data_18783 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18783 _Entry.PDB_ID 2LZX 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 18783 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.677 -0.153 18783 2 1 1 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.015 -4.954 18783 3 1 1 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.632 15.081 18783 4 1 1 . 1 1 3 3 CYS H H 3 7.424 7.424 7.373 0.051 18783 5 1 1 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.007 -0.762 18783 6 1 1 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.607 0.062 18783 7 1 1 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.133 -0.535 18783 8 1 1 . 1 1 4 4 ALA H H 4 8.691 8.691 8.055 0.636 18783 9 1 1 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.509 0.042 18783 10 1 1 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.274 -3.865 18783 11 1 1 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.463 -1.567 18783 12 1 1 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.305 -0.965 18783 13 1 1 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.749 -0.277 18783 14 1 1 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.973 -0.961 18783 15 1 1 . 1 1 6 6 GLU H H 6 8.221 8.221 8.590 -0.369 18783 16 1 1 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.938 0.493 18783 17 1 1 . 1 1 7 7 GLY H H 7 8.717 8.717 8.696 0.021 18783 18 1 1 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.604 -0.288 18783 19 1 1 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.745 -0.619 18783 20 1 1 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.399 0.452 18783 21 1 1 . 1 1 8 8 GLU H H 8 7.304 7.304 7.606 -0.302 18783 22 1 1 . 1 1 9 9 SER HA H 9 4.728 4.728 5.494 -0.766 18783 23 1 1 . 1 1 9 9 SER CA C 9 58.770 58.770 57.986 0.784 18783 24 1 1 . 1 1 9 9 SER CB C 9 64.148 64.148 63.424 0.724 18783 25 1 1 . 1 1 9 9 SER H H 9 8.066 8.066 8.418 -0.352 18783 26 1 1 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.822 0.226 18783 27 1 1 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.932 -3.108 18783 28 1 1 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.583 17.568 18783 29 1 1 . 1 1 10 10 CYS H H 10 8.073 8.073 9.165 -1.092 18783 30 1 1 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.187 -0.123 18783 31 1 1 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.312 0.499 18783 32 1 1 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.226 2.427 18783 33 1 1 . 1 1 11 11 ASN H H 11 8.092 8.092 8.628 -0.536 18783 34 1 1 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.236 -0.689 18783 35 1 1 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.102 3.259 18783 36 1 1 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.963 0.369 18783 37 1 1 . 1 1 12 12 VAL H H 12 8.440 8.440 8.134 0.306 18783 38 1 1 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.325 -0.134 18783 39 1 1 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.288 -1.190 18783 40 1 1 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.288 -1.708 18783 41 1 1 . 1 1 13 13 GLU H H 13 7.542 7.542 8.142 -0.600 18783 42 1 1 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 43 1 1 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.955 -0.058 18783 44 1 1 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.848 2.151 18783 45 1 1 . 1 1 14 14 PHE H H 14 7.461 7.461 6.829 0.632 18783 46 1 1 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 47 1 1 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.923 1.226 18783 48 1 1 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.939 0.100 18783 49 1 1 . 1 1 15 15 TYR H H 15 8.283 8.283 7.340 0.943 18783 50 1 1 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.696 -0.537 18783 51 1 1 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.290 -0.211 18783 52 1 1 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.879 -0.894 18783 53 1 1 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.241 0.292 18783 54 1 1 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.461 -3.672 18783 55 1 1 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.654 12.950 18783 56 1 1 . 1 1 17 17 CYS H H 17 8.030 8.030 8.255 -0.225 18783 57 1 1 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.494 0.140 18783 58 1 1 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.925 -5.899 18783 59 1 1 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.893 13.680 18783 60 1 1 . 1 1 18 18 CYS H H 18 8.804 8.804 8.298 0.506 18783 61 1 1 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 62 1 1 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.275 1.043 18783 63 1 1 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.285 -0.592 18783 64 1 1 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.977 0.950 18783 65 1 1 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 66 1 1 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.375 -0.086 18783 67 1 1 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.606 -2.570 18783 68 1 1 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.873 -1.111 18783 69 1 1 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 70 1 1 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.635 1.131 18783 71 1 1 . 1 1 22 22 GLY H H 22 7.843 7.843 7.744 0.099 18783 72 1 1 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.276 -0.172 18783 73 1 1 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.608 -1.379 18783 74 1 1 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.698 3.258 18783 75 1 1 . 1 1 23 23 LEU H H 23 6.269 6.269 7.429 -1.160 18783 76 1 1 . 1 1 24 24 THR HA H 24 4.337 4.337 4.440 -0.103 18783 77 1 1 . 1 1 24 24 THR CA C 24 59.771 59.771 60.707 -0.936 18783 78 1 1 . 1 1 24 24 THR CB C 24 70.307 70.307 70.966 -0.659 18783 79 1 1 . 1 1 24 24 THR H H 24 8.542 8.542 8.739 -0.197 18783 80 1 1 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.763 -0.340 18783 81 1 1 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.982 -4.063 18783 82 1 1 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.360 11.976 18783 83 1 1 . 1 1 25 25 CYS H H 25 7.102 7.102 8.897 -1.795 18783 84 1 1 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 85 1 1 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.484 -1.700 18783 86 1 1 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.358 0.436 18783 87 1 1 . 1 1 26 26 ILE H H 26 8.296 8.296 8.897 -0.601 18783 88 1 1 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 89 1 1 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.775 0.331 18783 90 1 1 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.387 1.579 18783 91 1 1 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.236 1.375 18783 92 1 1 . 1 1 28 28 GLY H H 28 7.219 7.219 7.751 -0.532 18783 93 1 1 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 94 1 1 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.192 -0.981 18783 95 1 1 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.543 0.002 18783 96 1 1 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 97 1 1 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.397 -0.180 18783 98 1 1 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.395 -1.349 18783 99 1 1 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.559 1.772 18783 100 1 1 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.937 0.693 18783 101 1 1 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.689 -1.129 18783 102 1 1 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.419 -2.840 18783 103 1 1 . 1 1 31 31 ASP H H 31 7.854 7.854 7.641 0.213 18783 104 1 1 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.477 2.625 18783 105 1 1 . 1 1 32 32 GLY H H 32 7.902 7.902 8.915 -1.013 18783 106 1 1 . 1 1 33 33 THR HA H 33 4.791 4.791 5.168 -0.377 18783 107 1 1 . 1 1 33 33 THR CA C 33 61.391 61.391 60.131 1.260 18783 108 1 1 . 1 1 33 33 THR CB C 33 71.350 71.350 69.747 1.603 18783 109 1 1 . 1 1 33 33 THR H H 33 8.388 8.388 8.316 0.072 18783 110 1 1 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.552 0.474 18783 111 1 1 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.725 -4.823 18783 112 1 1 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.176 15.734 18783 113 1 1 . 1 1 34 34 CYS H H 34 8.342 8.342 8.820 -0.478 18783 114 1 1 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.815 -0.188 18783 115 1 1 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.145 -0.071 18783 116 1 1 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.802 0.197 18783 117 1 1 . 1 1 35 35 TYR H H 35 8.976 8.976 9.161 -0.185 18783 118 1 1 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.681 -0.064 18783 119 1 1 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.157 -2.990 18783 120 1 1 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.856 0.208 18783 121 1 1 . 1 1 36 36 TYR H H 36 8.567 8.567 8.772 -0.205 18783 122 1 2 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.677 -0.153 18783 123 1 2 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.019 -4.958 18783 124 1 2 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.614 15.098 18783 125 1 2 . 1 1 3 3 CYS H H 3 7.424 7.424 7.375 0.049 18783 126 1 2 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.006 -0.761 18783 127 1 2 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.609 0.060 18783 128 1 2 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.116 -0.519 18783 129 1 2 . 1 1 4 4 ALA H H 4 8.691 8.691 8.057 0.634 18783 130 1 2 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.504 0.047 18783 131 1 2 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.295 -3.886 18783 132 1 2 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.420 -1.524 18783 133 1 2 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.296 -0.956 18783 134 1 2 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.763 -0.291 18783 135 1 2 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.973 -0.961 18783 136 1 2 . 1 1 6 6 GLU H H 6 8.221 8.221 8.588 -0.367 18783 137 1 2 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.898 0.533 18783 138 1 2 . 1 1 7 7 GLY H H 7 8.717 8.717 8.638 0.079 18783 139 1 2 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.560 -0.244 18783 140 1 2 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.045 -0.919 18783 141 1 2 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.817 1.034 18783 142 1 2 . 1 1 8 8 GLU H H 8 7.304 7.304 7.678 -0.374 18783 143 1 2 . 1 1 9 9 SER HA H 9 4.728 4.728 5.503 -0.775 18783 144 1 2 . 1 1 9 9 SER CA C 9 58.770 58.770 57.281 1.489 18783 145 1 2 . 1 1 9 9 SER CB C 9 64.148 64.148 63.113 1.035 18783 146 1 2 . 1 1 9 9 SER H H 9 8.066 8.066 8.424 -0.358 18783 147 1 2 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.828 0.220 18783 148 1 2 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.041 -3.217 18783 149 1 2 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.726 17.425 18783 150 1 2 . 1 1 10 10 CYS H H 10 8.073 8.073 9.185 -1.112 18783 151 1 2 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.186 -0.122 18783 152 1 2 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.313 0.498 18783 153 1 2 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.216 2.437 18783 154 1 2 . 1 1 11 11 ASN H H 11 8.092 8.092 8.629 -0.537 18783 155 1 2 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.235 -0.688 18783 156 1 2 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.114 3.247 18783 157 1 2 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.966 0.366 18783 158 1 2 . 1 1 12 12 VAL H H 12 8.440 8.440 8.133 0.307 18783 159 1 2 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.351 -0.160 18783 160 1 2 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.878 -1.780 18783 161 1 2 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.882 -1.302 18783 162 1 2 . 1 1 13 13 GLU H H 13 7.542 7.542 8.226 -0.684 18783 163 1 2 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.647 -0.161 18783 164 1 2 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.966 -0.069 18783 165 1 2 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.848 2.151 18783 166 1 2 . 1 1 14 14 PHE H H 14 7.461 7.461 6.829 0.632 18783 167 1 2 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 168 1 2 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.918 1.231 18783 169 1 2 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.963 0.076 18783 170 1 2 . 1 1 15 15 TYR H H 15 8.283 8.283 7.335 0.948 18783 171 1 2 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.695 -0.536 18783 172 1 2 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.292 -0.214 18783 173 1 2 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.878 -0.893 18783 174 1 2 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.242 0.291 18783 175 1 2 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.460 -3.672 18783 176 1 2 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.658 12.946 18783 177 1 2 . 1 1 17 17 CYS H H 17 8.030 8.030 8.254 -0.224 18783 178 1 2 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.495 0.139 18783 179 1 2 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.918 -5.892 18783 180 1 2 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.897 13.676 18783 181 1 2 . 1 1 18 18 CYS H H 18 8.804 8.804 8.299 0.505 18783 182 1 2 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 183 1 2 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.275 1.043 18783 184 1 2 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.285 -0.592 18783 185 1 2 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.976 0.951 18783 186 1 2 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 187 1 2 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.374 -0.085 18783 188 1 2 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.613 -2.577 18783 189 1 2 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.874 -1.112 18783 190 1 2 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 191 1 2 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.639 1.127 18783 192 1 2 . 1 1 22 22 GLY H H 22 7.843 7.843 7.745 0.098 18783 193 1 2 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.189 -0.085 18783 194 1 2 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.616 -1.386 18783 195 1 2 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.880 3.076 18783 196 1 2 . 1 1 23 23 LEU H H 23 6.269 6.269 7.419 -1.150 18783 197 1 2 . 1 1 24 24 THR HA H 24 4.337 4.337 4.464 -0.127 18783 198 1 2 . 1 1 24 24 THR CA C 24 59.771 59.771 60.364 -0.593 18783 199 1 2 . 1 1 24 24 THR CB C 24 70.307 70.307 71.031 -0.724 18783 200 1 2 . 1 1 24 24 THR H H 24 8.542 8.542 8.722 -0.180 18783 201 1 2 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.792 -0.369 18783 202 1 2 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.822 -3.903 18783 203 1 2 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.156 12.180 18783 204 1 2 . 1 1 25 25 CYS H H 25 7.102 7.102 8.960 -1.858 18783 205 1 2 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 206 1 2 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.486 -1.702 18783 207 1 2 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.356 0.438 18783 208 1 2 . 1 1 26 26 ILE H H 26 8.296 8.296 8.898 -0.602 18783 209 1 2 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.421 -0.126 18783 210 1 2 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.773 0.333 18783 211 1 2 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.389 1.577 18783 212 1 2 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.355 1.256 18783 213 1 2 . 1 1 28 28 GLY H H 28 7.219 7.219 7.760 -0.541 18783 214 1 2 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 215 1 2 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 216 1 2 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.378 0.167 18783 217 1 2 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 218 1 2 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.354 -0.137 18783 219 1 2 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.200 -1.154 18783 220 1 2 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.524 1.807 18783 221 1 2 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.938 0.692 18783 222 1 2 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.688 -1.128 18783 223 1 2 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.421 -2.842 18783 224 1 2 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 225 1 2 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.488 2.614 18783 226 1 2 . 1 1 32 32 GLY H H 32 7.902 7.902 8.902 -1.000 18783 227 1 2 . 1 1 33 33 THR HA H 33 4.791 4.791 5.121 -0.330 18783 228 1 2 . 1 1 33 33 THR CA C 33 61.391 61.391 60.016 1.375 18783 229 1 2 . 1 1 33 33 THR CB C 33 71.350 71.350 69.631 1.719 18783 230 1 2 . 1 1 33 33 THR H H 33 8.388 8.388 8.399 -0.011 18783 231 1 2 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.512 0.514 18783 232 1 2 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.589 -4.687 18783 233 1 2 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.078 15.832 18783 234 1 2 . 1 1 34 34 CYS H H 34 8.342 8.342 8.816 -0.474 18783 235 1 2 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.815 -0.188 18783 236 1 2 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.143 -0.070 18783 237 1 2 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.808 0.191 18783 238 1 2 . 1 1 35 35 TYR H H 35 8.976 8.976 9.164 -0.188 18783 239 1 2 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.684 -0.067 18783 240 1 2 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.142 -2.975 18783 241 1 2 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.860 0.204 18783 242 1 2 . 1 1 36 36 TYR H H 36 8.567 8.567 8.779 -0.212 18783 243 1 3 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.627 -0.103 18783 244 1 3 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.173 -5.112 18783 245 1 3 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.037 15.676 18783 246 1 3 . 1 1 3 3 CYS H H 3 7.424 7.424 7.387 0.037 18783 247 1 3 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.898 -0.653 18783 248 1 3 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.500 0.169 18783 249 1 3 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.843 -0.246 18783 250 1 3 . 1 1 4 4 ALA H H 4 8.691 8.691 7.814 0.877 18783 251 1 3 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.507 0.044 18783 252 1 3 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.282 -3.873 18783 253 1 3 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.447 -1.551 18783 254 1 3 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.300 -0.960 18783 255 1 3 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.763 -0.291 18783 256 1 3 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.974 -0.962 18783 257 1 3 . 1 1 6 6 GLU H H 6 8.221 8.221 8.588 -0.367 18783 258 1 3 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.944 0.487 18783 259 1 3 . 1 1 7 7 GLY H H 7 8.717 8.717 8.696 0.021 18783 260 1 3 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.602 -0.286 18783 261 1 3 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.741 -0.615 18783 262 1 3 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.417 0.434 18783 263 1 3 . 1 1 8 8 GLU H H 8 7.304 7.304 7.612 -0.308 18783 264 1 3 . 1 1 9 9 SER HA H 9 4.728 4.728 5.494 -0.766 18783 265 1 3 . 1 1 9 9 SER CA C 9 58.770 58.770 58.024 0.746 18783 266 1 3 . 1 1 9 9 SER CB C 9 64.148 64.148 63.452 0.696 18783 267 1 3 . 1 1 9 9 SER H H 9 8.066 8.066 8.419 -0.353 18783 268 1 3 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.822 0.226 18783 269 1 3 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.932 -3.108 18783 270 1 3 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.573 17.578 18783 271 1 3 . 1 1 10 10 CYS H H 10 8.073 8.073 9.166 -1.093 18783 272 1 3 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.186 -0.122 18783 273 1 3 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.313 0.498 18783 274 1 3 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.223 2.430 18783 275 1 3 . 1 1 11 11 ASN H H 11 8.092 8.092 8.632 -0.540 18783 276 1 3 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.235 -0.688 18783 277 1 3 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.108 3.253 18783 278 1 3 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.966 0.366 18783 279 1 3 . 1 1 12 12 VAL H H 12 8.440 8.440 8.134 0.306 18783 280 1 3 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.350 -0.159 18783 281 1 3 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.875 -1.777 18783 282 1 3 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.874 -1.294 18783 283 1 3 . 1 1 13 13 GLU H H 13 7.542 7.542 8.228 -0.686 18783 284 1 3 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 285 1 3 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.958 -0.061 18783 286 1 3 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.845 2.154 18783 287 1 3 . 1 1 14 14 PHE H H 14 7.461 7.461 6.830 0.631 18783 288 1 3 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 289 1 3 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.919 1.230 18783 290 1 3 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.949 0.090 18783 291 1 3 . 1 1 15 15 TYR H H 15 8.283 8.283 7.337 0.946 18783 292 1 3 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.698 -0.539 18783 293 1 3 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.290 -0.211 18783 294 1 3 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.883 -0.897 18783 295 1 3 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.243 0.290 18783 296 1 3 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.459 -3.671 18783 297 1 3 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.657 12.947 18783 298 1 3 . 1 1 17 17 CYS H H 17 8.030 8.030 8.256 -0.226 18783 299 1 3 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.495 0.139 18783 300 1 3 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.924 -5.898 18783 301 1 3 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.898 13.675 18783 302 1 3 . 1 1 18 18 CYS H H 18 8.804 8.804 8.302 0.502 18783 303 1 3 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.288 0.218 18783 304 1 3 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.273 1.045 18783 305 1 3 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.286 -0.593 18783 306 1 3 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.977 0.950 18783 307 1 3 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 308 1 3 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.375 -0.086 18783 309 1 3 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.612 -2.576 18783 310 1 3 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.874 -1.112 18783 311 1 3 . 1 1 21 21 LEU H H 21 6.553 6.553 7.669 -1.116 18783 312 1 3 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.639 1.127 18783 313 1 3 . 1 1 22 22 GLY H H 22 7.843 7.843 7.747 0.096 18783 314 1 3 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.188 -0.084 18783 315 1 3 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.620 -1.390 18783 316 1 3 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.877 3.079 18783 317 1 3 . 1 1 23 23 LEU H H 23 6.269 6.269 7.419 -1.150 18783 318 1 3 . 1 1 24 24 THR HA H 24 4.337 4.337 4.464 -0.127 18783 319 1 3 . 1 1 24 24 THR CA C 24 59.771 59.771 60.368 -0.597 18783 320 1 3 . 1 1 24 24 THR CB C 24 70.307 70.307 71.028 -0.721 18783 321 1 3 . 1 1 24 24 THR H H 24 8.542 8.542 8.722 -0.180 18783 322 1 3 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.790 -0.367 18783 323 1 3 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.825 -3.906 18783 324 1 3 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.151 12.185 18783 325 1 3 . 1 1 25 25 CYS H H 25 7.102 7.102 8.960 -1.858 18783 326 1 3 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 327 1 3 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.487 -1.703 18783 328 1 3 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.364 0.430 18783 329 1 3 . 1 1 26 26 ILE H H 26 8.296 8.296 8.897 -0.601 18783 330 1 3 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.421 -0.126 18783 331 1 3 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.774 0.332 18783 332 1 3 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.387 1.579 18783 333 1 3 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.359 1.251 18783 334 1 3 . 