1 1 17 17 GLU H H 17 8.121 8.121 8.331 -0.210 25613 760 1 11 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.549 -0.029 25613 761 1 11 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.544 0.175 25613 762 1 11 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.221 0.158 25613 763 1 11 . 1 1 18 18 ASN H H 18 7.469 7.469 7.881 -0.412 25613 764 1 11 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.579 -0.051 25613 765 1 11 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.459 2.461 25613 766 1 11 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.574 0.698 25613 767 1 11 . 1 1 19 19 TYR H H 19 7.928 7.928 7.430 0.498 25613 768 1 11 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.846 0.121 25613 769 1 11 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.523 5.287 25613 770 1 11 . 1 1 20 20 CYS H H 20 7.484 7.484 7.733 -0.249 25613 771 1 12 . 1 1 2 2 ILE HA H 2 4.066 4.066 4.085 -0.019 25613 772 1 12 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.418 -3.925 25613 773 1 12 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.240 -6.972 25613 774 1 12 . 1 1 2 2 ILE H H 2 8.541 8.541 8.074 0.467 25613 775 1 12 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.546 0.185 25613 776 1 12 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.313 -1.541 25613 777 1 12 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.190 0.406 25613 778 1 12 . 1 1 3 3 VAL H H 3 8.164 8.164 8.098 0.066 25613 779 1 12 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.965 0.326 25613 780 1 12 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.307 -2.231 25613 781 1 12 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.739 -0.956 25613 782 1 12 . 1 1 4 4 GLU H H 4 8.161 8.161 8.466 -0.305 25613 783 1 12 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.149 -0.024 25613 784 1 12 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.560 0.023 25613 785 1 12 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.760 0.258 25613 786 1 12 . 1 1 5 5 GLN H H 5 8.290 8.290 7.437 0.853 25613 787 1 12 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.250 0.709 25613 788 1 12 . 1 1 6 6 CYS H H 6 8.369 8.369 8.055 0.314 25613 789 1 12 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.244 0.629 25613 790 1 12 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.539 12.278 25613 791 1 12 . 1 1 7 7 CYS H H 7 8.308 8.308 8.087 0.221 25613 792 1 12 . 1 1 8 8 THR HA H 8 4.110 4.110 4.224 -0.114 25613 793 1 12 . 1 1 8 8 THR CA C 8 64.398 64.398 63.871 0.527 25613 794 1 12 . 1 1 8 8 THR CB C 8 68.493 68.493 69.168 -0.675 25613 795 1 12 . 1 1 8 8 THR H H 8 8.233 8.233 8.114 0.119 25613 796 1 12 . 1 1 9 9 SER HA H 9 4.816 4.816 4.673 0.143 25613 797 1 12 . 1 1 9 9 SER CA C 9 55.989 55.989 56.793 -0.804 25613 798 1 12 . 1 1 9 9 SER CB C 9 64.007 64.007 64.865 -0.858 25613 799 1 12 . 1 1 9 9 SER H H 9 7.533 7.533 7.791 -0.258 25613 800 1 12 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.133 0.245 25613 801 1 12 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.626 -0.735 25613 802 1 12 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.681 2.244 25613 803 1 12 . 1 1 10 10 ILE H H 10 7.876 7.876 8.321 -0.445 25613 804 1 12 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.558 0.408 25613 805 1 12 . 1 1 11 11 CYS H H 11 9.710 9.710 8.912 0.797 25613 806 1 12 . 1 1 12 12 SER HA H 12 4.635 4.635 4.640 -0.005 25613 807 1 12 . 1 1 12 12 SER CA C 12 56.435 56.435 57.444 -1.009 25613 808 1 12 . 1 1 12 12 SER CB C 12 65.596 65.596 65.478 0.117 25613 809 1 12 . 1 1 12 12 SER H H 12 8.799 8.799 8.158 0.641 25613 810 1 12 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.748 0.140 25613 811 1 12 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.117 0.112 25613 812 1 12 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.956 0.191 25613 813 1 12 . 1 1 13 13 LEU H H 13 8.652 8.652 8.482 0.170 25613 814 1 12 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.052 0.141 25613 815 1 12 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.646 -0.666 25613 816 1 12 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.471 1.150 25613 817 1 12 . 1 1 14 14 TYR H H 14 7.517 7.517 7.326 0.191 25613 818 1 12 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.894 0.121 25613 819 1 12 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.799 -0.337 25613 820 1 12 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.059 0.888 25613 821 1 12 . 1 1 15 15 GLN H H 15 7.581 7.581 8.305 -0.724 25613 822 1 12 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.409 0.796 25613 823 1 12 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.352 0.683 25613 824 1 12 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.678 0.189 25613 825 1 12 . 1 1 16 16 LEU H H 16 8.084 8.084 8.012 0.072 25613 826 1 12 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.037 0.190 25613 827 1 12 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.163 -1.493 25613 828 1 12 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.078 -0.102 25613 829 1 12 . 1 1 17 17 GLU H H 17 8.121 8.121 8.203 -0.082 25613 830 1 12 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.559 -0.039 25613 831 1 12 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.489 0.230 25613 832 1 12 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.282 0.097 25613 833 1 12 . 1 1 18 18 ASN H H 18 7.469 7.469 7.891 -0.422 25613 834 1 12 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.584 -0.056 25613 835 1 12 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.752 2.168 25613 836 1 12 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.806 0.466 25613 837 1 12 . 1 1 19 19 TYR H H 19 7.928 7.928 7.571 0.357 25613 838 1 12 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.950 0.017 25613 839 1 12 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.814 5.996 25613 840 1 12 . 1 1 20 20 CYS H H 20 7.484 7.484 7.623 -0.139 25613 841 1 13 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.972 0.094 25613 842 1 13 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.901 -4.408 25613 843 1 13 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.523 -7.255 25613 844 1 13 . 1 1 2 2 ILE H H 2 8.541 8.541 8.258 0.283 25613 845 1 13 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.554 0.177 25613 846 1 13 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.652 -1.880 25613 847 1 13 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.315 0.281 25613 848 1 13 . 1 1 3 3 VAL H H 3 8.164 8.164 8.092 0.072 25613 849 1 13 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.024 0.267 25613 850 1 13 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.240 -2.164 25613 851 1 13 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.881 -1.098 25613 852 1 13 . 1 1 4 4 GLU H H 4 8.161 8.161 8.726 -0.565 25613 853 1 13 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.118 0.007 25613 854 1 13 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.577 0.006 25613 855 1 13 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.787 0.231 25613 856 1 13 . 1 1 5 5 GLN H H 5 8.290 8.290 7.610 0.680 25613 857 1 13 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.339 0.620 25613 858 1 13 . 1 1 6 6 CYS H H 6 8.369 8.369 8.179 0.190 25613 859 1 13 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.303 0.570 25613 860 1 13 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.686 12.131 25613 861 1 13 . 1 1 7 7 CYS H H 7 8.308 8.308 8.163 0.145 25613 862 1 13 . 1 1 8 8 THR HA H 8 4.110 4.110 4.288 -0.178 25613 863 1 13 . 1 1 8 8 THR CA C 8 64.398 64.398 64.175 0.223 25613 864 1 13 . 1 1 8 8 THR CB C 8 68.493 68.493 69.490 -0.997 25613 865 1 13 . 1 1 8 8 THR H H 8 8.233 8.233 8.140 0.093 25613 866 1 13 . 1 1 9 9 SER HA H 9 4.816 4.816 4.681 0.135 25613 867 1 13 . 1 1 9 9 SER CA C 9 55.989 55.989 56.866 -0.877 25613 868 1 13 . 1 1 9 9 SER CB C 9 64.007 64.007 64.933 -0.926 25613 869 1 13 . 1 1 9 9 SER H H 9 7.533 7.533 8.053 -0.520 25613 870 1 13 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.151 0.227 25613 871 1 13 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.765 -0.874 25613 872 1 13 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.468 1.457 25613 873 1 13 . 1 1 10 10 ILE H H 10 7.876 7.876 8.307 -0.431 25613 874 1 13 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.604 0.362 25613 875 1 13 . 1 1 11 11 CYS H H 11 9.710 9.710 8.668 1.042 25613 876 1 13 . 1 1 12 12 SER HA H 12 4.635 4.635 4.696 -0.061 25613 877 1 13 . 1 1 12 12 SER CA C 12 56.435 56.435 57.155 -0.720 25613 878 1 13 . 1 1 12 12 SER CB C 12 65.596 65.596 64.543 1.053 25613 879 1 13 . 1 1 12 12 SER H H 12 8.799 8.799 8.638 0.161 25613 880 1 13 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.991 -0.103 25613 881 1 13 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.843 0.386 25613 882 1 13 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.790 0.357 25613 883 1 13 . 1 1 13 13 LEU H H 13 8.652 8.652 8.521 0.131 25613 884 1 13 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.071 0.122 25613 885 1 13 . 1 1 14 14 TYR CA C 14 59.980 59.980 61.042 -1.062 25613 886 1 13 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.985 0.636 25613 887 1 13 . 1 1 14 14 TYR H H 14 7.517 7.517 7.624 -0.107 25613 888 1 13 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.824 0.191 25613 889 1 13 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.621 -0.159 25613 890 1 13 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.514 0.433 25613 891 1 13 . 1 1 15 15 GLN H H 15 7.581 7.581 7.547 0.034 25613 892 1 13 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.522 0.683 25613 893 1 13 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.487 0.548 25613 894 1 13 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.841 0.026 25613 895 1 13 . 1 1 16 16 LEU H H 16 8.084 8.084 7.866 0.218 25613 896 1 13 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.003 0.224 25613 897 1 13 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.827 -1.157 25613 898 1 13 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.790 0.187 25613 899 1 13 . 1 1 17 17 GLU H H 17 8.121 8.121 8.654 -0.533 25613 900 1 13 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.543 -0.023 25613 901 1 13 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.746 -0.027 25613 902 1 13 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.329 0.050 25613 903 1 13 . 1 1 18 18 ASN H H 18 7.469 7.469 7.900 -0.431 25613 904 1 13 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.584 -0.056 25613 905 1 13 . 1 1 19 19 TYR CA C 19 58.920 58.920 55.960 2.960 25613 906 1 13 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.451 0.821 25613 907 1 13 . 1 1 19 19 TYR H H 19 7.928 7.928 7.420 0.508 25613 908 1 13 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.572 0.395 25613 909 1 13 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.878 7.932 25613 910 1 13 . 1 1 20 20 CYS H H 20 7.484 7.484 7.696 -0.212 25613 911 1 14 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.969 0.097 25613 912 1 14 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.905 -5.412 25613 913 1 14 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.272 -7.004 25613 914 1 14 . 1 1 2 2 ILE H H 2 8.541 8.541 8.453 0.088 25613 915 1 14 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.605 0.126 25613 916 1 14 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.895 -2.123 25613 917 1 14 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.390 0.206 25613 918 1 14 . 1 1 3 3 VAL H H 3 8.164 8.164 8.068 0.096 25613 919 1 14 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.976 0.315 25613 920 1 14 . 1 1 4 4 GLU CA C 4 57.076 57.076 60.072 -2.996 25613 921 1 14 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.324 -1.541 25613 922 1 14 . 1 1 4 4 GLU H H 4 8.161 8.161 8.502 -0.341 25613 923 1 14 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.061 0.064 25613 924 1 14 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.903 -0.320 25613 925 1 14 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.739 0.279 25613 926 1 14 . 1 1 5 5 GLN H H 5 8.290 8.290 7.910 0.380 25613 927 1 14 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.391 0.568 25613 928 1 14 . 1 1 6 6 CYS H H 6 8.369 8.369 8.204 0.165 25613 929 1 14 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.275 0.598 25613 930 1 14 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.590 12.227 25613 931 1 14 . 1 1 7 7 CYS H H 7 8.308 8.308 8.315 -0.007 25613 932 1 14 . 1 1 8 8 THR HA H 8 4.110 4.110 4.224 -0.114 25613 933 1 14 . 1 1 8 8 THR CA C 8 64.398 64.398 64.253 0.145 25613 934 1 14 . 1 1 8 8 THR CB C 8 68.493 68.493 69.307 -0.814 25613 935 1 14 . 1 1 8 8 THR H H 8 8.233 8.233 8.096 0.137 25613 936 1 14 . 1 1 9 9 SER HA H 9 4.816 4.816 4.731 0.085 25613 937 1 14 . 1 1 9 9 SER CA C 9 55.989 55.989 56.509 -0.520 25613 938 1 14 . 1 1 9 9 SER CB C 9 64.007 64.007 64.851 -0.844 25613 939 1 14 . 1 1 9 9 SER H H 9 7.533 7.533 7.788 -0.255 25613 940 1 14 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.240 0.138 25613 941 1 14 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.201 -0.310 25613 942 1 14 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.235 -0.310 25613 943 1 14 . 1 1 10 10 ILE H H 10 7.876 7.876 8.310 -0.434 25613 944 1 14 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.814 0.152 25613 945 1 14 . 1 1 11 11 CYS H H 11 9.710 9.710 8.833 0.877 25613 946 1 14 . 1 1 12 12 SER HA H 12 4.635 4.635 4.525 0.110 25613 947 1 14 . 1 1 12 12 SER CA C 12 56.435 56.435 57.359 -0.924 25613 948 1 14 . 1 1 12 12 SER CB C 12 65.596 65.596 64.184 1.412 25613 949 1 14 . 1 1 12 12 SER H H 12 8.799 8.799 9.086 -0.287 25613 950 1 14 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.877 0.011 25613 951 1 14 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.135 0.095 25613 952 1 14 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.256 0.891 25613 953 1 14 . 