data_19570 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19570 _Entry.PDB_ID 2MFS 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 19570 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.771 0.039 19570 2 1 1 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.854 0.184 19570 3 1 1 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.047 0.377 19570 4 1 1 . 1 1 2 2 VAL H H 2 8.976 8.976 8.924 0.052 19570 5 1 1 . 1 1 3 3 LEU HA H 3 4.432 4.432 5.051 -0.619 19570 6 1 1 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.396 0.743 19570 7 1 1 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.608 -0.950 19570 8 1 1 . 1 1 3 3 LEU H H 3 7.973 7.973 9.107 -1.134 19570 9 1 1 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.763 -0.270 19570 10 1 1 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.443 0.686 19570 11 1 1 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.269 1.167 19570 12 1 1 . 1 1 4 4 ILE H H 4 8.340 8.340 8.703 -0.363 19570 13 1 1 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.880 -0.131 19570 14 1 1 . 1 1 5 5 GLY H H 5 9.146 9.146 9.058 0.088 19570 15 1 1 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.507 -0.015 19570 16 1 1 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.727 0.073 19570 17 1 1 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.231 -0.598 19570 18 1 1 . 1 1 6 6 GLN H H 6 8.233 8.233 7.715 0.518 19570 19 1 1 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.682 0.101 19570 20 1 1 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.714 -1.553 19570 21 1 1 . 1 1 7 7 ARG H H 7 8.123 8.123 8.524 -0.401 19570 22 1 1 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.794 0.093 19570 23 1 1 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.615 -3.670 19570 24 1 1 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.172 17.405 19570 25 1 1 . 1 1 8 8 CYS H H 8 8.013 8.013 8.731 -0.718 19570 26 1 1 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.871 -0.490 19570 27 1 1 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.630 0.636 19570 28 1 1 . 1 1 9 9 ASP CB C 9 43.113 43.113 43.786 -0.673 19570 29 1 1 . 1 1 9 9 ASP H H 9 8.432 8.432 8.579 -0.147 19570 30 1 1 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.360 0.153 19570 31 1 1 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.481 -1.443 19570 32 1 1 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.675 -0.499 19570 33 1 1 . 1 1 10 10 ASN H H 10 9.082 9.082 8.875 0.207 19570 34 1 1 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.725 -0.061 19570 35 1 1 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.100 -0.579 19570 36 1 1 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.498 -2.042 19570 37 1 1 . 1 1 11 11 ASP H H 11 8.418 8.418 7.784 0.634 19570 38 1 1 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.425 -0.104 19570 39 1 1 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.626 -0.698 19570 40 1 1 . 1 1 12 12 ARG H H 12 8.191 8.191 8.867 -0.676 19570 41 1 1 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.004 0.216 19570 42 1 1 . 1 1 13 13 GLY H H 13 7.410 7.410 7.800 -0.390 19570 43 1 1 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.621 -0.124 19570 44 1 1 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.063 1.603 19570 45 1 1 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.621 -0.208 19570 46 1 1 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.637 -0.193 19570 47 1 1 . 1 1 15 15 ARG H H 15 8.632 8.632 8.499 0.133 19570 48 1 1 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.073 -0.503 19570 49 1 1 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.238 -3.548 19570 50 1 1 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.476 12.981 19570 51 1 1 . 1 1 16 16 CYS H H 16 8.968 8.968 8.575 0.393 19570 52 1 1 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.506 0.058 19570 53 1 1 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.862 -6.367 19570 54 1 1 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.220 11.266 19570 55 1 1 . 1 1 17 17 CYS H H 17 10.147 10.147 8.815 1.332 19570 56 1 1 . 1 1 18 18 SER HA H 18 4.219 4.219 4.210 0.009 19570 57 1 1 . 1 1 18 18 SER CA C 18 60.065 60.065 60.763 -0.698 19570 58 1 1 . 1 1 18 18 SER CB C 18 62.259 62.259 63.360 -1.101 19570 59 1 1 . 1 1 18 18 SER H H 18 8.943 8.943 8.852 0.091 19570 60 1 1 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.927 0.484 19570 61 1 1 . 1 1 19 19 GLY H H 19 8.946 8.946 8.097 0.849 19570 62 1 1 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.656 -0.376 19570 63 1 1 . 1 1 20 20 GLN CA C 20 52.605 52.605 56.420 -3.815 19570 64 1 1 . 1 1 20 20 GLN H H 20 7.902 7.902 8.188 -0.286 19570 65 1 1 . 1 1 21 21 GLY CA C 21 44.825 44.825 45.571 -0.746 19570 66 1 1 . 1 1 21 21 GLY H H 21 7.685 7.685 7.557 0.128 19570 67 1 1 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.891 0.046 19570 68 1 1 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.647 -0.813 19570 69 1 1 . 1 1 22 22 ASN CB C 22 41.252 41.252 40.876 0.376 19570 70 1 1 . 1 1 22 22 ASN H H 22 8.318 8.318 8.592 -0.274 19570 71 1 1 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.646 0.025 19570 72 1 1 . 1 1 23 23 CYS CA C 23 51.888 51.888 57.853 -5.965 19570 73 1 1 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.866 12.499 19570 74 1 1 . 1 1 23 23 CYS H H 23 8.956 8.956 8.773 0.183 19570 75 1 1 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.418 0.079 19570 76 1 1 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.135 1.764 19570 77 1 1 . 1 1 24 24 VAL H H 24 8.895 8.895 9.068 -0.173 19570 78 1 1 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.644 -0.145 19570 79 1 1 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.740 0.040 19570 80 1 1 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.420 4.441 19570 81 1 1 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.064 -0.080 19570 82 1 1 . 1 1 26 26 LEU H H 26 8.145 8.145 7.852 0.293 19570 83 1 1 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.161 -0.148 19570 84 1 1 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.588 -1.476 19570 85 1 1 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.855 -0.191 19570 86 1 1 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.694 -0.507 19570 87 1 1 . 1 1 28 28 PHE CA C 28 60.859 60.859 57.970 2.889 19570 88 1 1 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.212 -0.513 19570 89 1 1 . 1 1 28 28 PHE H H 28 8.364 8.364 7.031 1.333 19570 90 1 1 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.358 0.002 19570 91 1 1 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.067 0.505 19570 92 1 1 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.408 2.619 19570 93 1 1 . 1 1 29 29 LEU H H 29 8.239 8.239 7.485 0.754 19570 94 1 1 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.185 -0.531 19570 95 1 1 . 1 1 30 30 GLY H H 30 7.976 7.976 7.877 0.099 19570 96 1 1 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.392 0.737 19570 97 1 1 . 1 1 31 31 GLY H H 31 8.061 8.061 7.684 0.377 19570 98 1 1 . 1 1 32 32 VAL HA H 32 4.835 4.835 4.791 0.044 19570 99 1 1 . 1 1 32 32 VAL CA C 32 60.065 60.065 60.275 -0.210 19570 100 1 1 . 1 1 32 32 VAL CB C 32 36.485 36.485 36.465 0.020 19570 101 1 1 . 1 1 32 32 VAL H H 32 8.601 8.601 8.830 -0.229 19570 102 1 1 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.032 -0.090 19570 103 1 1 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.428 -2.037 19570 104 1 1 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.934 14.364 19570 105 1 1 . 1 1 33 33 CYS H H 33 7.979 7.979 8.347 -0.368 19570 106 1 1 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.902 -0.148 19570 107 1 1 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.699 1.130 19570 108 1 1 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.917 0.686 19570 109 1 1 . 1 1 34 34 ALA H H 34 9.715 9.715 8.982 0.733 19570 110 1 2 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.595 0.215 19570 111 1 2 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.500 -0.462 19570 112 1 2 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.820 0.604 19570 113 1 2 . 1 1 2 2 VAL H H 2 8.976 8.976 8.898 0.078 19570 114 1 2 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.504 -0.072 19570 115 1 2 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.897 0.242 19570 116 1 2 . 1 1 3 3 LEU CB C 3 42.658 42.658 42.967 -0.309 19570 117 1 2 . 1 1 3 3 LEU H H 3 7.973 7.973 8.355 -0.382 19570 118 1 2 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.735 -0.242 19570 119 1 2 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.562 0.567 19570 120 1 2 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.423 1.013 19570 121 1 2 . 1 1 4 4 ILE H H 4 8.340 8.340 8.694 -0.354 19570 122 1 2 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.957 -0.208 19570 123 1 2 . 1 1 5 5 GLY H H 5 9.146 9.146 9.051 0.095 19570 124 1 2 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.429 0.063 19570 125 1 2 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.791 0.009 19570 126 1 2 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.095 -0.462 19570 127 1 2 . 1 1 6 6 GLN H H 6 8.233 8.233 7.577 0.656 19570 128 1 2 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.952 -0.169 19570 129 1 2 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.316 -2.155 19570 130 1 2 . 1 1 7 7 ARG H H 7 8.123 8.123 8.499 -0.376 19570 131 1 2 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.143 -0.256 19570 132 1 2 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.762 -2.817 19570 133 1 2 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.413 17.164 19570 134 1 2 . 1 1 8 8 CYS H H 8 8.013 8.013 8.903 -0.890 19570 135 1 2 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.868 -0.487 19570 136 1 2 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.969 0.297 19570 137 1 2 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.253 -1.140 19570 138 1 2 . 1 1 9 9 ASP H H 9 8.432 8.432 8.553 -0.121 19570 139 1 2 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.530 -0.017 19570 140 1 2 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.806 -0.768 19570 141 1 2 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.841 -0.665 19570 142 1 2 . 1 1 10 10 ASN H H 10 9.082 9.082 8.771 0.311 19570 143 1 2 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.584 0.080 19570 144 1 2 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.993 -1.472 19570 145 1 2 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.267 -1.810 19570 146 1 2 . 1 1 11 11 ASP H H 11 8.418 8.418 7.964 0.454 19570 147 1 2 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.474 -0.153 19570 148 1 2 . 1 1 12 12 ARG CA C 12 55.928 55.928 55.978 -0.050 19570 149 1 2 . 1 1 12 12 ARG H H 12 8.191 8.191 8.984 -0.793 19570 150 1 2 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.017 0.203 19570 151 1 2 . 1 1 13 13 GLY H H 13 7.410 7.410 7.542 -0.132 19570 152 1 2 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.637 -0.140 19570 153 1 2 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.992 1.674 19570 154 1 2 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.544 -0.131 19570 155 1 2 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.131 -0.687 19570 156 1 2 . 1 1 15 15 ARG H H 15 8.632 8.632 8.496 0.136 19570 157 1 2 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.213 -0.643 19570 158 1 2 . 1 1 16 16 CYS CA C 16 55.690 55.690 58.837 -3.147 19570 159 1 2 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.521 12.936 19570 160 1 2 . 1 1 16 16 CYS H H 16 8.968 8.968 8.527 0.441 19570 161 1 2 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.544 0.020 19570 162 1 2 . 1 1 17 17 CYS CA C 17 53.495 53.495 58.496 -5.002 19570 163 1 2 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.207 11.279 19570 164 1 2 . 1 1 17 17 CYS H H 17 10.147 10.147 8.908 1.239 19570 165 1 2 . 1 1 18 18 SER HA H 18 4.219 4.219 4.201 0.018 19570 166 1 2 . 1 1 18 18 SER CA C 18 60.065 60.065 60.017 0.048 19570 167 1 2 . 1 1 18 18 SER CB C 18 62.259 62.259 62.969 -0.710 19570 168 1 2 . 1 1 18 18 SER H H 18 8.943 8.943 8.595 0.348 19570 169 1 2 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.161 0.250 19570 170 1 2 . 1 1 19 19 GLY H H 19 8.946 8.946 8.971 -0.025 19570 171 1 2 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.585 -0.305 19570 172 1 2 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.685 -2.080 19570 173 1 2 . 1 1 20 20 GLN H H 20 7.902 7.902 8.063 -0.161 19570 174 1 2 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.849 -0.024 19570 175 1 2 . 1 1 21 21 GLY H H 21 7.685 7.685 8.036 -0.351 19570 176 1 2 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.043 -0.106 19570 177 1 2 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.669 -0.836 19570 178 1 2 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.121 -0.869 19570 179 1 2 . 1 1 22 22 ASN H H 22 8.318 8.318 8.437 -0.119 19570 180 1 2 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.723 -0.052 19570 181 1 2 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.118 -6.230 19570 182 1 2 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.857 12.508 19570 183 1 2 . 1 1 23 23 CYS H H 23 8.956 8.956 8.789 0.167 19570 184 1 2 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.462 0.035 19570 185 1 2 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.521 1.378 19570 186 1 2 . 1 1 24 24 VAL H H 24 8.895 8.895 9.107 -0.212 19570 187 1 2 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.635 -0.136 19570 188 1 2 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.761 0.019 19570 189 1 2 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.311 4.550 19570 190 1 2 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.784 -0.800 19570 191 1 2 . 1 1 26 26 LEU H H 26 8.145 8.145 7.957 0.188 19570 192 1 2 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.155 -0.142 19570 193 1 2 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.839 -1.727 19570 194 1 2 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.856 -0.192 19570 195 1 2 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.594 -0.407 19570 196 1 2 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.673 2.186 19570 197 1 2 . 1 1 28 28 PHE CB C 28 37.698 37.698 37.947 -0.249 19570 198 1 2 . 1 1 28 28 PHE H H 28 8.364 8.364 7.091 1.273 19570 199 1 2 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.361 -0.001 19570 200 1 2 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.086 0.486 19570 201 1 2 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.777 2.250 19570 202 1 2 . 1 1 29 29 LEU H H 29 8.239 8.239 7.397 0.842 19570 203 1 2 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.340 -0.687 19570 204 1 2 . 1 1 30 30 GLY H H 30 7.976 7.976 8.138 -0.162 19570 205 1 2 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.451 0.678 19570 206 1 2 . 1 1 31 31 GLY H H 31 8.061 8.061 7.740 0.321 19570 207 1 2 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.244 -0.409 19570 208 1 2 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.721 1.344 19570 209 1 2 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.462 1.023 19570 210 1 2 . 1 1 32 32 VAL H H 32 8.601 8.601 8.838 -0.237 19570 211 1 2 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.087 -0.145 19570 212 1 2 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.692 -2.301 19570 213 1 2 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.854 14.444 19570 214 1 2 . 1 1 33 33 CYS H H 33 7.979 7.979 8.305 -0.326 19570 215 1 2 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.925 -0.171 19570 216 1 2 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.719 1.110 19570 217 1 2 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.001 0.602 19570 218 1 2 . 1 1 34 34 ALA H H 34 9.715 9.715 9.003 0.712 19570 219 1 3 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.712 0.098 19570 220 1 3 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.933 0.105 19570 221 1 3 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.886 0.538 19570 222 1 3 . 1 1 2 2 VAL H H 2 8.976 8.976 8.851 0.125 19570 223 1 3 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.995 -0.563 19570 224 1 3 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.281 0.858 19570 225 1 3 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.602 -0.944 19570 226 1 3 . 1 1 3 3 LEU H H 3 7.973 7.973 8.014 -0.041 19570 227 1 3 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.719 -0.226 19570 228 1 3 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.703 0.426 19570 229 1 3 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.156 1.280 19570 230 1 3 . 1 1 4 4 ILE H H 4 8.340 8.340 8.636 -0.296 19570 231 1 3 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.926 -0.177 19570 232 1 3 . 1 1 5 5 GLY H H 5 9.146 9.146 9.065 0.081 19570 233 1 3 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.385 0.107 19570 234 1 3 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.979 -0.179 19570 235 1 3 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.962 -0.329 19570 236 1 3 . 1 1 6 6 GLN H H 6 8.233 8.233 7.621 0.612 19570 237 1 3 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.978 -0.195 19570 238 1 3 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.181 -2.020 19570 239 1 3 . 1 1 7 7 ARG H H 7 8.123 8.123 8.496 -0.373 19570 240 1 3 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.197 -0.310 19570 241 1 3 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.145 -3.200 19570 242 1 3 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.582 16.995 19570 243 1 3 . 1 1 8 8 CYS H H 8 8.013 8.013 8.829 -0.816 19570 244 1 3 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.922 -0.541 19570 245 1 3 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.891 0.375 19570 246 1 3 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.551 -1.438 19570 247 1 3 . 1 1 9 9 ASP H H 9 8.432 8.432 8.541 -0.109 19570 248 1 3 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.351 0.162 19570 249 1 3 . 1 1 10 10 ASN CA C 10 55.038 55.038 57.094 -2.056 19570 250 1 3 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.679 -0.503 19570 251 1 3 . 1 1 10 10 ASN H H 10 9.082 9.082 8.861 0.221 19570 252 1 3 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.749 -0.085 19570 253 1 3 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.168 -0.647 19570 254 1 3 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.307 -1.850 19570 255 1 3 . 1 1 11 11 ASP H H 11 8.418 8.418 7.861 0.557 19570 256 1 3 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.403 -0.082 19570 257 1 3 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.641 -0.713 19570 258 1 3 . 1 1 12 12 ARG H H 12 8.191 8.191 8.852 -0.661 19570 259 1 3 . 1 1 13 13 GLY CA C 13 44.220 44.220 43.972 0.248 19570 260 1 3 . 1 1 13 13 GLY H H 13 7.410 7.410 7.776 -0.366 19570 261 1 3 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.590 -0.093 19570 262 1 3 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.905 1.761 19570 263 1 3 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.558 -0.145 19570 264 1 3 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.053 -0.609 19570 265 1 3 . 1 1 15 15 ARG H H 15 8.632 8.632 8.411 0.221 19570 266 1 3 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.132 -0.562 19570 267 1 3 . 1 1 16 16 CYS CA C 16 55.690 55.690 58.786 -3.096 19570 268 1 3 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.852 12.604 19570 269 1 3 . 1 1 16 16 CYS H H 16 8.968 8.968 8.406 0.562 19570 270 1 3 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.470 0.094 19570 271 1 3 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.728 -6.233 19570 272 1 3 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.811 11.675 19570 273 1 3 . 1 1 17 17 CYS H H 17 10.147 10.147 8.916 1.231 19570 274 1 3 . 1 1 18 18 SER HA H 18 4.219 4.219 4.134 0.085 19570 275 1 3 . 1 1 18 18 SER CA C 18 60.065 60.065 61.447 -1.382 19570 276 1 3 . 1 1 18 18 SER CB C 18 62.259 62.259 63.231 -0.972 19570 277 1 3 . 1 1 18 18 SER H H 18 8.943 8.943 8.903 0.040 19570 278 1 3 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.126 0.285 19570 279 1 3 . 1 1 19 19 GLY H H 19 8.946 8.946 8.288 0.658 19570 280 1 3 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.513 -0.233 19570 281 1 3 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.133 -1.528 19570 282 1 3 . 1 1 20 20 GLN H H 20 7.902 7.902 7.567 0.335 19570 283 1 3 . 1 1 21 21 GLY CA C 21 44.825 44.825 45.068 -0.243 19570 284 1 3 . 1 1 21 21 GLY H H 21 7.685 7.685 8.125 -0.440 19570 285 1 3 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.926 0.011 19570 286 1 3 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.257 -0.424 19570 287 1 3 . 1 1 22 22 ASN CB C 22 41.252 41.252 41.797 -0.545 19570 288 1 3 . 1 1 22 22 ASN H H 22 8.318 8.318 8.273 0.045 19570 289 1 3 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.706 -0.035 19570 290 1 3 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.435 -6.547 19570 291 1 3 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.762 12.603 19570 292 1 3 . 1 1 23 23 CYS H H 23 8.956 8.956 8.720 0.236 19570 293 1 3 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.676 -0.179 19570 294 1 3 . 1 1 24 24 VAL CB C 24 34.899 34.899 35.257 -0.358 19570 295 1 3 . 1 1 24 24 VAL H H 24 8.895 8.895 8.976 -0.081 19570 296 1 3 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.707 -0.208 19570 297 1 3 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.820 -0.040 19570 298 1 3 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.472 4.389 19570 299 1 3 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.925 0.059 19570 300 1 3 . 