1 1 28 28 GLY H H 28 7.219 7.219 7.762 -0.543 18783 335 1 3 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 336 1 3 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.123 -0.912 18783 337 1 3 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.380 0.165 18783 338 1 3 . 1 1 29 29 ASN H H 29 7.452 7.452 8.083 -0.631 18783 339 1 3 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.353 -0.136 18783 340 1 3 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.200 -1.154 18783 341 1 3 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.524 1.807 18783 342 1 3 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.938 0.692 18783 343 1 3 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.687 -1.127 18783 344 1 3 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.422 -2.843 18783 345 1 3 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 346 1 3 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.269 2.833 18783 347 1 3 . 1 1 32 32 GLY H H 32 7.902 7.902 8.914 -1.012 18783 348 1 3 . 1 1 33 33 THR HA H 33 4.791 4.791 5.106 -0.315 18783 349 1 3 . 1 1 33 33 THR CA C 33 61.391 61.391 60.365 1.026 18783 350 1 3 . 1 1 33 33 THR CB C 33 71.350 71.350 69.972 1.378 18783 351 1 3 . 1 1 33 33 THR H H 33 8.388 8.388 8.412 -0.024 18783 352 1 3 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.556 0.470 18783 353 1 3 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.576 -4.674 18783 354 1 3 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.181 15.729 18783 355 1 3 . 1 1 34 34 CYS H H 34 8.342 8.342 8.832 -0.490 18783 356 1 3 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.815 -0.188 18783 357 1 3 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.142 -0.069 18783 358 1 3 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.818 0.181 18783 359 1 3 . 1 1 35 35 TYR H H 35 8.976 8.976 9.163 -0.187 18783 360 1 3 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.684 -0.067 18783 361 1 3 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.143 -2.976 18783 362 1 3 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.856 0.208 18783 363 1 3 . 1 1 36 36 TYR H H 36 8.567 8.567 8.787 -0.220 18783 364 1 4 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.678 -0.154 18783 365 1 4 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.020 -4.959 18783 366 1 4 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.671 15.042 18783 367 1 4 . 1 1 3 3 CYS H H 3 7.424 7.424 7.374 0.050 18783 368 1 4 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.020 -0.775 18783 369 1 4 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.625 0.044 18783 370 1 4 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.131 -0.533 18783 371 1 4 . 1 1 4 4 ALA H H 4 8.691 8.691 8.055 0.636 18783 372 1 4 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.498 0.053 18783 373 1 4 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.366 -3.957 18783 374 1 4 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.408 -1.512 18783 375 1 4 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.302 -0.962 18783 376 1 4 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.765 -0.293 18783 377 1 4 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.983 -0.971 18783 378 1 4 . 1 1 6 6 GLU H H 6 8.221 8.221 8.587 -0.366 18783 379 1 4 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.902 0.529 18783 380 1 4 . 1 1 7 7 GLY H H 7 8.717 8.717 8.632 0.085 18783 381 1 4 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.557 -0.241 18783 382 1 4 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.017 -0.891 18783 383 1 4 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.777 1.074 18783 384 1 4 . 1 1 8 8 GLU H H 8 7.304 7.304 7.671 -0.367 18783 385 1 4 . 1 1 9 9 SER HA H 9 4.728 4.728 5.496 -0.768 18783 386 1 4 . 1 1 9 9 SER CA C 9 58.770 58.770 57.513 1.257 18783 387 1 4 . 1 1 9 9 SER CB C 9 64.148 64.148 63.220 0.928 18783 388 1 4 . 1 1 9 9 SER H H 9 8.066 8.066 8.441 -0.375 18783 389 1 4 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.832 0.216 18783 390 1 4 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.076 -3.252 18783 391 1 4 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.694 17.457 18783 392 1 4 . 1 1 10 10 CYS H H 10 8.073 8.073 9.181 -1.108 18783 393 1 4 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.183 -0.119 18783 394 1 4 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.443 0.368 18783 395 1 4 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.540 2.113 18783 396 1 4 . 1 1 11 11 ASN H H 11 8.092 8.092 8.557 -0.465 18783 397 1 4 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.192 -0.645 18783 398 1 4 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.625 2.736 18783 399 1 4 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.487 -0.155 18783 400 1 4 . 1 1 12 12 VAL H H 12 8.440 8.440 8.133 0.307 18783 401 1 4 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.325 -0.134 18783 402 1 4 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.366 -1.268 18783 403 1 4 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.134 -1.554 18783 404 1 4 . 1 1 13 13 GLU H H 13 7.542 7.542 8.157 -0.615 18783 405 1 4 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.647 -0.161 18783 406 1 4 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.972 -0.075 18783 407 1 4 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.856 2.143 18783 408 1 4 . 1 1 14 14 PHE H H 14 7.461 7.461 6.827 0.634 18783 409 1 4 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 410 1 4 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.932 1.217 18783 411 1 4 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.932 0.107 18783 412 1 4 . 1 1 15 15 TYR H H 15 8.283 8.283 7.340 0.943 18783 413 1 4 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.693 -0.534 18783 414 1 4 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.289 -0.210 18783 415 1 4 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.875 -0.890 18783 416 1 4 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.241 0.292 18783 417 1 4 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.458 -3.670 18783 418 1 4 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.654 12.950 18783 419 1 4 . 1 1 17 17 CYS H H 17 8.030 8.030 8.251 -0.221 18783 420 1 4 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.490 0.144 18783 421 1 4 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.932 -5.906 18783 422 1 4 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.846 13.727 18783 423 1 4 . 1 1 18 18 CYS H H 18 8.804 8.804 8.262 0.542 18783 424 1 4 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.285 0.221 18783 425 1 4 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.275 1.043 18783 426 1 4 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.284 -0.591 18783 427 1 4 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 428 1 4 . 1 1 20 20 GLY H H 20 8.797 8.797 8.655 0.142 18783 429 1 4 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.376 -0.087 18783 430 1 4 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.602 -2.566 18783 431 1 4 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.876 -1.113 18783 432 1 4 . 1 1 21 21 LEU H H 21 6.553 6.553 7.661 -1.108 18783 433 1 4 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.640 1.126 18783 434 1 4 . 1 1 22 22 GLY H H 22 7.843 7.843 7.742 0.101 18783 435 1 4 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.238 -0.134 18783 436 1 4 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.580 -1.350 18783 437 1 4 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.676 3.280 18783 438 1 4 . 1 1 23 23 LEU H H 23 6.269 6.269 7.405 -1.136 18783 439 1 4 . 1 1 24 24 THR HA H 24 4.337 4.337 4.449 -0.112 18783 440 1 4 . 1 1 24 24 THR CA C 24 59.771 59.771 60.856 -1.085 18783 441 1 4 . 1 1 24 24 THR CB C 24 70.307 70.307 71.233 -0.926 18783 442 1 4 . 1 1 24 24 THR H H 24 8.542 8.542 8.732 -0.190 18783 443 1 4 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.844 -0.421 18783 444 1 4 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.947 -4.028 18783 445 1 4 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.334 12.002 18783 446 1 4 . 1 1 25 25 CYS H H 25 7.102 7.102 8.912 -1.810 18783 447 1 4 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.618 -0.201 18783 448 1 4 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.478 -1.694 18783 449 1 4 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.349 0.445 18783 450 1 4 . 1 1 26 26 ILE H H 26 8.296 8.296 8.902 -0.606 18783 451 1 4 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.421 -0.126 18783 452 1 4 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.766 0.340 18783 453 1 4 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 454 1 4 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.243 1.367 18783 455 1 4 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 456 1 4 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 457 1 4 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.190 -0.979 18783 458 1 4 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.539 0.006 18783 459 1 4 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 460 1 4 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.395 -0.178 18783 461 1 4 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.405 -1.359 18783 462 1 4 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.560 1.771 18783 463 1 4 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.936 0.694 18783 464 1 4 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.685 -1.125 18783 465 1 4 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.426 -2.847 18783 466 1 4 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 467 1 4 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.487 2.615 18783 468 1 4 . 1 1 32 32 GLY H H 32 7.902 7.902 8.918 -1.016 18783 469 1 4 . 1 1 33 33 THR HA H 33 4.791 4.791 5.154 -0.363 18783 470 1 4 . 1 1 33 33 THR CA C 33 61.391 61.391 60.155 1.236 18783 471 1 4 . 1 1 33 33 THR CB C 33 71.350 71.350 69.743 1.607 18783 472 1 4 . 1 1 33 33 THR H H 33 8.388 8.388 8.318 0.070 18783 473 1 4 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.554 0.472 18783 474 1 4 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.730 -4.828 18783 475 1 4 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.184 15.726 18783 476 1 4 . 1 1 34 34 CYS H H 34 8.342 8.342 8.823 -0.481 18783 477 1 4 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.816 -0.189 18783 478 1 4 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.134 -0.061 18783 479 1 4 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.813 0.186 18783 480 1 4 . 1 1 35 35 TYR H H 35 8.976 8.976 9.171 -0.195 18783 481 1 4 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.682 -0.065 18783 482 1 4 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.156 -2.989 18783 483 1 4 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.868 0.196 18783 484 1 4 . 1 1 36 36 TYR H H 36 8.567 8.567 8.867 -0.300 18783 485 1 5 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.678 -0.154 18783 486 1 5 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.013 -4.952 18783 487 1 5 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.628 15.085 18783 488 1 5 . 1 1 3 3 CYS H H 3 7.424 7.424 7.379 0.045 18783 489 1 5 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.003 -0.758 18783 490 1 5 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.612 0.057 18783 491 1 5 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.126 -0.528 18783 492 1 5 . 1 1 4 4 ALA H H 4 8.691 8.691 8.056 0.635 18783 493 1 5 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.504 0.047 18783 494 1 5 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.302 -3.893 18783 495 1 5 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.413 -1.518 18783 496 1 5 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.299 -0.959 18783 497 1 5 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.751 -0.279 18783 498 1 5 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.976 -0.964 18783 499 1 5 . 1 1 6 6 GLU H H 6 8.221 8.221 8.588 -0.367 18783 500 1 5 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.898 0.533 18783 501 1 5 . 1 1 7 7 GLY H H 7 8.717 8.717 8.638 0.079 18783 502 1 5 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.537 -0.221 18783 503 1 5 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.023 -0.896 18783 504 1 5 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.940 0.911 18783 505 1 5 . 1 1 8 8 GLU H H 8 7.304 7.304 7.616 -0.312 18783 506 1 5 . 1 1 9 9 SER HA H 9 4.728 4.728 5.416 -0.688 18783 507 1 5 . 1 1 9 9 SER CA C 9 58.770 58.770 57.505 1.265 18783 508 1 5 . 1 1 9 9 SER CB C 9 64.148 64.148 63.469 0.679 18783 509 1 5 . 1 1 9 9 SER H H 9 8.066 8.066 8.460 -0.394 18783 510 1 5 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.874 0.174 18783 511 1 5 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.906 -3.082 18783 512 1 5 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.533 17.618 18783 513 1 5 . 1 1 10 10 CYS H H 10 8.073 8.073 9.124 -1.051 18783 514 1 5 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.187 -0.123 18783 515 1 5 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.313 0.498 18783 516 1 5 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.223 2.430 18783 517 1 5 . 1 1 11 11 ASN H H 11 8.092 8.092 8.627 -0.535 18783 518 1 5 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.236 -0.689 18783 519 1 5 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.101 3.260 18783 520 1 5 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.963 0.369 18783 521 1 5 . 1 1 12 12 VAL H H 12 8.440 8.440 8.133 0.307 18783 522 1 5 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.327 -0.136 18783 523 1 5 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.286 -1.188 18783 524 1 5 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.294 -1.714 18783 525 1 5 . 1 1 13 13 GLU H H 13 7.542 7.542 8.143 -0.601 18783 526 1 5 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 527 1 5 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.967 -0.070 18783 528 1 5 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.849 2.150 18783 529 1 5 . 1 1 14 14 PHE H H 14 7.461 7.461 6.830 0.631 18783 530 1 5 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 531 1 5 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.920 1.229 18783 532 1 5 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.950 0.089 18783 533 1 5 . 1 1 15 15 TYR H H 15 8.283 8.283 7.337 0.946 18783 534 1 5 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.697 -0.538 18783 535 1 5 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.289 -0.210 18783 536 1 5 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.882 -0.897 18783 537 1 5 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.243 0.290 18783 538 1 5 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.462 -3.674 18783 539 1 5 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.658 12.946 18783 540 1 5 . 1 1 17 17 CYS H H 17 8.030 8.030 8.256 -0.226 18783 541 1 5 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.495 0.139 18783 542 1 5 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.921 -5.895 18783 543 1 5 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.900 13.673 18783 544 1 5 . 1 1 18 18 CYS H H 18 8.804 8.804 8.300 0.504 18783 545 1 5 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 546 1 5 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.272 1.046 18783 547 1 5 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.286 -0.593 18783 548 1 5 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 549 1 5 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 550 1 5 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.375 -0.087 18783 551 1 5 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.604 -2.568 18783 552 1 5 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.876 -1.114 18783 553 1 5 . 1 1 21 21 LEU H H 21 6.553 6.553 7.669 -1.116 18783 554 1 5 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.634 1.132 18783 555 1 5 . 1 1 22 22 GLY H H 22 7.843 7.843 7.743 0.100 18783 556 1 5 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.178 -0.074 18783 557 1 5 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.627 -1.397 18783 558 1 5 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.864 3.092 18783 559 1 5 . 1 1 23 23 LEU H H 23 6.269 6.269 7.417 -1.148 18783 560 1 5 . 1 1 24 24 THR HA H 24 4.337 4.337 4.464 -0.127 18783 561 1 5 . 1 1 24 24 THR CA C 24 59.771 59.771 60.365 -0.594 18783 562 1 5 . 1 1 24 24 THR CB C 24 70.307 70.307 71.025 -0.718 18783 563 1 5 . 1 1 24 24 THR H H 24 8.542 8.542 8.717 -0.175 18783 564 1 5 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.790 -0.367 18783 565 1 5 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.824 -3.905 18783 566 1 5 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.155 12.181 18783 567 1 5 . 1 1 25 25 CYS H H 25 7.102 7.102 8.960 -1.858 18783 568 1 5 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 569 1 5 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.486 -1.702 18783 570 1 5 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.362 0.432 18783 571 1 5 . 1 1 26 26 ILE H H 26 8.296 8.296 8.897 -0.601 18783 572 1 5 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 573 1 5 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.781 0.325 18783 574 1 5 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 575 1 5 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.235 1.375 18783 576 1 5 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 577 1 5 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 578 1 5 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.192 -0.981 18783 579 1 5 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.543 0.002 18783 580 1 5 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 581 1 5 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.415 -0.198 18783 582 1 5 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.302 -1.256 18783 583 1 5 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.555 1.776 18783 584 1 5 . 1 1 31 31 ASP HA H 31 5.630 5.630 5.009 0.621 18783 585 1 5 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.756 -1.196 18783 586 1 5 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.182 -2.603 18783 587 1 5 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 588 1 5 . 1 1 32 32 GLY CA C 32 47.102 47.102 43.987 3.115 18783 589 1 5 . 1 1 32 32 GLY H H 32 7.902 7.902 8.935 -1.033 18783 590 1 5 . 1 1 33 33 THR HA H 33 4.791 4.791 5.115 -0.324 18783 591 1 5 . 1 1 33 33 THR CA C 33 61.391 61.391 60.356 1.035 18783 592 1 5 . 1 1 33 33 THR CB C 33 71.350 71.350 69.974 1.376 18783 593 1 5 . 1 1 33 33 THR H H 33 8.388 8.388 8.412 -0.024 18783 594 1 5 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.555 0.471 18783 595 1 5 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.574 -4.672 18783 596 1 5 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.181 15.729 18783 597 1 5 . 1 1 34 34 CYS H H 34 8.342 8.342 8.822 -0.480 18783 598 1 5 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.814 -0.187 18783 599 1 5 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.146 -0.073 18783 600 1 5 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.794 0.206 18783 601 1 5 . 1 1 35 35 TYR H H 35 8.976 8.976 9.161 -0.185 18783 602 1 5 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.681 -0.064 18783 603 1 5 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.154 -2.987 18783 604 1 5 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.857 0.207 18783 605 1 5 . 1 1 36 36 TYR H H 36 8.567 8.567 8.771 -0.204 18783 606 1 6 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.626 -0.102 18783 607 1 6 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.169 -5.107 18783 608 1 6 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.041 15.672 18783 609 1 6 . 1 1 3 3 CYS H H 3 7.424 7.424 7.391 0.033 18783 610 1 6 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.895 -0.650 18783 611 1 6 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.504 0.165 18783 612 1 6 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.848 -0.250 18783 613 1 6 . 1 1 4 4 ALA H H 4 8.691 8.691 7.816 0.875 18783 614 1 6 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.504 0.047 18783 615 1 6 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.304 -3.895 18783 616 1 6 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.404 -1.508 18783 617 1 6 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.298 -0.958 18783 618 1 6 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.747 -0.275 18783 619 1 6 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.975 -0.963 18783 620 1 6 . 1 1 6 6 GLU H H 6 8.221 8.221 8.587 -0.366 18783 621 1 6 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.898 0.533 18783 622 1 6 . 1 1 7 7 GLY H H 7 8.717 8.717 8.638 0.079 18783 623 1 6 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.539 -0.223 18783 624 1 6 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.040 -0.914 18783 625 1 6 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.897 0.954 18783 626 1 6 . 1 1 8 8 GLU H H 8 7.304 7.304 7.609 -0.305 18783 627 1 6 . 1 1 9 9 SER HA H 9 4.728 4.728 5.414 -0.686 18783 628 1 6 . 1 1 9 9 SER CA C 9 58.770 58.770 57.499 1.271 18783 629 1 6 . 1 1 9 9 SER CB C 9 64.148 64.148 63.380 0.768 18783 630 1 6 . 1 1 9 9 SER H H 9 8.066 8.066 8.452 -0.386 18783 631 1 6 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.869 0.179 18783 632 1 6 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.910 -3.086 18783 633 1 6 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.551 17.600 18783 634 1 6 . 1 1 10 10 CYS H H 10 8.073 8.073 9.132 -1.059 18783 635 1 6 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.181 -0.117 18783 636 1 6 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.447 0.364 18783 637 1 6 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.519 2.134 18783 638 1 6 . 1 1 11 11 ASN H H 11 8.092 8.092 8.552 -0.460 18783 639 1 6 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.192 -0.645 18783 640 1 6 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.624 2.737 18783 641 1 6 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.486 -0.154 18783 642 1 6 . 1 1 12 12 VAL H H 12 8.440 8.440 8.126 0.314 18783 643 1 6 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.324 -0.133 18783 644 1 6 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.359 -1.261 18783 645 1 6 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.129 -1.549 18783 646 1 6 . 1 1 13 13 GLU H H 13 7.542 7.542 8.154 -0.612 18783 647 1 6 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.647 -0.161 18783 648 1 6 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.963 -0.066 18783 649 1 6 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.846 2.153 18783 650 1 6 . 1 1 14 14 PHE H H 14 7.461 7.461 6.830 0.631 18783 651 1 6 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 652 1 6 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.919 1.230 18783 653 1 6 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.956 0.083 18783 654 1 6 . 1 1 15 15 TYR H H 15 8.283 8.283 7.336 0.947 18783 655 1 6 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.695 -0.536 18783 656 1 6 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.295 -0.216 18783 657 1 6 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.879 -0.894 18783 658 1 6 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.244 0.289 18783 659 1 6 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.458 -3.670 18783 660 1 6 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.660 12.944 18783 661 1 6 . 1 1 17 17 CYS H H 17 8.030 8.030 8.256 -0.226 18783 662 1 6 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.496 0.138 18783 663 1 6 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.919 -5.893 18783 664 1 6 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.900 13.673 18783 665 1 6 . 