data_18784 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18784 _Entry.PDB_ID 2LZY 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 18784 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.654 0.347 18784 2 1 1 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.967 -4.555 18784 3 1 1 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.357 15.264 18784 4 1 1 . 1 1 3 3 CYS H H 3 7.856 7.856 8.356 -0.500 18784 5 1 1 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.476 0.033 18784 6 1 1 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.858 0.209 18784 7 1 1 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.838 -0.029 18784 8 1 1 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.527 -1.204 18784 9 1 1 . 1 1 5 5 GLY H H 5 7.965 7.965 7.919 0.046 18784 10 1 1 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.068 -0.372 18784 11 1 1 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.014 0.559 18784 12 1 1 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.689 -1.202 18784 13 1 1 . 1 1 6 6 GLU H H 6 8.365 8.365 8.259 0.106 18784 14 1 1 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.883 0.773 18784 15 1 1 . 1 1 7 7 GLY H H 7 9.294 9.294 8.636 0.658 18784 16 1 1 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 17 1 1 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.921 0.938 18784 18 1 1 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.734 -1.995 18784 19 1 1 . 1 1 8 8 GLU H H 8 7.948 7.948 7.923 0.025 18784 20 1 1 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 21 1 1 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.954 0.939 18784 22 1 1 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.522 5.269 18784 23 1 1 . 1 1 9 9 GLN H H 9 8.483 8.483 8.482 0.001 18784 24 1 1 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.415 -0.267 18784 25 1 1 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.408 -1.793 18784 26 1 1 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.921 22.306 18784 27 1 1 . 1 1 10 10 CYS H H 10 8.509 8.509 9.072 -0.563 18784 28 1 1 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.742 0.491 18784 29 1 1 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.358 0.193 18784 30 1 1 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.769 -1.284 18784 31 1 1 . 1 1 11 11 ASP H H 11 7.738 7.738 8.531 -0.793 18784 32 1 1 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.106 -0.432 18784 33 1 1 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.354 2.263 18784 34 1 1 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.010 1.002 18784 35 1 1 . 1 1 12 12 VAL H H 12 8.595 8.595 8.001 0.594 18784 36 1 1 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.330 -0.068 18784 37 1 1 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.447 1.220 18784 38 1 1 . 1 1 13 13 GLU CB C 13 28.487 28.487 30.972 -2.485 18784 39 1 1 . 1 1 13 13 GLU H H 13 7.937 7.937 7.838 0.099 18784 40 1 1 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.663 0.106 18784 41 1 1 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.345 0.794 18784 42 1 1 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.600 1.114 18784 43 1 1 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.184 0.032 18784 44 1 1 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.464 1.135 18784 45 1 1 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.125 -1.014 18784 46 1 1 . 1 1 15 15 ASN H H 15 8.602 8.602 8.721 -0.119 18784 47 1 1 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.814 -0.658 18784 48 1 1 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.618 1.425 18784 49 1 1 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.405 -4.924 18784 50 1 1 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.536 -0.126 18784 51 1 1 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.174 -2.967 18784 52 1 1 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.495 17.747 18784 53 1 1 . 1 1 17 17 CYS H H 17 7.125 7.125 8.213 -1.088 18784 54 1 1 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.550 0.211 18784 55 1 1 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.421 -6.863 18784 56 1 1 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.265 13.258 18784 57 1 1 . 1 1 18 18 CYS H H 18 8.830 8.830 8.869 -0.039 18784 58 1 1 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.644 0.264 18784 59 1 1 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.639 0.050 18784 60 1 1 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.754 0.195 18784 61 1 1 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.384 0.398 18784 62 1 1 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.524 0.369 18784 63 1 1 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.685 1.877 18784 64 1 1 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.042 -0.668 18784 65 1 1 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.928 3.752 18784 66 1 1 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.534 -3.643 18784 67 1 1 . 1 1 21 21 LEU H H 21 8.825 8.825 8.363 0.462 18784 68 1 1 . 1 1 22 22 THR HA H 22 4.507 4.507 4.658 -0.151 18784 69 1 1 . 1 1 22 22 THR CA C 22 61.221 61.221 59.920 1.301 18784 70 1 1 . 1 1 22 22 THR CB C 22 71.220 71.220 70.956 0.264 18784 71 1 1 . 1 1 22 22 THR H H 22 8.833 8.833 9.080 -0.247 18784 72 1 1 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.348 -0.657 18784 73 1 1 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.587 -2.212 18784 74 1 1 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.482 13.691 18784 75 1 1 . 1 1 23 23 CYS H H 23 7.992 7.992 8.842 -0.850 18784 76 1 1 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.665 -0.015 18784 77 1 1 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.720 -1.141 18784 78 1 1 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.963 0.133 18784 79 1 1 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 80 1 1 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.367 0.224 18784 81 1 1 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.999 0.646 18784 82 1 1 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.457 1.885 18784 83 1 1 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.098 2.269 18784 84 1 1 . 1 1 26 26 GLY H H 26 7.882 7.882 8.158 -0.276 18784 85 1 1 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.861 0.226 18784 86 1 1 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.659 -1.600 18784 87 1 1 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.476 -2.632 18784 88 1 1 . 1 1 27 27 ASP H H 27 7.730 7.730 7.844 -0.114 18784 89 1 1 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.457 -0.164 18784 90 1 1 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.421 0.326 18784 91 1 1 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.153 2.450 18784 92 1 1 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.645 0.791 18784 93 1 1 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.508 -0.802 18784 94 1 1 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.243 0.551 18784 95 1 1 . 1 1 29 29 TYR H H 29 7.422 7.422 7.891 -0.469 18784 96 1 1 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.675 2.571 18784 97 1 1 . 1 1 30 30 GLY H H 30 8.457 8.457 8.996 -0.539 18784 98 1 1 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.133 -0.343 18784 99 1 1 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.336 1.785 18784 100 1 1 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.040 -0.537 18784 101 1 1 . 1 1 31 31 ILE H H 31 8.636 8.636 8.295 0.341 18784 102 1 1 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.312 -0.129 18784 103 1 1 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.589 -2.941 18784 104 1 1 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.432 16.493 18784 105 1 1 . 1 1 32 32 CYS H H 32 8.187 8.187 8.595 -0.408 18784 106 1 1 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.728 0.226 18784 107 1 1 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.015 0.631 18784 108 1 1 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.088 1.388 18784 109 1 1 . 1 1 33 33 TYR H H 33 9.324 9.324 9.311 0.013 18784 110 1 1 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.363 0.030 18784 111 1 1 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.779 0.224 18784 112 1 1 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.195 0.523 18784 113 1 1 . 1 1 34 34 ILE H H 34 8.078 8.078 8.621 -0.543 18784 114 1 2 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.654 0.347 18784 115 1 2 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.964 -4.552 18784 116 1 2 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.355 15.266 18784 117 1 2 . 1 1 3 3 CYS H H 3 7.856 7.856 8.356 -0.500 18784 118 1 2 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.476 0.033 18784 119 1 2 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.859 0.208 18784 120 1 2 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.838 -0.029 18784 121 1 2 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.528 -1.204 18784 122 1 2 . 1 1 5 5 GLY H H 5 7.965 7.965 7.920 0.045 18784 123 1 2 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.069 -0.373 18784 124 1 2 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.011 0.562 18784 125 1 2 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.688 -1.201 18784 126 1 2 . 1 1 6 6 GLU H H 6 8.365 8.365 8.259 0.106 18784 127 1 2 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.882 0.774 18784 128 1 2 . 1 1 7 7 GLY H H 7 9.294 9.294 8.636 0.658 18784 129 1 2 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 130 1 2 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.921 0.938 18784 131 1 2 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.735 -1.996 18784 132 1 2 . 1 1 8 8 GLU H H 8 7.948 7.948 7.923 0.025 18784 133 1 2 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 134 1 2 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.956 0.937 18784 135 1 2 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.518 5.272 18784 136 1 2 . 1 1 9 9 GLN H H 9 8.483 8.483 8.482 0.001 18784 137 1 2 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.414 -0.266 18784 138 1 2 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.407 -1.792 18784 139 1 2 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.920 22.307 18784 140 1 2 . 1 1 10 10 CYS H H 10 8.509 8.509 9.071 -0.562 18784 141 1 2 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.774 0.459 18784 142 1 2 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.207 0.345 18784 143 1 2 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.606 -1.121 18784 144 1 2 . 1 1 11 11 ASP H H 11 7.738 7.738 8.516 -0.778 18784 145 1 2 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.126 -0.452 18784 146 1 2 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.553 2.064 18784 147 1 2 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.100 0.912 18784 148 1 2 . 1 1 12 12 VAL H H 12 8.595 8.595 8.017 0.578 18784 149 1 2 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.316 -0.054 18784 150 1 2 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.384 1.283 18784 151 1 2 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.074 -2.587 18784 152 1 2 . 1 1 13 13 GLU H H 13 7.937 7.937 7.861 0.076 18784 153 1 2 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.662 0.107 18784 154 1 2 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.347 0.792 18784 155 1 2 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.603 1.111 18784 156 1 2 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.184 0.032 18784 157 1 2 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.462 1.137 18784 158 1 2 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.123 -1.012 18784 159 1 2 . 1 1 15 15 ASN H H 15 8.602 8.602 8.718 -0.116 18784 160 1 2 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.814 -0.658 18784 161 1 2 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.619 1.424 18784 162 1 2 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.405 -4.924 18784 163 1 2 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.535 -0.125 18784 164 1 2 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.179 -2.972 18784 165 1 2 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.491 17.751 18784 166 1 2 . 1 1 17 17 CYS H H 17 7.125 7.125 8.213 -1.088 18784 167 1 2 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.550 0.211 18784 168 1 2 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.418 -6.860 18784 169 1 2 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.265 13.257 18784 170 1 2 . 1 1 18 18 CYS H H 18 8.830 8.830 8.869 -0.039 18784 171 1 2 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.644 0.264 18784 172 1 2 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.639 0.050 18784 173 1 2 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.753 0.196 18784 174 1 2 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.383 0.399 18784 175 1 2 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.525 0.368 18784 176 1 2 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.685 1.877 18784 177 1 2 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.067 -0.693 18784 178 1 2 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.977 3.703 18784 179 1 2 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.348 -3.457 18784 180 1 2 . 1 1 21 21 LEU H H 21 8.825 8.825 8.367 0.458 18784 181 1 2 . 1 1 22 22 THR HA H 22 4.507 4.507 4.649 -0.142 18784 182 1 2 . 1 1 22 22 THR CA C 22 61.221 61.221 59.959 1.262 18784 183 1 2 . 1 1 22 22 THR CB C 22 71.220 71.220 71.451 -0.231 18784 184 1 2 . 1 1 22 22 THR H H 22 8.833 8.833 9.119 -0.286 18784 185 1 2 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.324 -0.633 18784 186 1 2 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.707 -2.332 18784 187 1 2 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.650 13.523 18784 188 1 2 . 1 1 23 23 CYS H H 23 7.992 7.992 8.817 -0.825 18784 189 1 2 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.665 -0.015 18784 190 1 2 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.718 -1.139 18784 191 1 2 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.956 0.140 18784 192 1 2 . 1 1 24 24 ILE H H 24 8.831 8.831 9.324 -0.493 18784 193 1 2 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 194 1 2 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.996 0.649 18784 195 1 2 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.457 1.885 18784 196 1 2 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.170 2.197 18784 197 1 2 . 1 1 26 26 GLY H H 26 7.882 7.882 8.221 -0.339 18784 198 1 2 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.883 0.204 18784 199 1 2 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.690 -1.631 18784 200 1 2 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.240 -2.396 18784 201 1 2 . 1 1 27 27 ASP H H 27 7.730 7.730 7.801 -0.071 18784 202 1 2 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.419 -0.126 18784 203 1 2 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.100 0.647 18784 204 1 2 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.207 2.396 18784 205 1 2 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.643 0.793 18784 206 1 2 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.515 -0.809 18784 207 1 2 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.231 0.563 18784 208 1 2 . 1 1 29 29 TYR H H 29 7.422 7.422 7.891 -0.469 18784 209 1 2 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.675 2.571 18784 210 1 2 . 1 1 30 30 GLY H H 30 8.457 8.457 8.996 -0.539 18784 211 1 2 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.132 -0.342 18784 212 1 2 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.333 1.788 18784 213 1 2 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.034 -0.531 18784 214 1 2 . 1 1 31 31 ILE H H 31 8.636 8.636 8.293 0.343 18784 215 1 2 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.314 -0.131 18784 216 1 2 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.587 -2.939 18784 217 1 2 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.432 16.493 18784 218 1 2 . 1 1 32 32 CYS H H 32 8.187 8.187 8.595 -0.408 18784 219 1 2 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.728 0.226 18784 220 1 2 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.017 0.629 18784 221 1 2 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.091 1.385 18784 222 1 2 . 1 1 33 33 TYR H H 33 9.324 9.324 9.310 0.014 18784 223 1 2 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.363 0.030 18784 224 1 2 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.777 0.226 18784 225 1 2 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.195 0.523 18784 226 1 2 . 1 1 34 34 ILE H H 34 8.078 8.078 8.621 -0.543 18784 227 1 3 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.635 0.366 18784 228 1 3 . 1 1 3 3 CYS CA C 3 52.412 52.412 57.019 -4.607 18784 229 1 3 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.270 15.351 18784 230 1 3 . 1 1 3 3 CYS H H 3 7.856 7.856 8.341 -0.485 18784 231 1 3 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.478 0.031 18784 232 1 3 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.891 0.176 18784 233 1 3 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.925 -0.116 18784 234 1 3 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.662 -1.339 18784 235 1 3 . 1 1 5 5 GLY H H 5 7.965 7.965 8.140 -0.175 18784 236 1 3 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.039 -0.343 18784 237 1 3 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.287 0.286 18784 238 1 3 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.552 -1.065 18784 239 1 3 . 1 1 6 6 GLU H H 6 8.365 8.365 8.309 0.056 18784 240 1 3 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.666 0.990 18784 241 1 3 . 1 1 7 7 GLY H H 7 9.294 9.294 8.669 0.625 18784 242 1 3 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.450 0.093 18784 243 1 3 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.517 0.342 18784 244 1 3 . 1 1 8 8 GLU CB C 8 30.739 30.739 31.564 -0.825 18784 245 1 3 . 1 1 8 8 GLU H H 8 7.948 7.948 7.569 0.379 18784 246 1 3 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.648 0.152 18784 247 1 3 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.031 0.862 18784 248 1 3 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.819 4.973 18784 249 1 3 . 1 1 9 9 GLN H H 9 8.483 8.483 8.472 0.011 18784 250 1 3 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.408 -0.260 18784 251 1 3 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.507 -1.892 18784 252 1 3 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.132 22.095 18784 253 1 3 . 1 1 10 10 CYS H H 10 8.509 8.509 9.081 -0.572 18784 254 1 3 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.744 0.489 18784 255 1 3 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.108 0.444 18784 256 1 3 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.739 -1.254 18784 257 1 3 . 1 1 11 11 ASP H H 11 7.738 7.738 8.577 -0.839 18784 258 1 3 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.147 -0.473 18784 259 1 3 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.158 2.459 18784 260 1 3 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.375 1.637 18784 261 1 3 . 1 1 12 12 VAL H H 12 8.595 8.595 8.064 0.531 18784 262 1 3 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.310 -0.048 18784 263 1 3 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.343 1.325 18784 264 1 3 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.115 -2.628 18784 265 1 3 . 1 1 13 13 GLU H H 13 7.937 7.937 7.818 0.119 18784 266 1 3 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.660 0.109 18784 267 1 3 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.357 0.782 18784 268 1 3 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.601 1.113 18784 269 1 3 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.188 0.028 18784 270 1 3 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.450 1.149 18784 271 1 3 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.136 -1.025 18784 272 1 3 . 1 1 15 15 ASN H H 15 8.602 8.602 8.702 -0.100 18784 273 1 3 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.815 -0.659 18784 274 1 3 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.637 1.406 18784 275 1 3 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.378 -4.897 18784 276 1 3 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.524 -0.114 18784 277 1 3 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.216 -3.009 18784 278 1 3 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.461 17.781 18784 279 1 3 . 1 1 17 17 CYS H H 17 7.125 7.125 8.218 -1.093 18784 280 1 3 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.554 0.207 18784 281 1 3 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.415 -6.857 18784 282 1 3 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.281 13.241 18784 283 1 3 . 1 1 18 18 CYS H H 18 8.830 8.830 8.865 -0.035 18784 284 1 3 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.648 0.260 18784 285 1 3 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.630 0.058 18784 286 1 3 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.749 0.200 18784 287 1 3 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 288 1 3 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.526 0.367 18784 289 1 3 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.681 1.881 18784 290 1 3 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.037 -0.663 18784 291 1 3 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.940 3.740 18784 292 1 3 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.545 -3.654 18784 293 1 3 . 1 1 21 21 LEU H H 21 8.825 8.825 8.364 0.461 18784 294 1 3 . 1 1 22 22 THR HA H 22 4.507 4.507 4.657 -0.150 18784 295 1 3 . 1 1 22 22 THR CA C 22 61.221 61.221 59.915 1.306 18784 296 1 3 . 1 1 22 22 THR CB C 22 71.220 71.220 70.963 0.257 18784 297 1 3 . 1 1 22 22 THR H H 22 8.833 8.833 9.086 -0.253 18784 298 1 3 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.328 -0.637 18784 299 1 3 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.617 -2.242 18784 300 1 3 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.471 13.702 18784 301 1 3 . 1 1 23 23 CYS H H 23 7.992 7.992 8.841 -0.849 18784 302 1 3 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.663 -0.013 18784 303 1 3 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.736 -1.157 18784 304 1 3 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.967 0.129 18784 305 1 3 . 1 1 24 24 ILE H H 24 8.831 8.831 9.327 -0.496 18784 306 1 3 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.369 0.222 18784 307 1 3 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.995 0.650 18784 308 1 3 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.466 1.876 18784 309 1 3 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.088 2.279 18784 310 1 3 . 