1 1 13 13 LEU H H 13 8.652 8.652 8.379 0.273 25613 954 1 14 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.659 -0.466 25613 955 1 14 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.278 -0.298 25613 956 1 14 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.523 1.098 25613 957 1 14 . 1 1 14 14 TYR H H 14 7.517 7.517 7.085 0.432 25613 958 1 14 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.922 0.093 25613 959 1 14 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.746 -0.284 25613 960 1 14 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.129 0.818 25613 961 1 14 . 1 1 15 15 GLN H H 15 7.581 7.581 8.183 -0.602 25613 962 1 14 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.583 0.622 25613 963 1 14 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.365 0.670 25613 964 1 14 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.751 0.116 25613 965 1 14 . 1 1 16 16 LEU H H 16 8.084 8.084 7.988 0.096 25613 966 1 14 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.001 0.226 25613 967 1 14 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.160 -1.490 25613 968 1 14 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.313 -0.337 25613 969 1 14 . 1 1 17 17 GLU H H 17 8.121 8.121 8.478 -0.357 25613 970 1 14 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.517 0.003 25613 971 1 14 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.919 -0.200 25613 972 1 14 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.153 0.226 25613 973 1 14 . 1 1 18 18 ASN H H 18 7.469 7.469 7.960 -0.491 25613 974 1 14 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.550 -0.022 25613 975 1 14 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.940 1.980 25613 976 1 14 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.952 0.320 25613 977 1 14 . 1 1 19 19 TYR H H 19 7.928 7.928 7.389 0.539 25613 978 1 14 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.692 0.275 25613 979 1 14 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.311 7.500 25613 980 1 14 . 1 1 20 20 CYS H H 20 7.484 7.484 7.667 -0.183 25613 981 1 15 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.875 0.191 25613 982 1 15 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.920 -4.427 25613 983 1 15 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.286 -7.018 25613 984 1 15 . 1 1 2 2 ILE H H 2 8.541 8.541 8.373 0.168 25613 985 1 15 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.519 0.212 25613 986 1 15 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.502 -1.730 25613 987 1 15 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.435 0.161 25613 988 1 15 . 1 1 3 3 VAL H H 3 8.164 8.164 8.082 0.082 25613 989 1 15 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.991 0.300 25613 990 1 15 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.739 -2.663 25613 991 1 15 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.363 -1.580 25613 992 1 15 . 1 1 4 4 GLU H H 4 8.161 8.161 7.731 0.430 25613 993 1 15 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.082 0.043 25613 994 1 15 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.745 -0.162 25613 995 1 15 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.543 0.475 25613 996 1 15 . 1 1 5 5 GLN H H 5 8.290 8.290 7.559 0.731 25613 997 1 15 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.370 0.589 25613 998 1 15 . 1 1 6 6 CYS H H 6 8.369 8.369 8.326 0.043 25613 999 1 15 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.345 0.528 25613 1000 1 15 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.933 11.884 25613 1001 1 15 . 1 1 7 7 CYS H H 7 8.308 8.308 7.943 0.365 25613 1002 1 15 . 1 1 8 8 THR HA H 8 4.110 4.110 4.297 -0.187 25613 1003 1 15 . 1 1 8 8 THR CA C 8 64.398 64.398 63.402 0.996 25613 1004 1 15 . 1 1 8 8 THR CB C 8 68.493 68.493 69.227 -0.734 25613 1005 1 15 . 1 1 8 8 THR H H 8 8.233 8.233 8.158 0.075 25613 1006 1 15 . 1 1 9 9 SER HA H 9 4.816 4.816 4.703 0.113 25613 1007 1 15 . 1 1 9 9 SER CA C 9 55.989 55.989 56.851 -0.862 25613 1008 1 15 . 1 1 9 9 SER CB C 9 64.007 64.007 65.052 -1.045 25613 1009 1 15 . 1 1 9 9 SER H H 9 7.533 7.533 7.951 -0.418 25613 1010 1 15 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.155 0.223 25613 1011 1 15 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.761 -0.871 25613 1012 1 15 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.191 1.734 25613 1013 1 15 . 1 1 10 10 ILE H H 10 7.876 7.876 8.312 -0.436 25613 1014 1 15 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.602 0.364 25613 1015 1 15 . 1 1 11 11 CYS H H 11 9.710 9.710 8.651 1.059 25613 1016 1 15 . 1 1 12 12 SER HA H 12 4.635 4.635 4.588 0.048 25613 1017 1 15 . 1 1 12 12 SER CA C 12 56.435 56.435 56.714 -0.279 25613 1018 1 15 . 1 1 12 12 SER CB C 12 65.596 65.596 64.452 1.144 25613 1019 1 15 . 1 1 12 12 SER H H 12 8.799 8.799 8.579 0.220 25613 1020 1 15 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.817 0.071 25613 1021 1 15 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.208 0.021 25613 1022 1 15 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.378 -0.231 25613 1023 1 15 . 1 1 13 13 LEU H H 13 8.652 8.652 8.572 0.081 25613 1024 1 15 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.187 0.006 25613 1025 1 15 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.207 -0.227 25613 1026 1 15 . 1 1 14 14 TYR CB C 14 37.621 37.621 37.050 0.571 25613 1027 1 15 . 1 1 14 14 TYR H H 14 7.517 7.517 7.441 0.076 25613 1028 1 15 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.890 0.125 25613 1029 1 15 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.708 -0.246 25613 1030 1 15 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.652 0.295 25613 1031 1 15 . 1 1 15 15 GLN H H 15 7.581 7.581 7.480 0.101 25613 1032 1 15 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.427 0.778 25613 1033 1 15 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.537 0.498 25613 1034 1 15 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.854 0.013 25613 1035 1 15 . 1 1 16 16 LEU H H 16 8.084 8.084 8.086 -0.002 25613 1036 1 15 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.048 0.179 25613 1037 1 15 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.372 -0.702 25613 1038 1 15 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.827 0.149 25613 1039 1 15 . 1 1 17 17 GLU H H 17 8.121 8.121 8.304 -0.183 25613 1040 1 15 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.530 -0.010 25613 1041 1 15 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.974 -0.254 25613 1042 1 15 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.493 -0.114 25613 1043 1 15 . 1 1 18 18 ASN H H 18 7.469 7.469 7.681 -0.212 25613 1044 1 15 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.533 -0.005 25613 1045 1 15 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.192 1.728 25613 1046 1 15 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.002 0.270 25613 1047 1 15 . 1 1 19 19 TYR H H 19 7.928 7.928 7.289 0.639 25613 1048 1 15 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.905 0.062 25613 1049 1 15 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.286 5.524 25613 1050 1 15 . 1 1 20 20 CYS H H 20 7.484 7.484 7.642 -0.158 25613 1051 1 16 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.874 0.192 25613 1052 1 16 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.746 -5.253 25613 1053 1 16 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.362 -7.094 25613 1054 1 16 . 1 1 2 2 ILE H H 2 8.541 8.541 8.210 0.331 25613 1055 1 16 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.623 0.108 25613 1056 1 16 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.671 -1.899 25613 1057 1 16 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.392 0.204 25613 1058 1 16 . 1 1 3 3 VAL H H 3 8.164 8.164 8.013 0.151 25613 1059 1 16 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.010 0.281 25613 1060 1 16 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.772 -2.696 25613 1061 1 16 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.315 -1.532 25613 1062 1 16 . 1 1 4 4 GLU H H 4 8.161 8.161 8.453 -0.292 25613 1063 1 16 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.147 -0.022 25613 1064 1 16 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.568 0.015 25613 1065 1 16 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.410 0.608 25613 1066 1 16 . 1 1 5 5 GLN H H 5 8.290 8.290 8.474 -0.184 25613 1067 1 16 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.452 0.507 25613 1068 1 16 . 1 1 6 6 CYS H H 6 8.369 8.369 8.046 0.323 25613 1069 1 16 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.308 0.565 25613 1070 1 16 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.716 12.101 25613 1071 1 16 . 1 1 7 7 CYS H H 7 8.308 8.308 8.257 0.051 25613 1072 1 16 . 1 1 8 8 THR HA H 8 4.110 4.110 4.193 -0.083 25613 1073 1 16 . 1 1 8 8 THR CA C 8 64.398 64.398 64.049 0.349 25613 1074 1 16 . 1 1 8 8 THR CB C 8 68.493 68.493 69.109 -0.616 25613 1075 1 16 . 1 1 8 8 THR H H 8 8.233 8.233 8.247 -0.014 25613 1076 1 16 . 1 1 9 9 SER HA H 9 4.816 4.816 4.758 0.058 25613 1077 1 16 . 1 1 9 9 SER CA C 9 55.989 55.989 56.717 -0.728 25613 1078 1 16 . 1 1 9 9 SER CB C 9 64.007 64.007 64.866 -0.859 25613 1079 1 16 . 1 1 9 9 SER H H 9 7.533 7.533 7.858 -0.325 25613 1080 1 16 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.279 0.099 25613 1081 1 16 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.109 -0.219 25613 1082 1 16 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.127 -0.202 25613 1083 1 16 . 1 1 10 10 ILE H H 10 7.876 7.876 8.374 -0.498 25613 1084 1 16 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.606 0.360 25613 1085 1 16 . 1 1 11 11 CYS H H 11 9.710 9.710 8.880 0.830 25613 1086 1 16 . 1 1 12 12 SER HA H 12 4.635 4.635 4.598 0.037 25613 1087 1 16 . 1 1 12 12 SER CA C 12 56.435 56.435 57.204 -0.769 25613 1088 1 16 . 1 1 12 12 SER CB C 12 65.596 65.596 64.501 1.095 25613 1089 1 16 . 1 1 12 12 SER H H 12 8.799 8.799 8.674 0.125 25613 1090 1 16 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.820 0.068 25613 1091 1 16 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.213 0.016 25613 1092 1 16 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.951 0.196 25613 1093 1 16 . 1 1 13 13 LEU H H 13 8.652 8.652 8.416 0.236 25613 1094 1 16 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.139 0.054 25613 1095 1 16 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.562 -0.582 25613 1096 1 16 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.974 0.647 25613 1097 1 16 . 1 1 14 14 TYR H H 14 7.517 7.517 7.136 0.381 25613 1098 1 16 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.902 0.113 25613 1099 1 16 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.402 0.060 25613 1100 1 16 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.464 0.483 25613 1101 1 16 . 1 1 15 15 GLN H H 15 7.581 7.581 7.640 -0.059 25613 1102 1 16 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.648 0.557 25613 1103 1 16 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.592 0.443 25613 1104 1 16 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.654 0.213 25613 1105 1 16 . 1 1 16 16 LEU H H 16 8.084 8.084 7.982 0.102 25613 1106 1 16 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.035 0.192 25613 1107 1 16 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.122 -1.452 25613 1108 1 16 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.986 -0.010 25613 1109 1 16 . 1 1 17 17 GLU H H 17 8.121 8.121 8.172 -0.051 25613 1110 1 16 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.519 0.001 25613 1111 1 16 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.854 -0.135 25613 1112 1 16 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.280 0.099 25613 1113 1 16 . 1 1 18 18 ASN H H 18 7.469 7.469 7.812 -0.343 25613 1114 1 16 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.555 -0.027 25613 1115 1 16 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.035 1.885 25613 1116 1 16 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.632 0.640 25613 1117 1 16 . 1 1 19 19 TYR H H 19 7.928 7.928 7.540 0.388 25613 1118 1 16 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.851 0.116 25613 1119 1 16 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.224 5.586 25613 1120 1 16 . 1 1 20 20 CYS H H 20 7.484 7.484 7.532 -0.048 25613 1121 1 17 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.820 0.246 25613 1122 1 17 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.848 -4.355 25613 1123 1 17 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.278 -7.010 25613 1124 1 17 . 1 1 2 2 ILE H H 2 8.541 8.541 8.426 0.115 25613 1125 1 17 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.661 0.070 25613 1126 1 17 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.354 -1.582 25613 1127 1 17 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.093 0.503 25613 1128 1 17 . 1 1 3 3 VAL H H 3 8.164 8.164 7.879 0.285 25613 1129 1 17 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.997 0.294 25613 1130 1 17 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.112 -2.036 25613 1131 1 17 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.814 -1.032 25613 1132 1 17 . 1 1 4 4 GLU H H 4 8.161 8.161 8.379 -0.218 25613 1133 1 17 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.034 0.091 25613 1134 1 17 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.172 -0.590 25613 1135 1 17 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.925 0.093 25613 1136 1 17 . 1 1 5 5 GLN H H 5 8.290 8.290 7.673 0.617 25613 1137 1 17 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.445 0.514 25613 1138 1 17 . 1 1 6 6 CYS H H 6 8.369 8.369 8.179 0.190 25613 1139 1 17 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.347 0.526 25613 1140 1 17 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.878 11.939 25613 1141 1 17 . 1 1 7 7 CYS H H 7 8.308 8.308 7.886 0.422 25613 1142 1 17 . 1 1 8 8 THR HA H 8 4.110 4.110 4.254 -0.144 25613 1143 1 17 . 1 1 8 8 THR CA C 8 64.398 64.398 64.231 0.167 25613 1144 1 17 . 1 1 8 8 THR CB C 8 68.493 68.493 69.544 -1.051 25613 1145 1 17 . 1 1 8 8 THR H H 8 8.233 8.233 8.191 0.042 25613 1146 1 17 . 1 1 9 9 SER HA H 9 4.816 4.816 4.645 0.171 25613 1147 1 17 . 