1 1 26 26 LEU H H 26 8.145 8.145 7.979 0.166 19570 301 1 3 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.054 -0.041 19570 302 1 3 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.578 -1.466 19570 303 1 3 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.627 0.037 19570 304 1 3 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.620 -0.433 19570 305 1 3 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.887 1.972 19570 306 1 3 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.643 -0.945 19570 307 1 3 . 1 1 28 28 PHE H H 28 8.364 8.364 7.818 0.546 19570 308 1 3 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.409 -0.049 19570 309 1 3 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.180 0.392 19570 310 1 3 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.918 2.109 19570 311 1 3 . 1 1 29 29 LEU H H 29 8.239 8.239 7.970 0.269 19570 312 1 3 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.975 -0.321 19570 313 1 3 . 1 1 30 30 GLY H H 30 7.976 7.976 8.478 -0.502 19570 314 1 3 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.406 0.723 19570 315 1 3 . 1 1 31 31 GLY H H 31 8.061 8.061 7.439 0.622 19570 316 1 3 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.339 -0.504 19570 317 1 3 . 1 1 32 32 VAL CA C 32 60.065 60.065 59.051 1.014 19570 318 1 3 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.586 0.899 19570 319 1 3 . 1 1 32 32 VAL H H 32 8.601 8.601 8.997 -0.396 19570 320 1 3 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.171 -0.229 19570 321 1 3 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.364 -1.972 19570 322 1 3 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.270 14.028 19570 323 1 3 . 1 1 33 33 CYS H H 33 7.979 7.979 8.292 -0.313 19570 324 1 3 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.846 -0.092 19570 325 1 3 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.097 0.732 19570 326 1 3 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.979 0.624 19570 327 1 3 . 1 1 34 34 ALA H H 34 9.715 9.715 8.869 0.846 19570 328 1 4 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.664 0.146 19570 329 1 4 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.071 -0.033 19570 330 1 4 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.706 0.718 19570 331 1 4 . 1 1 2 2 VAL H H 2 8.976 8.976 8.843 0.133 19570 332 1 4 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.607 -0.175 19570 333 1 4 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.516 0.623 19570 334 1 4 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.518 -0.860 19570 335 1 4 . 1 1 3 3 LEU H H 3 7.973 7.973 8.014 -0.041 19570 336 1 4 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.661 -0.168 19570 337 1 4 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.714 0.415 19570 338 1 4 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.181 1.255 19570 339 1 4 . 1 1 4 4 ILE H H 4 8.340 8.340 8.471 -0.131 19570 340 1 4 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.821 -0.072 19570 341 1 4 . 1 1 5 5 GLY H H 5 9.146 9.146 9.068 0.078 19570 342 1 4 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.432 0.060 19570 343 1 4 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.218 -0.418 19570 344 1 4 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.073 -0.440 19570 345 1 4 . 1 1 6 6 GLN H H 6 8.233 8.233 7.766 0.467 19570 346 1 4 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.878 -0.095 19570 347 1 4 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.567 -1.406 19570 348 1 4 . 1 1 7 7 ARG H H 7 8.123 8.123 8.319 -0.196 19570 349 1 4 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.791 0.096 19570 350 1 4 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.794 -3.849 19570 351 1 4 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.507 17.070 19570 352 1 4 . 1 1 8 8 CYS H H 8 8.013 8.013 8.839 -0.826 19570 353 1 4 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.908 -0.527 19570 354 1 4 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.682 0.584 19570 355 1 4 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.309 -1.196 19570 356 1 4 . 1 1 9 9 ASP H H 9 8.432 8.432 8.587 -0.155 19570 357 1 4 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.502 0.011 19570 358 1 4 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.371 -0.333 19570 359 1 4 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.391 -0.215 19570 360 1 4 . 1 1 10 10 ASN H H 10 9.082 9.082 8.838 0.244 19570 361 1 4 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.593 0.071 19570 362 1 4 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.116 -0.595 19570 363 1 4 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.402 -1.945 19570 364 1 4 . 1 1 11 11 ASP H H 11 8.418 8.418 7.875 0.543 19570 365 1 4 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.448 -0.127 19570 366 1 4 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.192 -0.264 19570 367 1 4 . 1 1 12 12 ARG H H 12 8.191 8.191 9.093 -0.902 19570 368 1 4 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.312 -0.092 19570 369 1 4 . 1 1 13 13 GLY H H 13 7.410 7.410 7.539 -0.129 19570 370 1 4 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.750 -0.253 19570 371 1 4 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.732 0.934 19570 372 1 4 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.815 -0.402 19570 373 1 4 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.545 -0.101 19570 374 1 4 . 1 1 15 15 ARG H H 15 8.632 8.632 8.371 0.261 19570 375 1 4 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.923 -0.353 19570 376 1 4 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.712 -4.021 19570 377 1 4 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.330 13.127 19570 378 1 4 . 1 1 16 16 CYS H H 16 8.968 8.968 8.609 0.359 19570 379 1 4 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.523 0.041 19570 380 1 4 . 1 1 17 17 CYS CA C 17 53.495 53.495 58.627 -5.132 19570 381 1 4 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.291 11.195 19570 382 1 4 . 1 1 17 17 CYS H H 17 10.147 10.147 8.974 1.173 19570 383 1 4 . 1 1 18 18 SER HA H 18 4.219 4.219 4.166 0.053 19570 384 1 4 . 1 1 18 18 SER CA C 18 60.065 60.065 60.266 -0.201 19570 385 1 4 . 1 1 18 18 SER CB C 18 62.259 62.259 62.877 -0.618 19570 386 1 4 . 1 1 18 18 SER H H 18 8.943 8.943 8.655 0.287 19570 387 1 4 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.054 0.357 19570 388 1 4 . 1 1 19 19 GLY H H 19 8.946 8.946 8.577 0.369 19570 389 1 4 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.564 -0.284 19570 390 1 4 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.783 -2.178 19570 391 1 4 . 1 1 20 20 GLN H H 20 7.902 7.902 8.151 -0.249 19570 392 1 4 . 1 1 21 21 GLY CA C 21 44.825 44.825 45.002 -0.177 19570 393 1 4 . 1 1 21 21 GLY H H 21 7.685 7.685 7.986 -0.301 19570 394 1 4 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.917 0.020 19570 395 1 4 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.268 -1.435 19570 396 1 4 . 1 1 22 22 ASN CB C 22 41.252 41.252 41.836 -0.584 19570 397 1 4 . 1 1 22 22 ASN H H 22 8.318 8.318 8.320 -0.002 19570 398 1 4 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.573 0.098 19570 399 1 4 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.627 -7.739 19570 400 1 4 . 1 1 23 23 CYS CB C 23 38.365 38.365 24.932 13.433 19570 401 1 4 . 1 1 23 23 CYS H H 23 8.956 8.956 8.963 -0.007 19570 402 1 4 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.402 0.095 19570 403 1 4 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.327 1.572 19570 404 1 4 . 1 1 24 24 VAL H H 24 8.895 8.895 8.922 -0.027 19570 405 1 4 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.713 -0.214 19570 406 1 4 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.873 -0.093 19570 407 1 4 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.306 4.555 19570 408 1 4 . 1 1 26 26 LEU CB C 26 42.984 42.984 44.585 -1.601 19570 409 1 4 . 1 1 26 26 LEU H H 26 8.145 8.145 8.457 -0.312 19570 410 1 4 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.536 -0.523 19570 411 1 4 . 1 1 27 27 PRO CA C 27 64.112 64.112 64.160 -0.048 19570 412 1 4 . 1 1 27 27 PRO CB C 27 31.664 31.664 30.085 1.579 19570 413 1 4 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.567 -0.380 19570 414 1 4 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.993 1.866 19570 415 1 4 . 1 1 28 28 PHE CB C 28 37.698 37.698 40.274 -2.576 19570 416 1 4 . 1 1 28 28 PHE H H 28 8.364 8.364 8.084 0.280 19570 417 1 4 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.552 -0.192 19570 418 1 4 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.642 0.930 19570 419 1 4 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.962 2.065 19570 420 1 4 . 1 1 29 29 LEU H H 29 8.239 8.239 8.150 0.089 19570 421 1 4 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.004 -0.350 19570 422 1 4 . 1 1 30 30 GLY H H 30 7.976 7.976 8.071 -0.095 19570 423 1 4 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.669 1.460 19570 424 1 4 . 1 1 31 31 GLY H H 31 8.061 8.061 7.580 0.481 19570 425 1 4 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.080 -0.245 19570 426 1 4 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.124 1.941 19570 427 1 4 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.122 1.363 19570 428 1 4 . 1 1 32 32 VAL H H 32 8.601 8.601 9.068 -0.467 19570 429 1 4 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.976 -0.034 19570 430 1 4 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.096 -2.705 19570 431 1 4 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.018 14.280 19570 432 1 4 . 1 1 33 33 CYS H H 33 7.979 7.979 8.658 -0.679 19570 433 1 4 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.758 -0.004 19570 434 1 4 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.091 0.738 19570 435 1 4 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.404 0.199 19570 436 1 4 . 1 1 34 34 ALA H H 34 9.715 9.715 9.023 0.692 19570 437 1 5 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.839 -0.029 19570 438 1 5 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.865 0.173 19570 439 1 5 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.248 0.176 19570 440 1 5 . 1 1 2 2 VAL H H 2 8.976 8.976 8.792 0.184 19570 441 1 5 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.634 -0.202 19570 442 1 5 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.399 0.740 19570 443 1 5 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.871 -1.213 19570 444 1 5 . 1 1 3 3 LEU H H 3 7.973 7.973 7.938 0.035 19570 445 1 5 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.906 -0.413 19570 446 1 5 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.626 0.503 19570 447 1 5 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.147 1.289 19570 448 1 5 . 1 1 4 4 ILE H H 4 8.340 8.340 8.637 -0.297 19570 449 1 5 . 1 1 5 5 GLY CA C 5 44.749 44.749 45.109 -0.360 19570 450 1 5 . 1 1 5 5 GLY H H 5 9.146 9.146 9.136 0.010 19570 451 1 5 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.607 -0.115 19570 452 1 5 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.371 0.429 19570 453 1 5 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.589 -0.956 19570 454 1 5 . 1 1 6 6 GLN H H 6 8.233 8.233 7.795 0.438 19570 455 1 5 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.949 -0.166 19570 456 1 5 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.357 -1.196 19570 457 1 5 . 1 1 7 7 ARG H H 7 8.123 8.123 8.480 -0.357 19570 458 1 5 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.112 -0.225 19570 459 1 5 . 1 1 8 8 CYS CA C 8 52.945 52.945 57.377 -4.432 19570 460 1 5 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.318 17.259 19570 461 1 5 . 1 1 8 8 CYS H H 8 8.013 8.013 8.684 -0.671 19570 462 1 5 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.922 -0.541 19570 463 1 5 . 1 1 9 9 ASP CA C 9 54.266 54.266 54.043 0.223 19570 464 1 5 . 1 1 9 9 ASP CB C 9 43.113 43.113 43.994 -0.881 19570 465 1 5 . 1 1 9 9 ASP H H 9 8.432 8.432 8.793 -0.361 19570 466 1 5 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.497 0.016 19570 467 1 5 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.190 -1.152 19570 468 1 5 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.586 -0.410 19570 469 1 5 . 1 1 10 10 ASN H H 10 9.082 9.082 8.820 0.262 19570 470 1 5 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.710 -0.046 19570 471 1 5 . 1 1 11 11 ASP CA C 11 55.521 55.521 55.844 -0.323 19570 472 1 5 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.731 -2.274 19570 473 1 5 . 1 1 11 11 ASP H H 11 8.418 8.418 7.921 0.497 19570 474 1 5 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.472 -0.151 19570 475 1 5 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.138 -0.210 19570 476 1 5 . 1 1 12 12 ARG H H 12 8.191 8.191 8.726 -0.535 19570 477 1 5 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.344 -0.124 19570 478 1 5 . 1 1 13 13 GLY H H 13 7.410 7.410 7.535 -0.125 19570 479 1 5 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.734 -0.237 19570 480 1 5 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.584 1.082 19570 481 1 5 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.807 -0.394 19570 482 1 5 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.646 -0.202 19570 483 1 5 . 1 1 15 15 ARG H H 15 8.632 8.632 8.476 0.156 19570 484 1 5 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.075 -0.505 19570 485 1 5 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.481 -3.791 19570 486 1 5 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.507 12.950 19570 487 1 5 . 1 1 16 16 CYS H H 16 8.968 8.968 8.703 0.265 19570 488 1 5 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.501 0.063 19570 489 1 5 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.527 -6.032 19570 490 1 5 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.833 11.653 19570 491 1 5 . 1 1 17 17 CYS H H 17 10.147 10.147 8.732 1.415 19570 492 1 5 . 1 1 18 18 SER HA H 18 4.219 4.219 4.180 0.039 19570 493 1 5 . 1 1 18 18 SER CA C 18 60.065 60.065 61.419 -1.354 19570 494 1 5 . 1 1 18 18 SER CB C 18 62.259 62.259 63.121 -0.862 19570 495 1 5 . 1 1 18 18 SER H H 18 8.943 8.943 8.741 0.202 19570 496 1 5 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.947 0.464 19570 497 1 5 . 1 1 19 19 GLY H H 19 8.946 8.946 8.204 0.742 19570 498 1 5 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.536 -0.256 19570 499 1 5 . 1 1 20 20 GLN CA C 20 52.605 52.605 53.969 -1.364 19570 500 1 5 . 1 1 20 20 GLN H H 20 7.902 7.902 7.819 0.083 19570 501 1 5 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.710 0.115 19570 502 1 5 . 1 1 21 21 GLY H H 21 7.685 7.685 7.877 -0.192 19570 503 1 5 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.050 -0.113 19570 504 1 5 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.092 -1.259 19570 505 1 5 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.615 -1.363 19570 506 1 5 . 1 1 22 22 ASN H H 22 8.318 8.318 8.652 -0.334 19570 507 1 5 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.875 -0.204 19570 508 1 5 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.464 -6.576 19570 509 1 5 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.914 12.451 19570 510 1 5 . 1 1 23 23 CYS H H 23 8.956 8.956 8.707 0.249 19570 511 1 5 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.706 -0.209 19570 512 1 5 . 1 1 24 24 VAL CB C 24 34.899 34.899 35.162 -0.263 19570 513 1 5 . 1 1 24 24 VAL H H 24 8.895 8.895 9.202 -0.307 19570 514 1 5 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.664 -0.165 19570 515 1 5 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.808 -0.028 19570 516 1 5 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.342 4.519 19570 517 1 5 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.191 -0.206 19570 518 1 5 . 1 1 26 26 LEU H H 26 8.145 8.145 8.215 -0.070 19570 519 1 5 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.037 -0.024 19570 520 1 5 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.466 -1.354 19570 521 1 5 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.632 0.032 19570 522 1 5 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.549 -0.362 19570 523 1 5 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.971 1.888 19570 524 1 5 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.549 -0.851 19570 525 1 5 . 1 1 28 28 PHE H H 28 8.364 8.364 7.614 0.750 19570 526 1 5 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.372 -0.012 19570 527 1 5 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.785 0.787 19570 528 1 5 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.169 2.858 19570 529 1 5 . 1 1 29 29 LEU H H 29 8.239 8.239 8.095 0.144 19570 530 1 5 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.224 -0.570 19570 531 1 5 . 1 1 30 30 GLY H H 30 7.976 7.976 7.834 0.142 19570 532 1 5 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.376 0.753 19570 533 1 5 . 1 1 31 31 GLY H H 31 8.061 8.061 7.775 0.286 19570 534 1 5 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.034 -0.199 19570 535 1 5 . 1 1 32 32 VAL CA C 32 60.065 60.065 59.688 0.377 19570 536 1 5 . 1 1 32 32 VAL CB C 32 36.485 36.485 36.892 -0.408 19570 537 1 5 . 1 1 32 32 VAL H H 32 8.601 8.601 9.028 -0.427 19570 538 1 5 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.208 -0.266 19570 539 1 5 . 1 1 33 33 CYS CA C 33 56.391 56.391 57.855 -1.464 19570 540 1 5 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.751 14.547 19570 541 1 5 . 1 1 33 33 CYS H H 33 7.979 7.979 8.387 -0.408 19570 542 1 5 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.740 0.014 19570 543 1 5 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.329 0.500 19570 544 1 5 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.369 0.234 19570 545 1 5 . 1 1 34 34 ALA H H 34 9.715 9.715 9.089 0.626 19570 546 1 6 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.748 0.062 19570 547 1 6 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.688 0.350 19570 548 1 6 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.200 0.224 19570 549 1 6 . 1 1 2 2 VAL H H 2 8.976 8.976 8.776 0.200 19570 550 1 6 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.598 -0.166 19570 551 1 6 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.464 0.675 19570 552 1 6 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.581 -0.923 19570 553 1 6 . 1 1 3 3 LEU H H 3 7.973 7.973 7.719 0.254 19570 554 1 6 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.954 -0.461 19570 555 1 6 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.527 0.602 19570 556 1 6 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.337 1.099 19570 557 1 6 . 1 1 4 4 ILE H H 4 8.340 8.340 8.503 -0.163 19570 558 1 6 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.967 -0.218 19570 559 1 6 . 1 1 5 5 GLY H H 5 9.146 9.146 9.169 -0.023 19570 560 1 6 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.406 0.086 19570 561 1 6 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.044 -0.244 19570 562 1 6 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.841 -0.208 19570 563 1 6 . 1 1 6 6 GLN H H 6 8.233 8.233 7.571 0.662 19570 564 1 6 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.912 -0.129 19570 565 1 6 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.959 -1.798 19570 566 1 6 . 1 1 7 7 ARG H H 7 8.123 8.123 8.462 -0.339 19570 567 1 6 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.921 -0.034 19570 568 1 6 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.143 -3.198 19570 569 1 6 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.103 17.474 19570 570 1 6 . 1 1 8 8 CYS H H 8 8.013 8.013 8.721 -0.708 19570 571 1 6 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.884 -0.503 19570 572 1 6 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.697 0.569 19570 573 1 6 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.905 -1.792 19570 574 1 6 . 1 1 9 9 ASP H H 9 8.432 8.432 8.557 -0.125 19570 575 1 6 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.547 -0.034 19570 576 1 6 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.500 -0.462 19570 577 1 6 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.575 -0.399 19570 578 1 6 . 1 1 10 10 ASN H H 10 9.082 9.082 8.650 0.432 19570 579 1 6 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.553 0.111 19570 580 1 6 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.108 -0.587 19570 581 1 6 . 1 1 11 11 ASP CB C 11 39.457 39.457 40.927 -1.470 19570 582 1 6 . 1 1 11 11 ASP H H 11 8.418 8.418 8.474 -0.056 19570 583 1 6 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.426 -0.105 19570 584 1 6 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.216 -0.288 19570 585 1 6 . 1 1 12 12 ARG H H 12 8.191 8.191 9.043 -0.852 19570 586 1 6 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.149 0.071 19570 587 1 6 . 1 1 13 13 GLY H H 13 7.410 7.410 7.680 -0.270 19570 588 1 6 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.747 -0.250 19570 589 1 6 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.407 1.259 19570 590 1 6 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.749 -0.336 19570 591 1 6 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.775 -0.331 19570 592 1 6 . 1 1 15 15 ARG H H 15 8.632 8.632 8.390 0.242 19570 593 1 6 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.937 -0.367 19570 594 1 6 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.503 -3.813 19570 595 1 6 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.154 13.303 19570 596 1 6 . 1 1 16 16 CYS H H 16 8.968 8.968 8.605 0.363 19570 597 1 6 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.434 0.130 19570 598 1 6 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.581 -6.086 19570 599 1 6 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.302 11.184 19570 600 1 6 . 