1 1 18 18 CYS H H 18 8.804 8.804 8.302 0.502 18783 666 1 6 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 667 1 6 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.272 1.046 18783 668 1 6 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.285 -0.592 18783 669 1 6 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 670 1 6 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 671 1 6 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.375 -0.086 18783 672 1 6 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.606 -2.570 18783 673 1 6 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.873 -1.111 18783 674 1 6 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 675 1 6 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.634 1.132 18783 676 1 6 . 1 1 22 22 GLY H H 22 7.843 7.843 7.744 0.099 18783 677 1 6 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.273 -0.169 18783 678 1 6 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.610 -1.380 18783 679 1 6 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.699 3.257 18783 680 1 6 . 1 1 23 23 LEU H H 23 6.269 6.269 7.429 -1.160 18783 681 1 6 . 1 1 24 24 THR HA H 24 4.337 4.337 4.440 -0.103 18783 682 1 6 . 1 1 24 24 THR CA C 24 59.771 59.771 60.707 -0.936 18783 683 1 6 . 1 1 24 24 THR CB C 24 70.307 70.307 70.961 -0.654 18783 684 1 6 . 1 1 24 24 THR H H 24 8.542 8.542 8.741 -0.199 18783 685 1 6 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.764 -0.341 18783 686 1 6 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.981 -4.062 18783 687 1 6 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.366 11.970 18783 688 1 6 . 1 1 25 25 CYS H H 25 7.102 7.102 8.897 -1.795 18783 689 1 6 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 690 1 6 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.482 -1.698 18783 691 1 6 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.356 0.438 18783 692 1 6 . 1 1 26 26 ILE H H 26 8.296 8.296 8.897 -0.601 18783 693 1 6 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 694 1 6 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.778 0.328 18783 695 1 6 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.389 1.577 18783 696 1 6 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.234 1.376 18783 697 1 6 . 1 1 28 28 GLY H H 28 7.219 7.219 7.749 -0.530 18783 698 1 6 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 699 1 6 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.193 -0.982 18783 700 1 6 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.539 0.006 18783 701 1 6 . 1 1 29 29 ASN H H 29 7.452 7.452 8.142 -0.690 18783 702 1 6 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.397 -0.180 18783 703 1 6 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.394 -1.348 18783 704 1 6 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.559 1.772 18783 705 1 6 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.939 0.691 18783 706 1 6 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.692 -1.132 18783 707 1 6 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.420 -2.841 18783 708 1 6 . 1 1 31 31 ASP H H 31 7.854 7.854 7.641 0.213 18783 709 1 6 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.268 2.834 18783 710 1 6 . 1 1 32 32 GLY H H 32 7.902 7.902 8.912 -1.010 18783 711 1 6 . 1 1 33 33 THR HA H 33 4.791 4.791 5.118 -0.327 18783 712 1 6 . 1 1 33 33 THR CA C 33 61.391 61.391 60.354 1.037 18783 713 1 6 . 1 1 33 33 THR CB C 33 71.350 71.350 69.974 1.376 18783 714 1 6 . 1 1 33 33 THR H H 33 8.388 8.388 8.413 -0.025 18783 715 1 6 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.555 0.471 18783 716 1 6 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.572 -4.670 18783 717 1 6 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.184 15.726 18783 718 1 6 . 1 1 34 34 CYS H H 34 8.342 8.342 8.817 -0.475 18783 719 1 6 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.813 -0.186 18783 720 1 6 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.146 -0.073 18783 721 1 6 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.792 0.207 18783 722 1 6 . 1 1 35 35 TYR H H 35 8.976 8.976 9.164 -0.188 18783 723 1 6 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.679 -0.062 18783 724 1 6 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.168 -3.001 18783 725 1 6 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.857 0.207 18783 726 1 6 . 1 1 36 36 TYR H H 36 8.567 8.567 8.780 -0.213 18783 727 1 7 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.663 -0.139 18783 728 1 7 . 1 1 3 3 CYS CA C 3 53.061 53.061 57.810 -4.749 18783 729 1 7 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.494 15.220 18783 730 1 7 . 1 1 3 3 CYS H H 3 7.424 7.424 7.315 0.109 18783 731 1 7 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.052 -0.807 18783 732 1 7 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.641 0.028 18783 733 1 7 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.182 -0.584 18783 734 1 7 . 1 1 4 4 ALA H H 4 8.691 8.691 7.928 0.763 18783 735 1 7 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.504 0.047 18783 736 1 7 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.297 -3.889 18783 737 1 7 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.418 -1.522 18783 738 1 7 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.304 -0.964 18783 739 1 7 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.729 -0.257 18783 740 1 7 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.984 -0.972 18783 741 1 7 . 1 1 6 6 GLU H H 6 8.221 8.221 8.585 -0.364 18783 742 1 7 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.903 0.528 18783 743 1 7 . 1 1 7 7 GLY H H 7 8.717 8.717 8.639 0.078 18783 744 1 7 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.561 -0.245 18783 745 1 7 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.044 -0.918 18783 746 1 7 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.830 1.021 18783 747 1 7 . 1 1 8 8 GLU H H 8 7.304 7.304 7.666 -0.362 18783 748 1 7 . 1 1 9 9 SER HA H 9 4.728 4.728 5.504 -0.776 18783 749 1 7 . 1 1 9 9 SER CA C 9 58.770 58.770 57.260 1.510 18783 750 1 7 . 1 1 9 9 SER CB C 9 64.148 64.148 63.096 1.052 18783 751 1 7 . 1 1 9 9 SER H H 9 8.066 8.066 8.422 -0.356 18783 752 1 7 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.829 0.219 18783 753 1 7 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.035 -3.211 18783 754 1 7 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.720 17.431 18783 755 1 7 . 1 1 10 10 CYS H H 10 8.073 8.073 9.182 -1.109 18783 756 1 7 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.187 -0.123 18783 757 1 7 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.313 0.498 18783 758 1 7 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.218 2.435 18783 759 1 7 . 1 1 11 11 ASN H H 11 8.092 8.092 8.630 -0.538 18783 760 1 7 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.236 -0.689 18783 761 1 7 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.105 3.256 18783 762 1 7 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.963 0.369 18783 763 1 7 . 1 1 12 12 VAL H H 12 8.440 8.440 8.132 0.308 18783 764 1 7 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.328 -0.137 18783 765 1 7 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.281 -1.183 18783 766 1 7 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.298 -1.718 18783 767 1 7 . 1 1 13 13 GLU H H 13 7.542 7.542 8.142 -0.600 18783 768 1 7 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.645 -0.159 18783 769 1 7 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.965 -0.068 18783 770 1 7 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.838 2.161 18783 771 1 7 . 1 1 14 14 PHE H H 14 7.461 7.461 6.832 0.629 18783 772 1 7 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.985 -0.466 18783 773 1 7 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.911 1.238 18783 774 1 7 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.014 0.025 18783 775 1 7 . 1 1 15 15 TYR H H 15 8.283 8.283 7.324 0.959 18783 776 1 7 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.695 -0.536 18783 777 1 7 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.291 -0.212 18783 778 1 7 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.874 -0.889 18783 779 1 7 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.241 0.292 18783 780 1 7 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.469 -3.681 18783 781 1 7 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.654 12.950 18783 782 1 7 . 1 1 17 17 CYS H H 17 8.030 8.030 8.254 -0.224 18783 783 1 7 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.491 0.143 18783 784 1 7 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.919 -5.893 18783 785 1 7 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.882 13.691 18783 786 1 7 . 1 1 18 18 CYS H H 18 8.804 8.804 8.295 0.509 18783 787 1 7 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 788 1 7 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.274 1.044 18783 789 1 7 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.283 -0.590 18783 790 1 7 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.973 0.954 18783 791 1 7 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 792 1 7 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.375 -0.086 18783 793 1 7 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.608 -2.572 18783 794 1 7 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.877 -1.115 18783 795 1 7 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 796 1 7 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.636 1.130 18783 797 1 7 . 1 1 22 22 GLY H H 22 7.843 7.843 7.744 0.099 18783 798 1 7 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.180 -0.076 18783 799 1 7 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.623 -1.393 18783 800 1 7 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.872 3.084 18783 801 1 7 . 1 1 23 23 LEU H H 23 6.269 6.269 7.417 -1.148 18783 802 1 7 . 1 1 24 24 THR HA H 24 4.337 4.337 4.464 -0.127 18783 803 1 7 . 1 1 24 24 THR CA C 24 59.771 59.771 60.365 -0.594 18783 804 1 7 . 1 1 24 24 THR CB C 24 70.307 70.307 71.028 -0.720 18783 805 1 7 . 1 1 24 24 THR H H 24 8.542 8.542 8.719 -0.177 18783 806 1 7 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.791 -0.368 18783 807 1 7 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.824 -3.905 18783 808 1 7 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.154 12.182 18783 809 1 7 . 1 1 25 25 CYS H H 25 7.102 7.102 8.960 -1.858 18783 810 1 7 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 811 1 7 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.487 -1.703 18783 812 1 7 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.360 0.434 18783 813 1 7 . 1 1 26 26 ILE H H 26 8.296 8.296 8.899 -0.603 18783 814 1 7 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 815 1 7 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.784 0.322 18783 816 1 7 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 817 1 7 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.234 1.376 18783 818 1 7 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 819 1 7 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 820 1 7 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.192 -0.981 18783 821 1 7 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.541 0.004 18783 822 1 7 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 823 1 7 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.397 -0.180 18783 824 1 7 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.398 -1.352 18783 825 1 7 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.559 1.772 18783 826 1 7 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.939 0.691 18783 827 1 7 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.689 -1.129 18783 828 1 7 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.421 -2.842 18783 829 1 7 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 830 1 7 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.477 2.625 18783 831 1 7 . 1 1 32 32 GLY H H 32 7.902 7.902 8.913 -1.011 18783 832 1 7 . 1 1 33 33 THR HA H 33 4.791 4.791 5.171 -0.380 18783 833 1 7 . 1 1 33 33 THR CA C 33 61.391 61.391 60.125 1.266 18783 834 1 7 . 1 1 33 33 THR CB C 33 71.350 71.350 69.753 1.597 18783 835 1 7 . 1 1 33 33 THR H H 33 8.388 8.388 8.318 0.070 18783 836 1 7 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.555 0.471 18783 837 1 7 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.723 -4.821 18783 838 1 7 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.184 15.726 18783 839 1 7 . 1 1 34 34 CYS H H 34 8.342 8.342 8.810 -0.468 18783 840 1 7 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.814 -0.187 18783 841 1 7 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.144 -0.071 18783 842 1 7 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.798 0.201 18783 843 1 7 . 1 1 35 35 TYR H H 35 8.976 8.976 9.166 -0.190 18783 844 1 7 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.680 -0.063 18783 845 1 7 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.162 -2.995 18783 846 1 7 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.861 0.203 18783 847 1 7 . 1 1 36 36 TYR H H 36 8.567 8.567 8.881 -0.314 18783 848 1 8 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.626 -0.102 18783 849 1 8 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.269 -5.208 18783 850 1 8 . 1 1 3 3 CYS CB C 3 43.713 43.713 27.968 15.745 18783 851 1 8 . 1 1 3 3 CYS H H 3 7.424 7.424 7.318 0.106 18783 852 1 8 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.899 -0.654 18783 853 1 8 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.511 0.158 18783 854 1 8 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.806 -0.208 18783 855 1 8 . 1 1 4 4 ALA H H 4 8.691 8.691 7.815 0.876 18783 856 1 8 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.513 0.039 18783 857 1 8 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.242 -3.833 18783 858 1 8 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.522 -1.625 18783 859 1 8 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.301 -0.961 18783 860 1 8 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.772 -0.299 18783 861 1 8 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.969 -0.957 18783 862 1 8 . 1 1 6 6 GLU H H 6 8.221 8.221 8.593 -0.372 18783 863 1 8 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.898 0.533 18783 864 1 8 . 1 1 7 7 GLY H H 7 8.717 8.717 8.640 0.077 18783 865 1 8 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.560 -0.244 18783 866 1 8 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.953 -0.827 18783 867 1 8 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.821 1.030 18783 868 1 8 . 1 1 8 8 GLU H H 8 7.304 7.304 7.689 -0.385 18783 869 1 8 . 1 1 9 9 SER HA H 9 4.728 4.728 5.497 -0.769 18783 870 1 8 . 1 1 9 9 SER CA C 9 58.770 58.770 57.712 1.058 18783 871 1 8 . 1 1 9 9 SER CB C 9 64.148 64.148 63.352 0.796 18783 872 1 8 . 1 1 9 9 SER H H 9 8.066 8.066 8.452 -0.386 18783 873 1 8 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.836 0.212 18783 874 1 8 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.111 -3.287 18783 875 1 8 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.661 17.490 18783 876 1 8 . 1 1 10 10 CYS H H 10 8.073 8.073 9.191 -1.118 18783 877 1 8 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.170 -0.106 18783 878 1 8 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.498 0.313 18783 879 1 8 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.304 2.349 18783 880 1 8 . 1 1 11 11 ASN H H 11 8.092 8.092 8.576 -0.484 18783 881 1 8 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.235 -0.688 18783 882 1 8 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.930 2.431 18783 883 1 8 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.478 -0.146 18783 884 1 8 . 1 1 12 12 VAL H H 12 8.440 8.440 8.132 0.308 18783 885 1 8 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.344 -0.153 18783 886 1 8 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.872 -1.774 18783 887 1 8 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.800 -1.220 18783 888 1 8 . 1 1 13 13 GLU H H 13 7.542 7.542 8.247 -0.705 18783 889 1 8 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.643 -0.157 18783 890 1 8 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.979 -0.082 18783 891 1 8 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.803 2.196 18783 892 1 8 . 1 1 14 14 PHE H H 14 7.461 7.461 6.839 0.622 18783 893 1 8 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.984 -0.465 18783 894 1 8 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.882 1.267 18783 895 1 8 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.047 -0.008 18783 896 1 8 . 1 1 15 15 TYR H H 15 8.283 8.283 7.311 0.972 18783 897 1 8 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.701 -0.542 18783 898 1 8 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.293 -0.214 18783 899 1 8 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.886 -0.901 18783 900 1 8 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.246 0.287 18783 901 1 8 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.454 -3.666 18783 902 1 8 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.666 12.938 18783 903 1 8 . 1 1 17 17 CYS H H 17 8.030 8.030 8.260 -0.230 18783 904 1 8 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.496 0.138 18783 905 1 8 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.902 -5.876 18783 906 1 8 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.925 13.648 18783 907 1 8 . 1 1 18 18 CYS H H 18 8.804 8.804 8.312 0.492 18783 908 1 8 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.289 0.217 18783 909 1 8 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.272 1.046 18783 910 1 8 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.288 -0.594 18783 911 1 8 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.977 0.950 18783 912 1 8 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 913 1 8 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.374 -0.085 18783 914 1 8 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.614 -2.578 18783 915 1 8 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.870 -1.108 18783 916 1 8 . 1 1 21 21 LEU H H 21 6.553 6.553 7.671 -1.118 18783 917 1 8 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.639 1.127 18783 918 1 8 . 1 1 22 22 GLY H H 22 7.843 7.843 7.748 0.095 18783 919 1 8 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.184 -0.080 18783 920 1 8 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.620 -1.391 18783 921 1 8 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.880 3.076 18783 922 1 8 . 1 1 23 23 LEU H H 23 6.269 6.269 7.421 -1.152 18783 923 1 8 . 1 1 24 24 THR HA H 24 4.337 4.337 4.465 -0.128 18783 924 1 8 . 1 1 24 24 THR CA C 24 59.771 59.771 60.365 -0.594 18783 925 1 8 . 1 1 24 24 THR CB C 24 70.307 70.307 71.026 -0.719 18783 926 1 8 . 1 1 24 24 THR H H 24 8.542 8.542 8.724 -0.182 18783 927 1 8 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.787 -0.364 18783 928 1 8 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.829 -3.910 18783 929 1 8 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.147 12.189 18783 930 1 8 . 1 1 25 25 CYS H H 25 7.102 7.102 8.962 -1.860 18783 931 1 8 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 932 1 8 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.488 -1.704 18783 933 1 8 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.361 0.433 18783 934 1 8 . 1 1 26 26 ILE H H 26 8.296 8.296 8.899 -0.603 18783 935 1 8 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 936 1 8 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.781 0.325 18783 937 1 8 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 938 1 8 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.358 1.252 18783 939 1 8 . 1 1 28 28 GLY H H 28 7.219 7.219 7.760 -0.541 18783 940 1 8 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 941 1 8 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.125 -0.914 18783 942 1 8 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.377 0.168 18783 943 1 8 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 944 1 8 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.354 -0.137 18783 945 1 8 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.195 -1.149 18783 946 1 8 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.525 1.806 18783 947 1 8 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.938 0.692 18783 948 1 8 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.691 -1.131 18783 949 1 8 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.419 -2.840 18783 950 1 8 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 951 1 8 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.491 2.611 18783 952 1 8 . 1 1 32 32 GLY H H 32 7.902 7.902 8.905 -1.003 18783 953 1 8 . 1 1 33 33 THR HA H 33 4.791 4.791 5.127 -0.336 18783 954 1 8 . 1 1 33 33 THR CA C 33 61.391 61.391 60.011 1.380 18783 955 1 8 . 1 1 33 33 THR CB C 33 71.350 71.350 69.631 1.719 18783 956 1 8 . 1 1 33 33 THR H H 33 8.388 8.388 8.400 -0.012 18783 957 1 8 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.510 0.516 18783 958 1 8 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.588 -4.686 18783 959 1 8 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.071 15.839 18783 960 1 8 . 1 1 34 34 CYS H H 34 8.342 8.342 8.823 -0.481 18783 961 1 8 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.813 -0.186 18783 962 1 8 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.147 -0.074 18783 963 1 8 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.805 0.194 18783 964 1 8 . 1 1 35 35 TYR H H 35 8.976 8.976 9.166 -0.190 18783 965 1 8 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.683 -0.066 18783 966 1 8 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.148 -2.981 18783 967 1 8 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.862 0.202 18783 968 1 8 . 1 1 36 36 TYR H H 36 8.567 8.567 8.803 -0.236 18783 969 1 9 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.606 -0.082 18783 970 1 9 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.029 -4.968 18783 971 1 9 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.076 15.637 18783 972 1 9 . 1 1 3 3 CYS H H 3 7.424 7.424 7.340 0.084 18783 973 1 9 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.924 -0.679 18783 974 1 9 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.552 0.117 18783 975 1 9 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.933 -0.335 18783 976 1 9 . 1 1 4 4 ALA H H 4 8.691 8.691 7.745 0.946 18783 977 1 9 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.502 0.049 18783 978 1 9 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.307 -3.898 18783 979 1 9 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.404 -1.508 18783 980 1 9 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.298 -0.958 18783 981 1 9 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.742 -0.270 18783 982 1 9 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.983 -0.972 18783 983 1 9 . 1 1 6 6 GLU H H 6 8.221 8.221 8.585 -0.364 18783 984 1 9 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.903 0.528 18783 985 1 9 . 1 1 7 7 GLY H H 7 8.717 8.717 8.637 0.080 18783 986 1 9 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.560 -0.244 18783 987 1 9 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.063 -0.937 18783 988 1 9 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.868 0.983 18783 989 1 9 . 1 1 8 8 GLU H H 8 7.304 7.304 7.664 -0.360 18783 990 1 9 . 1 1 9 9 SER HA H 9 4.728 4.728 5.506 -0.778 18783 991 1 9 . 1 1 9 9 SER CA C 9 58.770 58.770 57.240 1.530 18783 992 1 9 . 1 1 9 9 SER CB C 9 64.148 64.148 63.081 1.067 18783 993 1 9 . 1 1 9 9 SER H H 9 8.066 8.066 8.415 -0.349 18783 994 1 9 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.827 0.221 18783 995 1 9 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.010 -3.186 18783 996 1 9 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.725 17.426 18783 997 1 9 . 