1 1 9 9 SER CA C 9 55.989 55.989 57.377 -1.388 25613 1148 1 17 . 1 1 9 9 SER CB C 9 64.007 64.007 65.406 -1.399 25613 1149 1 17 . 1 1 9 9 SER H H 9 7.533 7.533 7.861 -0.328 25613 1150 1 17 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.096 0.282 25613 1151 1 17 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.778 -0.887 25613 1152 1 17 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.730 2.195 25613 1153 1 17 . 1 1 10 10 ILE H H 10 7.876 7.876 8.238 -0.362 25613 1154 1 17 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.679 0.287 25613 1155 1 17 . 1 1 11 11 CYS H H 11 9.710 9.710 8.696 1.014 25613 1156 1 17 . 1 1 12 12 SER HA H 12 4.635 4.635 4.664 -0.029 25613 1157 1 17 . 1 1 12 12 SER CA C 12 56.435 56.435 56.923 -0.488 25613 1158 1 17 . 1 1 12 12 SER CB C 12 65.596 65.596 65.464 0.132 25613 1159 1 17 . 1 1 12 12 SER H H 12 8.799 8.799 8.143 0.656 25613 1160 1 17 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.732 0.156 25613 1161 1 17 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.041 0.188 25613 1162 1 17 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.011 0.136 25613 1163 1 17 . 1 1 13 13 LEU H H 13 8.652 8.652 8.506 0.146 25613 1164 1 17 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.105 0.088 25613 1165 1 17 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.217 -0.237 25613 1166 1 17 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.407 1.214 25613 1167 1 17 . 1 1 14 14 TYR H H 14 7.517 7.517 7.064 0.453 25613 1168 1 17 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.889 0.126 25613 1169 1 17 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.635 -0.173 25613 1170 1 17 . 1 1 15 15 GLN CB C 15 28.947 28.947 27.991 0.956 25613 1171 1 17 . 1 1 15 15 GLN H H 15 7.581 7.581 7.551 0.030 25613 1172 1 17 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.626 0.579 25613 1173 1 17 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.679 0.356 25613 1174 1 17 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.618 0.249 25613 1175 1 17 . 1 1 16 16 LEU H H 16 8.084 8.084 8.175 -0.091 25613 1176 1 17 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.006 0.221 25613 1177 1 17 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.238 -1.568 25613 1178 1 17 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.028 -0.052 25613 1179 1 17 . 1 1 17 17 GLU H H 17 8.121 8.121 8.454 -0.333 25613 1180 1 17 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.530 -0.010 25613 1181 1 17 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.480 0.239 25613 1182 1 17 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.166 0.213 25613 1183 1 17 . 1 1 18 18 ASN H H 18 7.469 7.469 7.949 -0.480 25613 1184 1 17 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.553 -0.025 25613 1185 1 17 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.231 1.689 25613 1186 1 17 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.131 0.141 25613 1187 1 17 . 1 1 19 19 TYR H H 19 7.928 7.928 7.322 0.606 25613 1188 1 17 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.647 0.320 25613 1189 1 17 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.987 7.823 25613 1190 1 17 . 1 1 20 20 CYS H H 20 7.484 7.484 7.660 -0.176 25613 1191 1 18 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.853 0.213 25613 1192 1 18 . 1 1 2 2 ILE CA C 2 57.493 57.493 63.221 -5.728 25613 1193 1 18 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.117 -6.849 25613 1194 1 18 . 1 1 2 2 ILE H H 2 8.541 8.541 8.228 0.313 25613 1195 1 18 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.656 0.075 25613 1196 1 18 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.481 -1.709 25613 1197 1 18 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.172 0.424 25613 1198 1 18 . 1 1 3 3 VAL H H 3 8.164 8.164 7.963 0.201 25613 1199 1 18 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.984 0.307 25613 1200 1 18 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.582 -2.506 25613 1201 1 18 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.298 -1.515 25613 1202 1 18 . 1 1 4 4 GLU H H 4 8.161 8.161 7.669 0.492 25613 1203 1 18 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.138 -0.013 25613 1204 1 18 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.731 -0.148 25613 1205 1 18 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.906 0.112 25613 1206 1 18 . 1 1 5 5 GLN H H 5 8.290 8.290 7.911 0.379 25613 1207 1 18 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.560 0.399 25613 1208 1 18 . 1 1 6 6 CYS H H 6 8.369 8.369 8.021 0.348 25613 1209 1 18 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.383 0.490 25613 1210 1 18 . 1 1 7 7 CYS CB C 7 38.817 38.817 27.118 11.699 25613 1211 1 18 . 1 1 7 7 CYS H H 7 8.308 8.308 8.157 0.151 25613 1212 1 18 . 1 1 8 8 THR HA H 8 4.110 4.110 4.293 -0.183 25613 1213 1 18 . 1 1 8 8 THR CA C 8 64.398 64.398 64.320 0.078 25613 1214 1 18 . 1 1 8 8 THR CB C 8 68.493 68.493 69.233 -0.740 25613 1215 1 18 . 1 1 8 8 THR H H 8 8.233 8.233 8.060 0.173 25613 1216 1 18 . 1 1 9 9 SER HA H 9 4.816 4.816 4.725 0.091 25613 1217 1 18 . 1 1 9 9 SER CA C 9 55.989 55.989 56.667 -0.678 25613 1218 1 18 . 1 1 9 9 SER CB C 9 64.007 64.007 65.197 -1.190 25613 1219 1 18 . 1 1 9 9 SER H H 9 7.533 7.533 7.484 0.049 25613 1220 1 18 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.237 0.141 25613 1221 1 18 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.363 -0.472 25613 1222 1 18 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.181 -0.256 25613 1223 1 18 . 1 1 10 10 ILE H H 10 7.876 7.876 8.381 -0.505 25613 1224 1 18 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.922 0.044 25613 1225 1 18 . 1 1 11 11 CYS H H 11 9.710 9.710 8.859 0.851 25613 1226 1 18 . 1 1 12 12 SER HA H 12 4.635 4.635 4.443 0.192 25613 1227 1 18 . 1 1 12 12 SER CA C 12 56.435 56.435 57.288 -0.853 25613 1228 1 18 . 1 1 12 12 SER CB C 12 65.596 65.596 63.903 1.693 25613 1229 1 18 . 1 1 12 12 SER H H 12 8.799 8.799 8.411 0.388 25613 1230 1 18 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.788 0.100 25613 1231 1 18 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.328 -0.099 25613 1232 1 18 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.771 0.376 25613 1233 1 18 . 1 1 13 13 LEU H H 13 8.652 8.652 8.371 0.281 25613 1234 1 18 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.187 0.006 25613 1235 1 18 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.261 -0.281 25613 1236 1 18 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.665 0.956 25613 1237 1 18 . 1 1 14 14 TYR H H 14 7.517 7.517 6.954 0.563 25613 1238 1 18 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.878 0.137 25613 1239 1 18 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.538 -0.076 25613 1240 1 18 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.213 0.734 25613 1241 1 18 . 1 1 15 15 GLN H H 15 7.581 7.581 7.696 -0.115 25613 1242 1 18 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.605 0.600 25613 1243 1 18 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.588 0.447 25613 1244 1 18 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.758 0.109 25613 1245 1 18 . 1 1 16 16 LEU H H 16 8.084 8.084 8.210 -0.126 25613 1246 1 18 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.054 0.173 25613 1247 1 18 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.763 -1.093 25613 1248 1 18 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.309 -0.333 25613 1249 1 18 . 1 1 17 17 GLU H H 17 8.121 8.121 8.018 0.103 25613 1250 1 18 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.503 0.017 25613 1251 1 18 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.815 -0.096 25613 1252 1 18 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.142 0.237 25613 1253 1 18 . 1 1 18 18 ASN H H 18 7.469 7.469 7.871 -0.402 25613 1254 1 18 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.528 0.000 25613 1255 1 18 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.275 1.645 25613 1256 1 18 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.966 0.306 25613 1257 1 18 . 1 1 19 19 TYR H H 19 7.928 7.928 7.303 0.625 25613 1258 1 18 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.725 0.242 25613 1259 1 18 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.523 7.287 25613 1260 1 18 . 1 1 20 20 CYS H H 20 7.484 7.484 7.621 -0.137 25613 1261 1 19 . 1 1 2 2 ILE HA H 2 4.066 4.066 4.072 -0.006 25613 1262 1 19 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.682 -4.189 25613 1263 1 19 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.449 -7.181 25613 1264 1 19 . 1 1 2 2 ILE H H 2 8.541 8.541 8.422 0.119 25613 1265 1 19 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.632 0.099 25613 1266 1 19 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.691 -1.919 25613 1267 1 19 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.469 0.127 25613 1268 1 19 . 1 1 3 3 VAL H H 3 8.164 8.164 7.971 0.193 25613 1269 1 19 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.984 0.307 25613 1270 1 19 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.382 -2.306 25613 1271 1 19 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.765 -0.982 25613 1272 1 19 . 1 1 4 4 GLU H H 4 8.161 8.161 8.568 -0.407 25613 1273 1 19 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.116 0.009 25613 1274 1 19 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.311 -0.728 25613 1275 1 19 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.662 0.356 25613 1276 1 19 . 1 1 5 5 GLN H H 5 8.290 8.290 7.657 0.633 25613 1277 1 19 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.274 0.685 25613 1278 1 19 . 1 1 6 6 CYS H H 6 8.369 8.369 7.933 0.436 25613 1279 1 19 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.269 0.604 25613 1280 1 19 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.509 12.308 25613 1281 1 19 . 1 1 7 7 CYS H H 7 8.308 8.308 8.061 0.247 25613 1282 1 19 . 1 1 8 8 THR HA H 8 4.110 4.110 4.318 -0.208 25613 1283 1 19 . 1 1 8 8 THR CA C 8 64.398 64.398 64.292 0.106 25613 1284 1 19 . 1 1 8 8 THR CB C 8 68.493 68.493 69.769 -1.276 25613 1285 1 19 . 1 1 8 8 THR H H 8 8.233 8.233 8.346 -0.113 25613 1286 1 19 . 1 1 9 9 SER HA H 9 4.816 4.816 4.669 0.147 25613 1287 1 19 . 1 1 9 9 SER CA C 9 55.989 55.989 57.244 -1.255 25613 1288 1 19 . 1 1 9 9 SER CB C 9 64.007 64.007 65.725 -1.718 25613 1289 1 19 . 1 1 9 9 SER H H 9 7.533 7.533 7.894 -0.361 25613 1290 1 19 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.152 0.226 25613 1291 1 19 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.645 -0.755 25613 1292 1 19 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.999 -0.074 25613 1293 1 19 . 1 1 10 10 ILE H H 10 7.876 7.876 8.275 -0.399 25613 1294 1 19 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.589 0.377 25613 1295 1 19 . 1 1 11 11 CYS H H 11 9.710 9.710 8.745 0.965 25613 1296 1 19 . 1 1 12 12 SER HA H 12 4.635 4.635 4.642 -0.007 25613 1297 1 19 . 1 1 12 12 SER CA C 12 56.435 56.435 57.452 -1.017 25613 1298 1 19 . 1 1 12 12 SER CB C 12 65.596 65.596 65.562 0.034 25613 1299 1 19 . 1 1 12 12 SER H H 12 8.799 8.799 8.138 0.661 25613 1300 1 19 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.750 0.138 25613 1301 1 19 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.183 0.046 25613 1302 1 19 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.866 0.281 25613 1303 1 19 . 1 1 13 13 LEU H H 13 8.652 8.652 8.441 0.211 25613 1304 1 19 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.038 0.155 25613 1305 1 19 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.490 -0.510 25613 1306 1 19 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.368 1.253 25613 1307 1 19 . 1 1 14 14 TYR H H 14 7.517 7.517 6.882 0.635 25613 1308 1 19 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.929 0.086 25613 1309 1 19 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.548 -0.086 25613 1310 1 19 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.262 0.685 25613 1311 1 19 . 1 1 15 15 GLN H H 15 7.581 7.581 7.641 -0.060 25613 1312 1 19 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.195 1.010 25613 1313 1 19 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.315 0.720 25613 1314 1 19 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.579 0.288 25613 1315 1 19 . 1 1 16 16 LEU H H 16 8.084 8.084 7.994 0.090 25613 1316 1 19 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.976 0.251 25613 1317 1 19 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.174 -1.504 25613 1318 1 19 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.364 -0.388 25613 1319 1 19 . 1 1 17 17 GLU H H 17 8.121 8.121 8.258 -0.137 25613 1320 1 19 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.553 -0.033 25613 1321 1 19 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.806 -0.087 25613 1322 1 19 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.194 0.185 25613 1323 1 19 . 1 1 18 18 ASN H H 18 7.469 7.469 7.855 -0.386 25613 1324 1 19 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.502 0.026 25613 1325 1 19 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.675 1.245 25613 1326 1 19 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.075 0.197 25613 1327 1 19 . 1 1 19 19 TYR H H 19 7.928 7.928 7.425 0.503 25613 1328 1 19 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.800 0.167 25613 1329 1 19 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.925 6.885 25613 1330 1 19 . 1 1 20 20 CYS H H 20 7.484 7.484 7.918 -0.434 25613 1331 1 20 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.890 0.176 25613 1332 1 20 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.887 -5.394 25613 1333 1 20 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.015 -6.747 25613 1334 1 20 . 1 1 2 2 ILE H H 2 8.541 8.541 8.169 0.372 25613 1335 1 20 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.536 0.195 25613 1336 1 20 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.660 -1.888 25613 1337 1 20 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.103 0.493 25613 1338 1 20 . 