1 1 26 26 GLY H H 26 7.882 7.882 8.156 -0.274 18784 311 1 3 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.862 0.225 18784 312 1 3 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.659 -1.600 18784 313 1 3 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.472 -2.628 18784 314 1 3 . 1 1 27 27 ASP H H 27 7.730 7.730 7.846 -0.116 18784 315 1 3 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.457 -0.164 18784 316 1 3 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.422 0.325 18784 317 1 3 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.151 2.452 18784 318 1 3 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.543 0.893 18784 319 1 3 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.543 -0.837 18784 320 1 3 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.214 0.580 18784 321 1 3 . 1 1 29 29 TYR H H 29 7.422 7.422 7.890 -0.468 18784 322 1 3 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.673 2.573 18784 323 1 3 . 1 1 30 30 GLY H H 30 8.457 8.457 9.028 -0.571 18784 324 1 3 . 1 1 31 31 ILE HA H 31 4.790 4.790 4.979 -0.189 18784 325 1 3 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.398 1.723 18784 326 1 3 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.983 -0.479 18784 327 1 3 . 1 1 31 31 ILE H H 31 8.636 8.636 8.304 0.332 18784 328 1 3 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.308 -0.125 18784 329 1 3 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.603 -2.955 18784 330 1 3 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.433 16.491 18784 331 1 3 . 1 1 32 32 CYS H H 32 8.187 8.187 8.619 -0.432 18784 332 1 3 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.726 0.228 18784 333 1 3 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.029 0.617 18784 334 1 3 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.056 1.420 18784 335 1 3 . 1 1 33 33 TYR H H 33 9.324 9.324 9.311 0.013 18784 336 1 3 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.360 0.033 18784 337 1 3 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.811 0.192 18784 338 1 3 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.177 0.541 18784 339 1 3 . 1 1 34 34 ILE H H 34 8.078 8.078 8.624 -0.546 18784 340 1 4 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.644 0.357 18784 341 1 4 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.938 -4.526 18784 342 1 4 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.323 15.298 18784 343 1 4 . 1 1 3 3 CYS H H 3 7.856 7.856 8.366 -0.510 18784 344 1 4 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.497 0.012 18784 345 1 4 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.882 0.185 18784 346 1 4 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.936 -0.127 18784 347 1 4 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.614 -1.291 18784 348 1 4 . 1 1 5 5 GLY H H 5 7.965 7.965 8.134 -0.169 18784 349 1 4 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.026 -0.330 18784 350 1 4 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.377 0.196 18784 351 1 4 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.485 -0.998 18784 352 1 4 . 1 1 6 6 GLU H H 6 8.365 8.365 8.322 0.043 18784 353 1 4 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.645 1.011 18784 354 1 4 . 1 1 7 7 GLY H H 7 9.294 9.294 8.666 0.628 18784 355 1 4 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.447 0.096 18784 356 1 4 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.555 0.304 18784 357 1 4 . 1 1 8 8 GLU CB C 8 30.739 30.739 31.532 -0.792 18784 358 1 4 . 1 1 8 8 GLU H H 8 7.948 7.948 7.565 0.383 18784 359 1 4 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.648 0.152 18784 360 1 4 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.045 0.848 18784 361 1 4 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.823 4.968 18784 362 1 4 . 1 1 9 9 GLN H H 9 8.483 8.483 8.470 0.013 18784 363 1 4 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.391 -0.243 18784 364 1 4 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.508 -1.893 18784 365 1 4 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.154 22.073 18784 366 1 4 . 1 1 10 10 CYS H H 10 8.509 8.509 9.082 -0.573 18784 367 1 4 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.740 0.493 18784 368 1 4 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.127 0.425 18784 369 1 4 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.728 -1.243 18784 370 1 4 . 1 1 11 11 ASP H H 11 7.738 7.738 8.582 -0.844 18784 371 1 4 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.149 -0.475 18784 372 1 4 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.153 2.464 18784 373 1 4 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.400 1.612 18784 374 1 4 . 1 1 12 12 VAL H H 12 8.595 8.595 8.073 0.522 18784 375 1 4 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.304 -0.042 18784 376 1 4 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.371 1.296 18784 377 1 4 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.080 -2.593 18784 378 1 4 . 1 1 13 13 GLU H H 13 7.937 7.937 7.810 0.127 18784 379 1 4 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.660 0.109 18784 380 1 4 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.364 0.775 18784 381 1 4 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.609 1.105 18784 382 1 4 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.192 0.024 18784 383 1 4 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.444 1.155 18784 384 1 4 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.138 -1.027 18784 385 1 4 . 1 1 15 15 ASN H H 15 8.602 8.602 8.701 -0.099 18784 386 1 4 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.817 -0.661 18784 387 1 4 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.645 1.399 18784 388 1 4 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.366 -4.885 18784 389 1 4 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.513 -0.103 18784 390 1 4 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.263 -3.056 18784 391 1 4 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.402 17.840 18784 392 1 4 . 1 1 17 17 CYS H H 17 7.125 7.125 8.223 -1.098 18784 393 1 4 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.550 0.211 18784 394 1 4 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.428 -6.870 18784 395 1 4 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.287 13.236 18784 396 1 4 . 1 1 18 18 CYS H H 18 8.830 8.830 8.855 -0.025 18784 397 1 4 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.652 0.256 18784 398 1 4 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.612 0.077 18784 399 1 4 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.747 0.202 18784 400 1 4 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.387 0.395 18784 401 1 4 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.520 0.373 18784 402 1 4 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.678 1.884 18784 403 1 4 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.055 -0.681 18784 404 1 4 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.994 3.686 18784 405 1 4 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.361 -3.470 18784 406 1 4 . 1 1 21 21 LEU H H 21 8.825 8.825 8.369 0.456 18784 407 1 4 . 1 1 22 22 THR HA H 22 4.507 4.507 4.649 -0.142 18784 408 1 4 . 1 1 22 22 THR CA C 22 61.221 61.221 59.961 1.260 18784 409 1 4 . 1 1 22 22 THR CB C 22 71.220 71.220 71.458 -0.238 18784 410 1 4 . 1 1 22 22 THR H H 22 8.833 8.833 9.125 -0.292 18784 411 1 4 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.298 -0.607 18784 412 1 4 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.746 -2.371 18784 413 1 4 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.640 13.533 18784 414 1 4 . 1 1 23 23 CYS H H 23 7.992 7.992 8.817 -0.825 18784 415 1 4 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.664 -0.014 18784 416 1 4 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.734 -1.155 18784 417 1 4 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.971 0.125 18784 418 1 4 . 1 1 24 24 ILE H H 24 8.831 8.831 9.327 -0.496 18784 419 1 4 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.369 0.222 18784 420 1 4 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.996 0.649 18784 421 1 4 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.465 1.877 18784 422 1 4 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.086 2.281 18784 423 1 4 . 1 1 26 26 GLY H H 26 7.882 7.882 8.154 -0.272 18784 424 1 4 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.862 0.225 18784 425 1 4 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.651 -1.592 18784 426 1 4 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.465 -2.621 18784 427 1 4 . 1 1 27 27 ASP H H 27 7.730 7.730 7.847 -0.117 18784 428 1 4 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.457 -0.164 18784 429 1 4 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.422 0.325 18784 430 1 4 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.149 2.454 18784 431 1 4 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.541 0.895 18784 432 1 4 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.558 -0.852 18784 433 1 4 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.195 0.599 18784 434 1 4 . 1 1 29 29 TYR H H 29 7.422 7.422 7.889 -0.467 18784 435 1 4 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.670 2.576 18784 436 1 4 . 1 1 30 30 GLY H H 30 8.457 8.457 9.039 -0.582 18784 437 1 4 . 1 1 31 31 ILE HA H 31 4.790 4.790 4.974 -0.184 18784 438 1 4 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.398 1.722 18784 439 1 4 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.961 -0.458 18784 440 1 4 . 1 1 31 31 ILE H H 31 8.636 8.636 8.303 0.333 18784 441 1 4 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.307 -0.124 18784 442 1 4 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.625 -2.977 18784 443 1 4 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.439 16.486 18784 444 1 4 . 1 1 32 32 CYS H H 32 8.187 8.187 8.612 -0.425 18784 445 1 4 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.726 0.228 18784 446 1 4 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.027 0.619 18784 447 1 4 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.056 1.420 18784 448 1 4 . 1 1 33 33 TYR H H 33 9.324 9.324 9.315 0.009 18784 449 1 4 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.360 0.033 18784 450 1 4 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.818 0.185 18784 451 1 4 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.171 0.547 18784 452 1 4 . 1 1 34 34 ILE H H 34 8.078 8.078 8.625 -0.547 18784 453 1 5 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.678 0.323 18784 454 1 5 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.864 -4.452 18784 455 1 5 . 1 1 3 3 CYS CB C 3 42.621 42.621 26.969 15.652 18784 456 1 5 . 1 1 3 3 CYS H H 3 7.856 7.856 8.369 -0.513 18784 457 1 5 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.479 0.030 18784 458 1 5 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.886 0.181 18784 459 1 5 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.830 -0.021 18784 460 1 5 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.509 -1.186 18784 461 1 5 . 1 1 5 5 GLY H H 5 7.965 7.965 7.921 0.044 18784 462 1 5 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.065 -0.369 18784 463 1 5 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.028 0.545 18784 464 1 5 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.679 -1.192 18784 465 1 5 . 1 1 6 6 GLU H H 6 8.365 8.365 8.261 0.104 18784 466 1 5 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.880 0.776 18784 467 1 5 . 1 1 7 7 GLY H H 7 9.294 9.294 8.636 0.658 18784 468 1 5 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 469 1 5 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.921 0.938 18784 470 1 5 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.733 -1.994 18784 471 1 5 . 1 1 8 8 GLU H H 8 7.948 7.948 7.914 0.034 18784 472 1 5 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.729 0.071 18784 473 1 5 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.953 0.940 18784 474 1 5 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.524 5.267 18784 475 1 5 . 1 1 9 9 GLN H H 9 8.483 8.483 8.481 0.002 18784 476 1 5 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.407 -0.259 18784 477 1 5 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.407 -1.792 18784 478 1 5 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.927 22.299 18784 479 1 5 . 1 1 10 10 CYS H H 10 8.509 8.509 9.072 -0.563 18784 480 1 5 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.727 0.506 18784 481 1 5 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.119 0.433 18784 482 1 5 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.692 -1.207 18784 483 1 5 . 1 1 11 11 ASP H H 11 7.738 7.738 8.565 -0.827 18784 484 1 5 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.147 -0.473 18784 485 1 5 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.153 2.465 18784 486 1 5 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.369 1.643 18784 487 1 5 . 1 1 12 12 VAL H H 12 8.595 8.595 8.059 0.536 18784 488 1 5 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.313 -0.051 18784 489 1 5 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.334 1.333 18784 490 1 5 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.124 -2.637 18784 491 1 5 . 1 1 13 13 GLU H H 13 7.937 7.937 7.822 0.115 18784 492 1 5 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.662 0.107 18784 493 1 5 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.346 0.793 18784 494 1 5 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.604 1.110 18784 495 1 5 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.186 0.030 18784 496 1 5 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.459 1.140 18784 497 1 5 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.126 -1.015 18784 498 1 5 . 1 1 15 15 ASN H H 15 8.602 8.602 8.722 -0.120 18784 499 1 5 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.815 -0.659 18784 500 1 5 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.620 1.423 18784 501 1 5 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.401 -4.920 18784 502 1 5 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.531 -0.121 18784 503 1 5 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.196 -2.989 18784 504 1 5 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.470 17.772 18784 505 1 5 . 1 1 17 17 CYS H H 17 7.125 7.125 8.215 -1.090 18784 506 1 5 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.548 0.213 18784 507 1 5 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.424 -6.866 18784 508 1 5 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.264 13.258 18784 509 1 5 . 1 1 18 18 CYS H H 18 8.830 8.830 8.864 -0.034 18784 510 1 5 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.644 0.264 18784 511 1 5 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.639 0.050 18784 512 1 5 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.753 0.196 18784 513 1 5 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.384 0.398 18784 514 1 5 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.523 0.371 18784 515 1 5 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.686 1.877 18784 516 1 5 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.037 -0.663 18784 517 1 5 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.931 3.749 18784 518 1 5 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.532 -3.641 18784 519 1 5 . 1 1 21 21 LEU H H 21 8.825 8.825 8.361 0.464 18784 520 1 5 . 1 1 22 22 THR HA H 22 4.507 4.507 4.657 -0.150 18784 521 1 5 . 1 1 22 22 THR CA C 22 61.221 61.221 59.921 1.300 18784 522 1 5 . 1 1 22 22 THR CB C 22 71.220 71.220 70.955 0.265 18784 523 1 5 . 1 1 22 22 THR H H 22 8.833 8.833 9.080 -0.247 18784 524 1 5 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.346 -0.655 18784 525 1 5 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.590 -2.215 18784 526 1 5 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.479 13.694 18784 527 1 5 . 1 1 23 23 CYS H H 23 7.992 7.992 8.843 -0.851 18784 528 1 5 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.665 -0.015 18784 529 1 5 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.719 -1.140 18784 530 1 5 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.960 0.136 18784 531 1 5 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 532 1 5 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 533 1 5 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.997 0.648 18784 534 1 5 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.457 1.885 18784 535 1 5 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.171 2.196 18784 536 1 5 . 1 1 26 26 GLY H H 26 7.882 7.882 8.221 -0.339 18784 537 1 5 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.884 0.203 18784 538 1 5 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.683 -1.624 18784 539 1 5 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.238 -2.394 18784 540 1 5 . 1 1 27 27 ASP H H 27 7.730 7.730 7.800 -0.070 18784 541 1 5 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.420 -0.127 18784 542 1 5 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.098 0.649 18784 543 1 5 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.209 2.393 18784 544 1 5 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.646 0.790 18784 545 1 5 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.506 -0.800 18784 546 1 5 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.234 0.560 18784 547 1 5 . 1 1 29 29 TYR H H 29 7.422 7.422 7.891 -0.469 18784 548 1 5 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.677 2.569 18784 549 1 5 . 1 1 30 30 GLY H H 30 8.457 8.457 9.000 -0.543 18784 550 1 5 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.130 -0.340 18784 551 1 5 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.336 1.785 18784 552 1 5 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.035 -0.532 18784 553 1 5 . 1 1 31 31 ILE H H 31 8.636 8.636 8.294 0.342 18784 554 1 5 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.313 -0.130 18784 555 1 5 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.585 -2.937 18784 556 1 5 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.432 16.493 18784 557 1 5 . 1 1 32 32 CYS H H 32 8.187 8.187 8.598 -0.411 18784 558 1 5 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.729 0.225 18784 559 1 5 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.014 0.632 18784 560 1 5 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.088 1.388 18784 561 1 5 . 1 1 33 33 TYR H H 33 9.324 9.324 9.310 0.014 18784 562 1 5 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.362 0.031 18784 563 1 5 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.787 0.216 18784 564 1 5 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.194 0.524 18784 565 1 5 . 1 1 34 34 ILE H H 34 8.078 8.078 8.622 -0.544 18784 566 1 6 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.889 0.112 18784 567 1 6 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.712 -3.300 18784 568 1 6 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.184 15.437 18784 569 1 6 . 1 1 3 3 CYS H H 3 7.856 7.856 8.173 -0.317 18784 570 1 6 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.515 -0.006 18784 571 1 6 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.939 0.128 18784 572 1 6 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.903 -0.094 18784 573 1 6 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.569 -1.246 18784 574 1 6 . 1 1 5 5 GLY H H 5 7.965 7.965 7.915 0.050 18784 575 1 6 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.053 -0.357 18784 576 1 6 . 1 1 6 6 GLU CA C 6 57.573 57.573 56.999 0.574 18784 577 1 6 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.656 -1.169 18784 578 1 6 . 1 1 6 6 GLU H H 6 8.365 8.365 8.260 0.105 18784 579 1 6 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.903 0.753 18784 580 1 6 . 1 1 7 7 GLY H H 7 9.294 9.294 8.640 0.654 18784 581 1 6 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.479 0.064 18784 582 1 6 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.943 0.916 18784 583 1 6 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.741 -2.002 18784 584 1 6 . 1 1 8 8 GLU H H 8 7.948 7.948 7.900 0.048 18784 585 1 6 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 586 1 6 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.000 0.893 18784 587 1 6 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.536 5.255 18784 588 1 6 . 1 1 9 9 GLN H H 9 8.483 8.483 8.475 0.008 18784 589 1 6 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.389 -0.241 18784 590 1 6 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.434 -1.819 18784 591 1 6 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.948 22.279 18784 592 1 6 . 1 1 10 10 CYS H H 10 8.509 8.509 9.071 -0.562 18784 593 1 6 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.736 0.497 18784 594 1 6 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.390 0.162 18784 595 1 6 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.842 -1.357 18784 596 1 6 . 1 1 11 11 ASP H H 11 7.738 7.738 8.549 -0.811 18784 597 1 6 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.113 -0.439 18784 598 1 6 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.115 2.502 18784 599 1 6 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.123 0.889 18784 600 1 6 . 1 1 12 12 VAL H H 12 8.595 8.595 7.946 0.649 18784 601 1 6 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.321 -0.058 18784 602 1 6 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.481 1.186 18784 603 1 6 . 1 1 13 13 GLU CB C 13 28.487 28.487 30.913 -2.426 18784 604 1 6 . 1 1 13 13 GLU H H 13 7.937 7.937 7.825 0.112 18784 605 1 6 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.657 0.112 18784 606 1 6 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.366 0.773 18784 607 1 6 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.663 1.051 18784 608 1 6 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.212 0.004 18784 609 1 6 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.356 1.243 18784 610 1 6 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.180 -1.069 18784 611 1 6 . 1 1 15 15 ASN H H 15 8.602 8.602 8.749 -0.147 18784 612 1 6 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.807 -0.651 18784 613 1 6 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.666 1.377 18784 614 1 6 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.518 -5.037 18784 615 1 6 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.479 -0.069 18784 616 1 6 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.933 -2.726 18784 617 1 6 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.160 17.082 18784 618 1 6 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 619 1 6 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.743 0.018 18784 620 1 6 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.423 -5.865 18784 621 1 6 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.891 13.631 18784 622 1 6 . 