1 1 17 17 CYS H H 17 10.147 10.147 9.005 1.142 19570 601 1 6 . 1 1 18 18 SER HA H 18 4.219 4.219 4.215 0.004 19570 602 1 6 . 1 1 18 18 SER CA C 18 60.065 60.065 60.227 -0.163 19570 603 1 6 . 1 1 18 18 SER CB C 18 62.259 62.259 62.956 -0.697 19570 604 1 6 . 1 1 18 18 SER H H 18 8.943 8.943 8.745 0.198 19570 605 1 6 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.066 0.346 19570 606 1 6 . 1 1 19 19 GLY H H 19 8.946 8.946 8.679 0.267 19570 607 1 6 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.526 -0.246 19570 608 1 6 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.931 -2.326 19570 609 1 6 . 1 1 20 20 GLN H H 20 7.902 7.902 8.216 -0.314 19570 610 1 6 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.636 0.189 19570 611 1 6 . 1 1 21 21 GLY H H 21 7.685 7.685 7.963 -0.278 19570 612 1 6 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.020 -0.083 19570 613 1 6 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.444 -1.611 19570 614 1 6 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.739 -1.487 19570 615 1 6 . 1 1 22 22 ASN H H 22 8.318 8.318 8.664 -0.346 19570 616 1 6 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.759 -0.088 19570 617 1 6 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.305 -7.417 19570 618 1 6 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.438 12.927 19570 619 1 6 . 1 1 23 23 CYS H H 23 8.956 8.956 8.737 0.219 19570 620 1 6 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.593 -0.096 19570 621 1 6 . 1 1 24 24 VAL CB C 24 34.899 34.899 32.227 2.672 19570 622 1 6 . 1 1 24 24 VAL H H 24 8.895 8.895 9.030 -0.135 19570 623 1 6 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.756 -0.257 19570 624 1 6 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.822 -0.042 19570 625 1 6 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.966 3.895 19570 626 1 6 . 1 1 26 26 LEU CB C 26 42.984 42.984 45.178 -2.194 19570 627 1 6 . 1 1 26 26 LEU H H 26 8.145 8.145 8.383 -0.238 19570 628 1 6 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.412 -0.399 19570 629 1 6 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.519 0.593 19570 630 1 6 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.785 1.879 19570 631 1 6 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.638 -0.451 19570 632 1 6 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.958 1.901 19570 633 1 6 . 1 1 28 28 PHE CB C 28 37.698 37.698 40.183 -2.485 19570 634 1 6 . 1 1 28 28 PHE H H 28 8.364 8.364 8.611 -0.247 19570 635 1 6 . 1 1 29 29 LEU HA H 29 4.360 4.360 5.085 -0.725 19570 636 1 6 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.756 0.816 19570 637 1 6 . 1 1 29 29 LEU CB C 29 44.027 44.027 43.746 0.281 19570 638 1 6 . 1 1 29 29 LEU H H 29 8.239 8.239 8.229 0.010 19570 639 1 6 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.704 -0.050 19570 640 1 6 . 1 1 30 30 GLY H H 30 7.976 7.976 8.490 -0.514 19570 641 1 6 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.330 0.799 19570 642 1 6 . 1 1 31 31 GLY H H 31 8.061 8.061 7.487 0.574 19570 643 1 6 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.187 -0.352 19570 644 1 6 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.066 1.999 19570 645 1 6 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.059 1.426 19570 646 1 6 . 1 1 32 32 VAL H H 32 8.601 8.601 8.882 -0.281 19570 647 1 6 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.897 0.045 19570 648 1 6 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.737 -2.346 19570 649 1 6 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.809 14.489 19570 650 1 6 . 1 1 33 33 CYS H H 33 7.979 7.979 8.642 -0.663 19570 651 1 6 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.793 -0.039 19570 652 1 6 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.839 0.990 19570 653 1 6 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.341 0.262 19570 654 1 6 . 1 1 34 34 ALA H H 34 9.715 9.715 9.056 0.659 19570 655 1 7 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.845 -0.035 19570 656 1 7 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.868 0.170 19570 657 1 7 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.110 0.314 19570 658 1 7 . 1 1 2 2 VAL H H 2 8.976 8.976 8.887 0.089 19570 659 1 7 . 1 1 3 3 LEU HA H 3 4.432 4.432 5.102 -0.670 19570 660 1 7 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.380 0.759 19570 661 1 7 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.710 -1.052 19570 662 1 7 . 1 1 3 3 LEU H H 3 7.973 7.973 9.014 -1.041 19570 663 1 7 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.764 -0.271 19570 664 1 7 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.529 0.600 19570 665 1 7 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.286 1.150 19570 666 1 7 . 1 1 4 4 ILE H H 4 8.340 8.340 8.750 -0.410 19570 667 1 7 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.928 -0.180 19570 668 1 7 . 1 1 5 5 GLY H H 5 9.146 9.146 8.977 0.169 19570 669 1 7 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.468 0.024 19570 670 1 7 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.423 0.377 19570 671 1 7 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.379 -0.746 19570 672 1 7 . 1 1 6 6 GLN H H 6 8.233 8.233 7.643 0.590 19570 673 1 7 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.184 -0.401 19570 674 1 7 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.253 -2.092 19570 675 1 7 . 1 1 7 7 ARG H H 7 8.123 8.123 8.514 -0.391 19570 676 1 7 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.196 -0.309 19570 677 1 7 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.950 -3.005 19570 678 1 7 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.511 17.066 19570 679 1 7 . 1 1 8 8 CYS H H 8 8.013 8.013 8.951 -0.938 19570 680 1 7 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.856 -0.475 19570 681 1 7 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.628 0.638 19570 682 1 7 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.314 -1.201 19570 683 1 7 . 1 1 9 9 ASP H H 9 8.432 8.432 8.470 -0.038 19570 684 1 7 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.506 0.007 19570 685 1 7 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.127 -1.089 19570 686 1 7 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.826 -0.650 19570 687 1 7 . 1 1 10 10 ASN H H 10 9.082 9.082 8.839 0.243 19570 688 1 7 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.671 -0.007 19570 689 1 7 . 1 1 11 11 ASP CA C 11 55.521 55.521 57.080 -1.559 19570 690 1 7 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.725 -2.268 19570 691 1 7 . 1 1 11 11 ASP H H 11 8.418 8.418 8.430 -0.012 19570 692 1 7 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.395 -0.074 19570 693 1 7 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.056 -0.128 19570 694 1 7 . 1 1 12 12 ARG H H 12 8.191 8.191 8.954 -0.763 19570 695 1 7 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.023 0.197 19570 696 1 7 . 1 1 13 13 GLY H H 13 7.410 7.410 7.550 -0.140 19570 697 1 7 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.548 -0.051 19570 698 1 7 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.780 1.886 19570 699 1 7 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.593 -0.180 19570 700 1 7 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.880 -0.436 19570 701 1 7 . 1 1 15 15 ARG H H 15 8.632 8.632 8.539 0.093 19570 702 1 7 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.964 -0.394 19570 703 1 7 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.267 -3.577 19570 704 1 7 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.051 13.406 19570 705 1 7 . 1 1 16 16 CYS H H 16 8.968 8.968 8.546 0.422 19570 706 1 7 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.397 0.167 19570 707 1 7 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.469 -5.974 19570 708 1 7 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.344 11.142 19570 709 1 7 . 1 1 17 17 CYS H H 17 10.147 10.147 8.898 1.249 19570 710 1 7 . 1 1 18 18 SER HA H 18 4.219 4.219 4.221 -0.002 19570 711 1 7 . 1 1 18 18 SER CA C 18 60.065 60.065 60.325 -0.261 19570 712 1 7 . 1 1 18 18 SER CB C 18 62.259 62.259 62.211 0.048 19570 713 1 7 . 1 1 18 18 SER H H 18 8.943 8.943 8.765 0.178 19570 714 1 7 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.899 0.512 19570 715 1 7 . 1 1 19 19 GLY H H 19 8.946 8.946 8.630 0.316 19570 716 1 7 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.504 -0.224 19570 717 1 7 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.912 -2.307 19570 718 1 7 . 1 1 20 20 GLN H H 20 7.902 7.902 8.065 -0.163 19570 719 1 7 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.747 0.078 19570 720 1 7 . 1 1 21 21 GLY H H 21 7.685 7.685 7.906 -0.221 19570 721 1 7 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.894 0.043 19570 722 1 7 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.002 -1.169 19570 723 1 7 . 1 1 22 22 ASN CB C 22 41.252 41.252 41.563 -0.311 19570 724 1 7 . 1 1 22 22 ASN H H 22 8.318 8.318 8.683 -0.365 19570 725 1 7 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.591 0.080 19570 726 1 7 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.417 -6.529 19570 727 1 7 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.745 12.620 19570 728 1 7 . 1 1 23 23 CYS H H 23 8.956 8.956 8.835 0.121 19570 729 1 7 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.520 -0.023 19570 730 1 7 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.007 0.892 19570 731 1 7 . 1 1 24 24 VAL H H 24 8.895 8.895 8.908 -0.013 19570 732 1 7 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.680 -0.181 19570 733 1 7 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.806 -0.026 19570 734 1 7 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.555 4.306 19570 735 1 7 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.328 -0.344 19570 736 1 7 . 1 1 26 26 LEU H H 26 8.145 8.145 7.762 0.383 19570 737 1 7 . 1 1 27 27 PRO HA H 27 4.013 4.013 3.998 0.015 19570 738 1 7 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.712 -1.600 19570 739 1 7 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.608 0.056 19570 740 1 7 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.527 -0.340 19570 741 1 7 . 1 1 28 28 PHE CA C 28 60.859 60.859 59.192 1.667 19570 742 1 7 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.191 -1.493 19570 743 1 7 . 1 1 28 28 PHE H H 28 8.364 8.364 7.721 0.643 19570 744 1 7 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.534 -0.174 19570 745 1 7 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.282 1.290 19570 746 1 7 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.771 2.256 19570 747 1 7 . 1 1 29 29 LEU H H 29 8.239 8.239 7.721 0.518 19570 748 1 7 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.581 -0.928 19570 749 1 7 . 1 1 30 30 GLY H H 30 7.976 7.976 8.567 -0.591 19570 750 1 7 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.362 0.767 19570 751 1 7 . 1 1 31 31 GLY H H 31 8.061 8.061 7.688 0.373 19570 752 1 7 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.437 -0.602 19570 753 1 7 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.093 1.972 19570 754 1 7 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.143 1.342 19570 755 1 7 . 1 1 32 32 VAL H H 32 8.601 8.601 9.168 -0.567 19570 756 1 7 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.908 0.034 19570 757 1 7 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.203 -2.812 19570 758 1 7 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.050 14.248 19570 759 1 7 . 1 1 33 33 CYS H H 33 7.979 7.979 8.299 -0.320 19570 760 1 7 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.947 -0.193 19570 761 1 7 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.865 0.964 19570 762 1 7 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.145 0.459 19570 763 1 7 . 1 1 34 34 ALA H H 34 9.715 9.715 9.034 0.681 19570 764 1 8 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.849 -0.039 19570 765 1 8 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.699 0.339 19570 766 1 8 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.290 0.134 19570 767 1 8 . 1 1 2 2 VAL H H 2 8.976 8.976 8.871 0.105 19570 768 1 8 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.659 -0.227 19570 769 1 8 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.575 0.564 19570 770 1 8 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.326 -0.668 19570 771 1 8 . 1 1 3 3 LEU H H 3 7.973 7.973 8.032 -0.059 19570 772 1 8 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.764 -0.271 19570 773 1 8 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.510 0.619 19570 774 1 8 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.482 0.954 19570 775 1 8 . 1 1 4 4 ILE H H 4 8.340 8.340 8.135 0.205 19570 776 1 8 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.998 -0.249 19570 777 1 8 . 1 1 5 5 GLY H H 5 9.146 9.146 9.023 0.123 19570 778 1 8 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.381 0.111 19570 779 1 8 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.016 -0.216 19570 780 1 8 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.995 -0.362 19570 781 1 8 . 1 1 6 6 GLN H H 6 8.233 8.233 7.594 0.639 19570 782 1 8 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.022 -0.239 19570 783 1 8 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.217 -2.056 19570 784 1 8 . 1 1 7 7 ARG H H 7 8.123 8.123 8.511 -0.388 19570 785 1 8 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.178 -0.291 19570 786 1 8 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.994 -3.049 19570 787 1 8 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.735 16.842 19570 788 1 8 . 1 1 8 8 CYS H H 8 8.013 8.013 8.892 -0.879 19570 789 1 8 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.948 -0.567 19570 790 1 8 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.773 0.493 19570 791 1 8 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.534 -1.421 19570 792 1 8 . 1 1 9 9 ASP H H 9 8.432 8.432 8.559 -0.127 19570 793 1 8 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.347 0.166 19570 794 1 8 . 1 1 10 10 ASN CA C 10 55.038 55.038 57.087 -2.049 19570 795 1 8 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.697 -0.521 19570 796 1 8 . 1 1 10 10 ASN H H 10 9.082 9.082 8.861 0.221 19570 797 1 8 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.747 -0.083 19570 798 1 8 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.124 -0.603 19570 799 1 8 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.397 -1.940 19570 800 1 8 . 1 1 11 11 ASP H H 11 8.418 8.418 8.013 0.405 19570 801 1 8 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.369 -0.048 19570 802 1 8 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.706 -0.778 19570 803 1 8 . 1 1 12 12 ARG H H 12 8.191 8.191 8.820 -0.629 19570 804 1 8 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.017 0.204 19570 805 1 8 . 1 1 13 13 GLY H H 13 7.410 7.410 7.693 -0.283 19570 806 1 8 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.574 -0.077 19570 807 1 8 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.917 1.749 19570 808 1 8 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.602 -0.189 19570 809 1 8 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.055 -0.611 19570 810 1 8 . 1 1 15 15 ARG H H 15 8.632 8.632 8.365 0.267 19570 811 1 8 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.141 -0.571 19570 812 1 8 . 1 1 16 16 CYS CA C 16 55.690 55.690 58.550 -2.860 19570 813 1 8 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.544 12.913 19570 814 1 8 . 1 1 16 16 CYS H H 16 8.968 8.968 8.402 0.566 19570 815 1 8 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.455 0.109 19570 816 1 8 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.118 -5.623 19570 817 1 8 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.307 11.179 19570 818 1 8 . 1 1 17 17 CYS H H 17 10.147 10.147 8.808 1.339 19570 819 1 8 . 1 1 18 18 SER HA H 18 4.219 4.219 4.201 0.018 19570 820 1 8 . 1 1 18 18 SER CA C 18 60.065 60.065 60.139 -0.074 19570 821 1 8 . 1 1 18 18 SER CB C 18 62.259 62.259 61.940 0.319 19570 822 1 8 . 1 1 18 18 SER H H 18 8.943 8.943 8.739 0.204 19570 823 1 8 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.111 0.300 19570 824 1 8 . 1 1 19 19 GLY H H 19 8.946 8.946 8.279 0.667 19570 825 1 8 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.483 -0.203 19570 826 1 8 . 1 1 20 20 GLN CA C 20 52.605 52.605 56.569 -3.964 19570 827 1 8 . 1 1 20 20 GLN H H 20 7.902 7.902 8.378 -0.476 19570 828 1 8 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.904 -0.079 19570 829 1 8 . 1 1 21 21 GLY H H 21 7.685 7.685 7.517 0.168 19570 830 1 8 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.070 -0.133 19570 831 1 8 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.303 -1.470 19570 832 1 8 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.548 -1.296 19570 833 1 8 . 1 1 22 22 ASN H H 22 8.318 8.318 8.823 -0.505 19570 834 1 8 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.652 0.019 19570 835 1 8 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.563 -6.675 19570 836 1 8 . 1 1 23 23 CYS CB C 23 38.365 38.365 26.141 12.224 19570 837 1 8 . 1 1 23 23 CYS H H 23 8.956 8.956 8.618 0.338 19570 838 1 8 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.630 -0.133 19570 839 1 8 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.300 0.599 19570 840 1 8 . 1 1 24 24 VAL H H 24 8.895 8.895 9.050 -0.155 19570 841 1 8 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.791 -0.292 19570 842 1 8 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.825 -0.045 19570 843 1 8 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.469 4.392 19570 844 1 8 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.968 0.016 19570 845 1 8 . 1 1 26 26 LEU H H 26 8.145 8.145 7.846 0.299 19570 846 1 8 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.052 -0.039 19570 847 1 8 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.651 -1.539 19570 848 1 8 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.696 -0.032 19570 849 1 8 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.527 -0.341 19570 850 1 8 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.864 1.995 19570 851 1 8 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.954 -1.256 19570 852 1 8 . 1 1 28 28 PHE H H 28 8.364 8.364 7.680 0.684 19570 853 1 8 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.330 0.030 19570 854 1 8 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.012 0.560 19570 855 1 8 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.310 2.717 19570 856 1 8 . 1 1 29 29 LEU H H 29 8.239 8.239 7.863 0.376 19570 857 1 8 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.170 -0.516 19570 858 1 8 . 1 1 30 30 GLY H H 30 7.976 7.976 8.389 -0.413 19570 859 1 8 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.237 0.892 19570 860 1 8 . 1 1 31 31 GLY H H 31 8.061 8.061 7.700 0.361 19570 861 1 8 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.330 -0.495 19570 862 1 8 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.516 1.549 19570 863 1 8 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.547 0.938 19570 864 1 8 . 1 1 32 32 VAL H H 32 8.601 8.601 8.992 -0.391 19570 865 1 8 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.117 -0.175 19570 866 1 8 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.016 -2.625 19570 867 1 8 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.527 13.771 19570 868 1 8 . 1 1 33 33 CYS H H 33 7.979 7.979 8.413 -0.434 19570 869 1 8 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.621 0.133 19570 870 1 8 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.082 0.747 19570 871 1 8 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.858 0.745 19570 872 1 8 . 1 1 34 34 ALA H H 34 9.715 9.715 8.803 0.912 19570 873 1 9 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.646 0.164 19570 874 1 9 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.240 -0.202 19570 875 1 9 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.299 1.125 19570 876 1 9 . 1 1 2 2 VAL H H 2 8.976 8.976 8.642 0.334 19570 877 1 9 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.668 -0.236 19570 878 1 9 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.252 0.887 19570 879 1 9 . 1 1 3 3 LEU CB C 3 42.658 42.658 44.062 -1.404 19570 880 1 9 . 1 1 3 3 LEU H H 3 7.973 7.973 7.927 0.046 19570 881 1 9 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.839 -0.346 19570 882 1 9 . 1 1 4 4 ILE CA C 4 63.129 63.129 63.455 -0.326 19570 883 1 9 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.340 1.096 19570 884 1 9 . 1 1 4 4 ILE H H 4 8.340 8.340 8.432 -0.092 19570 885 1 9 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.847 -0.098 19570 886 1 9 . 1 1 5 5 GLY H H 5 9.146 9.146 9.038 0.108 19570 887 1 9 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.434 0.058 19570 888 1 9 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.745 0.056 19570 889 1 9 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.358 -0.725 19570 890 1 9 . 1 1 6 6 GLN H H 6 8.233 8.233 7.722 0.511 19570 891 1 9 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.913 -0.130 19570 892 1 9 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.854 -1.693 19570 893 1 9 . 1 1 7 7 ARG H H 7 8.123 8.123 8.419 -0.296 19570 894 1 9 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.892 -0.005 19570 895 1 9 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.073 -3.128 19570 896 1 9 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.306 17.271 19570 897 1 9 . 