1 1 10 10 CYS H H 10 8.073 8.073 9.180 -1.107 18783 998 1 9 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.182 -0.118 18783 999 1 9 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.449 0.362 18783 1000 1 9 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.512 2.141 18783 1001 1 9 . 1 1 11 11 ASN H H 11 8.092 8.092 8.557 -0.465 18783 1002 1 9 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.191 -0.644 18783 1003 1 9 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.630 2.731 18783 1004 1 9 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.489 -0.157 18783 1005 1 9 . 1 1 12 12 VAL H H 12 8.440 8.440 8.127 0.313 18783 1006 1 9 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.344 -0.153 18783 1007 1 9 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.941 -1.843 18783 1008 1 9 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.718 -1.137 18783 1009 1 9 . 1 1 13 13 GLU H H 13 7.542 7.542 8.253 -0.711 18783 1010 1 9 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.645 -0.159 18783 1011 1 9 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.965 -0.068 18783 1012 1 9 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.840 2.159 18783 1013 1 9 . 1 1 14 14 PHE H H 14 7.461 7.461 6.831 0.630 18783 1014 1 9 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.985 -0.466 18783 1015 1 9 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.910 1.239 18783 1016 1 9 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.011 0.028 18783 1017 1 9 . 1 1 15 15 TYR H H 15 8.283 8.283 7.324 0.959 18783 1018 1 9 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.696 -0.537 18783 1019 1 9 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.290 -0.211 18783 1020 1 9 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.877 -0.892 18783 1021 1 9 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.241 0.292 18783 1022 1 9 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.467 -3.679 18783 1023 1 9 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.655 12.949 18783 1024 1 9 . 1 1 17 17 CYS H H 17 8.030 8.030 8.253 -0.223 18783 1025 1 9 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.492 0.142 18783 1026 1 9 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.919 -5.893 18783 1027 1 9 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.886 13.688 18783 1028 1 9 . 1 1 18 18 CYS H H 18 8.804 8.804 8.295 0.509 18783 1029 1 9 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 1030 1 9 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.275 1.043 18783 1031 1 9 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.284 -0.591 18783 1032 1 9 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.973 0.954 18783 1033 1 9 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 1034 1 9 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.376 -0.087 18783 1035 1 9 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.605 -2.569 18783 1036 1 9 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.880 -1.117 18783 1037 1 9 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 1038 1 9 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.636 1.130 18783 1039 1 9 . 1 1 22 22 GLY H H 22 7.843 7.843 7.743 0.100 18783 1040 1 9 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.274 -0.170 18783 1041 1 9 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.613 -1.383 18783 1042 1 9 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.699 3.257 18783 1043 1 9 . 1 1 23 23 LEU H H 23 6.269 6.269 7.428 -1.159 18783 1044 1 9 . 1 1 24 24 THR HA H 24 4.337 4.337 4.440 -0.103 18783 1045 1 9 . 1 1 24 24 THR CA C 24 59.771 59.771 60.708 -0.937 18783 1046 1 9 . 1 1 24 24 THR CB C 24 70.307 70.307 70.967 -0.660 18783 1047 1 9 . 1 1 24 24 THR H H 24 8.542 8.542 8.738 -0.196 18783 1048 1 9 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.766 -0.343 18783 1049 1 9 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.974 -4.056 18783 1050 1 9 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.368 11.968 18783 1051 1 9 . 1 1 25 25 CYS H H 25 7.102 7.102 8.897 -1.795 18783 1052 1 9 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 1053 1 9 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.486 -1.702 18783 1054 1 9 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.358 0.436 18783 1055 1 9 . 1 1 26 26 ILE H H 26 8.296 8.296 8.895 -0.599 18783 1056 1 9 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.419 -0.124 18783 1057 1 9 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.790 0.316 18783 1058 1 9 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.386 1.580 18783 1059 1 9 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.353 1.257 18783 1060 1 9 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 1061 1 9 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 1062 1 9 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 1063 1 9 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.381 0.164 18783 1064 1 9 . 1 1 29 29 ASN H H 29 7.452 7.452 8.083 -0.631 18783 1065 1 9 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.354 -0.137 18783 1066 1 9 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.200 -1.153 18783 1067 1 9 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.524 1.807 18783 1068 1 9 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.938 0.692 18783 1069 1 9 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.689 -1.129 18783 1070 1 9 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.421 -2.842 18783 1071 1 9 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1072 1 9 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.478 2.624 18783 1073 1 9 . 1 1 32 32 GLY H H 32 7.902 7.902 8.913 -1.011 18783 1074 1 9 . 1 1 33 33 THR HA H 33 4.791 4.791 5.170 -0.379 18783 1075 1 9 . 1 1 33 33 THR CA C 33 61.391 61.391 60.128 1.263 18783 1076 1 9 . 1 1 33 33 THR CB C 33 71.350 71.350 69.750 1.600 18783 1077 1 9 . 1 1 33 33 THR H H 33 8.388 8.388 8.316 0.072 18783 1078 1 9 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.553 0.473 18783 1079 1 9 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.724 -4.822 18783 1080 1 9 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.181 15.729 18783 1081 1 9 . 1 1 34 34 CYS H H 34 8.342 8.342 8.806 -0.464 18783 1082 1 9 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.814 -0.187 18783 1083 1 9 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.144 -0.071 18783 1084 1 9 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.796 0.203 18783 1085 1 9 . 1 1 35 35 TYR H H 35 8.976 8.976 9.165 -0.189 18783 1086 1 9 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.678 -0.061 18783 1087 1 9 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.165 -2.998 18783 1088 1 9 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.858 0.206 18783 1089 1 9 . 1 1 36 36 TYR H H 36 8.567 8.567 8.877 -0.310 18783 1090 1 10 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.628 -0.104 18783 1091 1 10 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.181 -5.120 18783 1092 1 10 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.048 15.665 18783 1093 1 10 . 1 1 3 3 CYS H H 3 7.424 7.424 7.368 0.056 18783 1094 1 10 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.905 -0.660 18783 1095 1 10 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.503 0.166 18783 1096 1 10 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.854 -0.256 18783 1097 1 10 . 1 1 4 4 ALA H H 4 8.691 8.691 7.810 0.881 18783 1098 1 10 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.508 0.043 18783 1099 1 10 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.300 -3.891 18783 1100 1 10 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.449 -1.553 18783 1101 1 10 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.317 -0.977 18783 1102 1 10 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.718 -0.246 18783 1103 1 10 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.984 -0.972 18783 1104 1 10 . 1 1 6 6 GLU H H 6 8.221 8.221 8.591 -0.370 18783 1105 1 10 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.901 0.530 18783 1106 1 10 . 1 1 7 7 GLY H H 7 8.717 8.717 8.637 0.080 18783 1107 1 10 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.543 -0.227 18783 1108 1 10 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.033 -0.907 18783 1109 1 10 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.328 0.523 18783 1110 1 10 . 1 1 8 8 GLU H H 8 7.304 7.304 7.616 -0.312 18783 1111 1 10 . 1 1 9 9 SER HA H 9 4.728 4.728 5.415 -0.687 18783 1112 1 10 . 1 1 9 9 SER CA C 9 58.770 58.770 57.479 1.291 18783 1113 1 10 . 1 1 9 9 SER CB C 9 64.148 64.148 63.671 0.477 18783 1114 1 10 . 1 1 9 9 SER H H 9 8.066 8.066 8.437 -0.371 18783 1115 1 10 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.881 0.167 18783 1116 1 10 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.733 -2.909 18783 1117 1 10 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.417 17.734 18783 1118 1 10 . 1 1 10 10 CYS H H 10 8.073 8.073 9.102 -1.029 18783 1119 1 10 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.185 -0.121 18783 1120 1 10 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.444 0.367 18783 1121 1 10 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.528 2.126 18783 1122 1 10 . 1 1 11 11 ASN H H 11 8.092 8.092 8.556 -0.464 18783 1123 1 10 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.192 -0.645 18783 1124 1 10 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.642 2.719 18783 1125 1 10 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.500 -0.168 18783 1126 1 10 . 1 1 12 12 VAL H H 12 8.440 8.440 8.130 0.310 18783 1127 1 10 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.344 -0.153 18783 1128 1 10 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.936 -1.838 18783 1129 1 10 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.708 -1.128 18783 1130 1 10 . 1 1 13 13 GLU H H 13 7.542 7.542 8.258 -0.716 18783 1131 1 10 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 1132 1 10 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.953 -0.056 18783 1133 1 10 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.843 2.156 18783 1134 1 10 . 1 1 14 14 PHE H H 14 7.461 7.461 6.831 0.630 18783 1135 1 10 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 1136 1 10 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.924 1.225 18783 1137 1 10 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.946 0.093 18783 1138 1 10 . 1 1 15 15 TYR H H 15 8.283 8.283 7.337 0.946 18783 1139 1 10 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.702 -0.543 18783 1140 1 10 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.288 -0.210 18783 1141 1 10 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.883 -0.898 18783 1142 1 10 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.242 0.291 18783 1143 1 10 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.477 -3.689 18783 1144 1 10 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.649 12.955 18783 1145 1 10 . 1 1 17 17 CYS H H 17 8.030 8.030 8.260 -0.230 18783 1146 1 10 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.494 0.140 18783 1147 1 10 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.937 -5.911 18783 1148 1 10 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.893 13.680 18783 1149 1 10 . 1 1 18 18 CYS H H 18 8.804 8.804 8.280 0.524 18783 1150 1 10 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.286 0.220 18783 1151 1 10 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.250 1.068 18783 1152 1 10 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.288 -0.595 18783 1153 1 10 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.992 0.935 18783 1154 1 10 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 1155 1 10 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.380 -0.091 18783 1156 1 10 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.576 -2.540 18783 1157 1 10 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.882 -1.119 18783 1158 1 10 . 1 1 21 21 LEU H H 21 6.553 6.553 7.662 -1.109 18783 1159 1 10 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.627 1.139 18783 1160 1 10 . 1 1 22 22 GLY H H 22 7.843 7.843 7.737 0.106 18783 1161 1 10 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.163 -0.059 18783 1162 1 10 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.631 -1.401 18783 1163 1 10 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.860 3.096 18783 1164 1 10 . 1 1 23 23 LEU H H 23 6.269 6.269 7.414 -1.145 18783 1165 1 10 . 1 1 24 24 THR HA H 24 4.337 4.337 4.463 -0.126 18783 1166 1 10 . 1 1 24 24 THR CA C 24 59.771 59.771 60.366 -0.595 18783 1167 1 10 . 1 1 24 24 THR CB C 24 70.307 70.307 71.017 -0.710 18783 1168 1 10 . 1 1 24 24 THR H H 24 8.542 8.542 8.717 -0.175 18783 1169 1 10 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.785 -0.362 18783 1170 1 10 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.836 -3.917 18783 1171 1 10 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.146 12.190 18783 1172 1 10 . 1 1 25 25 CYS H H 25 7.102 7.102 8.961 -1.859 18783 1173 1 10 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 1174 1 10 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.486 -1.702 18783 1175 1 10 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.356 0.438 18783 1176 1 10 . 1 1 26 26 ILE H H 26 8.296 8.296 8.893 -0.597 18783 1177 1 10 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.421 -0.126 18783 1178 1 10 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.776 0.330 18783 1179 1 10 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 1180 1 10 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.359 1.251 18783 1181 1 10 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 1182 1 10 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 1183 1 10 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 1184 1 10 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.380 0.165 18783 1185 1 10 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 1186 1 10 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.354 -0.137 18783 1187 1 10 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.199 -1.153 18783 1188 1 10 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.526 1.805 18783 1189 1 10 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.938 0.692 18783 1190 1 10 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.690 -1.130 18783 1191 1 10 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.422 -2.844 18783 1192 1 10 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1193 1 10 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.483 2.619 18783 1194 1 10 . 1 1 32 32 GLY H H 32 7.902 7.902 8.916 -1.014 18783 1195 1 10 . 1 1 33 33 THR HA H 33 4.791 4.791 5.164 -0.373 18783 1196 1 10 . 1 1 33 33 THR CA C 33 61.391 61.391 60.140 1.251 18783 1197 1 10 . 1 1 33 33 THR CB C 33 71.350 71.350 69.736 1.614 18783 1198 1 10 . 1 1 33 33 THR H H 33 8.388 8.388 8.320 0.068 18783 1199 1 10 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.549 0.477 18783 1200 1 10 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.724 -4.822 18783 1201 1 10 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.174 15.736 18783 1202 1 10 . 1 1 34 34 CYS H H 34 8.342 8.342 8.829 -0.487 18783 1203 1 10 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.814 -0.187 18783 1204 1 10 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.140 -0.067 18783 1205 1 10 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.785 0.214 18783 1206 1 10 . 1 1 35 35 TYR H H 35 8.976 8.976 9.168 -0.192 18783 1207 1 10 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.677 -0.060 18783 1208 1 10 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.178 -3.011 18783 1209 1 10 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.860 0.204 18783 1210 1 10 . 1 1 36 36 TYR H H 36 8.567 8.567 8.877 -0.310 18783 1211 1 11 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.731 -0.207 18783 1212 1 11 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.312 -5.251 18783 1213 1 11 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.169 15.544 18783 1214 1 11 . 1 1 3 3 CYS H H 3 7.424 7.424 7.437 -0.013 18783 1215 1 11 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.953 -0.708 18783 1216 1 11 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.611 0.058 18783 1217 1 11 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.740 -0.142 18783 1218 1 11 . 1 1 4 4 ALA H H 4 8.691 8.691 7.904 0.787 18783 1219 1 11 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.518 0.033 18783 1220 1 11 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.042 -3.633 18783 1221 1 11 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.100 -2.204 18783 1222 1 11 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.224 -0.884 18783 1223 1 11 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.865 -0.393 18783 1224 1 11 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.791 -0.779 18783 1225 1 11 . 1 1 6 6 GLU H H 6 8.221 8.221 7.853 0.368 18783 1226 1 11 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.962 0.469 18783 1227 1 11 . 1 1 7 7 GLY H H 7 8.717 8.717 8.664 0.053 18783 1228 1 11 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.587 -0.271 18783 1229 1 11 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.744 -0.618 18783 1230 1 11 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.486 0.365 18783 1231 1 11 . 1 1 8 8 GLU H H 8 7.304 7.304 7.665 -0.361 18783 1232 1 11 . 1 1 9 9 SER HA H 9 4.728 4.728 5.484 -0.756 18783 1233 1 11 . 1 1 9 9 SER CA C 9 58.770 58.770 58.208 0.562 18783 1234 1 11 . 1 1 9 9 SER CB C 9 64.148 64.148 63.549 0.599 18783 1235 1 11 . 1 1 9 9 SER H H 9 8.066 8.066 8.430 -0.364 18783 1236 1 11 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.831 0.217 18783 1237 1 11 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.922 -3.099 18783 1238 1 11 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.458 17.693 18783 1239 1 11 . 1 1 10 10 CYS H H 10 8.073 8.073 9.154 -1.081 18783 1240 1 11 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.189 -0.125 18783 1241 1 11 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.318 0.493 18783 1242 1 11 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.218 2.435 18783 1243 1 11 . 1 1 11 11 ASN H H 11 8.092 8.092 8.636 -0.544 18783 1244 1 11 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.241 -0.694 18783 1245 1 11 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.118 3.243 18783 1246 1 11 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.971 0.361 18783 1247 1 11 . 1 1 12 12 VAL H H 12 8.440 8.440 8.134 0.306 18783 1248 1 11 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.355 -0.164 18783 1249 1 11 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.875 -1.777 18783 1250 1 11 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.879 -1.299 18783 1251 1 11 . 1 1 13 13 GLU H H 13 7.542 7.542 8.231 -0.689 18783 1252 1 11 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.653 -0.167 18783 1253 1 11 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.971 -0.074 18783 1254 1 11 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.847 2.152 18783 1255 1 11 . 1 1 14 14 PHE H H 14 7.461 7.461 6.838 0.623 18783 1256 1 11 . 1 1 15 15 TYR HA H 15 4.519 4.519 5.001 -0.482 18783 1257 1 11 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.924 1.225 18783 1258 1 11 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.988 0.051 18783 1259 1 11 . 1 1 15 15 TYR H H 15 8.283 8.283 7.340 0.943 18783 1260 1 11 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.712 -0.553 18783 1261 1 11 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.307 -0.228 18783 1262 1 11 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.898 -0.913 18783 1263 1 11 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.284 0.249 18783 1264 1 11 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.486 -3.698 18783 1265 1 11 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.678 12.926 18783 1266 1 11 . 1 1 17 17 CYS H H 17 8.030 8.030 8.272 -0.242 18783 1267 1 11 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.592 0.042 18783 1268 1 11 . 1 1 18 18 CYS CA C 18 52.026 52.026 58.000 -5.974 18783 1269 1 11 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.065 13.508 18783 1270 1 11 . 1 1 18 18 CYS H H 18 8.804 8.804 8.389 0.415 18783 1271 1 11 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.305 0.201 18783 1272 1 11 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.300 1.018 18783 1273 1 11 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.307 -0.614 18783 1274 1 11 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.983 0.944 18783 1275 1 11 . 1 1 20 20 GLY H H 20 8.797 8.797 8.665 0.132 18783 1276 1 11 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.359 -0.070 18783 1277 1 11 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.594 -2.558 18783 1278 1 11 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.845 -1.083 18783 1279 1 11 . 1 1 21 21 LEU H H 21 6.553 6.553 7.677 -1.124 18783 1280 1 11 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.616 1.150 18783 1281 1 11 . 1 1 22 22 GLY H H 22 7.843 7.843 7.728 0.115 18783 1282 1 11 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.143 -0.039 18783 1283 1 11 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.597 -1.367 18783 1284 1 11 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.830 3.126 18783 1285 1 11 . 1 1 23 23 LEU H H 23 6.269 6.269 7.396 -1.127 18783 1286 1 11 . 1 1 24 24 THR HA H 24 4.337 4.337 4.458 -0.121 18783 1287 1 11 . 1 1 24 24 THR CA C 24 59.771 59.771 60.354 -0.583 18783 1288 1 11 . 1 1 24 24 THR CB C 24 70.307 70.307 71.018 -0.711 18783 1289 1 11 . 1 1 24 24 THR H H 24 8.542 8.542 8.696 -0.154 18783 1290 1 11 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.783 -0.360 18783 1291 1 11 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.822 -3.903 18783 1292 1 11 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.155 12.181 18783 1293 1 11 . 1 1 25 25 CYS H H 25 7.102 7.102 8.958 -1.856 18783 1294 1 11 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.615 -0.198 18783 1295 1 11 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.481 -1.697 18783 1296 1 11 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.348 0.446 18783 1297 1 11 . 1 1 26 26 ILE H H 26 8.296 8.296 8.893 -0.597 18783 1298 1 11 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 1299 1 11 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.777 0.329 18783 1300 1 11 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.386 1.580 18783 1301 1 11 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.356 1.254 18783 1302 1 11 . 1 1 28 28 GLY H H 28 7.219 7.219 7.760 -0.541 18783 1303 1 11 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.991 -0.096 18783 1304 1 11 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.125 -0.914 18783 1305 1 11 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.379 0.166 18783 1306 1 11 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 1307 1 11 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.355 -0.138 18783 1308 1 11 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.197 -1.151 18783 1309 1 11 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.526 1.805 18783 1310 1 11 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.940 0.690 18783 1311 1 11 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.692 -1.132 18783 1312 1 11 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.420 -2.841 18783 1313 1 11 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1314 1 11 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.266 2.836 18783 1315 1 11 . 1 1 32 32 GLY H H 32 7.902 7.902 8.912 -1.010 18783 1316 1 11 . 1 1 33 33 THR HA H 33 4.791 4.791 5.112 -0.321 18783 1317 1 11 . 1 1 33 33 THR CA C 33 61.391 61.391 60.348 1.043 18783 1318 1 11 . 1 1 33 33 THR CB C 33 71.350 71.350 69.972 1.378 18783 1319 1 11 . 1 1 33 33 THR H H 33 8.388 8.388 8.410 -0.022 18783 1320 1 11 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.540 0.486 18783 1321 1 11 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.554 -4.652 18783 1322 1 11 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.165 15.745 18783 1323 1 11 . 