1 1 18 18 CYS H H 18 8.830 8.830 8.801 0.029 18784 623 1 6 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 624 1 6 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.958 0.731 18784 625 1 6 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.408 0.541 18784 626 1 6 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 627 1 6 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.550 0.343 18784 628 1 6 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.629 1.933 18784 629 1 6 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.060 -0.686 18784 630 1 6 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.005 3.675 18784 631 1 6 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.437 -3.546 18784 632 1 6 . 1 1 21 21 LEU H H 21 8.825 8.825 8.442 0.383 18784 633 1 6 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 634 1 6 . 1 1 22 22 THR CA C 22 61.221 61.221 59.991 1.230 18784 635 1 6 . 1 1 22 22 THR CB C 22 71.220 71.220 71.504 -0.284 18784 636 1 6 . 1 1 22 22 THR H H 22 8.833 8.833 9.121 -0.288 18784 637 1 6 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.319 -0.628 18784 638 1 6 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.713 -2.338 18784 639 1 6 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.641 13.532 18784 640 1 6 . 1 1 23 23 CYS H H 23 7.992 7.992 8.822 -0.830 18784 641 1 6 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 642 1 6 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.715 -1.137 18784 643 1 6 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.955 0.141 18784 644 1 6 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 645 1 6 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.371 0.220 18784 646 1 6 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.997 0.648 18784 647 1 6 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.455 1.887 18784 648 1 6 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.107 2.260 18784 649 1 6 . 1 1 26 26 GLY H H 26 7.882 7.882 8.161 -0.279 18784 650 1 6 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.862 0.225 18784 651 1 6 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.651 -1.592 18784 652 1 6 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.457 -2.613 18784 653 1 6 . 1 1 27 27 ASP H H 27 7.730 7.730 7.845 -0.115 18784 654 1 6 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.460 -0.167 18784 655 1 6 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.418 0.329 18784 656 1 6 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.151 2.452 18784 657 1 6 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.534 0.902 18784 658 1 6 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.572 -0.866 18784 659 1 6 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.171 0.623 18784 660 1 6 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 661 1 6 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.677 2.569 18784 662 1 6 . 1 1 30 30 GLY H H 30 8.457 8.457 8.970 -0.513 18784 663 1 6 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.106 -0.316 18784 664 1 6 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.335 1.786 18784 665 1 6 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.003 -0.500 18784 666 1 6 . 1 1 31 31 ILE H H 31 8.636 8.636 8.288 0.348 18784 667 1 6 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.308 -0.125 18784 668 1 6 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.500 -2.852 18784 669 1 6 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.419 16.506 18784 670 1 6 . 1 1 32 32 CYS H H 32 8.187 8.187 8.614 -0.427 18784 671 1 6 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.738 0.216 18784 672 1 6 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.984 0.662 18784 673 1 6 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.128 1.348 18784 674 1 6 . 1 1 33 33 TYR H H 33 9.324 9.324 9.321 0.003 18784 675 1 6 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.363 0.030 18784 676 1 6 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.788 0.215 18784 677 1 6 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.183 0.535 18784 678 1 6 . 1 1 34 34 ILE H H 34 8.078 8.078 8.629 -0.551 18784 679 1 7 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.862 0.139 18784 680 1 7 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.689 -3.277 18784 681 1 7 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.342 15.279 18784 682 1 7 . 1 1 3 3 CYS H H 3 7.856 7.856 8.183 -0.327 18784 683 1 7 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.515 -0.006 18784 684 1 7 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.938 0.129 18784 685 1 7 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.904 -0.096 18784 686 1 7 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.569 -1.246 18784 687 1 7 . 1 1 5 5 GLY H H 5 7.965 7.965 7.915 0.050 18784 688 1 7 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.053 -0.357 18784 689 1 7 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.002 0.571 18784 690 1 7 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.658 -1.171 18784 691 1 7 . 1 1 6 6 GLU H H 6 8.365 8.365 8.260 0.105 18784 692 1 7 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.902 0.754 18784 693 1 7 . 1 1 7 7 GLY H H 7 9.294 9.294 8.637 0.657 18784 694 1 7 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.480 0.063 18784 695 1 7 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.944 0.915 18784 696 1 7 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.739 -2.000 18784 697 1 7 . 1 1 8 8 GLU H H 8 7.948 7.948 7.899 0.049 18784 698 1 7 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.724 0.076 18784 699 1 7 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.002 0.891 18784 700 1 7 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.535 5.255 18784 701 1 7 . 1 1 9 9 GLN H H 9 8.483 8.483 8.475 0.008 18784 702 1 7 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.392 -0.244 18784 703 1 7 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.434 -1.819 18784 704 1 7 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.939 22.288 18784 705 1 7 . 1 1 10 10 CYS H H 10 8.509 8.509 9.071 -0.562 18784 706 1 7 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.730 0.503 18784 707 1 7 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.115 0.436 18784 708 1 7 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.710 -1.225 18784 709 1 7 . 1 1 11 11 ASP H H 11 7.738 7.738 8.576 -0.838 18784 710 1 7 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.152 -0.478 18784 711 1 7 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.126 2.491 18784 712 1 7 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.415 1.597 18784 713 1 7 . 1 1 12 12 VAL H H 12 8.595 8.595 8.054 0.541 18784 714 1 7 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.311 -0.049 18784 715 1 7 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.331 1.335 18784 716 1 7 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.109 -2.622 18784 717 1 7 . 1 1 13 13 GLU H H 13 7.937 7.937 7.819 0.118 18784 718 1 7 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.657 0.112 18784 719 1 7 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.367 0.771 18784 720 1 7 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.658 1.056 18784 721 1 7 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.212 0.004 18784 722 1 7 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.358 1.241 18784 723 1 7 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.182 -1.071 18784 724 1 7 . 1 1 15 15 ASN H H 15 8.602 8.602 8.751 -0.149 18784 725 1 7 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.807 -0.651 18784 726 1 7 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.668 1.375 18784 727 1 7 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.513 -5.032 18784 728 1 7 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.478 -0.068 18784 729 1 7 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.935 -2.728 18784 730 1 7 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.162 17.080 18784 731 1 7 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 732 1 7 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.744 0.017 18784 733 1 7 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.417 -5.859 18784 734 1 7 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.893 13.629 18784 735 1 7 . 1 1 18 18 CYS H H 18 8.830 8.830 8.801 0.029 18784 736 1 7 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 737 1 7 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.958 0.731 18784 738 1 7 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.408 0.541 18784 739 1 7 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 740 1 7 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.551 0.342 18784 741 1 7 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.628 1.934 18784 742 1 7 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.036 -0.662 18784 743 1 7 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.968 3.712 18784 744 1 7 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.619 -3.728 18784 745 1 7 . 1 1 21 21 LEU H H 21 8.825 8.825 8.426 0.399 18784 746 1 7 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 747 1 7 . 1 1 22 22 THR CA C 22 61.221 61.221 59.964 1.257 18784 748 1 7 . 1 1 22 22 THR CB C 22 71.220 71.220 70.977 0.243 18784 749 1 7 . 1 1 22 22 THR H H 22 8.833 8.833 9.077 -0.244 18784 750 1 7 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.340 -0.649 18784 751 1 7 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.593 -2.218 18784 752 1 7 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.467 13.706 18784 753 1 7 . 1 1 23 23 CYS H H 23 7.992 7.992 8.848 -0.856 18784 754 1 7 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 755 1 7 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.715 -1.137 18784 756 1 7 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.953 0.143 18784 757 1 7 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 758 1 7 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.371 0.220 18784 759 1 7 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.997 0.648 18784 760 1 7 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.454 1.888 18784 761 1 7 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.111 2.256 18784 762 1 7 . 1 1 26 26 GLY H H 26 7.882 7.882 8.161 -0.279 18784 763 1 7 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.862 0.225 18784 764 1 7 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.651 -1.592 18784 765 1 7 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.455 -2.611 18784 766 1 7 . 1 1 27 27 ASP H H 27 7.730 7.730 7.844 -0.114 18784 767 1 7 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.460 -0.167 18784 768 1 7 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.416 0.331 18784 769 1 7 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.152 2.451 18784 770 1 7 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.533 0.903 18784 771 1 7 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.574 -0.868 18784 772 1 7 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.169 0.625 18784 773 1 7 . 1 1 29 29 TYR H H 29 7.422 7.422 7.905 -0.483 18784 774 1 7 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.678 2.568 18784 775 1 7 . 1 1 30 30 GLY H H 30 8.457 8.457 8.965 -0.508 18784 776 1 7 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.105 -0.315 18784 777 1 7 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.335 1.786 18784 778 1 7 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.999 -0.496 18784 779 1 7 . 1 1 31 31 ILE H H 31 8.636 8.636 8.288 0.348 18784 780 1 7 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.305 -0.122 18784 781 1 7 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.503 -2.855 18784 782 1 7 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.415 16.510 18784 783 1 7 . 1 1 32 32 CYS H H 32 8.187 8.187 8.615 -0.428 18784 784 1 7 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.738 0.216 18784 785 1 7 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.984 0.662 18784 786 1 7 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.128 1.348 18784 787 1 7 . 1 1 33 33 TYR H H 33 9.324 9.324 9.320 0.004 18784 788 1 7 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.362 0.031 18784 789 1 7 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.794 0.209 18784 790 1 7 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.179 0.539 18784 791 1 7 . 1 1 34 34 ILE H H 34 8.078 8.078 8.630 -0.552 18784 792 1 8 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.647 0.354 18784 793 1 8 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.954 -4.542 18784 794 1 8 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.341 15.280 18784 795 1 8 . 1 1 3 3 CYS H H 3 7.856 7.856 8.363 -0.507 18784 796 1 8 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.486 0.023 18784 797 1 8 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.887 0.180 18784 798 1 8 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.930 -0.121 18784 799 1 8 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.643 -1.320 18784 800 1 8 . 1 1 5 5 GLY H H 5 7.965 7.965 8.137 -0.172 18784 801 1 8 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.034 -0.338 18784 802 1 8 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.323 0.250 18784 803 1 8 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.526 -1.039 18784 804 1 8 . 1 1 6 6 GLU H H 6 8.365 8.365 8.314 0.051 18784 805 1 8 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.660 0.996 18784 806 1 8 . 1 1 7 7 GLY H H 7 9.294 9.294 8.667 0.627 18784 807 1 8 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.452 0.091 18784 808 1 8 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.510 0.349 18784 809 1 8 . 1 1 8 8 GLU CB C 8 30.739 30.739 31.573 -0.834 18784 810 1 8 . 1 1 8 8 GLU H H 8 7.948 7.948 7.566 0.382 18784 811 1 8 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.648 0.152 18784 812 1 8 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.043 0.850 18784 813 1 8 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.816 4.975 18784 814 1 8 . 1 1 9 9 GLN H H 9 8.483 8.483 8.472 0.011 18784 815 1 8 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.401 -0.253 18784 816 1 8 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.509 -1.894 18784 817 1 8 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.142 22.085 18784 818 1 8 . 1 1 10 10 CYS H H 10 8.509 8.509 9.083 -0.574 18784 819 1 8 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.743 0.490 18784 820 1 8 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.119 0.433 18784 821 1 8 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.732 -1.247 18784 822 1 8 . 1 1 11 11 ASP H H 11 7.738 7.738 8.578 -0.840 18784 823 1 8 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.165 -0.491 18784 824 1 8 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.275 2.342 18784 825 1 8 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.483 1.529 18784 826 1 8 . 1 1 12 12 VAL H H 12 8.595 8.595 8.084 0.511 18784 827 1 8 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.358 -0.096 18784 828 1 8 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.277 1.390 18784 829 1 8 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.181 -2.694 18784 830 1 8 . 1 1 13 13 GLU H H 13 7.937 7.937 7.814 0.123 18784 831 1 8 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.628 0.141 18784 832 1 8 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.475 0.664 18784 833 1 8 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.451 1.263 18784 834 1 8 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.190 0.026 18784 835 1 8 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.449 1.150 18784 836 1 8 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.137 -1.026 18784 837 1 8 . 1 1 15 15 ASN H H 15 8.602 8.602 8.703 -0.101 18784 838 1 8 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.816 -0.660 18784 839 1 8 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.639 1.404 18784 840 1 8 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.374 -4.893 18784 841 1 8 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.520 -0.110 18784 842 1 8 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.230 -3.023 18784 843 1 8 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.430 17.811 18784 844 1 8 . 1 1 17 17 CYS H H 17 7.125 7.125 8.221 -1.096 18784 845 1 8 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.552 0.209 18784 846 1 8 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.425 -6.867 18784 847 1 8 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.282 13.240 18784 848 1 8 . 1 1 18 18 CYS H H 18 8.830 8.830 8.860 -0.030 18784 849 1 8 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.650 0.258 18784 850 1 8 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.620 0.069 18784 851 1 8 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.747 0.202 18784 852 1 8 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.386 0.396 18784 853 1 8 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.522 0.371 18784 854 1 8 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.679 1.883 18784 855 1 8 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.059 -0.685 18784 856 1 8 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.989 3.691 18784 857 1 8 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.355 -3.463 18784 858 1 8 . 1 1 21 21 LEU H H 21 8.825 8.825 8.367 0.458 18784 859 1 8 . 1 1 22 22 THR HA H 22 4.507 4.507 4.649 -0.142 18784 860 1 8 . 1 1 22 22 THR CA C 22 61.221 61.221 59.961 1.260 18784 861 1 8 . 1 1 22 22 THR CB C 22 71.220 71.220 71.457 -0.237 18784 862 1 8 . 1 1 22 22 THR H H 22 8.833 8.833 9.126 -0.293 18784 863 1 8 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.301 -0.610 18784 864 1 8 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.742 -2.367 18784 865 1 8 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.638 13.535 18784 866 1 8 . 1 1 23 23 CYS H H 23 7.992 7.992 8.816 -0.824 18784 867 1 8 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.664 -0.014 18784 868 1 8 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.734 -1.155 18784 869 1 8 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.971 0.125 18784 870 1 8 . 1 1 24 24 ILE H H 24 8.831 8.831 9.326 -0.495 18784 871 1 8 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 872 1 8 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.999 0.646 18784 873 1 8 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.464 1.878 18784 874 1 8 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.162 2.205 18784 875 1 8 . 1 1 26 26 GLY H H 26 7.882 7.882 8.220 -0.338 18784 876 1 8 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.884 0.203 18784 877 1 8 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.693 -1.634 18784 878 1 8 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.235 -2.391 18784 879 1 8 . 1 1 27 27 ASP H H 27 7.730 7.730 7.803 -0.073 18784 880 1 8 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.419 -0.126 18784 881 1 8 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.101 0.646 18784 882 1 8 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.206 2.397 18784 883 1 8 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.542 0.894 18784 884 1 8 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.548 -0.842 18784 885 1 8 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.211 0.584 18784 886 1 8 . 1 1 29 29 TYR H H 29 7.422 7.422 7.890 -0.468 18784 887 1 8 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.669 2.577 18784 888 1 8 . 1 1 30 30 GLY H H 30 8.457 8.457 9.032 -0.575 18784 889 1 8 . 1 1 31 31 ILE HA H 31 4.790 4.790 4.977 -0.187 18784 890 1 8 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.398 1.722 18784 891 1 8 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.971 -0.469 18784 892 1 8 . 1 1 31 31 ILE H H 31 8.636 8.636 8.303 0.333 18784 893 1 8 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.308 -0.125 18784 894 1 8 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.609 -2.961 18784 895 1 8 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.436 16.489 18784 896 1 8 . 1 1 32 32 CYS H H 32 8.187 8.187 8.621 -0.434 18784 897 1 8 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.725 0.229 18784 898 1 8 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.028 0.618 18784 899 1 8 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.050 1.426 18784 900 1 8 . 1 1 33 33 TYR H H 33 9.324 9.324 9.312 0.012 18784 901 1 8 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.359 0.034 18784 902 1 8 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.821 0.182 18784 903 1 8 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.170 0.548 18784 904 1 8 . 1 1 34 34 ILE H H 34 8.078 8.078 8.625 -0.547 18784 905 1 9 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.874 0.127 18784 906 1 9 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.773 -3.361 18784 907 1 9 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.133 15.488 18784 908 1 9 . 1 1 3 3 CYS H H 3 7.856 7.856 8.172 -0.316 18784 909 1 9 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.519 -0.010 18784 910 1 9 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.944 0.124 18784 911 1 9 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.900 -0.091 18784 912 1 9 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.569 -1.246 18784 913 1 9 . 1 1 5 5 GLY H H 5 7.965 7.965 7.917 0.048 18784 914 1 9 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.054 -0.358 18784 915 1 9 . 1 1 6 6 GLU CA C 6 57.573 57.573 56.996 0.577 18784 916 1 9 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.654 -1.167 18784 917 1 9 . 1 1 6 6 GLU H H 6 8.365 8.365 8.260 0.105 18784 918 1 9 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.901 0.755 18784 919 1 9 . 1 1 7 7 GLY H H 7 9.294 9.294 8.640 0.654 18784 920 1 9 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.480 0.063 18784 921 1 9 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.943 0.916 18784 922 1 9 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.739 -2.000 18784 923 1 9 . 1 1 8 8 GLU H H 8 7.948 7.948 7.898 0.050 18784 924 1 9 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 925 1 9 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.002 0.891 18784 926 1 9 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.538 5.253 18784 927 1 9 . 1 1 9 9 GLN H H 9 8.483 8.483 8.475 0.008 18784 928 1 9 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.387 -0.239 18784 929 1 9 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.436 -1.821 18784 930 1 9 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.961 22.266 18784 931 1 9 . 