1 1 3 3 VAL H H 3 8.164 8.164 8.144 0.020 25613 1339 1 20 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.953 0.338 25613 1340 1 20 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.653 -2.577 25613 1341 1 20 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.259 -1.476 25613 1342 1 20 . 1 1 4 4 GLU H H 4 8.161 8.161 7.734 0.427 25613 1343 1 20 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.103 0.022 25613 1344 1 20 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.738 -0.155 25613 1345 1 20 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.797 0.221 25613 1346 1 20 . 1 1 5 5 GLN H H 5 8.290 8.290 7.698 0.592 25613 1347 1 20 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.353 0.606 25613 1348 1 20 . 1 1 6 6 CYS H H 6 8.369 8.369 8.251 0.118 25613 1349 1 20 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.247 0.626 25613 1350 1 20 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.763 12.054 25613 1351 1 20 . 1 1 7 7 CYS H H 7 8.308 8.308 8.040 0.268 25613 1352 1 20 . 1 1 8 8 THR HA H 8 4.110 4.110 4.198 -0.088 25613 1353 1 20 . 1 1 8 8 THR CA C 8 64.398 64.398 63.917 0.481 25613 1354 1 20 . 1 1 8 8 THR CB C 8 68.493 68.493 69.123 -0.630 25613 1355 1 20 . 1 1 8 8 THR H H 8 8.233 8.233 8.076 0.157 25613 1356 1 20 . 1 1 9 9 SER HA H 9 4.816 4.816 4.692 0.124 25613 1357 1 20 . 1 1 9 9 SER CA C 9 55.989 55.989 56.730 -0.741 25613 1358 1 20 . 1 1 9 9 SER CB C 9 64.007 64.007 64.955 -0.948 25613 1359 1 20 . 1 1 9 9 SER H H 9 7.533 7.533 7.734 -0.201 25613 1360 1 20 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.157 0.221 25613 1361 1 20 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.611 -0.721 25613 1362 1 20 . 1 1 10 10 ILE CB C 10 38.925 38.925 36.944 1.982 25613 1363 1 20 . 1 1 10 10 ILE H H 10 7.876 7.876 8.310 -0.434 25613 1364 1 20 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.930 0.036 25613 1365 1 20 . 1 1 11 11 CYS H H 11 9.710 9.710 8.679 1.031 25613 1366 1 20 . 1 1 12 12 SER HA H 12 4.635 4.635 4.609 0.026 25613 1367 1 20 . 1 1 12 12 SER CA C 12 56.435 56.435 56.864 -0.429 25613 1368 1 20 . 1 1 12 12 SER CB C 12 65.596 65.596 64.550 1.046 25613 1369 1 20 . 1 1 12 12 SER H H 12 8.799 8.799 9.133 -0.334 25613 1370 1 20 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.770 0.118 25613 1371 1 20 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.510 -0.280 25613 1372 1 20 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.525 -0.378 25613 1373 1 20 . 1 1 13 13 LEU H H 13 8.652 8.652 8.308 0.344 25613 1374 1 20 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.244 -0.051 25613 1375 1 20 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.718 -0.738 25613 1376 1 20 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.607 1.014 25613 1377 1 20 . 1 1 14 14 TYR H H 14 7.517 7.517 6.901 0.616 25613 1378 1 20 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.919 0.096 25613 1379 1 20 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.711 -0.249 25613 1380 1 20 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.096 0.851 25613 1381 1 20 . 1 1 15 15 GLN H H 15 7.581 7.581 8.104 -0.523 25613 1382 1 20 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.388 0.817 25613 1383 1 20 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.497 0.538 25613 1384 1 20 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.547 0.320 25613 1385 1 20 . 1 1 16 16 LEU H H 16 8.084 8.084 8.121 -0.037 25613 1386 1 20 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.981 0.246 25613 1387 1 20 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.523 -1.853 25613 1388 1 20 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.160 -0.183 25613 1389 1 20 . 1 1 17 17 GLU H H 17 8.121 8.121 8.146 -0.025 25613 1390 1 20 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.575 -0.055 25613 1391 1 20 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.643 0.076 25613 1392 1 20 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.371 0.008 25613 1393 1 20 . 1 1 18 18 ASN H H 18 7.469 7.469 7.936 -0.467 25613 1394 1 20 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.537 -0.009 25613 1395 1 20 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.938 1.982 25613 1396 1 20 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.752 0.520 25613 1397 1 20 . 1 1 19 19 TYR H H 19 7.928 7.928 7.498 0.430 25613 1398 1 20 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.750 0.217 25613 1399 1 20 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.612 6.198 25613 1400 1 20 . 1 1 20 20 CYS H H 20 7.484 7.484 7.805 -0.321 25613 1401 1 21 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.903 0.163 25613 1402 1 21 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.832 -5.339 25613 1403 1 21 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.148 -6.880 25613 1404 1 21 . 1 1 2 2 ILE H H 2 8.541 8.541 8.355 0.186 25613 1405 1 21 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.601 0.130 25613 1406 1 21 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.212 -1.440 25613 1407 1 21 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.058 0.538 25613 1408 1 21 . 1 1 3 3 VAL H H 3 8.164 8.164 8.171 -0.007 25613 1409 1 21 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.951 0.340 25613 1410 1 21 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.813 -2.737 25613 1411 1 21 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.269 -1.486 25613 1412 1 21 . 1 1 4 4 GLU H H 4 8.161 8.161 7.660 0.501 25613 1413 1 21 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.033 0.092 25613 1414 1 21 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.065 -0.481 25613 1415 1 21 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.736 0.282 25613 1416 1 21 . 1 1 5 5 GLN H H 5 8.290 8.290 8.012 0.278 25613 1417 1 21 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.511 0.448 25613 1418 1 21 . 1 1 6 6 CYS H H 6 8.369 8.369 8.076 0.293 25613 1419 1 21 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.410 0.463 25613 1420 1 21 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.953 11.864 25613 1421 1 21 . 1 1 7 7 CYS H H 7 8.308 8.308 8.207 0.101 25613 1422 1 21 . 1 1 8 8 THR HA H 8 4.110 4.110 4.220 -0.110 25613 1423 1 21 . 1 1 8 8 THR CA C 8 64.398 64.398 64.247 0.151 25613 1424 1 21 . 1 1 8 8 THR CB C 8 68.493 68.493 69.354 -0.861 25613 1425 1 21 . 1 1 8 8 THR H H 8 8.233 8.233 8.132 0.101 25613 1426 1 21 . 1 1 9 9 SER HA H 9 4.816 4.816 4.696 0.120 25613 1427 1 21 . 1 1 9 9 SER CA C 9 55.989 55.989 56.704 -0.715 25613 1428 1 21 . 1 1 9 9 SER CB C 9 64.007 64.007 64.828 -0.821 25613 1429 1 21 . 1 1 9 9 SER H H 9 7.533 7.533 7.891 -0.358 25613 1430 1 21 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.183 0.195 25613 1431 1 21 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.764 -0.873 25613 1432 1 21 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.971 -0.047 25613 1433 1 21 . 1 1 10 10 ILE H H 10 7.876 7.876 8.333 -0.457 25613 1434 1 21 . 1 1 11 11 CYS HA H 11 4.966 4.966 5.026 -0.060 25613 1435 1 21 . 1 1 11 11 CYS H H 11 9.710 9.710 8.689 1.021 25613 1436 1 21 . 1 1 12 12 SER HA H 12 4.635 4.635 4.451 0.184 25613 1437 1 21 . 1 1 12 12 SER CA C 12 56.435 56.435 57.356 -0.921 25613 1438 1 21 . 1 1 12 12 SER CB C 12 65.596 65.596 64.009 1.587 25613 1439 1 21 . 1 1 12 12 SER H H 12 8.799 8.799 8.611 0.188 25613 1440 1 21 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.794 0.094 25613 1441 1 21 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.518 -0.289 25613 1442 1 21 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.890 0.257 25613 1443 1 21 . 1 1 13 13 LEU H H 13 8.652 8.652 8.406 0.246 25613 1444 1 21 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.377 -0.184 25613 1445 1 21 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.029 -0.049 25613 1446 1 21 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.765 0.856 25613 1447 1 21 . 1 1 14 14 TYR H H 14 7.517 7.517 7.210 0.307 25613 1448 1 21 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.862 0.153 25613 1449 1 21 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.343 0.119 25613 1450 1 21 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.435 0.512 25613 1451 1 21 . 1 1 15 15 GLN H H 15 7.581 7.581 7.491 0.090 25613 1452 1 21 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.594 0.611 25613 1453 1 21 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.604 0.431 25613 1454 1 21 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.727 0.140 25613 1455 1 21 . 1 1 16 16 LEU H H 16 8.084 8.084 7.973 0.111 25613 1456 1 21 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.997 0.230 25613 1457 1 21 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.133 -1.463 25613 1458 1 21 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.314 -0.338 25613 1459 1 21 . 1 1 17 17 GLU H H 17 8.121 8.121 8.445 -0.324 25613 1460 1 21 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.505 0.015 25613 1461 1 21 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.978 -0.259 25613 1462 1 21 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.331 0.048 25613 1463 1 21 . 1 1 18 18 ASN H H 18 7.469 7.469 7.790 -0.321 25613 1464 1 21 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.582 -0.054 25613 1465 1 21 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.555 2.365 25613 1466 1 21 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.983 0.289 25613 1467 1 21 . 1 1 19 19 TYR H H 19 7.928 7.928 7.240 0.688 25613 1468 1 21 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.551 0.416 25613 1469 1 21 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.930 7.880 25613 1470 1 21 . 1 1 20 20 CYS H H 20 7.484 7.484 7.805 -0.321 25613 1471 1 22 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.930 0.136 25613 1472 1 22 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.480 -4.987 25613 1473 1 22 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.221 -6.953 25613 1474 1 22 . 1 1 2 2 ILE H H 2 8.541 8.541 8.394 0.147 25613 1475 1 22 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.715 0.016 25613 1476 1 22 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.877 -2.106 25613 1477 1 22 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.003 0.593 25613 1478 1 22 . 1 1 3 3 VAL H H 3 8.164 8.164 8.086 0.078 25613 1479 1 22 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.059 0.232 25613 1480 1 22 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.402 -2.326 25613 1481 1 22 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.654 -0.871 25613 1482 1 22 . 1 1 4 4 GLU H H 4 8.161 8.161 8.623 -0.462 25613 1483 1 22 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.103 0.022 25613 1484 1 22 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.753 -0.170 25613 1485 1 22 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.371 0.647 25613 1486 1 22 . 1 1 5 5 GLN H H 5 8.290 8.290 7.777 0.513 25613 1487 1 22 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.450 0.509 25613 1488 1 22 . 1 1 6 6 CYS H H 6 8.369 8.369 8.235 0.134 25613 1489 1 22 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.406 0.467 25613 1490 1 22 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.898 11.919 25613 1491 1 22 . 1 1 7 7 CYS H H 7 8.308 8.308 8.112 0.196 25613 1492 1 22 . 1 1 8 8 THR HA H 8 4.110 4.110 4.337 -0.227 25613 1493 1 22 . 1 1 8 8 THR CA C 8 64.398 64.398 63.455 0.944 25613 1494 1 22 . 1 1 8 8 THR CB C 8 68.493 68.493 69.115 -0.622 25613 1495 1 22 . 1 1 8 8 THR H H 8 8.233 8.233 8.204 0.029 25613 1496 1 22 . 1 1 9 9 SER HA H 9 4.816 4.816 4.692 0.124 25613 1497 1 22 . 1 1 9 9 SER CA C 9 55.989 55.989 56.893 -0.904 25613 1498 1 22 . 1 1 9 9 SER CB C 9 64.007 64.007 66.084 -2.077 25613 1499 1 22 . 1 1 9 9 SER H H 9 7.533 7.533 8.078 -0.545 25613 1500 1 22 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.151 0.227 25613 1501 1 22 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.910 -1.019 25613 1502 1 22 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.785 0.140 25613 1503 1 22 . 1 1 10 10 ILE H H 10 7.876 7.876 8.289 -0.413 25613 1504 1 22 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.928 0.038 25613 1505 1 22 . 1 1 11 11 CYS H H 11 9.710 9.710 8.743 0.967 25613 1506 1 22 . 1 1 12 12 SER HA H 12 4.635 4.635 4.521 0.114 25613 1507 1 22 . 1 1 12 12 SER CA C 12 56.435 56.435 57.253 -0.818 25613 1508 1 22 . 1 1 12 12 SER CB C 12 65.596 65.596 64.081 1.515 25613 1509 1 22 . 1 1 12 12 SER H H 12 8.799 8.799 9.004 -0.205 25613 1510 1 22 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.765 0.122 25613 1511 1 22 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.489 -0.260 25613 1512 1 22 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.875 0.272 25613 1513 1 22 . 1 1 13 13 LEU H H 13 8.652 8.652 8.357 0.295 25613 1514 1 22 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.102 0.091 25613 1515 1 22 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.461 -0.481 25613 1516 1 22 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.756 0.865 25613 1517 1 22 . 1 1 14 14 TYR H H 14 7.517 7.517 7.046 0.471 25613 1518 1 22 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.922 0.093 25613 1519 1 22 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.328 0.134 25613 1520 1 22 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.414 0.533 25613 1521 1 22 . 1 1 15 15 GLN H H 15 7.581 7.581 7.438 0.143 25613 1522 1 22 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.360 0.845 25613 1523 1 22 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.247 0.788 25613 1524 1 22 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.444 0.423 25613 1525 1 22 . 1 1 16 16 LEU H H 16 8.084 8.084 7.860 0.224 25613 1526 1 22 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.033 0.194 25613 1527 1 22 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.093 -1.423 25613 1528 1 22 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.008 -0.032 25613 1529 1 22 . 1 1 17 17 GLU H H 17 8.121 8.121 8.070 0.051 25613 1530 1 22 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.596 -0.076 25613 1531 1 22 . 1 1 18 18 ASN CA C 18 54.719 54.719 55.063 -0.344 25613 1532 1 22 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.207 0.172 25613 1533 1 22 . 