1 1 34 34 CYS H H 34 8.342 8.342 8.810 -0.468 18783 1324 1 11 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.776 -0.149 18783 1325 1 11 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.110 -0.037 18783 1326 1 11 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.781 0.218 18783 1327 1 11 . 1 1 35 35 TYR H H 35 8.976 8.976 9.141 -0.165 18783 1328 1 11 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.627 -0.010 18783 1329 1 11 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.101 -2.934 18783 1330 1 11 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.802 0.262 18783 1331 1 11 . 1 1 36 36 TYR H H 36 8.567 8.567 8.823 -0.256 18783 1332 1 12 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.661 -0.137 18783 1333 1 12 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.178 -5.117 18783 1334 1 12 . 1 1 3 3 CYS CB C 3 43.713 43.713 27.835 15.878 18783 1335 1 12 . 1 1 3 3 CYS H H 3 7.424 7.424 7.353 0.071 18783 1336 1 12 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.786 -0.541 18783 1337 1 12 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.596 0.072 18783 1338 1 12 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.606 -0.008 18783 1339 1 12 . 1 1 4 4 ALA H H 4 8.691 8.691 7.742 0.949 18783 1340 1 12 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.494 0.057 18783 1341 1 12 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.663 -4.255 18783 1342 1 12 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.645 -1.749 18783 1343 1 12 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.278 -0.938 18783 1344 1 12 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.828 -0.356 18783 1345 1 12 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.961 -0.949 18783 1346 1 12 . 1 1 6 6 GLU H H 6 8.221 8.221 8.591 -0.370 18783 1347 1 12 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.894 0.537 18783 1348 1 12 . 1 1 7 7 GLY H H 7 8.717 8.717 8.635 0.082 18783 1349 1 12 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.549 -0.233 18783 1350 1 12 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.054 -0.929 18783 1351 1 12 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.882 0.969 18783 1352 1 12 . 1 1 8 8 GLU H H 8 7.304 7.304 7.624 -0.320 18783 1353 1 12 . 1 1 9 9 SER HA H 9 4.728 4.728 5.416 -0.688 18783 1354 1 12 . 1 1 9 9 SER CA C 9 58.770 58.770 57.307 1.463 18783 1355 1 12 . 1 1 9 9 SER CB C 9 64.148 64.148 63.114 1.034 18783 1356 1 12 . 1 1 9 9 SER H H 9 8.066 8.066 8.423 -0.357 18783 1357 1 12 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.855 0.193 18783 1358 1 12 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.880 -3.056 18783 1359 1 12 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.584 17.567 18783 1360 1 12 . 1 1 10 10 CYS H H 10 8.073 8.073 9.145 -1.072 18783 1361 1 12 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.179 -0.115 18783 1362 1 12 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.447 0.364 18783 1363 1 12 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.517 2.136 18783 1364 1 12 . 1 1 11 11 ASN H H 11 8.092 8.092 8.566 -0.474 18783 1365 1 12 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.194 -0.647 18783 1366 1 12 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.634 2.727 18783 1367 1 12 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.500 -0.168 18783 1368 1 12 . 1 1 12 12 VAL H H 12 8.440 8.440 8.122 0.318 18783 1369 1 12 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.324 -0.133 18783 1370 1 12 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.355 -1.257 18783 1371 1 12 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.125 -1.546 18783 1372 1 12 . 1 1 13 13 GLU H H 13 7.542 7.542 8.157 -0.615 18783 1373 1 12 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.642 -0.156 18783 1374 1 12 . 1 1 14 14 PHE CA C 14 57.897 57.897 58.004 -0.107 18783 1375 1 12 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.800 2.199 18783 1376 1 12 . 1 1 14 14 PHE H H 14 7.461 7.461 6.845 0.616 18783 1377 1 12 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.986 -0.467 18783 1378 1 12 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.863 1.286 18783 1379 1 12 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.051 -0.012 18783 1380 1 12 . 1 1 15 15 TYR H H 15 8.283 8.283 7.304 0.979 18783 1381 1 12 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.702 -0.543 18783 1382 1 12 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.300 -0.221 18783 1383 1 12 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.899 -0.914 18783 1384 1 12 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.254 0.279 18783 1385 1 12 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.425 -3.637 18783 1386 1 12 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.689 12.915 18783 1387 1 12 . 1 1 17 17 CYS H H 17 8.030 8.030 8.264 -0.234 18783 1388 1 12 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.508 0.126 18783 1389 1 12 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.880 -5.854 18783 1390 1 12 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.001 13.572 18783 1391 1 12 . 1 1 18 18 CYS H H 18 8.804 8.804 8.340 0.464 18783 1392 1 12 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.290 0.216 18783 1393 1 12 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.271 1.047 18783 1394 1 12 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.293 -0.600 18783 1395 1 12 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.984 0.943 18783 1396 1 12 . 1 1 20 20 GLY H H 20 8.797 8.797 8.655 0.142 18783 1397 1 12 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.370 -0.081 18783 1398 1 12 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.617 -2.581 18783 1399 1 12 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.858 -1.096 18783 1400 1 12 . 1 1 21 21 LEU H H 21 6.553 6.553 7.676 -1.123 18783 1401 1 12 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.634 1.132 18783 1402 1 12 . 1 1 22 22 GLY H H 22 7.843 7.843 7.745 0.098 18783 1403 1 12 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.236 -0.132 18783 1404 1 12 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.581 -1.351 18783 1405 1 12 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.694 3.262 18783 1406 1 12 . 1 1 23 23 LEU H H 23 6.269 6.269 7.410 -1.141 18783 1407 1 12 . 1 1 24 24 THR HA H 24 4.337 4.337 4.448 -0.111 18783 1408 1 12 . 1 1 24 24 THR CA C 24 59.771 59.771 60.873 -1.102 18783 1409 1 12 . 1 1 24 24 THR CB C 24 70.307 70.307 71.220 -0.913 18783 1410 1 12 . 1 1 24 24 THR H H 24 8.542 8.542 8.721 -0.179 18783 1411 1 12 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.839 -0.416 18783 1412 1 12 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.958 -4.039 18783 1413 1 12 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.320 12.016 18783 1414 1 12 . 1 1 25 25 CYS H H 25 7.102 7.102 8.914 -1.812 18783 1415 1 12 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.618 -0.201 18783 1416 1 12 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.474 -1.690 18783 1417 1 12 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.344 0.450 18783 1418 1 12 . 1 1 26 26 ILE H H 26 8.296 8.296 8.902 -0.606 18783 1419 1 12 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 1420 1 12 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.780 0.326 18783 1421 1 12 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 1422 1 12 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.239 1.371 18783 1423 1 12 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 1424 1 12 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 1425 1 12 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.190 -0.979 18783 1426 1 12 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.545 0.000 18783 1427 1 12 . 1 1 29 29 ASN H H 29 7.452 7.452 8.140 -0.688 18783 1428 1 12 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.396 -0.179 18783 1429 1 12 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.402 -1.356 18783 1430 1 12 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.557 1.774 18783 1431 1 12 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.939 0.691 18783 1432 1 12 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.689 -1.129 18783 1433 1 12 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.420 -2.841 18783 1434 1 12 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1435 1 12 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.277 2.825 18783 1436 1 12 . 1 1 32 32 GLY H H 32 7.902 7.902 8.911 -1.009 18783 1437 1 12 . 1 1 33 33 THR HA H 33 4.791 4.791 5.137 -0.346 18783 1438 1 12 . 1 1 33 33 THR CA C 33 61.391 61.391 60.333 1.058 18783 1439 1 12 . 1 1 33 33 THR CB C 33 71.350 71.350 69.980 1.370 18783 1440 1 12 . 1 1 33 33 THR H H 33 8.388 8.388 8.413 -0.025 18783 1441 1 12 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.553 0.473 18783 1442 1 12 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.573 -4.671 18783 1443 1 12 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.174 15.736 18783 1444 1 12 . 1 1 34 34 CYS H H 34 8.342 8.342 8.804 -0.462 18783 1445 1 12 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.812 -0.185 18783 1446 1 12 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.149 -0.076 18783 1447 1 12 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.800 0.200 18783 1448 1 12 . 1 1 35 35 TYR H H 35 8.976 8.976 9.170 -0.194 18783 1449 1 12 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.680 -0.063 18783 1450 1 12 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.158 -2.991 18783 1451 1 12 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.862 0.202 18783 1452 1 12 . 1 1 36 36 TYR H H 36 8.567 8.567 8.797 -0.230 18783 1453 1 13 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.790 -0.266 18783 1454 1 13 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.190 -5.129 18783 1455 1 13 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.675 15.037 18783 1456 1 13 . 1 1 3 3 CYS H H 3 7.424 7.424 7.404 0.020 18783 1457 1 13 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.025 -0.780 18783 1458 1 13 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.706 -0.037 18783 1459 1 13 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.885 -0.287 18783 1460 1 13 . 1 1 4 4 ALA H H 4 8.691 8.691 8.147 0.544 18783 1461 1 13 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.523 0.028 18783 1462 1 13 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.010 -3.601 18783 1463 1 13 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.135 -2.239 18783 1464 1 13 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.230 -0.890 18783 1465 1 13 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.852 -0.380 18783 1466 1 13 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.785 -0.773 18783 1467 1 13 . 1 1 6 6 GLU H H 6 8.221 8.221 7.838 0.383 18783 1468 1 13 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.911 0.520 18783 1469 1 13 . 1 1 7 7 GLY H H 7 8.717 8.717 8.618 0.099 18783 1470 1 13 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.551 -0.235 18783 1471 1 13 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.011 -0.885 18783 1472 1 13 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.321 0.530 18783 1473 1 13 . 1 1 8 8 GLU H H 8 7.304 7.304 7.718 -0.414 18783 1474 1 13 . 1 1 9 9 SER HA H 9 4.728 4.728 5.482 -0.754 18783 1475 1 13 . 1 1 9 9 SER CA C 9 58.770 58.770 58.242 0.528 18783 1476 1 13 . 1 1 9 9 SER CB C 9 64.148 64.148 63.622 0.526 18783 1477 1 13 . 1 1 9 9 SER H H 9 8.066 8.066 8.441 -0.374 18783 1478 1 13 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.835 0.213 18783 1479 1 13 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.921 -3.097 18783 1480 1 13 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.381 17.770 18783 1481 1 13 . 1 1 10 10 CYS H H 10 8.073 8.073 9.152 -1.079 18783 1482 1 13 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.191 -0.127 18783 1483 1 13 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.315 0.496 18783 1484 1 13 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.224 2.429 18783 1485 1 13 . 1 1 11 11 ASN H H 11 8.092 8.092 8.642 -0.550 18783 1486 1 13 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.243 -0.696 18783 1487 1 13 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.099 3.261 18783 1488 1 13 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.967 0.365 18783 1489 1 13 . 1 1 12 12 VAL H H 12 8.440 8.440 8.133 0.307 18783 1490 1 13 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.354 -0.163 18783 1491 1 13 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.873 -1.775 18783 1492 1 13 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.869 -1.290 18783 1493 1 13 . 1 1 13 13 GLU H H 13 7.542 7.542 8.234 -0.692 18783 1494 1 13 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.652 -0.166 18783 1495 1 13 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.968 -0.071 18783 1496 1 13 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.826 2.173 18783 1497 1 13 . 1 1 14 14 PHE H H 14 7.461 7.461 6.842 0.619 18783 1498 1 13 . 1 1 15 15 TYR HA H 15 4.519 4.519 5.001 -0.482 18783 1499 1 13 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.911 1.238 18783 1500 1 13 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.999 0.040 18783 1501 1 13 . 1 1 15 15 TYR H H 15 8.283 8.283 7.334 0.949 18783 1502 1 13 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.715 -0.556 18783 1503 1 13 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.311 -0.232 18783 1504 1 13 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.902 -0.917 18783 1505 1 13 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.286 0.247 18783 1506 1 13 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.488 -3.700 18783 1507 1 13 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.679 12.925 18783 1508 1 13 . 1 1 17 17 CYS H H 17 8.030 8.030 8.277 -0.247 18783 1509 1 13 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.594 0.040 18783 1510 1 13 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.994 -5.968 18783 1511 1 13 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.077 13.496 18783 1512 1 13 . 1 1 18 18 CYS H H 18 8.804 8.804 8.402 0.402 18783 1513 1 13 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.305 0.201 18783 1514 1 13 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.299 1.019 18783 1515 1 13 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.308 -0.615 18783 1516 1 13 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.985 0.942 18783 1517 1 13 . 1 1 20 20 GLY H H 20 8.797 8.797 8.665 0.132 18783 1518 1 13 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.361 -0.072 18783 1519 1 13 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.589 -2.553 18783 1520 1 13 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.849 -1.087 18783 1521 1 13 . 1 1 21 21 LEU H H 21 6.553 6.553 7.676 -1.123 18783 1522 1 13 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.614 1.152 18783 1523 1 13 . 1 1 22 22 GLY H H 22 7.843 7.843 7.730 0.113 18783 1524 1 13 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.193 -0.089 18783 1525 1 13 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.562 -1.332 18783 1526 1 13 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.640 3.316 18783 1527 1 13 . 1 1 23 23 LEU H H 23 6.269 6.269 7.392 -1.123 18783 1528 1 13 . 1 1 24 24 THR HA H 24 4.337 4.337 4.441 -0.104 18783 1529 1 13 . 1 1 24 24 THR CA C 24 59.771 59.771 60.860 -1.089 18783 1530 1 13 . 1 1 24 24 THR CB C 24 70.307 70.307 71.204 -0.896 18783 1531 1 13 . 1 1 24 24 THR H H 24 8.542 8.542 8.695 -0.154 18783 1532 1 13 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.829 -0.406 18783 1533 1 13 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.961 -4.042 18783 1534 1 13 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.311 12.025 18783 1535 1 13 . 1 1 25 25 CYS H H 25 7.102 7.102 8.912 -1.810 18783 1536 1 13 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.615 -0.198 18783 1537 1 13 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.476 -1.692 18783 1538 1 13 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.349 0.445 18783 1539 1 13 . 1 1 26 26 ILE H H 26 8.296 8.296 8.895 -0.599 18783 1540 1 13 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 1541 1 13 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.779 0.327 18783 1542 1 13 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.579 18783 1543 1 13 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.356 1.254 18783 1544 1 13 . 1 1 28 28 GLY H H 28 7.219 7.219 7.759 -0.540 18783 1545 1 13 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.991 -0.096 18783 1546 1 13 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 1547 1 13 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.377 0.168 18783 1548 1 13 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 1549 1 13 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.355 -0.138 18783 1550 1 13 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.199 -1.153 18783 1551 1 13 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.525 1.806 18783 1552 1 13 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.941 0.689 18783 1553 1 13 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.688 -1.129 18783 1554 1 13 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.423 -2.844 18783 1555 1 13 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 1556 1 13 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.484 2.618 18783 1557 1 13 . 1 1 32 32 GLY H H 32 7.902 7.902 8.915 -1.013 18783 1558 1 13 . 1 1 33 33 THR HA H 33 4.791 4.791 5.174 -0.383 18783 1559 1 13 . 1 1 33 33 THR CA C 33 61.391 61.391 60.119 1.272 18783 1560 1 13 . 1 1 33 33 THR CB C 33 71.350 71.350 69.741 1.609 18783 1561 1 13 . 1 1 33 33 THR H H 33 8.388 8.388 8.314 0.074 18783 1562 1 13 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.537 0.489 18783 1563 1 13 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.697 -4.795 18783 1564 1 13 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.154 15.755 18783 1565 1 13 . 1 1 34 34 CYS H H 34 8.342 8.342 8.803 -0.461 18783 1566 1 13 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.775 -0.148 18783 1567 1 13 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.111 -0.038 18783 1568 1 13 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.771 0.228 18783 1569 1 13 . 1 1 35 35 TYR H H 35 8.976 8.976 9.143 -0.167 18783 1570 1 13 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.625 -0.008 18783 1571 1 13 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.112 -2.945 18783 1572 1 13 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.800 0.264 18783 1573 1 13 . 1 1 36 36 TYR H H 36 8.567 8.567 8.830 -0.263 18783 1574 1 14 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.628 -0.104 18783 1575 1 14 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.140 -5.079 18783 1576 1 14 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.023 15.690 18783 1577 1 14 . 1 1 3 3 CYS H H 3 7.424 7.424 7.405 0.019 18783 1578 1 14 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.889 -0.644 18783 1579 1 14 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.511 0.157 18783 1580 1 14 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.848 -0.250 18783 1581 1 14 . 1 1 4 4 ALA H H 4 8.691 8.691 7.817 0.874 18783 1582 1 14 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.500 0.051 18783 1583 1 14 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.333 -3.924 18783 1584 1 14 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.366 -1.470 18783 1585 1 14 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.292 -0.952 18783 1586 1 14 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.750 -0.278 18783 1587 1 14 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.981 -0.969 18783 1588 1 14 . 1 1 6 6 GLU H H 6 8.221 8.221 8.585 -0.364 18783 1589 1 14 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.903 0.528 18783 1590 1 14 . 1 1 7 7 GLY H H 7 8.717 8.717 8.637 0.080 18783 1591 1 14 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.538 -0.222 18783 1592 1 14 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.017 -0.891 18783 1593 1 14 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.923 0.928 18783 1594 1 14 . 1 1 8 8 GLU H H 8 7.304 7.304 7.604 -0.300 18783 1595 1 14 . 1 1 9 9 SER HA H 9 4.728 4.728 5.414 -0.686 18783 1596 1 14 . 1 1 9 9 SER CA C 9 58.770 58.770 57.511 1.259 18783 1597 1 14 . 1 1 9 9 SER CB C 9 64.148 64.148 63.408 0.740 18783 1598 1 14 . 1 1 9 9 SER H H 9 8.066 8.066 8.457 -0.391 18783 1599 1 14 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.872 0.176 18783 1600 1 14 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.907 -3.083 18783 1601 1 14 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.532 17.619 18783 1602 1 14 . 1 1 10 10 CYS H H 10 8.073 8.073 9.125 -1.052 18783 1603 1 14 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.170 -0.106 18783 1604 1 14 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.500 0.311 18783 1605 1 14 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.302 2.351 18783 1606 1 14 . 1 1 11 11 ASN H H 11 8.092 8.092 8.565 -0.473 18783 1607 1 14 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.234 -0.687 18783 1608 1 14 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.930 2.431 18783 1609 1 14 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.477 -0.145 18783 1610 1 14 . 1 1 12 12 VAL H H 12 8.440 8.440 8.131 0.309 18783 1611 1 14 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.335 -0.144 18783 1612 1 14 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.273 -1.175 18783 1613 1 14 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.264 -1.684 18783 1614 1 14 . 1 1 13 13 GLU H H 13 7.542 7.542 8.161 -0.619 18783 1615 1 14 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.647 -0.161 18783 1616 1 14 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.966 -0.069 18783 1617 1 14 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.847 2.152 18783 1618 1 14 . 1 1 14 14 PHE H H 14 7.461 7.461 6.831 0.630 18783 1619 1 14 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 1620 1 14 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.917 1.232 18783 1621 1 14 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.967 0.072 18783 1622 1 14 . 1 1 15 15 TYR H H 15 8.283 8.283 7.336 0.947 18783 1623 1 14 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.698 -0.539 18783 1624 1 14 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.288 -0.208 18783 1625 1 14 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.885 -0.900 18783 1626 1 14 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.244 0.289 18783 1627 1 14 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.458 -3.670 18783 1628 1 14 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.662 12.942 18783 1629 1 14 . 1 1 17 17 CYS H H 17 8.030 8.030 8.256 -0.226 18783 1630 1 14 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.496 0.138 18783 1631 1 14 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.916 -5.891 18783 1632 1 14 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.912 13.661 18783 1633 1 14 . 1 1 18 18 CYS H H 18 8.804 8.804 8.306 0.498 18783 1634 1 14 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.286 0.220 18783 1635 1 14 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.273 1.045 18783 1636 1 14 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.286 -0.593 18783 1637 1 14 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 1638 1 14 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 1639 1 14 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.376 -0.087 18783 1640 1 14 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.600 -2.564 18783 1641 1 14 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.874 -1.113 18783 1642 1 14 . 1 1 21 21 LEU H H 21 6.553 6.553 7.670 -1.117 18783 1643 1 14 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.631 1.135 18783 1644 1 14 . 