1 1 8 8 CYS H H 8 8.013 8.013 9.028 -1.015 19570 898 1 9 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.937 -0.556 19570 899 1 9 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.962 0.305 19570 900 1 9 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.243 -1.130 19570 901 1 9 . 1 1 9 9 ASP H H 9 8.432 8.432 8.703 -0.271 19570 902 1 9 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.538 -0.025 19570 903 1 9 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.107 -0.069 19570 904 1 9 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.717 -0.541 19570 905 1 9 . 1 1 10 10 ASN H H 10 9.082 9.082 8.737 0.345 19570 906 1 9 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.551 0.113 19570 907 1 9 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.287 -0.766 19570 908 1 9 . 1 1 11 11 ASP CB C 11 39.457 39.457 40.992 -1.534 19570 909 1 9 . 1 1 11 11 ASP H H 11 8.418 8.418 8.346 0.072 19570 910 1 9 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.583 -0.262 19570 911 1 9 . 1 1 12 12 ARG CA C 12 55.928 55.928 55.050 0.878 19570 912 1 9 . 1 1 12 12 ARG H H 12 8.191 8.191 9.077 -0.886 19570 913 1 9 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.289 -0.069 19570 914 1 9 . 1 1 13 13 GLY H H 13 7.410 7.410 7.831 -0.421 19570 915 1 9 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.654 -0.157 19570 916 1 9 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.178 1.488 19570 917 1 9 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.706 -0.293 19570 918 1 9 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.022 -0.578 19570 919 1 9 . 1 1 15 15 ARG H H 15 8.632 8.632 8.401 0.231 19570 920 1 9 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.082 -0.512 19570 921 1 9 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.266 -3.576 19570 922 1 9 . 1 1 16 16 CYS CB C 16 39.457 39.457 27.535 11.922 19570 923 1 9 . 1 1 16 16 CYS H H 16 8.968 8.968 8.764 0.204 19570 924 1 9 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.502 0.062 19570 925 1 9 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.447 -5.952 19570 926 1 9 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.856 11.630 19570 927 1 9 . 1 1 17 17 CYS H H 17 10.147 10.147 8.842 1.305 19570 928 1 9 . 1 1 18 18 SER HA H 18 4.219 4.219 4.150 0.069 19570 929 1 9 . 1 1 18 18 SER CA C 18 60.065 60.065 61.755 -1.690 19570 930 1 9 . 1 1 18 18 SER CB C 18 62.259 62.259 63.222 -0.963 19570 931 1 9 . 1 1 18 18 SER H H 18 8.943 8.943 8.869 0.074 19570 932 1 9 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.052 0.359 19570 933 1 9 . 1 1 19 19 GLY H H 19 8.946 8.946 8.213 0.733 19570 934 1 9 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.565 -0.285 19570 935 1 9 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.216 -1.611 19570 936 1 9 . 1 1 20 20 GLN H H 20 7.902 7.902 7.941 -0.039 19570 937 1 9 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.666 0.159 19570 938 1 9 . 1 1 21 21 GLY H H 21 7.685 7.685 7.724 -0.039 19570 939 1 9 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.912 0.025 19570 940 1 9 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.753 -0.920 19570 941 1 9 . 1 1 22 22 ASN CB C 22 41.252 41.252 41.324 -0.072 19570 942 1 9 . 1 1 22 22 ASN H H 22 8.318 8.318 8.275 0.043 19570 943 1 9 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.505 0.166 19570 944 1 9 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.021 -7.133 19570 945 1 9 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.189 13.175 19570 946 1 9 . 1 1 23 23 CYS H H 23 8.956 8.956 8.680 0.276 19570 947 1 9 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.800 -0.303 19570 948 1 9 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.544 1.355 19570 949 1 9 . 1 1 24 24 VAL H H 24 8.895 8.895 9.134 -0.239 19570 950 1 9 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.484 0.015 19570 951 1 9 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.879 -0.099 19570 952 1 9 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.476 4.385 19570 953 1 9 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.859 -0.875 19570 954 1 9 . 1 1 26 26 LEU H H 26 8.145 8.145 8.044 0.101 19570 955 1 9 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.490 -0.477 19570 956 1 9 . 1 1 27 27 PRO CA C 27 64.112 64.112 64.197 -0.085 19570 957 1 9 . 1 1 27 27 PRO CB C 27 31.664 31.664 30.009 1.655 19570 958 1 9 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.560 -0.373 19570 959 1 9 . 1 1 28 28 PHE CA C 28 60.859 60.859 59.260 1.599 19570 960 1 9 . 1 1 28 28 PHE CB C 28 37.698 37.698 40.266 -2.567 19570 961 1 9 . 1 1 28 28 PHE H H 28 8.364 8.364 8.740 -0.376 19570 962 1 9 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.794 -0.434 19570 963 1 9 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.954 0.618 19570 964 1 9 . 1 1 29 29 LEU CB C 29 44.027 44.027 42.615 1.412 19570 965 1 9 . 1 1 29 29 LEU H H 29 8.239 8.239 8.361 -0.122 19570 966 1 9 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.428 0.226 19570 967 1 9 . 1 1 30 30 GLY H H 30 7.976 7.976 7.790 0.186 19570 968 1 9 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.924 1.205 19570 969 1 9 . 1 1 31 31 GLY H H 31 8.061 8.061 8.629 -0.568 19570 970 1 9 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.253 -0.418 19570 971 1 9 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.031 2.034 19570 972 1 9 . 1 1 32 32 VAL CB C 32 36.485 36.485 34.902 1.583 19570 973 1 9 . 1 1 32 32 VAL H H 32 8.601 8.601 9.059 -0.458 19570 974 1 9 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.216 -0.274 19570 975 1 9 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.513 -2.122 19570 976 1 9 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.159 14.139 19570 977 1 9 . 1 1 33 33 CYS H H 33 7.979 7.979 8.356 -0.377 19570 978 1 9 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.682 0.072 19570 979 1 9 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.437 0.392 19570 980 1 9 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.041 0.562 19570 981 1 9 . 1 1 34 34 ALA H H 34 9.715 9.715 8.885 0.830 19570 982 1 10 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.757 0.053 19570 983 1 10 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.691 0.347 19570 984 1 10 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.483 -0.059 19570 985 1 10 . 1 1 2 2 VAL H H 2 8.976 8.976 8.753 0.223 19570 986 1 10 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.633 -0.201 19570 987 1 10 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.568 0.571 19570 988 1 10 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.732 -1.074 19570 989 1 10 . 1 1 3 3 LEU H H 3 7.973 7.973 7.770 0.203 19570 990 1 10 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.808 -0.315 19570 991 1 10 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.681 0.448 19570 992 1 10 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.260 1.176 19570 993 1 10 . 1 1 4 4 ILE H H 4 8.340 8.340 8.503 -0.163 19570 994 1 10 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.895 -0.146 19570 995 1 10 . 1 1 5 5 GLY H H 5 9.146 9.146 9.100 0.046 19570 996 1 10 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.434 0.058 19570 997 1 10 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.555 0.245 19570 998 1 10 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.171 -0.537 19570 999 1 10 . 1 1 6 6 GLN H H 6 8.233 8.233 7.575 0.657 19570 1000 1 10 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.016 -0.233 19570 1001 1 10 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.404 -2.243 19570 1002 1 10 . 1 1 7 7 ARG H H 7 8.123 8.123 8.491 -0.368 19570 1003 1 10 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.943 -0.056 19570 1004 1 10 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.031 -3.086 19570 1005 1 10 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.415 17.162 19570 1006 1 10 . 1 1 8 8 CYS H H 8 8.013 8.013 8.938 -0.925 19570 1007 1 10 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.870 -0.489 19570 1008 1 10 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.306 0.960 19570 1009 1 10 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.264 -1.151 19570 1010 1 10 . 1 1 9 9 ASP H H 9 8.432 8.432 8.559 -0.127 19570 1011 1 10 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.402 0.111 19570 1012 1 10 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.242 -1.204 19570 1013 1 10 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.815 -0.639 19570 1014 1 10 . 1 1 10 10 ASN H H 10 9.082 9.082 8.664 0.418 19570 1015 1 10 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.715 -0.051 19570 1016 1 10 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.073 -0.552 19570 1017 1 10 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.488 -2.031 19570 1018 1 10 . 1 1 11 11 ASP H H 11 8.418 8.418 8.036 0.382 19570 1019 1 10 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.413 -0.092 19570 1020 1 10 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.629 -0.701 19570 1021 1 10 . 1 1 12 12 ARG H H 12 8.191 8.191 9.069 -0.878 19570 1022 1 10 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.010 0.210 19570 1023 1 10 . 1 1 13 13 GLY H H 13 7.410 7.410 7.742 -0.332 19570 1024 1 10 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.625 -0.128 19570 1025 1 10 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.997 1.669 19570 1026 1 10 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.618 -0.205 19570 1027 1 10 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.130 -0.686 19570 1028 1 10 . 1 1 15 15 ARG H H 15 8.632 8.632 8.465 0.167 19570 1029 1 10 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.899 -0.329 19570 1030 1 10 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.744 -4.054 19570 1031 1 10 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.216 13.241 19570 1032 1 10 . 1 1 16 16 CYS H H 16 8.968 8.968 8.771 0.197 19570 1033 1 10 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.459 0.105 19570 1034 1 10 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.391 -5.896 19570 1035 1 10 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.317 11.169 19570 1036 1 10 . 1 1 17 17 CYS H H 17 10.147 10.147 8.904 1.243 19570 1037 1 10 . 1 1 18 18 SER HA H 18 4.219 4.219 4.158 0.061 19570 1038 1 10 . 1 1 18 18 SER CA C 18 60.065 60.065 59.599 0.466 19570 1039 1 10 . 1 1 18 18 SER CB C 18 62.259 62.259 61.713 0.546 19570 1040 1 10 . 1 1 18 18 SER H H 18 8.943 8.943 8.750 0.193 19570 1041 1 10 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.117 0.294 19570 1042 1 10 . 1 1 19 19 GLY H H 19 8.946 8.946 8.080 0.866 19570 1043 1 10 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.604 -0.324 19570 1044 1 10 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.640 -2.035 19570 1045 1 10 . 1 1 20 20 GLN H H 20 7.902 7.902 8.222 -0.320 19570 1046 1 10 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.857 -0.032 19570 1047 1 10 . 1 1 21 21 GLY H H 21 7.685 7.685 7.915 -0.230 19570 1048 1 10 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.957 -0.020 19570 1049 1 10 . 1 1 22 22 ASN CA C 22 50.833 50.833 50.893 -0.060 19570 1050 1 10 . 1 1 22 22 ASN CB C 22 41.252 41.252 41.352 -0.100 19570 1051 1 10 . 1 1 22 22 ASN H H 22 8.318 8.318 8.476 -0.158 19570 1052 1 10 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.642 0.029 19570 1053 1 10 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.563 -7.675 19570 1054 1 10 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.546 12.819 19570 1055 1 10 . 1 1 23 23 CYS H H 23 8.956 8.956 8.915 0.041 19570 1056 1 10 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.591 -0.094 19570 1057 1 10 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.231 0.668 19570 1058 1 10 . 1 1 24 24 VAL H H 24 8.895 8.895 9.155 -0.260 19570 1059 1 10 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.880 -0.381 19570 1060 1 10 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.820 -0.040 19570 1061 1 10 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.807 4.054 19570 1062 1 10 . 1 1 26 26 LEU CB C 26 42.984 42.984 45.508 -2.524 19570 1063 1 10 . 1 1 26 26 LEU H H 26 8.145 8.145 8.799 -0.654 19570 1064 1 10 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.379 -0.366 19570 1065 1 10 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.684 0.428 19570 1066 1 10 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.849 1.815 19570 1067 1 10 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.580 -0.393 19570 1068 1 10 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.915 1.944 19570 1069 1 10 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.924 -2.226 19570 1070 1 10 . 1 1 28 28 PHE H H 28 8.364 8.364 8.578 -0.214 19570 1071 1 10 . 1 1 29 29 LEU HA H 29 4.360 4.360 5.061 -0.701 19570 1072 1 10 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.838 0.734 19570 1073 1 10 . 1 1 29 29 LEU CB C 29 44.027 44.027 43.497 0.530 19570 1074 1 10 . 1 1 29 29 LEU H H 29 8.239 8.239 8.252 -0.013 19570 1075 1 10 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.692 -0.038 19570 1076 1 10 . 1 1 30 30 GLY H H 30 7.976 7.976 8.133 -0.157 19570 1077 1 10 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.563 1.565 19570 1078 1 10 . 1 1 31 31 GLY H H 31 8.061 8.061 7.654 0.407 19570 1079 1 10 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.430 -0.595 19570 1080 1 10 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.230 1.835 19570 1081 1 10 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.456 1.029 19570 1082 1 10 . 1 1 32 32 VAL H H 32 8.601 8.601 8.905 -0.304 19570 1083 1 10 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.973 -0.031 19570 1084 1 10 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.278 -2.887 19570 1085 1 10 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.852 14.447 19570 1086 1 10 . 1 1 33 33 CYS H H 33 7.979 7.979 8.409 -0.430 19570 1087 1 10 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.930 -0.176 19570 1088 1 10 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.121 0.708 19570 1089 1 10 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.235 0.368 19570 1090 1 10 . 1 1 34 34 ALA H H 34 9.715 9.715 8.945 0.770 19570 1091 1 11 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.914 -0.104 19570 1092 1 11 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.843 0.195 19570 1093 1 11 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.164 0.260 19570 1094 1 11 . 1 1 2 2 VAL H H 2 8.976 8.976 8.954 0.022 19570 1095 1 11 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.616 -0.184 19570 1096 1 11 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.584 0.555 19570 1097 1 11 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.549 -0.891 19570 1098 1 11 . 1 1 3 3 LEU H H 3 7.973 7.973 9.121 -1.148 19570 1099 1 11 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.878 -0.385 19570 1100 1 11 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.625 0.504 19570 1101 1 11 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.056 1.380 19570 1102 1 11 . 1 1 4 4 ILE H H 4 8.340 8.340 8.347 -0.007 19570 1103 1 11 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.833 -0.084 19570 1104 1 11 . 1 1 5 5 GLY H H 5 9.146 9.146 9.044 0.102 19570 1105 1 11 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.459 0.033 19570 1106 1 11 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.614 0.186 19570 1107 1 11 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.253 -0.620 19570 1108 1 11 . 1 1 6 6 GLN H H 6 8.233 8.233 7.659 0.574 19570 1109 1 11 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.009 -0.226 19570 1110 1 11 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.013 -1.852 19570 1111 1 11 . 1 1 7 7 ARG H H 7 8.123 8.123 8.496 -0.373 19570 1112 1 11 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.224 -0.337 19570 1113 1 11 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.946 -3.001 19570 1114 1 11 . 1 1 8 8 CYS CB C 8 48.577 48.577 30.678 17.899 19570 1115 1 11 . 1 1 8 8 CYS H H 8 8.013 8.013 8.894 -0.881 19570 1116 1 11 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.954 -0.573 19570 1117 1 11 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.216 1.050 19570 1118 1 11 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.471 -1.358 19570 1119 1 11 . 1 1 9 9 ASP H H 9 8.432 8.432 8.732 -0.300 19570 1120 1 11 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.566 -0.053 19570 1121 1 11 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.193 -0.155 19570 1122 1 11 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.680 -0.504 19570 1123 1 11 . 1 1 10 10 ASN H H 10 9.082 9.082 8.696 0.386 19570 1124 1 11 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.534 0.130 19570 1125 1 11 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.466 -0.945 19570 1126 1 11 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.148 -1.691 19570 1127 1 11 . 1 1 11 11 ASP H H 11 8.418 8.418 7.755 0.663 19570 1128 1 11 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.583 -0.262 19570 1129 1 11 . 1 1 12 12 ARG CA C 12 55.928 55.928 55.098 0.830 19570 1130 1 11 . 1 1 12 12 ARG H H 12 8.191 8.191 9.142 -0.951 19570 1131 1 11 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.384 -0.164 19570 1132 1 11 . 1 1 13 13 GLY H H 13 7.410 7.410 7.451 -0.041 19570 1133 1 11 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.679 -0.182 19570 1134 1 11 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.495 1.171 19570 1135 1 11 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.629 -0.216 19570 1136 1 11 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.026 -0.582 19570 1137 1 11 . 1 1 15 15 ARG H H 15 8.632 8.632 8.397 0.235 19570 1138 1 11 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.925 -0.355 19570 1139 1 11 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.733 -4.043 19570 1140 1 11 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.353 13.104 19570 1141 1 11 . 1 1 16 16 CYS H H 16 8.968 8.968 8.640 0.328 19570 1142 1 11 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.481 0.083 19570 1143 1 11 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.000 -5.505 19570 1144 1 11 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.154 11.332 19570 1145 1 11 . 1 1 17 17 CYS H H 17 10.147 10.147 9.009 1.138 19570 1146 1 11 . 1 1 18 18 SER HA H 18 4.219 4.219 4.087 0.132 19570 1147 1 11 . 1 1 18 18 SER CA C 18 60.065 60.065 60.325 -0.260 19570 1148 1 11 . 1 1 18 18 SER CB C 18 62.259 62.259 62.449 -0.190 19570 1149 1 11 . 1 1 18 18 SER H H 18 8.943 8.943 8.753 0.190 19570 1150 1 11 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.909 0.502 19570 1151 1 11 . 1 1 19 19 GLY H H 19 8.946 8.946 8.454 0.492 19570 1152 1 11 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.363 -0.083 19570 1153 1 11 . 1 1 20 20 GLN CA C 20 52.605 52.605 55.027 -2.422 19570 1154 1 11 . 1 1 20 20 GLN H H 20 7.902 7.902 8.498 -0.596 19570 1155 1 11 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.486 0.339 19570 1156 1 11 . 1 1 21 21 GLY H H 21 7.685 7.685 7.924 -0.239 19570 1157 1 11 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.044 -0.107 19570 1158 1 11 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.346 -1.513 19570 1159 1 11 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.395 -1.143 19570 1160 1 11 . 1 1 22 22 ASN H H 22 8.318 8.318 8.783 -0.465 19570 1161 1 11 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.661 0.010 19570 1162 1 11 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.460 -7.572 19570 1163 1 11 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.279 13.086 19570 1164 1 11 . 1 1 23 23 CYS H H 23 8.956 8.956 8.820 0.136 19570 1165 1 11 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.321 0.176 19570 1166 1 11 . 1 1 24 24 VAL CB C 24 34.899 34.899 32.782 2.118 19570 1167 1 11 . 1 1 24 24 VAL H H 24 8.895 8.895 9.135 -0.240 19570 1168 1 11 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.944 -0.445 19570 1169 1 11 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.764 0.016 19570 1170 1 11 . 1 1 26 26 LEU CA C 26 55.861 55.861 50.952 4.909 19570 1171 1 11 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.510 0.474 19570 1172 1 11 . 1 1 26 26 LEU H H 26 8.145 8.145 7.589 0.556 19570 1173 1 11 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.130 -0.117 19570 1174 1 11 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.894 -1.782 19570 1175 1 11 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.886 -0.222 19570 1176 1 11 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.662 -0.475 19570 1177 1 11 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.570 2.289 19570 1178 1 11 . 1 1 28 28 PHE CB C 28 37.698 37.698 37.992 -0.294 19570 1179 1 11 . 1 1 28 28 PHE H H 28 8.364 8.364 7.260 1.104 19570 1180 1 11 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.335 0.025 19570 1181 1 11 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.026 0.546 19570 1182 1 11 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.609 2.418 19570 1183 1 11 . 1 1 29 29 LEU H H 29 8.239 8.239 7.300 0.939 19570 1184 1 11 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.440 -0.786 19570 1185 1 11 . 1 1 30 30 GLY H H 30 7.976 7.976 8.188 -0.212 19570 1186 1 11 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.252 0.877 19570 1187 1 11 . 1 1 31 31 GLY H H 31 8.061 8.061 7.689 0.372 19570 1188 1 11 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.259 -0.424 19570 1189 1 11 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.630 1.435 19570 1190 1 11 . 1 1 32 32 VAL CB C 32 36.485 36.485 34.920 1.565 19570 1191 1 11 . 1 1 32 32 VAL H H 32 8.601 8.601 8.854 -0.253 19570 1192 1 11 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.828 0.114 19570 1193 1 11 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.444 -3.053 19570 1194 1 11 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.321 14.977 19570 1195 1 11 . 