1 1 18 18 ASN H H 18 7.469 7.469 7.906 -0.437 25613 1534 1 22 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.535 -0.007 25613 1535 1 22 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.643 1.277 25613 1536 1 22 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.644 0.628 25613 1537 1 22 . 1 1 19 19 TYR H H 19 7.928 7.928 7.666 0.262 25613 1538 1 22 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.964 0.003 25613 1539 1 22 . 1 1 20 20 CYS CB C 20 35.810 35.810 30.193 5.617 25613 1540 1 22 . 1 1 20 20 CYS H H 20 7.484 7.484 7.615 -0.131 25613 1541 1 23 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.905 0.161 25613 1542 1 23 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.976 -5.483 25613 1543 1 23 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.110 -6.842 25613 1544 1 23 . 1 1 2 2 ILE H H 2 8.541 8.541 8.251 0.290 25613 1545 1 23 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.542 0.189 25613 1546 1 23 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.830 -2.058 25613 1547 1 23 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.256 0.340 25613 1548 1 23 . 1 1 3 3 VAL H H 3 8.164 8.164 8.090 0.074 25613 1549 1 23 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.975 0.316 25613 1550 1 23 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.740 -2.664 25613 1551 1 23 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.273 -1.490 25613 1552 1 23 . 1 1 4 4 GLU H H 4 8.161 8.161 8.005 0.156 25613 1553 1 23 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.101 0.024 25613 1554 1 23 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.817 -0.234 25613 1555 1 23 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.765 0.253 25613 1556 1 23 . 1 1 5 5 GLN H H 5 8.290 8.290 7.820 0.470 25613 1557 1 23 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.535 0.424 25613 1558 1 23 . 1 1 6 6 CYS H H 6 8.369 8.369 7.927 0.442 25613 1559 1 23 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.363 0.510 25613 1560 1 23 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.718 12.098 25613 1561 1 23 . 1 1 7 7 CYS H H 7 8.308 8.308 8.218 0.090 25613 1562 1 23 . 1 1 8 8 THR HA H 8 4.110 4.110 4.308 -0.198 25613 1563 1 23 . 1 1 8 8 THR CA C 8 64.398 64.398 63.712 0.686 25613 1564 1 23 . 1 1 8 8 THR CB C 8 68.493 68.493 69.313 -0.820 25613 1565 1 23 . 1 1 8 8 THR H H 8 8.233 8.233 8.202 0.031 25613 1566 1 23 . 1 1 9 9 SER HA H 9 4.816 4.816 4.705 0.111 25613 1567 1 23 . 1 1 9 9 SER CA C 9 55.989 55.989 56.505 -0.516 25613 1568 1 23 . 1 1 9 9 SER CB C 9 64.007 64.007 64.816 -0.809 25613 1569 1 23 . 1 1 9 9 SER H H 9 7.533 7.533 7.562 -0.029 25613 1570 1 23 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.163 0.215 25613 1571 1 23 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.733 -0.841 25613 1572 1 23 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.257 0.668 25613 1573 1 23 . 1 1 10 10 ILE H H 10 7.876 7.876 8.395 -0.519 25613 1574 1 23 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.523 0.443 25613 1575 1 23 . 1 1 11 11 CYS H H 11 9.710 9.710 8.711 0.999 25613 1576 1 23 . 1 1 12 12 SER HA H 12 4.635 4.635 4.446 0.189 25613 1577 1 23 . 1 1 12 12 SER CA C 12 56.435 56.435 57.362 -0.927 25613 1578 1 23 . 1 1 12 12 SER CB C 12 65.596 65.596 63.967 1.629 25613 1579 1 23 . 1 1 12 12 SER H H 12 8.799 8.799 8.412 0.387 25613 1580 1 23 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.836 0.052 25613 1581 1 23 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.427 -0.198 25613 1582 1 23 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.033 0.114 25613 1583 1 23 . 1 1 13 13 LEU H H 13 8.652 8.652 8.248 0.404 25613 1584 1 23 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.527 -0.334 25613 1585 1 23 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.015 -0.035 25613 1586 1 23 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.677 0.944 25613 1587 1 23 . 1 1 14 14 TYR H H 14 7.517 7.517 7.060 0.457 25613 1588 1 23 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.983 0.032 25613 1589 1 23 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.542 -0.080 25613 1590 1 23 . 1 1 15 15 GLN CB C 15 28.947 28.947 27.934 1.013 25613 1591 1 23 . 1 1 15 15 GLN H H 15 7.581 7.581 8.181 -0.600 25613 1592 1 23 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.817 0.388 25613 1593 1 23 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.467 0.568 25613 1594 1 23 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.750 0.117 25613 1595 1 23 . 1 1 16 16 LEU H H 16 8.084 8.084 8.160 -0.076 25613 1596 1 23 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.081 0.146 25613 1597 1 23 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.915 -1.245 25613 1598 1 23 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.342 -0.366 25613 1599 1 23 . 1 1 17 17 GLU H H 17 8.121 8.121 8.141 -0.020 25613 1600 1 23 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.557 -0.037 25613 1601 1 23 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.502 0.217 25613 1602 1 23 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.316 0.063 25613 1603 1 23 . 1 1 18 18 ASN H H 18 7.469 7.469 7.656 -0.187 25613 1604 1 23 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.519 0.009 25613 1605 1 23 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.478 1.442 25613 1606 1 23 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.355 -0.083 25613 1607 1 23 . 1 1 19 19 TYR H H 19 7.928 7.928 7.205 0.723 25613 1608 1 23 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.518 0.449 25613 1609 1 23 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.636 8.174 25613 1610 1 23 . 1 1 20 20 CYS H H 20 7.484 7.484 7.589 -0.105 25613 1611 1 24 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.897 0.169 25613 1612 1 24 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.855 -5.362 25613 1613 1 24 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.229 -6.961 25613 1614 1 24 . 1 1 2 2 ILE H H 2 8.541 8.541 8.510 0.031 25613 1615 1 24 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.581 0.150 25613 1616 1 24 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.958 -2.186 25613 1617 1 24 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.366 0.230 25613 1618 1 24 . 1 1 3 3 VAL H H 3 8.164 8.164 8.029 0.135 25613 1619 1 24 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.986 0.305 25613 1620 1 24 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.854 -2.778 25613 1621 1 24 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.298 -1.515 25613 1622 1 24 . 1 1 4 4 GLU H H 4 8.161 8.161 8.387 -0.226 25613 1623 1 24 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.051 0.074 25613 1624 1 24 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.993 -0.410 25613 1625 1 24 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.760 0.258 25613 1626 1 24 . 1 1 5 5 GLN H H 5 8.290 8.290 7.928 0.362 25613 1627 1 24 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.462 0.497 25613 1628 1 24 . 1 1 6 6 CYS H H 6 8.369 8.369 8.186 0.183 25613 1629 1 24 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.415 0.458 25613 1630 1 24 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.864 11.953 25613 1631 1 24 . 1 1 7 7 CYS H H 7 8.308 8.308 8.240 0.068 25613 1632 1 24 . 1 1 8 8 THR HA H 8 4.110 4.110 4.311 -0.201 25613 1633 1 24 . 1 1 8 8 THR CA C 8 64.398 64.398 63.692 0.706 25613 1634 1 24 . 1 1 8 8 THR CB C 8 68.493 68.493 69.355 -0.862 25613 1635 1 24 . 1 1 8 8 THR H H 8 8.233 8.233 8.140 0.093 25613 1636 1 24 . 1 1 9 9 SER HA H 9 4.816 4.816 4.743 0.073 25613 1637 1 24 . 1 1 9 9 SER CA C 9 55.989 55.989 56.624 -0.635 25613 1638 1 24 . 1 1 9 9 SER CB C 9 64.007 64.007 64.916 -0.909 25613 1639 1 24 . 1 1 9 9 SER H H 9 7.533 7.533 7.970 -0.436 25613 1640 1 24 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.257 0.121 25613 1641 1 24 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.309 -0.418 25613 1642 1 24 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.786 -0.861 25613 1643 1 24 . 1 1 10 10 ILE H H 10 7.876 7.876 8.329 -0.453 25613 1644 1 24 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.638 0.328 25613 1645 1 24 . 1 1 11 11 CYS H H 11 9.710 9.710 8.832 0.878 25613 1646 1 24 . 1 1 12 12 SER HA H 12 4.635 4.635 4.413 0.222 25613 1647 1 24 . 1 1 12 12 SER CA C 12 56.435 56.435 57.790 -1.355 25613 1648 1 24 . 1 1 12 12 SER CB C 12 65.596 65.596 63.811 1.785 25613 1649 1 24 . 1 1 12 12 SER H H 12 8.799 8.799 8.564 0.235 25613 1650 1 24 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.799 0.089 25613 1651 1 24 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.491 -0.262 25613 1652 1 24 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.903 0.244 25613 1653 1 24 . 1 1 13 13 LEU H H 13 8.652 8.652 8.361 0.291 25613 1654 1 24 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.172 0.021 25613 1655 1 24 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.416 -0.436 25613 1656 1 24 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.732 0.889 25613 1657 1 24 . 1 1 14 14 TYR H H 14 7.517 7.517 7.153 0.364 25613 1658 1 24 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.960 0.055 25613 1659 1 24 . 1 1 15 15 GLN CA C 15 58.462 58.462 57.998 0.464 25613 1660 1 24 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.016 0.931 25613 1661 1 24 . 1 1 15 15 GLN H H 15 7.581 7.581 7.465 0.116 25613 1662 1 24 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.635 0.570 25613 1663 1 24 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.174 0.861 25613 1664 1 24 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.672 0.195 25613 1665 1 24 . 1 1 16 16 LEU H H 16 8.084 8.084 7.900 0.184 25613 1666 1 24 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.074 0.153 25613 1667 1 24 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.616 -0.946 25613 1668 1 24 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.123 -0.147 25613 1669 1 24 . 1 1 17 17 GLU H H 17 8.121 8.121 7.881 0.240 25613 1670 1 24 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.568 -0.048 25613 1671 1 24 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.741 -0.022 25613 1672 1 24 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.556 -0.177 25613 1673 1 24 . 1 1 18 18 ASN H H 18 7.469 7.469 7.810 -0.341 25613 1674 1 24 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.516 0.012 25613 1675 1 24 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.574 1.346 25613 1676 1 24 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.553 -0.281 25613 1677 1 24 . 1 1 19 19 TYR H H 19 7.928 7.928 7.226 0.702 25613 1678 1 24 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.690 0.277 25613 1679 1 24 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.800 7.010 25613 1680 1 24 . 1 1 20 20 CYS H H 20 7.484 7.484 7.717 -0.233 25613 1681 1 25 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.886 0.180 25613 1682 1 25 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.417 -4.924 25613 1683 1 25 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.162 -6.894 25613 1684 1 25 . 1 1 2 2 ILE H H 2 8.541 8.541 8.276 0.265 25613 1685 1 25 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.532 0.199 25613 1686 1 25 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.092 -1.320 25613 1687 1 25 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.484 0.112 25613 1688 1 25 . 1 1 3 3 VAL H H 3 8.164 8.164 8.011 0.153 25613 1689 1 25 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.994 0.297 25613 1690 1 25 . 1 1 4 4 GLU CA C 4 57.076 57.076 58.955 -1.879 25613 1691 1 25 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.786 -1.003 25613 1692 1 25 . 1 1 4 4 GLU H H 4 8.161 8.161 7.903 0.258 25613 1693 1 25 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.073 0.052 25613 1694 1 25 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.754 -0.171 25613 1695 1 25 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.758 0.260 25613 1696 1 25 . 1 1 5 5 GLN H H 5 8.290 8.290 7.673 0.617 25613 1697 1 25 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.476 0.483 25613 1698 1 25 . 1 1 6 6 CYS H H 6 8.369 8.369 8.297 0.072 25613 1699 1 25 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.356 0.517 25613 1700 1 25 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.971 11.846 25613 1701 1 25 . 1 1 7 7 CYS H H 7 8.308 8.308 7.461 0.847 25613 1702 1 25 . 1 1 8 8 THR HA H 8 4.110 4.110 4.311 -0.201 25613 1703 1 25 . 1 1 8 8 THR CA C 8 64.398 64.398 64.118 0.280 25613 1704 1 25 . 1 1 8 8 THR CB C 8 68.493 68.493 69.338 -0.845 25613 1705 1 25 . 1 1 8 8 THR H H 8 8.233 8.233 8.188 0.045 25613 1706 1 25 . 1 1 9 9 SER HA H 9 4.816 4.816 4.742 0.074 25613 1707 1 25 . 1 1 9 9 SER CA C 9 55.989 55.989 56.603 -0.615 25613 1708 1 25 . 1 1 9 9 SER CB C 9 64.007 64.007 65.106 -1.099 25613 1709 1 25 . 1 1 9 9 SER H H 9 7.533 7.533 7.773 -0.240 25613 1710 1 25 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.225 0.153 25613 1711 1 25 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.388 -0.497 25613 1712 1 25 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.143 -0.218 25613 1713 1 25 . 1 1 10 10 ILE H H 10 7.876 7.876 8.396 -0.520 25613 1714 1 25 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.851 0.115 25613 1715 1 25 . 1 1 11 11 CYS H H 11 9.710 9.710 8.887 0.823 25613 1716 1 25 . 1 1 12 12 SER HA H 12 4.635 4.635 4.309 0.326 25613 1717 1 25 . 1 1 12 12 SER CA C 12 56.435 56.435 58.250 -1.815 25613 1718 1 25 . 1 1 12 12 SER CB C 12 65.596 65.596 63.944 1.652 25613 1719 1 25 . 1 1 12 12 SER H H 12 8.799 8.799 8.820 -0.021 25613 1720 1 25 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.871 0.017 25613 1721 1 25 . 1 1 13 13 LEU CA C 13 58.229 58.229 57.930 0.299 25613 1722 1 25 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.094 0.052 25613 1723 1 25 . 1 1 13 13 LEU H H 13 8.652 8.652 8.337 0.315 25613 1724 1 25 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.570 -0.377 25613 1725 1 25 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.083 -0.103 25613 1726 1 25 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.940 0.681 25613 1727 1 25 . 