1 1 22 22 GLY H H 22 7.843 7.843 7.742 0.101 18783 1645 1 14 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.229 -0.125 18783 1646 1 14 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.590 -1.360 18783 1647 1 14 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.673 3.283 18783 1648 1 14 . 1 1 23 23 LEU H H 23 6.269 6.269 7.408 -1.139 18783 1649 1 14 . 1 1 24 24 THR HA H 24 4.337 4.337 4.447 -0.110 18783 1650 1 14 . 1 1 24 24 THR CA C 24 59.771 59.771 60.870 -1.099 18783 1651 1 14 . 1 1 24 24 THR CB C 24 70.307 70.307 71.215 -0.908 18783 1652 1 14 . 1 1 24 24 THR H H 24 8.542 8.542 8.711 -0.169 18783 1653 1 14 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.840 -0.417 18783 1654 1 14 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.961 -4.042 18783 1655 1 14 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.321 12.015 18783 1656 1 14 . 1 1 25 25 CYS H H 25 7.102 7.102 8.913 -1.811 18783 1657 1 14 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 1658 1 14 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.487 -1.703 18783 1659 1 14 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.363 0.431 18783 1660 1 14 . 1 1 26 26 ILE H H 26 8.296 8.296 8.898 -0.602 18783 1661 1 14 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.420 -0.125 18783 1662 1 14 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.784 0.322 18783 1663 1 14 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.389 1.577 18783 1664 1 14 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.233 1.377 18783 1665 1 14 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 1666 1 14 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.946 -0.051 18783 1667 1 14 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.192 -0.981 18783 1668 1 14 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.543 0.002 18783 1669 1 14 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 1670 1 14 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.415 -0.198 18783 1671 1 14 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.299 -1.253 18783 1672 1 14 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.555 1.776 18783 1673 1 14 . 1 1 31 31 ASP HA H 31 5.630 5.630 5.010 0.620 18783 1674 1 14 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.755 -1.195 18783 1675 1 14 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.183 -2.604 18783 1676 1 14 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1677 1 14 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.221 2.881 18783 1678 1 14 . 1 1 32 32 GLY H H 32 7.902 7.902 8.922 -1.020 18783 1679 1 14 . 1 1 33 33 THR HA H 33 4.791 4.791 5.185 -0.394 18783 1680 1 14 . 1 1 33 33 THR CA C 33 61.391 61.391 60.114 1.277 18783 1681 1 14 . 1 1 33 33 THR CB C 33 71.350 71.350 69.755 1.595 18783 1682 1 14 . 1 1 33 33 THR H H 33 8.388 8.388 8.319 0.069 18783 1683 1 14 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.552 0.474 18783 1684 1 14 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.724 -4.822 18783 1685 1 14 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.176 15.734 18783 1686 1 14 . 1 1 34 34 CYS H H 34 8.342 8.342 8.792 -0.450 18783 1687 1 14 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.814 -0.187 18783 1688 1 14 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.147 -0.074 18783 1689 1 14 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.785 0.214 18783 1690 1 14 . 1 1 35 35 TYR H H 35 8.976 8.976 9.166 -0.190 18783 1691 1 14 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.676 -0.059 18783 1692 1 14 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.167 -3.000 18783 1693 1 14 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.858 0.206 18783 1694 1 14 . 1 1 36 36 TYR H H 36 8.567 8.567 8.857 -0.290 18783 1695 1 15 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.783 -0.259 18783 1696 1 15 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.152 -5.091 18783 1697 1 15 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.748 14.965 18783 1698 1 15 . 1 1 3 3 CYS H H 3 7.424 7.424 7.428 -0.004 18783 1699 1 15 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.024 -0.779 18783 1700 1 15 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.703 -0.034 18783 1701 1 15 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.899 -0.301 18783 1702 1 15 . 1 1 4 4 ALA H H 4 8.691 8.691 8.147 0.544 18783 1703 1 15 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.517 0.034 18783 1704 1 15 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.052 -3.643 18783 1705 1 15 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.109 -2.213 18783 1706 1 15 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.230 -0.890 18783 1707 1 15 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.875 -0.403 18783 1708 1 15 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.806 -0.794 18783 1709 1 15 . 1 1 6 6 GLU H H 6 8.221 8.221 7.893 0.328 18783 1710 1 15 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.912 0.519 18783 1711 1 15 . 1 1 7 7 GLY H H 7 8.717 8.717 8.620 0.097 18783 1712 1 15 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.543 -0.227 18783 1713 1 15 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.993 -0.867 18783 1714 1 15 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.987 0.864 18783 1715 1 15 . 1 1 8 8 GLU H H 8 7.304 7.304 7.667 -0.363 18783 1716 1 15 . 1 1 9 9 SER HA H 9 4.728 4.728 5.416 -0.688 18783 1717 1 15 . 1 1 9 9 SER CA C 9 58.770 58.770 57.483 1.287 18783 1718 1 15 . 1 1 9 9 SER CB C 9 64.148 64.148 63.506 0.642 18783 1719 1 15 . 1 1 9 9 SER H H 9 8.066 8.066 8.460 -0.394 18783 1720 1 15 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.882 0.166 18783 1721 1 15 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.907 -3.083 18783 1722 1 15 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.533 17.618 18783 1723 1 15 . 1 1 10 10 CYS H H 10 8.073 8.073 9.122 -1.049 18783 1724 1 15 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.190 -0.126 18783 1725 1 15 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.316 0.494 18783 1726 1 15 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.226 2.427 18783 1727 1 15 . 1 1 11 11 ASN H H 11 8.092 8.092 8.633 -0.541 18783 1728 1 15 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.242 -0.695 18783 1729 1 15 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.110 3.251 18783 1730 1 15 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.968 0.364 18783 1731 1 15 . 1 1 12 12 VAL H H 12 8.440 8.440 8.136 0.304 18783 1732 1 15 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.355 -0.164 18783 1733 1 15 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.880 -1.782 18783 1734 1 15 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.883 -1.303 18783 1735 1 15 . 1 1 13 13 GLU H H 13 7.542 7.542 8.231 -0.689 18783 1736 1 15 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.653 -0.167 18783 1737 1 15 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.973 -0.076 18783 1738 1 15 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.851 2.148 18783 1739 1 15 . 1 1 14 14 PHE H H 14 7.461 7.461 6.836 0.625 18783 1740 1 15 . 1 1 15 15 TYR HA H 15 4.519 4.519 5.001 -0.482 18783 1741 1 15 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.927 1.222 18783 1742 1 15 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.971 0.068 18783 1743 1 15 . 1 1 15 15 TYR H H 15 8.283 8.283 7.342 0.941 18783 1744 1 15 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.709 -0.550 18783 1745 1 15 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.307 -0.228 18783 1746 1 15 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.895 -0.910 18783 1747 1 15 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.283 0.250 18783 1748 1 15 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.488 -3.700 18783 1749 1 15 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.674 12.930 18783 1750 1 15 . 1 1 17 17 CYS H H 17 8.030 8.030 8.271 -0.241 18783 1751 1 15 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.591 0.043 18783 1752 1 15 . 1 1 18 18 CYS CA C 18 52.026 52.026 58.004 -5.978 18783 1753 1 15 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.059 13.514 18783 1754 1 15 . 1 1 18 18 CYS H H 18 8.804 8.804 8.380 0.424 18783 1755 1 15 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.304 0.202 18783 1756 1 15 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.301 1.017 18783 1757 1 15 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.307 -0.614 18783 1758 1 15 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.983 0.944 18783 1759 1 15 . 1 1 20 20 GLY H H 20 8.797 8.797 8.664 0.133 18783 1760 1 15 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.359 -0.070 18783 1761 1 15 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.595 -2.559 18783 1762 1 15 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.844 -1.082 18783 1763 1 15 . 1 1 21 21 LEU H H 21 6.553 6.553 7.674 -1.121 18783 1764 1 15 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.620 1.146 18783 1765 1 15 . 1 1 22 22 GLY H H 22 7.843 7.843 7.730 0.113 18783 1766 1 15 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.245 -0.141 18783 1767 1 15 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.576 -1.346 18783 1768 1 15 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.664 3.292 18783 1769 1 15 . 1 1 23 23 LEU H H 23 6.269 6.269 7.408 -1.139 18783 1770 1 15 . 1 1 24 24 THR HA H 24 4.337 4.337 4.435 -0.098 18783 1771 1 15 . 1 1 24 24 THR CA C 24 59.771 59.771 60.693 -0.922 18783 1772 1 15 . 1 1 24 24 THR CB C 24 70.307 70.307 70.965 -0.658 18783 1773 1 15 . 1 1 24 24 THR H H 24 8.542 8.542 8.720 -0.178 18783 1774 1 15 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.759 -0.336 18783 1775 1 15 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.973 -4.054 18783 1776 1 15 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.367 11.969 18783 1777 1 15 . 1 1 25 25 CYS H H 25 7.102 7.102 8.894 -1.792 18783 1778 1 15 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.615 -0.198 18783 1779 1 15 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.481 -1.697 18783 1780 1 15 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.355 0.439 18783 1781 1 15 . 1 1 26 26 ILE H H 26 8.296 8.296 8.893 -0.597 18783 1782 1 15 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.417 -0.122 18783 1783 1 15 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.786 0.320 18783 1784 1 15 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.386 1.580 18783 1785 1 15 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.353 1.257 18783 1786 1 15 . 1 1 28 28 GLY H H 28 7.219 7.219 7.759 -0.540 18783 1787 1 15 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.991 -0.096 18783 1788 1 15 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 1789 1 15 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.379 0.166 18783 1790 1 15 . 1 1 29 29 ASN H H 29 7.452 7.452 8.084 -0.632 18783 1791 1 15 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.354 -0.137 18783 1792 1 15 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.200 -1.154 18783 1793 1 15 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.524 1.807 18783 1794 1 15 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.940 0.690 18783 1795 1 15 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.690 -1.129 18783 1796 1 15 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.424 -2.845 18783 1797 1 15 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 1798 1 15 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.264 2.838 18783 1799 1 15 . 1 1 32 32 GLY H H 32 7.902 7.902 8.912 -1.010 18783 1800 1 15 . 1 1 33 33 THR HA H 33 4.791 4.791 5.111 -0.320 18783 1801 1 15 . 1 1 33 33 THR CA C 33 61.391 61.391 60.355 1.036 18783 1802 1 15 . 1 1 33 33 THR CB C 33 71.350 71.350 69.971 1.379 18783 1803 1 15 . 1 1 33 33 THR H H 33 8.388 8.388 8.409 -0.021 18783 1804 1 15 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.543 0.483 18783 1805 1 15 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.549 -4.647 18783 1806 1 15 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.168 15.742 18783 1807 1 15 . 1 1 34 34 CYS H H 34 8.342 8.342 8.814 -0.472 18783 1808 1 15 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.776 -0.149 18783 1809 1 15 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.110 -0.037 18783 1810 1 15 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.787 0.212 18783 1811 1 15 . 1 1 35 35 TYR H H 35 8.976 8.976 9.140 -0.164 18783 1812 1 15 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.629 -0.012 18783 1813 1 15 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.094 -2.927 18783 1814 1 15 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.803 0.260 18783 1815 1 15 . 1 1 36 36 TYR H H 36 8.567 8.567 8.733 -0.166 18783 1816 1 16 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.791 -0.267 18783 1817 1 16 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.202 -5.141 18783 1818 1 16 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.670 15.043 18783 1819 1 16 . 1 1 3 3 CYS H H 3 7.424 7.424 7.398 0.026 18783 1820 1 16 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.024 -0.779 18783 1821 1 16 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.709 -0.040 18783 1822 1 16 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.888 -0.290 18783 1823 1 16 . 1 1 4 4 ALA H H 4 8.691 8.691 8.145 0.546 18783 1824 1 16 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.524 0.027 18783 1825 1 16 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.000 -3.591 18783 1826 1 16 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.142 -2.246 18783 1827 1 16 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.224 -0.884 18783 1828 1 16 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.864 -0.392 18783 1829 1 16 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.778 -0.766 18783 1830 1 16 . 1 1 6 6 GLU H H 6 8.221 8.221 7.835 0.386 18783 1831 1 16 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.904 0.527 18783 1832 1 16 . 1 1 7 7 GLY H H 7 8.717 8.717 8.619 0.098 18783 1833 1 16 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.555 -0.239 18783 1834 1 16 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.074 -0.948 18783 1835 1 16 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.879 0.972 18783 1836 1 16 . 1 1 8 8 GLU H H 8 7.304 7.304 7.654 -0.350 18783 1837 1 16 . 1 1 9 9 SER HA H 9 4.728 4.728 5.420 -0.692 18783 1838 1 16 . 1 1 9 9 SER CA C 9 58.770 58.770 57.239 1.531 18783 1839 1 16 . 1 1 9 9 SER CB C 9 64.148 64.148 63.053 1.095 18783 1840 1 16 . 1 1 9 9 SER H H 9 8.066 8.066 8.415 -0.349 18783 1841 1 16 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.858 0.190 18783 1842 1 16 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.873 -3.049 18783 1843 1 16 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.618 17.533 18783 1844 1 16 . 1 1 10 10 CYS H H 10 8.073 8.073 9.152 -1.079 18783 1845 1 16 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.187 -0.123 18783 1846 1 16 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.450 0.361 18783 1847 1 16 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.525 2.128 18783 1848 1 16 . 1 1 11 11 ASN H H 11 8.092 8.092 8.567 -0.475 18783 1849 1 16 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.199 -0.652 18783 1850 1 16 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.644 2.717 18783 1851 1 16 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.501 -0.169 18783 1852 1 16 . 1 1 12 12 VAL H H 12 8.440 8.440 8.128 0.312 18783 1853 1 16 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.327 -0.136 18783 1854 1 16 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.362 -1.264 18783 1855 1 16 . 1 1 13 13 GLU CB C 13 29.580 29.580 31.121 -1.541 18783 1856 1 16 . 1 1 13 13 GLU H H 13 7.542 7.542 8.161 -0.619 18783 1857 1 16 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.651 -0.165 18783 1858 1 16 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.969 -0.073 18783 1859 1 16 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.824 2.175 18783 1860 1 16 . 1 1 14 14 PHE H H 14 7.461 7.461 6.842 0.619 18783 1861 1 16 . 1 1 15 15 TYR HA H 15 4.519 4.519 5.000 -0.481 18783 1862 1 16 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.908 1.240 18783 1863 1 16 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.006 0.033 18783 1864 1 16 . 1 1 15 15 TYR H H 15 8.283 8.283 7.330 0.953 18783 1865 1 16 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.715 -0.556 18783 1866 1 16 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.312 -0.233 18783 1867 1 16 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.902 -0.917 18783 1868 1 16 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.286 0.247 18783 1869 1 16 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.487 -3.699 18783 1870 1 16 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.678 12.926 18783 1871 1 16 . 1 1 17 17 CYS H H 17 8.030 8.030 8.277 -0.247 18783 1872 1 16 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.594 0.040 18783 1873 1 16 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.995 -5.969 18783 1874 1 16 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.088 13.485 18783 1875 1 16 . 1 1 18 18 CYS H H 18 8.804 8.804 8.400 0.404 18783 1876 1 16 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.306 0.200 18783 1877 1 16 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.296 1.022 18783 1878 1 16 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.310 -0.617 18783 1879 1 16 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.985 0.942 18783 1880 1 16 . 1 1 20 20 GLY H H 20 8.797 8.797 8.666 0.131 18783 1881 1 16 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.359 -0.070 18783 1882 1 16 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.603 -2.567 18783 1883 1 16 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.848 -1.086 18783 1884 1 16 . 1 1 21 21 LEU H H 21 6.553 6.553 7.677 -1.124 18783 1885 1 16 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.620 1.146 18783 1886 1 16 . 1 1 22 22 GLY H H 22 7.843 7.843 7.735 0.108 18783 1887 1 16 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.202 -0.098 18783 1888 1 16 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.550 -1.320 18783 1889 1 16 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.652 3.304 18783 1890 1 16 . 1 1 23 23 LEU H H 23 6.269 6.269 7.396 -1.127 18783 1891 1 16 . 1 1 24 24 THR HA H 24 4.337 4.337 4.442 -0.105 18783 1892 1 16 . 1 1 24 24 THR CA C 24 59.771 59.771 60.858 -1.087 18783 1893 1 16 . 1 1 24 24 THR CB C 24 70.307 70.307 71.207 -0.900 18783 1894 1 16 . 1 1 24 24 THR H H 24 8.542 8.542 8.697 -0.155 18783 1895 1 16 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.832 -0.409 18783 1896 1 16 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.956 -4.037 18783 1897 1 16 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.322 12.014 18783 1898 1 16 . 1 1 25 25 CYS H H 25 7.102 7.102 8.911 -1.809 18783 1899 1 16 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.615 -0.198 18783 1900 1 16 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.482 -1.698 18783 1901 1 16 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.356 0.438 18783 1902 1 16 . 1 1 26 26 ILE H H 26 8.296 8.296 8.894 -0.598 18783 1903 1 16 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 1904 1 16 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.782 0.325 18783 1905 1 16 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 1906 1 16 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.236 1.374 18783 1907 1 16 . 1 1 28 28 GLY H H 28 7.219 7.219 7.750 -0.531 18783 1908 1 16 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.947 -0.052 18783 1909 1 16 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.192 -0.981 18783 1910 1 16 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.545 0.000 18783 1911 1 16 . 1 1 29 29 ASN H H 29 7.452 7.452 8.141 -0.689 18783 1912 1 16 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.398 -0.181 18783 1913 1 16 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.398 -1.353 18783 1914 1 16 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.560 1.771 18783 1915 1 16 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.941 0.689 18783 1916 1 16 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.690 -1.130 18783 1917 1 16 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.425 -2.845 18783 1918 1 16 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 1919 1 16 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.493 2.609 18783 1920 1 16 . 1 1 32 32 GLY H H 32 7.902 7.902 8.906 -1.004 18783 1921 1 16 . 1 1 33 33 THR HA H 33 4.791 4.791 5.135 -0.344 18783 1922 1 16 . 1 1 33 33 THR CA C 33 61.391 61.391 59.993 1.398 18783 1923 1 16 . 1 1 33 33 THR CB C 33 71.350 71.350 69.632 1.718 18783 1924 1 16 . 1 1 33 33 THR H H 33 8.388 8.388 8.397 -0.009 18783 1925 1 16 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.496 0.530 18783 1926 1 16 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.558 -4.656 18783 1927 1 16 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.054 15.856 18783 1928 1 16 . 1 1 34 34 CYS H H 34 8.342 8.342 8.799 -0.457 18783 1929 1 16 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.775 -0.148 18783 1930 1 16 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.112 -0.039 18783 1931 1 16 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.780 0.219 18783 1932 1 16 . 1 1 35 35 TYR H H 35 8.976 8.976 9.141 -0.165 18783 1933 1 16 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.629 -0.012 18783 1934 1 16 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.095 -2.928 18783 1935 1 16 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.808 0.256 18783 1936 1 16 . 1 1 36 36 TYR H H 36 8.567 8.567 8.733 -0.166 18783 1937 1 17 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.679 -0.155 18783 1938 1 17 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.017 -4.956 18783 1939 1 17 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.613 15.100 18783 1940 1 17 . 1 1 3 3 CYS H H 3 7.424 7.424 7.383 0.041 18783 1941 1 17 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.004 -0.759 18783 1942 1 17 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.609 0.060 18783 1943 1 17 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.114 -0.516 18783 1944 1 17 . 1 1 4 4 ALA H H 4 8.691 8.691 8.055 0.636 18783 1945 1 17 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.503 0.048 18783 1946 1 17 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.302 -3.893 18783 1947 1 17 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.412 -1.516 18783 1948 1 17 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.299 -0.959 18783 1949 1 17 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.757 -0.284 18783 1950 1 17 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.973 -0.961 18783 1951 1 17 . 1 1 6 6 GLU H H 6 8.221 8.221 8.590 -0.369 18783 1952 1 17 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.898 0.533 18783 1953 1 17 . 1 1 7 7 GLY H H 7 8.717 8.717 8.637 0.080 18783 1954 1 17 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.561 -0.245 18783 1955 1 17 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.034 -0.908 18783 1956 1 17 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.818 1.033 18783 1957 1 17 . 1 1 8 8 GLU H H 8 7.304 7.304 7.681 -0.377 18783 1958 1 17 . 1 1 9 9 SER HA H 9 4.728 4.728 5.504 -0.776 18783 1959 1 17 . 1 1 9 9 SER CA C 9 58.770 58.770 57.313 1.457 18783 1960 1 17 . 1 1 9 9 SER CB C 9 64.148 64.148 63.121 1.027 18783 1961 1 17 . 1 1 9 9 SER H H 9 8.066 8.066 8.426 -0.360 18783 1962 1 17 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.827 0.221 18783 1963 1 17 . 1 1 10 10 CYS CA C 10 52.824 52.824 56.034 -3.210 18783 1964 1 17 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.742 17.409 18783 1965 1 17 . 1 1 10 10 CYS H H 10 8.073 8.073 9.188 -1.115 18783 1966 1 17 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.201 -0.137 18783 1967 1 17 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.288 0.523 18783 1968 1 17 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.294 2.359 18783 1969 1 17 . 