1 1 10 10 CYS H H 10 8.509 8.509 9.074 -0.565 18784 932 1 9 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.769 0.464 18784 933 1 9 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.245 0.306 18784 934 1 9 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.686 -1.201 18784 935 1 9 . 1 1 11 11 ASP H H 11 7.738 7.738 8.528 -0.790 18784 936 1 9 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.137 -0.463 18784 937 1 9 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.342 2.275 18784 938 1 9 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.249 0.763 18784 939 1 9 . 1 1 12 12 VAL H H 12 8.595 8.595 7.971 0.624 18784 940 1 9 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.306 -0.044 18784 941 1 9 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.411 1.256 18784 942 1 9 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.010 -2.523 18784 943 1 9 . 1 1 13 13 GLU H H 13 7.937 7.937 7.847 0.090 18784 944 1 9 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.657 0.112 18784 945 1 9 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.366 0.773 18784 946 1 9 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.656 1.058 18784 947 1 9 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.211 0.005 18784 948 1 9 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.364 1.235 18784 949 1 9 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.185 -1.074 18784 950 1 9 . 1 1 15 15 ASN H H 15 8.602 8.602 8.753 -0.151 18784 951 1 9 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.808 -0.652 18784 952 1 9 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.664 1.379 18784 953 1 9 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.520 -5.039 18784 954 1 9 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.478 -0.068 18784 955 1 9 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.939 -2.732 18784 956 1 9 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.157 17.085 18784 957 1 9 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 958 1 9 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.742 0.019 18784 959 1 9 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.423 -5.865 18784 960 1 9 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.889 13.633 18784 961 1 9 . 1 1 18 18 CYS H H 18 8.830 8.830 8.798 0.032 18784 962 1 9 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 963 1 9 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.957 0.732 18784 964 1 9 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.410 0.539 18784 965 1 9 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.386 0.396 18784 966 1 9 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.550 0.343 18784 967 1 9 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.630 1.932 18784 968 1 9 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.053 -0.679 18784 969 1 9 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.020 3.660 18784 970 1 9 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.376 -3.485 18784 971 1 9 . 1 1 21 21 LEU H H 21 8.825 8.825 8.412 0.413 18784 972 1 9 . 1 1 22 22 THR HA H 22 4.507 4.507 4.620 -0.113 18784 973 1 9 . 1 1 22 22 THR CA C 22 61.221 61.221 60.288 0.932 18784 974 1 9 . 1 1 22 22 THR CB C 22 71.220 71.220 71.594 -0.374 18784 975 1 9 . 1 1 22 22 THR H H 22 8.833 8.833 9.076 -0.243 18784 976 1 9 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.373 -0.682 18784 977 1 9 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.521 -2.146 18784 978 1 9 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.498 13.675 18784 979 1 9 . 1 1 23 23 CYS H H 23 7.992 7.992 8.793 -0.801 18784 980 1 9 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 981 1 9 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.717 -1.138 18784 982 1 9 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.959 0.137 18784 983 1 9 . 1 1 24 24 ILE H H 24 8.831 8.831 9.322 -0.491 18784 984 1 9 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.372 0.219 18784 985 1 9 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.994 0.651 18784 986 1 9 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.456 1.886 18784 987 1 9 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.108 2.259 18784 988 1 9 . 1 1 26 26 GLY H H 26 7.882 7.882 8.160 -0.278 18784 989 1 9 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.863 0.224 18784 990 1 9 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.646 -1.587 18784 991 1 9 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.450 -2.606 18784 992 1 9 . 1 1 27 27 ASP H H 27 7.730 7.730 7.845 -0.115 18784 993 1 9 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.461 -0.168 18784 994 1 9 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.416 0.331 18784 995 1 9 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.153 2.450 18784 996 1 9 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.534 0.902 18784 997 1 9 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.575 -0.869 18784 998 1 9 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.171 0.623 18784 999 1 9 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1000 1 9 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.680 2.566 18784 1001 1 9 . 1 1 30 30 GLY H H 30 8.457 8.457 8.974 -0.517 18784 1002 1 9 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.105 -0.315 18784 1003 1 9 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.335 1.786 18784 1004 1 9 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.003 -0.500 18784 1005 1 9 . 1 1 31 31 ILE H H 31 8.636 8.636 8.287 0.349 18784 1006 1 9 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.307 -0.124 18784 1007 1 9 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.497 -2.849 18784 1008 1 9 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.418 16.507 18784 1009 1 9 . 1 1 32 32 CYS H H 32 8.187 8.187 8.616 -0.429 18784 1010 1 9 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.738 0.216 18784 1011 1 9 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.983 0.663 18784 1012 1 9 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.132 1.344 18784 1013 1 9 . 1 1 33 33 TYR H H 33 9.324 9.324 9.318 0.006 18784 1014 1 9 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1015 1 9 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.801 0.202 18784 1016 1 9 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.177 0.541 18784 1017 1 9 . 1 1 34 34 ILE H H 34 8.078 8.078 8.630 -0.552 18784 1018 1 10 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.864 0.137 18784 1019 1 10 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.814 -3.402 18784 1020 1 10 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.102 15.519 18784 1021 1 10 . 1 1 3 3 CYS H H 3 7.856 7.856 8.172 -0.316 18784 1022 1 10 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.527 -0.018 18784 1023 1 10 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.957 0.110 18784 1024 1 10 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.876 -0.067 18784 1025 1 10 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.582 -1.259 18784 1026 1 10 . 1 1 5 5 GLY H H 5 7.965 7.965 7.921 0.044 18784 1027 1 10 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.049 -0.353 18784 1028 1 10 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.023 0.550 18784 1029 1 10 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.641 -1.154 18784 1030 1 10 . 1 1 6 6 GLU H H 6 8.365 8.365 8.263 0.102 18784 1031 1 10 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.891 0.765 18784 1032 1 10 . 1 1 7 7 GLY H H 7 9.294 9.294 8.641 0.653 18784 1033 1 10 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 1034 1 10 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.940 0.919 18784 1035 1 10 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.723 -1.984 18784 1036 1 10 . 1 1 8 8 GLU H H 8 7.948 7.948 7.873 0.075 18784 1037 1 10 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.712 0.088 18784 1038 1 10 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.052 0.841 18784 1039 1 10 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.594 5.197 18784 1040 1 10 . 1 1 9 9 GLN H H 9 8.483 8.483 8.474 0.009 18784 1041 1 10 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.384 -0.236 18784 1042 1 10 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.462 -1.847 18784 1043 1 10 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.027 22.200 18784 1044 1 10 . 1 1 10 10 CYS H H 10 8.509 8.509 9.080 -0.571 18784 1045 1 10 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.769 0.464 18784 1046 1 10 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.248 0.304 18784 1047 1 10 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.680 -1.195 18784 1048 1 10 . 1 1 11 11 ASP H H 11 7.738 7.738 8.531 -0.793 18784 1049 1 10 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.135 -0.461 18784 1050 1 10 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.345 2.272 18784 1051 1 10 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.244 0.768 18784 1052 1 10 . 1 1 12 12 VAL H H 12 8.595 8.595 7.976 0.619 18784 1053 1 10 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.306 -0.044 18784 1054 1 10 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.412 1.255 18784 1055 1 10 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.006 -2.519 18784 1056 1 10 . 1 1 13 13 GLU H H 13 7.937 7.937 7.846 0.091 18784 1057 1 10 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.657 0.112 18784 1058 1 10 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.367 0.772 18784 1059 1 10 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.661 1.053 18784 1060 1 10 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.211 0.005 18784 1061 1 10 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.370 1.229 18784 1062 1 10 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.189 -1.078 18784 1063 1 10 . 1 1 15 15 ASN H H 15 8.602 8.602 8.752 -0.150 18784 1064 1 10 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.808 -0.652 18784 1065 1 10 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.667 1.376 18784 1066 1 10 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.514 -5.033 18784 1067 1 10 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.475 -0.065 18784 1068 1 10 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.945 -2.738 18784 1069 1 10 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.152 17.090 18784 1070 1 10 . 1 1 17 17 CYS H H 17 7.125 7.125 8.182 -1.057 18784 1071 1 10 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.741 0.020 18784 1072 1 10 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.424 -5.866 18784 1073 1 10 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.889 13.633 18784 1074 1 10 . 1 1 18 18 CYS H H 18 8.830 8.830 8.796 0.034 18784 1075 1 10 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.744 0.164 18784 1076 1 10 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.952 0.737 18784 1077 1 10 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.413 0.536 18784 1078 1 10 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.384 0.398 18784 1079 1 10 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.552 0.341 18784 1080 1 10 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.631 1.931 18784 1081 1 10 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.031 -0.657 18784 1082 1 10 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.969 3.711 18784 1083 1 10 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.620 -3.729 18784 1084 1 10 . 1 1 21 21 LEU H H 21 8.825 8.825 8.428 0.397 18784 1085 1 10 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 1086 1 10 . 1 1 22 22 THR CA C 22 61.221 61.221 59.964 1.257 18784 1087 1 10 . 1 1 22 22 THR CB C 22 71.220 71.220 70.974 0.246 18784 1088 1 10 . 1 1 22 22 THR H H 22 8.833 8.833 9.074 -0.241 18784 1089 1 10 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.341 -0.650 18784 1090 1 10 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.593 -2.218 18784 1091 1 10 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.469 13.704 18784 1092 1 10 . 1 1 23 23 CYS H H 23 7.992 7.992 8.848 -0.856 18784 1093 1 10 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 1094 1 10 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.714 -1.135 18784 1095 1 10 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.954 0.142 18784 1096 1 10 . 1 1 24 24 ILE H H 24 8.831 8.831 9.321 -0.490 18784 1097 1 10 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.372 0.219 18784 1098 1 10 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.994 0.651 18784 1099 1 10 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.455 1.887 18784 1100 1 10 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.110 2.257 18784 1101 1 10 . 1 1 26 26 GLY H H 26 7.882 7.882 8.161 -0.279 18784 1102 1 10 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.863 0.224 18784 1103 1 10 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.649 -1.590 18784 1104 1 10 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.456 -2.612 18784 1105 1 10 . 1 1 27 27 ASP H H 27 7.730 7.730 7.845 -0.115 18784 1106 1 10 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.460 -0.167 18784 1107 1 10 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.418 0.329 18784 1108 1 10 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.153 2.450 18784 1109 1 10 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.533 0.903 18784 1110 1 10 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.575 -0.869 18784 1111 1 10 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.169 0.625 18784 1112 1 10 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1113 1 10 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.673 2.573 18784 1114 1 10 . 1 1 30 30 GLY H H 30 8.457 8.457 8.980 -0.523 18784 1115 1 10 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.078 -0.288 18784 1116 1 10 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.347 1.774 18784 1117 1 10 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.999 -0.496 18784 1118 1 10 . 1 1 31 31 ILE H H 31 8.636 8.636 8.291 0.345 18784 1119 1 10 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.310 -0.127 18784 1120 1 10 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.489 -2.841 18784 1121 1 10 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.420 16.505 18784 1122 1 10 . 1 1 32 32 CYS H H 32 8.187 8.187 8.645 -0.458 18784 1123 1 10 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.741 0.213 18784 1124 1 10 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.969 0.677 18784 1125 1 10 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.148 1.327 18784 1126 1 10 . 1 1 33 33 TYR H H 33 9.324 9.324 9.317 0.007 18784 1127 1 10 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1128 1 10 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.802 0.201 18784 1129 1 10 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.174 0.544 18784 1130 1 10 . 1 1 34 34 ILE H H 34 8.078 8.078 8.631 -0.553 18784 1131 1 11 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.809 0.192 18784 1132 1 11 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.593 -3.181 18784 1133 1 11 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.869 14.752 18784 1134 1 11 . 1 1 3 3 CYS H H 3 7.856 7.856 8.290 -0.434 18784 1135 1 11 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.519 -0.010 18784 1136 1 11 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.953 0.114 18784 1137 1 11 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.892 -0.083 18784 1138 1 11 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.565 -1.242 18784 1139 1 11 . 1 1 5 5 GLY H H 5 7.965 7.965 7.914 0.051 18784 1140 1 11 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.051 -0.355 18784 1141 1 11 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.010 0.563 18784 1142 1 11 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.648 -1.161 18784 1143 1 11 . 1 1 6 6 GLU H H 6 8.365 8.365 8.261 0.104 18784 1144 1 11 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.900 0.756 18784 1145 1 11 . 1 1 7 7 GLY H H 7 9.294 9.294 8.638 0.656 18784 1146 1 11 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.480 0.063 18784 1147 1 11 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.945 0.914 18784 1148 1 11 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.740 -2.001 18784 1149 1 11 . 1 1 8 8 GLU H H 8 7.948 7.948 7.894 0.054 18784 1150 1 11 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 1151 1 11 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.002 0.891 18784 1152 1 11 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.543 5.248 18784 1153 1 11 . 1 1 9 9 GLN H H 9 8.483 8.483 8.474 0.009 18784 1154 1 11 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.382 -0.234 18784 1155 1 11 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.438 -1.823 18784 1156 1 11 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.961 22.266 18784 1157 1 11 . 1 1 10 10 CYS H H 10 8.509 8.509 9.076 -0.567 18784 1158 1 11 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.768 0.465 18784 1159 1 11 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.249 0.302 18784 1160 1 11 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.682 -1.197 18784 1161 1 11 . 1 1 11 11 ASP H H 11 7.738 7.738 8.529 -0.791 18784 1162 1 11 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.137 -0.463 18784 1163 1 11 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.344 2.273 18784 1164 1 11 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.252 0.760 18784 1165 1 11 . 1 1 12 12 VAL H H 12 8.595 8.595 7.974 0.621 18784 1166 1 11 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.304 -0.042 18784 1167 1 11 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.422 1.245 18784 1168 1 11 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.003 -2.516 18784 1169 1 11 . 1 1 13 13 GLU H H 13 7.937 7.937 7.846 0.091 18784 1170 1 11 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.656 0.113 18784 1171 1 11 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.372 0.767 18784 1172 1 11 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.654 1.060 18784 1173 1 11 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.214 0.002 18784 1174 1 11 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.473 1.126 18784 1175 1 11 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.218 -1.107 18784 1176 1 11 . 1 1 15 15 ASN H H 15 8.602 8.602 8.737 -0.135 18784 1177 1 11 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.808 -0.652 18784 1178 1 11 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.666 1.377 18784 1179 1 11 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.513 -5.032 18784 1180 1 11 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.477 -0.067 18784 1181 1 11 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.943 -2.736 18784 1182 1 11 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.152 17.090 18784 1183 1 11 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 1184 1 11 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.741 0.020 18784 1185 1 11 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.423 -5.865 18784 1186 1 11 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.887 13.635 18784 1187 1 11 . 1 1 18 18 CYS H H 18 8.830 8.830 8.798 0.032 18784 1188 1 11 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.744 0.164 18784 1189 1 11 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.951 0.738 18784 1190 1 11 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.413 0.536 18784 1191 1 11 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 1192 1 11 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.550 0.343 18784 1193 1 11 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.631 1.931 18784 1194 1 11 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.052 -0.678 18784 1195 1 11 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.019 3.661 18784 1196 1 11 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.377 -3.486 18784 1197 1 11 . 1 1 21 21 LEU H H 21 8.825 8.825 8.413 0.412 18784 1198 1 11 . 1 1 22 22 THR HA H 22 4.507 4.507 4.620 -0.113 18784 1199 1 11 . 1 1 22 22 THR CA C 22 61.221 61.221 60.290 0.931 18784 1200 1 11 . 1 1 22 22 THR CB C 22 71.220 71.220 71.594 -0.374 18784 1201 1 11 . 1 1 22 22 THR H H 22 8.833 8.833 9.076 -0.243 18784 1202 1 11 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.373 -0.682 18784 1203 1 11 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.516 -2.141 18784 1204 1 11 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.504 13.669 18784 1205 1 11 . 1 1 23 23 CYS H H 23 7.992 7.992 8.792 -0.800 18784 1206 1 11 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 1207 1 11 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.713 -1.134 18784 1208 1 11 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.950 0.145 18784 1209 1 11 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 1210 1 11 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.371 0.220 18784 1211 1 11 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.999 0.646 18784 1212 1 11 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.453 1.889 18784 1213 1 11 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.181 2.186 18784 1214 1 11 . 1 1 26 26 GLY H H 26 7.882 7.882 8.222 -0.340 18784 1215 1 11 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.885 0.202 18784 1216 1 11 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.684 -1.625 18784 1217 1 11 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.223 -2.379 18784 1218 1 11 . 1 1 27 27 ASP H H 27 7.730 7.730 7.803 -0.073 18784 1219 1 11 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.423 -0.130 18784 1220 1 11 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.095 0.652 18784 1221 1 11 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.209 2.394 18784 1222 1 11 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.535 0.901 18784 1223 1 11 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.570 -0.864 18784 1224 1 11 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.171 0.623 18784 1225 1 11 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1226 1 11 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.680 2.566 18784 1227 1 11 . 1 1 30 30 GLY H H 30 8.457 8.457 8.974 -0.517 18784 1228 1 11 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.102 -0.312 18784 1229 1 11 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.335 1.786 18784 1230 1 11 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.000 -0.497 18784 1231 1 11 . 1 1 31 31 ILE H H 31 8.636 8.636 8.288 0.348 18784 1232 1 11 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.306 -0.123 18784 1233 1 11 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.501 -2.853 18784 1234 1 11 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.416 16.509 18784 1235 1 11 . 