1 1 14 14 TYR H H 14 7.517 7.517 7.140 0.377 25613 1728 1 25 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.804 0.211 25613 1729 1 25 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.356 0.106 25613 1730 1 25 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.370 0.577 25613 1731 1 25 . 1 1 15 15 GLN H H 15 7.581 7.581 7.525 0.056 25613 1732 1 25 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.713 0.492 25613 1733 1 25 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.890 0.145 25613 1734 1 25 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.669 0.198 25613 1735 1 25 . 1 1 16 16 LEU H H 16 8.084 8.084 8.081 0.003 25613 1736 1 25 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.016 0.211 25613 1737 1 25 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.016 -1.345 25613 1738 1 25 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.416 -0.441 25613 1739 1 25 . 1 1 17 17 GLU H H 17 8.121 8.121 8.002 0.119 25613 1740 1 25 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.548 -0.028 25613 1741 1 25 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.581 0.138 25613 1742 1 25 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.374 0.005 25613 1743 1 25 . 1 1 18 18 ASN H H 18 7.469 7.469 7.881 -0.412 25613 1744 1 25 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.462 0.066 25613 1745 1 25 . 1 1 19 19 TYR CA C 19 58.920 58.920 58.101 0.819 25613 1746 1 25 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.103 0.169 25613 1747 1 25 . 1 1 19 19 TYR H H 19 7.928 7.928 7.171 0.757 25613 1748 1 25 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.586 0.381 25613 1749 1 25 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.470 7.340 25613 1750 1 25 . 1 1 20 20 CYS H H 20 7.484 7.484 7.802 -0.318 25613 1751 1 26 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.934 0.132 25613 1752 1 26 . 1 1 2 2 ILE CA C 2 57.493 57.493 63.197 -5.704 25613 1753 1 26 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.177 -6.909 25613 1754 1 26 . 1 1 2 2 ILE H H 2 8.541 8.541 8.293 0.248 25613 1755 1 26 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.630 0.101 25613 1756 1 26 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.542 -1.770 25613 1757 1 26 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.184 0.412 25613 1758 1 26 . 1 1 3 3 VAL H H 3 8.164 8.164 8.154 0.010 25613 1759 1 26 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.006 0.285 25613 1760 1 26 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.664 -2.588 25613 1761 1 26 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.414 -1.631 25613 1762 1 26 . 1 1 4 4 GLU H H 4 8.161 8.161 8.397 -0.236 25613 1763 1 26 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.082 0.043 25613 1764 1 26 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.798 -0.215 25613 1765 1 26 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.553 0.465 25613 1766 1 26 . 1 1 5 5 GLN H H 5 8.290 8.290 8.054 0.236 25613 1767 1 26 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.461 0.498 25613 1768 1 26 . 1 1 6 6 CYS H H 6 8.369 8.369 8.157 0.212 25613 1769 1 26 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.335 0.538 25613 1770 1 26 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.710 12.107 25613 1771 1 26 . 1 1 7 7 CYS H H 7 8.308 8.308 8.157 0.151 25613 1772 1 26 . 1 1 8 8 THR HA H 8 4.110 4.110 4.387 -0.277 25613 1773 1 26 . 1 1 8 8 THR CA C 8 64.398 64.398 63.437 0.961 25613 1774 1 26 . 1 1 8 8 THR CB C 8 68.493 68.493 69.021 -0.528 25613 1775 1 26 . 1 1 8 8 THR H H 8 8.233 8.233 8.158 0.075 25613 1776 1 26 . 1 1 9 9 SER HA H 9 4.816 4.816 4.722 0.094 25613 1777 1 26 . 1 1 9 9 SER CA C 9 55.989 55.989 57.014 -1.025 25613 1778 1 26 . 1 1 9 9 SER CB C 9 64.007 64.007 65.741 -1.734 25613 1779 1 26 . 1 1 9 9 SER H H 9 7.533 7.533 7.914 -0.381 25613 1780 1 26 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.265 0.113 25613 1781 1 26 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.579 -0.688 25613 1782 1 26 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.839 0.086 25613 1783 1 26 . 1 1 10 10 ILE H H 10 7.876 7.876 8.268 -0.392 25613 1784 1 26 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.653 0.313 25613 1785 1 26 . 1 1 11 11 CYS H H 11 9.710 9.710 8.732 0.978 25613 1786 1 26 . 1 1 12 12 SER HA H 12 4.635 4.635 4.609 0.026 25613 1787 1 26 . 1 1 12 12 SER CA C 12 56.435 56.435 57.307 -0.872 25613 1788 1 26 . 1 1 12 12 SER CB C 12 65.596 65.596 64.764 0.832 25613 1789 1 26 . 1 1 12 12 SER H H 12 8.799 8.799 8.053 0.746 25613 1790 1 26 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.823 0.065 25613 1791 1 26 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.086 0.143 25613 1792 1 26 . 1 1 13 13 LEU CB C 13 41.147 41.147 41.029 0.118 25613 1793 1 26 . 1 1 13 13 LEU H H 13 8.652 8.652 8.501 0.151 25613 1794 1 26 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.221 -0.028 25613 1795 1 26 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.702 -0.722 25613 1796 1 26 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.537 1.084 25613 1797 1 26 . 1 1 14 14 TYR H H 14 7.517 7.517 7.375 0.142 25613 1798 1 26 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.903 0.112 25613 1799 1 26 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.797 -0.335 25613 1800 1 26 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.092 0.855 25613 1801 1 26 . 1 1 15 15 GLN H H 15 7.581 7.581 8.220 -0.639 25613 1802 1 26 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.714 0.491 25613 1803 1 26 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.224 0.811 25613 1804 1 26 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.689 0.178 25613 1805 1 26 . 1 1 16 16 LEU H H 16 8.084 8.084 7.979 0.105 25613 1806 1 26 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.986 0.241 25613 1807 1 26 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.340 -1.670 25613 1808 1 26 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.149 -0.173 25613 1809 1 26 . 1 1 17 17 GLU H H 17 8.121 8.121 8.314 -0.193 25613 1810 1 26 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.536 -0.016 25613 1811 1 26 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.686 0.033 25613 1812 1 26 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.447 -0.068 25613 1813 1 26 . 1 1 18 18 ASN H H 18 7.469 7.469 7.752 -0.283 25613 1814 1 26 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.613 -0.085 25613 1815 1 26 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.337 2.583 25613 1816 1 26 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.768 0.504 25613 1817 1 26 . 1 1 19 19 TYR H H 19 7.928 7.928 7.289 0.639 25613 1818 1 26 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.663 0.304 25613 1819 1 26 . 1 1 20 20 CYS CB C 20 35.810 35.810 28.166 7.644 25613 1820 1 26 . 1 1 20 20 CYS H H 20 7.484 7.484 7.897 -0.413 25613 1821 1 27 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.996 0.070 25613 1822 1 27 . 1 1 2 2 ILE CA C 2 57.493 57.493 61.936 -4.443 25613 1823 1 27 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.559 -7.291 25613 1824 1 27 . 1 1 2 2 ILE H H 2 8.541 8.541 8.340 0.201 25613 1825 1 27 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.826 -0.095 25613 1826 1 27 . 1 1 3 3 VAL CA C 3 64.772 64.772 65.992 -1.220 25613 1827 1 27 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.140 0.456 25613 1828 1 27 . 1 1 3 3 VAL H H 3 8.164 8.164 7.837 0.327 25613 1829 1 27 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.985 0.306 25613 1830 1 27 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.255 -2.179 25613 1831 1 27 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.756 -0.973 25613 1832 1 27 . 1 1 4 4 GLU H H 4 8.161 8.161 8.542 -0.381 25613 1833 1 27 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.163 -0.038 25613 1834 1 27 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.848 -0.265 25613 1835 1 27 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.783 0.235 25613 1836 1 27 . 1 1 5 5 GLN H H 5 8.290 8.290 7.663 0.627 25613 1837 1 27 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.596 0.363 25613 1838 1 27 . 1 1 6 6 CYS H H 6 8.369 8.369 7.973 0.396 25613 1839 1 27 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.366 0.507 25613 1840 1 27 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.992 11.825 25613 1841 1 27 . 1 1 7 7 CYS H H 7 8.308 8.308 8.228 0.080 25613 1842 1 27 . 1 1 8 8 THR HA H 8 4.110 4.110 4.294 -0.184 25613 1843 1 27 . 1 1 8 8 THR CA C 8 64.398 64.398 64.085 0.313 25613 1844 1 27 . 1 1 8 8 THR CB C 8 68.493 68.493 69.299 -0.806 25613 1845 1 27 . 1 1 8 8 THR H H 8 8.233 8.233 8.104 0.129 25613 1846 1 27 . 1 1 9 9 SER HA H 9 4.816 4.816 4.718 0.098 25613 1847 1 27 . 1 1 9 9 SER CA C 9 55.989 55.989 56.946 -0.957 25613 1848 1 27 . 1 1 9 9 SER CB C 9 64.007 64.007 65.964 -1.957 25613 1849 1 27 . 1 1 9 9 SER H H 9 7.533 7.533 7.732 -0.199 25613 1850 1 27 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.203 0.175 25613 1851 1 27 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.486 -0.595 25613 1852 1 27 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.028 -0.103 25613 1853 1 27 . 1 1 10 10 ILE H H 10 7.876 7.876 8.327 -0.451 25613 1854 1 27 . 1 1 11 11 CYS HA H 11 4.966 4.966 5.023 -0.057 25613 1855 1 27 . 1 1 11 11 CYS H H 11 9.710 9.710 8.711 0.999 25613 1856 1 27 . 1 1 12 12 SER HA H 12 4.635 4.635 4.645 -0.010 25613 1857 1 27 . 1 1 12 12 SER CA C 12 56.435 56.435 57.443 -1.008 25613 1858 1 27 . 1 1 12 12 SER CB C 12 65.596 65.596 64.322 1.274 25613 1859 1 27 . 1 1 12 12 SER H H 12 8.799 8.799 9.086 -0.287 25613 1860 1 27 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.815 0.073 25613 1861 1 27 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.584 -0.354 25613 1862 1 27 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.745 0.402 25613 1863 1 27 . 1 1 13 13 LEU H H 13 8.652 8.652 8.452 0.200 25613 1864 1 27 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.144 0.049 25613 1865 1 27 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.598 -0.618 25613 1866 1 27 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.749 0.872 25613 1867 1 27 . 1 1 14 14 TYR H H 14 7.517 7.517 7.089 0.428 25613 1868 1 27 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.816 0.199 25613 1869 1 27 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.611 -0.149 25613 1870 1 27 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.328 0.619 25613 1871 1 27 . 1 1 15 15 GLN H H 15 7.581 7.581 7.688 -0.107 25613 1872 1 27 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.677 0.528 25613 1873 1 27 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.634 0.401 25613 1874 1 27 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.970 -0.103 25613 1875 1 27 . 1 1 16 16 LEU H H 16 8.084 8.084 8.153 -0.069 25613 1876 1 27 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.079 0.148 25613 1877 1 27 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.179 -0.509 25613 1878 1 27 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.731 0.245 25613 1879 1 27 . 1 1 17 17 GLU H H 17 8.121 8.121 8.538 -0.417 25613 1880 1 27 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.520 -0.000 25613 1881 1 27 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.512 0.207 25613 1882 1 27 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.188 0.191 25613 1883 1 27 . 1 1 18 18 ASN H H 18 7.469 7.469 7.722 -0.253 25613 1884 1 27 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.569 -0.041 25613 1885 1 27 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.173 1.747 25613 1886 1 27 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.200 0.072 25613 1887 1 27 . 1 1 19 19 TYR H H 19 7.928 7.928 7.491 0.437 25613 1888 1 27 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.606 0.361 25613 1889 1 27 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.849 7.961 25613 1890 1 27 . 1 1 20 20 CYS H H 20 7.484 7.484 7.662 -0.178 25613 1891 1 28 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.851 0.215 25613 1892 1 28 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.311 -4.818 25613 1893 1 28 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.376 -7.108 25613 1894 1 28 . 1 1 2 2 ILE H H 2 8.541 8.541 8.365 0.176 25613 1895 1 28 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.395 0.336 25613 1896 1 28 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.288 -1.516 25613 1897 1 28 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.472 0.124 25613 1898 1 28 . 1 1 3 3 VAL H H 3 8.164 8.164 8.017 0.147 25613 1899 1 28 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.963 0.328 25613 1900 1 28 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.553 -2.477 25613 1901 1 28 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.385 -1.602 25613 1902 1 28 . 1 1 4 4 GLU H H 4 8.161 8.161 7.878 0.283 25613 1903 1 28 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.089 0.036 25613 1904 1 28 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.100 -0.517 25613 1905 1 28 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.803 0.215 25613 1906 1 28 . 1 1 5 5 GLN H H 5 8.290 8.290 7.651 0.639 25613 1907 1 28 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.399 0.560 25613 1908 1 28 . 1 1 6 6 CYS H H 6 8.369 8.369 8.312 0.057 25613 1909 1 28 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.395 0.478 25613 1910 1 28 . 1 1 7 7 CYS CB C 7 38.817 38.817 27.022 11.795 25613 1911 1 28 . 1 1 7 7 CYS H H 7 8.308 8.308 7.759 0.549 25613 1912 1 28 . 1 1 8 8 THR HA H 8 4.110 4.110 4.281 -0.171 25613 1913 1 28 . 1 1 8 8 THR CA C 8 64.398 64.398 64.388 0.010 25613 1914 1 28 . 1 1 8 8 THR CB C 8 68.493 68.493 69.224 -0.731 25613 1915 1 28 . 1 1 8 8 THR H H 8 8.233 8.233 8.329 -0.096 25613 1916 1 28 . 1 1 9 9 SER HA H 9 4.816 4.816 4.712 0.104 25613 1917 1 28 . 1 1 9 9 SER CA C 9 55.989 55.989 56.757 -0.768 25613 1918 1 28 . 1 1 9 9 SER CB C 9 64.007 64.007 65.538 -1.531 25613 1919 1 28 . 