1 1 11 11 ASN H H 11 8.092 8.092 8.653 -0.561 18783 1970 1 17 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.233 -0.686 18783 1971 1 17 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.103 3.258 18783 1972 1 17 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.942 0.390 18783 1973 1 17 . 1 1 12 12 VAL H H 12 8.440 8.440 8.222 0.218 18783 1974 1 17 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.350 -0.159 18783 1975 1 17 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.860 -1.762 18783 1976 1 17 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.878 -1.298 18783 1977 1 17 . 1 1 13 13 GLU H H 13 7.542 7.542 8.224 -0.682 18783 1978 1 17 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.652 -0.166 18783 1979 1 17 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.918 -0.021 18783 1980 1 17 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.829 2.170 18783 1981 1 17 . 1 1 14 14 PHE H H 14 7.461 7.461 6.833 0.628 18783 1982 1 17 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 1983 1 17 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.917 1.232 18783 1984 1 17 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.955 0.084 18783 1985 1 17 . 1 1 15 15 TYR H H 15 8.283 8.283 7.333 0.950 18783 1986 1 17 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.710 -0.551 18783 1987 1 17 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.294 -0.215 18783 1988 1 17 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.876 -0.891 18783 1989 1 17 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.244 0.289 18783 1990 1 17 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.462 -3.674 18783 1991 1 17 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.660 12.944 18783 1992 1 17 . 1 1 17 17 CYS H H 17 8.030 8.030 8.261 -0.231 18783 1993 1 17 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.496 0.138 18783 1994 1 17 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.915 -5.889 18783 1995 1 17 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.901 13.672 18783 1996 1 17 . 1 1 18 18 CYS H H 18 8.804 8.804 8.303 0.501 18783 1997 1 17 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 1998 1 17 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.271 1.047 18783 1999 1 17 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.286 -0.593 18783 2000 1 17 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 2001 1 17 . 1 1 20 20 GLY H H 20 8.797 8.797 8.656 0.141 18783 2002 1 17 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.376 -0.087 18783 2003 1 17 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.603 -2.567 18783 2004 1 17 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.875 -1.113 18783 2005 1 17 . 1 1 21 21 LEU H H 21 6.553 6.553 7.669 -1.116 18783 2006 1 17 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.634 1.132 18783 2007 1 17 . 1 1 22 22 GLY H H 22 7.843 7.843 7.742 0.101 18783 2008 1 17 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.269 -0.165 18783 2009 1 17 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.609 -1.379 18783 2010 1 17 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.700 3.256 18783 2011 1 17 . 1 1 23 23 LEU H H 23 6.269 6.269 7.427 -1.158 18783 2012 1 17 . 1 1 24 24 THR HA H 24 4.337 4.337 4.439 -0.102 18783 2013 1 17 . 1 1 24 24 THR CA C 24 59.771 59.771 60.712 -0.941 18783 2014 1 17 . 1 1 24 24 THR CB C 24 70.307 70.307 70.946 -0.639 18783 2015 1 17 . 1 1 24 24 THR H H 24 8.542 8.542 8.738 -0.196 18783 2016 1 17 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.757 -0.334 18783 2017 1 17 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.983 -4.064 18783 2018 1 17 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.356 11.980 18783 2019 1 17 . 1 1 25 25 CYS H H 25 7.102 7.102 8.899 -1.797 18783 2020 1 17 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 2021 1 17 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.472 -1.688 18783 2022 1 17 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.309 0.485 18783 2023 1 17 . 1 1 26 26 ILE H H 26 8.296 8.296 8.909 -0.613 18783 2024 1 17 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 2025 1 17 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.780 0.326 18783 2026 1 17 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.385 1.581 18783 2027 1 17 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.358 1.252 18783 2028 1 17 . 1 1 28 28 GLY H H 28 7.219 7.219 7.855 -0.636 18783 2029 1 17 . 1 1 29 29 ASN HA H 29 4.895 4.895 5.094 -0.199 18783 2030 1 17 . 1 1 29 29 ASN CA C 29 50.211 50.211 50.594 -0.383 18783 2031 1 17 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.115 0.430 18783 2032 1 17 . 1 1 29 29 ASN H H 29 7.452 7.452 7.998 -0.546 18783 2033 1 17 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.323 -0.106 18783 2034 1 17 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.103 -1.058 18783 2035 1 17 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.267 2.064 18783 2036 1 17 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.975 0.655 18783 2037 1 17 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.674 -1.114 18783 2038 1 17 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.446 -2.867 18783 2039 1 17 . 1 1 31 31 ASP H H 31 7.854 7.854 7.649 0.205 18783 2040 1 17 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.539 2.563 18783 2041 1 17 . 1 1 32 32 GLY H H 32 7.902 7.902 8.929 -1.027 18783 2042 1 17 . 1 1 33 33 THR HA H 33 4.791 4.791 5.180 -0.389 18783 2043 1 17 . 1 1 33 33 THR CA C 33 61.391 61.391 60.110 1.281 18783 2044 1 17 . 1 1 33 33 THR CB C 33 71.350 71.350 69.743 1.607 18783 2045 1 17 . 1 1 33 33 THR H H 33 8.388 8.388 8.308 0.080 18783 2046 1 17 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.547 0.479 18783 2047 1 17 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.726 -4.824 18783 2048 1 17 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.176 15.734 18783 2049 1 17 . 1 1 34 34 CYS H H 34 8.342 8.342 8.807 -0.465 18783 2050 1 17 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.815 -0.188 18783 2051 1 17 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.145 -0.072 18783 2052 1 17 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.795 0.204 18783 2053 1 17 . 1 1 35 35 TYR H H 35 8.976 8.976 9.162 -0.186 18783 2054 1 17 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.679 -0.062 18783 2055 1 17 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.165 -2.998 18783 2056 1 17 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.865 0.199 18783 2057 1 17 . 1 1 36 36 TYR H H 36 8.567 8.567 8.877 -0.310 18783 2058 1 18 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.723 -0.199 18783 2059 1 18 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.332 -5.271 18783 2060 1 18 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.172 15.541 18783 2061 1 18 . 1 1 3 3 CYS H H 3 7.424 7.424 7.420 0.004 18783 2062 1 18 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.952 -0.707 18783 2063 1 18 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.620 0.049 18783 2064 1 18 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.713 -0.115 18783 2065 1 18 . 1 1 4 4 ALA H H 4 8.691 8.691 7.907 0.784 18783 2066 1 18 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.518 0.033 18783 2067 1 18 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.033 -3.624 18783 2068 1 18 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.102 -2.206 18783 2069 1 18 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.218 -0.878 18783 2070 1 18 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.855 -0.383 18783 2071 1 18 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.785 -0.773 18783 2072 1 18 . 1 1 6 6 GLU H H 6 8.221 8.221 7.824 0.397 18783 2073 1 18 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.913 0.518 18783 2074 1 18 . 1 1 7 7 GLY H H 7 8.717 8.717 8.618 0.099 18783 2075 1 18 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.550 -0.234 18783 2076 1 18 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.152 -1.026 18783 2077 1 18 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.183 0.668 18783 2078 1 18 . 1 1 8 8 GLU H H 8 7.304 7.304 7.650 -0.346 18783 2079 1 18 . 1 1 9 9 SER HA H 9 4.728 4.728 5.424 -0.696 18783 2080 1 18 . 1 1 9 9 SER CA C 9 58.770 58.770 57.436 1.334 18783 2081 1 18 . 1 1 9 9 SER CB C 9 64.148 64.148 63.280 0.868 18783 2082 1 18 . 1 1 9 9 SER H H 9 8.066 8.066 8.369 -0.303 18783 2083 1 18 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.860 0.188 18783 2084 1 18 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.729 -2.905 18783 2085 1 18 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.620 17.531 18783 2086 1 18 . 1 1 10 10 CYS H H 10 8.073 8.073 9.140 -1.067 18783 2087 1 18 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.186 -0.121 18783 2088 1 18 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.452 0.359 18783 2089 1 18 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.518 2.135 18783 2090 1 18 . 1 1 11 11 ASN H H 11 8.092 8.092 8.562 -0.470 18783 2091 1 18 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.199 -0.652 18783 2092 1 18 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.625 2.736 18783 2093 1 18 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.489 -0.157 18783 2094 1 18 . 1 1 12 12 VAL H H 12 8.440 8.440 8.130 0.310 18783 2095 1 18 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.348 -0.157 18783 2096 1 18 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.941 -1.843 18783 2097 1 18 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.718 -1.139 18783 2098 1 18 . 1 1 13 13 GLU H H 13 7.542 7.542 8.259 -0.717 18783 2099 1 18 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.651 -0.165 18783 2100 1 18 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.974 -0.077 18783 2101 1 18 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.839 2.160 18783 2102 1 18 . 1 1 14 14 PHE H H 14 7.461 7.461 6.839 0.622 18783 2103 1 18 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.999 -0.480 18783 2104 1 18 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.919 1.230 18783 2105 1 18 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.026 0.013 18783 2106 1 18 . 1 1 15 15 TYR H H 15 8.283 8.283 7.331 0.952 18783 2107 1 18 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.711 -0.552 18783 2108 1 18 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.306 -0.228 18783 2109 1 18 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.896 -0.911 18783 2110 1 18 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.283 0.250 18783 2111 1 18 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.496 -3.708 18783 2112 1 18 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.673 12.931 18783 2113 1 18 . 1 1 17 17 CYS H H 17 8.030 8.030 8.272 -0.242 18783 2114 1 18 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.590 0.044 18783 2115 1 18 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.997 -5.971 18783 2116 1 18 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.061 13.512 18783 2117 1 18 . 1 1 18 18 CYS H H 18 8.804 8.804 8.389 0.415 18783 2118 1 18 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.306 0.200 18783 2119 1 18 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.303 1.015 18783 2120 1 18 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.306 -0.613 18783 2121 1 18 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.979 0.948 18783 2122 1 18 . 1 1 20 20 GLY H H 20 8.797 8.797 8.666 0.131 18783 2123 1 18 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.361 -0.072 18783 2124 1 18 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.597 -2.562 18783 2125 1 18 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.855 -1.093 18783 2126 1 18 . 1 1 21 21 LEU H H 21 6.553 6.553 7.676 -1.123 18783 2127 1 18 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.621 1.145 18783 2128 1 18 . 1 1 22 22 GLY H H 22 7.843 7.843 7.733 0.110 18783 2129 1 18 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.145 -0.041 18783 2130 1 18 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.595 -1.365 18783 2131 1 18 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.839 3.118 18783 2132 1 18 . 1 1 23 23 LEU H H 23 6.269 6.269 7.401 -1.132 18783 2133 1 18 . 1 1 24 24 THR HA H 24 4.337 4.337 4.458 -0.121 18783 2134 1 18 . 1 1 24 24 THR CA C 24 59.771 59.771 60.355 -0.584 18783 2135 1 18 . 1 1 24 24 THR CB C 24 70.307 70.307 71.019 -0.712 18783 2136 1 18 . 1 1 24 24 THR H H 24 8.542 8.542 8.695 -0.153 18783 2137 1 18 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.786 -0.363 18783 2138 1 18 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.815 -3.896 18783 2139 1 18 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.158 12.178 18783 2140 1 18 . 1 1 25 25 CYS H H 25 7.102 7.102 8.957 -1.855 18783 2141 1 18 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.614 -0.197 18783 2142 1 18 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.484 -1.700 18783 2143 1 18 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.355 0.439 18783 2144 1 18 . 1 1 26 26 ILE H H 26 8.296 8.296 8.892 -0.596 18783 2145 1 18 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 2146 1 18 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.782 0.324 18783 2147 1 18 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.386 1.580 18783 2148 1 18 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.356 1.254 18783 2149 1 18 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 2150 1 18 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.991 -0.096 18783 2151 1 18 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 2152 1 18 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.382 0.163 18783 2153 1 18 . 1 1 29 29 ASN H H 29 7.452 7.452 8.083 -0.631 18783 2154 1 18 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.378 -0.161 18783 2155 1 18 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.098 -1.052 18783 2156 1 18 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.562 1.770 18783 2157 1 18 . 1 1 31 31 ASP HA H 31 5.630 5.630 5.011 0.619 18783 2158 1 18 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.757 -1.196 18783 2159 1 18 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.184 -2.605 18783 2160 1 18 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 2161 1 18 . 1 1 32 32 GLY CA C 32 47.102 47.102 43.986 3.116 18783 2162 1 18 . 1 1 32 32 GLY H H 32 7.902 7.902 8.937 -1.035 18783 2163 1 18 . 1 1 33 33 THR HA H 33 4.791 4.791 5.120 -0.329 18783 2164 1 18 . 1 1 33 33 THR CA C 33 61.391 61.391 60.345 1.046 18783 2165 1 18 . 1 1 33 33 THR CB C 33 71.350 71.350 69.972 1.378 18783 2166 1 18 . 1 1 33 33 THR H H 33 8.388 8.388 8.408 -0.020 18783 2167 1 18 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.543 0.483 18783 2168 1 18 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.545 -4.643 18783 2169 1 18 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.169 15.741 18783 2170 1 18 . 1 1 34 34 CYS H H 34 8.342 8.342 8.801 -0.459 18783 2171 1 18 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.775 -0.148 18783 2172 1 18 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.110 -0.037 18783 2173 1 18 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.785 0.214 18783 2174 1 18 . 1 1 35 35 TYR H H 35 8.976 8.976 9.140 -0.164 18783 2175 1 18 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.627 -0.010 18783 2176 1 18 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.096 -2.929 18783 2177 1 18 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.805 0.259 18783 2178 1 18 . 1 1 36 36 TYR H H 36 8.567 8.567 8.819 -0.252 18783 2179 1 19 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.739 -0.215 18783 2180 1 19 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.392 -5.331 18783 2181 1 19 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.049 15.664 18783 2182 1 19 . 1 1 3 3 CYS H H 3 7.424 7.424 7.352 0.072 18783 2183 1 19 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.955 -0.710 18783 2184 1 19 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.624 0.045 18783 2185 1 19 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.718 -0.120 18783 2186 1 19 . 1 1 4 4 ALA H H 4 8.691 8.691 7.900 0.791 18783 2187 1 19 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.526 0.025 18783 2188 1 19 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.004 -3.595 18783 2189 1 19 . 1 1 5 5 PHE CB C 5 39.896 39.896 42.155 -2.259 18783 2190 1 19 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.232 -0.892 18783 2191 1 19 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.848 -0.376 18783 2192 1 19 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.788 -0.776 18783 2193 1 19 . 1 1 6 6 GLU H H 6 8.221 8.221 7.846 0.375 18783 2194 1 19 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.911 0.520 18783 2195 1 19 . 1 1 7 7 GLY H H 7 8.717 8.717 8.620 0.097 18783 2196 1 19 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.552 -0.236 18783 2197 1 19 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.026 -0.900 18783 2198 1 19 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.900 0.951 18783 2199 1 19 . 1 1 8 8 GLU H H 8 7.304 7.304 7.656 -0.352 18783 2200 1 19 . 1 1 9 9 SER HA H 9 4.728 4.728 5.416 -0.688 18783 2201 1 19 . 1 1 9 9 SER CA C 9 58.770 58.770 57.411 1.359 18783 2202 1 19 . 1 1 9 9 SER CB C 9 64.148 64.148 63.229 0.919 18783 2203 1 19 . 1 1 9 9 SER H H 9 8.066 8.066 8.434 -0.368 18783 2204 1 19 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.867 0.181 18783 2205 1 19 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.911 -3.087 18783 2206 1 19 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.590 17.561 18783 2207 1 19 . 1 1 10 10 CYS H H 10 8.073 8.073 9.152 -1.079 18783 2208 1 19 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.193 -0.129 18783 2209 1 19 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.314 0.497 18783 2210 1 19 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.225 2.428 18783 2211 1 19 . 1 1 11 11 ASN H H 11 8.092 8.092 8.645 -0.553 18783 2212 1 19 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.243 -0.696 18783 2213 1 19 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.099 3.262 18783 2214 1 19 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.968 0.364 18783 2215 1 19 . 1 1 12 12 VAL H H 12 8.440 8.440 8.132 0.308 18783 2216 1 19 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.354 -0.163 18783 2217 1 19 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.870 -1.772 18783 2218 1 19 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.873 -1.293 18783 2219 1 19 . 1 1 13 13 GLU H H 13 7.542 7.542 8.234 -0.692 18783 2220 1 19 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.647 -0.161 18783 2221 1 19 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.994 -0.097 18783 2222 1 19 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.795 2.204 18783 2223 1 19 . 1 1 14 14 PHE H H 14 7.461 7.461 6.850 0.611 18783 2224 1 19 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.997 -0.478 18783 2225 1 19 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.880 1.268 18783 2226 1 19 . 1 1 15 15 TYR CB C 15 39.039 39.039 39.084 -0.045 18783 2227 1 19 . 1 1 15 15 TYR H H 15 8.283 8.283 7.312 0.971 18783 2228 1 19 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.719 -0.560 18783 2229 1 19 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.310 -0.231 18783 2230 1 19 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.908 -0.923 18783 2231 1 19 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.289 0.244 18783 2232 1 19 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.482 -3.694 18783 2233 1 19 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.686 12.918 18783 2234 1 19 . 1 1 17 17 CYS H H 17 8.030 8.030 8.281 -0.251 18783 2235 1 19 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.594 0.040 18783 2236 1 19 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.979 -5.953 18783 2237 1 19 . 1 1 18 18 CYS CB C 18 39.573 39.573 26.103 13.470 18783 2238 1 19 . 1 1 18 18 CYS H H 18 8.804 8.804 8.408 0.396 18783 2239 1 19 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.305 0.201 18783 2240 1 19 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.295 1.023 18783 2241 1 19 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.310 -0.617 18783 2242 1 19 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.986 0.941 18783 2243 1 19 . 1 1 20 20 GLY H H 20 8.797 8.797 8.665 0.132 18783 2244 1 19 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.361 -0.072 18783 2245 1 19 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.582 -2.546 18783 2246 1 19 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.848 -1.086 18783 2247 1 19 . 1 1 21 21 LEU H H 21 6.553 6.553 7.679 -1.126 18783 2248 1 19 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.610 1.156 18783 2249 1 19 . 1 1 22 22 GLY H H 22 7.843 7.843 7.726 0.117 18783 2250 1 19 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.190 -0.086 18783 2251 1 19 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.572 -1.342 18783 2252 1 19 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.630 3.326 18783 2253 1 19 . 1 1 23 23 LEU H H 23 6.269 6.269 7.388 -1.119 18783 2254 1 19 . 1 1 24 24 THR HA H 24 4.337 4.337 4.441 -0.104 18783 2255 1 19 . 1 1 24 24 THR CA C 24 59.771 59.771 60.863 -1.092 18783 2256 1 19 . 1 1 24 24 THR CB C 24 70.307 70.307 71.198 -0.891 18783 2257 1 19 . 1 1 24 24 THR H H 24 8.542 8.542 8.694 -0.152 18783 2258 1 19 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.830 -0.407 18783 2259 1 19 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.963 -4.044 18783 2260 1 19 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.312 12.024 18783 2261 1 19 . 1 1 25 25 CYS H H 25 7.102 7.102 8.912 -1.810 18783 2262 1 19 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.615 -0.198 18783 2263 1 19 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.479 -1.695 18783 2264 1 19 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.346 0.448 18783 2265 1 19 . 1 1 26 26 ILE H H 26 8.296 8.296 8.894 -0.598 18783 2266 1 19 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.418 -0.123 18783 2267 1 19 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.779 0.327 18783 2268 1 19 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.387 1.579 18783 2269 1 19 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.358 1.252 18783 2270 1 19 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 2271 1 19 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.991 -0.096 18783 2272 1 19 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.124 -0.913 18783 2273 1 19 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.381 0.164 18783 2274 1 19 . 1 1 29 29 ASN H H 29 7.452 7.452 8.083 -0.631 18783 2275 1 19 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.377 -0.160 18783 2276 1 19 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.099 -1.053 18783 2277 1 19 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.561 1.770 18783 2278 1 19 . 1 1 31 31 ASP HA H 31 5.630 5.630 5.012 0.618 18783 2279 1 19 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.755 -1.195 18783 2280 1 19 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.185 -2.606 18783 2281 1 19 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 2282 1 19 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.204 2.898 18783 2283 1 19 . 1 1 32 32 GLY H H 32 7.902 7.902 8.924 -1.022 18783 2284 1 19 . 1 1 33 33 THR HA H 33 4.791 4.791 5.143 -0.352 18783 2285 1 19 . 1 1 33 33 THR CA C 33 61.391 61.391 59.992 1.399 18783 2286 1 19 . 1 1 33 33 THR CB C 33 71.350 71.350 69.629 1.722 18783 2287 1 19 . 1 1 33 33 THR H H 33 8.388 8.388 8.394 -0.006 18783 2288 1 19 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.494 0.532 18783 2289 1 19 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.560 -4.658 18783 2290 1 19 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.052 15.858 18783 2291 1 19 . 