1 1 33 33 CYS H H 33 7.979 7.979 8.492 -0.513 19570 1196 1 11 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.646 0.108 19570 1197 1 11 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.242 0.587 19570 1198 1 11 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.086 0.517 19570 1199 1 11 . 1 1 34 34 ALA H H 34 9.715 9.715 9.044 0.671 19570 1200 1 12 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.906 -0.096 19570 1201 1 12 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.740 0.298 19570 1202 1 12 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.393 0.031 19570 1203 1 12 . 1 1 2 2 VAL H H 2 8.976 8.976 8.916 0.060 19570 1204 1 12 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.980 -0.548 19570 1205 1 12 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.524 0.615 19570 1206 1 12 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.332 -0.674 19570 1207 1 12 . 1 1 3 3 LEU H H 3 7.973 7.973 9.136 -1.163 19570 1208 1 12 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.734 -0.241 19570 1209 1 12 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.598 0.531 19570 1210 1 12 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.189 1.247 19570 1211 1 12 . 1 1 4 4 ILE H H 4 8.340 8.340 8.290 0.050 19570 1212 1 12 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.839 -0.090 19570 1213 1 12 . 1 1 5 5 GLY H H 5 9.146 9.146 9.133 0.013 19570 1214 1 12 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.544 -0.052 19570 1215 1 12 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.284 0.516 19570 1216 1 12 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.345 -0.712 19570 1217 1 12 . 1 1 6 6 GLN H H 6 8.233 8.233 7.645 0.588 19570 1218 1 12 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.974 -0.191 19570 1219 1 12 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.642 -1.481 19570 1220 1 12 . 1 1 7 7 ARG H H 7 8.123 8.123 8.463 -0.340 19570 1221 1 12 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.092 -0.205 19570 1222 1 12 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.113 -3.168 19570 1223 1 12 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.664 16.913 19570 1224 1 12 . 1 1 8 8 CYS H H 8 8.013 8.013 8.990 -0.977 19570 1225 1 12 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.983 -0.602 19570 1226 1 12 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.160 1.106 19570 1227 1 12 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.446 -1.333 19570 1228 1 12 . 1 1 9 9 ASP H H 9 8.432 8.432 8.473 -0.041 19570 1229 1 12 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.571 -0.058 19570 1230 1 12 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.197 -0.159 19570 1231 1 12 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.681 -0.505 19570 1232 1 12 . 1 1 10 10 ASN H H 10 9.082 9.082 8.808 0.274 19570 1233 1 12 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.679 -0.015 19570 1234 1 12 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.397 -0.876 19570 1235 1 12 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.796 -2.339 19570 1236 1 12 . 1 1 11 11 ASP H H 11 8.418 8.418 7.954 0.464 19570 1237 1 12 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.494 -0.173 19570 1238 1 12 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.033 -0.105 19570 1239 1 12 . 1 1 12 12 ARG H H 12 8.191 8.191 8.977 -0.786 19570 1240 1 12 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.174 0.046 19570 1241 1 12 . 1 1 13 13 GLY H H 13 7.410 7.410 7.652 -0.242 19570 1242 1 12 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.683 -0.186 19570 1243 1 12 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.184 1.482 19570 1244 1 12 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.734 -0.321 19570 1245 1 12 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.605 -0.161 19570 1246 1 12 . 1 1 15 15 ARG H H 15 8.632 8.632 8.355 0.277 19570 1247 1 12 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.779 -0.209 19570 1248 1 12 . 1 1 16 16 CYS CA C 16 55.690 55.690 60.024 -4.334 19570 1249 1 12 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.053 13.404 19570 1250 1 12 . 1 1 16 16 CYS H H 16 8.968 8.968 8.608 0.360 19570 1251 1 12 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.455 0.109 19570 1252 1 12 . 1 1 17 17 CYS CA C 17 53.495 53.495 58.946 -5.451 19570 1253 1 12 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.730 10.756 19570 1254 1 12 . 1 1 17 17 CYS H H 17 10.147 10.147 8.847 1.300 19570 1255 1 12 . 1 1 18 18 SER HA H 18 4.219 4.219 4.212 0.007 19570 1256 1 12 . 1 1 18 18 SER CA C 18 60.065 60.065 60.125 -0.060 19570 1257 1 12 . 1 1 18 18 SER CB C 18 62.259 62.259 62.678 -0.419 19570 1258 1 12 . 1 1 18 18 SER H H 18 8.943 8.943 8.717 0.226 19570 1259 1 12 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.946 0.465 19570 1260 1 12 . 1 1 19 19 GLY H H 19 8.946 8.946 8.703 0.243 19570 1261 1 12 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.538 -0.258 19570 1262 1 12 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.309 -1.704 19570 1263 1 12 . 1 1 20 20 GLN H H 20 7.902 7.902 7.865 0.037 19570 1264 1 12 . 1 1 21 21 GLY CA C 21 44.825 44.825 45.055 -0.230 19570 1265 1 12 . 1 1 21 21 GLY H H 21 7.685 7.685 8.312 -0.627 19570 1266 1 12 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.032 -0.095 19570 1267 1 12 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.891 -1.058 19570 1268 1 12 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.333 -1.081 19570 1269 1 12 . 1 1 22 22 ASN H H 22 8.318 8.318 8.442 -0.124 19570 1270 1 12 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.530 0.141 19570 1271 1 12 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.715 -7.827 19570 1272 1 12 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.811 12.554 19570 1273 1 12 . 1 1 23 23 CYS H H 23 8.956 8.956 8.673 0.283 19570 1274 1 12 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.402 0.096 19570 1275 1 12 . 1 1 24 24 VAL CB C 24 34.899 34.899 32.794 2.105 19570 1276 1 12 . 1 1 24 24 VAL H H 24 8.895 8.895 8.978 -0.083 19570 1277 1 12 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.796 -0.297 19570 1278 1 12 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.846 -0.066 19570 1279 1 12 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.665 4.196 19570 1280 1 12 . 1 1 26 26 LEU CB C 26 42.984 42.984 45.020 -2.036 19570 1281 1 12 . 1 1 26 26 LEU H H 26 8.145 8.145 8.826 -0.681 19570 1282 1 12 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.389 -0.376 19570 1283 1 12 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.944 0.168 19570 1284 1 12 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.691 1.973 19570 1285 1 12 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.631 -0.444 19570 1286 1 12 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.941 1.918 19570 1287 1 12 . 1 1 28 28 PHE CB C 28 37.698 37.698 40.066 -2.368 19570 1288 1 12 . 1 1 28 28 PHE H H 28 8.364 8.364 8.629 -0.265 19570 1289 1 12 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.959 -0.599 19570 1290 1 12 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.873 0.699 19570 1291 1 12 . 1 1 29 29 LEU CB C 29 44.027 44.027 43.589 0.438 19570 1292 1 12 . 1 1 29 29 LEU H H 29 8.239 8.239 8.289 -0.050 19570 1293 1 12 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.698 -0.044 19570 1294 1 12 . 1 1 30 30 GLY H H 30 7.976 7.976 7.768 0.208 19570 1295 1 12 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.349 1.780 19570 1296 1 12 . 1 1 31 31 GLY H H 31 8.061 8.061 7.756 0.305 19570 1297 1 12 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.328 -0.493 19570 1298 1 12 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.207 1.858 19570 1299 1 12 . 1 1 32 32 VAL CB C 32 36.485 36.485 34.548 1.937 19570 1300 1 12 . 1 1 32 32 VAL H H 32 8.601 8.601 8.942 -0.341 19570 1301 1 12 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.838 0.104 19570 1302 1 12 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.567 -3.176 19570 1303 1 12 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.988 14.310 19570 1304 1 12 . 1 1 33 33 CYS H H 33 7.979 7.979 8.365 -0.386 19570 1305 1 12 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.619 0.135 19570 1306 1 12 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.692 0.137 19570 1307 1 12 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.907 0.696 19570 1308 1 12 . 1 1 34 34 ALA H H 34 9.715 9.715 8.924 0.791 19570 1309 1 13 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.747 0.063 19570 1310 1 13 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.164 -0.126 19570 1311 1 13 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.894 0.530 19570 1312 1 13 . 1 1 2 2 VAL H H 2 8.976 8.976 8.893 0.083 19570 1313 1 13 . 1 1 3 3 LEU HA H 3 4.432 4.432 5.052 -0.620 19570 1314 1 13 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.397 0.742 19570 1315 1 13 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.582 -0.924 19570 1316 1 13 . 1 1 3 3 LEU H H 3 7.973 7.973 9.181 -1.208 19570 1317 1 13 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.685 -0.192 19570 1318 1 13 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.661 0.468 19570 1319 1 13 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.334 1.102 19570 1320 1 13 . 1 1 4 4 ILE H H 4 8.340 8.340 8.426 -0.086 19570 1321 1 13 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.883 -0.134 19570 1322 1 13 . 1 1 5 5 GLY H H 5 9.146 9.146 9.183 -0.037 19570 1323 1 13 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.449 0.043 19570 1324 1 13 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.906 -0.106 19570 1325 1 13 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.864 -0.231 19570 1326 1 13 . 1 1 6 6 GLN H H 6 8.233 8.233 7.592 0.641 19570 1327 1 13 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.742 0.041 19570 1328 1 13 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.792 -1.631 19570 1329 1 13 . 1 1 7 7 ARG H H 7 8.123 8.123 8.446 -0.323 19570 1330 1 13 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.150 -0.263 19570 1331 1 13 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.075 -3.130 19570 1332 1 13 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.786 16.791 19570 1333 1 13 . 1 1 8 8 CYS H H 8 8.013 8.013 9.034 -1.021 19570 1334 1 13 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.825 -0.444 19570 1335 1 13 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.571 0.695 19570 1336 1 13 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.508 -1.395 19570 1337 1 13 . 1 1 9 9 ASP H H 9 8.432 8.432 8.644 -0.212 19570 1338 1 13 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.525 -0.012 19570 1339 1 13 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.032 0.006 19570 1340 1 13 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.782 -0.606 19570 1341 1 13 . 1 1 10 10 ASN H H 10 9.082 9.082 8.856 0.226 19570 1342 1 13 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.595 0.069 19570 1343 1 13 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.096 -0.576 19570 1344 1 13 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.908 -2.451 19570 1345 1 13 . 1 1 11 11 ASP H H 11 8.418 8.418 7.940 0.478 19570 1346 1 13 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.564 -0.243 19570 1347 1 13 . 1 1 12 12 ARG CA C 12 55.928 55.928 55.468 0.460 19570 1348 1 13 . 1 1 12 12 ARG H H 12 8.191 8.191 8.904 -0.713 19570 1349 1 13 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.165 0.055 19570 1350 1 13 . 1 1 13 13 GLY H H 13 7.410 7.410 7.523 -0.113 19570 1351 1 13 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.680 -0.183 19570 1352 1 13 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.283 1.383 19570 1353 1 13 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.614 -0.202 19570 1354 1 13 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.119 -0.675 19570 1355 1 13 . 1 1 15 15 ARG H H 15 8.632 8.632 8.464 0.168 19570 1356 1 13 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.951 -0.381 19570 1357 1 13 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.727 -4.037 19570 1358 1 13 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.169 13.288 19570 1359 1 13 . 1 1 16 16 CYS H H 16 8.968 8.968 8.728 0.240 19570 1360 1 13 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.529 0.035 19570 1361 1 13 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.663 -6.168 19570 1362 1 13 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.341 11.145 19570 1363 1 13 . 1 1 17 17 CYS H H 17 10.147 10.147 8.810 1.337 19570 1364 1 13 . 1 1 18 18 SER HA H 18 4.219 4.219 4.204 0.015 19570 1365 1 13 . 1 1 18 18 SER CA C 18 60.065 60.065 60.733 -0.668 19570 1366 1 13 . 1 1 18 18 SER CB C 18 62.259 62.259 63.205 -0.945 19570 1367 1 13 . 1 1 18 18 SER H H 18 8.943 8.943 8.817 0.126 19570 1368 1 13 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.887 0.524 19570 1369 1 13 . 1 1 19 19 GLY H H 19 8.946 8.946 7.992 0.954 19570 1370 1 13 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.599 -0.319 19570 1371 1 13 . 1 1 20 20 GLN CA C 20 52.605 52.605 53.957 -1.352 19570 1372 1 13 . 1 1 20 20 GLN H H 20 7.902 7.902 8.070 -0.168 19570 1373 1 13 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.906 -0.081 19570 1374 1 13 . 1 1 21 21 GLY H H 21 7.685 7.685 8.031 -0.346 19570 1375 1 13 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.030 -0.093 19570 1376 1 13 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.314 -1.481 19570 1377 1 13 . 1 1 22 22 ASN CB C 22 41.252 41.252 43.059 -1.807 19570 1378 1 13 . 1 1 22 22 ASN H H 22 8.318 8.318 8.648 -0.330 19570 1379 1 13 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.599 0.072 19570 1380 1 13 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.623 -7.735 19570 1381 1 13 . 1 1 23 23 CYS CB C 23 38.365 38.365 26.141 12.224 19570 1382 1 13 . 1 1 23 23 CYS H H 23 8.956 8.956 8.762 0.194 19570 1383 1 13 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.490 0.007 19570 1384 1 13 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.402 1.497 19570 1385 1 13 . 1 1 24 24 VAL H H 24 8.895 8.895 9.193 -0.298 19570 1386 1 13 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.631 -0.132 19570 1387 1 13 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.956 -0.176 19570 1388 1 13 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.454 4.407 19570 1389 1 13 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.222 0.762 19570 1390 1 13 . 1 1 26 26 LEU H H 26 8.145 8.145 8.736 -0.591 19570 1391 1 13 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.549 -0.536 19570 1392 1 13 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.442 0.670 19570 1393 1 13 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.962 1.702 19570 1394 1 13 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.604 -0.417 19570 1395 1 13 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.790 2.069 19570 1396 1 13 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.440 -1.742 19570 1397 1 13 . 1 1 28 28 PHE H H 28 8.364 8.364 8.127 0.237 19570 1398 1 13 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.957 -0.597 19570 1399 1 13 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.470 1.102 19570 1400 1 13 . 1 1 29 29 LEU CB C 29 44.027 44.027 42.505 1.522 19570 1401 1 13 . 1 1 29 29 LEU H H 29 8.239 8.239 8.127 0.112 19570 1402 1 13 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.558 0.096 19570 1403 1 13 . 1 1 30 30 GLY H H 30 7.976 7.976 7.463 0.513 19570 1404 1 13 . 1 1 31 31 GLY CA C 31 46.129 46.129 43.318 2.811 19570 1405 1 13 . 1 1 31 31 GLY H H 31 8.061 8.061 8.171 -0.110 19570 1406 1 13 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.206 -0.371 19570 1407 1 13 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.590 1.475 19570 1408 1 13 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.050 1.435 19570 1409 1 13 . 1 1 32 32 VAL H H 32 8.601 8.601 8.765 -0.164 19570 1410 1 13 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.957 -0.015 19570 1411 1 13 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.464 -3.073 19570 1412 1 13 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.316 13.982 19570 1413 1 13 . 1 1 33 33 CYS H H 33 7.979 7.979 8.532 -0.553 19570 1414 1 13 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.743 0.011 19570 1415 1 13 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.471 0.358 19570 1416 1 13 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.637 0.966 19570 1417 1 13 . 1 1 34 34 ALA H H 34 9.715 9.715 8.880 0.835 19570 1418 1 14 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.845 -0.035 19570 1419 1 14 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.745 0.292 19570 1420 1 14 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.066 0.359 19570 1421 1 14 . 1 1 2 2 VAL H H 2 8.976 8.976 8.827 0.149 19570 1422 1 14 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.689 -0.257 19570 1423 1 14 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.370 0.769 19570 1424 1 14 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.693 -1.035 19570 1425 1 14 . 1 1 3 3 LEU H H 3 7.973 7.973 8.021 -0.048 19570 1426 1 14 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.700 -0.207 19570 1427 1 14 . 1 1 4 4 ILE CA C 4 63.129 63.129 63.448 -0.319 19570 1428 1 14 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.184 1.252 19570 1429 1 14 . 1 1 4 4 ILE H H 4 8.340 8.340 8.364 -0.024 19570 1430 1 14 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.899 -0.150 19570 1431 1 14 . 1 1 5 5 GLY H H 5 9.146 9.146 9.157 -0.011 19570 1432 1 14 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.474 0.018 19570 1433 1 14 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.858 -0.058 19570 1434 1 14 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.170 -0.537 19570 1435 1 14 . 1 1 6 6 GLN H H 6 8.233 8.233 7.711 0.522 19570 1436 1 14 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.235 -0.452 19570 1437 1 14 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.347 -2.186 19570 1438 1 14 . 1 1 7 7 ARG H H 7 8.123 8.123 8.576 -0.453 19570 1439 1 14 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.153 -0.266 19570 1440 1 14 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.230 -3.284 19570 1441 1 14 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.932 16.645 19570 1442 1 14 . 1 1 8 8 CYS H H 8 8.013 8.013 9.003 -0.990 19570 1443 1 14 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.893 -0.512 19570 1444 1 14 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.740 0.526 19570 1445 1 14 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.159 -1.046 19570 1446 1 14 . 1 1 9 9 ASP H H 9 8.432 8.432 8.658 -0.226 19570 1447 1 14 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.398 0.115 19570 1448 1 14 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.206 -1.168 19570 1449 1 14 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.804 -0.628 19570 1450 1 14 . 1 1 10 10 ASN H H 10 9.082 9.082 8.731 0.351 19570 1451 1 14 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.655 0.009 19570 1452 1 14 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.639 -1.117 19570 1453 1 14 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.358 -1.901 19570 1454 1 14 . 1 1 11 11 ASP H H 11 8.418 8.418 8.431 -0.013 19570 1455 1 14 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.367 -0.046 19570 1456 1 14 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.254 -0.326 19570 1457 1 14 . 1 1 12 12 ARG H H 12 8.191 8.191 8.995 -0.804 19570 1458 1 14 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.334 -0.114 19570 1459 1 14 . 1 1 13 13 GLY H H 13 7.410 7.410 7.626 -0.216 19570 1460 1 14 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.659 -0.162 19570 1461 1 14 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.200 1.466 19570 1462 1 14 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.713 -0.300 19570 1463 1 14 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.594 -0.150 19570 1464 1 14 . 1 1 15 15 ARG H H 15 8.632 8.632 8.391 0.241 19570 1465 1 14 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.893 -0.323 19570 1466 1 14 . 1 1 16 16 CYS CA C 16 55.690 55.690 60.010 -4.320 19570 1467 1 14 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.556 12.901 19570 1468 1 14 . 1 1 16 16 CYS H H 16 8.968 8.968 8.706 0.262 19570 1469 1 14 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.439 0.125 19570 1470 1 14 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.293 -5.798 19570 1471 1 14 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.761 11.726 19570 1472 1 14 . 1 1 17 17 CYS H H 17 10.147 10.147 9.035 1.112 19570 1473 1 14 . 1 1 18 18 SER HA H 18 4.219 4.219 4.242 -0.022 19570 1474 1 14 . 1 1 18 18 SER CA C 18 60.065 60.065 60.205 -0.140 19570 1475 1 14 . 1 1 18 18 SER CB C 18 62.259 62.259 61.938 0.321 19570 1476 1 14 . 1 1 18 18 SER H H 18 8.943 8.943 8.706 0.237 19570 1477 1 14 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.212 0.199 19570 1478 1 14 . 1 1 19 19 GLY H H 19 8.946 8.946 8.161 0.785 19570 1479 1 14 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.470 -0.190 19570 1480 1 14 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.691 -2.086 19570 1481 1 14 . 1 1 20 20 GLN H H 20 7.902 7.902 8.533 -0.631 19570 1482 1 14 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.511 0.314 19570 1483 1 14 . 