1 1 9 9 SER H H 9 7.533 7.533 7.663 -0.130 25613 1920 1 28 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.114 0.264 25613 1921 1 28 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.759 -0.868 25613 1922 1 28 . 1 1 10 10 ILE CB C 10 38.925 38.925 38.743 0.182 25613 1923 1 28 . 1 1 10 10 ILE H H 10 7.876 7.876 8.199 -0.323 25613 1924 1 28 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.630 0.336 25613 1925 1 28 . 1 1 11 11 CYS H H 11 9.710 9.710 8.727 0.983 25613 1926 1 28 . 1 1 12 12 SER HA H 12 4.635 4.635 4.637 -0.002 25613 1927 1 28 . 1 1 12 12 SER CA C 12 56.435 56.435 56.779 -0.344 25613 1928 1 28 . 1 1 12 12 SER CB C 12 65.596 65.596 65.220 0.376 25613 1929 1 28 . 1 1 12 12 SER H H 12 8.799 8.799 8.099 0.700 25613 1930 1 28 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.751 0.137 25613 1931 1 28 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.132 0.097 25613 1932 1 28 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.976 0.171 25613 1933 1 28 . 1 1 13 13 LEU H H 13 8.652 8.652 8.400 0.252 25613 1934 1 28 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.206 -0.013 25613 1935 1 28 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.867 -0.887 25613 1936 1 28 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.561 1.060 25613 1937 1 28 . 1 1 14 14 TYR H H 14 7.517 7.517 7.023 0.494 25613 1938 1 28 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.924 0.091 25613 1939 1 28 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.722 -0.260 25613 1940 1 28 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.132 0.815 25613 1941 1 28 . 1 1 15 15 GLN H H 15 7.581 7.581 8.090 -0.509 25613 1942 1 28 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.581 0.624 25613 1943 1 28 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.453 0.582 25613 1944 1 28 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.684 0.183 25613 1945 1 28 . 1 1 16 16 LEU H H 16 8.084 8.084 7.812 0.272 25613 1946 1 28 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.000 0.227 25613 1947 1 28 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.190 -1.520 25613 1948 1 28 . 1 1 17 17 GLU CB C 17 28.976 28.976 28.990 -0.014 25613 1949 1 28 . 1 1 17 17 GLU H H 17 8.121 8.121 8.282 -0.161 25613 1950 1 28 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.521 -0.001 25613 1951 1 28 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.602 0.117 25613 1952 1 28 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.222 0.157 25613 1953 1 28 . 1 1 18 18 ASN H H 18 7.469 7.469 7.774 -0.305 25613 1954 1 28 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.544 -0.016 25613 1955 1 28 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.618 1.302 25613 1956 1 28 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.121 0.151 25613 1957 1 28 . 1 1 19 19 TYR H H 19 7.928 7.928 7.471 0.457 25613 1958 1 28 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.727 0.240 25613 1959 1 28 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.068 6.742 25613 1960 1 28 . 1 1 20 20 CYS H H 20 7.484 7.484 7.545 -0.061 25613 1961 1 29 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.821 0.245 25613 1962 1 29 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.716 -5.223 25613 1963 1 29 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.360 -7.092 25613 1964 1 29 . 1 1 2 2 ILE H H 2 8.541 8.541 8.287 0.254 25613 1965 1 29 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.575 0.156 25613 1966 1 29 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.786 -2.014 25613 1967 1 29 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.076 0.520 25613 1968 1 29 . 1 1 3 3 VAL H H 3 8.164 8.164 8.156 0.008 25613 1969 1 29 . 1 1 4 4 GLU HA H 4 4.291 4.291 4.002 0.289 25613 1970 1 29 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.101 -2.025 25613 1971 1 29 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.637 -0.854 25613 1972 1 29 . 1 1 4 4 GLU H H 4 8.161 8.161 8.225 -0.064 25613 1973 1 29 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.083 0.042 25613 1974 1 29 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.979 -0.396 25613 1975 1 29 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.776 0.242 25613 1976 1 29 . 1 1 5 5 GLN H H 5 8.290 8.290 7.646 0.644 25613 1977 1 29 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.341 0.618 25613 1978 1 29 . 1 1 6 6 CYS H H 6 8.369 8.369 8.313 0.056 25613 1979 1 29 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.276 0.597 25613 1980 1 29 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.833 11.984 25613 1981 1 29 . 1 1 7 7 CYS H H 7 8.308 8.308 8.014 0.294 25613 1982 1 29 . 1 1 8 8 THR HA H 8 4.110 4.110 4.293 -0.183 25613 1983 1 29 . 1 1 8 8 THR CA C 8 64.398 64.398 63.988 0.410 25613 1984 1 29 . 1 1 8 8 THR CB C 8 68.493 68.493 69.621 -1.128 25613 1985 1 29 . 1 1 8 8 THR H H 8 8.233 8.233 8.197 0.036 25613 1986 1 29 . 1 1 9 9 SER HA H 9 4.816 4.816 4.699 0.117 25613 1987 1 29 . 1 1 9 9 SER CA C 9 55.989 55.989 56.903 -0.914 25613 1988 1 29 . 1 1 9 9 SER CB C 9 64.007 64.007 64.849 -0.842 25613 1989 1 29 . 1 1 9 9 SER H H 9 7.533 7.533 7.983 -0.450 25613 1990 1 29 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.173 0.205 25613 1991 1 29 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.389 -0.498 25613 1992 1 29 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.103 1.822 25613 1993 1 29 . 1 1 10 10 ILE H H 10 7.876 7.876 8.286 -0.410 25613 1994 1 29 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.661 0.305 25613 1995 1 29 . 1 1 11 11 CYS H H 11 9.710 9.710 8.896 0.814 25613 1996 1 29 . 1 1 12 12 SER HA H 12 4.635 4.635 4.637 -0.002 25613 1997 1 29 . 1 1 12 12 SER CA C 12 56.435 56.435 57.045 -0.610 25613 1998 1 29 . 1 1 12 12 SER CB C 12 65.596 65.596 65.493 0.103 25613 1999 1 29 . 1 1 12 12 SER H H 12 8.799 8.799 8.289 0.510 25613 2000 1 29 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.742 0.146 25613 2001 1 29 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.025 0.204 25613 2002 1 29 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.988 0.159 25613 2003 1 29 . 1 1 13 13 LEU H H 13 8.652 8.652 8.382 0.270 25613 2004 1 29 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.187 0.006 25613 2005 1 29 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.256 -0.276 25613 2006 1 29 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.260 1.361 25613 2007 1 29 . 1 1 14 14 TYR H H 14 7.517 7.517 6.946 0.571 25613 2008 1 29 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.954 0.061 25613 2009 1 29 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.861 -0.399 25613 2010 1 29 . 1 1 15 15 GLN CB C 15 28.947 28.947 27.991 0.956 25613 2011 1 29 . 1 1 15 15 GLN H H 15 7.581 7.581 8.156 -0.575 25613 2012 1 29 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.478 0.727 25613 2013 1 29 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.634 0.401 25613 2014 1 29 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.665 0.202 25613 2015 1 29 . 1 1 16 16 LEU H H 16 8.084 8.084 8.221 -0.137 25613 2016 1 29 . 1 1 17 17 GLU HA H 17 4.227 4.227 3.925 0.302 25613 2017 1 29 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.322 -1.652 25613 2018 1 29 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.156 -0.180 25613 2019 1 29 . 1 1 17 17 GLU H H 17 8.121 8.121 8.489 -0.368 25613 2020 1 29 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.498 0.022 25613 2021 1 29 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.998 -0.279 25613 2022 1 29 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.174 0.205 25613 2023 1 29 . 1 1 18 18 ASN H H 18 7.469 7.469 7.791 -0.322 25613 2024 1 29 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.546 -0.018 25613 2025 1 29 . 1 1 19 19 TYR CA C 19 58.920 58.920 57.271 1.649 25613 2026 1 29 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.138 0.134 25613 2027 1 29 . 1 1 19 19 TYR H H 19 7.928 7.928 7.380 0.548 25613 2028 1 29 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.842 0.125 25613 2029 1 29 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.812 5.998 25613 2030 1 29 . 1 1 20 20 CYS H H 20 7.484 7.484 7.714 -0.230 25613 2031 1 30 . 1 1 2 2 ILE HA H 2 4.066 4.066 3.895 0.171 25613 2032 1 30 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.044 -4.551 25613 2033 1 30 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.516 -7.248 25613 2034 1 30 . 1 1 2 2 ILE H H 2 8.541 8.541 8.229 0.312 25613 2035 1 30 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.667 0.064 25613 2036 1 30 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.484 -1.712 25613 2037 1 30 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.261 0.335 25613 2038 1 30 . 1 1 3 3 VAL H H 3 8.164 8.164 7.946 0.218 25613 2039 1 30 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.911 0.380 25613 2040 1 30 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.298 -2.222 25613 2041 1 30 . 1 1 4 4 GLU CB C 4 27.783 27.783 28.593 -0.809 25613 2042 1 30 . 1 1 4 4 GLU H H 4 8.161 8.161 8.192 -0.031 25613 2043 1 30 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.121 0.004 25613 2044 1 30 . 1 1 5 5 GLN CA C 5 58.583 58.583 59.128 -0.545 25613 2045 1 30 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.599 0.418 25613 2046 1 30 . 1 1 5 5 GLN H H 5 8.290 8.290 7.646 0.644 25613 2047 1 30 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.663 0.296 25613 2048 1 30 . 1 1 6 6 CYS H H 6 8.369 8.369 8.145 0.224 25613 2049 1 30 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.332 0.541 25613 2050 1 30 . 1 1 7 7 CYS CB C 7 38.817 38.817 27.084 11.733 25613 2051 1 30 . 1 1 7 7 CYS H H 7 8.308 8.308 8.209 0.099 25613 2052 1 30 . 1 1 8 8 THR HA H 8 4.110 4.110 4.315 -0.205 25613 2053 1 30 . 1 1 8 8 THR CA C 8 64.398 64.398 63.778 0.620 25613 2054 1 30 . 1 1 8 8 THR CB C 8 68.493 68.493 69.308 -0.815 25613 2055 1 30 . 1 1 8 8 THR H H 8 8.233 8.233 8.237 -0.004 25613 2056 1 30 . 1 1 9 9 SER HA H 9 4.816 4.816 4.727 0.089 25613 2057 1 30 . 1 1 9 9 SER CA C 9 55.989 55.989 56.725 -0.736 25613 2058 1 30 . 1 1 9 9 SER CB C 9 64.007 64.007 65.829 -1.822 25613 2059 1 30 . 1 1 9 9 SER H H 9 7.533 7.533 8.019 -0.486 25613 2060 1 30 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.238 0.140 25613 2061 1 30 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.610 -0.719 25613 2062 1 30 . 1 1 10 10 ILE CB C 10 38.925 38.925 39.097 -0.173 25613 2063 1 30 . 1 1 10 10 ILE H H 10 7.876 7.876 8.242 -0.366 25613 2064 1 30 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.858 0.108 25613 2065 1 30 . 1 1 11 11 CYS H H 11 9.710 9.710 8.717 0.993 25613 2066 1 30 . 1 1 12 12 SER HA H 12 4.635 4.635 4.505 0.130 25613 2067 1 30 . 1 1 12 12 SER CA C 12 56.435 56.435 56.922 -0.487 25613 2068 1 30 . 1 1 12 12 SER CB C 12 65.596 65.596 64.035 1.561 25613 2069 1 30 . 1 1 12 12 SER H H 12 8.799 8.799 8.488 0.311 25613 2070 1 30 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.788 0.100 25613 2071 1 30 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.541 -0.312 25613 2072 1 30 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.920 0.227 25613 2073 1 30 . 1 1 13 13 LEU H H 13 8.652 8.652 8.293 0.359 25613 2074 1 30 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.447 -0.254 25613 2075 1 30 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.502 -0.522 25613 2076 1 30 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.543 1.078 25613 2077 1 30 . 1 1 14 14 TYR H H 14 7.517 7.517 7.014 0.503 25613 2078 1 30 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.897 0.118 25613 2079 1 30 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.645 -0.183 25613 2080 1 30 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.115 0.832 25613 2081 1 30 . 1 1 15 15 GLN H H 15 7.581 7.581 8.136 -0.555 25613 2082 1 30 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.629 0.576 25613 2083 1 30 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.389 0.646 25613 2084 1 30 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.729 0.138 25613 2085 1 30 . 1 1 16 16 LEU H H 16 8.084 8.084 7.860 0.224 25613 2086 1 30 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.064 0.163 25613 2087 1 30 . 1 1 17 17 GLU CA C 17 57.670 57.670 58.839 -1.169 25613 2088 1 30 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.312 -0.337 25613 2089 1 30 . 1 1 17 17 GLU H H 17 8.121 8.121 8.399 -0.278 25613 2090 1 30 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.527 -0.007 25613 2091 1 30 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.933 -0.214 25613 2092 1 30 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.227 0.152 25613 2093 1 30 . 1 1 18 18 ASN H H 18 7.469 7.469 7.889 -0.420 25613 2094 1 30 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.541 -0.013 25613 2095 1 30 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.852 2.068 25613 2096 1 30 . 1 1 19 19 TYR CB C 19 38.272 38.272 38.007 0.265 25613 2097 1 30 . 1 1 19 19 TYR H H 19 7.928 7.928 7.184 0.744 25613 2098 1 30 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.551 0.416 25613 2099 1 30 . 1 1 20 20 CYS CB C 20 35.810 35.810 27.768 8.042 25613 2100 1 30 . 