1 1 32 32 CYS H H 32 8.187 8.187 8.617 -0.430 18784 1236 1 11 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.740 0.214 18784 1237 1 11 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.976 0.670 18784 1238 1 11 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.144 1.332 18784 1239 1 11 . 1 1 33 33 TYR H H 33 9.324 9.324 9.320 0.004 18784 1240 1 11 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1241 1 11 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.797 0.206 18784 1242 1 11 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.180 0.538 18784 1243 1 11 . 1 1 34 34 ILE H H 34 8.078 8.078 8.629 -0.551 18784 1244 1 12 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.794 0.207 18784 1245 1 12 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.282 -3.870 18784 1246 1 12 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.630 14.991 18784 1247 1 12 . 1 1 3 3 CYS H H 3 7.856 7.856 8.362 -0.506 18784 1248 1 12 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.527 -0.018 18784 1249 1 12 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.962 0.106 18784 1250 1 12 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.874 -0.065 18784 1251 1 12 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.583 -1.260 18784 1252 1 12 . 1 1 5 5 GLY H H 5 7.965 7.965 7.924 0.041 18784 1253 1 12 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.050 -0.354 18784 1254 1 12 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.015 0.558 18784 1255 1 12 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.642 -1.155 18784 1256 1 12 . 1 1 6 6 GLU H H 6 8.365 8.365 8.263 0.102 18784 1257 1 12 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.890 0.766 18784 1258 1 12 . 1 1 7 7 GLY H H 7 9.294 9.294 8.644 0.650 18784 1259 1 12 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 1260 1 12 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.944 0.915 18784 1261 1 12 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.721 -1.982 18784 1262 1 12 . 1 1 8 8 GLU H H 8 7.948 7.948 7.874 0.074 18784 1263 1 12 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.714 0.086 18784 1264 1 12 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.050 0.843 18784 1265 1 12 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.595 5.196 18784 1266 1 12 . 1 1 9 9 GLN H H 9 8.483 8.483 8.473 0.010 18784 1267 1 12 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.380 -0.232 18784 1268 1 12 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.466 -1.851 18784 1269 1 12 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.035 22.192 18784 1270 1 12 . 1 1 10 10 CYS H H 10 8.509 8.509 9.085 -0.576 18784 1271 1 12 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.728 0.505 18784 1272 1 12 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.131 0.421 18784 1273 1 12 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.763 -1.278 18784 1274 1 12 . 1 1 11 11 ASP H H 11 7.738 7.738 8.589 -0.851 18784 1275 1 12 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.154 -0.480 18784 1276 1 12 . 1 1 12 12 VAL CA C 12 65.617 65.617 62.913 2.704 18784 1277 1 12 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.574 1.438 18784 1278 1 12 . 1 1 12 12 VAL H H 12 8.595 8.595 8.009 0.586 18784 1279 1 12 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.309 -0.047 18784 1280 1 12 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.341 1.326 18784 1281 1 12 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.091 -2.604 18784 1282 1 12 . 1 1 13 13 GLU H H 13 7.937 7.937 7.815 0.122 18784 1283 1 12 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.656 0.113 18784 1284 1 12 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.368 0.771 18784 1285 1 12 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.653 1.061 18784 1286 1 12 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.215 0.001 18784 1287 1 12 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.473 1.126 18784 1288 1 12 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.221 -1.110 18784 1289 1 12 . 1 1 15 15 ASN H H 15 8.602 8.602 8.735 -0.133 18784 1290 1 12 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.809 -0.653 18784 1291 1 12 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.666 1.377 18784 1292 1 12 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.513 -5.032 18784 1293 1 12 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.476 -0.066 18784 1294 1 12 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.941 -2.734 18784 1295 1 12 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.149 17.093 18784 1296 1 12 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 1297 1 12 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.739 0.022 18784 1298 1 12 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.430 -5.872 18784 1299 1 12 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.884 13.638 18784 1300 1 12 . 1 1 18 18 CYS H H 18 8.830 8.830 8.796 0.034 18784 1301 1 12 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.744 0.164 18784 1302 1 12 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.952 0.737 18784 1303 1 12 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.415 0.534 18784 1304 1 12 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.384 0.398 18784 1305 1 12 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.553 0.340 18784 1306 1 12 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.633 1.929 18784 1307 1 12 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.049 -0.675 18784 1308 1 12 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.016 3.664 18784 1309 1 12 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.373 -3.482 18784 1310 1 12 . 1 1 21 21 LEU H H 21 8.825 8.825 8.410 0.415 18784 1311 1 12 . 1 1 22 22 THR HA H 22 4.507 4.507 4.620 -0.113 18784 1312 1 12 . 1 1 22 22 THR CA C 22 61.221 61.221 60.289 0.931 18784 1313 1 12 . 1 1 22 22 THR CB C 22 71.220 71.220 71.593 -0.373 18784 1314 1 12 . 1 1 22 22 THR H H 22 8.833 8.833 9.074 -0.241 18784 1315 1 12 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.374 -0.683 18784 1316 1 12 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.517 -2.142 18784 1317 1 12 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.501 13.672 18784 1318 1 12 . 1 1 23 23 CYS H H 23 7.992 7.992 8.793 -0.801 18784 1319 1 12 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.670 -0.020 18784 1320 1 12 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.712 -1.133 18784 1321 1 12 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.951 0.145 18784 1322 1 12 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 1323 1 12 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.371 0.220 18784 1324 1 12 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.998 0.647 18784 1325 1 12 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.453 1.889 18784 1326 1 12 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.108 2.259 18784 1327 1 12 . 1 1 26 26 GLY H H 26 7.882 7.882 8.161 -0.279 18784 1328 1 12 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.863 0.224 18784 1329 1 12 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.649 -1.590 18784 1330 1 12 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.452 -2.608 18784 1331 1 12 . 1 1 27 27 ASP H H 27 7.730 7.730 7.844 -0.114 18784 1332 1 12 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.460 -0.167 18784 1333 1 12 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.420 0.327 18784 1334 1 12 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.153 2.450 18784 1335 1 12 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.533 0.903 18784 1336 1 12 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.576 -0.870 18784 1337 1 12 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.172 0.622 18784 1338 1 12 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1339 1 12 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.672 2.574 18784 1340 1 12 . 1 1 30 30 GLY H H 30 8.457 8.457 8.982 -0.525 18784 1341 1 12 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.077 -0.287 18784 1342 1 12 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.348 1.773 18784 1343 1 12 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.005 -0.502 18784 1344 1 12 . 1 1 31 31 ILE H H 31 8.636 8.636 8.291 0.345 18784 1345 1 12 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.310 -0.127 18784 1346 1 12 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.487 -2.839 18784 1347 1 12 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.423 16.502 18784 1348 1 12 . 1 1 32 32 CYS H H 32 8.187 8.187 8.645 -0.458 18784 1349 1 12 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.741 0.213 18784 1350 1 12 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.969 0.677 18784 1351 1 12 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.150 1.326 18784 1352 1 12 . 1 1 33 33 TYR H H 33 9.324 9.324 9.318 0.006 18784 1353 1 12 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1354 1 12 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.805 0.198 18784 1355 1 12 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.173 0.545 18784 1356 1 12 . 1 1 34 34 ILE H H 34 8.078 8.078 8.631 -0.553 18784 1357 1 13 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.632 0.369 18784 1358 1 13 . 1 1 3 3 CYS CA C 3 52.412 52.412 57.049 -4.637 18784 1359 1 13 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.211 15.410 18784 1360 1 13 . 1 1 3 3 CYS H H 3 7.856 7.856 8.338 -0.482 18784 1361 1 13 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.466 0.043 18784 1362 1 13 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.723 0.344 18784 1363 1 13 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.817 -0.008 18784 1364 1 13 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.650 -1.327 18784 1365 1 13 . 1 1 5 5 GLY H H 5 7.965 7.965 8.194 -0.229 18784 1366 1 13 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.059 -0.363 18784 1367 1 13 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.064 0.509 18784 1368 1 13 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.662 -1.175 18784 1369 1 13 . 1 1 6 6 GLU H H 6 8.365 8.365 8.264 0.101 18784 1370 1 13 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.956 0.700 18784 1371 1 13 . 1 1 7 7 GLY H H 7 9.294 9.294 8.616 0.678 18784 1372 1 13 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.534 0.009 18784 1373 1 13 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.075 0.784 18784 1374 1 13 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.536 -1.797 18784 1375 1 13 . 1 1 8 8 GLU H H 8 7.948 7.948 7.887 0.061 18784 1376 1 13 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.720 0.080 18784 1377 1 13 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.781 1.112 18784 1378 1 13 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.638 5.153 18784 1379 1 13 . 1 1 9 9 GLN H H 9 8.483 8.483 8.501 -0.018 18784 1380 1 13 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.403 -0.255 18784 1381 1 13 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.433 -1.818 18784 1382 1 13 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.975 22.252 18784 1383 1 13 . 1 1 10 10 CYS H H 10 8.509 8.509 9.078 -0.569 18784 1384 1 13 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.724 0.509 18784 1385 1 13 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.126 0.426 18784 1386 1 13 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.681 -1.196 18784 1387 1 13 . 1 1 11 11 ASP H H 11 7.738 7.738 8.568 -0.830 18784 1388 1 13 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.151 -0.477 18784 1389 1 13 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.116 2.501 18784 1390 1 13 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.330 1.682 18784 1391 1 13 . 1 1 12 12 VAL H H 12 8.595 8.595 8.072 0.523 18784 1392 1 13 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.320 -0.058 18784 1393 1 13 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.301 1.366 18784 1394 1 13 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.162 -2.675 18784 1395 1 13 . 1 1 13 13 GLU H H 13 7.937 7.937 7.824 0.113 18784 1396 1 13 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.662 0.107 18784 1397 1 13 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.356 0.783 18784 1398 1 13 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.618 1.096 18784 1399 1 13 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.188 0.028 18784 1400 1 13 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.459 1.140 18784 1401 1 13 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.132 -1.021 18784 1402 1 13 . 1 1 15 15 ASN H H 15 8.602 8.602 8.725 -0.123 18784 1403 1 13 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.816 -0.660 18784 1404 1 13 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.620 1.423 18784 1405 1 13 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.402 -4.921 18784 1406 1 13 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.529 -0.119 18784 1407 1 13 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.199 -2.992 18784 1408 1 13 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.448 17.794 18784 1409 1 13 . 1 1 17 17 CYS H H 17 7.125 7.125 8.216 -1.091 18784 1410 1 13 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.549 0.212 18784 1411 1 13 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.419 -6.861 18784 1412 1 13 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.288 13.234 18784 1413 1 13 . 1 1 18 18 CYS H H 18 8.830 8.830 8.867 -0.037 18784 1414 1 13 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.656 0.252 18784 1415 1 13 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.411 0.278 18784 1416 1 13 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.692 0.258 18784 1417 1 13 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.340 0.442 18784 1418 1 13 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.389 0.504 18784 1419 1 13 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.577 1.985 18784 1420 1 13 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.026 -0.652 18784 1421 1 13 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.991 3.689 18784 1422 1 13 . 1 1 21 21 LEU CB C 21 41.891 41.891 44.984 -3.093 18784 1423 1 13 . 1 1 21 21 LEU H H 21 8.825 8.825 8.374 0.451 18784 1424 1 13 . 1 1 22 22 THR HA H 22 4.507 4.507 4.622 -0.115 18784 1425 1 13 . 1 1 22 22 THR CA C 22 61.221 61.221 60.227 0.994 18784 1426 1 13 . 1 1 22 22 THR CB C 22 71.220 71.220 71.558 -0.338 18784 1427 1 13 . 1 1 22 22 THR H H 22 8.833 8.833 9.073 -0.240 18784 1428 1 13 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.380 -0.689 18784 1429 1 13 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.513 -2.138 18784 1430 1 13 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.514 13.659 18784 1431 1 13 . 1 1 23 23 CYS H H 23 7.992 7.992 8.788 -0.796 18784 1432 1 13 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.665 -0.015 18784 1433 1 13 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.717 -1.138 18784 1434 1 13 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.955 0.141 18784 1435 1 13 . 1 1 24 24 ILE H H 24 8.831 8.831 9.325 -0.494 18784 1436 1 13 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 1437 1 13 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.998 0.647 18784 1438 1 13 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.458 1.884 18784 1439 1 13 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.167 2.200 18784 1440 1 13 . 1 1 26 26 GLY H H 26 7.882 7.882 8.220 -0.338 18784 1441 1 13 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.883 0.204 18784 1442 1 13 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.688 -1.629 18784 1443 1 13 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.243 -2.399 18784 1444 1 13 . 1 1 27 27 ASP H H 27 7.730 7.730 7.801 -0.071 18784 1445 1 13 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.419 -0.126 18784 1446 1 13 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.103 0.644 18784 1447 1 13 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.207 2.396 18784 1448 1 13 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.548 0.888 18784 1449 1 13 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.503 -0.797 18784 1450 1 13 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.238 0.556 18784 1451 1 13 . 1 1 29 29 TYR H H 29 7.422 7.422 7.889 -0.467 18784 1452 1 13 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.673 2.573 18784 1453 1 13 . 1 1 30 30 GLY H H 30 8.457 8.457 9.002 -0.545 18784 1454 1 13 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.101 -0.311 18784 1455 1 13 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.352 1.769 18784 1456 1 13 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.028 -0.525 18784 1457 1 13 . 1 1 31 31 ILE H H 31 8.636 8.636 8.293 0.343 18784 1458 1 13 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.311 -0.128 18784 1459 1 13 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.560 -2.912 18784 1460 1 13 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.458 16.467 18784 1461 1 13 . 1 1 32 32 CYS H H 32 8.187 8.187 8.634 -0.447 18784 1462 1 13 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.738 0.216 18784 1463 1 13 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.052 0.594 18784 1464 1 13 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.065 1.411 18784 1465 1 13 . 1 1 33 33 TYR H H 33 9.324 9.324 9.317 0.007 18784 1466 1 13 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.410 -0.017 18784 1467 1 13 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.403 0.600 18784 1468 1 13 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.357 0.361 18784 1469 1 13 . 1 1 34 34 ILE H H 34 8.078 8.078 8.602 -0.524 18784 1470 1 14 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.656 0.345 18784 1471 1 14 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.981 -4.569 18784 1472 1 14 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.340 15.281 18784 1473 1 14 . 1 1 3 3 CYS H H 3 7.856 7.856 8.350 -0.494 18784 1474 1 14 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.475 0.034 18784 1475 1 14 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.834 0.233 18784 1476 1 14 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.781 0.028 18784 1477 1 14 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.727 -1.404 18784 1478 1 14 . 1 1 5 5 GLY H H 5 7.965 7.965 8.150 -0.185 18784 1479 1 14 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.081 -0.385 18784 1480 1 14 . 1 1 6 6 GLU CA C 6 57.573 57.573 56.918 0.655 18784 1481 1 14 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.744 -1.257 18784 1482 1 14 . 1 1 6 6 GLU H H 6 8.365 8.365 8.246 0.119 18784 1483 1 14 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.958 0.698 18784 1484 1 14 . 1 1 7 7 GLY H H 7 9.294 9.294 8.690 0.604 18784 1485 1 14 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.505 0.038 18784 1486 1 14 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.434 0.425 18784 1487 1 14 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.956 -2.217 18784 1488 1 14 . 1 1 8 8 GLU H H 8 7.948 7.948 7.990 -0.042 18784 1489 1 14 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.690 0.110 18784 1490 1 14 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.009 0.884 18784 1491 1 14 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.396 5.394 18784 1492 1 14 . 1 1 9 9 GLN H H 9 8.483 8.483 8.510 -0.027 18784 1493 1 14 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.412 -0.264 18784 1494 1 14 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.395 -1.780 18784 1495 1 14 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.968 22.259 18784 1496 1 14 . 1 1 10 10 CYS H H 10 8.509 8.509 9.071 -0.562 18784 1497 1 14 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.726 0.507 18784 1498 1 14 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.096 0.456 18784 1499 1 14 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.698 -1.213 18784 1500 1 14 . 1 1 11 11 ASP H H 11 7.738 7.738 8.490 -0.752 18784 1501 1 14 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.153 -0.479 18784 1502 1 14 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.078 2.539 18784 1503 1 14 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.244 1.768 18784 1504 1 14 . 1 1 12 12 VAL H H 12 8.595 8.595 8.071 0.524 18784 1505 1 14 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.336 -0.074 18784 1506 1 14 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.227 1.440 18784 1507 1 14 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.258 -2.771 18784 1508 1 14 . 1 1 13 13 GLU H H 13 7.937 7.937 7.846 0.091 18784 1509 1 14 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.663 0.106 18784 1510 1 14 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.358 0.781 18784 1511 1 14 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.615 1.099 18784 1512 1 14 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.182 0.034 18784 1513 1 14 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.472 1.127 18784 1514 1 14 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.124 -1.013 18784 1515 1 14 . 1 1 15 15 ASN H H 15 8.602 8.602 8.722 -0.120 18784 1516 1 14 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.814 -0.658 18784 1517 1 14 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.611 1.433 18784 1518 1 14 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.419 -4.939 18784 1519 1 14 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.541 -0.131 18784 1520 1 14 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.149 -2.942 18784 1521 1 14 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.523 17.719 18784 1522 1 14 . 1 1 17 17 CYS H H 17 7.125 7.125 8.209 -1.084 18784 1523 1 14 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.551 0.210 18784 1524 1 14 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.409 -6.851 18784 1525 1 14 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.261 13.261 18784 1526 1 14 . 1 1 18 18 CYS H H 18 8.830 8.830 8.873 -0.043 18784 1527 1 14 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.641 0.267 18784 1528 1 14 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.649 0.040 18784 1529 1 14 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.758 0.191 18784 1530 1 14 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.383 0.399 18784 1531 1 14 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.525 0.368 18784 1532 1 14 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.687 1.875 18784 1533 1 14 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.046 -0.672 18784 1534 1 14 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.926 3.754 18784 1535 1 14 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.539 -3.648 18784 1536 1 14 . 1 1 21 21 LEU H H 21 8.825 8.825 8.363 0.462 18784 1537 1 14 . 