1 1 21 21 GLY H H 21 7.685 7.685 7.894 -0.209 19570 1484 1 14 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.992 -0.055 19570 1485 1 14 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.324 -1.491 19570 1486 1 14 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.151 -0.900 19570 1487 1 14 . 1 1 22 22 ASN H H 22 8.318 8.318 8.669 -0.351 19570 1488 1 14 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.634 0.037 19570 1489 1 14 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.495 -7.607 19570 1490 1 14 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.647 12.718 19570 1491 1 14 . 1 1 23 23 CYS H H 23 8.956 8.956 8.822 0.134 19570 1492 1 14 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.565 -0.068 19570 1493 1 14 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.424 0.475 19570 1494 1 14 . 1 1 24 24 VAL H H 24 8.895 8.895 8.946 -0.051 19570 1495 1 14 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.837 -0.338 19570 1496 1 14 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.735 0.045 19570 1497 1 14 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.683 4.178 19570 1498 1 14 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.283 0.701 19570 1499 1 14 . 1 1 26 26 LEU H H 26 8.145 8.145 8.400 -0.255 19570 1500 1 14 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.124 -0.111 19570 1501 1 14 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.734 -1.622 19570 1502 1 14 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.797 -0.133 19570 1503 1 14 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.649 -0.462 19570 1504 1 14 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.141 2.719 19570 1505 1 14 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.048 -0.350 19570 1506 1 14 . 1 1 28 28 PHE H H 28 8.364 8.364 7.131 1.233 19570 1507 1 14 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.340 0.020 19570 1508 1 14 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.133 0.439 19570 1509 1 14 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.685 2.342 19570 1510 1 14 . 1 1 29 29 LEU H H 29 8.239 8.239 7.483 0.756 19570 1511 1 14 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.741 -0.087 19570 1512 1 14 . 1 1 30 30 GLY H H 30 7.976 7.976 8.443 -0.467 19570 1513 1 14 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.189 0.940 19570 1514 1 14 . 1 1 31 31 GLY H H 31 8.061 8.061 7.787 0.274 19570 1515 1 14 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.282 -0.447 19570 1516 1 14 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.772 1.293 19570 1517 1 14 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.108 1.377 19570 1518 1 14 . 1 1 32 32 VAL H H 32 8.601 8.601 8.752 -0.151 19570 1519 1 14 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.654 0.288 19570 1520 1 14 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.239 -2.848 19570 1521 1 14 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.575 14.723 19570 1522 1 14 . 1 1 33 33 CYS H H 33 7.979 7.979 8.509 -0.530 19570 1523 1 14 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.801 -0.047 19570 1524 1 14 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.069 0.760 19570 1525 1 14 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.633 -0.030 19570 1526 1 14 . 1 1 34 34 ALA H H 34 9.715 9.715 8.926 0.789 19570 1527 1 15 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.732 0.078 19570 1528 1 15 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.788 0.250 19570 1529 1 15 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.320 0.104 19570 1530 1 15 . 1 1 2 2 VAL H H 2 8.976 8.976 8.705 0.271 19570 1531 1 15 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.670 -0.238 19570 1532 1 15 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.538 0.601 19570 1533 1 15 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.670 -1.012 19570 1534 1 15 . 1 1 3 3 LEU H H 3 7.973 7.973 7.899 0.074 19570 1535 1 15 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.831 -0.338 19570 1536 1 15 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.381 0.748 19570 1537 1 15 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.092 1.344 19570 1538 1 15 . 1 1 4 4 ILE H H 4 8.340 8.340 8.519 -0.179 19570 1539 1 15 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.799 -0.050 19570 1540 1 15 . 1 1 5 5 GLY H H 5 9.146 9.146 9.211 -0.065 19570 1541 1 15 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.583 -0.091 19570 1542 1 15 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.170 0.630 19570 1543 1 15 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.776 -1.143 19570 1544 1 15 . 1 1 6 6 GLN H H 6 8.233 8.233 7.809 0.424 19570 1545 1 15 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.788 -0.005 19570 1546 1 15 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.607 -2.446 19570 1547 1 15 . 1 1 7 7 ARG H H 7 8.123 8.123 8.650 -0.527 19570 1548 1 15 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.195 -0.308 19570 1549 1 15 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.439 -3.494 19570 1550 1 15 . 1 1 8 8 CYS CB C 8 48.577 48.577 32.116 16.461 19570 1551 1 15 . 1 1 8 8 CYS H H 8 8.013 8.013 9.011 -0.998 19570 1552 1 15 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.948 -0.567 19570 1553 1 15 . 1 1 9 9 ASP CA C 9 54.266 54.266 54.486 -0.220 19570 1554 1 15 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.218 -1.105 19570 1555 1 15 . 1 1 9 9 ASP H H 9 8.432 8.432 8.775 -0.343 19570 1556 1 15 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.378 0.135 19570 1557 1 15 . 1 1 10 10 ASN CA C 10 55.038 55.038 56.542 -1.504 19570 1558 1 15 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.773 -0.597 19570 1559 1 15 . 1 1 10 10 ASN H H 10 9.082 9.082 8.859 0.223 19570 1560 1 15 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.624 0.040 19570 1561 1 15 . 1 1 11 11 ASP CA C 11 55.521 55.521 55.916 -0.395 19570 1562 1 15 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.600 -2.143 19570 1563 1 15 . 1 1 11 11 ASP H H 11 8.418 8.418 7.822 0.596 19570 1564 1 15 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.452 -0.132 19570 1565 1 15 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.024 -0.096 19570 1566 1 15 . 1 1 12 12 ARG H H 12 8.191 8.191 9.049 -0.858 19570 1567 1 15 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.064 0.156 19570 1568 1 15 . 1 1 13 13 GLY H H 13 7.410 7.410 7.805 -0.395 19570 1569 1 15 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.624 -0.127 19570 1570 1 15 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.061 1.605 19570 1571 1 15 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.735 -0.322 19570 1572 1 15 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.837 -0.393 19570 1573 1 15 . 1 1 15 15 ARG H H 15 8.632 8.632 8.471 0.161 19570 1574 1 15 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.950 -0.380 19570 1575 1 15 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.560 -3.870 19570 1576 1 15 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.158 13.299 19570 1577 1 15 . 1 1 16 16 CYS H H 16 8.968 8.968 8.702 0.266 19570 1578 1 15 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.421 0.143 19570 1579 1 15 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.484 -5.989 19570 1580 1 15 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.464 11.022 19570 1581 1 15 . 1 1 17 17 CYS H H 17 10.147 10.147 8.888 1.259 19570 1582 1 15 . 1 1 18 18 SER HA H 18 4.219 4.219 4.187 0.032 19570 1583 1 15 . 1 1 18 18 SER CA C 18 60.065 60.065 59.941 0.124 19570 1584 1 15 . 1 1 18 18 SER CB C 18 62.259 62.259 62.279 -0.020 19570 1585 1 15 . 1 1 18 18 SER H H 18 8.943 8.943 8.759 0.184 19570 1586 1 15 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.871 0.540 19570 1587 1 15 . 1 1 19 19 GLY H H 19 8.946 8.946 8.403 0.543 19570 1588 1 15 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.519 -0.239 19570 1589 1 15 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.734 -2.129 19570 1590 1 15 . 1 1 20 20 GLN H H 20 7.902 7.902 8.095 -0.193 19570 1591 1 15 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.841 -0.016 19570 1592 1 15 . 1 1 21 21 GLY H H 21 7.685 7.685 8.093 -0.408 19570 1593 1 15 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.998 -0.061 19570 1594 1 15 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.346 -1.514 19570 1595 1 15 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.378 -1.126 19570 1596 1 15 . 1 1 22 22 ASN H H 22 8.318 8.318 8.624 -0.306 19570 1597 1 15 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.836 -0.165 19570 1598 1 15 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.255 -6.367 19570 1599 1 15 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.698 12.667 19570 1600 1 15 . 1 1 23 23 CYS H H 23 8.956 8.956 8.623 0.333 19570 1601 1 15 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.624 -0.127 19570 1602 1 15 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.450 0.449 19570 1603 1 15 . 1 1 24 24 VAL H H 24 8.895 8.895 8.900 -0.005 19570 1604 1 15 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.627 -0.128 19570 1605 1 15 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.805 -0.025 19570 1606 1 15 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.705 4.156 19570 1607 1 15 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.146 -0.162 19570 1608 1 15 . 1 1 26 26 LEU H H 26 8.145 8.145 8.255 -0.110 19570 1609 1 15 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.418 -0.405 19570 1610 1 15 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.551 0.561 19570 1611 1 15 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.788 1.876 19570 1612 1 15 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.601 -0.414 19570 1613 1 15 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.374 2.485 19570 1614 1 15 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.042 -1.344 19570 1615 1 15 . 1 1 28 28 PHE H H 28 8.364 8.364 8.386 -0.022 19570 1616 1 15 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.642 -0.282 19570 1617 1 15 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.054 0.518 19570 1618 1 15 . 1 1 29 29 LEU CB C 29 44.027 44.027 42.617 1.410 19570 1619 1 15 . 1 1 29 29 LEU H H 29 8.239 8.239 8.321 -0.082 19570 1620 1 15 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.270 -0.616 19570 1621 1 15 . 1 1 30 30 GLY H H 30 7.976 7.976 7.570 0.406 19570 1622 1 15 . 1 1 31 31 GLY CA C 31 46.129 46.129 43.008 3.121 19570 1623 1 15 . 1 1 31 31 GLY H H 31 8.061 8.061 8.735 -0.674 19570 1624 1 15 . 1 1 32 32 VAL HA H 32 4.835 4.835 4.921 -0.086 19570 1625 1 15 . 1 1 32 32 VAL CA C 32 60.065 60.065 59.488 0.577 19570 1626 1 15 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.897 0.588 19570 1627 1 15 . 1 1 32 32 VAL H H 32 8.601 8.601 8.670 -0.069 19570 1628 1 15 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.125 -0.183 19570 1629 1 15 . 1 1 33 33 CYS CA C 33 56.391 56.391 57.753 -1.362 19570 1630 1 15 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.486 13.812 19570 1631 1 15 . 1 1 33 33 CYS H H 33 7.979 7.979 8.451 -0.472 19570 1632 1 15 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.725 0.029 19570 1633 1 15 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.026 0.803 19570 1634 1 15 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.264 0.340 19570 1635 1 15 . 1 1 34 34 ALA H H 34 9.715 9.715 8.691 1.024 19570 1636 1 16 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.635 0.175 19570 1637 1 16 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.291 -0.253 19570 1638 1 16 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.098 0.326 19570 1639 1 16 . 1 1 2 2 VAL H H 2 8.976 8.976 8.844 0.132 19570 1640 1 16 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.511 -0.079 19570 1641 1 16 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.880 0.259 19570 1642 1 16 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.160 -0.502 19570 1643 1 16 . 1 1 3 3 LEU H H 3 7.973 7.973 8.357 -0.384 19570 1644 1 16 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.830 -0.337 19570 1645 1 16 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.629 0.500 19570 1646 1 16 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.561 0.875 19570 1647 1 16 . 1 1 4 4 ILE H H 4 8.340 8.340 8.042 0.298 19570 1648 1 16 . 1 1 5 5 GLY CA C 5 44.749 44.749 45.270 -0.521 19570 1649 1 16 . 1 1 5 5 GLY H H 5 9.146 9.146 9.124 0.022 19570 1650 1 16 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.440 0.052 19570 1651 1 16 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.375 -0.575 19570 1652 1 16 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.727 -0.094 19570 1653 1 16 . 1 1 6 6 GLN H H 6 8.233 8.233 7.594 0.639 19570 1654 1 16 . 1 1 7 7 ARG HA H 7 4.783 4.783 5.133 -0.350 19570 1655 1 16 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.692 -1.531 19570 1656 1 16 . 1 1 7 7 ARG H H 7 8.123 8.123 8.551 -0.428 19570 1657 1 16 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.102 -0.215 19570 1658 1 16 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.865 -2.920 19570 1659 1 16 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.585 16.991 19570 1660 1 16 . 1 1 8 8 CYS H H 8 8.013 8.013 9.066 -1.053 19570 1661 1 16 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.933 -0.552 19570 1662 1 16 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.375 0.891 19570 1663 1 16 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.778 -1.665 19570 1664 1 16 . 1 1 9 9 ASP H H 9 8.432 8.432 8.691 -0.259 19570 1665 1 16 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.547 -0.034 19570 1666 1 16 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.327 -0.289 19570 1667 1 16 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.794 -0.618 19570 1668 1 16 . 1 1 10 10 ASN H H 10 9.082 9.082 8.784 0.298 19570 1669 1 16 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.619 0.045 19570 1670 1 16 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.737 -1.216 19570 1671 1 16 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.367 -1.910 19570 1672 1 16 . 1 1 11 11 ASP H H 11 8.418 8.418 7.960 0.458 19570 1673 1 16 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.494 -0.173 19570 1674 1 16 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.039 -0.111 19570 1675 1 16 . 1 1 12 12 ARG H H 12 8.191 8.191 9.089 -0.898 19570 1676 1 16 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.255 -0.035 19570 1677 1 16 . 1 1 13 13 GLY H H 13 7.410 7.410 7.621 -0.211 19570 1678 1 16 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.594 -0.097 19570 1679 1 16 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.293 1.373 19570 1680 1 16 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.691 -0.278 19570 1681 1 16 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.684 -0.240 19570 1682 1 16 . 1 1 15 15 ARG H H 15 8.632 8.632 8.377 0.255 19570 1683 1 16 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.005 -0.435 19570 1684 1 16 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.519 -3.829 19570 1685 1 16 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.274 13.183 19570 1686 1 16 . 1 1 16 16 CYS H H 16 8.968 8.968 8.662 0.306 19570 1687 1 16 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.520 0.044 19570 1688 1 16 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.265 -5.770 19570 1689 1 16 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.928 11.558 19570 1690 1 16 . 1 1 17 17 CYS H H 17 10.147 10.147 8.976 1.171 19570 1691 1 16 . 1 1 18 18 SER HA H 18 4.219 4.219 4.222 -0.003 19570 1692 1 16 . 1 1 18 18 SER CA C 18 60.065 60.065 59.839 0.226 19570 1693 1 16 . 1 1 18 18 SER CB C 18 62.259 62.259 62.600 -0.341 19570 1694 1 16 . 1 1 18 18 SER H H 18 8.943 8.943 8.603 0.340 19570 1695 1 16 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.049 0.362 19570 1696 1 16 . 1 1 19 19 GLY H H 19 8.946 8.946 8.643 0.303 19570 1697 1 16 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.446 -0.166 19570 1698 1 16 . 1 1 20 20 GLN CA C 20 52.605 52.605 55.191 -2.586 19570 1699 1 16 . 1 1 20 20 GLN H H 20 7.902 7.902 8.423 -0.521 19570 1700 1 16 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.575 0.250 19570 1701 1 16 . 1 1 21 21 GLY H H 21 7.685 7.685 7.883 -0.198 19570 1702 1 16 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.001 -0.064 19570 1703 1 16 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.363 -1.530 19570 1704 1 16 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.324 -1.072 19570 1705 1 16 . 1 1 22 22 ASN H H 22 8.318 8.318 8.548 -0.230 19570 1706 1 16 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.640 0.031 19570 1707 1 16 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.009 -7.121 19570 1708 1 16 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.491 12.874 19570 1709 1 16 . 1 1 23 23 CYS H H 23 8.956 8.956 8.833 0.123 19570 1710 1 16 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.619 -0.122 19570 1711 1 16 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.608 0.291 19570 1712 1 16 . 1 1 24 24 VAL H H 24 8.895 8.895 9.070 -0.175 19570 1713 1 16 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.513 -0.014 19570 1714 1 16 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.787 -0.007 19570 1715 1 16 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.657 4.204 19570 1716 1 16 . 1 1 26 26 LEU CB C 26 42.984 42.984 44.529 -1.545 19570 1717 1 16 . 1 1 26 26 LEU H H 26 8.145 8.145 8.708 -0.563 19570 1718 1 16 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.361 -0.348 19570 1719 1 16 . 1 1 27 27 PRO CA C 27 64.112 64.112 64.347 -0.235 19570 1720 1 16 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.912 1.752 19570 1721 1 16 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.637 -0.450 19570 1722 1 16 . 1 1 28 28 PHE CA C 28 60.859 60.859 59.182 1.677 19570 1723 1 16 . 1 1 28 28 PHE CB C 28 37.698 37.698 40.180 -2.482 19570 1724 1 16 . 1 1 28 28 PHE H H 28 8.364 8.364 8.618 -0.254 19570 1725 1 16 . 1 1 29 29 LEU HA H 29 4.360 4.360 5.005 -0.645 19570 1726 1 16 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.074 0.498 19570 1727 1 16 . 1 1 29 29 LEU CB C 29 44.027 44.027 44.118 -0.091 19570 1728 1 16 . 1 1 29 29 LEU H H 29 8.239 8.239 7.993 0.246 19570 1729 1 16 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.341 0.313 19570 1730 1 16 . 1 1 30 30 GLY H H 30 7.976 7.976 8.024 -0.048 19570 1731 1 16 . 1 1 31 31 GLY CA C 31 46.129 46.129 43.742 2.387 19570 1732 1 16 . 1 1 31 31 GLY H H 31 8.061 8.061 8.560 -0.499 19570 1733 1 16 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.255 -0.420 19570 1734 1 16 . 1 1 32 32 VAL CA C 32 60.065 60.065 57.716 2.349 19570 1735 1 16 . 1 1 32 32 VAL CB C 32 36.485 36.485 34.542 1.943 19570 1736 1 16 . 1 1 32 32 VAL H H 32 8.601 8.601 8.800 -0.199 19570 1737 1 16 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.618 0.324 19570 1738 1 16 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.293 -2.902 19570 1739 1 16 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.705 14.593 19570 1740 1 16 . 1 1 33 33 CYS H H 33 7.979 7.979 8.541 -0.562 19570 1741 1 16 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.894 -0.140 19570 1742 1 16 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.693 1.136 19570 1743 1 16 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.184 0.419 19570 1744 1 16 . 1 1 34 34 ALA H H 34 9.715 9.715 8.738 0.977 19570 1745 1 17 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.716 0.094 19570 1746 1 17 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.696 0.342 19570 1747 1 17 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.528 -0.104 19570 1748 1 17 . 1 1 2 2 VAL H H 2 8.976 8.976 8.772 0.204 19570 1749 1 17 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.562 -0.130 19570 1750 1 17 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.635 0.504 19570 1751 1 17 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.317 -0.659 19570 1752 1 17 . 1 1 3 3 LEU H H 3 7.973 7.973 7.839 0.134 19570 1753 1 17 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.644 -0.151 19570 1754 1 17 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.629 0.500 19570 1755 1 17 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.331 1.105 19570 1756 1 17 . 1 1 4 4 ILE H H 4 8.340 8.340 8.378 -0.038 19570 1757 1 17 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.866 -0.117 19570 1758 1 17 . 1 1 5 5 GLY H H 5 9.146 9.146 9.118 0.028 19570 1759 1 17 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.516 -0.024 19570 1760 1 17 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.737 0.063 19570 1761 1 17 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.289 -0.656 19570 1762 1 17 . 1 1 6 6 GLN H H 6 8.233 8.233 7.672 0.561 19570 1763 1 17 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.832 -0.049 19570 1764 1 17 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.619 -2.458 19570 1765 1 17 . 1 1 7 7 ARG H H 7 8.123 8.123 8.625 -0.502 19570 1766 1 17 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.749 0.138 19570 1767 1 17 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.432 -3.487 19570 1768 1 17 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.587 16.990 19570 1769 1 17 . 1 1 8 8 CYS H H 8 8.013 8.013 8.923 -0.910 19570 1770 1 17 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.927 -0.546 19570 1771 1 17 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.032 1.234 19570 1772 1 17 . 1 1 9 9 ASP CB C 9 43.113 43.113 43.933 -0.820 19570 1773 1 17 . 1 1 9 9 ASP H H 9 8.432 8.432 8.584 -0.152 19570 1774 1 17 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.488 0.025 19570 1775 1 17 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.664 -0.626 19570 1776 1 17 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.844 -0.668 19570 1777 1 17 . 