1 1 34 34 CYS H H 34 8.342 8.342 8.791 -0.449 18783 2292 1 19 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.775 -0.148 18783 2293 1 19 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.116 -0.043 18783 2294 1 19 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.765 0.234 18783 2295 1 19 . 1 1 35 35 TYR H H 35 8.976 8.976 9.146 -0.170 18783 2296 1 19 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.622 -0.005 18783 2297 1 19 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.111 -2.944 18783 2298 1 19 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.806 0.258 18783 2299 1 19 . 1 1 36 36 TYR H H 36 8.567 8.567 8.825 -0.258 18783 2300 1 20 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.678 -0.154 18783 2301 1 20 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.013 -4.952 18783 2302 1 20 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.629 15.084 18783 2303 1 20 . 1 1 3 3 CYS H H 3 7.424 7.424 7.379 0.045 18783 2304 1 20 . 1 1 4 4 ALA HA H 4 4.245 4.245 5.003 -0.758 18783 2305 1 20 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.611 0.058 18783 2306 1 20 . 1 1 4 4 ALA CB C 4 21.598 21.598 22.120 -0.522 18783 2307 1 20 . 1 1 4 4 ALA H H 4 8.691 8.691 8.054 0.637 18783 2308 1 20 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.501 0.050 18783 2309 1 20 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.304 -3.896 18783 2310 1 20 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.411 -1.515 18783 2311 1 20 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.292 -0.952 18783 2312 1 20 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.771 -0.299 18783 2313 1 20 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.968 -0.956 18783 2314 1 20 . 1 1 6 6 GLU H H 6 8.221 8.221 8.583 -0.362 18783 2315 1 20 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.901 0.530 18783 2316 1 20 . 1 1 7 7 GLY H H 7 8.717 8.717 8.636 0.081 18783 2317 1 20 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.542 -0.226 18783 2318 1 20 . 1 1 8 8 GLU CA C 8 54.126 54.126 55.037 -0.911 18783 2319 1 20 . 1 1 8 8 GLU CB C 8 32.851 32.851 31.891 0.960 18783 2320 1 20 . 1 1 8 8 GLU H H 8 7.304 7.304 7.612 -0.308 18783 2321 1 20 . 1 1 9 9 SER HA H 9 4.728 4.728 5.414 -0.686 18783 2322 1 20 . 1 1 9 9 SER CA C 9 58.770 58.770 57.473 1.297 18783 2323 1 20 . 1 1 9 9 SER CB C 9 64.148 64.148 63.321 0.828 18783 2324 1 20 . 1 1 9 9 SER H H 9 8.066 8.066 8.447 -0.381 18783 2325 1 20 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.866 0.182 18783 2326 1 20 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.906 -3.082 18783 2327 1 20 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.564 17.587 18783 2328 1 20 . 1 1 10 10 CYS H H 10 8.073 8.073 9.132 -1.059 18783 2329 1 20 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.187 -0.123 18783 2330 1 20 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.312 0.499 18783 2331 1 20 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.219 2.434 18783 2332 1 20 . 1 1 11 11 ASN H H 11 8.092 8.092 8.627 -0.535 18783 2333 1 20 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.236 -0.689 18783 2334 1 20 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.101 3.260 18783 2335 1 20 . 1 1 12 12 VAL CB C 12 31.332 31.332 30.963 0.369 18783 2336 1 20 . 1 1 12 12 VAL H H 12 8.440 8.440 8.132 0.308 18783 2337 1 20 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.351 -0.160 18783 2338 1 20 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.877 -1.779 18783 2339 1 20 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.880 -1.300 18783 2340 1 20 . 1 1 13 13 GLU H H 13 7.542 7.542 8.226 -0.684 18783 2341 1 20 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 2342 1 20 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.961 -0.064 18783 2343 1 20 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.852 2.147 18783 2344 1 20 . 1 1 14 14 PHE H H 14 7.461 7.461 6.829 0.632 18783 2345 1 20 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.987 -0.468 18783 2346 1 20 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.920 1.229 18783 2347 1 20 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.958 0.081 18783 2348 1 20 . 1 1 15 15 TYR H H 15 8.283 8.283 7.336 0.947 18783 2349 1 20 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.697 -0.538 18783 2350 1 20 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.288 -0.209 18783 2351 1 20 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.883 -0.898 18783 2352 1 20 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.242 0.291 18783 2353 1 20 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.455 -3.667 18783 2354 1 20 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.657 12.947 18783 2355 1 20 . 1 1 17 17 CYS H H 17 8.030 8.030 8.255 -0.225 18783 2356 1 20 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.496 0.138 18783 2357 1 20 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.924 -5.898 18783 2358 1 20 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.899 13.674 18783 2359 1 20 . 1 1 18 18 CYS H H 18 8.804 8.804 8.303 0.501 18783 2360 1 20 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.287 0.219 18783 2361 1 20 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.269 1.049 18783 2362 1 20 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.286 -0.593 18783 2363 1 20 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.983 0.945 18783 2364 1 20 . 1 1 20 20 GLY H H 20 8.797 8.797 8.657 0.140 18783 2365 1 20 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.376 -0.087 18783 2366 1 20 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.609 -2.573 18783 2367 1 20 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.877 -1.115 18783 2368 1 20 . 1 1 21 21 LEU H H 21 6.553 6.553 7.667 -1.114 18783 2369 1 20 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.639 1.127 18783 2370 1 20 . 1 1 22 22 GLY H H 22 7.843 7.843 7.761 0.082 18783 2371 1 20 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.190 -0.086 18783 2372 1 20 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.646 -1.416 18783 2373 1 20 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.867 3.089 18783 2374 1 20 . 1 1 23 23 LEU H H 23 6.269 6.269 7.432 -1.163 18783 2375 1 20 . 1 1 24 24 THR HA H 24 4.337 4.337 4.463 -0.126 18783 2376 1 20 . 1 1 24 24 THR CA C 24 59.771 59.771 60.388 -0.617 18783 2377 1 20 . 1 1 24 24 THR CB C 24 70.307 70.307 71.028 -0.721 18783 2378 1 20 . 1 1 24 24 THR H H 24 8.542 8.542 8.684 -0.142 18783 2379 1 20 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.787 -0.364 18783 2380 1 20 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.811 -3.892 18783 2381 1 20 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.160 12.176 18783 2382 1 20 . 1 1 25 25 CYS H H 25 7.102 7.102 8.957 -1.855 18783 2383 1 20 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.617 -0.200 18783 2384 1 20 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.488 -1.704 18783 2385 1 20 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.362 0.431 18783 2386 1 20 . 1 1 26 26 ILE H H 26 8.296 8.296 8.896 -0.600 18783 2387 1 20 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.421 -0.126 18783 2388 1 20 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.778 0.329 18783 2389 1 20 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.390 1.576 18783 2390 1 20 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.355 1.255 18783 2391 1 20 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 2392 1 20 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.990 -0.095 18783 2393 1 20 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.123 -0.912 18783 2394 1 20 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.377 0.168 18783 2395 1 20 . 1 1 29 29 ASN H H 29 7.452 7.452 8.083 -0.631 18783 2396 1 20 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.377 -0.160 18783 2397 1 20 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.096 -1.050 18783 2398 1 20 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.560 1.771 18783 2399 1 20 . 1 1 31 31 ASP HA H 31 5.630 5.630 5.010 0.620 18783 2400 1 20 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.751 -1.191 18783 2401 1 20 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.186 -2.607 18783 2402 1 20 . 1 1 31 31 ASP H H 31 7.854 7.854 7.642 0.212 18783 2403 1 20 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.224 2.878 18783 2404 1 20 . 1 1 32 32 GLY H H 32 7.902 7.902 8.919 -1.017 18783 2405 1 20 . 1 1 33 33 THR HA H 33 4.791 4.791 5.172 -0.381 18783 2406 1 20 . 1 1 33 33 THR CA C 33 61.391 61.391 60.123 1.268 18783 2407 1 20 . 1 1 33 33 THR CB C 33 71.350 71.350 69.745 1.605 18783 2408 1 20 . 1 1 33 33 THR H H 33 8.388 8.388 8.314 0.074 18783 2409 1 20 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.561 0.465 18783 2410 1 20 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.705 -4.803 18783 2411 1 20 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.188 15.723 18783 2412 1 20 . 1 1 34 34 CYS H H 34 8.342 8.342 8.805 -0.463 18783 2413 1 20 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.811 -0.184 18783 2414 1 20 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.138 -0.065 18783 2415 1 20 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.794 0.205 18783 2416 1 20 . 1 1 35 35 TYR H H 35 8.976 8.976 9.162 -0.186 18783 2417 1 20 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.649 -0.032 18783 2418 1 20 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.407 -3.240 18783 2419 1 20 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.958 0.106 18783 2420 1 20 . 1 1 36 36 TYR H H 36 8.567 8.567 8.971 -0.404 18783 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 18783 2 1 1 "Average Difference" HA 39 0.443 0.208 0.396 18783 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18783 4 1 1 "Average Difference" CA 34 2.373 0.906 2.226 18783 5 1 1 "Average Difference" CB 29 6.772 -3.152 6.100 18783 6 1 1 "Average Difference" HN 29 0.661 0.270 0.614 18783 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18783 8 1 2 "Average Difference" HA 39 0.437 0.202 0.393 18783 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18783 10 1 2 "Average Difference" CA 34 2.377 0.889 2.238 18783 11 1 2 "Average Difference" CB 29 6.779 -3.206 6.079 18783 12 1 2 "Average Difference" HN 29 0.669 0.276 0.620 18783 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18783 14 1 3 "Average Difference" HA 39 0.442 0.205 0.397 18783 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18783 16 1 3 "Average Difference" CA 34 2.371 0.905 2.225 18783 17 1 3 "Average Difference" CB 29 6.823 -3.192 6.137 18783 18 1 3 "Average Difference" HN 29 0.677 0.269 0.632 18783 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18783 20 1 4 "Average Difference" HA 39 0.442 0.207 0.396 18783 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18783 22 1 4 "Average Difference" CA 34 2.372 0.933 2.214 18783 23 1 4 "Average Difference" CB 29 6.762 -3.146 6.092 18783 24 1 4 "Average Difference" HN 29 0.664 0.271 0.617 18783 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18783 26 1 5 "Average Difference" HA 39 0.442 0.209 0.395 18783 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18783 28 1 5 "Average Difference" CA 34 2.375 0.872 2.243 18783 29 1 5 "Average Difference" CB 29 6.782 -3.168 6.102 18783 30 1 5 "Average Difference" HN 29 0.666 0.273 0.618 18783 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18783 32 1 6 "Average Difference" HA 39 0.436 0.201 0.391 18783 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18783 34 1 6 "Average Difference" CA 34 2.368 0.919 2.215 18783 35 1 6 "Average Difference" CB 29 6.813 -3.172 6.136 18783 36 1 6 "Average Difference" HN 29 0.668 0.262 0.625 18783 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18783 38 1 7 "Average Difference" HA 39 0.445 0.207 0.399 18783 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18783 40 1 7 "Average Difference" CA 34 2.368 0.877 2.233 18783 41 1 7 "Average Difference" CB 29 6.784 -3.179 6.099 18783 42 1 7 "Average Difference" HN 29 0.675 0.268 0.630 18783 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18783 44 1 8 "Average Difference" HA 39 0.432 0.198 0.389 18783 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18783 46 1 8 "Average Difference" CA 34 2.356 0.933 2.196 18783 47 1 8 "Average Difference" CB 29 6.832 -3.209 6.138 18783 48 1 8 "Average Difference" HN 29 0.681 0.269 0.637 18783 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18783 50 1 9 "Average Difference" HA 39 0.436 0.202 0.392 18783 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18783 52 1 9 "Average Difference" CA 34 2.378 0.929 2.222 18783 53 1 9 "Average Difference" CB 29 6.798 -3.201 6.103 18783 54 1 9 "Average Difference" HN 29 0.678 0.260 0.637 18783 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18783 56 1 10 "Average Difference" HA 39 0.432 0.199 0.388 18783 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18783 58 1 10 "Average Difference" CA 34 2.363 0.916 2.211 18783 59 1 10 "Average Difference" CB 29 6.835 -3.179 6.157 18783 60 1 10 "Average Difference" HN 29 0.675 0.262 0.633 18783 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18783 62 1 11 "Average Difference" HA 39 0.439 0.207 0.392 18783 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18783 64 1 11 "Average Difference" CA 34 2.369 0.913 2.219 18783 65 1 11 "Average Difference" CB 29 6.817 -3.171 6.141 18783 66 1 11 "Average Difference" HN 29 0.670 0.251 0.632 18783 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18783 68 1 12 "Average Difference" HA 39 0.433 0.201 0.388 18783 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18783 70 1 12 "Average Difference" CA 34 2.385 0.930 2.230 18783 71 1 12 "Average Difference" CB 29 6.826 -3.175 6.150 18783 72 1 12 "Average Difference" HN 29 0.673 0.259 0.632 18783 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18783 74 1 13 "Average Difference" HA 39 0.439 0.211 0.390 18783 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18783 76 1 13 "Average Difference" CA 34 2.379 0.939 2.219 18783 77 1 13 "Average Difference" CB 29 6.781 -3.157 6.108 18783 78 1 13 "Average Difference" HN 29 0.659 0.255 0.619 18783 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18783 80 1 14 "Average Difference" HA 39 0.435 0.206 0.388 18783 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18783 82 1 14 "Average Difference" CA 34 2.369 0.925 2.214 18783 83 1 14 "Average Difference" CB 29 6.822 -3.185 6.139 18783 84 1 14 "Average Difference" HN 29 0.669 0.260 0.627 18783 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18783 86 1 15 "Average Difference" HA 39 0.439 0.211 0.390 18783 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18783 88 1 15 "Average Difference" CA 34 2.380 0.910 2.233 18783 89 1 15 "Average Difference" CB 29 6.757 -3.161 6.078 18783 90 1 15 "Average Difference" HN 29 0.654 0.255 0.613 18783 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18783 92 1 16 "Average Difference" HA 39 0.431 0.205 0.384 18783 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18783 94 1 16 "Average Difference" CA 34 2.360 0.912 2.209 18783 95 1 16 "Average Difference" CB 29 6.770 -3.144 6.102 18783 96 1 16 "Average Difference" HN 29 0.653 0.247 0.616 18783 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18783 98 1 17 "Average Difference" HA 39 0.444 0.213 0.395 18783 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18783 100 1 17 "Average Difference" CA 34 2.387 0.891 2.248 18783 101 1 17 "Average Difference" CB 29 6.762 -3.218 6.052 18783 102 1 17 "Average Difference" HN 29 0.667 0.282 0.615 18783 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18783 104 1 18 "Average Difference" HA 39 0.433 0.208 0.385 18783 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18783 106 1 18 "Average Difference" CA 34 2.368 0.907 2.220 18783 107 1 18 "Average Difference" CB 29 6.796 -3.168 6.118 18783 108 1 18 "Average Difference" HN 29 0.669 0.244 0.634 18783 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18783 110 1 19 "Average Difference" HA 39 0.429 0.207 0.381 18783 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18783 112 1 19 "Average Difference" CA 34 2.404 0.900 2.262 18783 113 1 19 "Average Difference" CB 29 6.818 -3.215 6.119 18783 114 1 19 "Average Difference" HN 29 0.667 0.245 0.632 18783 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18783 116 1 20 "Average Difference" HA 39 0.438 0.208 0.390 18783 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18783 118 1 20 "Average Difference" CA 34 2.393 0.897 2.252 18783 119 1 20 "Average Difference" CB 29 6.777 -3.198 6.081 18783 120 1 20 "Average Difference" HN 29 0.669 0.276 0.620 18783 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 18783 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 CYS HA H 3 4.524 4.524 4.684 -0.160 18783 2 1 . 1 1 3 3 CYS CA C 3 53.061 53.061 58.131 -5.070 18783 3 1 . 1 1 3 3 CYS CB C 3 43.713 43.713 28.340 15.373 18783 4 1 . 1 1 3 3 CYS H H 3 7.424 7.424 7.379 0.045 18783 5 1 . 1 1 4 4 ALA HA H 4 4.245 4.245 4.961 -0.716 18783 6 1 . 1 1 4 4 ALA CA C 4 50.669 50.669 50.598 0.071 18783 7 1 . 1 1 4 4 ALA CB C 4 21.598 21.598 21.925 -0.327 18783 8 1 . 1 1 4 4 ALA H H 4 8.691 8.691 7.948 0.743 18783 9 1 . 1 1 5 5 PHE HA H 5 4.551 4.551 4.509 0.042 18783 10 1 . 1 1 5 5 PHE CA C 5 53.409 53.409 57.236 -3.827 18783 11 1 . 1 1 5 5 PHE CB C 5 39.896 39.896 41.646 -1.750 18783 12 1 . 1 1 6 6 GLU HA H 6 3.340 3.340 4.277 -0.937 18783 13 1 . 1 1 6 6 GLU CA C 6 57.472 57.472 57.788 -0.316 18783 14 1 . 1 1 6 6 GLU CB C 6 29.012 29.012 29.919 -0.908 18783 15 1 . 1 1 6 6 GLU H H 6 8.221 8.221 8.366 -0.145 18783 16 1 . 1 1 7 7 GLY CA C 7 45.431 45.431 44.910 0.521 18783 17 1 . 1 1 7 7 GLY H H 7 8.717 8.717 8.640 0.077 18783 18 1 . 1 1 8 8 GLU HA H 8 4.316 4.316 4.558 -0.242 18783 19 1 . 1 1 8 8 GLU CA C 8 54.126 54.126 54.992 -0.866 18783 20 1 . 1 1 8 8 GLU CB C 8 32.851 32.851 32.018 0.833 18783 21 1 . 1 1 8 8 GLU H H 8 7.304 7.304 7.648 -0.344 18783 22 1 . 1 1 9 9 SER HA H 9 4.728 4.728 5.456 -0.728 18783 23 1 . 1 1 9 9 SER CA C 9 58.770 58.770 57.556 1.214 18783 24 1 . 1 1 9 9 SER CB C 9 64.148 64.148 63.323 0.825 18783 25 1 . 1 1 9 9 SER H H 9 8.066 8.066 8.432 -0.366 18783 26 1 . 1 1 10 10 CYS HA H 10 5.048 5.048 4.849 0.199 18783 27 1 . 1 1 10 10 CYS CA C 10 52.824 52.824 55.934 -3.110 18783 28 1 . 1 1 10 10 CYS CB C 10 49.151 49.151 31.590 17.561 18783 29 1 . 1 1 10 10 CYS H H 10 8.073 8.073 9.153 -1.081 18783 30 1 . 1 1 11 11 ASN HA H 11 5.064 5.064 5.185 -0.121 18783 31 1 . 1 1 11 11 ASN CA C 11 52.811 52.811 52.378 0.433 18783 32 1 . 1 1 11 11 ASN CB C 11 42.653 42.653 40.339 2.314 18783 33 1 . 1 1 11 11 ASN H H 11 8.092 8.092 8.602 -0.510 18783 34 1 . 1 1 12 12 VAL HA H 12 3.547 3.547 4.222 -0.675 18783 35 1 . 1 1 12 12 VAL CA C 12 65.361 65.361 62.372 2.989 18783 36 1 . 1 1 12 12 VAL CB C 12 31.332 31.332 31.200 0.132 18783 37 1 . 1 1 12 12 VAL H H 12 8.440 8.440 8.136 0.304 18783 38 1 . 1 1 13 13 GLU HA H 13 4.191 4.191 4.341 -0.150 18783 39 1 . 1 1 13 13 GLU CA C 13 56.098 56.098 57.662 -1.564 18783 40 1 . 1 1 13 13 GLU CB C 13 29.580 29.580 30.981 -1.401 18783 41 1 . 1 1 13 13 GLU H H 13 7.542 7.542 8.203 -0.661 18783 42 1 . 1 1 14 14 PHE HA H 14 4.486 4.486 4.648 -0.162 18783 43 1 . 1 1 14 14 PHE CA C 14 57.897 57.897 57.967 -0.070 18783 44 1 . 1 1 14 14 PHE CB C 14 41.999 41.999 39.836 2.163 18783 45 1 . 1 1 14 14 PHE H H 14 7.461 7.461 6.835 0.626 18783 46 1 . 1 1 15 15 TYR HA H 15 4.519 4.519 4.990 -0.471 18783 47 1 . 1 1 15 15 TYR CA C 15 56.149 56.149 54.912 1.237 18783 48 1 . 1 1 15 15 TYR CB C 15 39.039 39.039 38.986 0.053 18783 49 1 . 1 1 15 15 TYR H H 15 8.283 8.283 7.331 0.952 18783 50 1 . 1 1 16 16 PRO HA H 16 4.159 4.159 4.703 -0.544 18783 51 1 . 1 1 16 16 PRO CA C 16 62.079 62.079 62.297 -0.218 18783 52 1 . 1 1 16 16 PRO CB C 16 31.985 31.985 32.887 -0.902 18783 53 1 . 1 1 17 17 CYS HA H 17 4.533 4.533 4.256 0.277 18783 54 1 . 1 1 17 17 CYS CA C 17 55.788 55.788 59.468 -3.680 18783 55 1 . 1 1 17 17 CYS CB C 17 40.604 40.604 27.665 12.939 18783 56 1 . 1 1 17 17 CYS H H 17 8.030 8.030 8.262 -0.232 18783 57 1 . 1 1 18 18 CYS HA H 18 4.634 4.634 4.524 0.110 18783 58 1 . 1 1 18 18 CYS CA C 18 52.026 52.026 57.941 -5.915 18783 59 1 . 1 1 18 18 CYS CB C 18 39.573 39.573 25.954 13.619 18783 60 1 . 1 1 18 18 CYS H H 18 8.804 8.804 8.328 0.476 18783 61 1 . 1 1 19 19 PRO HA H 19 4.506 4.506 4.293 0.213 18783 62 1 . 1 1 19 19 PRO CA C 19 64.318 64.318 63.280 1.038 18783 63 1 . 1 1 19 19 PRO CB C 19 31.693 31.693 32.293 -0.600 18783 64 1 . 1 1 20 20 GLY CA C 20 45.927 45.927 44.980 0.947 18783 65 1 . 1 1 20 20 GLY H H 20 8.797 8.797 8.659 0.138 18783 66 1 . 1 1 21 21 LEU HA H 21 4.289 4.289 4.371 -0.082 18783 67 1 . 1 1 21 21 LEU CA C 21 53.036 53.036 55.602 -2.566 18783 68 1 . 1 1 21 21 LEU CB C 21 41.762 41.762 42.866 -1.104 18783 69 1 . 1 1 21 21 LEU H H 21 6.553 6.553 7.671 -1.118 18783 70 1 . 1 1 22 22 GLY CA C 22 45.766 45.766 44.630 1.136 18783 71 1 . 1 1 22 22 GLY H H 22 7.843 7.843 7.740 0.103 18783 72 1 . 1 1 23 23 LEU HA H 23 5.104 5.104 5.209 -0.105 18783 73 1 . 1 1 23 23 LEU CA C 23 52.230 52.230 53.601 -1.371 18783 74 1 . 1 1 23 23 LEU CB C 23 45.956 45.956 42.760 3.196 18783 75 1 . 1 1 23 23 LEU H H 23 6.269 6.269 7.413 -1.144 18783 76 1 . 1 1 24 24 THR HA H 24 4.337 4.337 4.451 -0.114 18783 77 1 . 1 1 24 24 THR CA C 24 59.771 59.771 60.600 -0.829 18783 78 1 . 1 1 24 24 THR CB C 24 70.307 70.307 71.065 -0.758 18783 79 1 . 1 1 24 24 THR H H 24 8.542 8.542 8.716 -0.174 18783 80 1 . 1 1 25 25 CYS HA H 25 4.423 4.423 4.796 -0.373 18783 81 1 . 1 1 25 25 CYS CA C 25 54.919 54.919 58.902 -3.983 18783 82 1 . 1 1 25 25 CYS CB C 25 39.336 39.336 27.256 12.080 18783 83 1 . 1 1 25 25 CYS H H 25 7.102 7.102 8.930 -1.828 18783 84 1 . 1 1 26 26 ILE HA H 26 4.417 4.417 4.616 -0.199 18783 85 1 . 1 1 26 26 ILE CA C 26 55.784 55.784 57.483 -1.699 18783 86 1 . 1 1 26 26 ILE CB C 26 39.794 39.794 39.353 0.441 18783 87 1 . 1 1 26 26 ILE H H 26 8.296 8.296 8.897 -0.601 18783 88 1 . 1 1 27 27 PRO HA H 27 4.295 4.295 4.419 -0.124 18783 89 1 . 1 1 27 27 PRO CA C 27 64.106 64.106 63.779 0.327 18783 90 1 . 1 1 27 27 PRO CB C 27 33.966 33.966 32.388 1.578 18783 91 1 . 1 1 28 28 GLY CA C 28 46.610 46.610 45.308 1.302 18783 92 1 . 1 1 28 28 GLY H H 28 7.219 7.219 7.761 -0.542 18783 93 1 . 1 1 29 29 ASN HA H 29 4.895 4.895 4.978 -0.083 18783 94 1 . 1 1 29 29 ASN CA C 29 50.211 50.211 51.125 -0.914 18783 95 1 . 1 1 29 29 ASN CB C 29 39.545 39.545 39.431 0.114 18783 96 1 . 1 1 29 29 ASN H H 29 7.452 7.452 8.102 -0.650 18783 97 1 . 1 1 30 30 PRO HA H 30 4.217 4.217 4.375 -0.158 18783 98 1 . 1 1 30 30 PRO CA C 30 63.046 63.046 64.249 -1.203 18783 99 1 . 1 1 30 30 PRO CB C 30 34.331 34.331 32.531 1.800 18783 100 1 . 1 1 31 31 ASP HA H 31 5.630 5.630 4.958 0.672 18783 101 1 . 1 1 31 31 ASP CA C 31 51.560 51.560 52.705 -1.145 18783 102 1 . 1 1 31 31 ASP CB C 31 41.579 41.579 44.363 -2.784 18783 103 1 . 1 1 31 31 ASP H H 31 7.854 7.854 7.643 0.211 18783 104 1 . 1 1 32 32 GLY CA C 32 47.102 47.102 44.343 2.759 18783 105 1 . 1 1 32 32 GLY H H 32 7.902 7.902 8.917 -1.014 18783 106 1 . 1 1 33 33 THR HA H 33 4.791 4.791 5.144 -0.353 18783 107 1 . 1 1 33 33 THR CA C 33 61.391 61.391 60.181 1.210 18783 108 1 . 1 1 33 33 THR CB C 33 71.350 71.350 69.803 1.547 18783 109 1 . 1 1 33 33 THR H H 33 8.388 8.388 8.365 0.022 18783 110 1 . 1 1 34 34 CYS HA H 34 5.026 5.026 4.541 0.485 18783 111 1 . 1 1 34 34 CYS CA C 34 54.902 54.902 59.636 -4.734 18783 112 1 . 1 1 34 34 CYS CB C 34 40.910 40.910 25.153 15.756 18783 113 1 . 1 1 34 34 CYS H H 34 8.342 8.342 8.811 -0.469 18783 114 1 . 1 1 35 35 TYR HA H 35 4.627 4.627 4.802 -0.175 18783 115 1 . 1 1 35 35 TYR CA C 35 56.073 56.073 56.134 -0.061 18783 116 1 . 1 1 35 35 TYR CB C 35 41.999 41.999 41.793 0.206 18783 117 1 . 1 1 35 35 TYR H H 35 8.976 8.976 9.158 -0.182 18783 118 1 . 1 1 36 36 TYR HA H 36 4.617 4.617 4.663 -0.046 18783 119 1 . 1 1 36 36 TYR CA C 36 57.167 57.167 60.154 -2.987 18783 120 1 . 1 1 36 36 TYR CB C 36 39.064 39.064 38.848 0.216 18783 121 1 . 1 1 36 36 TYR H H 36 8.567 8.567 8.823 -0.256 18783 stop_ save_