1 1 22 22 THR HA H 22 4.507 4.507 4.658 -0.151 18784 1538 1 14 . 1 1 22 22 THR CA C 22 61.221 61.221 59.918 1.303 18784 1539 1 14 . 1 1 22 22 THR CB C 22 71.220 71.220 70.954 0.266 18784 1540 1 14 . 1 1 22 22 THR H H 22 8.833 8.833 9.077 -0.244 18784 1541 1 14 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.358 -0.667 18784 1542 1 14 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.575 -2.200 18784 1543 1 14 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.490 13.683 18784 1544 1 14 . 1 1 23 23 CYS H H 23 7.992 7.992 8.841 -0.849 18784 1545 1 14 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.664 -0.014 18784 1546 1 14 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.717 -1.138 18784 1547 1 14 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.963 0.133 18784 1548 1 14 . 1 1 24 24 ILE H H 24 8.831 8.831 9.322 -0.491 18784 1549 1 14 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.366 0.225 18784 1550 1 14 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.999 0.646 18784 1551 1 14 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.455 1.887 18784 1552 1 14 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.172 2.195 18784 1553 1 14 . 1 1 26 26 GLY H H 26 7.882 7.882 8.222 -0.340 18784 1554 1 14 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.882 0.205 18784 1555 1 14 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.698 -1.639 18784 1556 1 14 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.250 -2.406 18784 1557 1 14 . 1 1 27 27 ASP H H 27 7.730 7.730 7.800 -0.070 18784 1558 1 14 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.418 -0.125 18784 1559 1 14 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.105 0.642 18784 1560 1 14 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.206 2.397 18784 1561 1 14 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.655 0.781 18784 1562 1 14 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.475 -0.769 18784 1563 1 14 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.255 0.539 18784 1564 1 14 . 1 1 29 29 TYR H H 29 7.422 7.422 7.886 -0.464 18784 1565 1 14 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.678 2.568 18784 1566 1 14 . 1 1 30 30 GLY H H 30 8.457 8.457 9.021 -0.564 18784 1567 1 14 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.108 -0.318 18784 1568 1 14 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.356 1.765 18784 1569 1 14 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.046 -0.543 18784 1570 1 14 . 1 1 31 31 ILE H H 31 8.636 8.636 8.295 0.341 18784 1571 1 14 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.314 -0.131 18784 1572 1 14 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.576 -2.928 18784 1573 1 14 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.424 16.501 18784 1574 1 14 . 1 1 32 32 CYS H H 32 8.187 8.187 8.626 -0.439 18784 1575 1 14 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.729 0.225 18784 1576 1 14 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.008 0.638 18784 1577 1 14 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.101 1.375 18784 1578 1 14 . 1 1 33 33 TYR H H 33 9.324 9.324 9.308 0.016 18784 1579 1 14 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.363 0.030 18784 1580 1 14 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.771 0.232 18784 1581 1 14 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.201 0.517 18784 1582 1 14 . 1 1 34 34 ILE H H 34 8.078 8.078 8.620 -0.542 18784 1583 1 15 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.884 0.117 18784 1584 1 15 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.571 -3.159 18784 1585 1 15 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.382 15.239 18784 1586 1 15 . 1 1 3 3 CYS H H 3 7.856 7.856 8.188 -0.332 18784 1587 1 15 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.522 -0.013 18784 1588 1 15 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.972 0.095 18784 1589 1 15 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.885 -0.076 18784 1590 1 15 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.565 -1.242 18784 1591 1 15 . 1 1 5 5 GLY H H 5 7.965 7.965 7.911 0.054 18784 1592 1 15 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.051 -0.355 18784 1593 1 15 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.008 0.566 18784 1594 1 15 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.652 -1.165 18784 1595 1 15 . 1 1 6 6 GLU H H 6 8.365 8.365 8.262 0.102 18784 1596 1 15 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.893 0.763 18784 1597 1 15 . 1 1 7 7 GLY H H 7 9.294 9.294 8.645 0.649 18784 1598 1 15 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.484 0.059 18784 1599 1 15 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.941 0.918 18784 1600 1 15 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.713 -1.974 18784 1601 1 15 . 1 1 8 8 GLU H H 8 7.948 7.948 7.870 0.078 18784 1602 1 15 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.714 0.086 18784 1603 1 15 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.042 0.851 18784 1604 1 15 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.598 5.193 18784 1605 1 15 . 1 1 9 9 GLN H H 9 8.483 8.483 8.474 0.009 18784 1606 1 15 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.383 -0.235 18784 1607 1 15 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.462 -1.847 18784 1608 1 15 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.006 22.221 18784 1609 1 15 . 1 1 10 10 CYS H H 10 8.509 8.509 9.078 -0.569 18784 1610 1 15 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.736 0.497 18784 1611 1 15 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.395 0.157 18784 1612 1 15 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.836 -1.351 18784 1613 1 15 . 1 1 11 11 ASP H H 11 7.738 7.738 8.552 -0.814 18784 1614 1 15 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.114 -0.440 18784 1615 1 15 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.108 2.509 18784 1616 1 15 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.124 0.888 18784 1617 1 15 . 1 1 12 12 VAL H H 12 8.595 8.595 7.947 0.648 18784 1618 1 15 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.317 -0.055 18784 1619 1 15 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.495 1.171 18784 1620 1 15 . 1 1 13 13 GLU CB C 13 28.487 28.487 30.898 -2.411 18784 1621 1 15 . 1 1 13 13 GLU H H 13 7.937 7.937 7.822 0.115 18784 1622 1 15 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.655 0.114 18784 1623 1 15 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.376 0.763 18784 1624 1 15 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.661 1.053 18784 1625 1 15 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.213 0.003 18784 1626 1 15 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.365 1.234 18784 1627 1 15 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.191 -1.080 18784 1628 1 15 . 1 1 15 15 ASN H H 15 8.602 8.602 8.749 -0.147 18784 1629 1 15 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.809 -0.653 18784 1630 1 15 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.666 1.377 18784 1631 1 15 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.517 -5.035 18784 1632 1 15 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.475 -0.065 18784 1633 1 15 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.946 -2.739 18784 1634 1 15 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.137 17.105 18784 1635 1 15 . 1 1 17 17 CYS H H 17 7.125 7.125 8.183 -1.058 18784 1636 1 15 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.742 0.019 18784 1637 1 15 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.419 -5.861 18784 1638 1 15 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.890 13.632 18784 1639 1 15 . 1 1 18 18 CYS H H 18 8.830 8.830 8.798 0.032 18784 1640 1 15 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.744 0.164 18784 1641 1 15 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.954 0.735 18784 1642 1 15 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.412 0.537 18784 1643 1 15 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.386 0.396 18784 1644 1 15 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.550 0.343 18784 1645 1 15 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.631 1.931 18784 1646 1 15 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.054 -0.680 18784 1647 1 15 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.011 3.669 18784 1648 1 15 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.443 -3.552 18784 1649 1 15 . 1 1 21 21 LEU H H 21 8.825 8.825 8.443 0.382 18784 1650 1 15 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 1651 1 15 . 1 1 22 22 THR CA C 22 61.221 61.221 59.991 1.230 18784 1652 1 15 . 1 1 22 22 THR CB C 22 71.220 71.220 71.501 -0.281 18784 1653 1 15 . 1 1 22 22 THR H H 22 8.833 8.833 9.120 -0.287 18784 1654 1 15 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.318 -0.627 18784 1655 1 15 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.709 -2.334 18784 1656 1 15 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.641 13.532 18784 1657 1 15 . 1 1 23 23 CYS H H 23 7.992 7.992 8.822 -0.830 18784 1658 1 15 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 1659 1 15 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.717 -1.138 18784 1660 1 15 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.951 0.145 18784 1661 1 15 . 1 1 24 24 ILE H H 24 8.831 8.831 9.323 -0.492 18784 1662 1 15 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.372 0.219 18784 1663 1 15 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.994 0.651 18784 1664 1 15 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.456 1.886 18784 1665 1 15 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.110 2.257 18784 1666 1 15 . 1 1 26 26 GLY H H 26 7.882 7.882 8.161 -0.279 18784 1667 1 15 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.863 0.224 18784 1668 1 15 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.656 -1.597 18784 1669 1 15 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.459 -2.615 18784 1670 1 15 . 1 1 27 27 ASP H H 27 7.730 7.730 7.844 -0.114 18784 1671 1 15 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.460 -0.167 18784 1672 1 15 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.419 0.328 18784 1673 1 15 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.154 2.449 18784 1674 1 15 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.535 0.901 18784 1675 1 15 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.565 -0.859 18784 1676 1 15 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.178 0.616 18784 1677 1 15 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1678 1 15 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.678 2.568 18784 1679 1 15 . 1 1 30 30 GLY H H 30 8.457 8.457 8.973 -0.516 18784 1680 1 15 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.076 -0.286 18784 1681 1 15 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.347 1.774 18784 1682 1 15 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.996 -0.493 18784 1683 1 15 . 1 1 31 31 ILE H H 31 8.636 8.636 8.291 0.345 18784 1684 1 15 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.308 -0.125 18784 1685 1 15 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.491 -2.843 18784 1686 1 15 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.416 16.509 18784 1687 1 15 . 1 1 32 32 CYS H H 32 8.187 8.187 8.649 -0.462 18784 1688 1 15 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.740 0.214 18784 1689 1 15 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.971 0.675 18784 1690 1 15 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.139 1.337 18784 1691 1 15 . 1 1 33 33 TYR H H 33 9.324 9.324 9.317 0.007 18784 1692 1 15 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1693 1 15 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.804 0.199 18784 1694 1 15 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.173 0.545 18784 1695 1 15 . 1 1 34 34 ILE H H 34 8.078 8.078 8.631 -0.553 18784 1696 1 16 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.891 0.110 18784 1697 1 16 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.692 -3.280 18784 1698 1 16 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.192 15.429 18784 1699 1 16 . 1 1 3 3 CYS H H 3 7.856 7.856 8.174 -0.318 18784 1700 1 16 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.524 -0.015 18784 1701 1 16 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.949 0.118 18784 1702 1 16 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.884 -0.075 18784 1703 1 16 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.588 -1.265 18784 1704 1 16 . 1 1 5 5 GLY H H 5 7.965 7.965 7.923 0.042 18784 1705 1 16 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.051 -0.355 18784 1706 1 16 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.012 0.561 18784 1707 1 16 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.652 -1.165 18784 1708 1 16 . 1 1 6 6 GLU H H 6 8.365 8.365 8.262 0.103 18784 1709 1 16 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.893 0.763 18784 1710 1 16 . 1 1 7 7 GLY H H 7 9.294 9.294 8.645 0.649 18784 1711 1 16 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 1712 1 16 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.942 0.917 18784 1713 1 16 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.716 -1.977 18784 1714 1 16 . 1 1 8 8 GLU H H 8 7.948 7.948 7.875 0.073 18784 1715 1 16 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.711 0.089 18784 1716 1 16 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.042 0.851 18784 1717 1 16 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.599 5.192 18784 1718 1 16 . 1 1 9 9 GLN H H 9 8.483 8.483 8.475 0.008 18784 1719 1 16 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.382 -0.234 18784 1720 1 16 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.458 -1.843 18784 1721 1 16 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.984 22.243 18784 1722 1 16 . 1 1 10 10 CYS H H 10 8.509 8.509 9.078 -0.569 18784 1723 1 16 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.740 0.493 18784 1724 1 16 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.341 0.211 18784 1725 1 16 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.791 -1.306 18784 1726 1 16 . 1 1 11 11 ASP H H 11 7.738 7.738 8.543 -0.805 18784 1727 1 16 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.091 -0.417 18784 1728 1 16 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.420 2.197 18784 1729 1 16 . 1 1 12 12 VAL CB C 12 32.012 32.012 31.007 1.005 18784 1730 1 16 . 1 1 12 12 VAL H H 12 8.595 8.595 8.008 0.587 18784 1731 1 16 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.378 -0.116 18784 1732 1 16 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.705 0.962 18784 1733 1 16 . 1 1 13 13 GLU CB C 13 28.487 28.487 30.615 -2.128 18784 1734 1 16 . 1 1 13 13 GLU H H 13 7.937 7.937 7.857 0.080 18784 1735 1 16 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.682 0.087 18784 1736 1 16 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.438 0.701 18784 1737 1 16 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.675 1.039 18784 1738 1 16 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.214 0.002 18784 1739 1 16 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.351 1.248 18784 1740 1 16 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.185 -1.074 18784 1741 1 16 . 1 1 15 15 ASN H H 15 8.602 8.602 8.739 -0.137 18784 1742 1 16 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.806 -0.650 18784 1743 1 16 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.663 1.381 18784 1744 1 16 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.523 -5.042 18784 1745 1 16 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.476 -0.066 18784 1746 1 16 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.945 -2.738 18784 1747 1 16 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.144 17.098 18784 1748 1 16 . 1 1 17 17 CYS H H 17 7.125 7.125 8.183 -1.058 18784 1749 1 16 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.743 0.018 18784 1750 1 16 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.421 -5.863 18784 1751 1 16 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.892 13.630 18784 1752 1 16 . 1 1 18 18 CYS H H 18 8.830 8.830 8.802 0.028 18784 1753 1 16 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 1754 1 16 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.959 0.730 18784 1755 1 16 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.408 0.541 18784 1756 1 16 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 1757 1 16 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.551 0.342 18784 1758 1 16 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.631 1.931 18784 1759 1 16 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.051 -0.677 18784 1760 1 16 . 1 1 21 21 LEU CA C 21 56.680 56.680 53.012 3.668 18784 1761 1 16 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.365 -3.474 18784 1762 1 16 . 1 1 21 21 LEU H H 21 8.825 8.825 8.413 0.412 18784 1763 1 16 . 1 1 22 22 THR HA H 22 4.507 4.507 4.620 -0.113 18784 1764 1 16 . 1 1 22 22 THR CA C 22 61.221 61.221 60.286 0.935 18784 1765 1 16 . 1 1 22 22 THR CB C 22 71.220 71.220 71.591 -0.371 18784 1766 1 16 . 1 1 22 22 THR H H 22 8.833 8.833 9.078 -0.245 18784 1767 1 16 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.375 -0.684 18784 1768 1 16 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.510 -2.135 18784 1769 1 16 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.500 13.673 18784 1770 1 16 . 1 1 23 23 CYS H H 23 7.992 7.992 8.792 -0.800 18784 1771 1 16 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.670 -0.020 18784 1772 1 16 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.712 -1.133 18784 1773 1 16 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.947 0.150 18784 1774 1 16 . 1 1 24 24 ILE H H 24 8.831 8.831 9.320 -0.489 18784 1775 1 16 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.372 0.220 18784 1776 1 16 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.995 0.650 18784 1777 1 16 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.454 1.888 18784 1778 1 16 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.186 2.181 18784 1779 1 16 . 1 1 26 26 GLY H H 26 7.882 7.882 8.225 -0.343 18784 1780 1 16 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.885 0.202 18784 1781 1 16 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.680 -1.621 18784 1782 1 16 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.222 -2.378 18784 1783 1 16 . 1 1 27 27 ASP H H 27 7.730 7.730 7.802 -0.072 18784 1784 1 16 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.424 -0.131 18784 1785 1 16 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.097 0.650 18784 1786 1 16 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.211 2.392 18784 1787 1 16 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.531 0.905 18784 1788 1 16 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.591 -0.885 18784 1789 1 16 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.155 0.639 18784 1790 1 16 . 1 1 29 29 TYR H H 29 7.422 7.422 7.904 -0.482 18784 1791 1 16 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.679 2.567 18784 1792 1 16 . 1 1 30 30 GLY H H 30 8.457 8.457 8.977 -0.520 18784 1793 1 16 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.074 -0.284 18784 1794 1 16 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.348 1.773 18784 1795 1 16 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.996 -0.493 18784 1796 1 16 . 1 1 31 31 ILE H H 31 8.636 8.636 8.289 0.347 18784 1797 1 16 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.309 -0.126 18784 1798 1 16 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.488 -2.840 18784 1799 1 16 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.419 16.506 18784 1800 1 16 . 1 1 32 32 CYS H H 32 8.187 8.187 8.650 -0.463 18784 1801 1 16 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.740 0.214 18784 1802 1 16 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.975 0.671 18784 1803 1 16 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.140 1.336 18784 1804 1 16 . 1 1 33 33 TYR H H 33 9.324 9.324 9.314 0.010 18784 1805 1 16 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.361 0.032 18784 1806 1 16 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.798 0.205 18784 1807 1 16 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.177 0.541 18784 1808 1 16 . 1 1 34 34 ILE H H 34 8.078 8.078 8.631 -0.553 18784 1809 1 17 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.619 0.382 18784 1810 1 17 . 1 1 3 3 CYS CA C 3 52.412 52.412 57.334 -4.922 18784 1811 1 17 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.247 15.374 18784 1812 1 17 . 1 1 3 3 CYS H H 3 7.856 7.856 8.342 -0.486 18784 1813 1 17 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.472 0.037 18784 1814 1 17 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.851 0.216 18784 1815 1 17 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.845 -0.036 18784 1816 1 17 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.521 -1.198 18784 1817 1 17 . 1 1 5 5 GLY H H 5 7.965 7.965 7.908 0.057 18784 1818 1 17 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.069 -0.373 18784 1819 1 17 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.005 0.568 18784 1820 1 17 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.695 -1.208 18784 1821 1 17 . 1 1 6 6 GLU H H 6 8.365 8.365 8.258 0.107 18784 1822 1 17 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.884 0.772 18784 1823 1 17 . 1 1 7 7 GLY H H 7 9.294 9.294 8.638 0.656 18784 1824 1 17 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 1825 1 17 . 1 1 8 8 GLU CA C 8 54.859 54.859 53.922 0.937 18784 1826 1 17 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.735 -1.996 18784 1827 1 17 . 1 1 8 8 GLU H H 8 7.948 7.948 7.927 0.021 18784 1828 1 17 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 1829 1 17 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.952 0.941 18784 1830 1 17 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.521 5.270 18784 1831 1 17 . 1 1 9 9 GLN H H 9 8.483 8.483 8.483 0.000 18784 1832 1 17 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.418 -0.270 18784 1833 1 17 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.407 -1.792 18784 1834 1 17 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.917 22.310 18784 1835 1 17 . 1 1 10 10 CYS H H 10 8.509 8.509 9.070 -0.561 18784 1836 1 17 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.730 0.503 18784 1837 1 17 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.101 0.451 18784 1838 1 17 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.708 -1.223 18784 1839 1 17 . 