1 1 10 10 ASN H H 10 9.082 9.082 8.765 0.317 19570 1778 1 17 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.618 0.046 19570 1779 1 17 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.194 -0.673 19570 1780 1 17 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.785 -2.328 19570 1781 1 17 . 1 1 11 11 ASP H H 11 8.418 8.418 8.266 0.152 19570 1782 1 17 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.462 -0.141 19570 1783 1 17 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.116 -0.188 19570 1784 1 17 . 1 1 12 12 ARG H H 12 8.191 8.191 8.934 -0.743 19570 1785 1 17 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.066 0.154 19570 1786 1 17 . 1 1 13 13 GLY H H 13 7.410 7.410 7.685 -0.275 19570 1787 1 17 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.604 -0.107 19570 1788 1 17 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.967 1.699 19570 1789 1 17 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.890 -0.477 19570 1790 1 17 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.501 -0.057 19570 1791 1 17 . 1 1 15 15 ARG H H 15 8.632 8.632 8.334 0.298 19570 1792 1 17 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.924 -0.354 19570 1793 1 17 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.671 -3.981 19570 1794 1 17 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.383 13.074 19570 1795 1 17 . 1 1 16 16 CYS H H 16 8.968 8.968 8.533 0.435 19570 1796 1 17 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.467 0.097 19570 1797 1 17 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.528 -6.033 19570 1798 1 17 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.371 11.115 19570 1799 1 17 . 1 1 17 17 CYS H H 17 10.147 10.147 8.879 1.268 19570 1800 1 17 . 1 1 18 18 SER HA H 18 4.219 4.219 4.203 0.016 19570 1801 1 17 . 1 1 18 18 SER CA C 18 60.065 60.065 60.013 0.052 19570 1802 1 17 . 1 1 18 18 SER CB C 18 62.259 62.259 62.551 -0.292 19570 1803 1 17 . 1 1 18 18 SER H H 18 8.943 8.943 8.661 0.282 19570 1804 1 17 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.089 0.322 19570 1805 1 17 . 1 1 19 19 GLY H H 19 8.946 8.946 8.212 0.734 19570 1806 1 17 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.601 -0.321 19570 1807 1 17 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.670 -2.066 19570 1808 1 17 . 1 1 20 20 GLN H H 20 7.902 7.902 8.390 -0.488 19570 1809 1 17 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.934 -0.109 19570 1810 1 17 . 1 1 21 21 GLY H H 21 7.685 7.685 7.995 -0.310 19570 1811 1 17 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.025 -0.088 19570 1812 1 17 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.679 -1.846 19570 1813 1 17 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.740 -1.488 19570 1814 1 17 . 1 1 22 22 ASN H H 22 8.318 8.318 8.478 -0.160 19570 1815 1 17 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.573 0.098 19570 1816 1 17 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.581 -7.693 19570 1817 1 17 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.939 12.426 19570 1818 1 17 . 1 1 23 23 CYS H H 23 8.956 8.956 8.770 0.186 19570 1819 1 17 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.624 -0.127 19570 1820 1 17 . 1 1 24 24 VAL CB C 24 34.899 34.899 34.785 0.113 19570 1821 1 17 . 1 1 24 24 VAL H H 24 8.895 8.895 9.211 -0.316 19570 1822 1 17 . 1 1 25 25 PRO HA H 25 4.499 4.499 5.020 -0.521 19570 1823 1 17 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.754 0.026 19570 1824 1 17 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.276 4.585 19570 1825 1 17 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.581 0.403 19570 1826 1 17 . 1 1 26 26 LEU H H 26 8.145 8.145 8.483 -0.338 19570 1827 1 17 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.165 -0.152 19570 1828 1 17 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.713 -1.601 19570 1829 1 17 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.793 -0.129 19570 1830 1 17 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.578 -0.391 19570 1831 1 17 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.337 2.522 19570 1832 1 17 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.310 -0.612 19570 1833 1 17 . 1 1 28 28 PHE H H 28 8.364 8.364 7.205 1.159 19570 1834 1 17 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.256 0.104 19570 1835 1 17 . 1 1 29 29 LEU CA C 29 55.572 55.572 56.068 -0.496 19570 1836 1 17 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.854 2.173 19570 1837 1 17 . 1 1 29 29 LEU H H 29 8.239 8.239 7.480 0.759 19570 1838 1 17 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.025 -0.371 19570 1839 1 17 . 1 1 30 30 GLY H H 30 7.976 7.976 7.889 0.087 19570 1840 1 17 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.893 1.236 19570 1841 1 17 . 1 1 31 31 GLY H H 31 8.061 8.061 7.578 0.483 19570 1842 1 17 . 1 1 32 32 VAL HA H 32 4.835 4.835 4.949 -0.114 19570 1843 1 17 . 1 1 32 32 VAL CA C 32 60.065 60.065 59.852 0.213 19570 1844 1 17 . 1 1 32 32 VAL CB C 32 36.485 36.485 36.544 -0.059 19570 1845 1 17 . 1 1 32 32 VAL H H 32 8.601 8.601 8.949 -0.348 19570 1846 1 17 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.864 0.078 19570 1847 1 17 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.624 -2.233 19570 1848 1 17 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.823 13.475 19570 1849 1 17 . 1 1 33 33 CYS H H 33 7.979 7.979 8.544 -0.565 19570 1850 1 17 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.717 0.037 19570 1851 1 17 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.505 0.324 19570 1852 1 17 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.408 1.195 19570 1853 1 17 . 1 1 34 34 ALA H H 34 9.715 9.715 8.447 1.268 19570 1854 1 18 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.667 0.143 19570 1855 1 18 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.234 -0.196 19570 1856 1 18 . 1 1 2 2 VAL CB C 2 34.424 34.424 33.636 0.788 19570 1857 1 18 . 1 1 2 2 VAL H H 2 8.976 8.976 8.537 0.439 19570 1858 1 18 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.630 -0.198 19570 1859 1 18 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.510 0.629 19570 1860 1 18 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.936 -1.278 19570 1861 1 18 . 1 1 3 3 LEU H H 3 7.973 7.973 7.593 0.380 19570 1862 1 18 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.815 -0.322 19570 1863 1 18 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.044 1.085 19570 1864 1 18 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.053 1.383 19570 1865 1 18 . 1 1 4 4 ILE H H 4 8.340 8.340 8.760 -0.420 19570 1866 1 18 . 1 1 5 5 GLY CA C 5 44.749 44.749 45.165 -0.416 19570 1867 1 18 . 1 1 5 5 GLY H H 5 9.146 9.146 8.966 0.180 19570 1868 1 18 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.389 0.103 19570 1869 1 18 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.013 -0.213 19570 1870 1 18 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.195 -0.562 19570 1871 1 18 . 1 1 6 6 GLN H H 6 8.233 8.233 7.584 0.649 19570 1872 1 18 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.992 -0.209 19570 1873 1 18 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.027 -1.866 19570 1874 1 18 . 1 1 7 7 ARG H H 7 8.123 8.123 8.407 -0.284 19570 1875 1 18 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.466 -0.579 19570 1876 1 18 . 1 1 8 8 CYS CA C 8 52.945 52.945 55.565 -2.620 19570 1877 1 18 . 1 1 8 8 CYS CB C 8 48.577 48.577 30.947 17.630 19570 1878 1 18 . 1 1 8 8 CYS H H 8 8.013 8.013 8.855 -0.842 19570 1879 1 18 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.934 -0.553 19570 1880 1 18 . 1 1 9 9 ASP CA C 9 54.266 54.266 54.083 0.183 19570 1881 1 18 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.643 -1.530 19570 1882 1 18 . 1 1 9 9 ASP H H 9 8.432 8.432 8.579 -0.147 19570 1883 1 18 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.571 -0.058 19570 1884 1 18 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.375 -0.337 19570 1885 1 18 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.613 -0.437 19570 1886 1 18 . 1 1 10 10 ASN H H 10 9.082 9.082 8.840 0.242 19570 1887 1 18 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.667 -0.003 19570 1888 1 18 . 1 1 11 11 ASP CA C 11 55.521 55.521 57.129 -1.608 19570 1889 1 18 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.595 -2.138 19570 1890 1 18 . 1 1 11 11 ASP H H 11 8.418 8.418 7.950 0.468 19570 1891 1 18 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.354 -0.033 19570 1892 1 18 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.299 -0.371 19570 1893 1 18 . 1 1 12 12 ARG H H 12 8.191 8.191 9.106 -0.915 19570 1894 1 18 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.007 0.213 19570 1895 1 18 . 1 1 13 13 GLY H H 13 7.410 7.410 7.567 -0.157 19570 1896 1 18 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.607 -0.110 19570 1897 1 18 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.917 1.749 19570 1898 1 18 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.565 -0.152 19570 1899 1 18 . 1 1 15 15 ARG CA C 15 54.444 54.444 55.298 -0.855 19570 1900 1 18 . 1 1 15 15 ARG H H 15 8.632 8.632 8.467 0.165 19570 1901 1 18 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.007 -0.437 19570 1902 1 18 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.467 -3.777 19570 1903 1 18 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.927 12.530 19570 1904 1 18 . 1 1 16 16 CYS H H 16 8.968 8.968 8.756 0.212 19570 1905 1 18 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.375 0.189 19570 1906 1 18 . 1 1 17 17 CYS CA C 17 53.495 53.495 58.961 -5.466 19570 1907 1 18 . 1 1 17 17 CYS CB C 17 39.486 39.486 27.366 12.120 19570 1908 1 18 . 1 1 17 17 CYS H H 17 10.147 10.147 8.831 1.316 19570 1909 1 18 . 1 1 18 18 SER HA H 18 4.219 4.219 4.179 0.040 19570 1910 1 18 . 1 1 18 18 SER CA C 18 60.065 60.065 60.322 -0.257 19570 1911 1 18 . 1 1 18 18 SER CB C 18 62.259 62.259 62.311 -0.052 19570 1912 1 18 . 1 1 18 18 SER H H 18 8.943 8.943 8.751 0.193 19570 1913 1 18 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.867 0.544 19570 1914 1 18 . 1 1 19 19 GLY H H 19 8.946 8.946 8.299 0.647 19570 1915 1 18 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.544 -0.264 19570 1916 1 18 . 1 1 20 20 GLN CA C 20 52.605 52.605 55.295 -2.690 19570 1917 1 18 . 1 1 20 20 GLN H H 20 7.902 7.902 8.073 -0.171 19570 1918 1 18 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.501 0.325 19570 1919 1 18 . 1 1 21 21 GLY H H 21 7.685 7.685 8.345 -0.660 19570 1920 1 18 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.670 0.267 19570 1921 1 18 . 1 1 22 22 ASN CA C 22 50.833 50.833 53.012 -2.179 19570 1922 1 18 . 1 1 22 22 ASN CB C 22 41.252 41.252 40.788 0.464 19570 1923 1 18 . 1 1 22 22 ASN H H 22 8.318 8.318 8.409 -0.091 19570 1924 1 18 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.617 0.054 19570 1925 1 18 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.338 -6.450 19570 1926 1 18 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.563 12.802 19570 1927 1 18 . 1 1 23 23 CYS H H 23 8.956 8.956 8.751 0.205 19570 1928 1 18 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.443 0.054 19570 1929 1 18 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.175 1.724 19570 1930 1 18 . 1 1 24 24 VAL H H 24 8.895 8.895 8.803 0.092 19570 1931 1 18 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.462 0.037 19570 1932 1 18 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.772 0.008 19570 1933 1 18 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.532 4.329 19570 1934 1 18 . 1 1 26 26 LEU CB C 26 42.984 42.984 44.103 -1.119 19570 1935 1 18 . 1 1 26 26 LEU H H 26 8.145 8.145 7.933 0.212 19570 1936 1 18 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.337 -0.324 19570 1937 1 18 . 1 1 27 27 PRO CA C 27 64.112 64.112 63.636 0.476 19570 1938 1 18 . 1 1 27 27 PRO CB C 27 31.664 31.664 29.908 1.756 19570 1939 1 18 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.555 -0.368 19570 1940 1 18 . 1 1 28 28 PHE CA C 28 60.859 60.859 59.028 1.831 19570 1941 1 18 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.915 -2.217 19570 1942 1 18 . 1 1 28 28 PHE H H 28 8.364 8.364 8.055 0.309 19570 1943 1 18 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.785 -0.425 19570 1944 1 18 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.768 0.804 19570 1945 1 18 . 1 1 29 29 LEU CB C 29 44.027 44.027 43.674 0.353 19570 1946 1 18 . 1 1 29 29 LEU H H 29 8.239 8.239 7.908 0.331 19570 1947 1 18 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.225 0.429 19570 1948 1 18 . 1 1 30 30 GLY H H 30 7.976 7.976 7.758 0.218 19570 1949 1 18 . 1 1 31 31 GLY CA C 31 46.129 46.129 43.991 2.138 19570 1950 1 18 . 1 1 31 31 GLY H H 31 8.061 8.061 8.579 -0.518 19570 1951 1 18 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.272 -0.437 19570 1952 1 18 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.486 1.579 19570 1953 1 18 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.352 1.133 19570 1954 1 18 . 1 1 32 32 VAL H H 32 8.601 8.601 8.733 -0.132 19570 1955 1 18 . 1 1 33 33 CYS HA H 33 4.942 4.942 5.235 -0.293 19570 1956 1 18 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.751 -2.360 19570 1957 1 18 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.486 13.812 19570 1958 1 18 . 1 1 33 33 CYS H H 33 7.979 7.979 8.378 -0.399 19570 1959 1 18 . 1 1 34 34 ALA HA H 34 4.754 4.754 5.008 -0.254 19570 1960 1 18 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.255 1.573 19570 1961 1 18 . 1 1 34 34 ALA CB C 34 22.603 22.603 21.754 0.849 19570 1962 1 18 . 1 1 34 34 ALA H H 34 9.715 9.715 8.937 0.778 19570 1963 1 19 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.800 0.010 19570 1964 1 19 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.070 -0.032 19570 1965 1 19 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.358 0.067 19570 1966 1 19 . 1 1 2 2 VAL H H 2 8.976 8.976 8.749 0.227 19570 1967 1 19 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.946 -0.514 19570 1968 1 19 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.454 0.685 19570 1969 1 19 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.449 -0.791 19570 1970 1 19 . 1 1 3 3 LEU H H 3 7.973 7.973 7.799 0.174 19570 1971 1 19 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.909 -0.416 19570 1972 1 19 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.428 0.701 19570 1973 1 19 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.181 1.255 19570 1974 1 19 . 1 1 4 4 ILE H H 4 8.340 8.340 8.306 0.034 19570 1975 1 19 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.818 -0.069 19570 1976 1 19 . 1 1 5 5 GLY H H 5 9.146 9.146 9.277 -0.131 19570 1977 1 19 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.430 0.062 19570 1978 1 19 . 1 1 6 6 GLN CA C 6 54.800 54.800 55.074 -0.274 19570 1979 1 19 . 1 1 6 6 GLN CB C 6 29.633 29.633 29.872 -0.239 19570 1980 1 19 . 1 1 6 6 GLN H H 6 8.233 8.233 7.657 0.576 19570 1981 1 19 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.680 0.103 19570 1982 1 19 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.994 -1.833 19570 1983 1 19 . 1 1 7 7 ARG H H 7 8.123 8.123 8.437 -0.314 19570 1984 1 19 . 1 1 8 8 CYS HA H 8 4.887 4.887 4.939 -0.052 19570 1985 1 19 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.548 -3.603 19570 1986 1 19 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.725 16.852 19570 1987 1 19 . 1 1 8 8 CYS H H 8 8.013 8.013 9.013 -1.000 19570 1988 1 19 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.958 -0.577 19570 1989 1 19 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.181 1.085 19570 1990 1 19 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.431 -1.318 19570 1991 1 19 . 1 1 9 9 ASP H H 9 8.432 8.432 8.624 -0.192 19570 1992 1 19 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.450 0.063 19570 1993 1 19 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.629 -0.591 19570 1994 1 19 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.608 -0.432 19570 1995 1 19 . 1 1 10 10 ASN H H 10 9.082 9.082 8.855 0.227 19570 1996 1 19 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.683 -0.019 19570 1997 1 19 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.921 -1.400 19570 1998 1 19 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.500 -2.043 19570 1999 1 19 . 1 1 11 11 ASP H H 11 8.418 8.418 7.899 0.519 19570 2000 1 19 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.260 0.061 19570 2001 1 19 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.617 -0.689 19570 2002 1 19 . 1 1 12 12 ARG H H 12 8.191 8.191 8.944 -0.753 19570 2003 1 19 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.111 0.109 19570 2004 1 19 . 1 1 13 13 GLY H H 13 7.410 7.410 7.699 -0.289 19570 2005 1 19 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.633 -0.136 19570 2006 1 19 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.194 1.472 19570 2007 1 19 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.656 -0.243 19570 2008 1 19 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.865 -0.421 19570 2009 1 19 . 1 1 15 15 ARG H H 15 8.632 8.632 8.399 0.233 19570 2010 1 19 . 1 1 16 16 CYS HA H 16 4.570 4.570 5.002 -0.432 19570 2011 1 19 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.594 -3.904 19570 2012 1 19 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.166 13.291 19570 2013 1 19 . 1 1 16 16 CYS H H 16 8.968 8.968 8.666 0.302 19570 2014 1 19 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.471 0.093 19570 2015 1 19 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.267 -5.772 19570 2016 1 19 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.732 10.754 19570 2017 1 19 . 1 1 17 17 CYS H H 17 10.147 10.147 8.877 1.270 19570 2018 1 19 . 1 1 18 18 SER HA H 18 4.219 4.219 4.184 0.035 19570 2019 1 19 . 1 1 18 18 SER CA C 18 60.065 60.065 59.830 0.235 19570 2020 1 19 . 1 1 18 18 SER CB C 18 62.259 62.259 62.239 0.020 19570 2021 1 19 . 1 1 18 18 SER H H 18 8.943 8.943 8.832 0.111 19570 2022 1 19 . 1 1 19 19 GLY CA C 19 45.411 45.411 44.948 0.463 19570 2023 1 19 . 1 1 19 19 GLY H H 19 8.946 8.946 8.462 0.484 19570 2024 1 19 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.501 -0.221 19570 2025 1 19 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.986 -2.381 19570 2026 1 19 . 1 1 20 20 GLN H H 20 7.902 7.902 8.162 -0.260 19570 2027 1 19 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.744 0.081 19570 2028 1 19 . 1 1 21 21 GLY H H 21 7.685 7.685 7.976 -0.291 19570 2029 1 19 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.996 -0.059 19570 2030 1 19 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.327 -1.494 19570 2031 1 19 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.340 -1.088 19570 2032 1 19 . 1 1 22 22 ASN H H 22 8.318 8.318 8.330 -0.012 19570 2033 1 19 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.560 0.111 19570 2034 1 19 . 1 1 23 23 CYS CA C 23 51.888 51.888 59.004 -7.116 19570 2035 1 19 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.344 13.021 19570 2036 1 19 . 1 1 23 23 CYS H H 23 8.956 8.956 8.776 0.180 19570 2037 1 19 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.547 -0.050 19570 2038 1 19 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.999 0.900 19570 2039 1 19 . 1 1 24 24 VAL H H 24 8.895 8.895 9.158 -0.263 19570 2040 1 19 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.826 -0.327 19570 2041 1 19 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.839 -0.059 19570 2042 1 19 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.241 4.620 19570 2043 1 19 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.329 -0.345 19570 2044 1 19 . 1 1 26 26 LEU H H 26 8.145 8.145 7.927 0.218 19570 2045 1 19 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.036 -0.023 19570 2046 1 19 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.856 -1.744 19570 2047 1 19 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.703 -0.039 19570 2048 1 19 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.556 -0.369 19570 2049 1 19 . 1 1 28 28 PHE CA C 28 60.859 60.859 59.486 1.373 19570 2050 1 19 . 1 1 28 28 PHE CB C 28 37.698 37.698 38.665 -0.967 19570 2051 1 19 . 1 1 28 28 PHE H H 28 8.364 8.364 7.946 0.418 19570 2052 1 19 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.623 -0.263 19570 2053 1 19 . 1 1 29 29 LEU CA C 29 55.572 55.572 55.062 0.510 19570 2054 1 19 . 1 1 29 29 LEU CB C 29 44.027 44.027 41.592 2.436 19570 2055 1 19 . 1 1 29 29 LEU H H 29 8.239 8.239 7.908 0.331 19570 2056 1 19 . 1 1 30 30 GLY CA C 30 44.654 44.654 45.287 -0.633 19570 2057 1 19 . 1 1 30 30 GLY H H 30 7.976 7.976 8.503 -0.527 19570 2058 1 19 . 1 1 31 31 GLY CA C 31 46.129 46.129 45.164 0.965 19570 2059 1 19 . 1 1 31 31 GLY H H 31 8.061 8.061 7.631 0.430 19570 2060 1 19 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.090 -0.255 19570 2061 1 19 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.437 1.628 19570 2062 1 19 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.595 0.890 19570 2063 1 19 . 1 1 32 32 VAL H H 32 8.601 8.601 9.037 -0.437 19570 2064 1 19 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.666 0.276 19570 2065 1 19 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.084 -2.693 19570 2066 1 19 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.713 14.585 19570 2067 1 19 . 1 1 33 33 CYS H H 33 7.979 7.979 8.621 -0.642 19570 2068 1 19 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.899 -0.145 19570 2069 1 19 . 1 1 34 34 ALA CA C 34 51.829 51.829 50.929 0.900 19570 2070 1 19 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.514 0.089 19570 2071 1 19 . 