1 1 20 20 CYS H H 20 7.484 7.484 7.628 -0.144 25613 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 25613 2 1 1 "Average Difference" HA 19 0.312 -0.189 0.254 25613 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25613 4 1 1 "Average Difference" CA 15 1.699 0.732 1.588 25613 5 1 1 "Average Difference" CB 17 3.723 -0.694 3.771 25613 6 1 1 "Average Difference" HN 19 0.381 -0.121 0.372 25613 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25613 8 1 2 "Average Difference" HA 19 0.296 -0.153 0.261 25613 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25613 10 1 2 "Average Difference" CA 15 1.662 0.623 1.595 25613 11 1 2 "Average Difference" CB 17 3.807 -0.784 3.840 25613 12 1 2 "Average Difference" HN 19 0.413 -0.092 0.414 25613 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25613 14 1 3 "Average Difference" HA 19 0.288 -0.177 0.233 25613 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25613 16 1 3 "Average Difference" CA 15 1.783 0.746 1.676 25613 17 1 3 "Average Difference" CB 17 3.679 -0.779 3.706 25613 18 1 3 "Average Difference" HN 19 0.393 -0.082 0.395 25613 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25613 20 1 4 "Average Difference" HA 19 0.347 -0.181 0.304 25613 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25613 22 1 4 "Average Difference" CA 15 1.496 0.529 1.449 25613 23 1 4 "Average Difference" CB 17 3.763 -0.825 3.784 25613 24 1 4 "Average Difference" HN 19 0.409 -0.099 0.407 25613 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25613 26 1 5 "Average Difference" HA 19 0.311 -0.229 0.216 25613 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25613 28 1 5 "Average Difference" CA 15 1.802 0.868 1.635 25613 29 1 5 "Average Difference" CB 17 3.784 -0.871 3.795 25613 30 1 5 "Average Difference" HN 19 0.418 -0.143 0.403 25613 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25613 32 1 6 "Average Difference" HA 19 0.355 -0.181 0.314 25613 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25613 34 1 6 "Average Difference" CA 15 1.699 0.700 1.602 25613 35 1 6 "Average Difference" CB 17 3.753 -0.759 3.788 25613 36 1 6 "Average Difference" HN 19 0.405 -0.114 0.399 25613 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25613 38 1 7 "Average Difference" HA 19 0.307 -0.198 0.242 25613 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25613 40 1 7 "Average Difference" CA 15 1.868 0.704 1.791 25613 41 1 7 "Average Difference" CB 17 3.966 -0.922 3.976 25613 42 1 7 "Average Difference" HN 19 0.429 -0.058 0.436 25613 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25613 44 1 8 "Average Difference" HA 19 0.346 -0.203 0.288 25613 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25613 46 1 8 "Average Difference" CA 15 1.660 0.677 1.569 25613 47 1 8 "Average Difference" CB 17 3.768 -0.742 3.808 25613 48 1 8 "Average Difference" HN 19 0.409 -0.113 0.404 25613 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25613 50 1 9 "Average Difference" HA 19 0.315 -0.211 0.241 25613 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25613 52 1 9 "Average Difference" CA 15 1.751 0.737 1.645 25613 53 1 9 "Average Difference" CB 17 3.813 -0.668 3.870 25613 54 1 9 "Average Difference" HN 19 0.426 -0.118 0.420 25613 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25613 56 1 10 "Average Difference" HA 19 0.310 -0.186 0.254 25613 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25613 58 1 10 "Average Difference" CA 15 1.753 0.617 1.698 25613 59 1 10 "Average Difference" CB 17 3.674 -0.762 3.704 25613 60 1 10 "Average Difference" HN 19 0.399 -0.131 0.388 25613 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25613 62 1 11 "Average Difference" HA 19 0.289 -0.144 0.257 25613 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25613 64 1 11 "Average Difference" CA 15 1.739 0.644 1.672 25613 65 1 11 "Average Difference" CB 17 3.657 -0.872 3.661 25613 66 1 11 "Average Difference" HN 19 0.411 -0.060 0.418 25613 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25613 68 1 12 "Average Difference" HA 19 0.327 -0.200 0.266 25613 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25613 70 1 12 "Average Difference" CA 15 1.489 0.600 1.411 25613 71 1 12 "Average Difference" CB 17 3.797 -0.866 3.811 25613 72 1 12 "Average Difference" HN 19 0.426 -0.100 0.425 25613 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25613 74 1 13 "Average Difference" HA 19 0.307 -0.192 0.247 25613 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25613 76 1 13 "Average Difference" CA 15 1.662 0.614 1.599 25613 77 1 13 "Average Difference" CB 17 3.989 -0.901 4.006 25613 78 1 13 "Average Difference" HN 19 0.420 -0.040 0.430 25613 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25613 80 1 14 "Average Difference" HA 19 0.292 -0.152 0.257 25613 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25613 82 1 14 "Average Difference" CA 15 1.843 0.799 1.718 25613 83 1 14 "Average Difference" CB 17 3.939 -0.838 3.967 25613 84 1 14 "Average Difference" HN 19 0.381 -0.007 0.391 25613 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25613 86 1 15 "Average Difference" HA 19 0.298 -0.191 0.236 25613 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25613 88 1 15 "Average Difference" CA 15 1.553 0.612 1.478 25613 89 1 15 "Average Difference" CB 17 3.680 -0.676 3.729 25613 90 1 15 "Average Difference" HN 19 0.395 -0.140 0.379 25613 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25613 92 1 16 "Average Difference" HA 19 0.255 -0.167 0.198 25613 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25613 94 1 16 "Average Difference" CA 15 1.751 0.731 1.647 25613 95 1 16 "Average Difference" CB 17 3.712 -0.680 3.761 25613 96 1 16 "Average Difference" HN 19 0.317 -0.058 0.320 25613 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25613 98 1 17 "Average Difference" HA 19 0.276 -0.198 0.198 25613 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25613 100 1 17 "Average Difference" CA 15 1.518 0.711 1.388 25613 101 1 17 "Average Difference" CB 17 3.945 -0.885 3.963 25613 102 1 17 "Average Difference" HN 19 0.424 -0.136 0.412 25613 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25613 104 1 18 "Average Difference" HA 19 0.243 -0.159 0.188 25613 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25613 106 1 18 "Average Difference" CA 15 1.782 0.771 1.663 25613 107 1 18 "Average Difference" CB 17 3.805 -0.768 3.841 25613 108 1 18 "Average Difference" HN 19 0.386 -0.191 0.345 25613 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25613 110 1 19 "Average Difference" HA 19 0.352 -0.212 0.289 25613 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25613 112 1 19 "Average Difference" CA 15 1.525 0.816 1.333 25613 113 1 19 "Average Difference" CB 17 3.900 -0.646 3.964 25613 114 1 19 "Average Difference" HN 19 0.436 -0.126 0.429 25613 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25613 116 1 20 "Average Difference" HA 19 0.309 -0.193 0.249 25613 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25613 118 1 20 "Average Difference" CA 15 1.810 0.797 1.682 25613 119 1 20 "Average Difference" CB 17 3.760 -0.844 3.777 25613 120 1 20 "Average Difference" HN 19 0.427 -0.107 0.425 25613 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 25613 122 1 21 "Average Difference" HA 19 0.267 -0.171 0.211 25613 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 25613 124 1 21 "Average Difference" CA 15 1.799 0.767 1.684 25613 125 1 21 "Average Difference" CB 17 3.896 -0.813 3.927 25613 126 1 21 "Average Difference" HN 19 0.387 -0.122 0.377 25613 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 25613 128 1 22 "Average Difference" HA 19 0.278 -0.154 0.238 25613 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 25613 130 1 22 "Average Difference" CA 15 1.690 0.780 1.553 25613 131 1 22 "Average Difference" CB 17 3.696 -0.751 3.730 25613 132 1 22 "Average Difference" HN 19 0.375 -0.069 0.378 25613 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 25613 134 1 23 "Average Difference" HA 19 0.274 -0.163 0.226 25613 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 25613 136 1 23 "Average Difference" CA 15 1.785 0.758 1.673 25613 137 1 23 "Average Difference" CB 17 3.977 -0.883 3.997 25613 138 1 23 "Average Difference" HN 19 0.414 -0.157 0.394 25613 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 25613 140 1 24 "Average Difference" HA 19 0.258 -0.175 0.194 25613 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 25613 142 1 24 "Average Difference" CA 15 1.794 0.762 1.680 25613 143 1 24 "Average Difference" CB 17 3.837 -0.693 3.890 25613 144 1 24 "Average Difference" HN 19 0.359 -0.115 0.350 25613 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 25613 146 1 25 "Average Difference" HA 19 0.279 -0.167 0.229 25613 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 25613 148 1 25 "Average Difference" CA 15 1.553 0.725 1.421 25613 149 1 25 "Average Difference" CB 17 3.824 -0.729 3.869 25613 150 1 25 "Average Difference" HN 19 0.421 -0.168 0.397 25613 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 25613 152 1 26 "Average Difference" HA 19 0.258 -0.155 0.211 25613 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 25613 154 1 26 "Average Difference" CA 15 1.939 0.737 1.856 25613 155 1 26 "Average Difference" CB 17 3.926 -0.779 3.966 25613 156 1 26 "Average Difference" HN 19 0.411 -0.061 0.418 25613 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 25613 158 1 27 "Average Difference" HA 19 0.236 -0.129 0.203 25613 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 25613 160 1 27 "Average Difference" CA 15 1.471 0.642 1.370 25613 161 1 27 "Average Difference" CB 17 3.949 -0.760 3.994 25613 162 1 27 "Average Difference" HN 19 0.390 -0.078 0.393 25613 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 25613 164 1 28 "Average Difference" HA 19 0.286 -0.199 0.212 25613 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 25613 166 1 28 "Average Difference" CA 15 1.604 0.791 1.444 25613 167 1 28 "Average Difference" CB 17 3.778 -0.646 3.837 25613 168 1 28 "Average Difference" HN 19 0.423 -0.180 0.394 25613 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 25613 170 1 29 "Average Difference" HA 19 0.304 -0.198 0.237 25613 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 25613 172 1 29 "Average Difference" CA 15 1.697 0.775 1.562 25613 173 1 29 "Average Difference" CB 17 3.751 -0.799 3.777 25613 174 1 29 "Average Difference" HN 19 0.411 -0.076 0.415 25613 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 25613 176 1 30 "Average Difference" HA 19 0.259 -0.148 0.218 25613 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 25613 178 1 30 "Average Difference" CA 15 1.572 0.669 1.472 25613 179 1 30 "Average Difference" CB 17 3.944 -0.799 3.981 25613 180 1 30 "Average Difference" HN 19 0.438 -0.123 0.432 25613 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 25613 _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 HA H 2 4.066 4.066 3.942 0.124 25613 2 1 . 1 1 2 2 ILE CA C 2 57.493 57.493 62.340 -4.847 25613 3 1 . 1 1 2 2 ILE CB C 2 31.268 31.268 38.247 -6.979 25613 4 1 . 1 1 2 2 ILE H H 2 8.541 8.541 8.297 0.244 25613 5 1 . 1 1 3 3 VAL HA H 3 3.731 3.731 3.563 0.168 25613 6 1 . 1 1 3 3 VAL CA C 3 64.772 64.772 66.534 -1.762 25613 7 1 . 1 1 3 3 VAL CB C 3 31.596 31.596 31.298 0.298 25613 8 1 . 1 1 3 3 VAL H H 3 8.164 8.164 8.046 0.118 25613 9 1 . 1 1 4 4 GLU HA H 4 4.291 4.291 3.973 0.318 25613 10 1 . 1 1 4 4 GLU CA C 4 57.076 57.076 59.556 -2.480 25613 11 1 . 1 1 4 4 GLU CB C 4 27.783 27.783 29.082 -1.299 25613 12 1 . 1 1 4 4 GLU H H 4 8.161 8.161 8.132 0.029 25613 13 1 . 1 1 5 5 GLN HA H 5 4.125 4.125 4.091 0.034 25613 14 1 . 1 1 5 5 GLN CA C 5 58.583 58.583 58.870 -0.287 25613 15 1 . 1 1 5 5 GLN CB C 5 29.018 29.018 28.670 0.348 25613 16 1 . 1 1 5 5 GLN H H 5 8.290 8.290 7.790 0.500 25613 17 1 . 1 1 6 6 CYS HA H 6 4.959 4.959 4.412 0.547 25613 18 1 . 1 1 6 6 CYS H H 6 8.369 8.369 8.172 0.197 25613 19 1 . 1 1 7 7 CYS HA H 7 4.873 4.873 4.330 0.543 25613 20 1 . 1 1 7 7 CYS CB C 7 38.817 38.817 26.795 12.022 25613 21 1 . 1 1 7 7 CYS H H 7 8.308 8.308 8.104 0.204 25613 22 1 . 1 1 8 8 THR HA H 8 4.110 4.110 4.288 -0.178 25613 23 1 . 1 1 8 8 THR CA C 8 64.398 64.398 63.949 0.449 25613 24 1 . 1 1 8 8 THR CB C 8 68.493 68.493 69.324 -0.831 25613 25 1 . 1 1 8 8 THR H H 8 8.233 8.233 8.197 0.036 25613 26 1 . 1 1 9 9 SER HA H 9 4.816 4.816 4.696 0.120 25613 27 1 . 1 1 9 9 SER CA C 9 55.989 55.989 56.861 -0.872 25613 28 1 . 1 1 9 9 SER CB C 9 64.007 64.007 65.232 -1.225 25613 29 1 . 1 1 9 9 SER H H 9 7.533 7.533 7.896 -0.363 25613 30 1 . 1 1 10 10 ILE HA H 10 4.378 4.378 4.173 0.205 25613 31 1 . 1 1 10 10 ILE CA C 10 59.891 59.891 60.634 -0.744 25613 32 1 . 1 1 10 10 ILE CB C 10 38.925 38.925 37.906 1.019 25613 33 1 . 1 1 10 10 ILE H H 10 7.876 7.876 8.309 -0.433 25613 34 1 . 1 1 11 11 CYS HA H 11 4.966 4.966 4.731 0.235 25613 35 1 . 1 1 11 11 CYS H H 11 9.710 9.710 8.760 0.950 25613 36 1 . 1 1 12 12 SER HA H 12 4.635 4.635 4.579 0.056 25613 37 1 . 1 1 12 12 SER CA C 12 56.435 56.435 57.258 -0.823 25613 38 1 . 1 1 12 12 SER CB C 12 65.596 65.596 64.647 0.949 25613 39 1 . 1 1 12 12 SER H H 12 8.799 8.799 8.565 0.234 25613 40 1 . 1 1 13 13 LEU HA H 13 3.888 3.888 3.809 0.079 25613 41 1 . 1 1 13 13 LEU CA C 13 58.229 58.229 58.180 0.049 25613 42 1 . 1 1 13 13 LEU CB C 13 41.147 41.147 40.947 0.200 25613 43 1 . 1 1 13 13 LEU H H 13 8.652 8.652 8.378 0.274 25613 44 1 . 1 1 14 14 TYR HA H 14 4.193 4.193 4.242 -0.049 25613 45 1 . 1 1 14 14 TYR CA C 14 59.980 59.980 60.437 -0.457 25613 46 1 . 1 1 14 14 TYR CB C 14 37.621 37.621 36.622 0.999 25613 47 1 . 1 1 14 14 TYR H H 14 7.517 7.517 7.106 0.411 25613 48 1 . 1 1 15 15 GLN HA H 15 4.015 4.015 3.900 0.115 25613 49 1 . 1 1 15 15 GLN CA C 15 58.462 58.462 58.572 -0.110 25613 50 1 . 1 1 15 15 GLN CB C 15 28.947 28.947 28.218 0.729 25613 51 1 . 1 1 15 15 GLN H H 15 7.581 7.581 7.785 -0.204 25613 52 1 . 1 1 16 16 LEU HA H 16 4.205 4.205 3.501 0.705 25613 53 1 . 1 1 16 16 LEU CA C 16 58.035 58.035 57.449 0.586 25613 54 1 . 1 1 16 16 LEU CB C 16 41.867 41.867 41.686 0.181 25613 55 1 . 1 1 16 16 LEU H H 16 8.084 8.084 7.993 0.091 25613 56 1 . 1 1 17 17 GLU HA H 17 4.227 4.227 4.007 0.220 25613 57 1 . 1 1 17 17 GLU CA C 17 57.670 57.670 59.091 -1.421 25613 58 1 . 1 1 17 17 GLU CB C 17 28.976 28.976 29.142 -0.166 25613 59 1 . 1 1 17 17 GLU H H 17 8.121 8.121 8.310 -0.189 25613 60 1 . 1 1 18 18 ASN HA H 18 4.520 4.520 4.541 -0.021 25613 61 1 . 1 1 18 18 ASN CA C 18 54.719 54.719 54.732 -0.013 25613 62 1 . 1 1 18 18 ASN CB C 18 38.379 38.379 38.313 0.066 25613 63 1 . 1 1 18 18 ASN H H 18 7.469 7.469 7.855 -0.386 25613 64 1 . 1 1 19 19 TYR HA H 19 4.528 4.528 4.556 -0.029 25613 65 1 . 1 1 19 19 TYR CA C 19 58.920 58.920 56.905 2.015 25613 66 1 . 1 1 19 19 TYR CB C 19 38.272 38.272 37.906 0.366 25613 67 1 . 1 1 19 19 TYR H H 19 7.928 7.928 7.407 0.521 25613 68 1 . 1 1 20 20 CYS HA H 20 4.967 4.967 4.756 0.211 25613 69 1 . 1 1 20 20 CYS CB C 20 35.810 35.810 29.207 6.603 25613 70 1 . 1 1 20 20 CYS H H 20 7.484 7.484 7.699 -0.215 25613 stop_ save_