1 1 11 11 ASP H H 11 7.738 7.738 8.488 -0.750 18784 1840 1 17 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.150 -0.476 18784 1841 1 17 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.121 2.496 18784 1842 1 17 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.310 1.702 18784 1843 1 17 . 1 1 12 12 VAL H H 12 8.595 8.595 8.061 0.534 18784 1844 1 17 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.325 -0.063 18784 1845 1 17 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.276 1.391 18784 1846 1 17 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.198 -2.711 18784 1847 1 17 . 1 1 13 13 GLU H H 13 7.937 7.937 7.838 0.099 18784 1848 1 17 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.663 0.106 18784 1849 1 17 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.347 0.792 18784 1850 1 17 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.603 1.111 18784 1851 1 17 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.184 0.032 18784 1852 1 17 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.464 1.135 18784 1853 1 17 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.124 -1.013 18784 1854 1 17 . 1 1 15 15 ASN H H 15 8.602 8.602 8.721 -0.119 18784 1855 1 17 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.813 -0.657 18784 1856 1 17 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.618 1.425 18784 1857 1 17 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.405 -4.924 18784 1858 1 17 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.537 -0.127 18784 1859 1 17 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.172 -2.965 18784 1860 1 17 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.507 17.735 18784 1861 1 17 . 1 1 17 17 CYS H H 17 7.125 7.125 8.212 -1.087 18784 1862 1 17 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.550 0.211 18784 1863 1 17 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.417 -6.859 18784 1864 1 17 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.264 13.258 18784 1865 1 17 . 1 1 18 18 CYS H H 18 8.830 8.830 8.870 -0.040 18784 1866 1 17 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.643 0.265 18784 1867 1 17 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.643 0.046 18784 1868 1 17 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.756 0.193 18784 1869 1 17 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.384 0.398 18784 1870 1 17 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.524 0.369 18784 1871 1 17 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.686 1.876 18784 1872 1 17 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.070 -0.696 18784 1873 1 17 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.975 3.705 18784 1874 1 17 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.346 -3.455 18784 1875 1 17 . 1 1 21 21 LEU H H 21 8.825 8.825 8.368 0.457 18784 1876 1 17 . 1 1 22 22 THR HA H 22 4.507 4.507 4.649 -0.142 18784 1877 1 17 . 1 1 22 22 THR CA C 22 61.221 61.221 59.958 1.263 18784 1878 1 17 . 1 1 22 22 THR CB C 22 71.220 71.220 71.451 -0.231 18784 1879 1 17 . 1 1 22 22 THR H H 22 8.833 8.833 9.119 -0.286 18784 1880 1 17 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.325 -0.634 18784 1881 1 17 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.705 -2.330 18784 1882 1 17 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.656 13.517 18784 1883 1 17 . 1 1 23 23 CYS H H 23 7.992 7.992 8.816 -0.824 18784 1884 1 17 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.664 -0.014 18784 1885 1 17 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.721 -1.142 18784 1886 1 17 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.960 0.136 18784 1887 1 17 . 1 1 24 24 ILE H H 24 8.831 8.831 9.324 -0.493 18784 1888 1 17 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 1889 1 17 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.994 0.651 18784 1890 1 17 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.458 1.884 18784 1891 1 17 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.098 2.269 18784 1892 1 17 . 1 1 26 26 GLY H H 26 7.882 7.882 8.158 -0.276 18784 1893 1 17 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.861 0.226 18784 1894 1 17 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.659 -1.600 18784 1895 1 17 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.478 -2.634 18784 1896 1 17 . 1 1 27 27 ASP H H 27 7.730 7.730 7.843 -0.113 18784 1897 1 17 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.456 -0.163 18784 1898 1 17 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.424 0.323 18784 1899 1 17 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.150 2.453 18784 1900 1 17 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.645 0.791 18784 1901 1 17 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.507 -0.801 18784 1902 1 17 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.242 0.552 18784 1903 1 17 . 1 1 29 29 TYR H H 29 7.422 7.422 7.891 -0.469 18784 1904 1 17 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.673 2.573 18784 1905 1 17 . 1 1 30 30 GLY H H 30 8.457 8.457 8.994 -0.537 18784 1906 1 17 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.133 -0.343 18784 1907 1 17 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.334 1.787 18784 1908 1 17 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.038 -0.535 18784 1909 1 17 . 1 1 31 31 ILE H H 31 8.636 8.636 8.294 0.342 18784 1910 1 17 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.313 -0.130 18784 1911 1 17 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.584 -2.936 18784 1912 1 17 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.435 16.490 18784 1913 1 17 . 1 1 32 32 CYS H H 32 8.187 8.187 8.596 -0.409 18784 1914 1 17 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.729 0.225 18784 1915 1 17 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.015 0.631 18784 1916 1 17 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.092 1.385 18784 1917 1 17 . 1 1 33 33 TYR H H 33 9.324 9.324 9.310 0.014 18784 1918 1 17 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.363 0.030 18784 1919 1 17 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.777 0.226 18784 1920 1 17 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.197 0.521 18784 1921 1 17 . 1 1 34 34 ILE H H 34 8.078 8.078 8.620 -0.542 18784 1922 1 18 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.632 0.369 18784 1923 1 18 . 1 1 3 3 CYS CA C 3 52.412 52.412 57.033 -4.621 18784 1924 1 18 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.277 15.344 18784 1925 1 18 . 1 1 3 3 CYS H H 3 7.856 7.856 8.343 -0.487 18784 1926 1 18 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.485 0.024 18784 1927 1 18 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.883 0.184 18784 1928 1 18 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.932 -0.123 18784 1929 1 18 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.633 -1.310 18784 1930 1 18 . 1 1 5 5 GLY H H 5 7.965 7.965 8.139 -0.174 18784 1931 1 18 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.036 -0.340 18784 1932 1 18 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.329 0.244 18784 1933 1 18 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.521 -1.034 18784 1934 1 18 . 1 1 6 6 GLU H H 6 8.365 8.365 8.316 0.049 18784 1935 1 18 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.653 1.003 18784 1936 1 18 . 1 1 7 7 GLY H H 7 9.294 9.294 8.668 0.626 18784 1937 1 18 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.450 0.093 18784 1938 1 18 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.528 0.331 18784 1939 1 18 . 1 1 8 8 GLU CB C 8 30.739 30.739 31.557 -0.818 18784 1940 1 18 . 1 1 8 8 GLU H H 8 7.948 7.948 7.567 0.381 18784 1941 1 18 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.647 0.153 18784 1942 1 18 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.046 0.847 18784 1943 1 18 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.820 4.971 18784 1944 1 18 . 1 1 9 9 GLN H H 9 8.483 8.483 8.472 0.011 18784 1945 1 18 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.414 -0.266 18784 1946 1 18 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.518 -1.903 18784 1947 1 18 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.111 22.116 18784 1948 1 18 . 1 1 10 10 CYS H H 10 8.509 8.509 9.085 -0.576 18784 1949 1 18 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.742 0.491 18784 1950 1 18 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.095 0.457 18784 1951 1 18 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.733 -1.248 18784 1952 1 18 . 1 1 11 11 ASP H H 11 7.738 7.738 8.497 -0.759 18784 1953 1 18 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.148 -0.474 18784 1954 1 18 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.141 2.476 18784 1955 1 18 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.344 1.668 18784 1956 1 18 . 1 1 12 12 VAL H H 12 8.595 8.595 8.068 0.527 18784 1957 1 18 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.316 -0.054 18784 1958 1 18 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.315 1.352 18784 1959 1 18 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.152 -2.665 18784 1960 1 18 . 1 1 13 13 GLU H H 13 7.937 7.937 7.823 0.114 18784 1961 1 18 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.661 0.108 18784 1962 1 18 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.359 0.780 18784 1963 1 18 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.606 1.108 18784 1964 1 18 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.187 0.029 18784 1965 1 18 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.449 1.151 18784 1966 1 18 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.133 -1.022 18784 1967 1 18 . 1 1 15 15 ASN H H 15 8.602 8.602 8.703 -0.101 18784 1968 1 18 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.811 -0.655 18784 1969 1 18 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.639 1.404 18784 1970 1 18 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.372 -4.891 18784 1971 1 18 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.525 -0.115 18784 1972 1 18 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.213 -3.006 18784 1973 1 18 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.487 17.755 18784 1974 1 18 . 1 1 17 17 CYS H H 17 7.125 7.125 8.215 -1.090 18784 1975 1 18 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.560 0.201 18784 1976 1 18 . 1 1 18 18 CYS CA C 18 52.558 52.558 59.397 -6.839 18784 1977 1 18 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.312 13.210 18784 1978 1 18 . 1 1 18 18 CYS H H 18 8.830 8.830 8.877 -0.047 18784 1979 1 18 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.658 0.250 18784 1980 1 18 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.413 0.276 18784 1981 1 18 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.690 0.259 18784 1982 1 18 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.343 0.439 18784 1983 1 18 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.387 0.506 18784 1984 1 18 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.571 1.991 18784 1985 1 18 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.053 -0.679 18784 1986 1 18 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.997 3.683 18784 1987 1 18 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.024 -3.133 18784 1988 1 18 . 1 1 21 21 LEU H H 21 8.825 8.825 8.401 0.424 18784 1989 1 18 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 1990 1 18 . 1 1 22 22 THR CA C 22 61.221 61.221 59.963 1.258 18784 1991 1 18 . 1 1 22 22 THR CB C 22 71.220 71.220 71.466 -0.246 18784 1992 1 18 . 1 1 22 22 THR H H 22 8.833 8.833 9.122 -0.289 18784 1993 1 18 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.303 -0.612 18784 1994 1 18 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.743 -2.368 18784 1995 1 18 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.637 13.536 18784 1996 1 18 . 1 1 23 23 CYS H H 23 7.992 7.992 8.817 -0.825 18784 1997 1 18 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.658 -0.008 18784 1998 1 18 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.750 -1.171 18784 1999 1 18 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.967 0.129 18784 2000 1 18 . 1 1 24 24 ILE H H 24 8.831 8.831 9.329 -0.498 18784 2001 1 18 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.368 0.223 18784 2002 1 18 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.997 0.648 18784 2003 1 18 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.465 1.877 18784 2004 1 18 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.103 2.264 18784 2005 1 18 . 1 1 26 26 GLY H H 26 7.882 7.882 8.167 -0.285 18784 2006 1 18 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.900 0.187 18784 2007 1 18 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.103 -1.044 18784 2008 1 18 . 1 1 27 27 ASP CB C 27 38.844 38.844 40.809 -1.965 18784 2009 1 18 . 1 1 27 27 ASP H H 27 7.730 7.730 7.857 -0.127 18784 2010 1 18 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.455 -0.162 18784 2011 1 18 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.286 0.461 18784 2012 1 18 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.398 2.205 18784 2013 1 18 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.632 0.804 18784 2014 1 18 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.620 -0.914 18784 2015 1 18 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.144 0.650 18784 2016 1 18 . 1 1 29 29 TYR H H 29 7.422 7.422 7.614 -0.192 18784 2017 1 18 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.672 2.574 18784 2018 1 18 . 1 1 30 30 GLY H H 30 8.457 8.457 9.012 -0.555 18784 2019 1 18 . 1 1 31 31 ILE HA H 31 4.790 4.790 4.976 -0.186 18784 2020 1 18 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.403 1.718 18784 2021 1 18 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.975 -0.472 18784 2022 1 18 . 1 1 31 31 ILE H H 31 8.636 8.636 8.305 0.331 18784 2023 1 18 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.303 -0.120 18784 2024 1 18 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.623 -2.975 18784 2025 1 18 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.439 16.486 18784 2026 1 18 . 1 1 32 32 CYS H H 32 8.187 8.187 8.620 -0.433 18784 2027 1 18 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.726 0.228 18784 2028 1 18 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.028 0.618 18784 2029 1 18 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.055 1.421 18784 2030 1 18 . 1 1 33 33 TYR H H 33 9.324 9.324 9.319 0.005 18784 2031 1 18 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.357 0.036 18784 2032 1 18 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.828 0.175 18784 2033 1 18 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.167 0.551 18784 2034 1 18 . 1 1 34 34 ILE H H 34 8.078 8.078 8.625 -0.547 18784 2035 1 19 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.886 0.115 18784 2036 1 19 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.703 -3.291 18784 2037 1 19 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.044 15.576 18784 2038 1 19 . 1 1 3 3 CYS H H 3 7.856 7.856 8.174 -0.318 18784 2039 1 19 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.468 0.041 18784 2040 1 19 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.804 0.263 18784 2041 1 19 . 1 1 4 4 PRO CB C 4 32.809 32.809 33.066 -0.257 18784 2042 1 19 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.628 -1.305 18784 2043 1 19 . 1 1 5 5 GLY H H 5 7.965 7.965 8.137 -0.172 18784 2044 1 19 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.054 -0.358 18784 2045 1 19 . 1 1 6 6 GLU CA C 6 57.573 57.573 56.987 0.586 18784 2046 1 19 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.663 -1.176 18784 2047 1 19 . 1 1 6 6 GLU H H 6 8.365 8.365 8.257 0.108 18784 2048 1 19 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.992 0.664 18784 2049 1 19 . 1 1 7 7 GLY H H 7 9.294 9.294 8.612 0.682 18784 2050 1 19 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.524 0.019 18784 2051 1 19 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.121 0.738 18784 2052 1 19 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.554 -1.815 18784 2053 1 19 . 1 1 8 8 GLU H H 8 7.948 7.948 7.909 0.039 18784 2054 1 19 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.726 0.074 18784 2055 1 19 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.789 1.104 18784 2056 1 19 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.587 5.204 18784 2057 1 19 . 1 1 9 9 GLN H H 9 8.483 8.483 8.497 -0.014 18784 2058 1 19 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.385 -0.237 18784 2059 1 19 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.435 -1.820 18784 2060 1 19 . 1 1 10 10 CYS CB C 10 51.227 51.227 28.947 22.280 18784 2061 1 19 . 1 1 10 10 CYS H H 10 8.509 8.509 9.072 -0.563 18784 2062 1 19 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.727 0.506 18784 2063 1 19 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.129 0.423 18784 2064 1 19 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.773 -1.288 18784 2065 1 19 . 1 1 11 11 ASP H H 11 7.738 7.738 8.582 -0.844 18784 2066 1 19 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.154 -0.480 18784 2067 1 19 . 1 1 12 12 VAL CA C 12 65.617 65.617 62.914 2.703 18784 2068 1 19 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.577 1.435 18784 2069 1 19 . 1 1 12 12 VAL H H 12 8.595 8.595 8.005 0.590 18784 2070 1 19 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.310 -0.048 18784 2071 1 19 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.334 1.333 18784 2072 1 19 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.106 -2.619 18784 2073 1 19 . 1 1 13 13 GLU H H 13 7.937 7.937 7.818 0.119 18784 2074 1 19 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.656 0.113 18784 2075 1 19 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.371 0.768 18784 2076 1 19 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.661 1.053 18784 2077 1 19 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.211 0.005 18784 2078 1 19 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.371 1.228 18784 2079 1 19 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.191 -1.080 18784 2080 1 19 . 1 1 15 15 ASN H H 15 8.602 8.602 8.758 -0.156 18784 2081 1 19 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.808 -0.652 18784 2082 1 19 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.666 1.377 18784 2083 1 19 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.515 -5.034 18784 2084 1 19 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.478 -0.068 18784 2085 1 19 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.936 -2.729 18784 2086 1 19 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.160 17.082 18784 2087 1 19 . 1 1 17 17 CYS H H 17 7.125 7.125 8.181 -1.056 18784 2088 1 19 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.742 0.019 18784 2089 1 19 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.423 -5.865 18784 2090 1 19 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.890 13.632 18784 2091 1 19 . 1 1 18 18 CYS H H 18 8.830 8.830 8.800 0.030 18784 2092 1 19 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 2093 1 19 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.959 0.730 18784 2094 1 19 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.409 0.540 18784 2095 1 19 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 2096 1 19 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.553 0.340 18784 2097 1 19 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.630 1.932 18784 2098 1 19 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.005 -0.631 18784 2099 1 19 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.973 3.707 18784 2100 1 19 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.596 -3.705 18784 2101 1 19 . 1 1 21 21 LEU H H 21 8.825 8.825 8.431 0.394 18784 2102 1 19 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 2103 1 19 . 1 1 22 22 THR CA C 22 61.221 61.221 59.963 1.258 18784 2104 1 19 . 1 1 22 22 THR CB C 22 71.220 71.220 70.975 0.245 18784 2105 1 19 . 1 1 22 22 THR H H 22 8.833 8.833 9.069 -0.236 18784 2106 1 19 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.341 -0.650 18784 2107 1 19 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.593 -2.218 18784 2108 1 19 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.465 13.708 18784 2109 1 19 . 1 1 23 23 CYS H H 23 7.992 7.992 8.848 -0.856 18784 2110 1 19 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 2111 1 19 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.715 -1.136 18784 2112 1 19 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.953 0.143 18784 2113 1 19 . 1 1 24 24 ILE H H 24 8.831 8.831 9.322 -0.491 18784 2114 1 19 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.371 0.220 18784 2115 1 19 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.998 0.647 18784 2116 1 19 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.455 1.887 18784 2117 1 19 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.181 2.186 18784 2118 1 19 . 1 1 26 26 GLY H H 26 7.882 7.882 8.223 -0.341 18784 2119 1 19 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.885 0.202 18784 2120 1 19 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.681 -1.622 18784 2121 1 19 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.224 -2.380 18784 2122 1 19 . 1 1 27 27 ASP H H 27 7.730 7.730 7.802 -0.072 18784 2123 1 19 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.422 -0.129 18784 2124 1 19 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.097 0.650 18784 2125 1 19 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.208 2.395 18784 2126 1 19 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.535 0.901 18784 2127 1 19 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.570 -0.864 18784 2128 1 19 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.173 0.621 18784 2129 1 19 . 1 1 29 29 TYR H H 29 7.422 7.422 7.903 -0.481 18784 2130 1 19 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.682 2.564 18784 2131 1 19 . 1 1 30 30 GLY H H 30 8.457 8.457 8.974 -0.517 18784 2132 1 19 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.108 -0.318 18784 2133 1 19 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.333 1.788 18784 2134 1 19 . 1 1 31 31 ILE CB C 31 41.503 41.503 41.999 -0.496 18784 2135 1 19 . 1 1 31 31 ILE H H 31 8.636 8.636 8.287 0.349 18784 2136 1 19 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.302 -0.119 18784 2137 1 19 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.475 -2.827 18784 2138 1 19 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.424 16.502 18784 2139 1 19 . 1 1 32 32 CYS H H 32 8.187 8.187 8.620 -0.433 18784 2140 1 19 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.743 0.211 18784 2141 1 19 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.035 0.611 18784 2142 1 19 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.076 1.400 18784 2143 1 19 . 