1 1 34 34 ALA H H 34 9.715 9.715 8.711 1.004 19570 2072 1 20 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.631 0.179 19570 2073 1 20 . 1 1 2 2 VAL CA C 2 60.038 60.038 60.188 -0.150 19570 2074 1 20 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.358 0.066 19570 2075 1 20 . 1 1 2 2 VAL H H 2 8.976 8.976 8.810 0.166 19570 2076 1 20 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.523 -0.091 19570 2077 1 20 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.860 0.279 19570 2078 1 20 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.203 -0.544 19570 2079 1 20 . 1 1 3 3 LEU H H 3 7.973 7.973 8.222 -0.249 19570 2080 1 20 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.840 -0.347 19570 2081 1 20 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.548 0.581 19570 2082 1 20 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.281 1.155 19570 2083 1 20 . 1 1 4 4 ILE H H 4 8.340 8.340 8.452 -0.112 19570 2084 1 20 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.970 -0.221 19570 2085 1 20 . 1 1 5 5 GLY H H 5 9.146 9.146 9.159 -0.013 19570 2086 1 20 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.574 -0.082 19570 2087 1 20 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.712 0.088 19570 2088 1 20 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.269 -0.636 19570 2089 1 20 . 1 1 6 6 GLN H H 6 8.233 8.233 7.679 0.554 19570 2090 1 20 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.848 -0.065 19570 2091 1 20 . 1 1 7 7 ARG CA C 7 54.161 54.161 55.532 -1.371 19570 2092 1 20 . 1 1 7 7 ARG H H 7 8.123 8.123 8.450 -0.327 19570 2093 1 20 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.035 -0.148 19570 2094 1 20 . 1 1 8 8 CYS CA C 8 52.945 52.945 57.030 -4.085 19570 2095 1 20 . 1 1 8 8 CYS CB C 8 48.577 48.577 30.911 17.666 19570 2096 1 20 . 1 1 8 8 CYS H H 8 8.013 8.013 8.660 -0.647 19570 2097 1 20 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.877 -0.496 19570 2098 1 20 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.406 0.860 19570 2099 1 20 . 1 1 9 9 ASP CB C 9 43.113 43.113 43.974 -0.861 19570 2100 1 20 . 1 1 9 9 ASP H H 9 8.432 8.432 8.713 -0.281 19570 2101 1 20 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.537 -0.024 19570 2102 1 20 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.036 0.001 19570 2103 1 20 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.901 -0.725 19570 2104 1 20 . 1 1 10 10 ASN H H 10 9.082 9.082 8.778 0.304 19570 2105 1 20 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.708 -0.044 19570 2106 1 20 . 1 1 11 11 ASP CA C 11 55.521 55.521 55.952 -0.431 19570 2107 1 20 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.747 -2.290 19570 2108 1 20 . 1 1 11 11 ASP H H 11 8.418 8.418 8.137 0.281 19570 2109 1 20 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.573 -0.252 19570 2110 1 20 . 1 1 12 12 ARG CA C 12 55.928 55.928 55.901 0.027 19570 2111 1 20 . 1 1 12 12 ARG H H 12 8.191 8.191 8.945 -0.754 19570 2112 1 20 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.087 0.133 19570 2113 1 20 . 1 1 13 13 GLY H H 13 7.410 7.410 7.710 -0.300 19570 2114 1 20 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.629 -0.132 19570 2115 1 20 . 1 1 14 14 PRO CB C 14 34.666 34.666 32.954 1.712 19570 2116 1 20 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.652 -0.239 19570 2117 1 20 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.798 -0.354 19570 2118 1 20 . 1 1 15 15 ARG H H 15 8.632 8.632 8.402 0.230 19570 2119 1 20 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.945 -0.375 19570 2120 1 20 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.627 -3.937 19570 2121 1 20 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.227 13.230 19570 2122 1 20 . 1 1 16 16 CYS H H 16 8.968 8.968 8.639 0.329 19570 2123 1 20 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.518 0.046 19570 2124 1 20 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.170 -5.675 19570 2125 1 20 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.051 11.435 19570 2126 1 20 . 1 1 17 17 CYS H H 17 10.147 10.147 8.980 1.167 19570 2127 1 20 . 1 1 18 18 SER HA H 18 4.219 4.219 4.204 0.015 19570 2128 1 20 . 1 1 18 18 SER CA C 18 60.065 60.065 59.760 0.305 19570 2129 1 20 . 1 1 18 18 SER CB C 18 62.259 62.259 62.336 -0.077 19570 2130 1 20 . 1 1 18 18 SER H H 18 8.943 8.943 8.677 0.266 19570 2131 1 20 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.180 0.231 19570 2132 1 20 . 1 1 19 19 GLY H H 19 8.946 8.946 8.189 0.757 19570 2133 1 20 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.595 -0.315 19570 2134 1 20 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.974 -2.369 19570 2135 1 20 . 1 1 20 20 GLN H H 20 7.902 7.902 8.537 -0.635 19570 2136 1 20 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.572 0.253 19570 2137 1 20 . 1 1 21 21 GLY H H 21 7.685 7.685 7.886 -0.201 19570 2138 1 20 . 1 1 22 22 ASN HA H 22 4.937 4.937 5.004 -0.067 19570 2139 1 20 . 1 1 22 22 ASN CA C 22 50.833 50.833 51.702 -0.869 19570 2140 1 20 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.381 -1.129 19570 2141 1 20 . 1 1 22 22 ASN H H 22 8.318 8.318 8.304 0.014 19570 2142 1 20 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.640 0.031 19570 2143 1 20 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.783 -6.895 19570 2144 1 20 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.256 13.109 19570 2145 1 20 . 1 1 23 23 CYS H H 23 8.956 8.956 8.634 0.322 19570 2146 1 20 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.446 0.051 19570 2147 1 20 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.141 1.758 19570 2148 1 20 . 1 1 24 24 VAL H H 24 8.895 8.895 9.137 -0.242 19570 2149 1 20 . 1 1 25 25 PRO HA H 25 4.499 4.499 5.129 -0.630 19570 2150 1 20 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.850 -0.070 19570 2151 1 20 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.729 4.132 19570 2152 1 20 . 1 1 26 26 LEU CB C 26 42.984 42.984 42.684 0.300 19570 2153 1 20 . 1 1 26 26 LEU H H 26 8.145 8.145 8.286 -0.141 19570 2154 1 20 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.112 -0.099 19570 2155 1 20 . 1 1 27 27 PRO CA C 27 64.112 64.112 65.072 -0.960 19570 2156 1 20 . 1 1 27 27 PRO CB C 27 31.664 31.664 31.674 -0.010 19570 2157 1 20 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.608 -0.421 19570 2158 1 20 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.487 2.372 19570 2159 1 20 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.450 -1.752 19570 2160 1 20 . 1 1 28 28 PHE H H 28 8.364 8.364 7.611 0.753 19570 2161 1 20 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.498 -0.138 19570 2162 1 20 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.338 1.234 19570 2163 1 20 . 1 1 29 29 LEU CB C 29 44.027 44.027 43.426 0.601 19570 2164 1 20 . 1 1 29 29 LEU H H 29 8.239 8.239 7.663 0.576 19570 2165 1 20 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.955 -0.301 19570 2166 1 20 . 1 1 30 30 GLY H H 30 7.976 7.976 8.532 -0.556 19570 2167 1 20 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.660 1.469 19570 2168 1 20 . 1 1 31 31 GLY H H 31 8.061 8.061 7.913 0.148 19570 2169 1 20 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.104 -0.269 19570 2170 1 20 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.665 1.400 19570 2171 1 20 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.271 1.214 19570 2172 1 20 . 1 1 32 32 VAL H H 32 8.601 8.601 8.929 -0.328 19570 2173 1 20 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.972 -0.030 19570 2174 1 20 . 1 1 33 33 CYS CA C 33 56.391 56.391 59.073 -2.682 19570 2175 1 20 . 1 1 33 33 CYS CB C 33 39.298 39.298 24.648 14.650 19570 2176 1 20 . 1 1 33 33 CYS H H 33 7.979 7.979 8.588 -0.609 19570 2177 1 20 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.771 -0.017 19570 2178 1 20 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.055 0.774 19570 2179 1 20 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.340 0.263 19570 2180 1 20 . 1 1 34 34 ALA H H 34 9.715 9.715 9.154 0.561 19570 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 19570 2 1 1 "Average Difference" HA 39 0.311 0.069 0.307 19570 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19570 4 1 1 "Average Difference" CA 30 2.326 0.725 2.248 19570 5 1 1 "Average Difference" CB 22 6.685 -3.204 6.006 19570 6 1 1 "Average Difference" HN 30 0.568 -0.101 0.568 19570 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19570 8 1 2 "Average Difference" HA 39 0.328 0.056 0.327 19570 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19570 10 1 2 "Average Difference" CA 30 2.109 0.623 2.049 19570 11 1 2 "Average Difference" CB 22 6.654 -3.167 5.990 19570 12 1 2 "Average Difference" HN 30 0.513 -0.087 0.514 19570 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19570 14 1 3 "Average Difference" HA 39 0.321 0.095 0.311 19570 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19570 16 1 3 "Average Difference" CA 30 2.224 0.710 2.144 19570 17 1 3 "Average Difference" CB 22 6.603 -3.060 5.989 19570 18 1 3 "Average Difference" HN 30 0.480 -0.099 0.478 19570 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19570 20 1 4 "Average Difference" HA 39 0.371 0.077 0.368 19570 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19570 22 1 4 "Average Difference" CA 30 2.358 0.589 2.322 19570 23 1 4 "Average Difference" CB 22 6.754 -3.125 6.128 19570 24 1 4 "Average Difference" HN 30 0.436 -0.031 0.443 19570 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19570 26 1 5 "Average Difference" HA 39 0.319 0.094 0.309 19570 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19570 28 1 5 "Average Difference" CA 30 2.260 0.676 2.193 19570 29 1 5 "Average Difference" CB 22 6.712 -2.948 6.172 19570 30 1 5 "Average Difference" HN 30 0.450 -0.080 0.450 19570 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19570 32 1 6 "Average Difference" HA 39 0.342 0.088 0.335 19570 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19570 34 1 6 "Average Difference" CA 30 2.319 0.571 2.286 19570 35 1 6 "Average Difference" CB 22 6.810 -3.037 6.238 19570 36 1 6 "Average Difference" HN 30 0.440 0.011 0.448 19570 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19570 38 1 7 "Average Difference" HA 39 0.348 0.085 0.342 19570 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19570 40 1 7 "Average Difference" CA 30 2.285 0.645 2.230 19570 41 1 7 "Average Difference" CB 22 6.679 -3.128 6.040 19570 42 1 7 "Average Difference" HN 30 0.505 -0.003 0.513 19570 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19570 44 1 8 "Average Difference" HA 39 0.323 0.075 0.319 19570 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19570 46 1 8 "Average Difference" CA 30 2.305 0.746 2.219 19570 47 1 8 "Average Difference" CB 22 6.528 -3.073 5.895 19570 48 1 8 "Average Difference" HN 30 0.503 -0.105 0.501 19570 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19570 50 1 9 "Average Difference" HA 39 0.327 0.099 0.316 19570 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19570 52 1 9 "Average Difference" CA 30 2.261 0.564 2.227 19570 53 1 9 "Average Difference" CB 22 6.667 -3.118 6.032 19570 54 1 9 "Average Difference" HN 30 0.473 -0.007 0.481 19570 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19570 56 1 10 "Average Difference" HA 39 0.389 0.115 0.376 19570 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19570 58 1 10 "Average Difference" CA 30 2.374 0.550 2.349 19570 59 1 10 "Average Difference" CB 22 6.728 -3.013 6.157 19570 60 1 10 "Average Difference" HN 30 0.481 -0.009 0.489 19570 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19570 62 1 11 "Average Difference" HA 39 0.339 0.071 0.336 19570 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19570 64 1 11 "Average Difference" CA 30 2.413 0.631 2.369 19570 65 1 11 "Average Difference" CB 22 6.877 -3.336 6.155 19570 66 1 11 "Average Difference" HN 30 0.576 -0.056 0.584 19570 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19570 68 1 12 "Average Difference" HA 39 0.402 0.125 0.388 19570 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19570 70 1 12 "Average Difference" CA 30 2.366 0.520 2.347 19570 71 1 12 "Average Difference" CB 22 6.674 -3.017 6.093 19570 72 1 12 "Average Difference" HN 30 0.510 0.021 0.519 19570 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19570 74 1 13 "Average Difference" HA 39 0.397 0.149 0.373 19570 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19570 76 1 13 "Average Difference" CA 30 2.441 0.501 2.429 19570 77 1 13 "Average Difference" CB 22 6.601 -3.101 5.964 19570 78 1 13 "Average Difference" HN 30 0.541 0.004 0.550 19570 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19570 80 1 14 "Average Difference" HA 39 0.328 0.074 0.324 19570 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19570 82 1 14 "Average Difference" CA 30 2.417 0.748 2.337 19570 83 1 14 "Average Difference" CB 22 6.671 -3.202 5.990 19570 84 1 14 "Average Difference" HN 30 0.528 -0.047 0.534 19570 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19570 86 1 15 "Average Difference" HA 39 0.370 0.126 0.353 19570 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19570 88 1 15 "Average Difference" CA 30 2.293 0.506 2.275 19570 89 1 15 "Average Difference" CB 22 6.546 -3.015 5.947 19570 90 1 15 "Average Difference" HN 30 0.494 -0.002 0.502 19570 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19570 92 1 16 "Average Difference" HA 39 0.380 0.099 0.372 19570 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19570 94 1 16 "Average Difference" CA 30 2.338 0.554 2.311 19570 95 1 16 "Average Difference" CB 22 6.747 -2.994 6.189 19570 96 1 16 "Average Difference" HN 30 0.494 0.030 0.501 19570 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19570 98 1 17 "Average Difference" HA 39 0.340 0.054 0.341 19570 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19570 100 1 17 "Average Difference" CA 30 2.432 0.733 2.359 19570 101 1 17 "Average Difference" CB 22 6.535 -2.998 5.944 19570 102 1 17 "Average Difference" HN 30 0.564 -0.107 0.563 19570 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19570 104 1 18 "Average Difference" HA 39 0.372 0.104 0.362 19570 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19570 106 1 18 "Average Difference" CA 30 2.253 0.517 2.230 19570 107 1 18 "Average Difference" CB 22 6.737 -3.171 6.084 19570 108 1 18 "Average Difference" HN 30 0.485 -0.077 0.487 19570 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19570 110 1 19 "Average Difference" HA 39 0.361 0.064 0.360 19570 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19570 112 1 19 "Average Difference" CA 30 2.363 0.710 2.292 19570 113 1 19 "Average Difference" CB 22 6.670 -3.108 6.041 19570 114 1 19 "Average Difference" HN 30 0.490 -0.054 0.495 19570 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19570 116 1 20 "Average Difference" HA 39 0.355 0.089 0.348 19570 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19570 118 1 20 "Average Difference" CA 30 2.303 0.539 2.277 19570 119 1 20 "Average Difference" CB 22 6.827 -3.143 6.203 19570 120 1 20 "Average Difference" HN 30 0.471 -0.034 0.478 19570 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 19570 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 VAL HA H 2 4.810 4.810 4.751 0.059 19570 2 1 . 1 1 2 2 VAL CA C 2 60.038 60.038 59.958 0.080 19570 3 1 . 1 1 2 2 VAL CB C 2 34.424 34.424 34.095 0.329 19570 4 1 . 1 1 2 2 VAL H H 2 8.976 8.976 8.812 0.164 19570 5 1 . 1 1 3 3 LEU HA H 3 4.432 4.432 4.731 -0.299 19570 6 1 . 1 1 3 3 LEU CA C 3 53.139 53.139 52.524 0.615 19570 7 1 . 1 1 3 3 LEU CB C 3 42.658 42.658 43.543 -0.885 19570 8 1 . 1 1 3 3 LEU H H 3 7.973 7.973 8.253 -0.280 19570 9 1 . 1 1 4 4 ILE HA H 4 3.493 3.493 3.789 -0.296 19570 10 1 . 1 1 4 4 ILE CA C 4 63.129 63.129 62.637 0.492 19570 11 1 . 1 1 4 4 ILE CB C 4 38.436 38.436 37.257 1.179 19570 12 1 . 1 1 4 4 ILE H H 4 8.340 8.340 8.467 -0.127 19570 13 1 . 1 1 5 5 GLY CA C 5 44.749 44.749 44.933 -0.185 19570 14 1 . 1 1 5 5 GLY H H 5 9.146 9.146 9.103 0.043 19570 15 1 . 1 1 6 6 GLN HA H 6 4.492 4.492 4.467 0.025 19570 16 1 . 1 1 6 6 GLN CA C 6 54.800 54.800 54.781 0.019 19570 17 1 . 1 1 6 6 GLN CB C 6 29.633 29.633 30.173 -0.540 19570 18 1 . 1 1 6 6 GLN H H 6 8.233 8.233 7.659 0.574 19570 19 1 . 1 1 7 7 ARG HA H 7 4.783 4.783 4.936 -0.153 19570 20 1 . 1 1 7 7 ARG CA C 7 54.161 54.161 56.004 -1.843 19570 21 1 . 1 1 7 7 ARG H H 7 8.123 8.123 8.491 -0.368 19570 22 1 . 1 1 8 8 CYS HA H 8 4.887 4.887 5.064 -0.177 19570 23 1 . 1 1 8 8 CYS CA C 8 52.945 52.945 56.256 -3.311 19570 24 1 . 1 1 8 8 CYS CB C 8 48.577 48.577 31.450 17.127 19570 25 1 . 1 1 8 8 CYS H H 8 8.013 8.013 8.898 -0.885 19570 26 1 . 1 1 9 9 ASP HA H 9 4.381 4.381 4.911 -0.530 19570 27 1 . 1 1 9 9 ASP CA C 9 54.266 54.266 53.642 0.624 19570 28 1 . 1 1 9 9 ASP CB C 9 43.113 43.113 44.336 -1.223 19570 29 1 . 1 1 9 9 ASP H H 9 8.432 8.432 8.619 -0.187 19570 30 1 . 1 1 10 10 ASN HA H 10 4.513 4.513 4.481 0.032 19570 31 1 . 1 1 10 10 ASN CA C 10 55.038 55.038 55.810 -0.772 19570 32 1 . 1 1 10 10 ASN CB C 10 38.176 38.176 38.714 -0.538 19570 33 1 . 1 1 10 10 ASN H H 10 9.082 9.082 8.794 0.288 19570 34 1 . 1 1 11 11 ASP HA H 11 4.664 4.664 4.649 0.015 19570 35 1 . 1 1 11 11 ASP CA C 11 55.521 55.521 56.367 -0.846 19570 36 1 . 1 1 11 11 ASP CB C 11 39.457 39.457 41.477 -2.020 19570 37 1 . 1 1 11 11 ASP H H 11 8.418 8.418 8.041 0.377 19570 38 1 . 1 1 12 12 ARG HA H 12 4.321 4.321 4.451 -0.130 19570 39 1 . 1 1 12 12 ARG CA C 12 55.928 55.928 56.104 -0.176 19570 40 1 . 1 1 12 12 ARG H H 12 8.191 8.191 8.978 -0.787 19570 41 1 . 1 1 13 13 GLY CA C 13 44.220 44.220 44.139 0.081 19570 42 1 . 1 1 13 13 GLY H H 13 7.410 7.410 7.651 -0.241 19570 43 1 . 1 1 14 14 PRO HA H 14 4.497 4.497 4.644 -0.147 19570 44 1 . 1 1 14 14 PRO CB C 14 34.666 34.666 33.155 1.511 19570 45 1 . 1 1 15 15 ARG HA H 15 4.413 4.413 4.675 -0.262 19570 46 1 . 1 1 15 15 ARG CA C 15 54.444 54.444 54.860 -0.416 19570 47 1 . 1 1 15 15 ARG H H 15 8.632 8.632 8.424 0.209 19570 48 1 . 1 1 16 16 CYS HA H 16 4.570 4.570 4.991 -0.421 19570 49 1 . 1 1 16 16 CYS CA C 16 55.690 55.690 59.466 -3.776 19570 50 1 . 1 1 16 16 CYS CB C 16 39.457 39.457 26.423 13.034 19570 51 1 . 1 1 16 16 CYS H H 16 8.968 8.968 8.627 0.341 19570 52 1 . 1 1 17 17 CYS HA H 17 4.564 4.564 4.473 0.091 19570 53 1 . 1 1 17 17 CYS CA C 17 53.495 53.495 59.291 -5.796 19570 54 1 . 1 1 17 17 CYS CB C 17 39.486 39.486 28.169 11.317 19570 55 1 . 1 1 17 17 CYS H H 17 10.147 10.147 8.897 1.250 19570 56 1 . 1 1 18 18 SER HA H 18 4.219 4.219 4.188 0.031 19570 57 1 . 1 1 18 18 SER CA C 18 60.065 60.065 60.352 -0.288 19570 58 1 . 1 1 18 18 SER CB C 18 62.259 62.259 62.609 -0.350 19570 59 1 . 1 1 18 18 SER H H 18 8.943 8.943 8.745 0.199 19570 60 1 . 1 1 19 19 GLY CA C 19 45.411 45.411 45.021 0.390 19570 61 1 . 1 1 19 19 GLY H H 19 8.946 8.946 8.377 0.569 19570 62 1 . 1 1 20 20 GLN HA H 20 4.280 4.280 4.536 -0.256 19570 63 1 . 1 1 20 20 GLN CA C 20 52.605 52.605 54.855 -2.250 19570 64 1 . 1 1 20 20 GLN H H 20 7.902 7.902 8.163 -0.261 19570 65 1 . 1 1 21 21 GLY CA C 21 44.825 44.825 44.807 0.018 19570 66 1 . 1 1 21 21 GLY H H 21 7.685 7.685 7.947 -0.262 19570 67 1 . 1 1 22 22 ASN HA H 22 4.937 4.937 4.974 -0.037 19570 68 1 . 1 1 22 22 ASN CA C 22 50.833 50.833 52.082 -1.249 19570 69 1 . 1 1 22 22 ASN CB C 22 41.252 41.252 42.083 -0.831 19570 70 1 . 1 1 22 22 ASN H H 22 8.318 8.318 8.522 -0.203 19570 71 1 . 1 1 23 23 CYS HA H 23 4.671 4.671 4.648 0.023 19570 72 1 . 1 1 23 23 CYS CA C 23 51.888 51.888 58.931 -7.043 19570 73 1 . 1 1 23 23 CYS CB C 23 38.365 38.365 25.628 12.737 19570 74 1 . 1 1 23 23 CYS H H 23 8.956 8.956 8.760 0.196 19570 75 1 . 1 1 24 24 VAL HA H 24 4.497 4.497 4.544 -0.047 19570 76 1 . 1 1 24 24 VAL CB C 24 34.899 34.899 33.814 1.085 19570 77 1 . 1 1 24 24 VAL H H 24 8.895 8.895 9.054 -0.159 19570 78 1 . 1 1 25 25 PRO HA H 25 4.499 4.499 4.737 -0.238 19570 79 1 . 1 1 26 26 LEU HA H 26 4.780 4.780 4.813 -0.033 19570 80 1 . 1 1 26 26 LEU CA C 26 55.861 55.861 51.501 4.360 19570 81 1 . 1 1 26 26 LEU CB C 26 42.984 42.984 43.540 -0.556 19570 82 1 . 1 1 26 26 LEU H H 26 8.145 8.145 8.222 -0.077 19570 83 1 . 1 1 27 27 PRO HA H 27 4.013 4.013 4.245 -0.232 19570 84 1 . 1 1 27 27 PRO CA C 27 64.112 64.112 64.829 -0.717 19570 85 1 . 1 1 27 27 PRO CB C 27 31.664 31.664 30.906 0.758 19570 86 1 . 1 1 28 28 PHE HA H 28 4.187 4.187 4.597 -0.410 19570 87 1 . 1 1 28 28 PHE CA C 28 60.859 60.859 58.801 2.058 19570 88 1 . 1 1 28 28 PHE CB C 28 37.698 37.698 39.163 -1.464 19570 89 1 . 1 1 28 28 PHE H H 28 8.364 8.364 7.897 0.467 19570 90 1 . 1 1 29 29 LEU HA H 29 4.360 4.360 4.613 -0.253 19570 91 1 . 1 1 29 29 LEU CA C 29 55.572 55.572 54.923 0.649 19570 92 1 . 1 1 29 29 LEU CB C 29 44.027 44.027 42.392 1.635 19570 93 1 . 1 1 29 29 LEU H H 29 8.239 8.239 7.900 0.339 19570 94 1 . 1 1 30 30 GLY CA C 30 44.654 44.654 44.942 -0.288 19570 95 1 . 1 1 30 30 GLY H H 30 7.976 7.976 8.095 -0.119 19570 96 1 . 1 1 31 31 GLY CA C 31 46.129 46.129 44.764 1.365 19570 97 1 . 1 1 31 31 GLY H H 31 8.061 8.061 7.889 0.172 19570 98 1 . 1 1 32 32 VAL HA H 32 4.835 4.835 5.190 -0.355 19570 99 1 . 1 1 32 32 VAL CA C 32 60.065 60.065 58.682 1.383 19570 100 1 . 1 1 32 32 VAL CB C 32 36.485 36.485 35.423 1.062 19570 101 1 . 1 1 32 32 VAL H H 32 8.601 8.601 8.910 -0.309 19570 102 1 . 1 1 33 33 CYS HA H 33 4.942 4.942 4.967 -0.025 19570 103 1 . 1 1 33 33 CYS CA C 33 56.391 56.391 58.874 -2.483 19570 104 1 . 1 1 33 33 CYS CB C 33 39.298 39.298 25.014 14.284 19570 105 1 . 1 1 33 33 CYS H H 33 7.979 7.979 8.456 -0.477 19570 106 1 . 1 1 34 34 ALA HA H 34 4.754 4.754 4.798 -0.044 19570 107 1 . 1 1 34 34 ALA CA C 34 51.829 51.829 51.061 0.768 19570 108 1 . 1 1 34 34 ALA CB C 34 22.603 22.603 22.101 0.502 19570 109 1 . 1 1 34 34 ALA H H 34 9.715 9.715 8.907 0.808 19570 stop_ save_