1 1 33 33 TYR H H 33 9.324 9.324 9.323 0.001 18784 2144 1 19 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.410 -0.017 18784 2145 1 19 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.421 0.582 18784 2146 1 19 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.342 0.376 18784 2147 1 19 . 1 1 34 34 ILE H H 34 8.078 8.078 8.610 -0.532 18784 2148 1 20 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.870 0.131 18784 2149 1 20 . 1 1 3 3 CYS CA C 3 52.412 52.412 55.812 -3.400 18784 2150 1 20 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.082 15.539 18784 2151 1 20 . 1 1 3 3 CYS H H 3 7.856 7.856 8.173 -0.317 18784 2152 1 20 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.438 0.071 18784 2153 1 20 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.828 0.239 18784 2154 1 20 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.846 -0.037 18784 2155 1 20 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.577 -1.254 18784 2156 1 20 . 1 1 5 5 GLY H H 5 7.965 7.965 8.193 -0.228 18784 2157 1 20 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.054 -0.358 18784 2158 1 20 . 1 1 6 6 GLU CA C 6 57.573 57.573 56.999 0.574 18784 2159 1 20 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.657 -1.170 18784 2160 1 20 . 1 1 6 6 GLU H H 6 8.365 8.365 8.261 0.104 18784 2161 1 20 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.955 0.701 18784 2162 1 20 . 1 1 7 7 GLY H H 7 9.294 9.294 8.697 0.597 18784 2163 1 20 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.513 0.030 18784 2164 1 20 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.428 0.431 18784 2165 1 20 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.958 -2.219 18784 2166 1 20 . 1 1 8 8 GLU H H 8 7.948 7.948 7.893 0.055 18784 2167 1 20 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.690 0.110 18784 2168 1 20 . 1 1 9 9 GLN CA C 9 56.893 56.893 56.042 0.851 18784 2169 1 20 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.472 5.319 18784 2170 1 20 . 1 1 9 9 GLN H H 9 8.483 8.483 8.502 -0.019 18784 2171 1 20 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.378 -0.230 18784 2172 1 20 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.442 -1.827 18784 2173 1 20 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.061 22.166 18784 2174 1 20 . 1 1 10 10 CYS H H 10 8.509 8.509 9.077 -0.568 18784 2175 1 20 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.729 0.504 18784 2176 1 20 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.115 0.437 18784 2177 1 20 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.700 -1.215 18784 2178 1 20 . 1 1 11 11 ASP H H 11 7.738 7.738 8.576 -0.838 18784 2179 1 20 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.155 -0.481 18784 2180 1 20 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.099 2.518 18784 2181 1 20 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.377 1.635 18784 2182 1 20 . 1 1 12 12 VAL H H 12 8.595 8.595 8.070 0.525 18784 2183 1 20 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.317 -0.055 18784 2184 1 20 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.304 1.363 18784 2185 1 20 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.140 -2.652 18784 2186 1 20 . 1 1 13 13 GLU H H 13 7.937 7.937 7.821 0.116 18784 2187 1 20 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.657 0.112 18784 2188 1 20 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.373 0.766 18784 2189 1 20 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.665 1.049 18784 2190 1 20 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.210 0.006 18784 2191 1 20 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.369 1.230 18784 2192 1 20 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.184 -1.073 18784 2193 1 20 . 1 1 15 15 ASN H H 15 8.602 8.602 8.753 -0.151 18784 2194 1 20 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.807 -0.651 18784 2195 1 20 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.661 1.382 18784 2196 1 20 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.523 -5.042 18784 2197 1 20 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.481 -0.071 18784 2198 1 20 . 1 1 17 17 CYS CA C 17 56.207 56.207 58.928 -2.721 18784 2199 1 20 . 1 1 17 17 CYS CB C 17 43.242 43.242 26.177 17.065 18784 2200 1 20 . 1 1 17 17 CYS H H 17 7.125 7.125 8.180 -1.055 18784 2201 1 20 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.744 0.017 18784 2202 1 20 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.419 -5.862 18784 2203 1 20 . 1 1 18 18 CYS CB C 18 38.522 38.522 24.892 13.630 18784 2204 1 20 . 1 1 18 18 CYS H H 18 8.830 8.830 8.804 0.026 18784 2205 1 20 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.743 0.165 18784 2206 1 20 . 1 1 19 19 PRO CA C 19 61.689 61.689 60.957 0.732 18784 2207 1 20 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.409 0.540 18784 2208 1 20 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.385 0.397 18784 2209 1 20 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.551 0.342 18784 2210 1 20 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.631 1.931 18784 2211 1 20 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.038 -0.664 18784 2212 1 20 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.966 3.714 18784 2213 1 20 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.621 -3.730 18784 2214 1 20 . 1 1 21 21 LEU H H 21 8.825 8.825 8.427 0.398 18784 2215 1 20 . 1 1 22 22 THR HA H 22 4.507 4.507 4.650 -0.143 18784 2216 1 20 . 1 1 22 22 THR CA C 22 61.221 61.221 59.963 1.258 18784 2217 1 20 . 1 1 22 22 THR CB C 22 71.220 71.220 70.975 0.245 18784 2218 1 20 . 1 1 22 22 THR H H 22 8.833 8.833 9.074 -0.241 18784 2219 1 20 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.347 -0.656 18784 2220 1 20 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.586 -2.211 18784 2221 1 20 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.474 13.699 18784 2222 1 20 . 1 1 23 23 CYS H H 23 7.992 7.992 8.847 -0.855 18784 2223 1 20 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.669 -0.019 18784 2224 1 20 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.710 -1.131 18784 2225 1 20 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.955 0.141 18784 2226 1 20 . 1 1 24 24 ILE H H 24 8.831 8.831 9.321 -0.490 18784 2227 1 20 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.370 0.221 18784 2228 1 20 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.998 0.647 18784 2229 1 20 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.452 1.890 18784 2230 1 20 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.181 2.186 18784 2231 1 20 . 1 1 26 26 GLY H H 26 7.882 7.882 8.224 -0.342 18784 2232 1 20 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.885 0.202 18784 2233 1 20 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.689 -1.630 18784 2234 1 20 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.229 -2.385 18784 2235 1 20 . 1 1 27 27 ASP H H 27 7.730 7.730 7.802 -0.072 18784 2236 1 20 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.422 -0.129 18784 2237 1 20 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.098 0.649 18784 2238 1 20 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.209 2.394 18784 2239 1 20 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.541 0.895 18784 2240 1 20 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.550 -0.843 18784 2241 1 20 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.186 0.608 18784 2242 1 20 . 1 1 29 29 TYR H H 29 7.422 7.422 7.899 -0.477 18784 2243 1 20 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.679 2.567 18784 2244 1 20 . 1 1 30 30 GLY H H 30 8.457 8.457 9.005 -0.548 18784 2245 1 20 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.064 -0.274 18784 2246 1 20 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.361 1.760 18784 2247 1 20 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.001 -0.498 18784 2248 1 20 . 1 1 31 31 ILE H H 31 8.636 8.636 8.291 0.345 18784 2249 1 20 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.307 -0.124 18784 2250 1 20 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.496 -2.848 18784 2251 1 20 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.417 16.508 18784 2252 1 20 . 1 1 32 32 CYS H H 32 8.187 8.187 8.656 -0.469 18784 2253 1 20 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.739 0.215 18784 2254 1 20 . 1 1 33 33 TYR CA C 33 57.646 57.646 56.977 0.668 18784 2255 1 20 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.136 1.340 18784 2256 1 20 . 1 1 33 33 TYR H H 33 9.324 9.324 9.318 0.006 18784 2257 1 20 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.362 0.031 18784 2258 1 20 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.792 0.211 18784 2259 1 20 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.182 0.536 18784 2260 1 20 . 1 1 34 34 ILE H H 34 8.078 8.078 8.629 -0.551 18784 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 18784 2 1 1 "Average Difference" HA 36 0.391 0.062 0.392 18784 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18784 4 1 1 "Average Difference" CA 32 2.125 0.053 2.158 18784 5 1 1 "Average Difference" CB 28 7.985 -3.417 7.350 18784 6 1 1 "Average Difference" HN 25 0.474 0.188 0.444 18784 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18784 8 1 2 "Average Difference" HA 36 0.389 0.061 0.390 18784 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18784 10 1 2 "Average Difference" CA 32 2.121 0.052 2.155 18784 11 1 2 "Average Difference" CB 28 7.969 -3.406 7.337 18784 12 1 2 "Average Difference" HN 25 0.472 0.190 0.442 18784 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18784 14 1 3 "Average Difference" HA 36 0.396 0.051 0.398 18784 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18784 16 1 3 "Average Difference" CA 32 2.139 0.076 2.172 18784 17 1 3 "Average Difference" CB 28 7.963 -3.470 7.299 18784 18 1 3 "Average Difference" HN 25 0.482 0.191 0.452 18784 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18784 20 1 4 "Average Difference" HA 36 0.394 0.050 0.397 18784 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18784 22 1 4 "Average Difference" CA 32 2.137 0.087 2.169 18784 23 1 4 "Average Difference" CB 28 7.946 -3.457 7.286 18784 24 1 4 "Average Difference" HN 25 0.483 0.193 0.452 18784 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18784 26 1 5 "Average Difference" HA 36 0.390 0.061 0.391 18784 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18784 28 1 5 "Average Difference" CA 32 2.129 0.027 2.163 18784 29 1 5 "Average Difference" CB 28 8.015 -3.459 7.363 18784 30 1 5 "Average Difference" HN 25 0.476 0.192 0.445 18784 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18784 32 1 6 "Average Difference" HA 36 0.388 0.071 0.387 18784 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18784 34 1 6 "Average Difference" CA 32 1.949 -0.038 1.980 18784 35 1 6 "Average Difference" CB 28 7.957 -3.394 7.329 18784 36 1 6 "Average Difference" HN 25 0.467 0.179 0.440 18784 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18784 38 1 7 "Average Difference" HA 36 0.390 0.071 0.389 18784 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18784 40 1 7 "Average Difference" CA 32 1.950 -0.057 1.980 18784 41 1 7 "Average Difference" CB 28 7.966 -3.431 7.321 18784 42 1 7 "Average Difference" HN 25 0.465 0.183 0.436 18784 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18784 44 1 8 "Average Difference" HA 36 0.394 0.050 0.397 18784 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18784 46 1 8 "Average Difference" CA 32 2.134 0.082 2.166 18784 47 1 8 "Average Difference" CB 28 7.943 -3.458 7.282 18784 48 1 8 "Average Difference" HN 25 0.483 0.194 0.452 18784 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18784 50 1 9 "Average Difference" HA 36 0.390 0.072 0.388 18784 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18784 52 1 9 "Average Difference" CA 32 1.933 -0.031 1.963 18784 53 1 9 "Average Difference" CB 28 7.967 -3.397 7.339 18784 54 1 9 "Average Difference" HN 25 0.462 0.176 0.436 18784 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18784 56 1 10 "Average Difference" HA 36 0.387 0.070 0.386 18784 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18784 58 1 10 "Average Difference" CA 32 1.946 -0.035 1.977 18784 59 1 10 "Average Difference" CB 28 7.967 -3.410 7.332 18784 60 1 10 "Average Difference" HN 25 0.467 0.180 0.440 18784 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18784 62 1 11 "Average Difference" HA 36 0.388 0.069 0.388 18784 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18784 64 1 11 "Average Difference" CA 32 1.922 -0.039 1.952 18784 65 1 11 "Average Difference" CB 28 7.914 -3.377 7.289 18784 66 1 11 "Average Difference" HN 25 0.467 0.181 0.439 18784 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18784 68 1 12 "Average Difference" HA 36 0.392 0.068 0.391 18784 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18784 70 1 12 "Average Difference" CA 32 1.980 -0.027 2.012 18784 71 1 12 "Average Difference" CB 28 7.929 -3.394 7.298 18784 72 1 12 "Average Difference" HN 25 0.473 0.187 0.443 18784 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18784 74 1 13 "Average Difference" HA 36 0.397 0.057 0.398 18784 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18784 76 1 13 "Average Difference" CA 32 2.138 0.021 2.172 18784 77 1 13 "Average Difference" CB 28 7.979 -3.450 7.327 18784 78 1 13 "Average Difference" HN 25 0.475 0.201 0.439 18784 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18784 80 1 14 "Average Difference" HA 36 0.392 0.063 0.393 18784 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18784 82 1 14 "Average Difference" CA 32 2.135 0.044 2.169 18784 83 1 14 "Average Difference" CB 28 7.990 -3.434 7.347 18784 84 1 14 "Average Difference" HN 25 0.469 0.206 0.430 18784 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18784 86 1 15 "Average Difference" HA 36 0.387 0.070 0.386 18784 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18784 88 1 15 "Average Difference" CA 32 1.941 -0.038 1.972 18784 89 1 15 "Average Difference" CB 28 7.938 -3.385 7.311 18784 90 1 15 "Average Difference" HN 25 0.469 0.181 0.442 18784 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18784 92 1 16 "Average Difference" HA 36 0.387 0.070 0.386 18784 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18784 94 1 16 "Average Difference" CA 32 1.920 -0.021 1.951 18784 95 1 16 "Average Difference" CB 28 7.954 -3.420 7.313 18784 96 1 16 "Average Difference" HN 25 0.464 0.181 0.436 18784 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18784 98 1 17 "Average Difference" HA 36 0.394 0.062 0.395 18784 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18784 100 1 17 "Average Difference" CA 32 2.163 0.049 2.197 18784 101 1 17 "Average Difference" CB 28 7.985 -3.421 7.347 18784 102 1 17 "Average Difference" HN 25 0.466 0.188 0.436 18784 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18784 104 1 18 "Average Difference" HA 36 0.392 0.055 0.393 18784 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18784 106 1 18 "Average Difference" CA 32 2.132 0.055 2.166 18784 107 1 18 "Average Difference" CB 28 7.934 -3.488 7.257 18784 108 1 18 "Average Difference" HN 25 0.466 0.181 0.439 18784 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18784 110 1 19 "Average Difference" HA 36 0.386 0.071 0.384 18784 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18784 112 1 19 "Average Difference" CA 32 1.962 -0.080 1.992 18784 113 1 19 "Average Difference" CB 28 7.978 -3.434 7.334 18784 114 1 19 "Average Difference" HN 25 0.471 0.191 0.439 18784 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18784 116 1 20 "Average Difference" HA 36 0.389 0.070 0.388 18784 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18784 118 1 20 "Average Difference" CA 32 1.952 -0.047 1.982 18784 119 1 20 "Average Difference" CB 28 7.971 -3.436 7.325 18784 120 1 20 "Average Difference" HN 25 0.467 0.202 0.430 18784 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 18784 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 CYS HA H 3 5.001 5.001 4.754 0.247 18784 2 1 . 1 1 3 3 CYS CA C 3 52.412 52.412 56.387 -3.975 18784 3 1 . 1 1 3 3 CYS CB C 3 42.621 42.621 27.282 15.338 18784 4 1 . 1 1 3 3 CYS H H 3 7.856 7.856 8.279 -0.423 18784 5 1 . 1 1 4 4 PRO HA H 4 4.509 4.509 4.493 0.016 18784 6 1 . 1 1 4 4 PRO CA C 4 63.067 63.067 62.890 0.177 18784 7 1 . 1 1 4 4 PRO CB C 4 32.809 32.809 32.885 -0.076 18784 8 1 . 1 1 5 5 GLY CA C 5 42.323 42.323 43.590 -1.267 18784 9 1 . 1 1 5 5 GLY H H 5 7.965 7.965 8.012 -0.047 18784 10 1 . 1 1 6 6 GLU HA H 6 3.696 3.696 4.053 -0.357 18784 11 1 . 1 1 6 6 GLU CA C 6 57.573 57.573 57.070 0.503 18784 12 1 . 1 1 6 6 GLU CB C 6 28.487 28.487 29.638 -1.151 18784 13 1 . 1 1 6 6 GLU H H 6 8.365 8.365 8.271 0.094 18784 14 1 . 1 1 7 7 GLY CA C 7 45.656 45.656 44.859 0.797 18784 15 1 . 1 1 7 7 GLY H H 7 9.294 9.294 8.648 0.646 18784 16 1 . 1 1 8 8 GLU HA H 8 4.543 4.543 4.483 0.060 18784 17 1 . 1 1 8 8 GLU CA C 8 54.859 54.859 54.120 0.739 18784 18 1 . 1 1 8 8 GLU CB C 8 30.739 30.739 32.500 -1.761 18784 19 1 . 1 1 8 8 GLU H H 8 7.948 7.948 7.836 0.112 18784 20 1 . 1 1 9 9 GLN HA H 9 4.800 4.800 4.704 0.096 18784 21 1 . 1 1 9 9 GLN CA C 9 56.893 56.893 55.990 0.903 18784 22 1 . 1 1 9 9 GLN CB C 9 34.791 34.791 29.600 5.191 18784 23 1 . 1 1 9 9 GLN H H 9 8.483 8.483 8.481 0.002 18784 24 1 . 1 1 10 10 CYS HA H 10 5.148 5.148 5.396 -0.248 18784 25 1 . 1 1 10 10 CYS CA C 10 53.615 53.615 55.448 -1.833 18784 26 1 . 1 1 10 10 CYS CB C 10 51.227 51.227 29.002 22.225 18784 27 1 . 1 1 10 10 CYS H H 10 8.509 8.509 9.076 -0.567 18784 28 1 . 1 1 11 11 ASP HA H 11 5.233 5.233 4.741 0.492 18784 29 1 . 1 1 11 11 ASP CA C 11 52.552 52.552 52.191 0.361 18784 30 1 . 1 1 11 11 ASP CB C 11 41.485 41.485 42.727 -1.242 18784 31 1 . 1 1 11 11 ASP H H 11 7.738 7.738 8.547 -0.809 18784 32 1 . 1 1 12 12 VAL HA H 12 3.674 3.674 4.139 -0.465 18784 33 1 . 1 1 12 12 VAL CA C 12 65.617 65.617 63.191 2.426 18784 34 1 . 1 1 12 12 VAL CB C 12 32.012 32.012 30.695 1.317 18784 35 1 . 1 1 12 12 VAL H H 12 8.595 8.595 8.027 0.569 18784 36 1 . 1 1 13 13 GLU HA H 13 4.262 4.262 4.320 -0.058 18784 37 1 . 1 1 13 13 GLU CA C 13 59.667 59.667 58.376 1.291 18784 38 1 . 1 1 13 13 GLU CB C 13 28.487 28.487 31.060 -2.573 18784 39 1 . 1 1 13 13 GLU H H 13 7.937 7.937 7.831 0.107 18784 40 1 . 1 1 14 14 PHE HA H 14 4.769 4.769 4.659 0.110 18784 41 1 . 1 1 14 14 PHE CA C 14 59.139 59.139 58.371 0.768 18784 42 1 . 1 1 14 14 PHE CB C 14 42.714 42.714 41.626 1.088 18784 43 1 . 1 1 15 15 ASN HA H 15 5.216 5.216 5.199 0.017 18784 44 1 . 1 1 15 15 ASN CA C 15 51.599 51.599 50.421 1.178 18784 45 1 . 1 1 15 15 ASN CB C 15 39.111 39.111 40.161 -1.050 18784 46 1 . 1 1 15 15 ASN H H 15 8.602 8.602 8.731 -0.129 18784 47 1 . 1 1 16 16 PRO HA H 16 4.156 4.156 4.811 -0.655 18784 48 1 . 1 1 16 16 PRO CA C 16 63.043 63.043 61.646 1.397 18784 49 1 . 1 1 16 16 PRO CB C 16 28.481 28.481 33.455 -4.974 18784 50 1 . 1 1 17 17 CYS HA H 17 4.410 4.410 4.503 -0.093 18784 51 1 . 1 1 17 17 CYS CA C 17 56.207 56.207 59.069 -2.862 18784 52 1 . 1 1 17 17 CYS CB C 17 43.242 43.242 25.813 17.429 18784 53 1 . 1 1 17 17 CYS H H 17 7.125 7.125 8.198 -1.073 18784 54 1 . 1 1 18 18 CYS HA H 18 4.761 4.761 4.647 0.114 18784 55 1 . 1 1 18 18 CYS CA C 18 52.558 52.558 58.920 -6.362 18784 56 1 . 1 1 18 18 CYS CB C 18 38.522 38.522 25.083 13.439 18784 57 1 . 1 1 18 18 CYS H H 18 8.830 8.830 8.833 -0.003 18784 58 1 . 1 1 19 19 PRO HA H 19 4.908 4.908 4.696 0.212 18784 59 1 . 1 1 19 19 PRO CA C 19 61.689 61.689 61.273 0.416 18784 60 1 . 1 1 19 19 PRO CB C 19 30.949 30.949 30.575 0.374 18784 61 1 . 1 1 20 20 PRO HA H 20 4.782 4.782 4.380 0.402 18784 62 1 . 1 1 20 20 PRO CA C 20 63.893 63.893 63.524 0.369 18784 63 1 . 1 1 20 20 PRO CB C 20 31.562 31.562 29.646 1.916 18784 64 1 . 1 1 21 21 LEU HA H 21 4.374 4.374 5.046 -0.672 18784 65 1 . 1 1 21 21 LEU CA C 21 56.680 56.680 52.980 3.700 18784 66 1 . 1 1 21 21 LEU CB C 21 41.891 41.891 45.420 -3.529 18784 67 1 . 1 1 21 21 LEU H H 21 8.825 8.825 8.397 0.428 18784 68 1 . 1 1 22 22 THR HA H 22 4.507 4.507 4.644 -0.137 18784 69 1 . 1 1 22 22 THR CA C 22 61.221 61.221 60.035 1.186 18784 70 1 . 1 1 22 22 THR CB C 22 71.220 71.220 71.297 -0.077 18784 71 1 . 1 1 22 22 THR H H 22 8.833 8.833 9.092 -0.259 18784 72 1 . 1 1 23 23 CYS HA H 23 4.691 4.691 5.341 -0.650 18784 73 1 . 1 1 23 23 CYS CA C 23 55.375 55.375 57.619 -2.244 18784 74 1 . 1 1 23 23 CYS CB C 23 40.173 40.173 26.541 13.632 18784 75 1 . 1 1 23 23 CYS H H 23 7.992 7.992 8.822 -0.830 18784 76 1 . 1 1 24 24 ILE HA H 24 4.650 4.650 4.666 -0.016 18784 77 1 . 1 1 24 24 ILE CA C 24 57.579 57.579 58.720 -1.141 18784 78 1 . 1 1 24 24 ILE CB C 24 41.096 41.096 40.958 0.138 18784 79 1 . 1 1 24 24 ILE H H 24 8.831 8.831 9.324 -0.493 18784 80 1 . 1 1 25 25 PRO HA H 25 4.591 4.591 4.370 0.221 18784 81 1 . 1 1 25 25 PRO CA C 25 64.645 64.645 63.997 0.648 18784 82 1 . 1 1 25 25 PRO CB C 25 34.342 34.342 32.457 1.885 18784 83 1 . 1 1 26 26 GLY CA C 26 47.367 47.367 45.135 2.232 18784 84 1 . 1 1 26 26 GLY H H 26 7.882 7.882 8.188 -0.306 18784 85 1 . 1 1 27 27 ASP HA H 27 5.087 5.087 4.874 0.213 18784 86 1 . 1 1 27 27 ASP CA C 27 51.059 51.059 52.641 -1.582 18784 87 1 . 1 1 27 27 ASP CB C 27 38.844 38.844 41.327 -2.483 18784 88 1 . 1 1 27 27 ASP H H 27 7.730 7.730 7.826 -0.096 18784 89 1 . 1 1 28 28 PRO HA H 28 4.293 4.293 4.441 -0.148 18784 90 1 . 1 1 28 28 PRO CA C 28 63.747 63.747 63.269 0.478 18784 91 1 . 1 1 28 28 PRO CB C 28 34.603 34.603 32.189 2.413 18784 92 1 . 1 1 29 29 TYR HA H 29 5.436 5.436 4.569 0.867 18784 93 1 . 1 1 29 29 TYR CA C 29 57.706 57.706 58.550 -0.844 18784 94 1 . 1 1 29 29 TYR CB C 29 40.794 40.794 40.196 0.598 18784 95 1 . 1 1 29 29 TYR H H 29 7.422 7.422 7.883 -0.461 18784 96 1 . 1 1 30 30 GLY CA C 30 47.246 47.246 44.676 2.570 18784 97 1 . 1 1 30 30 GLY H H 30 8.457 8.457 8.995 -0.538 18784 98 1 . 1 1 31 31 ILE HA H 31 4.790 4.790 5.077 -0.287 18784 99 1 . 1 1 31 31 ILE CA C 31 59.121 59.121 57.353 1.767 18784 100 1 . 1 1 31 31 ILE CB C 31 41.503 41.503 42.006 -0.503 18784 101 1 . 1 1 31 31 ILE H H 31 8.636 8.636 8.293 0.342 18784 102 1 . 1 1 32 32 CYS HA H 32 5.183 5.183 5.309 -0.126 18784 103 1 . 1 1 32 32 CYS CA C 32 55.648 55.648 58.543 -2.895 18784 104 1 . 1 1 32 32 CYS CB C 32 41.925 41.925 25.427 16.498 18784 105 1 . 1 1 32 32 CYS H H 32 8.187 8.187 8.622 -0.435 18784 106 1 . 1 1 33 33 TYR HA H 33 4.954 4.954 4.734 0.220 18784 107 1 . 1 1 33 33 TYR CA C 33 57.646 57.646 57.003 0.643 18784 108 1 . 1 1 33 33 TYR CB C 33 43.476 43.476 42.103 1.373 18784 109 1 . 1 1 33 33 TYR H H 33 9.324 9.324 9.315 0.009 18784 110 1 . 1 1 34 34 ILE HA H 34 4.393 4.393 4.366 0.027 18784 111 1 . 1 1 34 34 ILE CA C 34 61.003 61.003 60.759 0.244 18784 112 1 . 1 1 34 34 ILE CB C 34 39.718 39.718 39.198 0.520 18784 113 1 . 1 1 34 34 ILE H H 34 8.078 8.078 8.624 -0.546 18784 stop_ save_